ID 5MU8A STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU A 15 13 VAL B Protein S 1 FT #SUB 59 57 LEU A 157 155 ILE B Protein S 2 FT #SUB 75 73 HIS A 114 112 LYS B Protein S 1 FT #SUB 75 73 HIS A 115 113 PRO B Protein S 3 FT #SUB 77 75 LEU A 117 115 TYR B Protein S 1 FT #SUB 84 82 ARG A 36 34 ASN B Protein S 1 FT #SUB 93 91 VAL A 36 34 ASN B Protein S 2 FT #SUB 95 93 LEU A 36 34 ASN B Protein S 4 FT #SUB 95 93 LEU A 150 148 GLY B Protein B 3 FT #SUB 96 94 LEU A 150 148 GLY B Protein B 2 FT #SUB 96 94 LEU A 153 151 TYR B Protein S 3 FT #SUB 97 95 SER A 63 61 GLN B Protein B 4 FT #SUB 97 95 SER A 150 148 GLY B Protein B 4 FT #SUB 97 95 SER A 151 149 GLN B Protein B 1 FT #SUB 98 96 ALA A 63 61 GLN B Protein S 1 FT #SUB 99 97 ILE A 65 63 LEU B Protein B 1 FT #SUB 99 97 ILE A 117 115 TYR B Protein A 5 FT #SUB 99 97 ILE A 119 117 PRO B Protein B 2 FT #SUB 99 97 ILE A 151 149 GLN B Protein S 1 FT #SUB 100 98 LYS A 119 117 PRO B Protein S 2 FT #SUB 101 99 SER A 115 113 PRO B Protein S 1 FT #SUB 101 99 SER A 116 114 TRP B Protein S 2 FT #SUB 101 99 SER A 117 115 TYR B Protein A 8 FT #SUB 104 102 GLN A 116 114 TRP B Protein S 4 FT #SUB 105 103 ARG A 105 103 ARG B Protein S 1 FT #SUB 121 119 TYR A 121 119 TYR B Protein B 1 FT #SUB 123 121 GLY A 61 59 TYR B Protein B 2 FT #SUB 123 121 GLY A 121 119 TYR B Protein B 3 FT #SUB 123 121 GLY A 153 151 TYR B Protein B 2 FT #SUB 124 122 GLY A 61 59 TYR B Protein B 4 FT #SUB 125 123 VAL A 16 14 ALA B Protein S 1 FT #SUB 125 123 VAL A 17 15 HIS B Protein B 3 FT #SUB 125 123 VAL A 38 36 LEU B Protein B 1 FT #SUB 125 123 VAL A 61 59 TYR B Protein A 3 FT #SUB 125 123 VAL A 156 154 ILE B Protein S 1 FT #SUB 125 123 VAL A 157 155 ILE B Protein S 3 FT #SUB 126 124 PHE A 17 15 HIS B Protein S 3 FT #SUB 126 124 PHE A 36 34 ASN B Protein S 3 FT #SUB 127 125 GLN A 38 36 LEU B Protein B 1 FT #SUB 159 157 LEU A 157 155 ILE B Protein S 1 FT #SUB 11 9 SER A 148 146 GLU C Protein A 7 FT #SUB 11 9 SER A 149 147 SER C Protein A 7 FT #SUB 36 34 ASN A 10 8 PRO C Protein A 4 FT #SUB 149 147 SER A 11 9 SER C Protein B 1 FT #SUB 89 87 TYR A 73 71 SER o Protein S 1 FT #SUB 89 87 TYR A 106 104 GLU o Protein S 1 FT #SUB 26 24 GLY A 90 88 GLN p Protein B 1 FT #SUB 27 25 GLN A 89 87 TYR p Protein S 3 FT #SUB 27 25 GLN A 91 89 THR p Protein S 3 FT #SUB 28 26 LEU A 89 87 TYR p Protein B 2 FT #SUB 29 27 GLN A 89 87 TYR p Protein A 4 FT #SUB 48 46 ASN A 89 87 TYR p Protein S 7 FT #SUB 137 135 GLU A 88 86 SER p Protein S 4 FT #SUB 46 44 ARG A 21 19 ASN q Protein S 2 FT #SUB 46 44 ARG A 22 20 PRO q Protein S 1 FT #SUB 46 44 ARG A 23 21 GLN q Protein S 1 FT #SUB 46 44 ARG A 31 29 LEU q Protein S 2 FT #SUB 46 44 ARG A 34 32 ARG q Protein S 2 FT #SUB 47 45 ASP A 34 32 ARG q Protein S 8 FT #SUB 47 45 ASP A 35 33 ALA q Protein S 1 FT #SUB 87 85 VAL A 33 31 ARG q Protein S 1 FT #SUB 133 131 ARG A 33 31 ARG q Protein S 10 FT #SUB 133 131 ARG A 34 32 ARG q Protein S 3 FT #HET 11 9 SER A 4 202 JNI C B 3 FT #HET 13 11 LYS A 4 202 JNI C B 1 FT #HET 15 13 VAL A 4 202 JNI C S 2 FT #HET 17 15 HIS A 2 202 JNI A S 4 FT #HET 38 36 LEU A 4 202 JNI C S 6 FT #HET 40 38 ALA A 4 202 JNI C S 1 FT #HET 59 57 LEU A 1 201 JNI A S 4 FT #HET 61 59 TYR A 1 201 JNI A S 4 FT #HET 62 60 SER A 1 201 JNI A B 1 FT #HET 121 119 TYR A 1 201 JNI A S 14 FT #HET 122 120 LEU A 1 201 JNI A B 3 FT #HET 123 121 GLY A 1 201 JNI A B 3 FT #HET 124 122 GLY A 1 201 JNI A B 2 FT #HET 153 151 TYR A 1 201 JNI A S 5 FT #HET 153 151 TYR A 2 202 JNI A S 2 FT #HET 157 155 ILE A 1 201 JNI A S 2 FT #HET 157 155 ILE A 4 202 JNI C S 1 FT DISORDER 1 10 FT DISORDER 32 35 FT DISORDER 108 111 CC SEQUENCE 141 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNALLANGVE LRDNQLVVPS EGLYLIYSQV LFKGQGCPST CC HVLLTHTISR IAVSYQTKVN LLSAIKSPCQ RETEAKPWYE PIYLGGVFQL EKGDRLSAEI CC NRPDYLDFAE SGQVYFGIIA L CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL----NALLANGVELRDNQL CC ********************* *************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET----EAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* *************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8B STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 15 13 VAL B 57 55 LEU A Protein S 1 FT #SUB 16 14 ALA B 125 123 VAL A Protein B 1 FT #SUB 17 15 HIS B 125 123 VAL A Protein S 3 FT #SUB 17 15 HIS B 126 124 PHE A Protein S 3 FT #SUB 36 34 ASN B 84 82 ARG A Protein S 1 FT #SUB 36 34 ASN B 93 91 VAL A Protein S 2 FT #SUB 36 34 ASN B 95 93 LEU A Protein S 4 FT #SUB 36 34 ASN B 126 124 PHE A Protein A 3 FT #SUB 38 36 LEU B 125 123 VAL A Protein S 1 FT #SUB 38 36 LEU B 127 125 GLN A Protein S 1 FT #SUB 61 59 TYR B 123 121 GLY A Protein S 2 FT #SUB 61 59 TYR B 124 122 GLY A Protein S 4 FT #SUB 61 59 TYR B 125 123 VAL A Protein S 3 FT #SUB 63 61 GLN B 97 95 SER A Protein S 4 FT #SUB 63 61 GLN B 98 96 ALA A Protein S 1 FT #SUB 65 63 LEU B 99 97 ILE A Protein S 1 FT #SUB 105 103 ARG B 105 103 ARG A Protein S 1 FT #SUB 114 112 LYS B 75 73 HIS A Protein S 1 FT #SUB 115 113 PRO B 75 73 HIS A Protein B 3 FT #SUB 115 113 PRO B 101 99 SER A Protein B 1 FT #SUB 116 114 TRP B 101 99 SER A Protein B 2 FT #SUB 116 114 TRP B 104 102 GLN A Protein A 4 FT #SUB 117 115 TYR B 77 75 LEU A Protein S 1 FT #SUB 117 115 TYR B 99 97 ILE A Protein S 5 FT #SUB 117 115 TYR B 101 99 SER A Protein A 8 FT #SUB 119 117 PRO B 99 97 ILE A Protein S 2 FT #SUB 119 117 PRO B 100 98 LYS A Protein S 2 FT #SUB 121 119 TYR B 121 119 TYR A Protein S 1 FT #SUB 121 119 TYR B 123 121 GLY A Protein S 3 FT #SUB 150 148 GLY B 95 93 LEU A Protein B 3 FT #SUB 150 148 GLY B 96 94 LEU A Protein B 2 FT #SUB 150 148 GLY B 97 95 SER A Protein B 4 FT #SUB 151 149 GLN B 97 95 SER A Protein B 1 FT #SUB 151 149 GLN B 99 97 ILE A Protein S 1 FT #SUB 153 151 TYR B 96 94 LEU A Protein S 3 FT #SUB 153 151 TYR B 123 121 GLY A Protein S 2 FT #SUB 156 154 ILE B 125 123 VAL A Protein B 1 FT #SUB 157 155 ILE B 59 57 LEU A Protein S 2 FT #SUB 157 155 ILE B 125 123 VAL A Protein S 3 FT #SUB 157 155 ILE B 159 157 LEU A Protein S 1 FT #SUB 57 55 LEU B 123 121 GLY D Protein S 1 FT #SUB 96 94 LEU B 127 125 GLN D Protein A 4 FT #SUB 97 95 SER B 127 125 GLN D Protein A 10 FT #SUB 123 121 GLY B 57 55 LEU D Protein B 2 FT #SUB 124 122 GLY B 125 123 VAL D Protein B 2 FT #SUB 125 123 VAL B 124 122 GLY D Protein A 4 FT #SUB 125 123 VAL B 125 123 VAL D Protein A 12 FT #SUB 125 123 VAL B 126 124 PHE D Protein B 2 FT #SUB 126 124 PHE B 125 123 VAL D Protein S 1 FT #SUB 126 124 PHE B 126 124 PHE D Protein S 3 FT #SUB 127 125 GLN B 95 93 LEU D Protein S 1 FT #SUB 127 125 GLN B 96 94 LEU D Protein S 5 FT #SUB 127 125 GLN B 97 95 SER D Protein S 8 FT #SUB 75 73 HIS B 41 39 ASN W Protein S 3 FT #SUB 75 73 HIS B 42 40 GLY W Protein S 9 FT #SUB 75 73 HIS B 44 42 GLU W Protein B 1 FT #SUB 77 75 LEU B 130 128 LYS W Protein S 1 FT #SUB 92 90 LYS B 90 88 GLN W Protein S 5 FT #SUB 92 90 LYS B 91 89 THR W Protein B 1 FT #SUB 94 92 ASN B 87 85 VAL W Protein S 1 FT #SUB 94 92 ASN B 88 86 SER W Protein S 7 FT #SUB 94 92 ASN B 89 87 TYR W Protein A 4 FT #SUB 94 92 ASN B 90 88 GLN W Protein S 1 FT #SUB 97 95 SER B 87 85 VAL W Protein S 1 FT #SUB 97 95 SER B 88 86 SER W Protein S 2 FT #SUB 99 97 ILE B 87 85 VAL W Protein S 1 FT #SUB 101 99 SER B 130 128 LYS W Protein S 3 FT #SUB 139 137 ASN B 46 44 ARG W Protein B 2 FT #SUB 140 138 ARG B 46 44 ARG W Protein S 12 FT #SUB 142 140 ASP B 46 44 ARG W Protein S 1 FT #SUB 21 19 ASN B 46 44 ARG Z Protein S 1 FT #SUB 23 21 GLN B 46 44 ARG Z Protein S 1 FT #SUB 25 23 GLU B 130 128 LYS Z Protein S 8 FT #SUB 25 23 GLU B 131 129 GLY Z Protein S 2 FT #SUB 26 24 GLY B 87 85 VAL Z Protein B 2 FT #SUB 26 24 GLY B 90 88 GLN Z Protein B 2 FT #SUB 27 25 GLN B 90 88 GLN Z Protein S 4 FT #SUB 27 25 GLN B 133 131 ARG Z Protein S 1 FT #SUB 29 27 GLN B 46 44 ARG Z Protein S 1 FT #SUB 42 40 GLY B 75 73 HIS i Protein B 3 FT #SUB 44 42 GLU B 75 73 HIS i Protein S 7 FT #SUB 46 44 ARG B 139 137 ASN i Protein S 1 FT #SUB 46 44 ARG B 140 138 ARG i Protein S 11 FT #SUB 87 85 VAL B 94 92 ASN i Protein B 1 FT #SUB 87 85 VAL B 99 97 ILE i Protein S 4 FT #SUB 88 86 SER B 94 92 ASN i Protein B 4 FT #SUB 88 86 SER B 97 95 SER i Protein S 1 FT #SUB 90 88 GLN B 94 92 ASN i Protein S 1 FT #SUB 91 89 THR B 92 90 LYS i Protein S 1 FT #SUB 130 128 LYS B 77 75 LEU i Protein S 1 FT #SUB 130 128 LYS B 101 99 SER i Protein S 2 FT #SUB 88 86 SER B 129 127 GLU k Protein S 1 FT #SUB 89 87 TYR B 89 87 TYR k Protein S 23 FT #SUB 129 127 GLU B 88 86 SER k Protein S 2 FT #SUB 33 31 ARG B 109 107 GLU o Protein B 1 FT #SUB 34 32 ARG B 109 107 GLU o Protein B 4 FT #SUB 35 33 ALA B 109 107 GLU o Protein A 6 FT #HET 57 55 LEU B 3 201 JNI C S 6 FT #HET 59 57 LEU B 1 201 JNI A S 3 FT #HET 60 58 ILE B 1 201 JNI A B 1 FT #HET 121 119 TYR B 1 201 JNI A S 3 FT #HET 123 121 GLY B 1 201 JNI A B 5 FT #HET 124 122 GLY B 1 201 JNI A B 1 FT #HET 159 157 LEU B 3 201 JNI C B 2 FT DISORDER 1 11 FT DISORDER 108 110 CC SEQUENCE 145 AA (ATOM); CC DKPVAHVVAN PQAEGQLQWL NRRANALLAN GVELRDNQLV VPSEGLYLIY SQVLFKGQGC CC PSTHVLLTHT ISRIAVSYQT KVNLLSAIKS PCQRETAEAK PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM -----------DKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC *************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET---AEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* **************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8C STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 10 8 PRO C 36 34 ASN A Protein S 4 FT #SUB 11 9 SER C 149 147 SER A Protein S 1 FT #SUB 148 146 GLU C 11 9 SER A Protein S 7 FT #SUB 149 147 SER C 11 9 SER A Protein A 7 FT #SUB 57 55 LEU C 15 13 VAL D Protein S 1 FT #SUB 84 82 ARG C 36 34 ASN D Protein S 1 FT #SUB 94 92 ASN C 36 34 ASN D Protein B 1 FT #SUB 94 92 ASN C 148 146 GLU D Protein S 2 FT #SUB 94 92 ASN C 149 147 SER D Protein S 4 FT #SUB 95 93 LEU C 150 148 GLY D Protein B 3 FT #SUB 96 94 LEU C 150 148 GLY D Protein B 2 FT #SUB 96 94 LEU C 153 151 TYR D Protein S 5 FT #SUB 97 95 SER C 63 61 GLN D Protein B 3 FT #SUB 97 95 SER C 149 147 SER D Protein S 1 FT #SUB 97 95 SER C 150 148 GLY D Protein A 7 FT #SUB 97 95 SER C 151 149 GLN D Protein A 5 FT #SUB 98 96 ALA C 63 61 GLN D Protein S 1 FT #SUB 98 96 ALA C 121 119 TYR D Protein S 1 FT #SUB 99 97 ILE C 65 63 LEU D Protein A 5 FT #SUB 99 97 ILE C 117 115 TYR D Protein A 12 FT #SUB 99 97 ILE C 119 117 PRO D Protein B 2 FT #SUB 99 97 ILE C 151 149 GLN D Protein S 1 FT #SUB 100 98 LYS C 119 117 PRO D Protein S 2 FT #SUB 101 99 SER C 116 114 TRP D Protein S 2 FT #SUB 101 99 SER C 117 115 TYR D Protein A 5 FT #SUB 104 102 GLN C 104 102 GLN D Protein S 2 FT #SUB 105 103 ARG C 105 103 ARG D Protein S 7 FT #SUB 120 118 ILE C 121 119 TYR D Protein S 1 FT #SUB 121 119 TYR C 121 119 TYR D Protein B 5 FT #SUB 122 120 LEU C 63 61 GLN D Protein S 2 FT #SUB 122 120 LEU C 153 151 TYR D Protein A 2 FT #SUB 123 121 GLY C 61 59 TYR D Protein B 2 FT #SUB 123 121 GLY C 153 151 TYR D Protein B 5 FT #SUB 124 122 GLY C 61 59 TYR D Protein B 4 FT #SUB 125 123 VAL C 16 14 ALA D Protein S 2 FT #SUB 125 123 VAL C 17 15 HIS D Protein A 4 FT #SUB 125 123 VAL C 38 36 LEU D Protein S 1 FT #SUB 125 123 VAL C 61 59 TYR D Protein A 5 FT #SUB 126 124 PHE C 17 15 HIS D Protein S 5 FT #SUB 126 124 PHE C 36 34 ASN D Protein S 3 FT #SUB 159 157 LEU C 157 155 ILE D Protein S 1 FT #HET 10 8 PRO C 4 202 JNI C B 1 FT #HET 17 15 HIS C 4 202 JNI C S 7 FT #HET 36 34 ASN C 4 202 JNI C A 11 FT #HET 38 36 LEU C 4 202 JNI C S 5 FT #HET 59 57 LEU C 5 201 JNI D S 4 FT #HET 61 59 TYR C 4 202 JNI C S 2 FT #HET 121 119 TYR C 3 201 JNI C S 17 FT #HET 123 121 GLY C 5 201 JNI D B 1 FT #HET 149 147 SER C 4 202 JNI C B 3 FT #HET 150 148 GLY C 4 202 JNI C B 5 FT #HET 157 155 ILE C 2 202 JNI A S 2 FT #HET 157 155 ILE C 5 201 JNI D S 1 FT DISORDER 1 9 FT DISORDER 109 112 CC SEQUENCE 146 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPA KPWYEPIYLG GVFQLEKGDR CC LSAEINRPDY LDFAESGQVY FGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8D STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU D 123 121 GLY B Protein S 2 FT #SUB 95 93 LEU D 127 125 GLN B Protein B 1 FT #SUB 96 94 LEU D 127 125 GLN B Protein A 5 FT #SUB 97 95 SER D 127 125 GLN B Protein B 8 FT #SUB 123 121 GLY D 57 55 LEU B Protein B 1 FT #SUB 124 122 GLY D 125 123 VAL B Protein B 4 FT #SUB 125 123 VAL D 124 122 GLY B Protein S 2 FT #SUB 125 123 VAL D 125 123 VAL B Protein A 12 FT #SUB 125 123 VAL D 126 124 PHE B Protein B 1 FT #SUB 126 124 PHE D 125 123 VAL B Protein S 2 FT #SUB 126 124 PHE D 126 124 PHE B Protein S 3 FT #SUB 127 125 GLN D 96 94 LEU B Protein S 4 FT #SUB 127 125 GLN D 97 95 SER B Protein S 10 FT #SUB 15 13 VAL D 57 55 LEU C Protein S 1 FT #SUB 16 14 ALA D 125 123 VAL C Protein B 2 FT #SUB 17 15 HIS D 125 123 VAL C Protein S 4 FT #SUB 17 15 HIS D 126 124 PHE C Protein S 5 FT #SUB 36 34 ASN D 84 82 ARG C Protein S 1 FT #SUB 36 34 ASN D 94 92 ASN C Protein S 1 FT #SUB 36 34 ASN D 126 124 PHE C Protein A 3 FT #SUB 38 36 LEU D 125 123 VAL C Protein S 1 FT #SUB 61 59 TYR D 123 121 GLY C Protein S 2 FT #SUB 61 59 TYR D 124 122 GLY C Protein S 4 FT #SUB 61 59 TYR D 125 123 VAL C Protein S 5 FT #SUB 63 61 GLN D 97 95 SER C Protein S 3 FT #SUB 63 61 GLN D 98 96 ALA C Protein S 1 FT #SUB 63 61 GLN D 122 120 LEU C Protein S 2 FT #SUB 65 63 LEU D 99 97 ILE C Protein S 5 FT #SUB 104 102 GLN D 104 102 GLN C Protein S 2 FT #SUB 105 103 ARG D 105 103 ARG C Protein S 7 FT #SUB 116 114 TRP D 101 99 SER C Protein B 2 FT #SUB 117 115 TYR D 99 97 ILE C Protein S 12 FT #SUB 117 115 TYR D 101 99 SER C Protein A 5 FT #SUB 119 117 PRO D 99 97 ILE C Protein S 2 FT #SUB 119 117 PRO D 100 98 LYS C Protein S 2 FT #SUB 121 119 TYR D 98 96 ALA C Protein S 1 FT #SUB 121 119 TYR D 120 118 ILE C Protein S 1 FT #SUB 121 119 TYR D 121 119 TYR C Protein S 5 FT #SUB 148 146 GLU D 94 92 ASN C Protein S 2 FT #SUB 149 147 SER D 94 92 ASN C Protein B 4 FT #SUB 149 147 SER D 97 95 SER C Protein B 1 FT #SUB 150 148 GLY D 95 93 LEU C Protein B 3 FT #SUB 150 148 GLY D 96 94 LEU C Protein B 2 FT #SUB 150 148 GLY D 97 95 SER C Protein B 7 FT #SUB 151 149 GLN D 97 95 SER C Protein A 5 FT #SUB 151 149 GLN D 99 97 ILE C Protein S 1 FT #SUB 153 151 TYR D 96 94 LEU C Protein S 5 FT #SUB 153 151 TYR D 122 120 LEU C Protein S 2 FT #SUB 153 151 TYR D 123 121 GLY C Protein S 5 FT #SUB 157 155 ILE D 159 157 LEU C Protein S 1 FT #SUB 89 87 TYR D 89 87 TYR W Protein S 22 FT #SUB 12 10 ASP D 75 73 HIS Y Protein S 1 FT #SUB 41 39 ASN D 75 73 HIS Y Protein B 7 FT #SUB 42 40 GLY D 75 73 HIS Y Protein B 10 FT #SUB 44 42 GLU D 75 73 HIS Y Protein S 1 FT #SUB 44 42 GLU D 140 138 ARG Y Protein S 1 FT #SUB 46 44 ARG D 139 137 ASN Y Protein S 2 FT #SUB 46 44 ARG D 140 138 ARG Y Protein S 16 FT #SUB 52 50 VAL D 77 75 LEU Y Protein B 1 FT #SUB 87 85 VAL D 97 95 SER Y Protein S 1 FT #SUB 87 85 VAL D 99 97 ILE Y Protein S 4 FT #SUB 88 86 SER D 94 92 ASN Y Protein B 3 FT #SUB 88 86 SER D 97 95 SER Y Protein S 1 FT #SUB 90 88 GLN D 81 79 THR Y Protein S 2 FT #SUB 90 88 GLN D 83 81 SER Y Protein S 1 FT #SUB 90 88 GLN D 92 90 LYS Y Protein S 2 FT #SUB 90 88 GLN D 94 92 ASN Y Protein S 1 FT #SUB 91 89 THR D 91 89 THR Y Protein S 1 FT #SUB 91 89 THR D 92 90 LYS Y Protein S 1 FT #SUB 131 129 GLY D 77 75 LEU Y Protein B 1 FT #SUB 75 73 HIS D 42 40 GLY k Protein S 3 FT #SUB 75 73 HIS D 44 42 GLU k Protein S 6 FT #SUB 77 75 LEU D 131 129 GLY k Protein S 1 FT #SUB 81 79 THR D 90 88 GLN k Protein S 1 FT #SUB 91 89 THR D 91 89 THR k Protein S 2 FT #SUB 92 90 LYS D 89 87 TYR k Protein B 1 FT #SUB 92 90 LYS D 90 88 GLN k Protein S 2 FT #SUB 92 90 LYS D 91 89 THR k Protein B 1 FT #SUB 94 92 ASN D 88 86 SER k Protein S 4 FT #SUB 94 92 ASN D 89 87 TYR k Protein A 2 FT #SUB 94 92 ASN D 90 88 GLN k Protein S 1 FT #SUB 97 95 SER D 88 86 SER k Protein S 1 FT #SUB 99 97 ILE D 87 85 VAL k Protein S 4 FT #SUB 101 99 SER D 130 128 LYS k Protein S 2 FT #SUB 139 137 ASN D 46 44 ARG k Protein B 1 FT #SUB 140 138 ARG D 46 44 ARG k Protein S 11 FT #HET 13 11 LYS D 5 201 JNI D S 1 FT #HET 57 55 LEU D 1 201 JNI A S 1 FT #HET 59 57 LEU D 5 201 JNI D S 7 FT #HET 61 59 TYR D 5 201 JNI D S 1 FT #HET 62 60 SER D 3 201 JNI C B 1 FT #HET 121 119 TYR D 3 201 JNI C S 7 FT #HET 123 121 GLY D 3 201 JNI C B 1 FT #HET 158 156 ALA D 5 201 JNI D B 2 FT #HET 159 157 LEU D 5 201 JNI D A 4 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8F STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU F 11 9 SER G Protein S 1 FT #SUB 57 55 LEU F 15 13 VAL G Protein S 1 FT #SUB 59 57 LEU F 157 155 ILE G Protein S 1 FT #SUB 73 71 SER F 114 112 LYS G Protein B 1 FT #SUB 75 73 HIS F 115 113 PRO G Protein S 3 FT #SUB 77 75 LEU F 117 115 TYR G Protein S 2 FT #SUB 84 82 ARG F 36 34 ASN G Protein S 3 FT #SUB 93 91 VAL F 36 34 ASN G Protein S 1 FT #SUB 94 92 ASN F 149 147 SER G Protein A 3 FT #SUB 95 93 LEU F 36 34 ASN G Protein S 4 FT #SUB 95 93 LEU F 150 148 GLY G Protein B 1 FT #SUB 96 94 LEU F 17 15 HIS G Protein S 1 FT #SUB 96 94 LEU F 150 148 GLY G Protein B 2 FT #SUB 96 94 LEU F 153 151 TYR G Protein S 4 FT #SUB 97 95 SER F 63 61 GLN G Protein B 2 FT #SUB 97 95 SER F 150 148 GLY G Protein B 5 FT #SUB 97 95 SER F 151 149 GLN G Protein B 1 FT #SUB 98 96 ALA F 63 61 GLN G Protein S 1 FT #SUB 99 97 ILE F 65 63 LEU G Protein B 1 FT #SUB 99 97 ILE F 117 115 TYR G Protein A 7 FT #SUB 99 97 ILE F 119 117 PRO G Protein B 2 FT #SUB 99 97 ILE F 151 149 GLN G Protein S 1 FT #SUB 100 98 LYS F 119 117 PRO G Protein S 1 FT #SUB 101 99 SER F 116 114 TRP G Protein S 2 FT #SUB 101 99 SER F 117 115 TYR G Protein A 8 FT #SUB 105 103 ARG F 105 103 ARG G Protein S 1 FT #SUB 121 119 TYR F 121 119 TYR G Protein S 6 FT #SUB 123 121 GLY F 61 59 TYR G Protein B 2 FT #SUB 123 121 GLY F 121 119 TYR G Protein B 2 FT #SUB 123 121 GLY F 153 151 TYR G Protein B 4 FT #SUB 124 122 GLY F 61 59 TYR G Protein B 4 FT #SUB 125 123 VAL F 16 14 ALA G Protein S 1 FT #SUB 125 123 VAL F 17 15 HIS G Protein B 3 FT #SUB 125 123 VAL F 38 36 LEU G Protein B 1 FT #SUB 125 123 VAL F 61 59 TYR G Protein A 3 FT #SUB 125 123 VAL F 157 155 ILE G Protein S 3 FT #SUB 126 124 PHE F 17 15 HIS G Protein S 4 FT #SUB 126 124 PHE F 36 34 ASN G Protein S 4 FT #SUB 126 124 PHE F 38 36 LEU G Protein B 1 FT #SUB 127 125 GLN F 38 36 LEU G Protein B 1 FT #SUB 11 9 SER F 36 34 ASN H Protein B 1 FT #SUB 11 9 SER F 148 146 GLU H Protein S 2 FT #SUB 11 9 SER F 149 147 SER H Protein A 6 FT #SUB 11 9 SER F 151 149 GLN H Protein A 3 FT #SUB 38 36 LEU F 38 36 LEU H Protein S 1 FT #SUB 149 147 SER F 11 9 SER H Protein B 3 FT #SUB 149 147 SER F 12 10 ASP H Protein A 6 FT #SUB 151 149 GLN F 11 9 SER H Protein S 1 FT #SUB 89 87 TYR F 72 70 PRO Q Protein S 1 FT #SUB 89 87 TYR F 106 104 GLU Q Protein S 2 FT #SUB 26 24 GLY F 90 88 GLN d Protein B 1 FT #SUB 27 25 GLN F 88 86 SER d Protein S 1 FT #SUB 27 25 GLN F 89 87 TYR d Protein S 4 FT #SUB 27 25 GLN F 90 88 GLN d Protein S 2 FT #SUB 47 45 ASP F 89 87 TYR d Protein A 4 FT #SUB 47 45 ASP F 93 91 VAL d Protein S 1 FT #SUB 48 46 ASN F 89 87 TYR d Protein S 4 FT #SUB 90 88 GLN F 127 125 GLN d Protein B 4 FT #SUB 92 90 LYS F 129 127 GLU d Protein S 1 FT #SUB 137 135 GLU F 88 86 SER d Protein S 5 FT #SUB 46 44 ARG F 23 21 GLN e Protein S 1 FT #SUB 46 44 ARG F 34 32 ARG e Protein S 5 FT #SUB 47 45 ASP F 35 33 ALA e Protein S 1 FT #SUB 87 85 VAL F 32 30 ASN e Protein S 1 FT #SUB 90 88 GLN F 39 37 LEU e Protein S 6 FT #SUB 133 131 ARG F 34 32 ARG e Protein S 2 FT #SUB 133 131 ARG F 35 33 ALA e Protein S 3 FT #SUB 25 23 GLU F 21 19 ASN h Protein B 1 FT #SUB 25 23 GLU F 31 29 LEU h Protein S 2 FT #SUB 27 25 GLN F 23 21 GLN h Protein S 1 FT #SUB 74 72 THR F 44 42 GLU h Protein S 5 FT #SUB 108 106 PRO F 12 10 ASP h Protein S 2 FT #SUB 25 23 GLU F 10 8 PRO j Protein S 4 FT #SUB 67 65 LYS F 33 31 ARG j Protein S 6 FT #SUB 69 67 GLN F 33 31 ARG j Protein S 6 FT #SUB 69 67 GLN F 34 32 ARG j Protein S 5 FT #SUB 69 67 GLN F 37 35 ALA j Protein S 1 FT #SUB 112 110 GLU F 23 21 GLN j Protein S 4 FT #SUB 112 110 GLU F 34 32 ARG j Protein A 4 FT #SUB 112 110 GLU F 149 147 SER j Protein B 2 FT #SUB 113 111 ALA F 34 32 ARG j Protein B 1 FT #SUB 113 111 ALA F 35 33 ALA j Protein A 2 FT #SUB 114 112 LYS F 34 32 ARG j Protein S 2 FT #SUB 115 113 PRO F 33 31 ARG j Protein S 2 FT #HET 17 15 HIS F 7 202 JNI F S 2 FT #HET 59 57 LEU F 6 201 JNI F S 4 FT #HET 60 58 ILE F 6 201 JNI F B 1 FT #HET 62 60 SER F 6 201 JNI F B 1 FT #HET 63 61 GLN F 6 201 JNI F S 2 FT #HET 121 119 TYR F 6 201 JNI F A 25 FT #HET 122 120 LEU F 6 201 JNI F B 1 FT #HET 123 121 GLY F 6 201 JNI F B 5 FT #HET 124 122 GLY F 6 201 JNI F B 2 FT #HET 153 151 TYR F 6 201 JNI F S 5 FT #HET 157 155 ILE F 6 201 JNI F S 1 FT DISORDER 1 10 FT DISORDER 32 37 FT DISORDER 109 111 CC SEQUENCE 140 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPEAKPWYEP IYLGGVFQLE KGDRLSAEIN CC RPDYLDFAES GQVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP---EAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** *************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8G STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 11 9 SER G 57 55 LEU F Protein B 1 FT #SUB 15 13 VAL G 57 55 LEU F Protein S 1 FT #SUB 16 14 ALA G 125 123 VAL F Protein B 1 FT #SUB 17 15 HIS G 96 94 LEU F Protein S 1 FT #SUB 17 15 HIS G 125 123 VAL F Protein S 3 FT #SUB 17 15 HIS G 126 124 PHE F Protein S 4 FT #SUB 36 34 ASN G 84 82 ARG F Protein S 3 FT #SUB 36 34 ASN G 93 91 VAL F Protein S 1 FT #SUB 36 34 ASN G 95 93 LEU F Protein S 4 FT #SUB 36 34 ASN G 126 124 PHE F Protein A 4 FT #SUB 38 36 LEU G 125 123 VAL F Protein S 1 FT #SUB 38 36 LEU G 126 124 PHE F Protein S 1 FT #SUB 38 36 LEU G 127 125 GLN F Protein S 1 FT #SUB 61 59 TYR G 123 121 GLY F Protein S 2 FT #SUB 61 59 TYR G 124 122 GLY F Protein S 4 FT #SUB 61 59 TYR G 125 123 VAL F Protein S 3 FT #SUB 63 61 GLN G 97 95 SER F Protein S 2 FT #SUB 63 61 GLN G 98 96 ALA F Protein S 1 FT #SUB 65 63 LEU G 99 97 ILE F Protein S 1 FT #SUB 105 103 ARG G 105 103 ARG F Protein S 1 FT #SUB 114 112 LYS G 73 71 SER F Protein S 1 FT #SUB 115 113 PRO G 75 73 HIS F Protein B 3 FT #SUB 116 114 TRP G 101 99 SER F Protein B 2 FT #SUB 117 115 TYR G 77 75 LEU F Protein S 2 FT #SUB 117 115 TYR G 99 97 ILE F Protein S 7 FT #SUB 117 115 TYR G 101 99 SER F Protein A 8 FT #SUB 119 117 PRO G 99 97 ILE F Protein S 2 FT #SUB 119 117 PRO G 100 98 LYS F Protein S 1 FT #SUB 121 119 TYR G 121 119 TYR F Protein S 6 FT #SUB 121 119 TYR G 123 121 GLY F Protein S 2 FT #SUB 149 147 SER G 94 92 ASN F Protein A 3 FT #SUB 150 148 GLY G 95 93 LEU F Protein B 1 FT #SUB 150 148 GLY G 96 94 LEU F Protein B 2 FT #SUB 150 148 GLY G 97 95 SER F Protein B 5 FT #SUB 151 149 GLN G 97 95 SER F Protein B 1 FT #SUB 151 149 GLN G 99 97 ILE F Protein S 1 FT #SUB 153 151 TYR G 96 94 LEU F Protein S 4 FT #SUB 153 151 TYR G 123 121 GLY F Protein S 4 FT #SUB 157 155 ILE G 59 57 LEU F Protein S 1 FT #SUB 157 155 ILE G 125 123 VAL F Protein S 3 FT #SUB 57 55 LEU G 123 121 GLY I Protein S 2 FT #SUB 96 94 LEU G 127 125 GLN I Protein A 4 FT #SUB 97 95 SER G 127 125 GLN I Protein A 10 FT #SUB 123 121 GLY G 57 55 LEU I Protein B 2 FT #SUB 124 122 GLY G 125 123 VAL I Protein B 4 FT #SUB 125 123 VAL G 124 122 GLY I Protein A 3 FT #SUB 125 123 VAL G 125 123 VAL I Protein A 12 FT #SUB 125 123 VAL G 126 124 PHE I Protein B 2 FT #SUB 126 124 PHE G 125 123 VAL I Protein S 1 FT #SUB 126 124 PHE G 126 124 PHE I Protein S 2 FT #SUB 127 125 GLN G 95 93 LEU I Protein S 1 FT #SUB 127 125 GLN G 96 94 LEU I Protein S 1 FT #SUB 127 125 GLN G 97 95 SER I Protein S 9 FT #SUB 33 31 ARG G 109 107 GLU Q Protein A 3 FT #SUB 33 31 ARG G 110 108 GLY Q Protein S 4 FT #SUB 33 31 ARG G 112 110 GLU Q Protein S 2 FT #SUB 34 32 ARG G 109 107 GLU Q Protein B 6 FT #SUB 35 33 ALA G 109 107 GLU Q Protein A 9 FT #HET 57 55 LEU G 9 202 JNI H S 4 FT #HET 59 57 LEU G 6 201 JNI F S 1 FT #HET 61 59 TYR G 6 201 JNI F S 3 FT #HET 121 119 TYR G 6 201 JNI F S 6 FT #HET 123 121 GLY G 6 201 JNI F B 2 FT #HET 159 157 LEU G 9 202 JNI H S 4 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8H STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 11 9 SER H 149 147 SER F Protein S 3 FT #SUB 11 9 SER H 151 149 GLN F Protein S 1 FT #SUB 12 10 ASP H 149 147 SER F Protein S 6 FT #SUB 36 34 ASN H 11 9 SER F Protein S 1 FT #SUB 38 36 LEU H 38 36 LEU F Protein S 1 FT #SUB 148 146 GLU H 11 9 SER F Protein A 2 FT #SUB 149 147 SER H 11 9 SER F Protein A 6 FT #SUB 151 149 GLN H 11 9 SER F Protein S 3 FT #SUB 57 55 LEU H 15 13 VAL I Protein S 1 FT #SUB 59 57 LEU H 157 155 ILE I Protein S 2 FT #SUB 75 73 HIS H 114 112 LYS I Protein S 5 FT #SUB 77 75 LEU H 117 115 TYR I Protein S 2 FT #SUB 84 82 ARG H 36 34 ASN I Protein S 4 FT #SUB 93 91 VAL H 36 34 ASN I Protein S 1 FT #SUB 94 92 ASN H 149 147 SER I Protein A 3 FT #SUB 94 92 ASN H 150 148 GLY I Protein B 2 FT #SUB 95 93 LEU H 36 34 ASN I Protein S 4 FT #SUB 95 93 LEU H 150 148 GLY I Protein B 3 FT #SUB 96 94 LEU H 150 148 GLY I Protein B 2 FT #SUB 96 94 LEU H 153 151 TYR I Protein S 4 FT #SUB 97 95 SER H 63 61 GLN I Protein B 4 FT #SUB 97 95 SER H 149 147 SER I Protein S 1 FT #SUB 97 95 SER H 150 148 GLY I Protein A 8 FT #SUB 97 95 SER H 151 149 GLN I Protein A 7 FT #SUB 98 96 ALA H 63 61 GLN I Protein A 2 FT #SUB 98 96 ALA H 121 119 TYR I Protein S 1 FT #SUB 99 97 ILE H 65 63 LEU I Protein A 5 FT #SUB 99 97 ILE H 117 115 TYR I Protein A 6 FT #SUB 99 97 ILE H 119 117 PRO I Protein B 1 FT #SUB 99 97 ILE H 151 149 GLN I Protein S 1 FT #SUB 100 98 LYS H 119 117 PRO I Protein S 3 FT #SUB 101 99 SER H 116 114 TRP I Protein S 2 FT #SUB 101 99 SER H 117 115 TYR I Protein A 9 FT #SUB 104 102 GLN H 104 102 GLN I Protein S 1 FT #SUB 120 118 ILE H 121 119 TYR I Protein A 3 FT #SUB 121 119 TYR H 121 119 TYR I Protein A 9 FT #SUB 122 120 LEU H 63 61 GLN I Protein S 1 FT #SUB 122 120 LEU H 153 151 TYR I Protein S 1 FT #SUB 123 121 GLY H 61 59 TYR I Protein B 2 FT #SUB 123 121 GLY H 153 151 TYR I Protein B 4 FT #SUB 124 122 GLY H 61 59 TYR I Protein B 4 FT #SUB 125 123 VAL H 16 14 ALA I Protein S 1 FT #SUB 125 123 VAL H 17 15 HIS I Protein A 5 FT #SUB 125 123 VAL H 61 59 TYR I Protein A 5 FT #SUB 125 123 VAL H 157 155 ILE I Protein S 1 FT #SUB 126 124 PHE H 17 15 HIS I Protein S 5 FT #SUB 126 124 PHE H 36 34 ASN I Protein S 2 FT #SUB 126 124 PHE H 38 36 LEU I Protein B 2 FT #SUB 127 125 GLN H 38 36 LEU I Protein B 1 FT #SUB 159 157 LEU H 157 155 ILE I Protein S 1 FT #SUB 21 19 ASN H 69 67 GLN R Protein S 1 FT #SUB 23 21 GLN H 69 67 GLN R Protein S 5 FT #SUB 23 21 GLN H 115 113 PRO R Protein S 1 FT #SUB 33 31 ARG H 23 21 GLN R Protein S 1 FT #SUB 33 31 ARG H 25 23 GLU R Protein S 5 FT #SUB 34 32 ARG H 25 23 GLU R Protein B 1 FT #SUB 34 32 ARG H 69 67 GLN R Protein S 1 FT #HET 59 57 LEU H 8 201 JNI H S 1 FT #HET 61 59 TYR H 8 201 JNI H S 1 FT #HET 63 61 GLN H 9 202 JNI H S 1 FT #HET 121 119 TYR H 9 202 JNI H S 15 FT #HET 123 121 GLY H 8 201 JNI H B 4 FT #HET 153 151 TYR H 8 201 JNI H S 4 FT #HET 157 155 ILE H 8 201 JNI H S 2 FT #HET 159 157 LEU H 8 201 JNI H B 1 FT DISORDER 1 9 CC SEQUENCE 150 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPE GAEAKPWYEP IYLGGVFQLE CC KGDRLSAEIN RPDYLDFAES GQVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8I STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU I 123 121 GLY G Protein S 2 FT #SUB 95 93 LEU I 127 125 GLN G Protein B 1 FT #SUB 96 94 LEU I 127 125 GLN G Protein S 1 FT #SUB 97 95 SER I 127 125 GLN G Protein A 9 FT #SUB 123 121 GLY I 57 55 LEU G Protein B 2 FT #SUB 124 122 GLY I 125 123 VAL G Protein B 3 FT #SUB 125 123 VAL I 124 122 GLY G Protein A 4 FT #SUB 125 123 VAL I 125 123 VAL G Protein A 12 FT #SUB 125 123 VAL I 126 124 PHE G Protein B 1 FT #SUB 126 124 PHE I 125 123 VAL G Protein S 2 FT #SUB 126 124 PHE I 126 124 PHE G Protein S 2 FT #SUB 127 125 GLN I 96 94 LEU G Protein S 4 FT #SUB 127 125 GLN I 97 95 SER G Protein S 10 FT #SUB 15 13 VAL I 57 55 LEU H Protein S 1 FT #SUB 16 14 ALA I 125 123 VAL H Protein B 1 FT #SUB 17 15 HIS I 125 123 VAL H Protein S 5 FT #SUB 17 15 HIS I 126 124 PHE H Protein S 5 FT #SUB 36 34 ASN I 84 82 ARG H Protein S 4 FT #SUB 36 34 ASN I 93 91 VAL H Protein S 1 FT #SUB 36 34 ASN I 95 93 LEU H Protein S 4 FT #SUB 36 34 ASN I 126 124 PHE H Protein B 2 FT #SUB 38 36 LEU I 126 124 PHE H Protein S 2 FT #SUB 38 36 LEU I 127 125 GLN H Protein S 1 FT #SUB 61 59 TYR I 123 121 GLY H Protein S 2 FT #SUB 61 59 TYR I 124 122 GLY H Protein S 4 FT #SUB 61 59 TYR I 125 123 VAL H Protein S 5 FT #SUB 63 61 GLN I 97 95 SER H Protein S 4 FT #SUB 63 61 GLN I 98 96 ALA H Protein S 2 FT #SUB 63 61 GLN I 122 120 LEU H Protein S 1 FT #SUB 65 63 LEU I 99 97 ILE H Protein S 5 FT #SUB 104 102 GLN I 104 102 GLN H Protein S 1 FT #SUB 114 112 LYS I 75 73 HIS H Protein S 5 FT #SUB 116 114 TRP I 101 99 SER H Protein B 2 FT #SUB 117 115 TYR I 77 75 LEU H Protein S 2 FT #SUB 117 115 TYR I 99 97 ILE H Protein S 6 FT #SUB 117 115 TYR I 101 99 SER H Protein A 9 FT #SUB 119 117 PRO I 99 97 ILE H Protein S 1 FT #SUB 119 117 PRO I 100 98 LYS H Protein S 3 FT #SUB 121 119 TYR I 98 96 ALA H Protein S 1 FT #SUB 121 119 TYR I 120 118 ILE H Protein S 3 FT #SUB 121 119 TYR I 121 119 TYR H Protein S 9 FT #SUB 149 147 SER I 94 92 ASN H Protein A 3 FT #SUB 149 147 SER I 97 95 SER H Protein B 1 FT #SUB 150 148 GLY I 94 92 ASN H Protein B 2 FT #SUB 150 148 GLY I 95 93 LEU H Protein B 3 FT #SUB 150 148 GLY I 96 94 LEU H Protein B 2 FT #SUB 150 148 GLY I 97 95 SER H Protein B 8 FT #SUB 151 149 GLN I 97 95 SER H Protein A 7 FT #SUB 151 149 GLN I 99 97 ILE H Protein S 1 FT #SUB 153 151 TYR I 96 94 LEU H Protein S 4 FT #SUB 153 151 TYR I 122 120 LEU H Protein S 1 FT #SUB 153 151 TYR I 123 121 GLY H Protein S 4 FT #SUB 157 155 ILE I 59 57 LEU H Protein S 2 FT #SUB 157 155 ILE I 125 123 VAL H Protein S 1 FT #SUB 157 155 ILE I 159 157 LEU H Protein S 1 FT #HET 13 11 LYS I 8 201 JNI H S 5 FT #HET 59 57 LEU I 8 201 JNI H S 2 FT #HET 61 59 TYR I 8 201 JNI H S 6 FT #HET 121 119 TYR I 9 202 JNI H A 4 FT #HET 122 120 LEU I 9 202 JNI H B 3 FT #HET 123 121 GLY I 9 202 JNI H B 1 FT #HET 158 156 ALA I 8 201 JNI H B 2 FT #HET 159 157 LEU I 6 201 JNI F B 1 FT #HET 159 157 LEU I 8 201 JNI H S 1 FT DISORDER 1 10 FT DISORDER 105 112 CC SEQUENCE 141 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQAKPWYE PIYLGGVFQL EKGDRLSAEI CC NRPDYLDFAE SGQVYFGIIA L CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQ--------AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC **** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8J STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU J 11 9 SER K Protein S 2 FT #SUB 57 55 LEU J 15 13 VAL K Protein S 1 FT #SUB 59 57 LEU J 157 155 ILE K Protein S 1 FT #SUB 73 71 SER J 114 112 LYS K Protein B 1 FT #SUB 75 73 HIS J 114 112 LYS K Protein S 2 FT #SUB 75 73 HIS J 115 113 PRO K Protein S 3 FT #SUB 77 75 LEU J 117 115 TYR K Protein S 2 FT #SUB 84 82 ARG J 36 34 ASN K Protein S 5 FT #SUB 93 91 VAL J 36 34 ASN K Protein S 1 FT #SUB 94 92 ASN J 148 146 GLU K Protein S 1 FT #SUB 94 92 ASN J 149 147 SER K Protein S 3 FT #SUB 95 93 LEU J 36 34 ASN K Protein S 4 FT #SUB 95 93 LEU J 150 148 GLY K Protein B 2 FT #SUB 96 94 LEU J 150 148 GLY K Protein B 2 FT #SUB 96 94 LEU J 153 151 TYR K Protein S 3 FT #SUB 97 95 SER J 63 61 GLN K Protein B 4 FT #SUB 97 95 SER J 150 148 GLY K Protein A 6 FT #SUB 97 95 SER J 151 149 GLN K Protein B 1 FT #SUB 98 96 ALA J 63 61 GLN K Protein S 1 FT #SUB 99 97 ILE J 65 63 LEU K Protein B 1 FT #SUB 99 97 ILE J 117 115 TYR K Protein A 7 FT #SUB 99 97 ILE J 119 117 PRO K Protein B 1 FT #SUB 99 97 ILE J 151 149 GLN K Protein S 1 FT #SUB 100 98 LYS J 119 117 PRO K Protein S 4 FT #SUB 101 99 SER J 115 113 PRO K Protein S 1 FT #SUB 101 99 SER J 116 114 TRP K Protein S 2 FT #SUB 101 99 SER J 117 115 TYR K Protein A 7 FT #SUB 104 102 GLN J 104 102 GLN K Protein S 2 FT #SUB 105 103 ARG J 105 103 ARG K Protein S 3 FT #SUB 121 119 TYR J 63 61 GLN K Protein B 1 FT #SUB 121 119 TYR J 121 119 TYR K Protein A 5 FT #SUB 122 120 LEU J 63 61 GLN K Protein S 1 FT #SUB 122 120 LEU J 153 151 TYR K Protein B 1 FT #SUB 123 121 GLY J 61 59 TYR K Protein B 2 FT #SUB 123 121 GLY J 121 119 TYR K Protein B 5 FT #SUB 123 121 GLY J 153 151 TYR K Protein B 4 FT #SUB 124 122 GLY J 17 15 HIS K Protein B 1 FT #SUB 124 122 GLY J 61 59 TYR K Protein B 4 FT #SUB 125 123 VAL J 16 14 ALA K Protein S 1 FT #SUB 125 123 VAL J 17 15 HIS K Protein B 3 FT #SUB 125 123 VAL J 61 59 TYR K Protein A 3 FT #SUB 125 123 VAL J 157 155 ILE K Protein S 3 FT #SUB 126 124 PHE J 36 34 ASN K Protein S 4 FT #SUB 126 124 PHE J 38 36 LEU K Protein B 1 FT #SUB 127 125 GLN J 38 36 LEU K Protein B 1 FT #SUB 159 157 LEU J 11 9 SER K Protein B 1 FT #SUB 11 9 SER J 149 147 SER L Protein A 8 FT #SUB 12 10 ASP J 149 147 SER L Protein A 4 FT #SUB 149 147 SER J 12 10 ASP L Protein S 1 FT #SUB 89 87 TYR J 47 45 ASP u Protein S 1 FT #SUB 90 88 GLN J 27 25 GLN u Protein B 1 FT #SUB 91 89 THR J 27 25 GLN u Protein A 5 FT #SUB 92 90 LYS J 23 21 GLN u Protein S 2 FT #SUB 92 90 LYS J 24 22 ALA u Protein S 4 FT #SUB 92 90 LYS J 27 25 GLN u Protein A 7 FT #SUB 137 135 GLU J 23 21 GLN u Protein S 1 FT #SUB 137 135 GLU J 25 23 GLU u Protein S 1 FT #HET 17 15 HIS J 11 202 JNI J S 4 FT #HET 59 57 LEU J 10 201 JNI J S 4 FT #HET 60 58 ILE J 10 201 JNI J B 1 FT #HET 61 59 TYR J 10 201 JNI J S 6 FT #HET 62 60 SER J 10 201 JNI J B 4 FT #HET 63 61 GLN J 10 201 JNI J S 2 FT #HET 121 119 TYR J 10 201 JNI J S 19 FT #HET 122 120 LEU J 10 201 JNI J B 1 FT #HET 123 121 GLY J 10 201 JNI J B 2 FT #HET 124 122 GLY J 10 201 JNI J B 2 FT #HET 153 151 TYR J 10 201 JNI J S 5 FT DISORDER 1 10 FT DISORDER 32 37 FT DISORDER 109 113 CC SEQUENCE 138 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPKPWYEPIY LGGVFQLEKG DRLSAEINRP CC DYLDFAESGQ VYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP-----KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8K STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 11 9 SER K 57 55 LEU J Protein A 2 FT #SUB 11 9 SER K 159 157 LEU J Protein B 1 FT #SUB 15 13 VAL K 57 55 LEU J Protein S 1 FT #SUB 16 14 ALA K 125 123 VAL J Protein B 1 FT #SUB 17 15 HIS K 124 122 GLY J Protein S 1 FT #SUB 17 15 HIS K 125 123 VAL J Protein S 3 FT #SUB 36 34 ASN K 84 82 ARG J Protein S 5 FT #SUB 36 34 ASN K 93 91 VAL J Protein S 1 FT #SUB 36 34 ASN K 95 93 LEU J Protein S 4 FT #SUB 36 34 ASN K 126 124 PHE J Protein A 4 FT #SUB 38 36 LEU K 126 124 PHE J Protein S 1 FT #SUB 38 36 LEU K 127 125 GLN J Protein S 1 FT #SUB 61 59 TYR K 123 121 GLY J Protein S 2 FT #SUB 61 59 TYR K 124 122 GLY J Protein S 4 FT #SUB 61 59 TYR K 125 123 VAL J Protein S 3 FT #SUB 63 61 GLN K 97 95 SER J Protein S 4 FT #SUB 63 61 GLN K 98 96 ALA J Protein S 1 FT #SUB 63 61 GLN K 121 119 TYR J Protein S 1 FT #SUB 63 61 GLN K 122 120 LEU J Protein S 1 FT #SUB 65 63 LEU K 99 97 ILE J Protein S 1 FT #SUB 104 102 GLN K 104 102 GLN J Protein S 2 FT #SUB 105 103 ARG K 105 103 ARG J Protein S 3 FT #SUB 114 112 LYS K 73 71 SER J Protein S 1 FT #SUB 114 112 LYS K 75 73 HIS J Protein S 2 FT #SUB 115 113 PRO K 75 73 HIS J Protein A 3 FT #SUB 115 113 PRO K 101 99 SER J Protein B 1 FT #SUB 116 114 TRP K 101 99 SER J Protein B 2 FT #SUB 117 115 TYR K 77 75 LEU J Protein S 2 FT #SUB 117 115 TYR K 99 97 ILE J Protein S 7 FT #SUB 117 115 TYR K 101 99 SER J Protein A 7 FT #SUB 119 117 PRO K 99 97 ILE J Protein S 1 FT #SUB 119 117 PRO K 100 98 LYS J Protein S 4 FT #SUB 121 119 TYR K 121 119 TYR J Protein S 5 FT #SUB 121 119 TYR K 123 121 GLY J Protein S 5 FT #SUB 148 146 GLU K 94 92 ASN J Protein S 1 FT #SUB 149 147 SER K 94 92 ASN J Protein B 3 FT #SUB 150 148 GLY K 95 93 LEU J Protein B 2 FT #SUB 150 148 GLY K 96 94 LEU J Protein B 2 FT #SUB 150 148 GLY K 97 95 SER J Protein B 6 FT #SUB 151 149 GLN K 97 95 SER J Protein B 1 FT #SUB 151 149 GLN K 99 97 ILE J Protein S 1 FT #SUB 153 151 TYR K 96 94 LEU J Protein S 3 FT #SUB 153 151 TYR K 122 120 LEU J Protein S 1 FT #SUB 153 151 TYR K 123 121 GLY J Protein S 4 FT #SUB 157 155 ILE K 59 57 LEU J Protein S 1 FT #SUB 157 155 ILE K 125 123 VAL J Protein S 3 FT #SUB 57 55 LEU K 123 121 GLY M Protein S 2 FT #SUB 96 94 LEU K 127 125 GLN M Protein A 4 FT #SUB 97 95 SER K 127 125 GLN M Protein A 9 FT #SUB 123 121 GLY K 57 55 LEU M Protein B 2 FT #SUB 124 122 GLY K 125 123 VAL M Protein B 3 FT #SUB 125 123 VAL K 124 122 GLY M Protein A 4 FT #SUB 125 123 VAL K 125 123 VAL M Protein A 9 FT #SUB 125 123 VAL K 126 124 PHE M Protein B 3 FT #SUB 126 124 PHE K 125 123 VAL M Protein S 3 FT #SUB 126 124 PHE K 126 124 PHE M Protein S 4 FT #SUB 127 125 GLN K 96 94 LEU M Protein S 3 FT #SUB 127 125 GLN K 97 95 SER M Protein S 11 FT #SUB 75 73 HIS K 41 39 ASN Q Protein S 5 FT #SUB 75 73 HIS K 42 40 GLY Q Protein S 11 FT #SUB 75 73 HIS K 44 42 GLU Q Protein B 3 FT #SUB 77 75 LEU K 130 128 LYS Q Protein S 1 FT #SUB 81 79 THR K 90 88 GLN Q Protein S 2 FT #SUB 92 90 LYS K 91 89 THR Q Protein B 1 FT #SUB 94 92 ASN K 87 85 VAL Q Protein S 1 FT #SUB 94 92 ASN K 88 86 SER Q Protein S 4 FT #SUB 94 92 ASN K 89 87 TYR Q Protein A 3 FT #SUB 94 92 ASN K 90 88 GLN Q Protein S 6 FT #SUB 97 95 SER K 87 85 VAL Q Protein S 1 FT #SUB 99 97 ILE K 87 85 VAL Q Protein S 4 FT #SUB 101 99 SER K 130 128 LYS Q Protein S 3 FT #SUB 139 137 ASN K 46 44 ARG Q Protein B 1 FT #SUB 140 138 ARG K 44 42 GLU Q Protein S 1 FT #SUB 140 138 ARG K 46 44 ARG Q Protein S 12 FT #SUB 23 21 GLN K 140 138 ARG S Protein S 1 FT #SUB 23 21 GLN K 142 140 ASP S Protein S 1 FT #SUB 23 21 GLN K 143 141 TYR S Protein S 2 FT #SUB 25 23 GLU K 72 70 PRO S Protein S 4 FT #SUB 33 31 ARG K 22 20 PRO S Protein S 6 FT #SUB 33 31 ARG K 24 22 ALA S Protein S 1 FT #SUB 33 31 ARG K 25 23 GLU S Protein A 4 FT #SUB 33 31 ARG K 26 24 GLY S Protein B 1 FT #SUB 33 31 ARG K 146 144 PHE S Protein S 5 FT #SUB 34 32 ARG K 25 23 GLU S Protein B 10 FT #SUB 37 35 ALA K 25 23 GLU S Protein B 1 FT #SUB 41 39 ASN K 75 73 HIS e Protein B 7 FT #SUB 42 40 GLY K 75 73 HIS e Protein B 7 FT #SUB 44 42 GLU K 75 73 HIS e Protein S 1 FT #SUB 46 44 ARG K 139 137 ASN e Protein S 1 FT #SUB 46 44 ARG K 140 138 ARG e Protein S 12 FT #SUB 53 51 PRO K 75 73 HIS e Protein S 1 FT #SUB 53 51 PRO K 77 75 LEU e Protein B 1 FT #SUB 87 85 VAL K 81 79 THR e Protein B 1 FT #SUB 87 85 VAL K 94 92 ASN e Protein B 1 FT #SUB 87 85 VAL K 97 95 SER e Protein A 2 FT #SUB 87 85 VAL K 99 97 ILE e Protein S 4 FT #SUB 88 86 SER K 94 92 ASN e Protein B 4 FT #SUB 88 86 SER K 97 95 SER e Protein B 1 FT #SUB 89 87 TYR K 92 90 LYS e Protein B 1 FT #SUB 89 87 TYR K 94 92 ASN e Protein B 1 FT #SUB 90 88 GLN K 81 79 THR e Protein S 3 FT #SUB 90 88 GLN K 92 90 LYS e Protein S 2 FT #SUB 90 88 GLN K 94 92 ASN e Protein S 4 FT #SUB 91 89 THR K 92 90 LYS e Protein S 1 FT #SUB 130 128 LYS K 77 75 LEU e Protein S 2 FT #SUB 130 128 LYS K 101 99 SER e Protein S 2 FT #SUB 89 87 TYR K 89 87 TYR g Protein S 15 FT #SUB 112 110 GLU K 88 86 SER t Protein A 3 FT #SUB 112 110 GLU K 89 87 TYR t Protein S 10 FT #SUB 114 112 LYS K 89 87 TYR t Protein A 4 FT #SUB 115 113 PRO K 89 87 TYR t Protein S 1 FT #SUB 147 145 ALA K 33 31 ARG u Protein B 5 FT #SUB 148 146 GLU K 33 31 ARG u Protein S 5 FT #HET 59 57 LEU K 10 201 JNI J S 2 FT #HET 121 119 TYR K 10 201 JNI J S 6 FT #HET 123 121 GLY K 10 201 JNI J B 5 FT #HET 124 122 GLY K 10 201 JNI J B 1 FT #HET 159 157 LEU K 11 202 JNI J A 3 FT #HET 159 157 LEU K 12 201 JNI L S 1 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8L STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 12 10 ASP L 149 147 SER J Protein S 1 FT #SUB 149 147 SER L 11 9 SER J Protein A 8 FT #SUB 149 147 SER L 12 10 ASP J Protein S 4 FT #SUB 57 55 LEU L 15 13 VAL M Protein S 1 FT #SUB 75 73 HIS L 115 113 PRO M Protein S 1 FT #SUB 84 82 ARG L 36 34 ASN M Protein S 1 FT #SUB 94 92 ASN L 149 147 SER M Protein A 5 FT #SUB 94 92 ASN L 150 148 GLY M Protein B 1 FT #SUB 95 93 LEU L 36 34 ASN M Protein S 3 FT #SUB 95 93 LEU L 150 148 GLY M Protein B 2 FT #SUB 96 94 LEU L 150 148 GLY M Protein B 3 FT #SUB 96 94 LEU L 153 151 TYR M Protein S 4 FT #SUB 97 95 SER L 63 61 GLN M Protein B 4 FT #SUB 97 95 SER L 150 148 GLY M Protein A 6 FT #SUB 97 95 SER L 151 149 GLN M Protein B 2 FT #SUB 98 96 ALA L 121 119 TYR M Protein S 1 FT #SUB 99 97 ILE L 65 63 LEU M Protein B 2 FT #SUB 99 97 ILE L 117 115 TYR M Protein A 6 FT #SUB 99 97 ILE L 119 117 PRO M Protein B 4 FT #SUB 100 98 LYS L 117 115 TYR M Protein B 1 FT #SUB 100 98 LYS L 119 117 PRO M Protein S 2 FT #SUB 101 99 SER L 116 114 TRP M Protein S 3 FT #SUB 101 99 SER L 117 115 TYR M Protein A 8 FT #SUB 120 118 ILE L 121 119 TYR M Protein S 1 FT #SUB 121 119 TYR L 121 119 TYR M Protein B 8 FT #SUB 122 120 LEU L 63 61 GLN M Protein S 1 FT #SUB 122 120 LEU L 153 151 TYR M Protein S 1 FT #SUB 123 121 GLY L 61 59 TYR M Protein B 2 FT #SUB 123 121 GLY L 153 151 TYR M Protein B 4 FT #SUB 124 122 GLY L 17 15 HIS M Protein B 2 FT #SUB 124 122 GLY L 61 59 TYR M Protein B 4 FT #SUB 125 123 VAL L 16 14 ALA M Protein S 2 FT #SUB 125 123 VAL L 17 15 HIS M Protein B 4 FT #SUB 125 123 VAL L 61 59 TYR M Protein A 4 FT #SUB 125 123 VAL L 157 155 ILE M Protein S 1 FT #SUB 126 124 PHE L 17 15 HIS M Protein S 4 FT #SUB 126 124 PHE L 36 34 ASN M Protein S 3 FT #SUB 126 124 PHE L 38 36 LEU M Protein B 2 FT #SUB 127 125 GLN L 38 36 LEU M Protein B 1 FT #SUB 159 157 LEU L 15 13 VAL M Protein S 1 FT #SUB 159 157 LEU L 157 155 ILE M Protein S 1 FT #HET 59 57 LEU L 13 201 JNI M S 7 FT #HET 61 59 TYR L 13 201 JNI M S 1 FT #HET 121 119 TYR L 12 201 JNI L S 21 FT #HET 122 120 LEU L 12 201 JNI L B 8 FT #HET 123 121 GLY L 12 201 JNI L B 1 FT #HET 123 121 GLY L 13 201 JNI M B 5 FT #HET 153 151 TYR L 13 201 JNI M S 4 FT #HET 157 155 ILE L 11 202 JNI J S 1 FT #HET 157 155 ILE L 13 201 JNI M S 2 FT DISORDER 1 9 FT DISORDER 105 112 CC SEQUENCE 142 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQAKPWY EPIYLGGVFQ LEKGDRLSAE CC INRPDYLDFA ESGQVYFGII AL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQ--------AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC **** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8M STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU M 123 121 GLY K Protein S 2 FT #SUB 96 94 LEU M 127 125 GLN K Protein A 3 FT #SUB 97 95 SER M 127 125 GLN K Protein A 11 FT #SUB 123 121 GLY M 57 55 LEU K Protein B 2 FT #SUB 124 122 GLY M 125 123 VAL K Protein B 4 FT #SUB 125 123 VAL M 124 122 GLY K Protein A 3 FT #SUB 125 123 VAL M 125 123 VAL K Protein A 9 FT #SUB 125 123 VAL M 126 124 PHE K Protein B 3 FT #SUB 126 124 PHE M 125 123 VAL K Protein S 3 FT #SUB 126 124 PHE M 126 124 PHE K Protein S 4 FT #SUB 127 125 GLN M 96 94 LEU K Protein S 4 FT #SUB 127 125 GLN M 97 95 SER K Protein S 9 FT #SUB 15 13 VAL M 57 55 LEU L Protein S 1 FT #SUB 15 13 VAL M 159 157 LEU L Protein S 1 FT #SUB 16 14 ALA M 125 123 VAL L Protein B 2 FT #SUB 17 15 HIS M 124 122 GLY L Protein S 2 FT #SUB 17 15 HIS M 125 123 VAL L Protein S 4 FT #SUB 17 15 HIS M 126 124 PHE L Protein S 4 FT #SUB 36 34 ASN M 84 82 ARG L Protein S 1 FT #SUB 36 34 ASN M 95 93 LEU L Protein S 3 FT #SUB 36 34 ASN M 126 124 PHE L Protein A 3 FT #SUB 38 36 LEU M 126 124 PHE L Protein S 2 FT #SUB 38 36 LEU M 127 125 GLN L Protein S 1 FT #SUB 61 59 TYR M 123 121 GLY L Protein S 2 FT #SUB 61 59 TYR M 124 122 GLY L Protein S 4 FT #SUB 61 59 TYR M 125 123 VAL L Protein S 4 FT #SUB 63 61 GLN M 97 95 SER L Protein S 4 FT #SUB 63 61 GLN M 122 120 LEU L Protein S 1 FT #SUB 65 63 LEU M 99 97 ILE L Protein S 2 FT #SUB 115 113 PRO M 75 73 HIS L Protein B 1 FT #SUB 116 114 TRP M 101 99 SER L Protein A 3 FT #SUB 117 115 TYR M 99 97 ILE L Protein S 6 FT #SUB 117 115 TYR M 100 98 LYS L Protein B 1 FT #SUB 117 115 TYR M 101 99 SER L Protein A 8 FT #SUB 119 117 PRO M 99 97 ILE L Protein A 4 FT #SUB 119 117 PRO M 100 98 LYS L Protein S 2 FT #SUB 121 119 TYR M 98 96 ALA L Protein S 1 FT #SUB 121 119 TYR M 120 118 ILE L Protein S 1 FT #SUB 121 119 TYR M 121 119 TYR L Protein S 8 FT #SUB 149 147 SER M 94 92 ASN L Protein A 5 FT #SUB 150 148 GLY M 94 92 ASN L Protein B 1 FT #SUB 150 148 GLY M 95 93 LEU L Protein B 2 FT #SUB 150 148 GLY M 96 94 LEU L Protein B 3 FT #SUB 150 148 GLY M 97 95 SER L Protein B 6 FT #SUB 151 149 GLN M 97 95 SER L Protein B 2 FT #SUB 153 151 TYR M 96 94 LEU L Protein S 4 FT #SUB 153 151 TYR M 122 120 LEU L Protein S 1 FT #SUB 153 151 TYR M 123 121 GLY L Protein S 4 FT #SUB 157 155 ILE M 125 123 VAL L Protein S 1 FT #SUB 157 155 ILE M 159 157 LEU L Protein S 1 FT #SUB 41 39 ASN M 75 73 HIS O Protein B 2 FT #SUB 42 40 GLY M 75 73 HIS O Protein B 6 FT #SUB 44 42 GLU M 140 138 ARG O Protein S 1 FT #SUB 46 44 ARG M 139 137 ASN O Protein S 1 FT #SUB 46 44 ARG M 140 138 ARG O Protein S 13 FT #SUB 87 85 VAL M 94 92 ASN O Protein B 1 FT #SUB 87 85 VAL M 99 97 ILE O Protein S 4 FT #SUB 88 86 SER M 94 92 ASN O Protein B 3 FT #SUB 88 86 SER M 97 95 SER O Protein S 1 FT #SUB 89 87 TYR M 94 92 ASN O Protein B 2 FT #SUB 90 88 GLN M 81 79 THR O Protein S 2 FT #SUB 90 88 GLN M 92 90 LYS O Protein B 2 FT #SUB 91 89 THR M 92 90 LYS O Protein S 1 FT #SUB 130 128 LYS M 101 99 SER O Protein S 3 FT #SUB 89 87 TYR M 89 87 TYR Q Protein S 18 FT #SUB 75 73 HIS M 41 39 ASN g Protein S 1 FT #SUB 75 73 HIS M 42 40 GLY g Protein S 7 FT #SUB 75 73 HIS M 44 42 GLU g Protein B 1 FT #SUB 75 73 HIS M 53 51 PRO g Protein S 1 FT #SUB 77 75 LEU M 52 50 VAL g Protein S 1 FT #SUB 77 75 LEU M 131 129 GLY g Protein S 2 FT #SUB 81 79 THR M 90 88 GLN g Protein S 2 FT #SUB 83 81 SER M 90 88 GLN g Protein S 2 FT #SUB 91 89 THR M 91 89 THR g Protein S 1 FT #SUB 92 90 LYS M 89 87 TYR g Protein B 1 FT #SUB 92 90 LYS M 90 88 GLN g Protein A 5 FT #SUB 92 90 LYS M 91 89 THR g Protein B 3 FT #SUB 94 92 ASN M 88 86 SER g Protein S 3 FT #SUB 94 92 ASN M 89 87 TYR g Protein A 3 FT #SUB 99 97 ILE M 87 85 VAL g Protein S 4 FT #SUB 101 99 SER M 130 128 LYS g Protein S 2 FT #SUB 139 137 ASN M 46 44 ARG g Protein B 1 FT #SUB 140 138 ARG M 46 44 ARG g Protein S 16 FT #SUB 142 140 ASP M 46 44 ARG g Protein S 1 FT #HET 13 11 LYS M 13 201 JNI M S 4 FT #HET 59 57 LEU M 12 201 JNI L S 1 FT #HET 59 57 LEU M 13 201 JNI M S 5 FT #HET 60 58 ILE M 12 201 JNI L B 1 FT #HET 61 59 TYR M 12 201 JNI L S 2 FT #HET 61 59 TYR M 13 201 JNI M S 2 FT #HET 121 119 TYR M 12 201 JNI L S 7 FT #HET 122 120 LEU M 12 201 JNI L B 3 FT #HET 123 121 GLY M 12 201 JNI L B 7 FT #HET 158 156 ALA M 13 201 JNI M B 2 FT #HET 159 157 LEU M 13 201 JNI M B 5 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8N STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU N 11 9 SER O Protein S 2 FT #SUB 57 55 LEU N 15 13 VAL O Protein S 1 FT #SUB 59 57 LEU N 157 155 ILE O Protein S 2 FT #SUB 75 73 HIS N 114 112 LYS O Protein S 3 FT #SUB 75 73 HIS N 115 113 PRO O Protein S 3 FT #SUB 77 75 LEU N 117 115 TYR O Protein S 2 FT #SUB 84 82 ARG N 36 34 ASN O Protein S 2 FT #SUB 93 91 VAL N 36 34 ASN O Protein S 1 FT #SUB 94 92 ASN N 148 146 GLU O Protein S 1 FT #SUB 94 92 ASN N 149 147 SER O Protein A 6 FT #SUB 95 93 LEU N 36 34 ASN O Protein S 4 FT #SUB 95 93 LEU N 150 148 GLY O Protein B 2 FT #SUB 96 94 LEU N 150 148 GLY O Protein B 2 FT #SUB 96 94 LEU N 153 151 TYR O Protein S 4 FT #SUB 97 95 SER N 63 61 GLN O Protein B 2 FT #SUB 97 95 SER N 150 148 GLY O Protein B 6 FT #SUB 97 95 SER N 151 149 GLN O Protein B 3 FT #SUB 99 97 ILE N 65 63 LEU O Protein B 2 FT #SUB 99 97 ILE N 117 115 TYR O Protein A 5 FT #SUB 99 97 ILE N 119 117 PRO O Protein B 2 FT #SUB 99 97 ILE N 151 149 GLN O Protein S 1 FT #SUB 100 98 LYS N 118 116 GLU O Protein S 3 FT #SUB 100 98 LYS N 119 117 PRO O Protein S 3 FT #SUB 101 99 SER N 116 114 TRP O Protein S 3 FT #SUB 101 99 SER N 117 115 TYR O Protein A 8 FT #SUB 104 102 GLN N 104 102 GLN O Protein S 1 FT #SUB 105 103 ARG N 106 104 GLU O Protein S 2 FT #SUB 105 103 ARG N 107 105 THR O Protein S 1 FT #SUB 121 119 TYR N 121 119 TYR O Protein A 6 FT #SUB 122 120 LEU N 63 61 GLN O Protein S 1 FT #SUB 122 120 LEU N 153 151 TYR O Protein A 2 FT #SUB 123 121 GLY N 61 59 TYR O Protein B 2 FT #SUB 123 121 GLY N 121 119 TYR O Protein B 6 FT #SUB 123 121 GLY N 153 151 TYR O Protein B 5 FT #SUB 124 122 GLY N 17 15 HIS O Protein B 2 FT #SUB 124 122 GLY N 61 59 TYR O Protein B 4 FT #SUB 125 123 VAL N 16 14 ALA O Protein S 1 FT #SUB 125 123 VAL N 17 15 HIS O Protein B 4 FT #SUB 125 123 VAL N 38 36 LEU O Protein B 1 FT #SUB 125 123 VAL N 61 59 TYR O Protein A 3 FT #SUB 125 123 VAL N 156 154 ILE O Protein S 1 FT #SUB 125 123 VAL N 157 155 ILE O Protein S 3 FT #SUB 126 124 PHE N 17 15 HIS O Protein S 4 FT #SUB 126 124 PHE N 36 34 ASN O Protein S 4 FT #SUB 159 157 LEU N 11 9 SER O Protein B 2 FT #SUB 159 157 LEU N 157 155 ILE O Protein S 1 FT #SUB 11 9 SER N 149 147 SER P Protein A 6 FT #SUB 149 147 SER N 12 10 ASP P Protein S 1 FT #SUB 151 149 GLN N 11 9 SER P Protein S 4 FT #HET 17 15 HIS N 15 201 JNI P S 2 FT #HET 59 57 LEU N 14 201 JNI N S 5 FT #HET 60 58 ILE N 14 201 JNI N B 1 FT #HET 61 59 TYR N 14 201 JNI N S 2 FT #HET 62 60 SER N 14 201 JNI N B 3 FT #HET 63 61 GLN N 14 201 JNI N S 2 FT #HET 121 119 TYR N 14 201 JNI N S 17 FT #HET 122 120 LEU N 14 201 JNI N B 3 FT #HET 123 121 GLY N 14 201 JNI N B 5 FT #HET 124 122 GLY N 14 201 JNI N B 2 FT #HET 153 151 TYR N 14 201 JNI N S 7 FT #HET 157 155 ILE N 14 201 JNI N S 1 FT DISORDER 1 10 FT DISORDER 32 37 CC SEQUENCE 143 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPEGAEAKPW YEPIYLGGVF QLEKGDRLSA CC EINRPDYLDF AESGQVYFGI IAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8O STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 75 73 HIS O 41 39 ASN M Protein S 2 FT #SUB 75 73 HIS O 42 40 GLY M Protein S 6 FT #SUB 81 79 THR O 90 88 GLN M Protein S 2 FT #SUB 92 90 LYS O 90 88 GLN M Protein A 2 FT #SUB 92 90 LYS O 91 89 THR M Protein B 1 FT #SUB 94 92 ASN O 87 85 VAL M Protein S 1 FT #SUB 94 92 ASN O 88 86 SER M Protein S 3 FT #SUB 94 92 ASN O 89 87 TYR M Protein A 2 FT #SUB 97 95 SER O 88 86 SER M Protein S 1 FT #SUB 99 97 ILE O 87 85 VAL M Protein S 4 FT #SUB 101 99 SER O 130 128 LYS M Protein S 3 FT #SUB 139 137 ASN O 46 44 ARG M Protein B 1 FT #SUB 140 138 ARG O 44 42 GLU M Protein S 1 FT #SUB 140 138 ARG O 46 44 ARG M Protein S 13 FT #SUB 11 9 SER O 57 55 LEU N Protein B 2 FT #SUB 11 9 SER O 159 157 LEU N Protein B 2 FT #SUB 15 13 VAL O 57 55 LEU N Protein S 1 FT #SUB 16 14 ALA O 125 123 VAL N Protein B 1 FT #SUB 17 15 HIS O 124 122 GLY N Protein S 2 FT #SUB 17 15 HIS O 125 123 VAL N Protein S 4 FT #SUB 17 15 HIS O 126 124 PHE N Protein S 4 FT #SUB 36 34 ASN O 84 82 ARG N Protein S 2 FT #SUB 36 34 ASN O 93 91 VAL N Protein S 1 FT #SUB 36 34 ASN O 95 93 LEU N Protein S 4 FT #SUB 36 34 ASN O 126 124 PHE N Protein A 4 FT #SUB 38 36 LEU O 125 123 VAL N Protein S 1 FT #SUB 61 59 TYR O 123 121 GLY N Protein S 2 FT #SUB 61 59 TYR O 124 122 GLY N Protein S 4 FT #SUB 61 59 TYR O 125 123 VAL N Protein S 3 FT #SUB 63 61 GLN O 97 95 SER N Protein S 2 FT #SUB 63 61 GLN O 122 120 LEU N Protein S 1 FT #SUB 65 63 LEU O 99 97 ILE N Protein S 2 FT #SUB 104 102 GLN O 104 102 GLN N Protein S 1 FT #SUB 106 104 GLU O 105 103 ARG N Protein B 2 FT #SUB 107 105 THR O 105 103 ARG N Protein B 1 FT #SUB 114 112 LYS O 75 73 HIS N Protein S 3 FT #SUB 115 113 PRO O 75 73 HIS N Protein B 3 FT #SUB 116 114 TRP O 101 99 SER N Protein B 3 FT #SUB 117 115 TYR O 77 75 LEU N Protein S 2 FT #SUB 117 115 TYR O 99 97 ILE N Protein S 5 FT #SUB 117 115 TYR O 101 99 SER N Protein A 8 FT #SUB 118 116 GLU O 100 98 LYS N Protein S 3 FT #SUB 119 117 PRO O 99 97 ILE N Protein S 2 FT #SUB 119 117 PRO O 100 98 LYS N Protein S 3 FT #SUB 121 119 TYR O 121 119 TYR N Protein S 6 FT #SUB 121 119 TYR O 123 121 GLY N Protein S 6 FT #SUB 148 146 GLU O 94 92 ASN N Protein S 1 FT #SUB 149 147 SER O 94 92 ASN N Protein A 6 FT #SUB 150 148 GLY O 95 93 LEU N Protein B 2 FT #SUB 150 148 GLY O 96 94 LEU N Protein B 2 FT #SUB 150 148 GLY O 97 95 SER N Protein B 6 FT #SUB 151 149 GLN O 97 95 SER N Protein A 3 FT #SUB 151 149 GLN O 99 97 ILE N Protein S 1 FT #SUB 153 151 TYR O 96 94 LEU N Protein S 4 FT #SUB 153 151 TYR O 122 120 LEU N Protein S 2 FT #SUB 153 151 TYR O 123 121 GLY N Protein S 5 FT #SUB 156 154 ILE O 125 123 VAL N Protein B 1 FT #SUB 157 155 ILE O 59 57 LEU N Protein S 2 FT #SUB 157 155 ILE O 125 123 VAL N Protein S 3 FT #SUB 157 155 ILE O 159 157 LEU N Protein S 1 FT #SUB 57 55 LEU O 123 121 GLY Q Protein S 1 FT #SUB 96 94 LEU O 127 125 GLN Q Protein A 5 FT #SUB 97 95 SER O 127 125 GLN Q Protein A 11 FT #SUB 123 121 GLY O 57 55 LEU Q Protein B 1 FT #SUB 124 122 GLY O 125 123 VAL Q Protein B 4 FT #SUB 125 123 VAL O 124 122 GLY Q Protein A 4 FT #SUB 125 123 VAL O 125 123 VAL Q Protein A 7 FT #SUB 126 124 PHE O 125 123 VAL Q Protein S 2 FT #SUB 126 124 PHE O 126 124 PHE Q Protein S 3 FT #SUB 127 125 GLN O 96 94 LEU Q Protein S 5 FT #SUB 127 125 GLN O 97 95 SER Q Protein S 13 FT #SUB 88 86 SER O 129 127 GLU e Protein S 2 FT #SUB 89 87 TYR O 89 87 TYR e Protein S 19 FT #SUB 129 127 GLU O 88 86 SER e Protein S 1 FT #SUB 42 40 GLY O 75 73 HIS g Protein B 9 FT #SUB 44 42 GLU O 75 73 HIS g Protein S 2 FT #SUB 44 42 GLU O 76 74 VAL g Protein S 2 FT #SUB 46 44 ARG O 139 137 ASN g Protein S 1 FT #SUB 46 44 ARG O 140 138 ARG g Protein S 15 FT #SUB 52 50 VAL O 77 75 LEU g Protein B 1 FT #SUB 87 85 VAL O 99 97 ILE g Protein S 4 FT #SUB 88 86 SER O 94 92 ASN g Protein B 3 FT #SUB 88 86 SER O 97 95 SER g Protein S 1 FT #SUB 90 88 GLN O 81 79 THR g Protein S 2 FT #SUB 90 88 GLN O 83 81 SER g Protein S 4 FT #SUB 90 88 GLN O 92 90 LYS g Protein S 3 FT #SUB 90 88 GLN O 94 92 ASN g Protein S 2 FT #SUB 91 89 THR O 91 89 THR g Protein S 2 FT #SUB 91 89 THR O 92 90 LYS g Protein S 1 FT #SUB 130 128 LYS O 77 75 LEU g Protein S 1 FT #SUB 130 128 LYS O 99 97 ILE g Protein A 2 FT #SUB 130 128 LYS O 101 99 SER g Protein S 3 FT #SUB 131 129 GLY O 77 75 LEU g Protein B 2 FT #HET 57 55 LEU O 16 202 JNI P S 2 FT #HET 59 57 LEU O 14 201 JNI N S 3 FT #HET 121 119 TYR O 14 201 JNI N S 8 FT #HET 123 121 GLY O 14 201 JNI N B 3 FT #HET 124 122 GLY O 14 201 JNI N B 1 FT #HET 159 157 LEU O 16 202 JNI P A 5 FT DISORDER 1 10 FT DISORDER 108 111 CC SEQUENCE 145 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETEAK PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET----EAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* *************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8P STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 11 9 SER P 151 149 GLN N Protein S 4 FT #SUB 12 10 ASP P 149 147 SER N Protein S 1 FT #SUB 149 147 SER P 11 9 SER N Protein B 6 FT #SUB 57 55 LEU P 15 13 VAL Q Protein S 1 FT #SUB 57 55 LEU P 38 36 LEU Q Protein S 1 FT #SUB 84 82 ARG P 36 34 ASN Q Protein S 1 FT #SUB 94 92 ASN P 149 147 SER Q Protein S 1 FT #SUB 95 93 LEU P 36 34 ASN Q Protein S 2 FT #SUB 95 93 LEU P 150 148 GLY Q Protein B 1 FT #SUB 96 94 LEU P 150 148 GLY Q Protein B 2 FT #SUB 96 94 LEU P 153 151 TYR Q Protein S 4 FT #SUB 97 95 SER P 63 61 GLN Q Protein B 2 FT #SUB 97 95 SER P 150 148 GLY Q Protein B 5 FT #SUB 97 95 SER P 151 149 GLN Q Protein B 1 FT #SUB 98 96 ALA P 121 119 TYR Q Protein S 1 FT #SUB 99 97 ILE P 65 63 LEU Q Protein B 1 FT #SUB 99 97 ILE P 117 115 TYR Q Protein A 9 FT #SUB 99 97 ILE P 119 117 PRO Q Protein B 2 FT #SUB 100 98 LYS P 119 117 PRO Q Protein S 2 FT #SUB 101 99 SER P 115 113 PRO Q Protein S 1 FT #SUB 101 99 SER P 116 114 TRP Q Protein S 1 FT #SUB 101 99 SER P 117 115 TYR Q Protein A 4 FT #SUB 104 102 GLN P 104 102 GLN Q Protein S 2 FT #SUB 120 118 ILE P 121 119 TYR Q Protein S 1 FT #SUB 121 119 TYR P 121 119 TYR Q Protein B 5 FT #SUB 122 120 LEU P 63 61 GLN Q Protein S 1 FT #SUB 123 121 GLY P 61 59 TYR Q Protein B 2 FT #SUB 123 121 GLY P 153 151 TYR Q Protein B 4 FT #SUB 124 122 GLY P 61 59 TYR Q Protein B 4 FT #SUB 125 123 VAL P 16 14 ALA Q Protein S 1 FT #SUB 125 123 VAL P 17 15 HIS Q Protein A 4 FT #SUB 125 123 VAL P 61 59 TYR Q Protein A 2 FT #SUB 126 124 PHE P 17 15 HIS Q Protein S 5 FT #SUB 126 124 PHE P 36 34 ASN Q Protein S 1 FT #SUB 127 125 GLN P 38 36 LEU Q Protein B 1 FT #HET 59 57 LEU P 17 201 JNI Q S 4 FT #HET 121 119 TYR P 16 202 JNI P S 16 FT #HET 123 121 GLY P 17 201 JNI Q B 2 FT #HET 153 151 TYR P 17 201 JNI Q S 2 FT #HET 157 155 ILE P 15 201 JNI P S 4 FT #HET 159 157 LEU P 17 201 JNI Q A 2 FT DISORDER 1 9 FT DISORDER 110 114 CC SEQUENCE 145 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPE PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPE-----PWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ********* ************************************ CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8Q STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 72 70 PRO Q 89 87 TYR F Protein B 1 FT #SUB 106 104 GLU Q 89 87 TYR F Protein S 2 FT #SUB 109 107 GLU Q 33 31 ARG G Protein B 3 FT #SUB 109 107 GLU Q 34 32 ARG G Protein A 6 FT #SUB 109 107 GLU Q 35 33 ALA G Protein S 9 FT #SUB 110 108 GLY Q 33 31 ARG G Protein B 4 FT #SUB 112 110 GLU Q 33 31 ARG G Protein S 2 FT #SUB 41 39 ASN Q 75 73 HIS K Protein B 5 FT #SUB 42 40 GLY Q 75 73 HIS K Protein B 11 FT #SUB 44 42 GLU Q 75 73 HIS K Protein S 3 FT #SUB 44 42 GLU Q 140 138 ARG K Protein S 1 FT #SUB 46 44 ARG Q 139 137 ASN K Protein S 1 FT #SUB 46 44 ARG Q 140 138 ARG K Protein S 12 FT #SUB 87 85 VAL Q 94 92 ASN K Protein B 1 FT #SUB 87 85 VAL Q 97 95 SER K Protein S 1 FT #SUB 87 85 VAL Q 99 97 ILE K Protein S 4 FT #SUB 88 86 SER Q 94 92 ASN K Protein B 4 FT #SUB 89 87 TYR Q 94 92 ASN K Protein B 3 FT #SUB 90 88 GLN Q 81 79 THR K Protein S 2 FT #SUB 90 88 GLN Q 94 92 ASN K Protein S 6 FT #SUB 91 89 THR Q 92 90 LYS K Protein S 1 FT #SUB 130 128 LYS Q 77 75 LEU K Protein S 1 FT #SUB 130 128 LYS Q 101 99 SER K Protein S 3 FT #SUB 89 87 TYR Q 89 87 TYR M Protein S 18 FT #SUB 57 55 LEU Q 123 121 GLY O Protein S 1 FT #SUB 96 94 LEU Q 127 125 GLN O Protein A 5 FT #SUB 97 95 SER Q 127 125 GLN O Protein A 13 FT #SUB 123 121 GLY Q 57 55 LEU O Protein B 1 FT #SUB 124 122 GLY Q 125 123 VAL O Protein B 4 FT #SUB 125 123 VAL Q 124 122 GLY O Protein A 4 FT #SUB 125 123 VAL Q 125 123 VAL O Protein A 7 FT #SUB 125 123 VAL Q 126 124 PHE O Protein B 2 FT #SUB 126 124 PHE Q 126 124 PHE O Protein S 3 FT #SUB 127 125 GLN Q 96 94 LEU O Protein S 5 FT #SUB 127 125 GLN Q 97 95 SER O Protein S 11 FT #SUB 15 13 VAL Q 57 55 LEU P Protein S 1 FT #SUB 16 14 ALA Q 125 123 VAL P Protein B 1 FT #SUB 17 15 HIS Q 125 123 VAL P Protein S 4 FT #SUB 17 15 HIS Q 126 124 PHE P Protein S 5 FT #SUB 36 34 ASN Q 84 82 ARG P Protein S 1 FT #SUB 36 34 ASN Q 95 93 LEU P Protein S 2 FT #SUB 36 34 ASN Q 126 124 PHE P Protein B 1 FT #SUB 38 36 LEU Q 57 55 LEU P Protein S 1 FT #SUB 38 36 LEU Q 127 125 GLN P Protein S 1 FT #SUB 61 59 TYR Q 123 121 GLY P Protein S 2 FT #SUB 61 59 TYR Q 124 122 GLY P Protein S 4 FT #SUB 61 59 TYR Q 125 123 VAL P Protein S 2 FT #SUB 63 61 GLN Q 97 95 SER P Protein S 2 FT #SUB 63 61 GLN Q 122 120 LEU P Protein S 1 FT #SUB 65 63 LEU Q 99 97 ILE P Protein S 1 FT #SUB 104 102 GLN Q 104 102 GLN P Protein S 2 FT #SUB 115 113 PRO Q 101 99 SER P Protein B 1 FT #SUB 116 114 TRP Q 101 99 SER P Protein B 1 FT #SUB 117 115 TYR Q 99 97 ILE P Protein S 9 FT #SUB 117 115 TYR Q 101 99 SER P Protein A 4 FT #SUB 119 117 PRO Q 99 97 ILE P Protein S 2 FT #SUB 119 117 PRO Q 100 98 LYS P Protein S 2 FT #SUB 121 119 TYR Q 98 96 ALA P Protein S 1 FT #SUB 121 119 TYR Q 120 118 ILE P Protein S 1 FT #SUB 121 119 TYR Q 121 119 TYR P Protein S 5 FT #SUB 149 147 SER Q 94 92 ASN P Protein B 1 FT #SUB 150 148 GLY Q 95 93 LEU P Protein B 1 FT #SUB 150 148 GLY Q 96 94 LEU P Protein B 2 FT #SUB 150 148 GLY Q 97 95 SER P Protein B 5 FT #SUB 151 149 GLN Q 97 95 SER P Protein B 1 FT #SUB 153 151 TYR Q 96 94 LEU P Protein S 4 FT #SUB 153 151 TYR Q 123 121 GLY P Protein S 4 FT #SUB 75 73 HIS Q 42 40 GLY e Protein S 8 FT #SUB 75 73 HIS Q 44 42 GLU e Protein B 1 FT #SUB 77 75 LEU Q 130 128 LYS e Protein S 2 FT #SUB 77 75 LEU Q 131 129 GLY e Protein S 1 FT #SUB 81 79 THR Q 90 88 GLN e Protein S 1 FT #SUB 91 89 THR Q 91 89 THR e Protein S 2 FT #SUB 92 90 LYS Q 89 87 TYR e Protein B 1 FT #SUB 92 90 LYS Q 90 88 GLN e Protein A 6 FT #SUB 92 90 LYS Q 91 89 THR e Protein B 1 FT #SUB 94 92 ASN Q 88 86 SER e Protein S 4 FT #SUB 94 92 ASN Q 89 87 TYR e Protein A 2 FT #SUB 94 92 ASN Q 90 88 GLN e Protein S 1 FT #SUB 101 99 SER Q 130 128 LYS e Protein S 3 FT #SUB 139 137 ASN Q 46 44 ARG e Protein B 1 FT #SUB 140 138 ARG Q 46 44 ARG e Protein S 12 FT #SUB 142 140 ASP Q 46 44 ARG e Protein S 1 FT #HET 13 11 LYS Q 17 201 JNI Q S 4 FT #HET 59 57 LEU Q 17 201 JNI Q S 5 FT #HET 121 119 TYR Q 16 202 JNI P S 1 FT #HET 122 120 LEU Q 16 202 JNI P B 4 FT #HET 123 121 GLY Q 16 202 JNI P B 5 FT #HET 157 155 ILE Q 17 201 JNI Q S 2 FT #HET 158 156 ALA Q 17 201 JNI Q B 2 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8R STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 23 21 GLN R 33 31 ARG H Protein S 1 FT #SUB 25 23 GLU R 33 31 ARG H Protein S 5 FT #SUB 25 23 GLU R 34 32 ARG H Protein S 1 FT #SUB 69 67 GLN R 21 19 ASN H Protein S 1 FT #SUB 69 67 GLN R 23 21 GLN H Protein S 5 FT #SUB 69 67 GLN R 34 32 ARG H Protein S 1 FT #SUB 115 113 PRO R 23 21 GLN H Protein S 1 FT #SUB 57 55 LEU R 15 13 VAL S Protein S 1 FT #SUB 57 55 LEU R 38 36 LEU S Protein S 1 FT #SUB 59 57 LEU R 157 155 ILE S Protein S 1 FT #SUB 73 71 SER R 114 112 LYS S Protein B 3 FT #SUB 75 73 HIS R 114 112 LYS S Protein A 2 FT #SUB 75 73 HIS R 115 113 PRO S Protein S 4 FT #SUB 77 75 LEU R 117 115 TYR S Protein S 1 FT #SUB 84 82 ARG R 36 34 ASN S Protein S 2 FT #SUB 94 92 ASN R 148 146 GLU S Protein S 2 FT #SUB 94 92 ASN R 149 147 SER S Protein S 3 FT #SUB 95 93 LEU R 36 34 ASN S Protein S 3 FT #SUB 95 93 LEU R 150 148 GLY S Protein B 1 FT #SUB 96 94 LEU R 150 148 GLY S Protein B 2 FT #SUB 96 94 LEU R 153 151 TYR S Protein S 5 FT #SUB 97 95 SER R 63 61 GLN S Protein B 3 FT #SUB 97 95 SER R 150 148 GLY S Protein B 6 FT #SUB 97 95 SER R 151 149 GLN S Protein B 1 FT #SUB 99 97 ILE R 65 63 LEU S Protein A 4 FT #SUB 99 97 ILE R 117 115 TYR S Protein A 10 FT #SUB 99 97 ILE R 119 117 PRO S Protein B 2 FT #SUB 99 97 ILE R 145 143 ASP S Protein S 1 FT #SUB 99 97 ILE R 151 149 GLN S Protein S 1 FT #SUB 100 98 LYS R 119 117 PRO S Protein S 4 FT #SUB 101 99 SER R 117 115 TYR S Protein S 1 FT #SUB 104 102 GLN R 104 102 GLN S Protein S 3 FT #SUB 105 103 ARG R 105 103 ARG S Protein S 2 FT #SUB 105 103 ARG R 106 104 GLU S Protein S 1 FT #SUB 105 103 ARG R 109 107 GLU S Protein S 1 FT #SUB 121 119 TYR R 63 61 GLN S Protein B 1 FT #SUB 121 119 TYR R 121 119 TYR S Protein A 6 FT #SUB 122 120 LEU R 63 61 GLN S Protein S 1 FT #SUB 122 120 LEU R 153 151 TYR S Protein B 1 FT #SUB 123 121 GLY R 61 59 TYR S Protein B 2 FT #SUB 123 121 GLY R 121 119 TYR S Protein B 5 FT #SUB 123 121 GLY R 153 151 TYR S Protein B 4 FT #SUB 124 122 GLY R 61 59 TYR S Protein B 4 FT #SUB 125 123 VAL R 16 14 ALA S Protein S 1 FT #SUB 125 123 VAL R 17 15 HIS S Protein A 4 FT #SUB 125 123 VAL R 61 59 TYR S Protein A 5 FT #SUB 126 124 PHE R 17 15 HIS S Protein S 4 FT #SUB 126 124 PHE R 36 34 ASN S Protein S 2 FT #SUB 11 9 SER R 36 34 ASN T Protein B 3 FT #SUB 11 9 SER R 148 146 GLU T Protein S 3 FT #SUB 11 9 SER R 149 147 SER T Protein A 9 FT #SUB 149 147 SER R 12 10 ASP T Protein A 4 FT #SUB 89 87 TYR R 75 73 HIS d Protein S 4 FT #SUB 89 87 TYR R 113 111 ALA e Protein S 2 FT #SUB 89 87 TYR R 114 112 LYS e Protein S 5 FT #SUB 89 87 TYR R 115 113 PRO e Protein S 4 FT #SUB 90 88 GLN R 67 65 LYS e Protein B 1 FT #SUB 91 89 THR R 69 67 GLN e Protein A 5 FT #SUB 92 90 LYS R 69 67 GLN e Protein B 5 FT #HET 59 57 LEU R 18 201 JNI R S 2 FT #HET 61 59 TYR R 18 201 JNI R S 1 FT #HET 62 60 SER R 18 201 JNI R B 3 FT #HET 63 61 GLN R 18 201 JNI R S 2 FT #HET 121 119 TYR R 18 201 JNI R S 15 FT #HET 123 121 GLY R 18 201 JNI R B 3 FT #HET 124 122 GLY R 18 201 JNI R B 1 FT #HET 153 151 TYR R 18 201 JNI R S 8 FT DISORDER 1 10 FT DISORDER 32 37 FT DISORDER 108 112 CC SEQUENCE 138 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TAKPWYEPIY LGGVFQLEKG DRLSAEINRP CC DYLDFAESGQ VYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET-----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8S STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 22 20 PRO S 33 31 ARG K Protein B 6 FT #SUB 24 22 ALA S 33 31 ARG K Protein B 1 FT #SUB 25 23 GLU S 33 31 ARG K Protein B 4 FT #SUB 25 23 GLU S 34 32 ARG K Protein A 10 FT #SUB 25 23 GLU S 37 35 ALA K Protein S 1 FT #SUB 26 24 GLY S 33 31 ARG K Protein B 1 FT #SUB 72 70 PRO S 25 23 GLU K Protein A 4 FT #SUB 140 138 ARG S 23 21 GLN K Protein S 1 FT #SUB 142 140 ASP S 23 21 GLN K Protein S 1 FT #SUB 143 141 TYR S 23 21 GLN K Protein S 2 FT #SUB 146 144 PHE S 33 31 ARG K Protein S 5 FT #SUB 15 13 VAL S 57 55 LEU R Protein S 1 FT #SUB 16 14 ALA S 125 123 VAL R Protein B 1 FT #SUB 17 15 HIS S 125 123 VAL R Protein S 4 FT #SUB 17 15 HIS S 126 124 PHE R Protein S 4 FT #SUB 36 34 ASN S 84 82 ARG R Protein S 2 FT #SUB 36 34 ASN S 95 93 LEU R Protein S 3 FT #SUB 36 34 ASN S 126 124 PHE R Protein B 2 FT #SUB 38 36 LEU S 57 55 LEU R Protein S 1 FT #SUB 61 59 TYR S 123 121 GLY R Protein S 2 FT #SUB 61 59 TYR S 124 122 GLY R Protein S 4 FT #SUB 61 59 TYR S 125 123 VAL R Protein S 5 FT #SUB 63 61 GLN S 97 95 SER R Protein S 3 FT #SUB 63 61 GLN S 121 119 TYR R Protein S 1 FT #SUB 63 61 GLN S 122 120 LEU R Protein S 1 FT #SUB 65 63 LEU S 99 97 ILE R Protein S 4 FT #SUB 104 102 GLN S 104 102 GLN R Protein S 3 FT #SUB 105 103 ARG S 105 103 ARG R Protein S 2 FT #SUB 106 104 GLU S 105 103 ARG R Protein B 1 FT #SUB 109 107 GLU S 105 103 ARG R Protein S 1 FT #SUB 114 112 LYS S 73 71 SER R Protein S 3 FT #SUB 114 112 LYS S 75 73 HIS R Protein S 2 FT #SUB 115 113 PRO S 75 73 HIS R Protein B 4 FT #SUB 117 115 TYR S 77 75 LEU R Protein S 1 FT #SUB 117 115 TYR S 99 97 ILE R Protein S 10 FT #SUB 117 115 TYR S 101 99 SER R Protein B 1 FT #SUB 119 117 PRO S 99 97 ILE R Protein S 2 FT #SUB 119 117 PRO S 100 98 LYS R Protein S 4 FT #SUB 121 119 TYR S 121 119 TYR R Protein S 6 FT #SUB 121 119 TYR S 123 121 GLY R Protein S 5 FT #SUB 145 143 ASP S 99 97 ILE R Protein S 1 FT #SUB 148 146 GLU S 94 92 ASN R Protein S 2 FT #SUB 149 147 SER S 94 92 ASN R Protein B 3 FT #SUB 150 148 GLY S 95 93 LEU R Protein B 1 FT #SUB 150 148 GLY S 96 94 LEU R Protein B 2 FT #SUB 150 148 GLY S 97 95 SER R Protein B 6 FT #SUB 151 149 GLN S 97 95 SER R Protein B 1 FT #SUB 151 149 GLN S 99 97 ILE R Protein S 1 FT #SUB 153 151 TYR S 96 94 LEU R Protein S 5 FT #SUB 153 151 TYR S 122 120 LEU R Protein S 1 FT #SUB 153 151 TYR S 123 121 GLY R Protein S 4 FT #SUB 157 155 ILE S 59 57 LEU R Protein S 1 FT #SUB 57 55 LEU S 123 121 GLY U Protein S 2 FT #SUB 96 94 LEU S 127 125 GLN U Protein A 5 FT #SUB 97 95 SER S 127 125 GLN U Protein A 12 FT #SUB 123 121 GLY S 57 55 LEU U Protein B 2 FT #SUB 124 122 GLY S 125 123 VAL U Protein B 4 FT #SUB 125 123 VAL S 124 122 GLY U Protein A 4 FT #SUB 125 123 VAL S 125 123 VAL U Protein A 9 FT #SUB 125 123 VAL S 126 124 PHE U Protein B 2 FT #SUB 126 124 PHE S 125 123 VAL U Protein S 2 FT #SUB 126 124 PHE S 126 124 PHE U Protein S 4 FT #SUB 127 125 GLN S 96 94 LEU U Protein S 5 FT #SUB 127 125 GLN S 97 95 SER U Protein S 12 FT #SUB 75 73 HIS S 41 39 ASN u Protein S 4 FT #SUB 75 73 HIS S 42 40 GLY u Protein S 11 FT #SUB 81 79 THR S 90 88 GLN u Protein S 1 FT #SUB 91 89 THR S 91 89 THR u Protein S 1 FT #SUB 92 90 LYS S 90 88 GLN u Protein A 2 FT #SUB 92 90 LYS S 91 89 THR u Protein B 1 FT #SUB 94 92 ASN S 88 86 SER u Protein S 3 FT #SUB 94 92 ASN S 90 88 GLN u Protein S 3 FT #SUB 97 95 SER S 88 86 SER u Protein S 1 FT #SUB 99 97 ILE S 87 85 VAL u Protein S 2 FT #SUB 99 97 ILE S 130 128 LYS u Protein S 1 FT #SUB 101 99 SER S 130 128 LYS u Protein S 2 FT #SUB 139 137 ASN S 46 44 ARG u Protein B 1 FT #SUB 140 138 ARG S 46 44 ARG u Protein S 13 FT #HET 121 119 TYR S 18 201 JNI R S 4 FT #HET 123 121 GLY S 18 201 JNI R B 3 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8T STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 12 10 ASP T 149 147 SER R Protein S 4 FT #SUB 36 34 ASN T 11 9 SER R Protein S 3 FT #SUB 148 146 GLU T 11 9 SER R Protein S 3 FT #SUB 149 147 SER T 11 9 SER R Protein A 9 FT #SUB 57 55 LEU T 15 13 VAL U Protein S 1 FT #SUB 59 57 LEU T 157 155 ILE U Protein S 2 FT #SUB 75 73 HIS T 114 112 LYS U Protein S 3 FT #SUB 75 73 HIS T 115 113 PRO U Protein S 4 FT #SUB 77 75 LEU T 117 115 TYR U Protein S 2 FT #SUB 84 82 ARG T 36 34 ASN U Protein S 5 FT #SUB 94 92 ASN T 148 146 GLU U Protein S 1 FT #SUB 94 92 ASN T 149 147 SER U Protein S 4 FT #SUB 95 93 LEU T 36 34 ASN U Protein S 3 FT #SUB 95 93 LEU T 150 148 GLY U Protein B 2 FT #SUB 96 94 LEU T 17 15 HIS U Protein S 1 FT #SUB 96 94 LEU T 150 148 GLY U Protein B 2 FT #SUB 96 94 LEU T 153 151 TYR U Protein S 4 FT #SUB 97 95 SER T 63 61 GLN U Protein B 1 FT #SUB 97 95 SER T 150 148 GLY U Protein A 7 FT #SUB 97 95 SER T 151 149 GLN U Protein B 2 FT #SUB 98 96 ALA T 63 61 GLN U Protein S 1 FT #SUB 99 97 ILE T 65 63 LEU U Protein B 1 FT #SUB 99 97 ILE T 117 115 TYR U Protein A 9 FT #SUB 99 97 ILE T 119 117 PRO U Protein B 2 FT #SUB 100 98 LYS T 117 115 TYR U Protein B 3 FT #SUB 100 98 LYS T 119 117 PRO U Protein S 2 FT #SUB 101 99 SER T 115 113 PRO U Protein S 1 FT #SUB 101 99 SER T 116 114 TRP U Protein S 3 FT #SUB 101 99 SER T 117 115 TYR U Protein A 8 FT #SUB 104 102 GLN T 102 100 PRO U Protein S 3 FT #SUB 104 102 GLN T 104 102 GLN U Protein S 6 FT #SUB 105 103 ARG T 105 103 ARG U Protein S 7 FT #SUB 120 118 ILE T 121 119 TYR U Protein A 3 FT #SUB 121 119 TYR T 121 119 TYR U Protein A 15 FT #SUB 122 120 LEU T 63 61 GLN U Protein S 1 FT #SUB 122 120 LEU T 153 151 TYR U Protein A 2 FT #SUB 123 121 GLY T 61 59 TYR U Protein B 2 FT #SUB 123 121 GLY T 153 151 TYR U Protein B 4 FT #SUB 124 122 GLY T 61 59 TYR U Protein B 4 FT #SUB 125 123 VAL T 16 14 ALA U Protein S 1 FT #SUB 125 123 VAL T 17 15 HIS U Protein B 3 FT #SUB 125 123 VAL T 61 59 TYR U Protein A 3 FT #SUB 125 123 VAL T 157 155 ILE U Protein S 1 FT #SUB 126 124 PHE T 17 15 HIS U Protein S 8 FT #SUB 126 124 PHE T 36 34 ASN U Protein S 1 FT #SUB 127 125 GLN T 38 36 LEU U Protein B 1 FT #HET 59 57 LEU T 19 201 JNI U S 2 FT #HET 123 121 GLY T 19 201 JNI U B 2 FT #HET 153 151 TYR T 19 201 JNI U S 7 FT DISORDER 1 9 FT DISORDER 109 112 CC SEQUENCE 146 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPA KPWYEPIYLG GVFQLEKGDR CC LSAEINRPDY LDFAESGQVY FGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8U STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU U 123 121 GLY S Protein S 2 FT #SUB 96 94 LEU U 127 125 GLN S Protein A 5 FT #SUB 97 95 SER U 127 125 GLN S Protein A 12 FT #SUB 123 121 GLY U 57 55 LEU S Protein B 2 FT #SUB 124 122 GLY U 125 123 VAL S Protein B 4 FT #SUB 125 123 VAL U 124 122 GLY S Protein A 4 FT #SUB 125 123 VAL U 125 123 VAL S Protein A 9 FT #SUB 125 123 VAL U 126 124 PHE S Protein B 2 FT #SUB 126 124 PHE U 125 123 VAL S Protein S 2 FT #SUB 126 124 PHE U 126 124 PHE S Protein S 4 FT #SUB 127 125 GLN U 96 94 LEU S Protein S 5 FT #SUB 127 125 GLN U 97 95 SER S Protein S 12 FT #SUB 15 13 VAL U 57 55 LEU T Protein S 1 FT #SUB 16 14 ALA U 125 123 VAL T Protein B 1 FT #SUB 17 15 HIS U 96 94 LEU T Protein S 1 FT #SUB 17 15 HIS U 125 123 VAL T Protein S 3 FT #SUB 17 15 HIS U 126 124 PHE T Protein S 8 FT #SUB 36 34 ASN U 84 82 ARG T Protein S 5 FT #SUB 36 34 ASN U 95 93 LEU T Protein S 3 FT #SUB 36 34 ASN U 126 124 PHE T Protein B 1 FT #SUB 38 36 LEU U 127 125 GLN T Protein S 1 FT #SUB 61 59 TYR U 123 121 GLY T Protein S 2 FT #SUB 61 59 TYR U 124 122 GLY T Protein S 4 FT #SUB 61 59 TYR U 125 123 VAL T Protein S 3 FT #SUB 63 61 GLN U 97 95 SER T Protein S 1 FT #SUB 63 61 GLN U 98 96 ALA T Protein S 1 FT #SUB 63 61 GLN U 122 120 LEU T Protein S 1 FT #SUB 65 63 LEU U 99 97 ILE T Protein S 1 FT #SUB 102 100 PRO U 104 102 GLN T Protein B 3 FT #SUB 104 102 GLN U 104 102 GLN T Protein A 6 FT #SUB 105 103 ARG U 105 103 ARG T Protein S 7 FT #SUB 114 112 LYS U 75 73 HIS T Protein S 3 FT #SUB 115 113 PRO U 75 73 HIS T Protein B 4 FT #SUB 115 113 PRO U 101 99 SER T Protein B 1 FT #SUB 116 114 TRP U 101 99 SER T Protein B 3 FT #SUB 117 115 TYR U 77 75 LEU T Protein S 2 FT #SUB 117 115 TYR U 99 97 ILE T Protein A 9 FT #SUB 117 115 TYR U 100 98 LYS T Protein A 3 FT #SUB 117 115 TYR U 101 99 SER T Protein A 8 FT #SUB 119 117 PRO U 99 97 ILE T Protein S 2 FT #SUB 119 117 PRO U 100 98 LYS T Protein S 2 FT #SUB 121 119 TYR U 120 118 ILE T Protein S 3 FT #SUB 121 119 TYR U 121 119 TYR T Protein S 15 FT #SUB 148 146 GLU U 94 92 ASN T Protein S 1 FT #SUB 149 147 SER U 94 92 ASN T Protein B 4 FT #SUB 150 148 GLY U 95 93 LEU T Protein B 2 FT #SUB 150 148 GLY U 96 94 LEU T Protein B 2 FT #SUB 150 148 GLY U 97 95 SER T Protein B 7 FT #SUB 151 149 GLN U 97 95 SER T Protein A 2 FT #SUB 153 151 TYR U 96 94 LEU T Protein S 4 FT #SUB 153 151 TYR U 122 120 LEU T Protein S 2 FT #SUB 153 151 TYR U 123 121 GLY T Protein S 4 FT #SUB 157 155 ILE U 59 57 LEU T Protein S 2 FT #SUB 157 155 ILE U 125 123 VAL T Protein S 1 FT #SUB 88 86 SER U 129 127 GLU u Protein S 1 FT #SUB 89 87 TYR U 89 87 TYR u Protein S 19 FT #SUB 41 39 ASN U 75 73 HIS w Protein B 3 FT #SUB 42 40 GLY U 75 73 HIS w Protein B 10 FT #SUB 46 44 ARG U 139 137 ASN w Protein S 1 FT #SUB 46 44 ARG U 140 138 ARG w Protein S 13 FT #SUB 52 50 VAL U 77 75 LEU w Protein B 1 FT #SUB 87 85 VAL U 81 79 THR w Protein B 1 FT #SUB 87 85 VAL U 97 95 SER w Protein B 1 FT #SUB 87 85 VAL U 99 97 ILE w Protein S 6 FT #SUB 88 86 SER U 94 92 ASN w Protein B 4 FT #SUB 88 86 SER U 97 95 SER w Protein B 1 FT #SUB 89 87 TYR U 94 92 ASN w Protein B 3 FT #SUB 90 88 GLN U 81 79 THR w Protein S 5 FT #SUB 90 88 GLN U 83 81 SER w Protein S 2 FT #SUB 90 88 GLN U 92 90 LYS w Protein A 5 FT #SUB 90 88 GLN U 94 92 ASN w Protein S 4 FT #SUB 91 89 THR U 91 89 THR w Protein S 1 FT #SUB 91 89 THR U 92 90 LYS w Protein S 6 FT #SUB 130 128 LYS U 99 97 ILE w Protein S 1 FT #SUB 130 128 LYS U 101 99 SER w Protein S 3 FT #SUB 131 129 GLY U 77 75 LEU w Protein B 1 FT #HET 13 11 LYS U 19 201 JNI U S 7 FT #HET 59 57 LEU U 19 201 JNI U S 3 FT #HET 61 59 TYR U 19 201 JNI U S 6 FT #HET 158 156 ALA U 19 201 JNI U B 1 FT #HET 159 157 LEU U 19 201 JNI U B 2 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8V STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU V 15 13 VAL W Protein S 2 FT #SUB 59 57 LEU V 157 155 ILE W Protein S 2 FT #SUB 73 71 SER V 114 112 LYS W Protein B 1 FT #SUB 75 73 HIS V 114 112 LYS W Protein S 3 FT #SUB 75 73 HIS V 115 113 PRO W Protein S 6 FT #SUB 84 82 ARG V 36 34 ASN W Protein S 5 FT #SUB 94 92 ASN V 148 146 GLU W Protein S 3 FT #SUB 94 92 ASN V 149 147 SER W Protein S 3 FT #SUB 95 93 LEU V 36 34 ASN W Protein S 4 FT #SUB 95 93 LEU V 150 148 GLY W Protein B 3 FT #SUB 96 94 LEU V 150 148 GLY W Protein B 2 FT #SUB 96 94 LEU V 153 151 TYR W Protein S 5 FT #SUB 97 95 SER V 63 61 GLN W Protein B 2 FT #SUB 97 95 SER V 150 148 GLY W Protein B 6 FT #SUB 97 95 SER V 151 149 GLN W Protein B 1 FT #SUB 98 96 ALA V 63 61 GLN W Protein A 2 FT #SUB 99 97 ILE V 65 63 LEU W Protein B 2 FT #SUB 99 97 ILE V 117 115 TYR W Protein S 5 FT #SUB 99 97 ILE V 119 117 PRO W Protein B 4 FT #SUB 99 97 ILE V 151 149 GLN W Protein S 1 FT #SUB 100 98 LYS V 119 117 PRO W Protein S 2 FT #SUB 101 99 SER V 115 113 PRO W Protein S 1 FT #SUB 101 99 SER V 116 114 TRP W Protein S 2 FT #SUB 101 99 SER V 117 115 TYR W Protein S 6 FT #SUB 104 102 GLN V 104 102 GLN W Protein S 2 FT #SUB 105 103 ARG V 105 103 ARG W Protein S 2 FT #SUB 121 119 TYR V 121 119 TYR W Protein S 5 FT #SUB 122 120 LEU V 63 61 GLN W Protein S 1 FT #SUB 122 120 LEU V 153 151 TYR W Protein B 1 FT #SUB 123 121 GLY V 61 59 TYR W Protein B 2 FT #SUB 123 121 GLY V 121 119 TYR W Protein B 4 FT #SUB 123 121 GLY V 153 151 TYR W Protein B 4 FT #SUB 124 122 GLY V 17 15 HIS W Protein B 1 FT #SUB 124 122 GLY V 61 59 TYR W Protein B 4 FT #SUB 125 123 VAL V 16 14 ALA W Protein S 2 FT #SUB 125 123 VAL V 17 15 HIS W Protein A 6 FT #SUB 125 123 VAL V 38 36 LEU W Protein B 1 FT #SUB 125 123 VAL V 61 59 TYR W Protein A 3 FT #SUB 125 123 VAL V 157 155 ILE W Protein S 1 FT #SUB 126 124 PHE V 17 15 HIS W Protein S 6 FT #SUB 126 124 PHE V 36 34 ASN W Protein S 1 FT #SUB 159 157 LEU V 157 155 ILE W Protein S 1 FT #SUB 11 9 SER V 36 34 ASN X Protein B 1 FT #SUB 11 9 SER V 149 147 SER X Protein A 4 FT #SUB 149 147 SER V 12 10 ASP X Protein A 7 FT #HET 17 15 HIS V 21 202 JNI V S 3 FT #HET 59 57 LEU V 20 201 JNI V S 2 FT #HET 62 60 SER V 20 201 JNI V B 3 FT #HET 63 61 GLN V 20 201 JNI V S 2 FT #HET 121 119 TYR V 20 201 JNI V S 21 FT #HET 122 120 LEU V 20 201 JNI V B 4 FT #HET 123 121 GLY V 20 201 JNI V B 1 FT #HET 153 151 TYR V 20 201 JNI V S 5 FT DISORDER 1 10 FT DISORDER 32 37 FT DISORDER 109 113 CC SEQUENCE 138 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPKPWYEPIY LGGVFQLEKG DRLSAEINRP CC DYLDFAESGQ VYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP-----KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8W STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 41 39 ASN W 75 73 HIS B Protein B 3 FT #SUB 42 40 GLY W 75 73 HIS B Protein B 9 FT #SUB 44 42 GLU W 75 73 HIS B Protein S 1 FT #SUB 46 44 ARG W 139 137 ASN B Protein S 2 FT #SUB 46 44 ARG W 140 138 ARG B Protein S 12 FT #SUB 46 44 ARG W 142 140 ASP B Protein S 1 FT #SUB 87 85 VAL W 94 92 ASN B Protein B 1 FT #SUB 87 85 VAL W 97 95 SER B Protein S 1 FT #SUB 87 85 VAL W 99 97 ILE B Protein S 1 FT #SUB 88 86 SER W 94 92 ASN B Protein B 7 FT #SUB 88 86 SER W 97 95 SER B Protein A 2 FT #SUB 89 87 TYR W 94 92 ASN B Protein B 4 FT #SUB 90 88 GLN W 92 90 LYS B Protein S 5 FT #SUB 90 88 GLN W 94 92 ASN B Protein S 1 FT #SUB 91 89 THR W 92 90 LYS B Protein S 1 FT #SUB 130 128 LYS W 77 75 LEU B Protein S 1 FT #SUB 130 128 LYS W 101 99 SER B Protein S 3 FT #SUB 89 87 TYR W 89 87 TYR D Protein S 22 FT #SUB 15 13 VAL W 57 55 LEU V Protein S 2 FT #SUB 16 14 ALA W 125 123 VAL V Protein B 2 FT #SUB 17 15 HIS W 124 122 GLY V Protein S 1 FT #SUB 17 15 HIS W 125 123 VAL V Protein A 6 FT #SUB 17 15 HIS W 126 124 PHE V Protein S 6 FT #SUB 36 34 ASN W 84 82 ARG V Protein S 5 FT #SUB 36 34 ASN W 95 93 LEU V Protein S 4 FT #SUB 36 34 ASN W 126 124 PHE V Protein B 1 FT #SUB 38 36 LEU W 125 123 VAL V Protein S 1 FT #SUB 61 59 TYR W 123 121 GLY V Protein S 2 FT #SUB 61 59 TYR W 124 122 GLY V Protein S 4 FT #SUB 61 59 TYR W 125 123 VAL V Protein S 3 FT #SUB 63 61 GLN W 97 95 SER V Protein S 2 FT #SUB 63 61 GLN W 98 96 ALA V Protein S 2 FT #SUB 63 61 GLN W 122 120 LEU V Protein S 1 FT #SUB 65 63 LEU W 99 97 ILE V Protein S 2 FT #SUB 104 102 GLN W 104 102 GLN V Protein A 2 FT #SUB 105 103 ARG W 105 103 ARG V Protein S 2 FT #SUB 114 112 LYS W 73 71 SER V Protein S 1 FT #SUB 114 112 LYS W 75 73 HIS V Protein S 3 FT #SUB 115 113 PRO W 75 73 HIS V Protein A 6 FT #SUB 115 113 PRO W 101 99 SER V Protein B 1 FT #SUB 116 114 TRP W 101 99 SER V Protein B 2 FT #SUB 117 115 TYR W 99 97 ILE V Protein S 5 FT #SUB 117 115 TYR W 101 99 SER V Protein A 6 FT #SUB 119 117 PRO W 99 97 ILE V Protein A 4 FT #SUB 119 117 PRO W 100 98 LYS V Protein S 2 FT #SUB 121 119 TYR W 121 119 TYR V Protein S 5 FT #SUB 121 119 TYR W 123 121 GLY V Protein S 4 FT #SUB 148 146 GLU W 94 92 ASN V Protein S 3 FT #SUB 149 147 SER W 94 92 ASN V Protein B 3 FT #SUB 150 148 GLY W 95 93 LEU V Protein B 3 FT #SUB 150 148 GLY W 96 94 LEU V Protein B 2 FT #SUB 150 148 GLY W 97 95 SER V Protein B 6 FT #SUB 151 149 GLN W 97 95 SER V Protein B 1 FT #SUB 151 149 GLN W 99 97 ILE V Protein S 1 FT #SUB 153 151 TYR W 96 94 LEU V Protein S 5 FT #SUB 153 151 TYR W 122 120 LEU V Protein S 1 FT #SUB 153 151 TYR W 123 121 GLY V Protein S 4 FT #SUB 157 155 ILE W 59 57 LEU V Protein S 2 FT #SUB 157 155 ILE W 125 123 VAL V Protein S 1 FT #SUB 157 155 ILE W 159 157 LEU V Protein S 1 FT #SUB 57 55 LEU W 123 121 GLY Y Protein S 2 FT #SUB 96 94 LEU W 127 125 GLN Y Protein S 2 FT #SUB 97 95 SER W 127 125 GLN Y Protein A 10 FT #SUB 123 121 GLY W 57 55 LEU Y Protein B 2 FT #SUB 124 122 GLY W 125 123 VAL Y Protein B 4 FT #SUB 125 123 VAL W 124 122 GLY Y Protein A 4 FT #SUB 125 123 VAL W 125 123 VAL Y Protein A 12 FT #SUB 125 123 VAL W 126 124 PHE Y Protein B 1 FT #SUB 126 124 PHE W 125 123 VAL Y Protein S 2 FT #SUB 126 124 PHE W 126 124 PHE Y Protein S 3 FT #SUB 127 125 GLN W 96 94 LEU Y Protein S 1 FT #SUB 127 125 GLN W 97 95 SER Y Protein S 9 FT #SUB 22 20 PRO W 33 31 ARG a Protein B 3 FT #SUB 23 21 GLN W 32 30 ASN a Protein S 1 FT #SUB 23 21 GLN W 33 31 ARG a Protein A 7 FT #SUB 23 21 GLN W 34 32 ARG a Protein B 4 FT #SUB 24 22 ALA W 33 31 ARG a Protein B 3 FT #SUB 25 23 GLU W 23 21 GLN a Protein B 1 FT #SUB 25 23 GLU W 31 29 LEU a Protein S 1 FT #SUB 25 23 GLU W 33 31 ARG a Protein A 5 FT #SUB 25 23 GLU W 34 32 ARG a Protein A 5 FT #SUB 26 24 GLY W 34 32 ARG a Protein B 4 FT #SUB 27 25 GLN W 35 33 ALA a Protein S 2 FT #SUB 142 140 ASP W 23 21 GLN a Protein A 6 FT #SUB 75 73 HIS W 41 39 ASN i Protein S 1 FT #SUB 75 73 HIS W 42 40 GLY i Protein S 10 FT #SUB 75 73 HIS W 44 42 GLU i Protein S 1 FT #SUB 77 75 LEU W 52 50 VAL i Protein S 1 FT #SUB 77 75 LEU W 131 129 GLY i Protein S 2 FT #SUB 81 79 THR W 90 88 GLN i Protein S 3 FT #SUB 83 81 SER W 90 88 GLN i Protein S 1 FT #SUB 92 90 LYS W 89 87 TYR i Protein B 1 FT #SUB 92 90 LYS W 90 88 GLN i Protein A 4 FT #SUB 92 90 LYS W 91 89 THR i Protein B 2 FT #SUB 94 92 ASN W 88 86 SER i Protein S 3 FT #SUB 94 92 ASN W 89 87 TYR i Protein A 2 FT #SUB 94 92 ASN W 90 88 GLN i Protein S 1 FT #SUB 99 97 ILE W 87 85 VAL i Protein S 2 FT #SUB 101 99 SER W 130 128 LYS i Protein S 3 FT #SUB 139 137 ASN W 46 44 ARG i Protein B 1 FT #SUB 140 138 ARG W 44 42 GLU i Protein S 1 FT #SUB 140 138 ARG W 46 44 ARG i Protein S 14 FT #HET 57 55 LEU W 23 202 JNI X S 4 FT #HET 61 59 TYR W 20 201 JNI V S 3 FT #HET 121 119 TYR W 20 201 JNI V S 12 FT #HET 123 121 GLY W 20 201 JNI V B 5 FT #HET 159 157 LEU W 23 202 JNI X A 2 FT DISORDER 1 10 FT DISORDER 108 113 CC SEQUENCE 143 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETKPW YEPIYLGGVF QLEKGDRLSA CC EINRPDYLDF AESGQVYFGI IAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET------KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8X STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 12 10 ASP X 149 147 SER V Protein S 7 FT #SUB 36 34 ASN X 11 9 SER V Protein S 1 FT #SUB 149 147 SER X 11 9 SER V Protein A 4 FT #SUB 57 55 LEU X 15 13 VAL Y Protein S 1 FT #SUB 57 55 LEU X 38 36 LEU Y Protein S 1 FT #SUB 59 57 LEU X 157 155 ILE Y Protein S 1 FT #SUB 75 73 HIS X 114 112 LYS Y Protein S 6 FT #SUB 75 73 HIS X 115 113 PRO Y Protein S 4 FT #SUB 77 75 LEU X 117 115 TYR Y Protein S 1 FT #SUB 84 82 ARG X 36 34 ASN Y Protein S 3 FT #SUB 94 92 ASN X 148 146 GLU Y Protein S 5 FT #SUB 94 92 ASN X 149 147 SER Y Protein S 4 FT #SUB 95 93 LEU X 36 34 ASN Y Protein S 4 FT #SUB 95 93 LEU X 150 148 GLY Y Protein B 3 FT #SUB 96 94 LEU X 150 148 GLY Y Protein B 2 FT #SUB 96 94 LEU X 153 151 TYR Y Protein S 4 FT #SUB 97 95 SER X 63 61 GLN Y Protein B 2 FT #SUB 97 95 SER X 150 148 GLY Y Protein B 6 FT #SUB 97 95 SER X 151 149 GLN Y Protein B 4 FT #SUB 98 96 ALA X 63 61 GLN Y Protein A 2 FT #SUB 98 96 ALA X 121 119 TYR Y Protein S 1 FT #SUB 99 97 ILE X 65 63 LEU Y Protein B 2 FT #SUB 99 97 ILE X 117 115 TYR Y Protein A 3 FT #SUB 99 97 ILE X 119 117 PRO Y Protein B 3 FT #SUB 100 98 LYS X 119 117 PRO Y Protein S 2 FT #SUB 101 99 SER X 115 113 PRO Y Protein S 1 FT #SUB 101 99 SER X 116 114 TRP Y Protein S 2 FT #SUB 101 99 SER X 117 115 TYR Y Protein S 3 FT #SUB 104 102 GLN X 104 102 GLN Y Protein S 4 FT #SUB 104 102 GLN X 105 103 ARG Y Protein S 8 FT #SUB 105 103 ARG X 105 103 ARG Y Protein S 2 FT #SUB 120 118 ILE X 121 119 TYR Y Protein S 1 FT #SUB 121 119 TYR X 121 119 TYR Y Protein B 7 FT #SUB 122 120 LEU X 63 61 GLN Y Protein S 1 FT #SUB 122 120 LEU X 153 151 TYR Y Protein S 1 FT #SUB 123 121 GLY X 153 151 TYR Y Protein B 4 FT #SUB 124 122 GLY X 61 59 TYR Y Protein B 4 FT #SUB 125 123 VAL X 16 14 ALA Y Protein S 1 FT #SUB 125 123 VAL X 17 15 HIS Y Protein A 5 FT #SUB 125 123 VAL X 38 36 LEU Y Protein B 1 FT #SUB 125 123 VAL X 61 59 TYR Y Protein A 5 FT #SUB 125 123 VAL X 157 155 ILE Y Protein S 1 FT #SUB 126 124 PHE X 17 15 HIS Y Protein S 5 FT #SUB 126 124 PHE X 36 34 ASN Y Protein S 4 FT #SUB 126 124 PHE X 38 36 LEU Y Protein B 1 FT #HET 59 57 LEU X 22 201 JNI X S 4 FT #HET 121 119 TYR X 23 202 JNI X S 11 FT #HET 122 120 LEU X 22 201 JNI X B 1 FT #HET 123 121 GLY X 22 201 JNI X B 5 FT #HET 153 151 TYR X 22 201 JNI X S 4 FT #HET 157 155 ILE X 22 201 JNI X S 1 FT DISORDER 1 9 CC SEQUENCE 150 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPE GAEAKPWYEP IYLGGVFQLE CC KGDRLSAEIN RPDYLDFAES GQVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8Y STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 75 73 HIS Y 12 10 ASP D Protein S 1 FT #SUB 75 73 HIS Y 41 39 ASN D Protein S 7 FT #SUB 75 73 HIS Y 42 40 GLY D Protein S 10 FT #SUB 75 73 HIS Y 44 42 GLU D Protein B 1 FT #SUB 77 75 LEU Y 52 50 VAL D Protein S 1 FT #SUB 77 75 LEU Y 131 129 GLY D Protein S 1 FT #SUB 81 79 THR Y 90 88 GLN D Protein S 2 FT #SUB 83 81 SER Y 90 88 GLN D Protein S 1 FT #SUB 91 89 THR Y 91 89 THR D Protein S 1 FT #SUB 92 90 LYS Y 90 88 GLN D Protein S 2 FT #SUB 92 90 LYS Y 91 89 THR D Protein B 1 FT #SUB 94 92 ASN Y 88 86 SER D Protein S 3 FT #SUB 94 92 ASN Y 90 88 GLN D Protein S 1 FT #SUB 97 95 SER Y 87 85 VAL D Protein S 1 FT #SUB 97 95 SER Y 88 86 SER D Protein S 1 FT #SUB 99 97 ILE Y 87 85 VAL D Protein S 4 FT #SUB 139 137 ASN Y 46 44 ARG D Protein B 2 FT #SUB 140 138 ARG Y 44 42 GLU D Protein S 1 FT #SUB 140 138 ARG Y 46 44 ARG D Protein S 16 FT #SUB 57 55 LEU Y 123 121 GLY W Protein S 2 FT #SUB 96 94 LEU Y 127 125 GLN W Protein S 1 FT #SUB 97 95 SER Y 127 125 GLN W Protein A 9 FT #SUB 123 121 GLY Y 57 55 LEU W Protein B 2 FT #SUB 124 122 GLY Y 125 123 VAL W Protein B 4 FT #SUB 125 123 VAL Y 124 122 GLY W Protein A 4 FT #SUB 125 123 VAL Y 125 123 VAL W Protein A 12 FT #SUB 125 123 VAL Y 126 124 PHE W Protein B 2 FT #SUB 126 124 PHE Y 125 123 VAL W Protein S 1 FT #SUB 126 124 PHE Y 126 124 PHE W Protein S 3 FT #SUB 127 125 GLN Y 96 94 LEU W Protein S 2 FT #SUB 127 125 GLN Y 97 95 SER W Protein S 10 FT #SUB 15 13 VAL Y 57 55 LEU X Protein S 1 FT #SUB 16 14 ALA Y 125 123 VAL X Protein B 1 FT #SUB 17 15 HIS Y 125 123 VAL X Protein S 5 FT #SUB 17 15 HIS Y 126 124 PHE X Protein S 5 FT #SUB 36 34 ASN Y 84 82 ARG X Protein S 3 FT #SUB 36 34 ASN Y 95 93 LEU X Protein S 4 FT #SUB 36 34 ASN Y 126 124 PHE X Protein A 4 FT #SUB 38 36 LEU Y 57 55 LEU X Protein S 1 FT #SUB 38 36 LEU Y 125 123 VAL X Protein S 1 FT #SUB 38 36 LEU Y 126 124 PHE X Protein S 1 FT #SUB 61 59 TYR Y 124 122 GLY X Protein S 4 FT #SUB 61 59 TYR Y 125 123 VAL X Protein S 5 FT #SUB 63 61 GLN Y 97 95 SER X Protein S 2 FT #SUB 63 61 GLN Y 98 96 ALA X Protein S 2 FT #SUB 63 61 GLN Y 122 120 LEU X Protein S 1 FT #SUB 65 63 LEU Y 99 97 ILE X Protein S 2 FT #SUB 104 102 GLN Y 104 102 GLN X Protein S 4 FT #SUB 105 103 ARG Y 104 102 GLN X Protein S 8 FT #SUB 105 103 ARG Y 105 103 ARG X Protein S 2 FT #SUB 114 112 LYS Y 75 73 HIS X Protein S 6 FT #SUB 115 113 PRO Y 75 73 HIS X Protein B 4 FT #SUB 115 113 PRO Y 101 99 SER X Protein B 1 FT #SUB 116 114 TRP Y 101 99 SER X Protein B 2 FT #SUB 117 115 TYR Y 77 75 LEU X Protein S 1 FT #SUB 117 115 TYR Y 99 97 ILE X Protein S 3 FT #SUB 117 115 TYR Y 101 99 SER X Protein A 3 FT #SUB 119 117 PRO Y 99 97 ILE X Protein S 3 FT #SUB 119 117 PRO Y 100 98 LYS X Protein S 2 FT #SUB 121 119 TYR Y 98 96 ALA X Protein S 1 FT #SUB 121 119 TYR Y 120 118 ILE X Protein S 1 FT #SUB 121 119 TYR Y 121 119 TYR X Protein S 7 FT #SUB 148 146 GLU Y 94 92 ASN X Protein S 5 FT #SUB 149 147 SER Y 94 92 ASN X Protein B 4 FT #SUB 150 148 GLY Y 95 93 LEU X Protein B 3 FT #SUB 150 148 GLY Y 96 94 LEU X Protein B 2 FT #SUB 150 148 GLY Y 97 95 SER X Protein B 6 FT #SUB 151 149 GLN Y 97 95 SER X Protein A 4 FT #SUB 153 151 TYR Y 96 94 LEU X Protein S 4 FT #SUB 153 151 TYR Y 122 120 LEU X Protein S 1 FT #SUB 153 151 TYR Y 123 121 GLY X Protein S 4 FT #SUB 157 155 ILE Y 59 57 LEU X Protein S 1 FT #SUB 157 155 ILE Y 125 123 VAL X Protein S 1 FT #SUB 89 87 TYR Y 89 87 TYR i Protein S 14 FT #SUB 129 127 GLU Y 88 86 SER i Protein S 1 FT #SUB 41 39 ASN Y 75 73 HIS k Protein B 6 FT #SUB 42 40 GLY Y 75 73 HIS k Protein B 11 FT #SUB 46 44 ARG Y 139 137 ASN k Protein S 1 FT #SUB 46 44 ARG Y 140 138 ARG k Protein S 13 FT #SUB 46 44 ARG Y 142 140 ASP k Protein S 1 FT #SUB 87 85 VAL Y 99 97 ILE k Protein S 4 FT #SUB 88 86 SER Y 94 92 ASN k Protein B 5 FT #SUB 88 86 SER Y 97 95 SER k Protein A 2 FT #SUB 89 87 TYR Y 94 92 ASN k Protein B 3 FT #SUB 90 88 GLN Y 81 79 THR k Protein S 3 FT #SUB 90 88 GLN Y 83 81 SER k Protein S 2 FT #SUB 90 88 GLN Y 92 90 LYS k Protein A 7 FT #SUB 90 88 GLN Y 94 92 ASN k Protein S 1 FT #SUB 91 89 THR Y 91 89 THR k Protein S 2 FT #SUB 91 89 THR Y 92 90 LYS k Protein S 3 FT #SUB 130 128 LYS Y 101 99 SER k Protein S 2 FT #HET 13 11 LYS Y 22 201 JNI X S 6 FT #HET 59 57 LEU Y 22 201 JNI X S 6 FT #HET 61 59 TYR Y 22 201 JNI X S 6 FT #HET 121 119 TYR Y 23 202 JNI X A 11 FT #HET 123 121 GLY Y 23 202 JNI X B 3 FT #HET 158 156 ALA Y 22 201 JNI X B 1 FT #HET 159 157 LEU Y 22 201 JNI X B 4 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8Z STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 46 44 ARG Z 21 19 ASN B Protein S 1 FT #SUB 46 44 ARG Z 23 21 GLN B Protein S 1 FT #SUB 46 44 ARG Z 29 27 GLN B Protein S 1 FT #SUB 87 85 VAL Z 26 24 GLY B Protein S 2 FT #SUB 90 88 GLN Z 26 24 GLY B Protein S 2 FT #SUB 90 88 GLN Z 27 25 GLN B Protein S 4 FT #SUB 130 128 LYS Z 25 23 GLU B Protein S 8 FT #SUB 131 129 GLY Z 25 23 GLU B Protein B 2 FT #SUB 133 131 ARG Z 27 25 GLN B Protein S 1 FT #SUB 57 55 LEU Z 15 13 VAL a Protein S 1 FT #SUB 59 57 LEU Z 157 155 ILE a Protein S 1 FT #SUB 73 71 SER Z 114 112 LYS a Protein B 1 FT #SUB 75 73 HIS Z 114 112 LYS a Protein A 5 FT #SUB 75 73 HIS Z 115 113 PRO a Protein S 6 FT #SUB 77 75 LEU Z 117 115 TYR a Protein S 2 FT #SUB 84 82 ARG Z 36 34 ASN a Protein S 2 FT #SUB 93 91 VAL Z 36 34 ASN a Protein S 2 FT #SUB 94 92 ASN Z 149 147 SER a Protein S 2 FT #SUB 95 93 LEU Z 36 34 ASN a Protein S 4 FT #SUB 95 93 LEU Z 150 148 GLY a Protein B 1 FT #SUB 96 94 LEU Z 150 148 GLY a Protein B 2 FT #SUB 96 94 LEU Z 153 151 TYR a Protein S 4 FT #SUB 97 95 SER Z 63 61 GLN a Protein B 2 FT #SUB 97 95 SER Z 150 148 GLY a Protein B 6 FT #SUB 97 95 SER Z 151 149 GLN a Protein B 4 FT #SUB 98 96 ALA Z 63 61 GLN a Protein S 1 FT #SUB 99 97 ILE Z 65 63 LEU a Protein B 1 FT #SUB 99 97 ILE Z 117 115 TYR a Protein A 3 FT #SUB 99 97 ILE Z 119 117 PRO a Protein B 2 FT #SUB 100 98 LYS Z 119 117 PRO a Protein S 1 FT #SUB 101 99 SER Z 116 114 TRP a Protein S 2 FT #SUB 101 99 SER Z 117 115 TYR a Protein S 2 FT #SUB 104 102 GLN Z 104 102 GLN a Protein S 3 FT #SUB 105 103 ARG Z 105 103 ARG a Protein S 7 FT #SUB 105 103 ARG Z 106 104 GLU a Protein S 3 FT #SUB 121 119 TYR Z 121 119 TYR a Protein A 10 FT #SUB 122 120 LEU Z 63 61 GLN a Protein S 1 FT #SUB 123 121 GLY Z 61 59 TYR a Protein B 2 FT #SUB 123 121 GLY Z 121 119 TYR a Protein B 6 FT #SUB 123 121 GLY Z 153 151 TYR a Protein B 4 FT #SUB 124 122 GLY Z 17 15 HIS a Protein B 1 FT #SUB 124 122 GLY Z 61 59 TYR a Protein B 4 FT #SUB 125 123 VAL Z 16 14 ALA a Protein S 2 FT #SUB 125 123 VAL Z 17 15 HIS a Protein A 5 FT #SUB 125 123 VAL Z 61 59 TYR a Protein A 3 FT #SUB 125 123 VAL Z 157 155 ILE a Protein S 1 FT #SUB 126 124 PHE Z 36 34 ASN a Protein S 2 FT #SUB 127 125 GLN Z 38 36 LEU a Protein B 1 FT #SUB 159 157 LEU Z 157 155 ILE a Protein S 1 FT #SUB 11 9 SER Z 148 146 GLU b Protein B 2 FT #SUB 11 9 SER Z 149 147 SER b Protein A 5 FT #SUB 12 10 ASP Z 36 34 ASN b Protein S 2 FT #SUB 12 10 ASP Z 149 147 SER b Protein B 3 FT #SUB 151 149 GLN Z 11 9 SER b Protein S 1 FT #SUB 109 107 GLU Z 33 31 ARG f Protein B 5 FT #SUB 139 137 ASN Z 25 23 GLU i Protein B 1 FT #SUB 21 19 ASN Z 108 106 PRO n Protein S 1 FT #SUB 23 21 GLN Z 107 105 THR n Protein S 3 FT #SUB 23 21 GLN Z 113 111 ALA n Protein S 1 FT #SUB 31 29 LEU Z 109 107 GLU n Protein S 1 FT #HET 38 36 LEU Z 25 202 JNI Z S 1 FT #HET 59 57 LEU Z 24 201 JNI Z S 5 FT #HET 61 59 TYR Z 24 201 JNI Z S 2 FT #HET 62 60 SER Z 24 201 JNI Z B 3 FT #HET 63 61 GLN Z 24 201 JNI Z S 1 FT #HET 121 119 TYR Z 24 201 JNI Z S 32 FT #HET 122 120 LEU Z 24 201 JNI Z B 3 FT #HET 123 121 GLY Z 24 201 JNI Z B 5 FT #HET 124 122 GLY Z 24 201 JNI Z B 1 FT #HET 153 151 TYR Z 24 201 JNI Z S 6 FT DISORDER 1 10 FT DISORDER 32 37 CC SEQUENCE 143 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPEGAEAKPW YEPIYLGGVF QLEKGDRLSA CC EINRPDYLDF AESGQVYFGI IAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8a STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 23 21 GLN a 25 23 GLU W Protein S 1 FT #SUB 23 21 GLN a 142 140 ASP W Protein S 6 FT #SUB 31 29 LEU a 25 23 GLU W Protein S 1 FT #SUB 32 30 ASN a 23 21 GLN W Protein S 1 FT #SUB 33 31 ARG a 22 20 PRO W Protein S 3 FT #SUB 33 31 ARG a 23 21 GLN W Protein A 7 FT #SUB 33 31 ARG a 24 22 ALA W Protein B 3 FT #SUB 33 31 ARG a 25 23 GLU W Protein A 5 FT #SUB 34 32 ARG a 23 21 GLN W Protein B 4 FT #SUB 34 32 ARG a 25 23 GLU W Protein S 5 FT #SUB 34 32 ARG a 26 24 GLY W Protein S 4 FT #SUB 35 33 ALA a 27 25 GLN W Protein A 2 FT #SUB 15 13 VAL a 57 55 LEU Z Protein S 1 FT #SUB 16 14 ALA a 125 123 VAL Z Protein B 2 FT #SUB 17 15 HIS a 124 122 GLY Z Protein S 1 FT #SUB 17 15 HIS a 125 123 VAL Z Protein S 5 FT #SUB 36 34 ASN a 84 82 ARG Z Protein S 2 FT #SUB 36 34 ASN a 93 91 VAL Z Protein S 2 FT #SUB 36 34 ASN a 95 93 LEU Z Protein S 4 FT #SUB 36 34 ASN a 126 124 PHE Z Protein B 2 FT #SUB 38 36 LEU a 127 125 GLN Z Protein S 1 FT #SUB 61 59 TYR a 123 121 GLY Z Protein S 2 FT #SUB 61 59 TYR a 124 122 GLY Z Protein S 4 FT #SUB 61 59 TYR a 125 123 VAL Z Protein S 3 FT #SUB 63 61 GLN a 97 95 SER Z Protein S 2 FT #SUB 63 61 GLN a 98 96 ALA Z Protein S 1 FT #SUB 63 61 GLN a 122 120 LEU Z Protein S 1 FT #SUB 65 63 LEU a 99 97 ILE Z Protein S 1 FT #SUB 104 102 GLN a 104 102 GLN Z Protein S 3 FT #SUB 105 103 ARG a 105 103 ARG Z Protein A 7 FT #SUB 106 104 GLU a 105 103 ARG Z Protein B 3 FT #SUB 114 112 LYS a 73 71 SER Z Protein S 1 FT #SUB 114 112 LYS a 75 73 HIS Z Protein S 5 FT #SUB 115 113 PRO a 75 73 HIS Z Protein A 6 FT #SUB 116 114 TRP a 101 99 SER Z Protein B 2 FT #SUB 117 115 TYR a 77 75 LEU Z Protein S 2 FT #SUB 117 115 TYR a 99 97 ILE Z Protein S 3 FT #SUB 117 115 TYR a 101 99 SER Z Protein A 2 FT #SUB 119 117 PRO a 99 97 ILE Z Protein S 2 FT #SUB 119 117 PRO a 100 98 LYS Z Protein S 1 FT #SUB 121 119 TYR a 121 119 TYR Z Protein A 10 FT #SUB 121 119 TYR a 123 121 GLY Z Protein S 6 FT #SUB 149 147 SER a 94 92 ASN Z Protein B 2 FT #SUB 150 148 GLY a 95 93 LEU Z Protein B 1 FT #SUB 150 148 GLY a 96 94 LEU Z Protein B 2 FT #SUB 150 148 GLY a 97 95 SER Z Protein B 6 FT #SUB 151 149 GLN a 97 95 SER Z Protein A 4 FT #SUB 153 151 TYR a 96 94 LEU Z Protein S 4 FT #SUB 153 151 TYR a 123 121 GLY Z Protein S 4 FT #SUB 157 155 ILE a 59 57 LEU Z Protein S 1 FT #SUB 157 155 ILE a 125 123 VAL Z Protein S 1 FT #SUB 157 155 ILE a 159 157 LEU Z Protein S 1 FT #SUB 57 55 LEU a 123 121 GLY c Protein S 2 FT #SUB 95 93 LEU a 127 125 GLN c Protein B 1 FT #SUB 96 94 LEU a 127 125 GLN c Protein A 3 FT #SUB 97 95 SER a 127 125 GLN c Protein A 9 FT #SUB 123 121 GLY a 57 55 LEU c Protein B 2 FT #SUB 124 122 GLY a 125 123 VAL c Protein B 3 FT #SUB 125 123 VAL a 124 122 GLY c Protein B 2 FT #SUB 125 123 VAL a 125 123 VAL c Protein A 10 FT #SUB 125 123 VAL a 126 124 PHE c Protein B 2 FT #SUB 126 124 PHE a 125 123 VAL c Protein S 3 FT #SUB 126 124 PHE a 126 124 PHE c Protein S 3 FT #SUB 127 125 GLN a 96 94 LEU c Protein S 3 FT #SUB 127 125 GLN a 97 95 SER c Protein S 11 FT #SUB 127 125 GLN a 122 120 LEU c Protein S 1 FT #SUB 110 108 GLY a 88 86 SER h Protein B 2 FT #SUB 111 109 ALA a 88 86 SER h Protein S 4 FT #SUB 111 109 ALA a 89 87 TYR h Protein A 8 FT #SUB 112 110 GLU a 89 87 TYR h Protein S 3 FT #HET 57 55 LEU a 27 202 JNI b S 3 FT #HET 59 57 LEU a 24 201 JNI Z S 3 FT #HET 61 59 TYR a 24 201 JNI Z S 1 FT #HET 121 119 TYR a 24 201 JNI Z S 3 FT #HET 123 121 GLY a 24 201 JNI Z B 4 FT #HET 124 122 GLY a 24 201 JNI Z B 1 FT #HET 159 157 LEU a 27 202 JNI b S 2 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8b STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 11 9 SER b 151 149 GLN Z Protein S 1 FT #SUB 36 34 ASN b 12 10 ASP Z Protein S 2 FT #SUB 148 146 GLU b 11 9 SER Z Protein S 2 FT #SUB 149 147 SER b 11 9 SER Z Protein A 5 FT #SUB 149 147 SER b 12 10 ASP Z Protein A 3 FT #SUB 75 73 HIS b 112 110 GLU c Protein S 1 FT #SUB 75 73 HIS b 114 112 LYS c Protein S 5 FT #SUB 77 75 LEU b 117 115 TYR c Protein S 2 FT #SUB 84 82 ARG b 36 34 ASN c Protein S 1 FT #SUB 94 92 ASN b 36 34 ASN c Protein B 1 FT #SUB 94 92 ASN b 148 146 GLU c Protein S 1 FT #SUB 94 92 ASN b 149 147 SER c Protein S 3 FT #SUB 95 93 LEU b 36 34 ASN c Protein S 3 FT #SUB 95 93 LEU b 150 148 GLY c Protein B 1 FT #SUB 96 94 LEU b 150 148 GLY c Protein B 2 FT #SUB 96 94 LEU b 153 151 TYR c Protein S 4 FT #SUB 97 95 SER b 63 61 GLN c Protein B 4 FT #SUB 97 95 SER b 150 148 GLY c Protein B 6 FT #SUB 97 95 SER b 151 149 GLN c Protein B 1 FT #SUB 98 96 ALA b 63 61 GLN c Protein S 1 FT #SUB 98 96 ALA b 121 119 TYR c Protein S 1 FT #SUB 99 97 ILE b 65 63 LEU c Protein B 1 FT #SUB 99 97 ILE b 117 115 TYR c Protein A 7 FT #SUB 99 97 ILE b 119 117 PRO c Protein B 2 FT #SUB 99 97 ILE b 151 149 GLN c Protein S 1 FT #SUB 100 98 LYS b 118 116 GLU c Protein S 1 FT #SUB 100 98 LYS b 119 117 PRO c Protein S 2 FT #SUB 101 99 SER b 116 114 TRP c Protein S 2 FT #SUB 101 99 SER b 117 115 TYR c Protein A 9 FT #SUB 104 102 GLN b 104 102 GLN c Protein S 4 FT #SUB 105 103 ARG b 105 103 ARG c Protein S 3 FT #SUB 120 118 ILE b 121 119 TYR c Protein A 2 FT #SUB 121 119 TYR b 121 119 TYR c Protein B 7 FT #SUB 122 120 LEU b 63 61 GLN c Protein S 1 FT #SUB 122 120 LEU b 153 151 TYR c Protein B 1 FT #SUB 123 121 GLY b 61 59 TYR c Protein B 2 FT #SUB 123 121 GLY b 153 151 TYR c Protein B 4 FT #SUB 124 122 GLY b 17 15 HIS c Protein B 2 FT #SUB 124 122 GLY b 61 59 TYR c Protein B 2 FT #SUB 125 123 VAL b 15 13 VAL c Protein S 2 FT #SUB 125 123 VAL b 16 14 ALA c Protein S 1 FT #SUB 125 123 VAL b 17 15 HIS c Protein A 5 FT #SUB 125 123 VAL b 38 36 LEU c Protein B 1 FT #SUB 125 123 VAL b 61 59 TYR c Protein A 2 FT #SUB 126 124 PHE b 17 15 HIS c Protein S 6 FT #SUB 126 124 PHE b 36 34 ASN c Protein S 2 FT #SUB 127 125 GLN b 38 36 LEU c Protein B 1 FT #SUB 159 157 LEU b 157 155 ILE c Protein S 1 FT #SUB 46 44 ARG b 73 71 SER r Protein S 2 FT #HET 15 13 VAL b 25 202 JNI Z S 1 FT #HET 59 57 LEU b 26 201 JNI b S 6 FT #HET 61 59 TYR b 25 202 JNI Z S 1 FT #HET 121 119 TYR b 27 202 JNI b S 13 FT #HET 123 121 GLY b 26 201 JNI b B 1 FT #HET 153 151 TYR b 26 201 JNI b S 5 FT #HET 157 155 ILE b 25 202 JNI Z S 3 FT DISORDER 1 9 FT DISORDER 108 113 CC SEQUENCE 144 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETKP WYEPIYLGGV FQLEKGDRLS CC AEINRPDYLD FAESGQVYFG IIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET------KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8c STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU c 123 121 GLY a Protein S 2 FT #SUB 96 94 LEU c 127 125 GLN a Protein A 3 FT #SUB 97 95 SER c 127 125 GLN a Protein A 11 FT #SUB 122 120 LEU c 127 125 GLN a Protein S 1 FT #SUB 123 121 GLY c 57 55 LEU a Protein B 2 FT #SUB 124 122 GLY c 125 123 VAL a Protein B 2 FT #SUB 125 123 VAL c 124 122 GLY a Protein A 3 FT #SUB 125 123 VAL c 125 123 VAL a Protein A 10 FT #SUB 125 123 VAL c 126 124 PHE a Protein B 3 FT #SUB 126 124 PHE c 125 123 VAL a Protein S 2 FT #SUB 126 124 PHE c 126 124 PHE a Protein S 3 FT #SUB 127 125 GLN c 95 93 LEU a Protein S 1 FT #SUB 127 125 GLN c 96 94 LEU a Protein S 3 FT #SUB 127 125 GLN c 97 95 SER a Protein S 9 FT #SUB 15 13 VAL c 125 123 VAL b Protein S 2 FT #SUB 16 14 ALA c 125 123 VAL b Protein B 1 FT #SUB 17 15 HIS c 124 122 GLY b Protein S 2 FT #SUB 17 15 HIS c 125 123 VAL b Protein S 5 FT #SUB 17 15 HIS c 126 124 PHE b Protein S 6 FT #SUB 36 34 ASN c 84 82 ARG b Protein S 1 FT #SUB 36 34 ASN c 94 92 ASN b Protein S 1 FT #SUB 36 34 ASN c 95 93 LEU b Protein S 3 FT #SUB 36 34 ASN c 126 124 PHE b Protein B 2 FT #SUB 38 36 LEU c 125 123 VAL b Protein S 1 FT #SUB 38 36 LEU c 127 125 GLN b Protein S 1 FT #SUB 61 59 TYR c 123 121 GLY b Protein S 2 FT #SUB 61 59 TYR c 124 122 GLY b Protein S 2 FT #SUB 61 59 TYR c 125 123 VAL b Protein S 2 FT #SUB 63 61 GLN c 97 95 SER b Protein S 4 FT #SUB 63 61 GLN c 98 96 ALA b Protein S 1 FT #SUB 63 61 GLN c 122 120 LEU b Protein S 1 FT #SUB 65 63 LEU c 99 97 ILE b Protein S 1 FT #SUB 104 102 GLN c 104 102 GLN b Protein S 4 FT #SUB 105 103 ARG c 105 103 ARG b Protein S 3 FT #SUB 112 110 GLU c 75 73 HIS b Protein S 1 FT #SUB 114 112 LYS c 75 73 HIS b Protein S 5 FT #SUB 116 114 TRP c 101 99 SER b Protein B 2 FT #SUB 117 115 TYR c 77 75 LEU b Protein S 2 FT #SUB 117 115 TYR c 99 97 ILE b Protein S 7 FT #SUB 117 115 TYR c 101 99 SER b Protein A 9 FT #SUB 118 116 GLU c 100 98 LYS b Protein S 1 FT #SUB 119 117 PRO c 99 97 ILE b Protein S 2 FT #SUB 119 117 PRO c 100 98 LYS b Protein S 2 FT #SUB 121 119 TYR c 98 96 ALA b Protein S 1 FT #SUB 121 119 TYR c 120 118 ILE b Protein S 2 FT #SUB 121 119 TYR c 121 119 TYR b Protein S 7 FT #SUB 148 146 GLU c 94 92 ASN b Protein S 1 FT #SUB 149 147 SER c 94 92 ASN b Protein B 3 FT #SUB 150 148 GLY c 95 93 LEU b Protein B 1 FT #SUB 150 148 GLY c 96 94 LEU b Protein B 2 FT #SUB 150 148 GLY c 97 95 SER b Protein B 6 FT #SUB 151 149 GLN c 97 95 SER b Protein B 1 FT #SUB 151 149 GLN c 99 97 ILE b Protein S 1 FT #SUB 153 151 TYR c 96 94 LEU b Protein S 4 FT #SUB 153 151 TYR c 122 120 LEU b Protein S 1 FT #SUB 153 151 TYR c 123 121 GLY b Protein S 4 FT #SUB 157 155 ILE c 159 157 LEU b Protein S 1 FT #HET 13 11 LYS c 26 201 JNI b S 2 FT #HET 57 55 LEU c 24 201 JNI Z S 1 FT #HET 59 57 LEU c 26 201 JNI b S 2 FT #HET 61 59 TYR c 26 201 JNI b S 3 FT #HET 121 119 TYR c 27 202 JNI b A 5 FT #HET 122 120 LEU c 27 202 JNI b A 3 FT #HET 123 121 GLY c 27 202 JNI b B 1 FT #HET 158 156 ALA c 26 201 JNI b B 2 FT #HET 159 157 LEU c 26 201 JNI b A 7 FT DISORDER 1 10 FT DISORDER 108 111 CC SEQUENCE 145 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETEAK PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET----EAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* *************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8d STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 88 86 SER d 27 25 GLN F Protein B 1 FT #SUB 88 86 SER d 137 135 GLU F Protein S 5 FT #SUB 89 87 TYR d 27 25 GLN F Protein B 4 FT #SUB 89 87 TYR d 47 45 ASP F Protein S 4 FT #SUB 89 87 TYR d 48 46 ASN F Protein S 4 FT #SUB 90 88 GLN d 26 24 GLY F Protein S 1 FT #SUB 90 88 GLN d 27 25 GLN F Protein S 2 FT #SUB 93 91 VAL d 47 45 ASP F Protein S 1 FT #SUB 127 125 GLN d 90 88 GLN F Protein S 4 FT #SUB 129 127 GLU d 92 90 LYS F Protein S 1 FT #SUB 75 73 HIS d 89 87 TYR R Protein S 4 FT #SUB 13 11 LYS d 11 9 SER e Protein S 2 FT #SUB 57 55 LEU d 15 13 VAL e Protein S 2 FT #SUB 57 55 LEU d 38 36 LEU e Protein S 1 FT #SUB 59 57 LEU d 157 155 ILE e Protein S 1 FT #SUB 73 71 SER d 114 112 LYS e Protein B 1 FT #SUB 75 73 HIS d 114 112 LYS e Protein S 2 FT #SUB 75 73 HIS d 115 113 PRO e Protein S 2 FT #SUB 77 75 LEU d 117 115 TYR e Protein S 1 FT #SUB 84 82 ARG d 36 34 ASN e Protein S 4 FT #SUB 93 91 VAL d 36 34 ASN e Protein S 1 FT #SUB 94 92 ASN d 148 146 GLU e Protein S 1 FT #SUB 94 92 ASN d 149 147 SER e Protein S 4 FT #SUB 95 93 LEU d 36 34 ASN e Protein S 4 FT #SUB 95 93 LEU d 150 148 GLY e Protein B 1 FT #SUB 96 94 LEU d 150 148 GLY e Protein B 2 FT #SUB 96 94 LEU d 153 151 TYR e Protein S 4 FT #SUB 97 95 SER d 63 61 GLN e Protein B 2 FT #SUB 97 95 SER d 150 148 GLY e Protein B 7 FT #SUB 97 95 SER d 151 149 GLN e Protein B 3 FT #SUB 98 96 ALA d 63 61 GLN e Protein A 2 FT #SUB 99 97 ILE d 65 63 LEU e Protein B 2 FT #SUB 99 97 ILE d 117 115 TYR e Protein A 8 FT #SUB 99 97 ILE d 119 117 PRO e Protein B 2 FT #SUB 99 97 ILE d 151 149 GLN e Protein S 1 FT #SUB 100 98 LYS d 117 115 TYR e Protein B 1 FT #SUB 100 98 LYS d 118 116 GLU e Protein S 1 FT #SUB 100 98 LYS d 119 117 PRO e Protein S 2 FT #SUB 101 99 SER d 115 113 PRO e Protein S 1 FT #SUB 101 99 SER d 117 115 TYR e Protein A 2 FT #SUB 104 102 GLN d 114 112 LYS e Protein B 2 FT #SUB 105 103 ARG d 105 103 ARG e Protein S 5 FT #SUB 105 103 ARG d 106 104 GLU e Protein S 1 FT #SUB 105 103 ARG d 107 105 THR e Protein S 2 FT #SUB 105 103 ARG d 114 112 LYS e Protein B 1 FT #SUB 121 119 TYR d 121 119 TYR e Protein S 2 FT #SUB 122 120 LEU d 63 61 GLN e Protein S 1 FT #SUB 122 120 LEU d 153 151 TYR e Protein A 3 FT #SUB 123 121 GLY d 121 119 TYR e Protein B 4 FT #SUB 123 121 GLY d 153 151 TYR e Protein B 5 FT #SUB 124 122 GLY d 61 59 TYR e Protein B 3 FT #SUB 125 123 VAL d 16 14 ALA e Protein S 2 FT #SUB 125 123 VAL d 17 15 HIS e Protein A 5 FT #SUB 125 123 VAL d 38 36 LEU e Protein B 1 FT #SUB 125 123 VAL d 61 59 TYR e Protein A 5 FT #SUB 126 124 PHE d 17 15 HIS e Protein S 3 FT #SUB 126 124 PHE d 36 34 ASN e Protein S 2 FT #SUB 126 124 PHE d 38 36 LEU e Protein B 2 FT #SUB 127 125 GLN d 38 36 LEU e Protein B 1 FT #SUB 159 157 LEU d 157 155 ILE e Protein S 1 FT #SUB 11 9 SER d 148 146 GLU f Protein A 5 FT #SUB 11 9 SER d 149 147 SER f Protein A 8 FT #SUB 12 10 ASP d 36 34 ASN f Protein S 1 FT #SUB 149 147 SER d 12 10 ASP f Protein A 3 FT #SUB 25 23 GLU d 74 72 THR h Protein B 4 FT #SUB 25 23 GLU d 77 75 LEU h Protein S 6 FT #SUB 25 23 GLU d 140 138 ARG h Protein S 3 FT #SUB 26 24 GLY d 74 72 THR h Protein B 2 FT #SUB 26 24 GLY d 140 138 ARG h Protein B 1 FT #SUB 27 25 GLN d 140 138 ARG h Protein S 10 FT #SUB 46 44 ARG d 47 45 ASP h Protein S 2 FT #SUB 47 45 ASP d 26 24 GLY h Protein S 1 FT #SUB 47 45 ASP d 27 25 GLN h Protein S 1 FT #SUB 49 47 GLN d 25 23 GLU h Protein S 1 FT #SUB 91 89 THR d 23 21 GLN h Protein S 1 FT #SUB 92 90 LYS d 25 23 GLU h Protein S 4 FT #SUB 133 131 ARG d 27 25 GLN h Protein S 10 FT #HET 11 9 SER d 30 202 JNI f B 3 FT #HET 12 10 ASP d 30 202 JNI f B 3 FT #HET 15 13 VAL d 30 202 JNI f S 3 FT #HET 17 15 HIS d 29 201 JNI f S 3 FT #HET 41 39 ASN d 30 202 JNI f S 1 FT #HET 59 57 LEU d 28 201 JNI d S 4 FT #HET 61 59 TYR d 28 201 JNI d S 1 FT #HET 62 60 SER d 28 201 JNI d B 1 FT #HET 63 61 GLN d 28 201 JNI d S 2 FT #HET 121 119 TYR d 28 201 JNI d S 22 FT #HET 122 120 LEU d 28 201 JNI d B 1 FT #HET 123 121 GLY d 28 201 JNI d B 2 FT #HET 124 122 GLY d 28 201 JNI d B 1 FT #HET 153 151 TYR d 28 201 JNI d S 5 FT #HET 157 155 ILE d 30 202 JNI f S 4 FT DISORDER 1 10 FT DISORDER 32 37 FT DISORDER 109 113 CC SEQUENCE 138 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPKPWYEPIY LGGVFQLEKG DRLSAEINRP CC DYLDFAESGQ VYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP-----KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8e STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 23 21 GLN e 46 44 ARG F Protein S 1 FT #SUB 32 30 ASN e 87 85 VAL F Protein S 1 FT #SUB 34 32 ARG e 46 44 ARG F Protein S 5 FT #SUB 34 32 ARG e 133 131 ARG F Protein B 2 FT #SUB 35 33 ALA e 47 45 ASP F Protein S 1 FT #SUB 35 33 ALA e 133 131 ARG F Protein B 3 FT #SUB 39 37 LEU e 90 88 GLN F Protein B 6 FT #SUB 75 73 HIS e 41 39 ASN K Protein S 7 FT #SUB 75 73 HIS e 42 40 GLY K Protein S 7 FT #SUB 75 73 HIS e 44 42 GLU K Protein B 1 FT #SUB 75 73 HIS e 53 51 PRO K Protein S 1 FT #SUB 77 75 LEU e 53 51 PRO K Protein S 1 FT #SUB 77 75 LEU e 130 128 LYS K Protein S 2 FT #SUB 81 79 THR e 87 85 VAL K Protein S 1 FT #SUB 81 79 THR e 90 88 GLN K Protein S 3 FT #SUB 92 90 LYS e 89 87 TYR K Protein B 1 FT #SUB 92 90 LYS e 90 88 GLN K Protein S 2 FT #SUB 92 90 LYS e 91 89 THR K Protein B 1 FT #SUB 94 92 ASN e 87 85 VAL K Protein S 1 FT #SUB 94 92 ASN e 88 86 SER K Protein S 4 FT #SUB 94 92 ASN e 89 87 TYR K Protein S 1 FT #SUB 94 92 ASN e 90 88 GLN K Protein S 4 FT #SUB 97 95 SER e 87 85 VAL K Protein S 2 FT #SUB 97 95 SER e 88 86 SER K Protein S 1 FT #SUB 99 97 ILE e 87 85 VAL K Protein S 4 FT #SUB 101 99 SER e 130 128 LYS K Protein S 2 FT #SUB 139 137 ASN e 46 44 ARG K Protein B 1 FT #SUB 140 138 ARG e 46 44 ARG K Protein S 12 FT #SUB 88 86 SER e 129 127 GLU O Protein S 1 FT #SUB 89 87 TYR e 89 87 TYR O Protein S 19 FT #SUB 129 127 GLU e 88 86 SER O Protein S 2 FT #SUB 42 40 GLY e 75 73 HIS Q Protein B 8 FT #SUB 44 42 GLU e 75 73 HIS Q Protein S 1 FT #SUB 46 44 ARG e 139 137 ASN Q Protein S 1 FT #SUB 46 44 ARG e 140 138 ARG Q Protein S 12 FT #SUB 46 44 ARG e 142 140 ASP Q Protein S 1 FT #SUB 88 86 SER e 94 92 ASN Q Protein B 4 FT #SUB 89 87 TYR e 92 90 LYS Q Protein B 1 FT #SUB 89 87 TYR e 94 92 ASN Q Protein B 2 FT #SUB 90 88 GLN e 81 79 THR Q Protein S 1 FT #SUB 90 88 GLN e 92 90 LYS Q Protein A 6 FT #SUB 90 88 GLN e 94 92 ASN Q Protein S 1 FT #SUB 91 89 THR e 91 89 THR Q Protein S 2 FT #SUB 91 89 THR e 92 90 LYS Q Protein S 1 FT #SUB 130 128 LYS e 77 75 LEU Q Protein S 2 FT #SUB 130 128 LYS e 101 99 SER Q Protein S 3 FT #SUB 131 129 GLY e 77 75 LEU Q Protein B 1 FT #SUB 67 65 LYS e 90 88 GLN R Protein S 1 FT #SUB 69 67 GLN e 91 89 THR R Protein S 5 FT #SUB 69 67 GLN e 92 90 LYS R Protein S 5 FT #SUB 113 111 ALA e 89 87 TYR R Protein B 2 FT #SUB 114 112 LYS e 89 87 TYR R Protein S 5 FT #SUB 115 113 PRO e 89 87 TYR R Protein S 4 FT #SUB 11 9 SER e 13 11 LYS d Protein A 2 FT #SUB 15 13 VAL e 57 55 LEU d Protein S 2 FT #SUB 16 14 ALA e 125 123 VAL d Protein B 2 FT #SUB 17 15 HIS e 125 123 VAL d Protein S 5 FT #SUB 17 15 HIS e 126 124 PHE d Protein S 3 FT #SUB 36 34 ASN e 84 82 ARG d Protein S 4 FT #SUB 36 34 ASN e 93 91 VAL d Protein S 1 FT #SUB 36 34 ASN e 95 93 LEU d Protein S 4 FT #SUB 36 34 ASN e 126 124 PHE d Protein A 2 FT #SUB 38 36 LEU e 57 55 LEU d Protein S 1 FT #SUB 38 36 LEU e 125 123 VAL d Protein S 1 FT #SUB 38 36 LEU e 126 124 PHE d Protein S 2 FT #SUB 38 36 LEU e 127 125 GLN d Protein S 1 FT #SUB 61 59 TYR e 124 122 GLY d Protein S 3 FT #SUB 61 59 TYR e 125 123 VAL d Protein S 5 FT #SUB 63 61 GLN e 97 95 SER d Protein S 2 FT #SUB 63 61 GLN e 98 96 ALA d Protein S 2 FT #SUB 63 61 GLN e 122 120 LEU d Protein S 1 FT #SUB 65 63 LEU e 99 97 ILE d Protein S 2 FT #SUB 105 103 ARG e 105 103 ARG d Protein S 5 FT #SUB 106 104 GLU e 105 103 ARG d Protein B 1 FT #SUB 107 105 THR e 105 103 ARG d Protein B 2 FT #SUB 114 112 LYS e 73 71 SER d Protein S 1 FT #SUB 114 112 LYS e 75 73 HIS d Protein S 2 FT #SUB 114 112 LYS e 104 102 GLN d Protein S 2 FT #SUB 114 112 LYS e 105 103 ARG d Protein S 1 FT #SUB 115 113 PRO e 75 73 HIS d Protein B 2 FT #SUB 115 113 PRO e 101 99 SER d Protein B 1 FT #SUB 117 115 TYR e 77 75 LEU d Protein S 1 FT #SUB 117 115 TYR e 99 97 ILE d Protein S 8 FT #SUB 117 115 TYR e 100 98 LYS d Protein S 1 FT #SUB 117 115 TYR e 101 99 SER d Protein A 2 FT #SUB 118 116 GLU e 100 98 LYS d Protein S 1 FT #SUB 119 117 PRO e 99 97 ILE d Protein S 2 FT #SUB 119 117 PRO e 100 98 LYS d Protein S 2 FT #SUB 121 119 TYR e 121 119 TYR d Protein S 2 FT #SUB 121 119 TYR e 123 121 GLY d Protein S 4 FT #SUB 148 146 GLU e 94 92 ASN d Protein S 1 FT #SUB 149 147 SER e 94 92 ASN d Protein B 4 FT #SUB 150 148 GLY e 95 93 LEU d Protein B 1 FT #SUB 150 148 GLY e 96 94 LEU d Protein B 2 FT #SUB 150 148 GLY e 97 95 SER d Protein B 7 FT #SUB 151 149 GLN e 97 95 SER d Protein A 3 FT #SUB 151 149 GLN e 99 97 ILE d Protein S 1 FT #SUB 153 151 TYR e 96 94 LEU d Protein S 4 FT #SUB 153 151 TYR e 122 120 LEU d Protein S 3 FT #SUB 153 151 TYR e 123 121 GLY d Protein S 5 FT #SUB 157 155 ILE e 59 57 LEU d Protein S 1 FT #SUB 157 155 ILE e 159 157 LEU d Protein S 1 FT #SUB 57 55 LEU e 123 121 GLY g Protein S 2 FT #SUB 96 94 LEU e 127 125 GLN g Protein A 5 FT #SUB 97 95 SER e 127 125 GLN g Protein A 10 FT #SUB 123 121 GLY e 57 55 LEU g Protein B 1 FT #SUB 124 122 GLY e 125 123 VAL g Protein B 4 FT #SUB 125 123 VAL e 124 122 GLY g Protein A 4 FT #SUB 125 123 VAL e 125 123 VAL g Protein A 8 FT #SUB 125 123 VAL e 126 124 PHE g Protein B 3 FT #SUB 126 124 PHE e 125 123 VAL g Protein S 3 FT #SUB 126 124 PHE e 126 124 PHE g Protein S 4 FT #SUB 127 125 GLN e 96 94 LEU g Protein S 4 FT #SUB 127 125 GLN e 97 95 SER g Protein S 12 FT #HET 61 59 TYR e 28 201 JNI d S 3 FT #HET 121 119 TYR e 28 201 JNI d S 9 FT #HET 123 121 GLY e 28 201 JNI d B 2 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8f STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 33 31 ARG f 109 107 GLU Z Protein S 5 FT #SUB 12 10 ASP f 149 147 SER d Protein S 3 FT #SUB 36 34 ASN f 12 10 ASP d Protein S 1 FT #SUB 148 146 GLU f 11 9 SER d Protein S 5 FT #SUB 149 147 SER f 11 9 SER d Protein A 8 FT #SUB 84 82 ARG f 36 34 ASN g Protein S 2 FT #SUB 93 91 VAL f 36 34 ASN g Protein S 1 FT #SUB 94 92 ASN f 148 146 GLU g Protein S 1 FT #SUB 94 92 ASN f 149 147 SER g Protein A 3 FT #SUB 95 93 LEU f 36 34 ASN g Protein S 2 FT #SUB 95 93 LEU f 150 148 GLY g Protein B 1 FT #SUB 96 94 LEU f 150 148 GLY g Protein B 2 FT #SUB 96 94 LEU f 153 151 TYR g Protein S 4 FT #SUB 97 95 SER f 63 61 GLN g Protein B 3 FT #SUB 97 95 SER f 150 148 GLY g Protein B 4 FT #SUB 97 95 SER f 151 149 GLN g Protein B 1 FT #SUB 98 96 ALA f 63 61 GLN g Protein S 1 FT #SUB 99 97 ILE f 65 63 LEU g Protein B 1 FT #SUB 99 97 ILE f 117 115 TYR g Protein A 6 FT #SUB 99 97 ILE f 119 117 PRO g Protein B 3 FT #SUB 100 98 LYS f 119 117 PRO g Protein S 3 FT #SUB 101 99 SER f 116 114 TRP g Protein S 2 FT #SUB 101 99 SER f 117 115 TYR g Protein S 6 FT #SUB 104 102 GLN f 104 102 GLN g Protein S 1 FT #SUB 105 103 ARG f 105 103 ARG g Protein S 5 FT #SUB 120 118 ILE f 121 119 TYR g Protein A 5 FT #SUB 121 119 TYR f 121 119 TYR g Protein A 8 FT #SUB 122 120 LEU f 63 61 GLN g Protein S 1 FT #SUB 122 120 LEU f 153 151 TYR g Protein S 1 FT #SUB 123 121 GLY f 61 59 TYR g Protein B 2 FT #SUB 123 121 GLY f 153 151 TYR g Protein B 2 FT #SUB 124 122 GLY f 61 59 TYR g Protein B 4 FT #SUB 125 123 VAL f 17 15 HIS g Protein B 3 FT #SUB 125 123 VAL f 38 36 LEU g Protein B 1 FT #SUB 125 123 VAL f 61 59 TYR g Protein A 3 FT #SUB 125 123 VAL f 157 155 ILE g Protein S 1 FT #SUB 126 124 PHE f 17 15 HIS g Protein S 5 FT #SUB 126 124 PHE f 36 34 ASN g Protein S 4 FT #SUB 126 124 PHE f 38 36 LEU g Protein B 1 FT #SUB 127 125 GLN f 38 36 LEU g Protein B 1 FT #SUB 159 157 LEU f 157 155 ILE g Protein S 1 FT #HET 10 8 PRO f 30 202 JNI f B 2 FT #HET 11 9 SER f 30 202 JNI f S 2 FT #HET 17 15 HIS f 30 202 JNI f S 6 FT #HET 35 33 ALA f 30 202 JNI f B 2 FT #HET 36 34 ASN f 30 202 JNI f A 8 FT #HET 157 155 ILE f 29 201 JNI f S 3 FT DISORDER 1 9 FT DISORDER 108 114 CC SEQUENCE 143 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPW YEPIYLGGVF QLEKGDRLSA CC EINRPDYLDF AESGQVYFGI IAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET-------PWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* ************************************ CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8g STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 89 87 TYR g 89 87 TYR K Protein S 15 FT #SUB 41 39 ASN g 75 73 HIS M Protein B 1 FT #SUB 42 40 GLY g 75 73 HIS M Protein B 7 FT #SUB 44 42 GLU g 75 73 HIS M Protein S 1 FT #SUB 46 44 ARG g 139 137 ASN M Protein S 1 FT #SUB 46 44 ARG g 140 138 ARG M Protein S 16 FT #SUB 46 44 ARG g 142 140 ASP M Protein S 1 FT #SUB 52 50 VAL g 77 75 LEU M Protein B 1 FT #SUB 53 51 PRO g 75 73 HIS M Protein S 1 FT #SUB 87 85 VAL g 99 97 ILE M Protein S 4 FT #SUB 88 86 SER g 94 92 ASN M Protein B 3 FT #SUB 89 87 TYR g 92 90 LYS M Protein B 1 FT #SUB 89 87 TYR g 94 92 ASN M Protein B 3 FT #SUB 90 88 GLN g 81 79 THR M Protein S 2 FT #SUB 90 88 GLN g 83 81 SER M Protein S 2 FT #SUB 90 88 GLN g 92 90 LYS M Protein B 5 FT #SUB 91 89 THR g 91 89 THR M Protein S 1 FT #SUB 91 89 THR g 92 90 LYS M Protein S 3 FT #SUB 130 128 LYS g 101 99 SER M Protein S 2 FT #SUB 131 129 GLY g 77 75 LEU M Protein B 2 FT #SUB 75 73 HIS g 42 40 GLY O Protein S 9 FT #SUB 75 73 HIS g 44 42 GLU O Protein B 2 FT #SUB 76 74 VAL g 44 42 GLU O Protein B 2 FT #SUB 77 75 LEU g 52 50 VAL O Protein S 1 FT #SUB 77 75 LEU g 130 128 LYS O Protein S 1 FT #SUB 77 75 LEU g 131 129 GLY O Protein S 2 FT #SUB 81 79 THR g 90 88 GLN O Protein S 2 FT #SUB 83 81 SER g 90 88 GLN O Protein S 4 FT #SUB 91 89 THR g 91 89 THR O Protein S 2 FT #SUB 92 90 LYS g 90 88 GLN O Protein S 3 FT #SUB 92 90 LYS g 91 89 THR O Protein B 1 FT #SUB 94 92 ASN g 88 86 SER O Protein S 3 FT #SUB 94 92 ASN g 90 88 GLN O Protein S 2 FT #SUB 97 95 SER g 88 86 SER O Protein S 1 FT #SUB 99 97 ILE g 87 85 VAL O Protein S 4 FT #SUB 99 97 ILE g 130 128 LYS O Protein S 2 FT #SUB 101 99 SER g 130 128 LYS O Protein S 3 FT #SUB 139 137 ASN g 46 44 ARG O Protein B 1 FT #SUB 140 138 ARG g 46 44 ARG O Protein S 15 FT #SUB 57 55 LEU g 123 121 GLY e Protein S 1 FT #SUB 96 94 LEU g 127 125 GLN e Protein A 4 FT #SUB 97 95 SER g 127 125 GLN e Protein A 12 FT #SUB 123 121 GLY g 57 55 LEU e Protein B 2 FT #SUB 124 122 GLY g 125 123 VAL e Protein B 4 FT #SUB 125 123 VAL g 124 122 GLY e Protein A 4 FT #SUB 125 123 VAL g 125 123 VAL e Protein A 8 FT #SUB 125 123 VAL g 126 124 PHE e Protein B 3 FT #SUB 126 124 PHE g 125 123 VAL e Protein S 3 FT #SUB 126 124 PHE g 126 124 PHE e Protein S 4 FT #SUB 127 125 GLN g 96 94 LEU e Protein S 5 FT #SUB 127 125 GLN g 97 95 SER e Protein S 10 FT #SUB 17 15 HIS g 125 123 VAL f Protein S 3 FT #SUB 17 15 HIS g 126 124 PHE f Protein S 5 FT #SUB 36 34 ASN g 84 82 ARG f Protein S 2 FT #SUB 36 34 ASN g 93 91 VAL f Protein S 1 FT #SUB 36 34 ASN g 95 93 LEU f Protein S 2 FT #SUB 36 34 ASN g 126 124 PHE f Protein A 4 FT #SUB 38 36 LEU g 125 123 VAL f Protein S 1 FT #SUB 38 36 LEU g 126 124 PHE f Protein S 1 FT #SUB 38 36 LEU g 127 125 GLN f Protein S 1 FT #SUB 61 59 TYR g 123 121 GLY f Protein S 2 FT #SUB 61 59 TYR g 124 122 GLY f Protein S 4 FT #SUB 61 59 TYR g 125 123 VAL f Protein S 3 FT #SUB 63 61 GLN g 97 95 SER f Protein S 3 FT #SUB 63 61 GLN g 98 96 ALA f Protein S 1 FT #SUB 63 61 GLN g 122 120 LEU f Protein S 1 FT #SUB 65 63 LEU g 99 97 ILE f Protein S 1 FT #SUB 104 102 GLN g 104 102 GLN f Protein S 1 FT #SUB 105 103 ARG g 105 103 ARG f Protein S 5 FT #SUB 116 114 TRP g 101 99 SER f Protein B 2 FT #SUB 117 115 TYR g 99 97 ILE f Protein S 6 FT #SUB 117 115 TYR g 101 99 SER f Protein A 6 FT #SUB 119 117 PRO g 99 97 ILE f Protein S 3 FT #SUB 119 117 PRO g 100 98 LYS f Protein S 3 FT #SUB 121 119 TYR g 120 118 ILE f Protein S 5 FT #SUB 121 119 TYR g 121 119 TYR f Protein S 8 FT #SUB 148 146 GLU g 94 92 ASN f Protein S 1 FT #SUB 149 147 SER g 94 92 ASN f Protein A 3 FT #SUB 150 148 GLY g 95 93 LEU f Protein B 1 FT #SUB 150 148 GLY g 96 94 LEU f Protein B 2 FT #SUB 150 148 GLY g 97 95 SER f Protein B 4 FT #SUB 151 149 GLN g 97 95 SER f Protein B 1 FT #SUB 153 151 TYR g 96 94 LEU f Protein S 4 FT #SUB 153 151 TYR g 122 120 LEU f Protein S 1 FT #SUB 153 151 TYR g 123 121 GLY f Protein S 2 FT #SUB 157 155 ILE g 125 123 VAL f Protein S 1 FT #SUB 157 155 ILE g 159 157 LEU f Protein S 1 FT DISORDER 1 10 FT DISORDER 109 112 CC SEQUENCE 145 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPAK PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8h STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 12 10 ASP h 108 106 PRO F Protein S 2 FT #SUB 21 19 ASN h 25 23 GLU F Protein S 1 FT #SUB 23 21 GLN h 27 25 GLN F Protein S 1 FT #SUB 31 29 LEU h 25 23 GLU F Protein S 2 FT #SUB 44 42 GLU h 74 72 THR F Protein S 5 FT #SUB 88 86 SER h 110 108 GLY a Protein B 2 FT #SUB 88 86 SER h 111 109 ALA a Protein A 4 FT #SUB 89 87 TYR h 111 109 ALA a Protein A 8 FT #SUB 89 87 TYR h 112 110 GLU a Protein S 3 FT #SUB 23 21 GLN h 91 89 THR d Protein S 1 FT #SUB 25 23 GLU h 49 47 GLN d Protein B 1 FT #SUB 25 23 GLU h 92 90 LYS d Protein S 4 FT #SUB 26 24 GLY h 47 45 ASP d Protein B 1 FT #SUB 27 25 GLN h 47 45 ASP d Protein S 1 FT #SUB 27 25 GLN h 133 131 ARG d Protein S 10 FT #SUB 47 45 ASP h 46 44 ARG d Protein A 2 FT #SUB 74 72 THR h 25 23 GLU d Protein S 4 FT #SUB 74 72 THR h 26 24 GLY d Protein S 2 FT #SUB 77 75 LEU h 25 23 GLU d Protein A 6 FT #SUB 140 138 ARG h 25 23 GLU d Protein S 3 FT #SUB 140 138 ARG h 26 24 GLY d Protein S 1 FT #SUB 140 138 ARG h 27 25 GLN d Protein S 10 FT #SUB 57 55 LEU h 15 13 VAL i Protein S 1 FT #SUB 59 57 LEU h 157 155 ILE i Protein S 2 FT #SUB 75 73 HIS h 115 113 PRO i Protein S 2 FT #SUB 77 75 LEU h 117 115 TYR i Protein S 2 FT #SUB 84 82 ARG h 36 34 ASN i Protein S 4 FT #SUB 93 91 VAL h 36 34 ASN i Protein S 1 FT #SUB 94 92 ASN h 149 147 SER i Protein S 4 FT #SUB 95 93 LEU h 36 34 ASN i Protein S 4 FT #SUB 95 93 LEU h 150 148 GLY i Protein B 2 FT #SUB 96 94 LEU h 150 148 GLY i Protein B 3 FT #SUB 96 94 LEU h 153 151 TYR i Protein S 2 FT #SUB 97 95 SER h 63 61 GLN i Protein B 3 FT #SUB 97 95 SER h 149 147 SER i Protein S 1 FT #SUB 97 95 SER h 150 148 GLY i Protein A 7 FT #SUB 97 95 SER h 151 149 GLN i Protein B 4 FT #SUB 98 96 ALA h 63 61 GLN i Protein A 3 FT #SUB 99 97 ILE h 65 63 LEU i Protein A 3 FT #SUB 99 97 ILE h 117 115 TYR i Protein A 8 FT #SUB 99 97 ILE h 119 117 PRO i Protein B 2 FT #SUB 99 97 ILE h 151 149 GLN i Protein S 1 FT #SUB 100 98 LYS h 119 117 PRO i Protein S 2 FT #SUB 101 99 SER h 116 114 TRP i Protein S 2 FT #SUB 101 99 SER h 117 115 TYR i Protein S 6 FT #SUB 105 103 ARG h 105 103 ARG i Protein S 2 FT #SUB 105 103 ARG h 106 104 GLU i Protein S 3 FT #SUB 105 103 ARG h 107 105 THR i Protein S 3 FT #SUB 121 119 TYR h 121 119 TYR i Protein S 3 FT #SUB 122 120 LEU h 63 61 GLN i Protein S 1 FT #SUB 122 120 LEU h 153 151 TYR i Protein A 3 FT #SUB 123 121 GLY h 61 59 TYR i Protein B 2 FT #SUB 123 121 GLY h 121 119 TYR i Protein B 3 FT #SUB 123 121 GLY h 153 151 TYR i Protein B 4 FT #SUB 124 122 GLY h 61 59 TYR i Protein B 3 FT #SUB 125 123 VAL h 16 14 ALA i Protein S 2 FT #SUB 125 123 VAL h 17 15 HIS i Protein A 5 FT #SUB 125 123 VAL h 61 59 TYR i Protein A 3 FT #SUB 126 124 PHE h 17 15 HIS i Protein S 3 FT #SUB 126 124 PHE h 36 34 ASN i Protein S 4 FT #SUB 127 125 GLN h 38 36 LEU i Protein B 1 FT #SUB 159 157 LEU h 157 155 ILE i Protein S 1 FT #SUB 11 9 SER h 148 146 GLU j Protein A 8 FT #SUB 12 10 ASP h 148 146 GLU j Protein B 1 FT #SUB 40 38 ALA h 35 33 ALA j Protein S 1 FT #SUB 149 147 SER h 10 8 PRO j Protein B 1 FT #SUB 149 147 SER h 11 9 SER j Protein B 1 FT #SUB 149 147 SER h 12 10 ASP j Protein S 1 FT #SUB 149 147 SER h 13 11 LYS j Protein S 1 FT #HET 17 15 HIS h 32 202 JNI h S 5 FT #HET 59 57 LEU h 31 201 JNI h S 3 FT #HET 61 59 TYR h 31 201 JNI h S 1 FT #HET 62 60 SER h 31 201 JNI h B 1 FT #HET 121 119 TYR h 31 201 JNI h S 10 FT #HET 122 120 LEU h 31 201 JNI h B 3 FT #HET 153 151 TYR h 31 201 JNI h S 6 FT DISORDER 1 10 FT DISORDER 32 37 FT DISORDER 108 113 CC SEQUENCE 137 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TKPWYEPIYL GGVFQLEKGD RLSAEINRPD CC YLDFAESGQV YFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRET------KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******* ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8i STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 75 73 HIS i 42 40 GLY B Protein S 3 FT #SUB 75 73 HIS i 44 42 GLU B Protein A 7 FT #SUB 77 75 LEU i 130 128 LYS B Protein S 1 FT #SUB 92 90 LYS i 91 89 THR B Protein B 1 FT #SUB 94 92 ASN i 87 85 VAL B Protein S 1 FT #SUB 94 92 ASN i 88 86 SER B Protein S 4 FT #SUB 94 92 ASN i 90 88 GLN B Protein S 1 FT #SUB 97 95 SER i 88 86 SER B Protein S 1 FT #SUB 99 97 ILE i 87 85 VAL B Protein S 4 FT #SUB 101 99 SER i 130 128 LYS B Protein S 2 FT #SUB 139 137 ASN i 46 44 ARG B Protein B 1 FT #SUB 140 138 ARG i 46 44 ARG B Protein S 11 FT #SUB 41 39 ASN i 75 73 HIS W Protein B 1 FT #SUB 42 40 GLY i 75 73 HIS W Protein B 10 FT #SUB 44 42 GLU i 75 73 HIS W Protein S 1 FT #SUB 44 42 GLU i 140 138 ARG W Protein S 1 FT #SUB 46 44 ARG i 139 137 ASN W Protein S 1 FT #SUB 46 44 ARG i 140 138 ARG W Protein S 14 FT #SUB 52 50 VAL i 77 75 LEU W Protein B 1 FT #SUB 87 85 VAL i 99 97 ILE W Protein S 2 FT #SUB 88 86 SER i 94 92 ASN W Protein B 3 FT #SUB 89 87 TYR i 92 90 LYS W Protein B 1 FT #SUB 89 87 TYR i 94 92 ASN W Protein B 2 FT #SUB 90 88 GLN i 81 79 THR W Protein S 3 FT #SUB 90 88 GLN i 83 81 SER W Protein S 1 FT #SUB 90 88 GLN i 92 90 LYS W Protein A 4 FT #SUB 90 88 GLN i 94 92 ASN W Protein S 1 FT #SUB 91 89 THR i 92 90 LYS W Protein S 2 FT #SUB 130 128 LYS i 101 99 SER W Protein S 3 FT #SUB 131 129 GLY i 77 75 LEU W Protein B 2 FT #SUB 88 86 SER i 129 127 GLU Y Protein S 1 FT #SUB 89 87 TYR i 89 87 TYR Y Protein S 14 FT #SUB 25 23 GLU i 139 137 ASN Z Protein S 1 FT #SUB 15 13 VAL i 57 55 LEU h Protein S 1 FT #SUB 16 14 ALA i 125 123 VAL h Protein B 2 FT #SUB 17 15 HIS i 125 123 VAL h Protein S 5 FT #SUB 17 15 HIS i 126 124 PHE h Protein S 3 FT #SUB 36 34 ASN i 84 82 ARG h Protein S 4 FT #SUB 36 34 ASN i 93 91 VAL h Protein S 1 FT #SUB 36 34 ASN i 95 93 LEU h Protein S 4 FT #SUB 36 34 ASN i 126 124 PHE h Protein A 4 FT #SUB 38 36 LEU i 127 125 GLN h Protein S 1 FT #SUB 61 59 TYR i 123 121 GLY h Protein S 2 FT #SUB 61 59 TYR i 124 122 GLY h Protein S 3 FT #SUB 61 59 TYR i 125 123 VAL h Protein S 3 FT #SUB 63 61 GLN i 97 95 SER h Protein S 3 FT #SUB 63 61 GLN i 98 96 ALA h Protein S 3 FT #SUB 63 61 GLN i 122 120 LEU h Protein S 1 FT #SUB 65 63 LEU i 99 97 ILE h Protein S 3 FT #SUB 105 103 ARG i 105 103 ARG h Protein S 2 FT #SUB 106 104 GLU i 105 103 ARG h Protein B 3 FT #SUB 107 105 THR i 105 103 ARG h Protein B 3 FT #SUB 115 113 PRO i 75 73 HIS h Protein B 2 FT #SUB 116 114 TRP i 101 99 SER h Protein B 2 FT #SUB 117 115 TYR i 77 75 LEU h Protein S 2 FT #SUB 117 115 TYR i 99 97 ILE h Protein S 8 FT #SUB 117 115 TYR i 101 99 SER h Protein A 6 FT #SUB 119 117 PRO i 99 97 ILE h Protein S 2 FT #SUB 119 117 PRO i 100 98 LYS h Protein S 2 FT #SUB 121 119 TYR i 121 119 TYR h Protein S 3 FT #SUB 121 119 TYR i 123 121 GLY h Protein S 3 FT #SUB 149 147 SER i 94 92 ASN h Protein B 4 FT #SUB 149 147 SER i 97 95 SER h Protein B 1 FT #SUB 150 148 GLY i 95 93 LEU h Protein B 2 FT #SUB 150 148 GLY i 96 94 LEU h Protein B 3 FT #SUB 150 148 GLY i 97 95 SER h Protein B 7 FT #SUB 151 149 GLN i 97 95 SER h Protein A 4 FT #SUB 151 149 GLN i 99 97 ILE h Protein S 1 FT #SUB 153 151 TYR i 96 94 LEU h Protein S 2 FT #SUB 153 151 TYR i 122 120 LEU h Protein S 3 FT #SUB 153 151 TYR i 123 121 GLY h Protein S 4 FT #SUB 157 155 ILE i 59 57 LEU h Protein S 2 FT #SUB 157 155 ILE i 159 157 LEU h Protein S 1 FT #SUB 57 55 LEU i 123 121 GLY k Protein S 1 FT #SUB 96 94 LEU i 127 125 GLN k Protein A 5 FT #SUB 97 95 SER i 127 125 GLN k Protein A 10 FT #SUB 123 121 GLY i 57 55 LEU k Protein B 2 FT #SUB 124 122 GLY i 125 123 VAL k Protein B 4 FT #SUB 125 123 VAL i 124 122 GLY k Protein A 4 FT #SUB 125 123 VAL i 125 123 VAL k Protein A 12 FT #SUB 125 123 VAL i 126 124 PHE k Protein B 2 FT #SUB 126 124 PHE i 125 123 VAL k Protein S 2 FT #SUB 126 124 PHE i 126 124 PHE k Protein S 4 FT #SUB 127 125 GLN i 95 93 LEU k Protein S 1 FT #SUB 127 125 GLN i 96 94 LEU k Protein S 5 FT #SUB 127 125 GLN i 97 95 SER k Protein S 12 FT #HET 57 55 LEU i 34 202 JNI j S 2 FT #HET 59 57 LEU i 31 201 JNI h S 2 FT #HET 61 59 TYR i 31 201 JNI h S 4 FT #HET 121 119 TYR i 31 201 JNI h S 9 FT #HET 123 121 GLY i 31 201 JNI h B 5 FT #HET 159 157 LEU i 34 202 JNI j A 6 FT DISORDER 1 10 FT DISORDER 109 112 CC SEQUENCE 145 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPAK PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8j STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 10 8 PRO j 25 23 GLU F Protein S 4 FT #SUB 23 21 GLN j 112 110 GLU F Protein S 4 FT #SUB 33 31 ARG j 67 65 LYS F Protein S 6 FT #SUB 33 31 ARG j 69 67 GLN F Protein A 6 FT #SUB 33 31 ARG j 115 113 PRO F Protein B 2 FT #SUB 34 32 ARG j 69 67 GLN F Protein B 5 FT #SUB 34 32 ARG j 112 110 GLU F Protein S 4 FT #SUB 34 32 ARG j 113 111 ALA F Protein S 1 FT #SUB 34 32 ARG j 114 112 LYS F Protein S 2 FT #SUB 35 33 ALA j 113 111 ALA F Protein A 2 FT #SUB 37 35 ALA j 69 67 GLN F Protein B 1 FT #SUB 149 147 SER j 112 110 GLU F Protein S 2 FT #SUB 10 8 PRO j 149 147 SER h Protein B 1 FT #SUB 11 9 SER j 149 147 SER h Protein B 1 FT #SUB 12 10 ASP j 149 147 SER h Protein S 1 FT #SUB 13 11 LYS j 149 147 SER h Protein S 1 FT #SUB 35 33 ALA j 40 38 ALA h Protein B 1 FT #SUB 148 146 GLU j 11 9 SER h Protein S 8 FT #SUB 148 146 GLU j 12 10 ASP h Protein S 1 FT #SUB 57 55 LEU j 15 13 VAL k Protein S 1 FT #SUB 57 55 LEU j 38 36 LEU k Protein S 1 FT #SUB 59 57 LEU j 157 155 ILE k Protein S 1 FT #SUB 75 73 HIS j 114 112 LYS k Protein S 2 FT #SUB 75 73 HIS j 115 113 PRO k Protein S 1 FT #SUB 77 75 LEU j 117 115 TYR k Protein S 1 FT #SUB 84 82 ARG j 36 34 ASN k Protein S 3 FT #SUB 93 91 VAL j 36 34 ASN k Protein S 1 FT #SUB 94 92 ASN j 149 147 SER k Protein A 3 FT #SUB 94 92 ASN j 150 148 GLY k Protein B 1 FT #SUB 95 93 LEU j 36 34 ASN k Protein S 4 FT #SUB 95 93 LEU j 150 148 GLY k Protein B 2 FT #SUB 96 94 LEU j 150 148 GLY k Protein B 3 FT #SUB 96 94 LEU j 153 151 TYR k Protein S 2 FT #SUB 97 95 SER j 63 61 GLN k Protein B 2 FT #SUB 97 95 SER j 150 148 GLY k Protein B 6 FT #SUB 97 95 SER j 151 149 GLN k Protein B 2 FT #SUB 98 96 ALA j 63 61 GLN k Protein S 1 FT #SUB 99 97 ILE j 65 63 LEU k Protein A 2 FT #SUB 99 97 ILE j 117 115 TYR k Protein A 7 FT #SUB 99 97 ILE j 119 117 PRO k Protein B 2 FT #SUB 99 97 ILE j 151 149 GLN k Protein S 1 FT #SUB 100 98 LYS j 118 116 GLU k Protein S 2 FT #SUB 100 98 LYS j 119 117 PRO k Protein S 3 FT #SUB 104 102 GLN j 104 102 GLN k Protein S 1 FT #SUB 105 103 ARG j 105 103 ARG k Protein S 5 FT #SUB 105 103 ARG j 106 104 GLU k Protein S 2 FT #SUB 120 118 ILE j 121 119 TYR k Protein B 1 FT #SUB 121 119 TYR j 121 119 TYR k Protein B 5 FT #SUB 122 120 LEU j 63 61 GLN k Protein S 1 FT #SUB 123 121 GLY j 61 59 TYR k Protein B 2 FT #SUB 123 121 GLY j 153 151 TYR k Protein B 4 FT #SUB 124 122 GLY j 61 59 TYR k Protein B 4 FT #SUB 125 123 VAL j 17 15 HIS k Protein A 4 FT #SUB 125 123 VAL j 61 59 TYR k Protein A 3 FT #SUB 126 124 PHE j 17 15 HIS k Protein S 6 FT #SUB 126 124 PHE j 36 34 ASN k Protein S 2 FT #SUB 126 124 PHE j 38 36 LEU k Protein B 1 FT #SUB 127 125 GLN j 38 36 LEU k Protein B 1 FT #HET 13 11 LYS j 33 201 JNI j S 1 FT #HET 59 57 LEU j 33 201 JNI j S 2 FT #HET 61 59 TYR j 33 201 JNI j S 1 FT #HET 121 119 TYR j 34 202 JNI j S 10 FT #HET 122 120 LEU j 33 201 JNI j B 1 FT #HET 123 121 GLY j 33 201 JNI j B 6 FT #HET 124 122 GLY j 33 201 JNI j B 1 FT #HET 153 151 TYR j 33 201 JNI j S 4 FT #HET 157 155 ILE j 32 202 JNI h S 1 FT #HET 159 157 LEU j 33 201 JNI j B 1 FT DISORDER 1 9 CC SEQUENCE 150 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPE GAEAKPWYEP IYLGGVFQLE CC KGDRLSAEIN RPDYLDFAES GQVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8k STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 88 86 SER k 129 127 GLU B Protein S 2 FT #SUB 89 87 TYR k 89 87 TYR B Protein S 23 FT #SUB 129 127 GLU k 88 86 SER B Protein S 1 FT #SUB 42 40 GLY k 75 73 HIS D Protein B 3 FT #SUB 44 42 GLU k 75 73 HIS D Protein S 6 FT #SUB 46 44 ARG k 139 137 ASN D Protein S 1 FT #SUB 46 44 ARG k 140 138 ARG D Protein S 11 FT #SUB 87 85 VAL k 99 97 ILE D Protein S 4 FT #SUB 88 86 SER k 94 92 ASN D Protein B 4 FT #SUB 88 86 SER k 97 95 SER D Protein S 1 FT #SUB 89 87 TYR k 92 90 LYS D Protein B 1 FT #SUB 89 87 TYR k 94 92 ASN D Protein B 2 FT #SUB 90 88 GLN k 81 79 THR D Protein S 1 FT #SUB 90 88 GLN k 92 90 LYS D Protein S 2 FT #SUB 90 88 GLN k 94 92 ASN D Protein S 1 FT #SUB 91 89 THR k 91 89 THR D Protein S 2 FT #SUB 91 89 THR k 92 90 LYS D Protein S 1 FT #SUB 130 128 LYS k 101 99 SER D Protein S 2 FT #SUB 131 129 GLY k 77 75 LEU D Protein B 1 FT #SUB 75 73 HIS k 41 39 ASN Y Protein S 6 FT #SUB 75 73 HIS k 42 40 GLY Y Protein S 11 FT #SUB 81 79 THR k 90 88 GLN Y Protein S 3 FT #SUB 83 81 SER k 90 88 GLN Y Protein S 2 FT #SUB 91 89 THR k 91 89 THR Y Protein S 2 FT #SUB 92 90 LYS k 90 88 GLN Y Protein A 7 FT #SUB 92 90 LYS k 91 89 THR Y Protein B 3 FT #SUB 94 92 ASN k 88 86 SER Y Protein S 5 FT #SUB 94 92 ASN k 89 87 TYR Y Protein A 3 FT #SUB 94 92 ASN k 90 88 GLN Y Protein S 1 FT #SUB 97 95 SER k 88 86 SER Y Protein S 2 FT #SUB 99 97 ILE k 87 85 VAL Y Protein S 4 FT #SUB 101 99 SER k 130 128 LYS Y Protein S 2 FT #SUB 139 137 ASN k 46 44 ARG Y Protein B 1 FT #SUB 140 138 ARG k 46 44 ARG Y Protein S 13 FT #SUB 142 140 ASP k 46 44 ARG Y Protein S 1 FT #SUB 57 55 LEU k 123 121 GLY i Protein S 2 FT #SUB 95 93 LEU k 127 125 GLN i Protein B 1 FT #SUB 96 94 LEU k 127 125 GLN i Protein A 5 FT #SUB 97 95 SER k 127 125 GLN i Protein A 12 FT #SUB 123 121 GLY k 57 55 LEU i Protein B 1 FT #SUB 124 122 GLY k 125 123 VAL i Protein B 4 FT #SUB 125 123 VAL k 124 122 GLY i Protein A 4 FT #SUB 125 123 VAL k 125 123 VAL i Protein A 12 FT #SUB 125 123 VAL k 126 124 PHE i Protein B 2 FT #SUB 126 124 PHE k 125 123 VAL i Protein S 2 FT #SUB 126 124 PHE k 126 124 PHE i Protein S 4 FT #SUB 127 125 GLN k 96 94 LEU i Protein S 5 FT #SUB 127 125 GLN k 97 95 SER i Protein S 10 FT #SUB 15 13 VAL k 57 55 LEU j Protein S 1 FT #SUB 17 15 HIS k 125 123 VAL j Protein S 4 FT #SUB 17 15 HIS k 126 124 PHE j Protein S 6 FT #SUB 36 34 ASN k 84 82 ARG j Protein S 3 FT #SUB 36 34 ASN k 93 91 VAL j Protein S 1 FT #SUB 36 34 ASN k 95 93 LEU j Protein S 4 FT #SUB 36 34 ASN k 126 124 PHE j Protein B 2 FT #SUB 38 36 LEU k 57 55 LEU j Protein S 1 FT #SUB 38 36 LEU k 126 124 PHE j Protein S 1 FT #SUB 38 36 LEU k 127 125 GLN j Protein S 1 FT #SUB 61 59 TYR k 123 121 GLY j Protein S 2 FT #SUB 61 59 TYR k 124 122 GLY j Protein S 4 FT #SUB 61 59 TYR k 125 123 VAL j Protein S 3 FT #SUB 63 61 GLN k 97 95 SER j Protein S 2 FT #SUB 63 61 GLN k 98 96 ALA j Protein S 1 FT #SUB 63 61 GLN k 122 120 LEU j Protein S 1 FT #SUB 65 63 LEU k 99 97 ILE j Protein S 2 FT #SUB 104 102 GLN k 104 102 GLN j Protein S 1 FT #SUB 105 103 ARG k 105 103 ARG j Protein S 5 FT #SUB 106 104 GLU k 105 103 ARG j Protein B 2 FT #SUB 114 112 LYS k 75 73 HIS j Protein A 2 FT #SUB 115 113 PRO k 75 73 HIS j Protein S 1 FT #SUB 117 115 TYR k 77 75 LEU j Protein S 1 FT #SUB 117 115 TYR k 99 97 ILE j Protein S 7 FT #SUB 118 116 GLU k 100 98 LYS j Protein S 2 FT #SUB 119 117 PRO k 99 97 ILE j Protein S 2 FT #SUB 119 117 PRO k 100 98 LYS j Protein S 3 FT #SUB 121 119 TYR k 120 118 ILE j Protein S 1 FT #SUB 121 119 TYR k 121 119 TYR j Protein S 5 FT #SUB 149 147 SER k 94 92 ASN j Protein A 3 FT #SUB 150 148 GLY k 94 92 ASN j Protein B 1 FT #SUB 150 148 GLY k 95 93 LEU j Protein B 2 FT #SUB 150 148 GLY k 96 94 LEU j Protein B 3 FT #SUB 150 148 GLY k 97 95 SER j Protein B 6 FT #SUB 151 149 GLN k 97 95 SER j Protein B 2 FT #SUB 151 149 GLN k 99 97 ILE j Protein S 1 FT #SUB 153 151 TYR k 96 94 LEU j Protein S 2 FT #SUB 153 151 TYR k 123 121 GLY j Protein S 4 FT #SUB 157 155 ILE k 59 57 LEU j Protein S 1 FT #HET 13 11 LYS k 31 201 JNI h S 1 FT #HET 59 57 LEU k 33 201 JNI j S 1 FT #HET 61 59 TYR k 33 201 JNI j S 2 FT #HET 121 119 TYR k 34 202 JNI j A 10 FT #HET 159 157 LEU k 31 201 JNI h B 1 FT #HET 159 157 LEU k 33 201 JNI j A 6 FT DISORDER 1 10 FT DISORDER 107 113 CC SEQUENCE 142 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQREKPWY EPIYLGGVFQ LEKGDRLSAE CC INRPDYLDFA ESGQVYFGII AL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRE-------KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ****** ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8l STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 57 55 LEU l 15 13 VAL m Protein S 1 FT #SUB 59 57 LEU l 157 155 ILE m Protein S 1 FT #SUB 75 73 HIS l 114 112 LYS m Protein S 2 FT #SUB 75 73 HIS l 115 113 PRO m Protein S 4 FT #SUB 77 75 LEU l 117 115 TYR m Protein S 2 FT #SUB 84 82 ARG l 36 34 ASN m Protein S 2 FT #SUB 93 91 VAL l 36 34 ASN m Protein S 1 FT #SUB 94 92 ASN l 148 146 GLU m Protein S 1 FT #SUB 94 92 ASN l 149 147 SER m Protein S 4 FT #SUB 95 93 LEU l 36 34 ASN m Protein S 3 FT #SUB 95 93 LEU l 150 148 GLY m Protein B 2 FT #SUB 96 94 LEU l 150 148 GLY m Protein B 2 FT #SUB 96 94 LEU l 153 151 TYR m Protein S 4 FT #SUB 97 95 SER l 63 61 GLN m Protein B 4 FT #SUB 97 95 SER l 150 148 GLY m Protein B 4 FT #SUB 97 95 SER l 151 149 GLN m Protein B 2 FT #SUB 98 96 ALA l 63 61 GLN m Protein A 2 FT #SUB 99 97 ILE l 65 63 LEU m Protein B 2 FT #SUB 99 97 ILE l 117 115 TYR m Protein A 5 FT #SUB 99 97 ILE l 119 117 PRO m Protein B 2 FT #SUB 100 98 LYS l 118 116 GLU m Protein S 1 FT #SUB 100 98 LYS l 119 117 PRO m Protein S 5 FT #SUB 101 99 SER l 116 114 TRP m Protein S 2 FT #SUB 101 99 SER l 117 115 TYR m Protein S 7 FT #SUB 104 102 GLN l 102 100 PRO m Protein S 2 FT #SUB 104 102 GLN l 103 101 CYS m Protein S 1 FT #SUB 104 102 GLN l 104 102 GLN m Protein S 2 FT #SUB 105 103 ARG l 105 103 ARG m Protein S 3 FT #SUB 121 119 TYR l 121 119 TYR m Protein S 5 FT #SUB 122 120 LEU l 63 61 GLN m Protein S 1 FT #SUB 122 120 LEU l 153 151 TYR m Protein B 1 FT #SUB 123 121 GLY l 121 119 TYR m Protein B 1 FT #SUB 123 121 GLY l 153 151 TYR m Protein B 4 FT #SUB 124 122 GLY l 61 59 TYR m Protein B 2 FT #SUB 125 123 VAL l 16 14 ALA m Protein S 1 FT #SUB 125 123 VAL l 17 15 HIS m Protein A 5 FT #SUB 125 123 VAL l 61 59 TYR m Protein A 3 FT #SUB 125 123 VAL l 157 155 ILE m Protein S 1 FT #SUB 126 124 PHE l 17 15 HIS m Protein S 2 FT #SUB 126 124 PHE l 36 34 ASN m Protein S 4 FT #SUB 126 124 PHE l 38 36 LEU m Protein B 1 FT #SUB 127 125 GLN l 38 36 LEU m Protein B 1 FT #SUB 11 9 SER l 149 147 SER n Protein S 2 FT #SUB 38 36 LEU l 38 36 LEU n Protein S 1 FT #SUB 149 147 SER l 11 9 SER n Protein B 3 FT #SUB 149 147 SER l 12 10 ASP n Protein A 4 FT #SUB 149 147 SER l 13 11 LYS n Protein S 1 FT #SUB 151 149 GLN l 11 9 SER n Protein S 4 FT #HET 17 15 HIS l 36 201 JNI n S 3 FT #HET 59 57 LEU l 35 201 JNI l S 3 FT #HET 61 59 TYR l 35 201 JNI l S 1 FT #HET 62 60 SER l 35 201 JNI l B 3 FT #HET 63 61 GLN l 35 201 JNI l S 1 FT #HET 119 117 PRO l 35 201 JNI l S 1 FT #HET 121 119 TYR l 35 201 JNI l A 15 FT #HET 122 120 LEU l 35 201 JNI l B 4 FT #HET 123 121 GLY l 35 201 JNI l B 5 FT #HET 124 122 GLY l 35 201 JNI l B 1 FT #HET 153 151 TYR l 35 201 JNI l S 6 FT DISORDER 1 10 FT DISORDER 32 37 CC SEQUENCE 143 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPEGAEAKPW YEPIYLGGVF QLEKGDRLSA CC EINRPDYLDF AESGQVYFGI IAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8m STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 15 13 VAL m 57 55 LEU l Protein S 1 FT #SUB 16 14 ALA m 125 123 VAL l Protein B 1 FT #SUB 17 15 HIS m 125 123 VAL l Protein S 5 FT #SUB 17 15 HIS m 126 124 PHE l Protein S 2 FT #SUB 36 34 ASN m 84 82 ARG l Protein S 2 FT #SUB 36 34 ASN m 93 91 VAL l Protein S 1 FT #SUB 36 34 ASN m 95 93 LEU l Protein S 3 FT #SUB 36 34 ASN m 126 124 PHE l Protein A 4 FT #SUB 38 36 LEU m 126 124 PHE l Protein S 1 FT #SUB 38 36 LEU m 127 125 GLN l Protein S 1 FT #SUB 61 59 TYR m 124 122 GLY l Protein S 2 FT #SUB 61 59 TYR m 125 123 VAL l Protein S 3 FT #SUB 63 61 GLN m 97 95 SER l Protein S 4 FT #SUB 63 61 GLN m 98 96 ALA l Protein S 2 FT #SUB 63 61 GLN m 122 120 LEU l Protein S 1 FT #SUB 65 63 LEU m 99 97 ILE l Protein S 2 FT #SUB 102 100 PRO m 104 102 GLN l Protein B 2 FT #SUB 103 101 CYS m 104 102 GLN l Protein B 1 FT #SUB 104 102 GLN m 104 102 GLN l Protein B 2 FT #SUB 105 103 ARG m 105 103 ARG l Protein S 3 FT #SUB 114 112 LYS m 75 73 HIS l Protein S 2 FT #SUB 115 113 PRO m 75 73 HIS l Protein B 4 FT #SUB 116 114 TRP m 101 99 SER l Protein B 2 FT #SUB 117 115 TYR m 77 75 LEU l Protein S 2 FT #SUB 117 115 TYR m 99 97 ILE l Protein S 5 FT #SUB 117 115 TYR m 101 99 SER l Protein A 7 FT #SUB 118 116 GLU m 100 98 LYS l Protein S 1 FT #SUB 119 117 PRO m 99 97 ILE l Protein S 2 FT #SUB 119 117 PRO m 100 98 LYS l Protein A 5 FT #SUB 121 119 TYR m 121 119 TYR l Protein S 5 FT #SUB 121 119 TYR m 123 121 GLY l Protein S 1 FT #SUB 148 146 GLU m 94 92 ASN l Protein S 1 FT #SUB 149 147 SER m 94 92 ASN l Protein B 4 FT #SUB 150 148 GLY m 95 93 LEU l Protein B 2 FT #SUB 150 148 GLY m 96 94 LEU l Protein B 2 FT #SUB 150 148 GLY m 97 95 SER l Protein B 4 FT #SUB 151 149 GLN m 97 95 SER l Protein A 2 FT #SUB 153 151 TYR m 96 94 LEU l Protein S 4 FT #SUB 153 151 TYR m 122 120 LEU l Protein S 1 FT #SUB 153 151 TYR m 123 121 GLY l Protein S 4 FT #SUB 157 155 ILE m 59 57 LEU l Protein S 1 FT #SUB 157 155 ILE m 125 123 VAL l Protein S 1 FT #SUB 57 55 LEU m 123 121 GLY o Protein S 2 FT #SUB 95 93 LEU m 127 125 GLN o Protein B 1 FT #SUB 96 94 LEU m 127 125 GLN o Protein S 1 FT #SUB 97 95 SER m 127 125 GLN o Protein A 6 FT #SUB 123 121 GLY m 57 55 LEU o Protein B 2 FT #SUB 124 122 GLY m 125 123 VAL o Protein B 3 FT #SUB 125 123 VAL m 124 122 GLY o Protein B 2 FT #SUB 125 123 VAL m 125 123 VAL o Protein A 6 FT #SUB 125 123 VAL m 126 124 PHE o Protein B 2 FT #SUB 126 124 PHE m 125 123 VAL o Protein S 1 FT #SUB 126 124 PHE m 126 124 PHE o Protein S 3 FT #SUB 127 125 GLN m 95 93 LEU o Protein S 1 FT #SUB 127 125 GLN m 96 94 LEU o Protein S 3 FT #SUB 127 125 GLN m 97 95 SER o Protein S 11 FT #SUB 89 87 TYR m 89 87 TYR q Protein S 13 FT #SUB 41 39 ASN m 75 73 HIS s Protein B 1 FT #SUB 42 40 GLY m 75 73 HIS s Protein B 8 FT #SUB 44 42 GLU m 75 73 HIS s Protein S 3 FT #SUB 44 42 GLU m 140 138 ARG s Protein S 1 FT #SUB 46 44 ARG m 139 137 ASN s Protein S 1 FT #SUB 46 44 ARG m 140 138 ARG s Protein S 11 FT #SUB 87 85 VAL m 81 79 THR s Protein S 1 FT #SUB 88 86 SER m 94 92 ASN s Protein B 4 FT #SUB 89 87 TYR m 94 92 ASN s Protein B 2 FT #SUB 90 88 GLN m 81 79 THR s Protein S 3 FT #SUB 90 88 GLN m 83 81 SER s Protein S 1 FT #SUB 90 88 GLN m 92 90 LYS s Protein B 3 FT #SUB 91 89 THR m 92 90 LYS s Protein S 1 FT #SUB 130 128 LYS m 101 99 SER s Protein S 2 FT #HET 57 55 LEU m 37 202 JNI n S 3 FT #HET 121 119 TYR m 35 201 JNI l S 7 FT #HET 123 121 GLY m 35 201 JNI l B 3 FT #HET 127 125 GLN m 37 202 JNI n S 1 FT #HET 159 157 LEU m 37 202 JNI n S 4 FT DISORDER 1 10 FT DISORDER 109 110 CC SEQUENCE 147 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPAE AKPWYEPIYL GGVFQLEKGD CC RLSAEINRPD YLDFAESGQV YFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP--AEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** **************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8n STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 107 105 THR n 23 21 GLN Z Protein B 3 FT #SUB 108 106 PRO n 21 19 ASN Z Protein S 1 FT #SUB 109 107 GLU n 31 29 LEU Z Protein B 1 FT #SUB 113 111 ALA n 23 21 GLN Z Protein S 1 FT #SUB 11 9 SER n 149 147 SER l Protein S 3 FT #SUB 11 9 SER n 151 149 GLN l Protein S 4 FT #SUB 12 10 ASP n 149 147 SER l Protein A 4 FT #SUB 13 11 LYS n 149 147 SER l Protein S 1 FT #SUB 38 36 LEU n 38 36 LEU l Protein S 1 FT #SUB 149 147 SER n 11 9 SER l Protein S 2 FT #SUB 75 73 HIS n 115 113 PRO o Protein S 2 FT #SUB 84 82 ARG n 36 34 ASN o Protein S 1 FT #SUB 93 91 VAL n 36 34 ASN o Protein S 1 FT #SUB 94 92 ASN n 149 147 SER o Protein A 5 FT #SUB 95 93 LEU n 36 34 ASN o Protein S 2 FT #SUB 95 93 LEU n 150 148 GLY o Protein B 2 FT #SUB 96 94 LEU n 150 148 GLY o Protein B 2 FT #SUB 96 94 LEU n 153 151 TYR o Protein S 3 FT #SUB 97 95 SER n 63 61 GLN o Protein B 3 FT #SUB 97 95 SER n 150 148 GLY o Protein B 4 FT #SUB 97 95 SER n 151 149 GLN o Protein B 1 FT #SUB 98 96 ALA n 63 61 GLN o Protein A 2 FT #SUB 98 96 ALA n 121 119 TYR o Protein S 1 FT #SUB 99 97 ILE n 65 63 LEU o Protein B 1 FT #SUB 99 97 ILE n 117 115 TYR o Protein A 5 FT #SUB 99 97 ILE n 119 117 PRO o Protein B 2 FT #SUB 99 97 ILE n 151 149 GLN o Protein S 1 FT #SUB 100 98 LYS n 117 115 TYR o Protein S 1 FT #SUB 100 98 LYS n 118 116 GLU o Protein S 2 FT #SUB 100 98 LYS n 119 117 PRO o Protein S 1 FT #SUB 101 99 SER n 117 115 TYR o Protein A 7 FT #SUB 104 102 GLN n 104 102 GLN o Protein S 4 FT #SUB 105 103 ARG n 105 103 ARG o Protein S 4 FT #SUB 120 118 ILE n 121 119 TYR o Protein A 3 FT #SUB 121 119 TYR n 121 119 TYR o Protein B 7 FT #SUB 123 121 GLY n 153 151 TYR o Protein B 4 FT #SUB 124 122 GLY n 61 59 TYR o Protein B 1 FT #SUB 125 123 VAL n 16 14 ALA o Protein S 1 FT #SUB 125 123 VAL n 17 15 HIS o Protein B 2 FT #SUB 125 123 VAL n 61 59 TYR o Protein A 2 FT #SUB 125 123 VAL n 157 155 ILE o Protein S 2 FT #SUB 126 124 PHE n 17 15 HIS o Protein S 3 FT #SUB 126 124 PHE n 36 34 ASN o Protein S 4 FT #SUB 126 124 PHE n 38 36 LEU o Protein B 2 FT #SUB 127 125 GLN n 38 36 LEU o Protein B 1 FT #HET 15 13 VAL n 36 201 JNI n S 1 FT #HET 17 15 HIS n 36 201 JNI n S 1 FT #HET 59 57 LEU n 38 201 JNI o S 4 FT #HET 61 59 TYR n 38 201 JNI o S 2 FT #HET 121 119 TYR n 37 202 JNI n S 11 FT #HET 122 120 LEU n 38 201 JNI o B 1 FT #HET 123 121 GLY n 38 201 JNI o B 5 FT #HET 124 122 GLY n 38 201 JNI o B 1 FT #HET 153 151 TYR n 38 201 JNI o S 1 FT #HET 157 155 ILE n 36 201 JNI n S 3 FT DISORDER 1 9 FT DISORDER 110 112 CC SEQUENCE 147 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPE AKPWYEPIYL GGVFQLEKGD CC RLSAEINRPD YLDFAESGQV YFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPE---AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ********* ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8o STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 73 71 SER o 89 87 TYR A Protein S 1 FT #SUB 106 104 GLU o 89 87 TYR A Protein S 1 FT #SUB 109 107 GLU o 33 31 ARG B Protein B 1 FT #SUB 109 107 GLU o 34 32 ARG B Protein S 4 FT #SUB 109 107 GLU o 35 33 ALA B Protein S 6 FT #SUB 57 55 LEU o 123 121 GLY m Protein S 2 FT #SUB 95 93 LEU o 127 125 GLN m Protein B 1 FT #SUB 96 94 LEU o 127 125 GLN m Protein A 3 FT #SUB 97 95 SER o 127 125 GLN m Protein A 11 FT #SUB 123 121 GLY o 57 55 LEU m Protein B 2 FT #SUB 124 122 GLY o 125 123 VAL m Protein B 2 FT #SUB 125 123 VAL o 124 122 GLY m Protein A 3 FT #SUB 125 123 VAL o 125 123 VAL m Protein A 6 FT #SUB 125 123 VAL o 126 124 PHE m Protein B 1 FT #SUB 126 124 PHE o 125 123 VAL m Protein S 2 FT #SUB 126 124 PHE o 126 124 PHE m Protein S 3 FT #SUB 127 125 GLN o 95 93 LEU m Protein S 1 FT #SUB 127 125 GLN o 96 94 LEU m Protein S 1 FT #SUB 127 125 GLN o 97 95 SER m Protein S 6 FT #SUB 16 14 ALA o 125 123 VAL n Protein B 1 FT #SUB 17 15 HIS o 125 123 VAL n Protein S 2 FT #SUB 17 15 HIS o 126 124 PHE n Protein S 3 FT #SUB 36 34 ASN o 84 82 ARG n Protein S 1 FT #SUB 36 34 ASN o 93 91 VAL n Protein S 1 FT #SUB 36 34 ASN o 95 93 LEU n Protein S 2 FT #SUB 36 34 ASN o 126 124 PHE n Protein A 4 FT #SUB 38 36 LEU o 126 124 PHE n Protein S 2 FT #SUB 38 36 LEU o 127 125 GLN n Protein S 1 FT #SUB 61 59 TYR o 124 122 GLY n Protein S 1 FT #SUB 61 59 TYR o 125 123 VAL n Protein S 2 FT #SUB 63 61 GLN o 97 95 SER n Protein S 3 FT #SUB 63 61 GLN o 98 96 ALA n Protein S 2 FT #SUB 65 63 LEU o 99 97 ILE n Protein S 1 FT #SUB 104 102 GLN o 104 102 GLN n Protein S 4 FT #SUB 105 103 ARG o 105 103 ARG n Protein S 4 FT #SUB 115 113 PRO o 75 73 HIS n Protein B 2 FT #SUB 117 115 TYR o 99 97 ILE n Protein S 5 FT #SUB 117 115 TYR o 100 98 LYS n Protein B 1 FT #SUB 117 115 TYR o 101 99 SER n Protein A 7 FT #SUB 118 116 GLU o 100 98 LYS n Protein S 2 FT #SUB 119 117 PRO o 99 97 ILE n Protein S 2 FT #SUB 119 117 PRO o 100 98 LYS n Protein S 1 FT #SUB 121 119 TYR o 98 96 ALA n Protein S 1 FT #SUB 121 119 TYR o 120 118 ILE n Protein S 3 FT #SUB 121 119 TYR o 121 119 TYR n Protein S 7 FT #SUB 149 147 SER o 94 92 ASN n Protein A 5 FT #SUB 150 148 GLY o 95 93 LEU n Protein B 2 FT #SUB 150 148 GLY o 96 94 LEU n Protein B 2 FT #SUB 150 148 GLY o 97 95 SER n Protein B 4 FT #SUB 151 149 GLN o 97 95 SER n Protein B 1 FT #SUB 151 149 GLN o 99 97 ILE n Protein S 1 FT #SUB 153 151 TYR o 96 94 LEU n Protein S 3 FT #SUB 153 151 TYR o 123 121 GLY n Protein S 4 FT #SUB 157 155 ILE o 125 123 VAL n Protein S 2 FT #SUB 75 73 HIS o 41 39 ASN q Protein S 1 FT #SUB 75 73 HIS o 42 40 GLY q Protein S 3 FT #SUB 77 75 LEU o 131 129 GLY q Protein S 1 FT #SUB 79 77 THR o 87 85 VAL q Protein S 1 FT #SUB 81 79 THR o 87 85 VAL q Protein S 1 FT #SUB 81 79 THR o 90 88 GLN q Protein S 1 FT #SUB 83 81 SER o 90 88 GLN q Protein S 2 FT #SUB 91 89 THR o 91 89 THR q Protein S 2 FT #SUB 92 90 LYS o 89 87 TYR q Protein B 1 FT #SUB 92 90 LYS o 90 88 GLN q Protein A 6 FT #SUB 92 90 LYS o 91 89 THR q Protein B 1 FT #SUB 94 92 ASN o 87 85 VAL q Protein S 1 FT #SUB 94 92 ASN o 88 86 SER q Protein S 5 FT #SUB 94 92 ASN o 89 87 TYR q Protein A 3 FT #SUB 94 92 ASN o 90 88 GLN q Protein S 2 FT #SUB 99 97 ILE o 87 85 VAL q Protein S 3 FT #SUB 99 97 ILE o 130 128 LYS q Protein S 1 FT #SUB 101 99 SER o 130 128 LYS q Protein S 2 FT #SUB 139 137 ASN o 46 44 ARG q Protein B 1 FT #SUB 140 138 ARG o 44 42 GLU q Protein S 1 FT #SUB 140 138 ARG o 46 44 ARG q Protein S 14 FT #HET 13 11 LYS o 38 201 JNI o S 4 FT #HET 59 57 LEU o 38 201 JNI o S 4 FT #HET 121 119 TYR o 37 202 JNI n A 9 FT #HET 123 121 GLY o 37 202 JNI n B 3 FT #HET 158 156 ALA o 38 201 JNI o B 1 FT #HET 159 157 LEU o 38 201 JNI o A 8 FT DISORDER 1 10 FT DISORDER 112 113 CC SEQUENCE 147 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AKPWYEPIYL GGVFQLEKGD CC RLSAEINRPD YLDFAESGQV YFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGA--KPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC *********** ************************************* CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8p STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 88 86 SER p 137 135 GLU A Protein A 4 FT #SUB 89 87 TYR p 27 25 GLN A Protein A 3 FT #SUB 89 87 TYR p 28 26 LEU A Protein S 2 FT #SUB 89 87 TYR p 29 27 GLN A Protein S 4 FT #SUB 89 87 TYR p 48 46 ASN A Protein S 7 FT #SUB 90 88 GLN p 26 24 GLY A Protein S 1 FT #SUB 91 89 THR p 27 25 GLN A Protein S 3 FT #SUB 57 55 LEU p 11 9 SER q Protein S 1 FT #SUB 57 55 LEU p 15 13 VAL q Protein S 1 FT #SUB 57 55 LEU p 40 38 ALA q Protein S 1 FT #SUB 59 57 LEU p 157 155 ILE q Protein S 1 FT #SUB 75 73 HIS p 114 112 LYS q Protein S 5 FT #SUB 75 73 HIS p 115 113 PRO q Protein S 7 FT #SUB 77 75 LEU p 117 115 TYR q Protein S 3 FT #SUB 84 82 ARG p 36 34 ASN q Protein S 4 FT #SUB 94 92 ASN p 148 146 GLU q Protein S 1 FT #SUB 94 92 ASN p 149 147 SER q Protein S 6 FT #SUB 95 93 LEU p 36 34 ASN q Protein S 4 FT #SUB 95 93 LEU p 150 148 GLY q Protein B 2 FT #SUB 96 94 LEU p 150 148 GLY q Protein B 2 FT #SUB 96 94 LEU p 153 151 TYR q Protein S 4 FT #SUB 97 95 SER p 63 61 GLN q Protein B 2 FT #SUB 97 95 SER p 149 147 SER q Protein S 1 FT #SUB 97 95 SER p 150 148 GLY q Protein A 8 FT #SUB 97 95 SER p 151 149 GLN q Protein B 4 FT #SUB 98 96 ALA p 63 61 GLN q Protein S 2 FT #SUB 99 97 ILE p 65 63 LEU q Protein B 2 FT #SUB 99 97 ILE p 117 115 TYR q Protein A 7 FT #SUB 99 97 ILE p 119 117 PRO q Protein B 2 FT #SUB 99 97 ILE p 151 149 GLN q Protein S 1 FT #SUB 100 98 LYS p 117 115 TYR q Protein B 3 FT #SUB 100 98 LYS p 119 117 PRO q Protein S 5 FT #SUB 101 99 SER p 115 113 PRO q Protein S 1 FT #SUB 101 99 SER p 116 114 TRP q Protein S 2 FT #SUB 101 99 SER p 117 115 TYR q Protein A 7 FT #SUB 104 102 GLN p 104 102 GLN q Protein S 1 FT #SUB 104 102 GLN p 114 112 LYS q Protein B 2 FT #SUB 105 103 ARG p 105 103 ARG q Protein S 5 FT #SUB 121 119 TYR p 121 119 TYR q Protein S 4 FT #SUB 122 120 LEU p 63 61 GLN q Protein S 3 FT #SUB 122 120 LEU p 153 151 TYR q Protein A 2 FT #SUB 123 121 GLY p 61 59 TYR q Protein B 2 FT #SUB 123 121 GLY p 121 119 TYR q Protein B 1 FT #SUB 123 121 GLY p 153 151 TYR q Protein B 5 FT #SUB 124 122 GLY p 61 59 TYR q Protein B 3 FT #SUB 125 123 VAL p 16 14 ALA q Protein S 2 FT #SUB 125 123 VAL p 17 15 HIS q Protein A 5 FT #SUB 125 123 VAL p 61 59 TYR q Protein A 4 FT #SUB 125 123 VAL p 157 155 ILE q Protein S 1 FT #SUB 126 124 PHE p 17 15 HIS q Protein S 9 FT #SUB 126 124 PHE p 36 34 ASN q Protein S 3 FT #SUB 126 124 PHE p 38 36 LEU q Protein B 2 FT #SUB 127 125 GLN p 38 36 LEU q Protein A 2 FT #SUB 159 157 LEU p 11 9 SER q Protein B 4 FT #SUB 11 9 SER p 148 146 GLU r Protein A 5 FT #SUB 11 9 SER p 149 147 SER r Protein B 2 FT #SUB 149 147 SER p 12 10 ASP r Protein A 8 FT #HET 17 15 HIS p 40 202 JNI p S 9 FT #HET 59 57 LEU p 39 201 JNI p S 4 FT #HET 61 59 TYR p 39 201 JNI p S 5 FT #HET 63 61 GLN p 39 201 JNI p S 2 FT #HET 121 119 TYR p 39 201 JNI p S 19 FT #HET 122 120 LEU p 39 201 JNI p B 1 FT #HET 153 151 TYR p 39 201 JNI p S 7 FT DISORDER 1 10 FT DISORDER 32 37 FT DISORDER 109 112 CC SEQUENCE 139 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPAKPWYEPI YLGGVFQLEK GDRLSAEINR CC PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8q STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 21 19 ASN q 46 44 ARG A Protein S 2 FT #SUB 22 20 PRO q 46 44 ARG A Protein S 1 FT #SUB 23 21 GLN q 46 44 ARG A Protein S 1 FT #SUB 31 29 LEU q 46 44 ARG A Protein S 2 FT #SUB 33 31 ARG q 87 85 VAL A Protein S 1 FT #SUB 33 31 ARG q 133 131 ARG A Protein A 10 FT #SUB 34 32 ARG q 46 44 ARG A Protein S 2 FT #SUB 34 32 ARG q 47 45 ASP A Protein S 8 FT #SUB 34 32 ARG q 133 131 ARG A Protein B 3 FT #SUB 35 33 ALA q 47 45 ASP A Protein B 1 FT #SUB 89 87 TYR q 89 87 TYR m Protein S 13 FT #SUB 41 39 ASN q 75 73 HIS o Protein B 1 FT #SUB 42 40 GLY q 75 73 HIS o Protein B 3 FT #SUB 44 42 GLU q 140 138 ARG o Protein S 1 FT #SUB 46 44 ARG q 139 137 ASN o Protein S 1 FT #SUB 46 44 ARG q 140 138 ARG o Protein S 14 FT #SUB 87 85 VAL q 79 77 THR o Protein S 1 FT #SUB 87 85 VAL q 81 79 THR o Protein B 1 FT #SUB 87 85 VAL q 94 92 ASN o Protein B 1 FT #SUB 87 85 VAL q 99 97 ILE o Protein S 3 FT #SUB 88 86 SER q 94 92 ASN o Protein B 5 FT #SUB 89 87 TYR q 92 90 LYS o Protein B 1 FT #SUB 89 87 TYR q 94 92 ASN o Protein B 3 FT #SUB 90 88 GLN q 81 79 THR o Protein S 1 FT #SUB 90 88 GLN q 83 81 SER o Protein S 2 FT #SUB 90 88 GLN q 92 90 LYS o Protein B 6 FT #SUB 90 88 GLN q 94 92 ASN o Protein S 2 FT #SUB 91 89 THR q 91 89 THR o Protein S 2 FT #SUB 91 89 THR q 92 90 LYS o Protein S 1 FT #SUB 130 128 LYS q 99 97 ILE o Protein S 1 FT #SUB 130 128 LYS q 101 99 SER o Protein S 2 FT #SUB 131 129 GLY q 77 75 LEU o Protein B 1 FT #SUB 11 9 SER q 57 55 LEU p Protein B 1 FT #SUB 11 9 SER q 159 157 LEU p Protein B 4 FT #SUB 15 13 VAL q 57 55 LEU p Protein S 1 FT #SUB 16 14 ALA q 125 123 VAL p Protein B 2 FT #SUB 17 15 HIS q 125 123 VAL p Protein S 5 FT #SUB 17 15 HIS q 126 124 PHE p Protein S 9 FT #SUB 36 34 ASN q 84 82 ARG p Protein S 4 FT #SUB 36 34 ASN q 95 93 LEU p Protein S 4 FT #SUB 36 34 ASN q 126 124 PHE p Protein B 3 FT #SUB 38 36 LEU q 126 124 PHE p Protein S 2 FT #SUB 38 36 LEU q 127 125 GLN p Protein S 2 FT #SUB 40 38 ALA q 57 55 LEU p Protein S 1 FT #SUB 61 59 TYR q 123 121 GLY p Protein S 2 FT #SUB 61 59 TYR q 124 122 GLY p Protein S 3 FT #SUB 61 59 TYR q 125 123 VAL p Protein S 4 FT #SUB 63 61 GLN q 97 95 SER p Protein S 2 FT #SUB 63 61 GLN q 98 96 ALA p Protein S 2 FT #SUB 63 61 GLN q 122 120 LEU p Protein S 3 FT #SUB 65 63 LEU q 99 97 ILE p Protein S 2 FT #SUB 104 102 GLN q 104 102 GLN p Protein S 1 FT #SUB 105 103 ARG q 105 103 ARG p Protein S 5 FT #SUB 114 112 LYS q 75 73 HIS p Protein S 5 FT #SUB 114 112 LYS q 104 102 GLN p Protein S 2 FT #SUB 115 113 PRO q 75 73 HIS p Protein A 7 FT #SUB 115 113 PRO q 101 99 SER p Protein B 1 FT #SUB 116 114 TRP q 101 99 SER p Protein B 2 FT #SUB 117 115 TYR q 77 75 LEU p Protein S 3 FT #SUB 117 115 TYR q 99 97 ILE p Protein S 7 FT #SUB 117 115 TYR q 100 98 LYS p Protein S 3 FT #SUB 117 115 TYR q 101 99 SER p Protein A 7 FT #SUB 119 117 PRO q 99 97 ILE p Protein S 2 FT #SUB 119 117 PRO q 100 98 LYS p Protein S 5 FT #SUB 121 119 TYR q 121 119 TYR p Protein S 4 FT #SUB 121 119 TYR q 123 121 GLY p Protein S 1 FT #SUB 148 146 GLU q 94 92 ASN p Protein S 1 FT #SUB 149 147 SER q 94 92 ASN p Protein B 6 FT #SUB 149 147 SER q 97 95 SER p Protein B 1 FT #SUB 150 148 GLY q 95 93 LEU p Protein B 2 FT #SUB 150 148 GLY q 96 94 LEU p Protein B 2 FT #SUB 150 148 GLY q 97 95 SER p Protein B 8 FT #SUB 151 149 GLN q 97 95 SER p Protein A 4 FT #SUB 151 149 GLN q 99 97 ILE p Protein S 1 FT #SUB 153 151 TYR q 96 94 LEU p Protein S 4 FT #SUB 153 151 TYR q 122 120 LEU p Protein S 2 FT #SUB 153 151 TYR q 123 121 GLY p Protein S 5 FT #SUB 157 155 ILE q 59 57 LEU p Protein S 1 FT #SUB 157 155 ILE q 125 123 VAL p Protein S 1 FT #SUB 57 55 LEU q 123 121 GLY s Protein S 2 FT #SUB 95 93 LEU q 127 125 GLN s Protein B 1 FT #SUB 96 94 LEU q 127 125 GLN s Protein A 3 FT #SUB 97 95 SER q 127 125 GLN s Protein B 6 FT #SUB 123 121 GLY q 57 55 LEU s Protein B 2 FT #SUB 124 122 GLY q 125 123 VAL s Protein B 4 FT #SUB 125 123 VAL q 124 122 GLY s Protein A 4 FT #SUB 125 123 VAL q 125 123 VAL s Protein A 6 FT #SUB 125 123 VAL q 126 124 PHE s Protein B 1 FT #SUB 126 124 PHE q 125 123 VAL s Protein S 3 FT #SUB 126 124 PHE q 126 124 PHE s Protein S 4 FT #SUB 127 125 GLN q 96 94 LEU s Protein S 2 FT #SUB 127 125 GLN q 97 95 SER s Protein S 10 FT #HET 57 55 LEU q 42 202 JNI r S 4 FT #HET 59 57 LEU q 39 201 JNI p S 1 FT #HET 61 59 TYR q 39 201 JNI p S 1 FT #HET 121 119 TYR q 39 201 JNI p S 7 FT #HET 123 121 GLY q 39 201 JNI p B 3 FT #HET 124 122 GLY q 39 201 JNI p B 1 FT #HET 127 125 GLN q 42 202 JNI r S 1 FT #HET 159 157 LEU q 42 202 JNI r A 9 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8r STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 73 71 SER r 46 44 ARG b Protein A 2 FT #SUB 12 10 ASP r 149 147 SER p Protein S 8 FT #SUB 148 146 GLU r 11 9 SER p Protein A 5 FT #SUB 149 147 SER r 11 9 SER p Protein B 2 FT #SUB 59 57 LEU r 157 155 ILE s Protein S 2 FT #SUB 84 82 ARG r 36 34 ASN s Protein S 2 FT #SUB 93 91 VAL r 36 34 ASN s Protein S 1 FT #SUB 94 92 ASN r 149 147 SER s Protein A 2 FT #SUB 95 93 LEU r 36 34 ASN s Protein S 3 FT #SUB 95 93 LEU r 150 148 GLY s Protein B 4 FT #SUB 96 94 LEU r 150 148 GLY s Protein B 2 FT #SUB 96 94 LEU r 153 151 TYR s Protein S 4 FT #SUB 97 95 SER r 63 61 GLN s Protein B 3 FT #SUB 97 95 SER r 149 147 SER s Protein S 1 FT #SUB 97 95 SER r 150 148 GLY s Protein A 6 FT #SUB 97 95 SER r 151 149 GLN s Protein B 1 FT #SUB 98 96 ALA r 63 61 GLN s Protein S 1 FT #SUB 98 96 ALA r 121 119 TYR s Protein S 1 FT #SUB 99 97 ILE r 65 63 LEU s Protein B 2 FT #SUB 99 97 ILE r 117 115 TYR s Protein B 1 FT #SUB 99 97 ILE r 119 117 PRO s Protein B 2 FT #SUB 100 98 LYS r 119 117 PRO s Protein S 1 FT #SUB 101 99 SER r 117 115 TYR s Protein S 1 FT #SUB 104 102 GLN r 105 103 ARG s Protein S 4 FT #SUB 104 102 GLN r 114 112 LYS s Protein B 2 FT #SUB 105 103 ARG r 105 103 ARG s Protein S 7 FT #SUB 120 118 ILE r 121 119 TYR s Protein S 1 FT #SUB 121 119 TYR r 121 119 TYR s Protein B 8 FT #SUB 122 120 LEU r 63 61 GLN s Protein S 1 FT #SUB 122 120 LEU r 153 151 TYR s Protein S 1 FT #SUB 123 121 GLY r 61 59 TYR s Protein B 2 FT #SUB 123 121 GLY r 153 151 TYR s Protein B 2 FT #SUB 124 122 GLY r 61 59 TYR s Protein B 4 FT #SUB 125 123 VAL r 17 15 HIS s Protein B 2 FT #SUB 125 123 VAL r 38 36 LEU s Protein B 1 FT #SUB 125 123 VAL r 61 59 TYR s Protein A 2 FT #SUB 125 123 VAL r 157 155 ILE s Protein S 3 FT #SUB 126 124 PHE r 17 15 HIS s Protein S 6 FT #SUB 126 124 PHE r 36 34 ASN s Protein S 2 FT #SUB 126 124 PHE r 38 36 LEU s Protein B 1 FT #SUB 127 125 GLN r 38 36 LEU s Protein B 1 FT #SUB 159 157 LEU r 157 155 ILE s Protein S 1 FT #HET 11 9 SER r 40 202 JNI p S 2 FT #HET 15 13 VAL r 40 202 JNI p S 2 FT #HET 17 15 HIS r 40 202 JNI p S 4 FT #HET 59 57 LEU r 41 201 JNI r S 4 FT #HET 61 59 TYR r 41 201 JNI r S 3 FT #HET 62 60 SER r 41 201 JNI r B 1 FT #HET 121 119 TYR r 42 202 JNI r S 27 FT #HET 122 120 LEU r 41 201 JNI r B 1 FT #HET 123 121 GLY r 41 201 JNI r B 7 FT #HET 153 151 TYR r 41 201 JNI r S 9 FT #HET 157 155 ILE r 40 202 JNI p S 4 FT #HET 157 155 ILE r 41 201 JNI r S 2 FT #HET 159 157 LEU r 41 201 JNI r S 4 FT DISORDER 1 9 FT DISORDER 109 114 CC SEQUENCE 144 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPP WYEPIYLGGV FQLEKGDRLS CC AEINRPDYLD FAESGQVYFG IIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP------PWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************ CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8s STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 75 73 HIS s 41 39 ASN m Protein S 1 FT #SUB 75 73 HIS s 42 40 GLY m Protein S 8 FT #SUB 75 73 HIS s 44 42 GLU m Protein B 3 FT #SUB 81 79 THR s 87 85 VAL m Protein S 1 FT #SUB 81 79 THR s 90 88 GLN m Protein S 3 FT #SUB 83 81 SER s 90 88 GLN m Protein S 1 FT #SUB 92 90 LYS s 90 88 GLN m Protein A 3 FT #SUB 92 90 LYS s 91 89 THR m Protein B 1 FT #SUB 94 92 ASN s 88 86 SER m Protein S 4 FT #SUB 94 92 ASN s 89 87 TYR m Protein A 2 FT #SUB 101 99 SER s 130 128 LYS m Protein S 2 FT #SUB 139 137 ASN s 46 44 ARG m Protein B 1 FT #SUB 140 138 ARG s 44 42 GLU m Protein S 1 FT #SUB 140 138 ARG s 46 44 ARG m Protein S 11 FT #SUB 57 55 LEU s 123 121 GLY q Protein S 2 FT #SUB 96 94 LEU s 127 125 GLN q Protein S 2 FT #SUB 97 95 SER s 127 125 GLN q Protein A 10 FT #SUB 123 121 GLY s 57 55 LEU q Protein B 2 FT #SUB 124 122 GLY s 125 123 VAL q Protein B 4 FT #SUB 125 123 VAL s 124 122 GLY q Protein A 4 FT #SUB 125 123 VAL s 125 123 VAL q Protein A 6 FT #SUB 125 123 VAL s 126 124 PHE q Protein B 3 FT #SUB 126 124 PHE s 125 123 VAL q Protein S 1 FT #SUB 126 124 PHE s 126 124 PHE q Protein S 4 FT #SUB 127 125 GLN s 95 93 LEU q Protein S 1 FT #SUB 127 125 GLN s 96 94 LEU q Protein S 3 FT #SUB 127 125 GLN s 97 95 SER q Protein S 6 FT #SUB 17 15 HIS s 125 123 VAL r Protein S 2 FT #SUB 17 15 HIS s 126 124 PHE r Protein S 6 FT #SUB 36 34 ASN s 84 82 ARG r Protein S 2 FT #SUB 36 34 ASN s 93 91 VAL r Protein S 1 FT #SUB 36 34 ASN s 95 93 LEU r Protein S 3 FT #SUB 36 34 ASN s 126 124 PHE r Protein B 2 FT #SUB 38 36 LEU s 125 123 VAL r Protein S 1 FT #SUB 38 36 LEU s 126 124 PHE r Protein S 1 FT #SUB 38 36 LEU s 127 125 GLN r Protein S 1 FT #SUB 61 59 TYR s 123 121 GLY r Protein S 2 FT #SUB 61 59 TYR s 124 122 GLY r Protein S 4 FT #SUB 61 59 TYR s 125 123 VAL r Protein S 2 FT #SUB 63 61 GLN s 97 95 SER r Protein S 3 FT #SUB 63 61 GLN s 98 96 ALA r Protein S 1 FT #SUB 63 61 GLN s 122 120 LEU r Protein S 1 FT #SUB 65 63 LEU s 99 97 ILE r Protein S 2 FT #SUB 105 103 ARG s 104 102 GLN r Protein S 4 FT #SUB 105 103 ARG s 105 103 ARG r Protein S 7 FT #SUB 114 112 LYS s 104 102 GLN r Protein S 2 FT #SUB 117 115 TYR s 99 97 ILE r Protein S 1 FT #SUB 117 115 TYR s 101 99 SER r Protein S 1 FT #SUB 119 117 PRO s 99 97 ILE r Protein S 2 FT #SUB 119 117 PRO s 100 98 LYS r Protein S 1 FT #SUB 121 119 TYR s 98 96 ALA r Protein S 1 FT #SUB 121 119 TYR s 120 118 ILE r Protein S 1 FT #SUB 121 119 TYR s 121 119 TYR r Protein S 8 FT #SUB 149 147 SER s 94 92 ASN r Protein A 2 FT #SUB 149 147 SER s 97 95 SER r Protein B 1 FT #SUB 150 148 GLY s 95 93 LEU r Protein B 4 FT #SUB 150 148 GLY s 96 94 LEU r Protein B 2 FT #SUB 150 148 GLY s 97 95 SER r Protein B 6 FT #SUB 151 149 GLN s 97 95 SER r Protein B 1 FT #SUB 153 151 TYR s 96 94 LEU r Protein S 4 FT #SUB 153 151 TYR s 122 120 LEU r Protein S 1 FT #SUB 153 151 TYR s 123 121 GLY r Protein S 2 FT #SUB 157 155 ILE s 59 57 LEU r Protein S 2 FT #SUB 157 155 ILE s 125 123 VAL r Protein S 3 FT #SUB 157 155 ILE s 159 157 LEU r Protein S 1 FT #HET 13 11 LYS s 41 201 JNI r S 2 FT #HET 59 57 LEU s 41 201 JNI r S 1 FT #HET 61 59 TYR s 41 201 JNI r S 5 FT #HET 121 119 TYR s 42 202 JNI r A 5 FT #HET 123 121 GLY s 42 202 JNI r B 2 FT #HET 159 157 LEU s 39 201 JNI p B 1 FT DISORDER 1 10 CC SEQUENCE 149 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK CC GDRLSAEINR PDYLDFAESG QVYFGIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8t STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 88 86 SER t 112 110 GLU K Protein B 3 FT #SUB 89 87 TYR t 112 110 GLU K Protein A 10 FT #SUB 89 87 TYR t 114 112 LYS K Protein S 4 FT #SUB 89 87 TYR t 115 113 PRO K Protein S 1 FT #SUB 57 55 LEU t 15 13 VAL u Protein S 1 FT #SUB 57 55 LEU t 38 36 LEU u Protein S 1 FT #SUB 59 57 LEU t 157 155 ILE u Protein S 1 FT #SUB 73 71 SER t 114 112 LYS u Protein B 1 FT #SUB 75 73 HIS t 114 112 LYS u Protein S 2 FT #SUB 75 73 HIS t 115 113 PRO u Protein S 3 FT #SUB 77 75 LEU t 117 115 TYR u Protein S 1 FT #SUB 84 82 ARG t 36 34 ASN u Protein S 5 FT #SUB 94 92 ASN t 149 147 SER u Protein S 2 FT #SUB 95 93 LEU t 36 34 ASN u Protein S 4 FT #SUB 95 93 LEU t 150 148 GLY u Protein B 1 FT #SUB 96 94 LEU t 150 148 GLY u Protein B 2 FT #SUB 96 94 LEU t 153 151 TYR u Protein S 3 FT #SUB 97 95 SER t 63 61 GLN u Protein B 3 FT #SUB 97 95 SER t 150 148 GLY u Protein A 6 FT #SUB 97 95 SER t 151 149 GLN u Protein B 1 FT #SUB 99 97 ILE t 65 63 LEU u Protein B 1 FT #SUB 99 97 ILE t 117 115 TYR u Protein A 6 FT #SUB 99 97 ILE t 119 117 PRO u Protein B 2 FT #SUB 99 97 ILE t 151 149 GLN u Protein S 1 FT #SUB 100 98 LYS t 117 115 TYR u Protein A 4 FT #SUB 100 98 LYS t 118 116 GLU u Protein S 3 FT #SUB 100 98 LYS t 119 117 PRO u Protein S 2 FT #SUB 101 99 SER t 117 115 TYR u Protein A 5 FT #SUB 104 102 GLN t 102 100 PRO u Protein S 1 FT #SUB 104 102 GLN t 104 102 GLN u Protein S 5 FT #SUB 105 103 ARG t 105 103 ARG u Protein S 1 FT #SUB 121 119 TYR t 121 119 TYR u Protein A 6 FT #SUB 122 120 LEU t 63 61 GLN u Protein S 1 FT #SUB 123 121 GLY t 61 59 TYR u Protein B 2 FT #SUB 123 121 GLY t 121 119 TYR u Protein B 4 FT #SUB 123 121 GLY t 153 151 TYR u Protein B 4 FT #SUB 124 122 GLY t 61 59 TYR u Protein B 4 FT #SUB 125 123 VAL t 15 13 VAL u Protein S 1 FT #SUB 125 123 VAL t 16 14 ALA u Protein S 1 FT #SUB 125 123 VAL t 17 15 HIS u Protein A 4 FT #SUB 125 123 VAL t 38 36 LEU u Protein B 1 FT #SUB 125 123 VAL t 61 59 TYR u Protein A 4 FT #SUB 125 123 VAL t 157 155 ILE u Protein S 2 FT #SUB 126 124 PHE t 17 15 HIS u Protein S 4 FT #SUB 126 124 PHE t 36 34 ASN u Protein S 4 FT #SUB 127 125 GLN t 38 36 LEU u Protein B 1 FT #SUB 159 157 LEU t 11 9 SER u Protein B 2 FT #SUB 159 157 LEU t 157 155 ILE u Protein S 1 FT #SUB 11 9 SER t 148 146 GLU v Protein A 8 FT #SUB 11 9 SER t 149 147 SER v Protein B 2 FT #SUB 38 36 LEU t 38 36 LEU v Protein S 1 FT #SUB 149 147 SER t 13 11 LYS v Protein S 4 FT #SUB 151 149 GLN t 11 9 SER v Protein S 1 FT #HET 17 15 HIS t 44 202 JNI t S 9 FT #HET 59 57 LEU t 43 201 JNI t S 4 FT #HET 62 60 SER t 43 201 JNI t B 3 FT #HET 121 119 TYR t 43 201 JNI t A 28 FT #HET 122 120 LEU t 43 201 JNI t B 3 FT #HET 123 121 GLY t 43 201 JNI t B 4 FT #HET 124 122 GLY t 43 201 JNI t B 2 FT #HET 153 151 TYR t 43 201 JNI t S 7 FT DISORDER 1 10 FT DISORDER 32 37 CC SEQUENCE 143 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LLLANGVELR DNQLVVPSEG LYLIYSQVLF KGQGCPSTHV CC LLTHTISRIA VSYQTKVNLL SAIKSPCQRE TPEGAEAKPW YEPIYLGGVF QLEKGDRLSA CC EINRPDYLDF AESGQVYFGI IAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWL------LLANGVELRDNQL CC ********************* ************* CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ************************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8u STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 23 21 GLN u 92 90 LYS J Protein B 2 FT #SUB 23 21 GLN u 137 135 GLU J Protein B 1 FT #SUB 24 22 ALA u 92 90 LYS J Protein A 4 FT #SUB 25 23 GLU u 137 135 GLU J Protein S 1 FT #SUB 27 25 GLN u 90 88 GLN J Protein S 1 FT #SUB 27 25 GLN u 91 89 THR J Protein S 5 FT #SUB 27 25 GLN u 92 90 LYS J Protein S 7 FT #SUB 47 45 ASP u 89 87 TYR J Protein S 1 FT #SUB 33 31 ARG u 147 145 ALA K Protein S 5 FT #SUB 33 31 ARG u 148 146 GLU K Protein S 5 FT #SUB 41 39 ASN u 75 73 HIS S Protein B 4 FT #SUB 42 40 GLY u 75 73 HIS S Protein B 11 FT #SUB 46 44 ARG u 139 137 ASN S Protein S 1 FT #SUB 46 44 ARG u 140 138 ARG S Protein S 13 FT #SUB 87 85 VAL u 99 97 ILE S Protein S 2 FT #SUB 88 86 SER u 94 92 ASN S Protein B 3 FT #SUB 88 86 SER u 97 95 SER S Protein S 1 FT #SUB 90 88 GLN u 81 79 THR S Protein S 1 FT #SUB 90 88 GLN u 92 90 LYS S Protein S 2 FT #SUB 90 88 GLN u 94 92 ASN S Protein S 3 FT #SUB 91 89 THR u 91 89 THR S Protein S 1 FT #SUB 91 89 THR u 92 90 LYS S Protein S 1 FT #SUB 130 128 LYS u 99 97 ILE S Protein B 1 FT #SUB 130 128 LYS u 101 99 SER S Protein S 2 FT #SUB 89 87 TYR u 89 87 TYR U Protein S 19 FT #SUB 129 127 GLU u 88 86 SER U Protein S 1 FT #SUB 11 9 SER u 159 157 LEU t Protein B 2 FT #SUB 15 13 VAL u 57 55 LEU t Protein S 1 FT #SUB 15 13 VAL u 125 123 VAL t Protein S 1 FT #SUB 16 14 ALA u 125 123 VAL t Protein B 1 FT #SUB 17 15 HIS u 125 123 VAL t Protein S 4 FT #SUB 17 15 HIS u 126 124 PHE t Protein S 4 FT #SUB 36 34 ASN u 84 82 ARG t Protein S 5 FT #SUB 36 34 ASN u 95 93 LEU t Protein S 4 FT #SUB 36 34 ASN u 126 124 PHE t Protein A 4 FT #SUB 38 36 LEU u 57 55 LEU t Protein S 1 FT #SUB 38 36 LEU u 125 123 VAL t Protein S 1 FT #SUB 38 36 LEU u 127 125 GLN t Protein S 1 FT #SUB 61 59 TYR u 123 121 GLY t Protein S 2 FT #SUB 61 59 TYR u 124 122 GLY t Protein S 4 FT #SUB 61 59 TYR u 125 123 VAL t Protein S 4 FT #SUB 63 61 GLN u 97 95 SER t Protein S 3 FT #SUB 63 61 GLN u 122 120 LEU t Protein S 1 FT #SUB 65 63 LEU u 99 97 ILE t Protein S 1 FT #SUB 102 100 PRO u 104 102 GLN t Protein B 1 FT #SUB 104 102 GLN u 104 102 GLN t Protein S 5 FT #SUB 105 103 ARG u 105 103 ARG t Protein S 1 FT #SUB 114 112 LYS u 73 71 SER t Protein S 1 FT #SUB 114 112 LYS u 75 73 HIS t Protein S 2 FT #SUB 115 113 PRO u 75 73 HIS t Protein B 3 FT #SUB 117 115 TYR u 77 75 LEU t Protein S 1 FT #SUB 117 115 TYR u 99 97 ILE t Protein S 6 FT #SUB 117 115 TYR u 100 98 LYS t Protein A 4 FT #SUB 117 115 TYR u 101 99 SER t Protein A 5 FT #SUB 118 116 GLU u 100 98 LYS t Protein S 3 FT #SUB 119 117 PRO u 99 97 ILE t Protein S 2 FT #SUB 119 117 PRO u 100 98 LYS t Protein S 2 FT #SUB 121 119 TYR u 121 119 TYR t Protein S 6 FT #SUB 121 119 TYR u 123 121 GLY t Protein S 4 FT #SUB 149 147 SER u 94 92 ASN t Protein B 2 FT #SUB 150 148 GLY u 95 93 LEU t Protein B 1 FT #SUB 150 148 GLY u 96 94 LEU t Protein B 2 FT #SUB 150 148 GLY u 97 95 SER t Protein B 6 FT #SUB 151 149 GLN u 97 95 SER t Protein B 1 FT #SUB 151 149 GLN u 99 97 ILE t Protein S 1 FT #SUB 153 151 TYR u 96 94 LEU t Protein S 3 FT #SUB 153 151 TYR u 123 121 GLY t Protein S 4 FT #SUB 157 155 ILE u 59 57 LEU t Protein S 1 FT #SUB 157 155 ILE u 125 123 VAL t Protein S 2 FT #SUB 157 155 ILE u 159 157 LEU t Protein S 1 FT #SUB 57 55 LEU u 123 121 GLY w Protein S 2 FT #SUB 96 94 LEU u 127 125 GLN w Protein A 5 FT #SUB 97 95 SER u 127 125 GLN w Protein A 10 FT #SUB 123 121 GLY u 57 55 LEU w Protein B 3 FT #SUB 124 122 GLY u 125 123 VAL w Protein B 4 FT #SUB 125 123 VAL u 124 122 GLY w Protein B 2 FT #SUB 125 123 VAL u 125 123 VAL w Protein A 8 FT #SUB 125 123 VAL u 126 124 PHE w Protein B 2 FT #SUB 126 124 PHE u 125 123 VAL w Protein S 2 FT #SUB 126 124 PHE u 126 124 PHE w Protein S 4 FT #SUB 127 125 GLN u 96 94 LEU w Protein S 2 FT #SUB 127 125 GLN u 97 95 SER w Protein S 11 FT #HET 57 55 LEU u 46 202 JNI v S 6 FT #HET 59 57 LEU u 43 201 JNI t S 1 FT #HET 61 59 TYR u 43 201 JNI t S 1 FT #HET 121 119 TYR u 43 201 JNI t S 10 FT #HET 123 121 GLY u 43 201 JNI t B 2 FT #HET 127 125 GLN u 46 202 JNI v S 2 FT #HET 159 157 LEU u 46 202 JNI v A 9 FT DISORDER 1 10 FT DISORDER 109 112 CC SEQUENCE 145 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPAK PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8v STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 11 9 SER v 151 149 GLN t Protein S 1 FT #SUB 13 11 LYS v 149 147 SER t Protein S 4 FT #SUB 38 36 LEU v 38 36 LEU t Protein S 1 FT #SUB 148 146 GLU v 11 9 SER t Protein S 8 FT #SUB 149 147 SER v 11 9 SER t Protein B 2 FT #SUB 57 55 LEU v 15 13 VAL w Protein S 1 FT #SUB 84 82 ARG v 36 34 ASN w Protein S 4 FT #SUB 94 92 ASN v 148 146 GLU w Protein S 1 FT #SUB 94 92 ASN v 149 147 SER w Protein S 4 FT #SUB 95 93 LEU v 36 34 ASN w Protein S 4 FT #SUB 95 93 LEU v 150 148 GLY w Protein B 2 FT #SUB 96 94 LEU v 150 148 GLY w Protein B 2 FT #SUB 96 94 LEU v 153 151 TYR w Protein S 4 FT #SUB 97 95 SER v 63 61 GLN w Protein B 2 FT #SUB 97 95 SER v 150 148 GLY w Protein B 4 FT #SUB 97 95 SER v 151 149 GLN w Protein B 1 FT #SUB 98 96 ALA v 63 61 GLN w Protein S 1 FT #SUB 99 97 ILE v 65 63 LEU w Protein S 1 FT #SUB 99 97 ILE v 117 115 TYR w Protein S 5 FT #SUB 99 97 ILE v 119 117 PRO w Protein B 2 FT #SUB 99 97 ILE v 145 143 ASP w Protein S 1 FT #SUB 101 99 SER v 116 114 TRP w Protein S 2 FT #SUB 101 99 SER v 117 115 TYR w Protein A 9 FT #SUB 104 102 GLN v 104 102 GLN w Protein S 1 FT #SUB 104 102 GLN v 105 103 ARG w Protein S 1 FT #SUB 105 103 ARG v 105 103 ARG w Protein S 8 FT #SUB 120 118 ILE v 121 119 TYR w Protein A 2 FT #SUB 121 119 TYR v 63 61 GLN w Protein B 1 FT #SUB 121 119 TYR v 121 119 TYR w Protein A 7 FT #SUB 122 120 LEU v 63 61 GLN w Protein S 1 FT #SUB 122 120 LEU v 153 151 TYR w Protein B 1 FT #SUB 123 121 GLY v 61 59 TYR w Protein B 2 FT #SUB 123 121 GLY v 153 151 TYR w Protein B 4 FT #SUB 124 122 GLY v 61 59 TYR w Protein B 4 FT #SUB 125 123 VAL v 17 15 HIS w Protein B 2 FT #SUB 125 123 VAL v 61 59 TYR w Protein B 1 FT #SUB 125 123 VAL v 157 155 ILE w Protein S 1 FT #SUB 126 124 PHE v 17 15 HIS w Protein S 3 FT #SUB 126 124 PHE v 36 34 ASN w Protein S 4 FT #SUB 127 125 GLN v 38 36 LEU w Protein A 2 FT #SUB 159 157 LEU v 157 155 ILE w Protein S 1 FT #HET 11 9 SER v 44 202 JNI t S 3 FT #HET 59 57 LEU v 45 201 JNI v S 2 FT #HET 121 119 TYR v 45 201 JNI v S 2 FT #HET 121 119 TYR v 46 202 JNI v S 21 FT #HET 123 121 GLY v 45 201 JNI v B 5 FT #HET 153 151 TYR v 45 201 JNI v S 3 FT #HET 157 155 ILE v 44 202 JNI t S 2 FT #HET 157 155 ILE v 45 201 JNI v S 2 FT #HET 159 157 LEU v 45 201 JNI v S 1 FT DISORDER 1 9 FT DISORDER 109 114 CC SEQUENCE 144 AA (ATOM); CC PSDKPVAHVV ANPQAEGQLQ WLNRRANALL ANGVELRDNQ LVVPSEGLYL IYSQVLFKGQ CC GCPSTHVLLT HTISRIAVSY QTKVNLLSAI KSPCQRETPP WYEPIYLGGV FQLEKGDRLS CC AEINRPDYLD FAESGQVYFG IIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ---------PSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ***************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP------PWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************ CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL // ID 5MU8w STANDARD; PRT; 159 AA. DT CONVERTED FROM PDB (SEQRES) 5MU8 DE Tumor necrosis factor OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.211 FT #SUB 75 73 HIS w 41 39 ASN U Protein S 3 FT #SUB 75 73 HIS w 42 40 GLY U Protein S 10 FT #SUB 77 75 LEU w 52 50 VAL U Protein S 1 FT #SUB 77 75 LEU w 131 129 GLY U Protein S 1 FT #SUB 81 79 THR w 87 85 VAL U Protein S 1 FT #SUB 81 79 THR w 90 88 GLN U Protein S 5 FT #SUB 83 81 SER w 90 88 GLN U Protein S 2 FT #SUB 91 89 THR w 91 89 THR U Protein S 1 FT #SUB 92 90 LYS w 90 88 GLN U Protein A 5 FT #SUB 92 90 LYS w 91 89 THR U Protein A 6 FT #SUB 94 92 ASN w 88 86 SER U Protein S 4 FT #SUB 94 92 ASN w 89 87 TYR U Protein A 3 FT #SUB 94 92 ASN w 90 88 GLN U Protein S 4 FT #SUB 97 95 SER w 87 85 VAL U Protein S 1 FT #SUB 97 95 SER w 88 86 SER U Protein S 1 FT #SUB 99 97 ILE w 87 85 VAL U Protein S 6 FT #SUB 99 97 ILE w 130 128 LYS U Protein S 1 FT #SUB 101 99 SER w 130 128 LYS U Protein S 3 FT #SUB 139 137 ASN w 46 44 ARG U Protein B 1 FT #SUB 140 138 ARG w 46 44 ARG U Protein S 13 FT #SUB 57 55 LEU w 123 121 GLY u Protein S 3 FT #SUB 96 94 LEU w 127 125 GLN u Protein S 2 FT #SUB 97 95 SER w 127 125 GLN u Protein A 11 FT #SUB 123 121 GLY w 57 55 LEU u Protein B 2 FT #SUB 124 122 GLY w 125 123 VAL u Protein B 2 FT #SUB 125 123 VAL w 124 122 GLY u Protein A 4 FT #SUB 125 123 VAL w 125 123 VAL u Protein A 8 FT #SUB 125 123 VAL w 126 124 PHE u Protein B 2 FT #SUB 126 124 PHE w 125 123 VAL u Protein S 2 FT #SUB 126 124 PHE w 126 124 PHE u Protein S 4 FT #SUB 127 125 GLN w 96 94 LEU u Protein S 5 FT #SUB 127 125 GLN w 97 95 SER u Protein S 10 FT #SUB 15 13 VAL w 57 55 LEU v Protein S 1 FT #SUB 17 15 HIS w 125 123 VAL v Protein S 2 FT #SUB 17 15 HIS w 126 124 PHE v Protein S 3 FT #SUB 36 34 ASN w 84 82 ARG v Protein S 4 FT #SUB 36 34 ASN w 95 93 LEU v Protein S 4 FT #SUB 36 34 ASN w 126 124 PHE v Protein A 4 FT #SUB 38 36 LEU w 127 125 GLN v Protein S 2 FT #SUB 61 59 TYR w 123 121 GLY v Protein S 2 FT #SUB 61 59 TYR w 124 122 GLY v Protein S 4 FT #SUB 61 59 TYR w 125 123 VAL v Protein S 1 FT #SUB 63 61 GLN w 97 95 SER v Protein S 2 FT #SUB 63 61 GLN w 98 96 ALA v Protein S 1 FT #SUB 63 61 GLN w 121 119 TYR v Protein S 1 FT #SUB 63 61 GLN w 122 120 LEU v Protein S 1 FT #SUB 65 63 LEU w 99 97 ILE v Protein S 1 FT #SUB 104 102 GLN w 104 102 GLN v Protein B 1 FT #SUB 105 103 ARG w 104 102 GLN v Protein B 1 FT #SUB 105 103 ARG w 105 103 ARG v Protein S 8 FT #SUB 116 114 TRP w 101 99 SER v Protein B 2 FT #SUB 117 115 TYR w 99 97 ILE v Protein S 5 FT #SUB 117 115 TYR w 101 99 SER v Protein A 9 FT #SUB 119 117 PRO w 99 97 ILE v Protein S 2 FT #SUB 121 119 TYR w 120 118 ILE v Protein S 2 FT #SUB 121 119 TYR w 121 119 TYR v Protein S 7 FT #SUB 145 143 ASP w 99 97 ILE v Protein S 1 FT #SUB 148 146 GLU w 94 92 ASN v Protein S 1 FT #SUB 149 147 SER w 94 92 ASN v Protein B 4 FT #SUB 150 148 GLY w 95 93 LEU v Protein B 2 FT #SUB 150 148 GLY w 96 94 LEU v Protein B 2 FT #SUB 150 148 GLY w 97 95 SER v Protein B 4 FT #SUB 151 149 GLN w 97 95 SER v Protein B 1 FT #SUB 153 151 TYR w 96 94 LEU v Protein S 4 FT #SUB 153 151 TYR w 122 120 LEU v Protein S 1 FT #SUB 153 151 TYR w 123 121 GLY v Protein S 4 FT #SUB 157 155 ILE w 125 123 VAL v Protein S 1 FT #SUB 157 155 ILE w 159 157 LEU v Protein S 1 FT #HET 59 57 LEU w 45 201 JNI v S 1 FT #HET 61 59 TYR w 45 201 JNI v S 4 FT #HET 121 119 TYR w 46 202 JNI v S 8 FT #HET 123 121 GLY w 46 202 JNI v B 2 FT #HET 159 157 LEU w 43 201 JNI t B 1 FT DISORDER 1 10 FT DISORDER 109 112 CC SEQUENCE 145 AA (ATOM); CC SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CC CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPAK PWYEPIYLGG VFQLEKGDRL CC SAEINRPDYL DFAESGQVYF GIIAL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AMVRSSSRTPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC ATOM ----------SDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQL CC **************************************** CC SEQRES VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ATOM VVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIK CC ************************************************** CC SEQRES SPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ATOM SPCQRETP----AKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESG CC ******** ************************************** CC SEQRES QVYFGIIAL CC ATOM QVYFGIIAL CC ********* SQ SEQUENCE 159 AA; MW; CN; AMVRSSSRTP SDKPVAHVVA NPQAEGQLQW LNRRANALLA NGVELRDNQL VVPSEGLYLI YSQVLFKGQG CPSTHVLLTH TISRIAVSYQ TKVNLLSAIK SPCQRETPEG AEAKPWYEPI YLGGVFQLEK GDRLSAEINR PDYLDFAESG QVYFGIIAL //