A0A087WU52_HUMAN Loading...

Cytoplasmic FMR1 interacting protein 1

AlphaFold DB (A0A0G2JRX2), UniProt , Accession A0A087WU52, Species HUMAN (Homo sapiens, Human), Gene CYFIP1, Length 151 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42.6Very low75.2Confident245 Ų245119.1 Ų119.1100%1.20768%0.678SS**  01010-74.7-174.7-87.500106.9A3M1-A3 PolarHBondContact O-N 3.4Å
2A51Low76.2Confident101 Ų101114.5 Ų114.584%0.83566%0.659SS**  trans-74116.3173.300000107Q4A2-Q4 PolarHBondContact O-N 3.31Å
3A64.5Low77Confident92 Ų92113.2 Ų113.276%0.7665%0.648SS**  trans-61.1122.4173.900000107.9M1 V5M1-A3 PolarHBondContact O-N 3.4Å; A3-V5 PolarHBondContact O-N 3.39Å; A3-V5 VanDerWaalsContact O-N 3.08Å
4Q72.2Confident77.7Confident187 Ų187111.4 Ų111.487%0.87464%0.641SS**  trans-65.6108.4171.4-86.2178.5-35.200107.4A2 T6A2-Q4 PolarHBondContact O-N 3.31Å; Q4-T6 PolarHBondContact O-N 3.32Å
5V77.7Confident78.4Confident108 Ų108110.9 Ų110.966%0.65564%0.635SS**  trans-67.7122.7171.5-179.70000107.2A3 D9A3-V5 PolarHBondContact O-N 3.39Å; A3-V5 VanDerWaalsContact O-N 3.08Å; V5-D9 HydrophobicContact CG1-CB 3.99Å
6T84.7Confident78.9Confident69 Ų69110.4 Ų110.442%0.42363%0.629SS.*  trans-77.1159.2178.868.90000110.4Q4 E8 D9 A10Q4-T6 PolarHBondContact O-N 3.32Å; T6-E8 VanDerWaalsContact C-N 3.26Å; T6-E8 PolarHBondContact O-N 3.31Å; T6-D9 PolarHBondContact N-OD2 2.64Å; T6-D9 PolarHBondContact O-N 2.8Å; T6-D9 PolarHBondContact OG1-N 3.25Å; T6-D9 PolarHBondContact OG1-OD2 3.01Å; T6-A10 PolarHBondContact O-N 3.38Å; T6-A10 VanDerWaalsContact O-N 3.08Å
7L85.1Confident79.2Confident131 Ų131110.6 Ų110.669%0.68663%0.627SS**Hα-helixtrans-61.6-38.3177.6-178.963.7000111.2D9 A10 L11L7-D9 VanDerWaalsContact C-N 3.35Å; L7-D9 PolarHBondContact O-N 2.85Å; L7-A10 PolarHBondContact O-N 2.74Å; L7-L11 HydrophobicContact CD1-CD1 4.45Å; L7-L11 HydrophobicContact CD1-CG 4.44Å; L7-L11 HydrophobicContact CG-CD1 4.09Å; L7-L11 WeakPolarHBondContact O-CG 3.34Å; L7-L11 PolarHBondContact O-N 3.38Å
8E88Confident79.3Confident154 Ų154114.2 Ų114.272%0.7264%0.637SS**Hα-helixtrans-58-45173.3-107.496.4-168.100112T6 A10 L11 S12T6-E8 VanDerWaalsContact C-N 3.26Å; T6-E8 PolarHBondContact O-N 3.31Å; E8-A10 VanDerWaalsContact C-N 3.29Å; E8-A10 PolarHBondContact O-N 3.15Å; E8-L11 PolarHBondContact O-N 3.08Å; E8-S12 VanDerWaalsContact O-CB 3.31Å; E8-S12 WeakPolarHBondContact O-CB 3.29Å; E8-S12 PolarHBondContact O-N 3.45Å
9D85.6Confident79.4Confident83 Ų83116.9 Ų116.944%0.44465%0.645SS.*Hα-helixtrans-64.6-36.9178.9-63.6-41.1000111.6V5 T6 L7 N13V5-D9 HydrophobicContact CG1-CB 3.99Å; T6-D9 PolarHBondContact N-OD2 2.64Å; T6-D9 PolarHBondContact O-N 2.8Å; T6-D9 PolarHBondContact OG1-N 3.25Å; T6-D9 PolarHBondContact OG1-OD2 3.01Å; L7-D9 VanDerWaalsContact C-N 3.35Å; L7-D9 PolarHBondContact O-N 2.85Å; D9-N13 VanDerWaalsContact O-CG 3.32Å; D9-N13 PolarHBondContact O-N 3.43Å; D9-N13 VanDerWaalsContact O-N 3.12Å; D9-N13 PolarHBondContact O-ND2 3.15Å
10A86.6Confident79.5Confident42 Ų42116 Ų11635%0.34764%0.638SS.*Hα-helixtrans-67.2-42177.300000111.8T6 L7 E8 V14T6-A10 PolarHBondContact O-N 3.38Å; T6-A10 VanDerWaalsContact O-N 3.08Å; L7-A10 PolarHBondContact O-N 2.74Å; E8-A10 VanDerWaalsContact C-N 3.29Å; E8-A10 PolarHBondContact O-N 3.15Å; A10-V14 WeakPolarHBondContact O-CG2 3.36Å; A10-V14 PolarHBondContact O-N 2.97Å
11L89.4Confident79.4Confident98 Ų98115.7 Ų115.751%0.51364%0.642SS.*Hα-helixtrans-68.2-44.4177.7-68.8170.8000111.5L7 E8 N13 V14 D15L7-L11 HydrophobicContact CD1-CD1 4.45Å; L7-L11 HydrophobicContact CD1-CG 4.44Å; L7-L11 HydrophobicContact CG-CD1 4.09Å; L7-L11 WeakPolarHBondContact O-CG 3.34Å; L7-L11 PolarHBondContact O-N 3.38Å; E8-L11 PolarHBondContact O-N 3.08Å; L11-N13 VanDerWaalsContact C-N 3.28Å; L11-N13 PolarHBondContact O-N 3.21Å; L11-V14 WeakPolarHBondContact O-CA 3.42Å; L11-V14 WeakPolarHBondContact O-CB 3.49Å; L11-V14 PolarHBondContact O-N 2.95Å; L11-D15 PolarHBondContact O-N 3.15Å
12S87.3Confident80.9Confident64 Ų64110.9 Ų110.945%0.44862%0.62SS.*Hα-helixtrans-57.7-39.6175.9178.80000112.5E8 V14 D15 L16E8-S12 VanDerWaalsContact O-CB 3.31Å; E8-S12 WeakPolarHBondContact O-CB 3.29Å; E8-S12 PolarHBondContact O-N 3.45Å; S12-V14 VanDerWaalsContact C-N 3.3Å; S12-V14 PolarHBondContact O-N 3.37Å; S12-D15 PolarHBondContact O-N 2.9Å; S12-L16 WeakPolarHBondContact O-CG 3.41Å; S12-L16 PolarHBondContact O-N 3.02Å; S12-L16 VanDerWaalsContact O-N 3.11Å
13N86.2Confident81.9Confident97 Ų97111 Ų11152%0.51961%0.612SS.*Hα-helixtrans-66.5-29.4175.2-77.6-45000113.6D9 L11D9-N13 VanDerWaalsContact O-CG 3.32Å; D9-N13 PolarHBondContact O-N 3.43Å; D9-N13 VanDerWaalsContact O-N 3.12Å; D9-N13 PolarHBondContact O-ND2 3.15Å; L11-N13 VanDerWaalsContact C-N 3.28Å; L11-N13 PolarHBondContact O-N 3.21Å
14V87.1Confident82.1Confident89 Ų89114 Ų11454%0.53962%0.616SS.*Hα-helixtrans-74.6-41175.4173.50000110.2A10 L11 S12 L16 L17A10-V14 WeakPolarHBondContact O-CG2 3.36Å; A10-V14 PolarHBondContact O-N 2.97Å; L11-V14 WeakPolarHBondContact O-CA 3.42Å; L11-V14 WeakPolarHBondContact O-CB 3.49Å; L11-V14 PolarHBondContact O-N 2.95Å; S12-V14 VanDerWaalsContact C-N 3.3Å; S12-V14 PolarHBondContact O-N 3.37Å; V14-L16 PolarHBondContact O-N 2.68Å; V14-L17 VanDerWaalsContact O-CB 3.29Å; V14-L17 WeakPolarHBondContact O-CB 3.38Å; V14-L17 PolarHBondContact O-N 3.42Å
15D88.3Confident81.9Confident104 Ų104113.5 Ų113.556%0.55661%0.613SS**Hα-helixtrans-60.4-36.5176.8-64.7-21.5000111.2L11 S12 L17 E18L11-D15 PolarHBondContact O-N 3.15Å; S12-D15 PolarHBondContact O-N 2.9Å; D15-L17 PolarHBondContact O-N 3.34Å; D15-E18 PolarHBondContact O-N 3.42Å; D15-E18 VanDerWaalsContact O-N 3.11Å
16L86.8Confident81.7Confident103 Ų103116.2 Ų116.254%0.53962%0.619SS.*Hα-helixtrans-62.7-20.2173.9-72172.1000114S12 V14 E18S12-L16 WeakPolarHBondContact O-CG 3.41Å; S12-L16 PolarHBondContact O-N 3.02Å; S12-L16 VanDerWaalsContact O-N 3.11Å; V14-L16 PolarHBondContact O-N 2.68Å; L16-E18 VanDerWaalsContact C-N 3.35Å
17L82.9Confident81.1Confident114 Ų114117.6 Ų117.660%0.59763%0.629SS**Hα-helixtrans-77.1-21.5176.4-61.3173.8000112.5V14 D15 E19 L20V14-L17 VanDerWaalsContact O-CB 3.29Å; V14-L17 WeakPolarHBondContact O-CB 3.38Å; V14-L17 PolarHBondContact O-N 3.42Å; D15-L17 PolarHBondContact O-N 3.34Å; L17-E19 VanDerWaalsContact C-N 3.32Å; L17-L20 WeakPolarHBondContact O-CB 3.36Å; L17-L20 PolarHBondContact O-N 2.9Å
18E81.9Confident80.5Confident174 Ų174116.8 Ų116.881%0.81363%0.633SS**Hα-helixtrans-68.8-33.2174.7-67.8-166.1160.800111.9D15 L16D15-E18 PolarHBondContact O-N 3.42Å; D15-E18 VanDerWaalsContact O-N 3.11Å; L16-E18 VanDerWaalsContact C-N 3.35Å
19E80.9Confident80.1Confident167 Ų167116.7 Ų116.778%0.7864%0.636SS**SBendtrans-89.4-0.9178.3-62.1-167.317000113.3L17 P21L17-E19 VanDerWaalsContact C-N 3.32Å; E19-P21 VanDerWaalsContact O-CD 3.25Å; E19-P21 WeakPolarHBondContact O-CD 3.37Å
20L81.3Confident79.8Confident98 Ų98120.3 Ų120.351%0.51365%0.65SS.*  trans-70.2116.4-179.4-16684.8000109.6L17 L22L17-L20 WeakPolarHBondContact O-CB 3.36Å; L17-L20 PolarHBondContact O-N 2.9Å; L20-L22 HydrophobicContact CD2-CD2 4.44Å; L20-L22 PolarHBondContact O-N 3.41Å
21P77.1Confident79.5Confident110 Ų110123.6 Ų123.671%0.71467%0.668SS**  trans-67.8107.817727.4-32.2000108.6E19 P23E19-P21 VanDerWaalsContact O-CD 3.25Å; E19-P21 WeakPolarHBondContact O-CD 3.37Å; P21-P23 WeakPolarHBondContact O-CD 3.17Å
22L74.9Confident79.2Confident143 Ų143124.3 Ų124.375%0.74968%0.678SS**  trans-72.7114.1170.2-64.5175.7000107.5L20 D24L20-L22 HydrophobicContact CD2-CD2 4.44Å; L20-L22 PolarHBondContact O-N 3.41Å; L22-D24 PolarHBondContact O-N 3.43Å
23P71.8Confident79Confident103 Ų103127.6 Ų127.667%0.66970%0.699SS**  trans-66.8109.8174.526.2-30.4000107.9P21 Q25P21-P23 WeakPolarHBondContact O-CD 3.17Å; P23-Q25 PolarHBondContact O-N 3.39Å
24D67.5Low78.9Confident157 Ų157128 Ų12884%0.8471%0.708SS**  trans-69.421.7176.7-127.39.4000112.7L22 Q26L22-D24 PolarHBondContact O-N 3.43Å; D24-Q26 PolarHBondContact O-N 3.37Å
25Q68.5Low78.8Confident175 Ų175129.1 Ų129.182%0.81872%0.72SS**  trans-75.163176.7-66.4-173.19.900109.5P23 P27P23-Q25 PolarHBondContact O-N 3.39Å; Q25-P27 WeakPolarHBondContact O-CD 3.35Å
26Q73.6Confident78.6Confident166 Ų166132.2 Ų132.278%0.77674%0.736SS**  trans-63.8119.8165.2-166.3155.49.100106.9D24 C28D24-Q26 PolarHBondContact O-N 3.37Å; Q26-C28 PolarHBondContact O-N 3.08Å; Q26-C28 VanDerWaalsContact O-N 3.16Å
27P72.9Confident78.5Confident98 Ų98135.5 Ų135.564%0.63675%0.753SS**  trans-58.1126.9176.421.2-29.5000107.9Q25 I29Q25-P27 WeakPolarHBondContact O-CD 3.35Å; P27-I29 VanDerWaalsContact O-CG1 3.31Å; P27-I29 WeakPolarHBondContact O-CG1 3.25Å; P27-I29 PolarHBondContact O-N 3Å
28C72.4Confident78.4Confident114 Ų114139.5 Ų139.577%0.7776%0.762SS**  trans-6799.9174.9-167.70000107.9Q26 E30Q26-C28 PolarHBondContact O-N 3.08Å; Q26-C28 VanDerWaalsContact O-N 3.16Å; C28-E30 PolarHBondContact SG-O 3.21Å
29I79.6Confident78.4Confident151 Ų151139.5 Ų139.577%0.77476%0.762SS**  trans-80.2-16.2176.4-42.2-179000110P27P27-I29 VanDerWaalsContact O-CG1 3.31Å; P27-I29 WeakPolarHBondContact O-CG1 3.25Å; P27-I29 PolarHBondContact O-N 3Å
30E79.6Confident78.2Confident160 Ų160134.4 Ų134.475%0.74874%0.743SS**SBendtrans-81.5128.5-178.4-64.1-172.5174.600110.9C28C28-E30 PolarHBondContact SG-O 3.21Å
31P80.1Confident77.9Confident110 Ų110135.1 Ų135.171%0.71475%0.747SS**PPolyproline II helixtrans-64.1149.6169.927.2-32000109.8
32P82.1Confident77.8Confident113 Ų113138.3 Ų138.373%0.73475%0.75SS**PPolyproline II helixtrans-58148.2174.125.3-33.6000110.6S34P32-S34 PolarHBondContact O-N 2.93Å; P32-S34 VanDerWaalsContact O-N 3.08Å
33P83.1Confident77.9Confident134 Ų134134.3 Ų134.387%0.8773%0.73SS**PPolyproline II helixtrans-60.1117.8-179.123.9-32.7000110
34S83.8Confident78Confident104 Ų104132.9 Ų132.973%0.72772%0.719SS**PPolyproline II helixtrans-94.3129.6173.9-172.90000109.5P32 L36P32-S34 PolarHBondContact O-N 2.93Å; P32-S34 VanDerWaalsContact O-N 3.08Å; S34-L36 PolarHBondContact O-N 2.83Å
35S85.6Confident78.7Confident113 Ų113126.7 Ų126.779%0.7969%0.686SS**PPolyproline II helixtrans-75.2116.6173.2-66.20000109.3L37S35-L37 PolarHBondContact O-N 3.25Å
36L84Confident79.1Confident170 Ų170122.9 Ų122.989%0.8967%0.667SS**  trans-83.1108.2173-68.3172.1000109.2S34S34-L36 PolarHBondContact O-N 2.83Å
37L85.3Confident79.4Confident171 Ų171121.2 Ų121.290%0.89566%0.659SS**  trans-84.2115.9167.7-96.1153.8000108.8S35S35-L37 PolarHBondContact O-N 3.25Å
38Y81.3Confident79.7Confident198 Ų198120.8 Ų120.878%0.77665%0.652SS**  trans-97.2114.2168175.4-103.4000108.9P40Y38-P40 HydrophobicContact CE1-CB 4.01Å; Y38-P40 HydrophobicContact CE1-CG 4.17Å
39Q80.4Confident80Confident175 Ų175118.4 Ų118.482%0.81863%0.626SS**  trans-115.2112.3170-173.2171.6-8.600108.4N41Q39-N41 PolarHBondContact O-N 3.46Å
40P77.1Confident79.8Confident59 Ų59116.5 Ų116.538%0.38362%0.618SS.*  trans-66.9123.7174.826.5-31.1000109.1Y38 F42Y38-P40 HydrophobicContact CE1-CB 4.01Å; Y38-P40 HydrophobicContact CE1-CG 4.17Å; P40-F42 HydrophobicContact CB-CE2 3.98Å; P40-F42 HydrophobicContact CB-CZ 4.09Å; P40-F42 HydrophobicContact CG-CE2 4.16Å
41N75Confident79.6Confident113 Ų113112.7 Ų112.760%0.60461%0.614SS**  trans-100.1117.3171.4-170.9-1.2000108.7Q39 N43Q39-N41 PolarHBondContact O-N 3.46Å; N41-N43 VanDerWaalsContact C-N 3.32Å; N41-N43 WeakPolarHBondContact OD1-CB 3.25Å; N41-N43 PolarHBondContact OD1-N 2.99Å
42F76.1Confident79.1Confident177 Ų177113.1 Ų113.178%0.77661%0.605SS**  trans-93.67.8175.7-62.2-78.7000112.5P40 T44P40-F42 HydrophobicContact CB-CE2 3.98Å; P40-F42 HydrophobicContact CB-CZ 4.09Å; P40-F42 HydrophobicContact CG-CE2 4.16Å; F42-T44 PolarHBondContact O-N 3.36Å
43N77.1Confident78.2Confident59 Ų59113.4 Ų113.432%0.31660%0.604SS.*  trans-62.5120.5175.5-171.9-4.4000110.1N41 N45 E47N41-N43 VanDerWaalsContact C-N 3.32Å; N41-N43 WeakPolarHBondContact OD1-CB 3.25Å; N41-N43 PolarHBondContact OD1-N 2.99Å; N43-N45 PolarHBondContact O-N 3.3Å; N43-N45 WeakPolarHBondContact OD1-CB 3.26Å; N43-N45 PolarHBondContact OD1-N 2.95Å; N43-N45 PolarHBondContact OD1-ND2 3.44Å; N43-E47 PolarHBondContact ND2-OE1 3.5Å
44T74.1Confident77.4Confident73 Ų73114 Ų11445%0.44861%0.605SS.*THydrogen-bonded Turntrans-83.411.9176.8550000113.3F42 F46 H66F42-T44 PolarHBondContact O-N 3.36Å; T44-F46 VanDerWaalsContact C-N 3.27Å; T44-F46 WeakPolarHBondContact O-CD2 3.33Å; T44-F46 WeakPolarHBondContact O-CE2 3.34Å; T44-H66 PolarHBondContact O-CE1 3.4Å; T44-H66 PolarHBondContact O-ND1 3.06Å; T44-H66 PolarHBondContact OG1-CE1 3.23Å
45N80.4Confident76.2Confident27 Ų27110.7 Ų110.714%0.14459%0.588CS.*THydrogen-bonded Turntrans-83.1-3176.1-65.9-18.5000113.2N43 E47 R49 N70N43-N45 PolarHBondContact O-N 3.3Å; N43-N45 WeakPolarHBondContact OD1-CB 3.26Å; N43-N45 PolarHBondContact OD1-N 2.95Å; N43-N45 PolarHBondContact OD1-ND2 3.44Å; N45-E47 PolarHBondContact O-N 2.89Å; N45-R49 PolarHBondContact O-NH1 3.48Å; N45-N70 PolarHBondContact OD1-ND2 3.14Å
46F78.1Confident75.2Confident96 Ų96110.3 Ų110.342%0.42158%0.576SS.*  trans48.255.1173.3-55.4-79.2000111.7T44 D48 R49 A63T44-F46 VanDerWaalsContact C-N 3.27Å; T44-F46 WeakPolarHBondContact O-CD2 3.33Å; T44-F46 WeakPolarHBondContact O-CE2 3.34Å; F46-D48 PolarHBondContact O-N 3.3Å; F46-R49 HydrophobicContact CB-CB 4.29Å; F46-R49 VanDerWaalsContact O-CB 3.22Å; F46-R49 WeakPolarHBondContact O-CB 3.44Å; F46-R49 WeakPolarHBondContact O-CD 3.37Å; F46-R49 WeakPolarHBondContact O-CG 3.19Å; F46-R49 PolarHBondContact O-N 3.22Å; F46-R49 PolarHBondContact O-NH1 3.26Å; F46-A63 HydrophobicContact CB-CB 3.73Å; F46-A63 HydrophobicContact CD2-CB 3.71Å; F46-A63 HydrophobicContact CG-CB 3.83Å
47E79.3Confident74.4Confident131 Ų131105.8 Ų105.861%0.61256%0.563SS**THydrogen-bonded Turntrans-59.8-30.6-175.9-68.3175.4-161.500112.3N43 N45 R49N43-E47 PolarHBondContact ND2-OE1 3.5Å; N45-E47 PolarHBondContact O-N 2.89Å; E47-R49 VanDerWaalsContact C-N 3.32Å; E47-R49 PolarHBondContact O-N 2.76Å
48D78.6Confident73.8Confident89 Ų89102.4 Ų102.448%0.47654%0.538SS..THydrogen-bonded Turntrans-86.56.7178.762.2-14.4000113.8F46 N50 A51 F52F46-D48 PolarHBondContact O-N 3.3Å; D48-N50 PolarHBondContact O-N 2.89Å; D48-A51 VanDerWaalsContact O-CB 3.28Å; D48-A51 WeakPolarHBondContact O-CB 3.46Å; D48-A51 PolarHBondContact O-N 2.65Å; D48-F52 HydrophobicContact CB-CE2 4.32Å; D48-F52 WeakPolarHBondContact O-CD2 3.48Å; D48-F52 WeakPolarHBondContact OD2-CE2 3.42Å
49R78.8Confident73.6Confident63 Ų6399.8 Ų99.824%0.23853%0.528CS..G310 helixtrans-50.1-31.6-179.963.9-172.5178.3-1033.3114.1N45 F46 E47 A51 F52 A63 T64N45-R49 PolarHBondContact O-NH1 3.48Å; F46-R49 HydrophobicContact CB-CB 4.29Å; F46-R49 VanDerWaalsContact O-CB 3.22Å; F46-R49 WeakPolarHBondContact O-CB 3.44Å; F46-R49 WeakPolarHBondContact O-CD 3.37Å; F46-R49 WeakPolarHBondContact O-CG 3.19Å; F46-R49 PolarHBondContact O-N 3.22Å; F46-R49 PolarHBondContact O-NH1 3.26Å; E47-R49 VanDerWaalsContact C-N 3.32Å; E47-R49 PolarHBondContact O-N 2.76Å; R49-A51 VanDerWaalsContact C-N 3.33Å; R49-F52 PolarHBondContact O-N 3.17Å; R49-A63 HydrophobicContact CB-CB 4.28Å; R49-T64 PolarHBondContact NE-OG1 3.18Å
50N77.1Confident73.7Confident112 Ų11293.7 Ų93.760%0.59950%0.5SS*.G310 helixtrans-75.9-17.8179.1-66.6-25.9000113.5D48 F52 V53D48-N50 PolarHBondContact O-N 2.89Å; N50-F52 VanDerWaalsContact C-N 3.29Å; N50-V53 WeakPolarHBondContact O-CG2 3.45Å
51A75.4Confident73.9Confident79 Ų7995.2 Ų95.265%0.65350%0.503SS*.G310 helixtrans-75-22.1174.900000112D48 R49 V53D48-A51 VanDerWaalsContact O-CB 3.28Å; D48-A51 WeakPolarHBondContact O-CB 3.46Å; D48-A51 PolarHBondContact O-N 2.65Å; R49-A51 VanDerWaalsContact C-N 3.33Å; A51-V53 PolarHBondContact O-N 3.24Å
52F68.8Low74.4Confident120 Ų12093.7 Ų93.753%0.52649%0.492SS..  trans-9647.9-178.1-62-81000112.8D48 R49 N50 T54 G55D48-F52 HydrophobicContact CB-CE2 4.32Å; D48-F52 WeakPolarHBondContact O-CD2 3.48Å; D48-F52 WeakPolarHBondContact OD2-CE2 3.42Å; R49-F52 PolarHBondContact O-N 3.17Å; N50-F52 VanDerWaalsContact C-N 3.29Å; F52-T54 PolarHBondContact O-N 3.44Å; F52-G55 PolarHBondContact O-N 3.37Å
53V63.9Low74.8Confident118 Ų11885.6 Ų85.672%0.71546%0.458SS*.THydrogen-bonded Turntrans-60.4-26.8-179.2-172.90000112.7N50 A51 G55N50-V53 WeakPolarHBondContact O-CG2 3.45Å; A51-V53 PolarHBondContact O-N 3.24Å; V53-G55 VanDerWaalsContact C-N 3.32Å
54T65.1Low75.3Confident146 Ų14685.7 Ų85.790%0.89646%0.46SS*.THydrogen-bonded Turntrans-81.4-10.317755.90000113.5F52F52-T54 PolarHBondContact O-N 3.44Å
55G59.2Low76Confident35 Ų3583 Ų8336%0.36144%0.444SS..SBendtrans-76.4155.1176.100000111.8F52 V53 A57F52-G55 PolarHBondContact O-N 3.37Å; V53-G55 VanDerWaalsContact C-N 3.32Å; G55-A57 PolarHBondContact O-N 3.44Å
56I64.1Low76.4Confident105 Ų10585 Ų8554%0.53845%0.452SS..  trans-47.6112.7176.6-52.2-178.4000109R58 Y59I56-R58 HydrophobicContact CG2-CB 3.81Å; I56-R58 PolarHBondContact O-N 2.87Å; I56-Y59 HydrophobicContact CB-CD2 3.84Å; I56-Y59 HydrophobicContact CB-CE2 3.94Å; I56-Y59 HydrophobicContact CD1-CE2 3.74Å; I56-Y59 HydrophobicContact CG1-CD2 4.4Å; I56-Y59 HydrophobicContact CG1-CE2 4.1Å; I56-Y59 PolarHBondContact O-N 2.88Å
57A66.9Low77Confident76 Ų7680.9 Ų80.963%0.62844%0.435SS*.Hα-helixtrans-50-25.4-175.200000113.9G55 Y59 I60 E61G55-A57 PolarHBondContact O-N 3.44Å; A57-Y59 VanDerWaalsContact C-N 3.35Å; A57-Y59 PolarHBondContact O-N 3.15Å; A57-I60 PolarHBondContact O-N 3Å; A57-E61 PolarHBondContact O-N 3.01Å
58R72.6Confident77.5Confident100 Ų10076 Ų7638%0.37742%0.415SS..Hα-helixtrans-55-41.3172.2-176.7179.5-77.2-178.6-6.4113.7I56 I60 E61 Q62 D151I56-R58 HydrophobicContact CG2-CB 3.81Å; I56-R58 PolarHBondContact O-N 2.87Å; R58-I60 VanDerWaalsContact C-N 3.34Å; R58-E61 PolarHBondContact O-N 3.4Å; R58-Q62 WeakPolarHBondContact O-CG 3.46Å; R58-Q62 PolarHBondContact O-N 3.45Å; R58-D151 VanDerWaalsContact CZ-CG 3.44Å; R58-D151 IonicContact CZ-OD1 2.83Å; R58-D151 VanDerWaalsContact CZ-OD1 3.24Å; R58-D151 IonicContact CZ-OD2 3.74Å; R58-D151 VanDerWaalsContact CZ-OD2 3.27Å; R58-D151 IonicContact NH1-OD1 2.72Å; R58-D151 PolarHBondContact NH1-OD1 3.24Å; R58-D151 IonicContact NH1-OD2 3.02Å; R58-D151 PolarHBondContact NH1-OD2 3.11Å; R58-D151 IonicContact NH2-OD1 3.37Å; R58-D151 PolarHBondContact NH2-OD1 3.39Å; R58-D151 IonicContact NH2-OD2 3.59Å; R58-D151 PolarHBondContact NH2-OD2 3.39Å
59Y76.9Confident78.2Confident142 Ų14274.9 Ų74.956%0.55741%0.408SS*.Hα-helixtrans-71.6-32.4-178.5-63.5-47.1000111.9I56 A57 Q62 A63I56-Y59 HydrophobicContact CB-CD2 3.84Å; I56-Y59 HydrophobicContact CB-CE2 3.94Å; I56-Y59 HydrophobicContact CD1-CE2 3.74Å; I56-Y59 HydrophobicContact CG1-CD2 4.4Å; I56-Y59 HydrophobicContact CG1-CE2 4.1Å; I56-Y59 PolarHBondContact O-N 2.88Å; A57-Y59 VanDerWaalsContact C-N 3.35Å; A57-Y59 PolarHBondContact O-N 3.15Å; Y59-Q62 PolarHBondContact O-N 2.93Å; Y59-A63 WeakPolarHBondContact O-CB 3.48Å; Y59-A63 PolarHBondContact O-N 3.49Å
60I82.3Confident78.8Confident47 Ų4773.4 Ų73.424%0.24141%0.405CS..Hα-helixtrans-64.2-43.4173.5-59.7175.8000110.2A57 R58 A63 T64A57-I60 PolarHBondContact O-N 3Å; R58-I60 VanDerWaalsContact C-N 3.34Å; I60-A63 PolarHBondContact O-N 3.39Å; I60-T64 WeakPolarHBondContact O-CB 3.33Å; I60-T64 PolarHBondContact O-N 3.24Å; I60-T64 PolarHBondContact O-OG1 3.26Å
61E82.3Confident79.6Confident92 Ų9273.5 Ų73.543%0.4340%0.402SS..Hα-helixtrans-61.5-47.5175.1-169.5-157.5145.200111.2A57 R58 T64 V65 R142A57-E61 PolarHBondContact O-N 3.01Å; R58-E61 PolarHBondContact O-N 3.4Å; E61-T64 PolarHBondContact O-N 2.98Å; E61-V65 WeakPolarHBondContact O-CG2 3.49Å; E61-V65 PolarHBondContact O-N 3.25Å; E61-R142 IonicContact OE1-CZ 3.7Å; E61-R142 IonicContact OE1-NH1 3.24Å; E61-R142 PolarHBondContact OE1-NH1 3.41Å
62Q84.1Confident80.5Confident80 Ų8071.2 Ų71.237%0.37438%0.378SS..Hα-helixtrans-62.5-44.4178.5-74.3-173.3-1700112.4R58 Y59 T64 V65 H66R58-Q62 WeakPolarHBondContact O-CG 3.46Å; R58-Q62 PolarHBondContact O-N 3.45Å; Y59-Q62 PolarHBondContact O-N 2.93Å; Q62-T64 VanDerWaalsContact C-N 3.32Å; Q62-T64 PolarHBondContact O-N 3.42Å; Q62-V65 PolarHBondContact O-N 2.86Å; Q62-H66 VanDerWaalsContact O-CB 3.31Å; Q62-H66 WeakPolarHBondContact O-CB 3.43Å; Q62-H66 PolarHBondContact O-N 3.22Å
63A86.2Confident81.8Confident7 Ų771.2 Ų71.26%0.05838%0.383CS..Hα-helixtrans-59.8-41.7175.800000112F46 R49 Y59 I60 H66 S67F46-A63 HydrophobicContact CB-CB 3.73Å; F46-A63 HydrophobicContact CD2-CB 3.71Å; F46-A63 HydrophobicContact CG-CB 3.83Å; R49-A63 HydrophobicContact CB-CB 4.28Å; Y59-A63 WeakPolarHBondContact O-CB 3.48Å; Y59-A63 PolarHBondContact O-N 3.49Å; I60-A63 PolarHBondContact O-N 3.39Å; A63-H66 PolarHBondContact O-N 3.34Å; A63-S67 WeakPolarHBondContact O-CB 3.21Å; A63-S67 PolarHBondContact O-N 3.48Å
64T87.1Confident83.3Confident61 Ų6171.5 Ų71.537%0.37438%0.376SS..Hα-helixtrans-65-45.1177.7-57.60000111.6R49 I60 E61 Q62 S68R49-T64 PolarHBondContact NE-OG1 3.18Å; I60-T64 WeakPolarHBondContact O-CB 3.33Å; I60-T64 PolarHBondContact O-N 3.24Å; I60-T64 PolarHBondContact O-OG1 3.26Å; E61-T64 PolarHBondContact O-N 2.98Å; Q62-T64 VanDerWaalsContact C-N 3.32Å; Q62-T64 PolarHBondContact O-N 3.42Å; T64-S68 WeakPolarHBondContact O-CB 3.26Å; T64-S68 PolarHBondContact O-N 3.43Å; T64-S68 VanDerWaalsContact O-N 3.12Å
65V88.8Confident84.8Confident17 Ų1767.9 Ų67.910%0.10335%0.35CS..Hα-helixtrans-63.4-43.3175.8170.50000111E61 Q62 S68 M69 E139E61-V65 WeakPolarHBondContact O-CG2 3.49Å; E61-V65 PolarHBondContact O-N 3.25Å; Q62-V65 PolarHBondContact O-N 2.86Å; V65-S68 PolarHBondContact O-N 2.79Å; V65-M69 HydrophobicContact CG1-CE 3.88Å; V65-M69 HydrophobicContact CG1-CG 4.43Å; V65-M69 HydrophobicContact CG1-SD 4.36Å; V65-M69 WeakPolarHBondContact O-CG 3.49Å; V65-M69 PolarHBondContact O-N 3.02Å; V65-E139 VanDerWaalsContact CG1-CD 3.41Å; V65-E139 HydrophobicContact CG1-CG 4.29Å; V65-E139 WeakPolarHBondContact CG1-OE1 3.2Å; V65-E139 WeakPolarHBondContact CG1-OE2 3.48Å
66H88.9Confident86.6Confident69 Ų6967.2 Ų67.232%0.31934%0.342SS..Hα-helixtrans-60.4-49.2179.5-174.1-93.8000111.8T44 Q62 A63 S68 M69 N70T44-H66 PolarHBondContact O-CE1 3.4Å; T44-H66 PolarHBondContact O-ND1 3.06Å; T44-H66 PolarHBondContact OG1-CE1 3.23Å; Q62-H66 VanDerWaalsContact O-CB 3.31Å; Q62-H66 WeakPolarHBondContact O-CB 3.43Å; Q62-H66 PolarHBondContact O-N 3.22Å; A63-H66 PolarHBondContact O-N 3.34Å; H66-S68 VanDerWaalsContact C-N 3.31Å; H66-S68 PolarHBondContact O-N 2.92Å; H66-M69 PolarHBondContact O-N 3.29Å; H66-M69 VanDerWaalsContact O-N 3.13Å; H66-N70 PolarHBondContact CE1-ND2 2.98Å; H66-N70 PolarHBondContact ND1-ND2 3Å; H66-N70 PolarHBondContact O-N 3.09Å
67S89.8Confident88.2Confident9 Ų968 Ų686%0.06334%0.344CS..Hα-helixtrans-54.8-47.1174.6-1720000111.4A63 M69 N70 E71A63-S67 WeakPolarHBondContact O-CB 3.21Å; A63-S67 PolarHBondContact O-N 3.48Å; S67-M69 VanDerWaalsContact C-N 3.32Å; S67-M69 PolarHBondContact O-N 3.04Å; S67-N70 PolarHBondContact O-N 3.43Å; S67-E71 WeakPolarHBondContact O-CG 3.49Å; S67-E71 PolarHBondContact O-N 2.8Å
68S90.4Very high89.7Confident28 Ų2871.1 Ų71.120%0.19635%0.345CS..Hα-helixtrans-65.9-31.5179.5-179.50000113.3T64 V65 H66 M72 R135T64-S68 WeakPolarHBondContact O-CB 3.26Å; T64-S68 PolarHBondContact O-N 3.43Å; T64-S68 VanDerWaalsContact O-N 3.12Å; V65-S68 PolarHBondContact O-N 2.79Å; H66-S68 VanDerWaalsContact C-N 3.31Å; H66-S68 PolarHBondContact O-N 2.92Å; S68-M72 PolarHBondContact O-N 3.47Å; S68-R135 PolarHBondContact OG-NH1 3.48Å; S68-R135 PolarHBondContact OG-NH2 3.35Å
69M92.3Very high90.9Very high66 Ų6668 Ų6833%0.32533%0.334SS..Hα-helixtrans-71.3-36.9172.8-74.1-176.5175.100112.1V65 H66 S67 M72 L73 E139V65-M69 HydrophobicContact CG1-CE 3.88Å; V65-M69 HydrophobicContact CG1-CG 4.43Å; V65-M69 HydrophobicContact CG1-SD 4.36Å; V65-M69 WeakPolarHBondContact O-CG 3.49Å; V65-M69 PolarHBondContact O-N 3.02Å; H66-M69 PolarHBondContact O-N 3.29Å; H66-M69 VanDerWaalsContact O-N 3.13Å; S67-M69 VanDerWaalsContact C-N 3.32Å; S67-M69 PolarHBondContact O-N 3.04Å; M69-M72 PolarHBondContact O-N 3.36Å; M69-L73 WeakPolarHBondContact O-CB 3.4Å; M69-L73 PolarHBondContact O-N 3.2Å; M69-E139 HydrophobicContact CE-CB 3.32Å; M69-E139 HydrophobicContact CE-CG 3.31Å
70N92.8Very high91.9Very high33 Ų3363.5 Ų63.518%0.17633%0.326CS..Hα-helixtrans-65-42.9176.3-78.1-16.6000111.7N45 H66 S67 M72 L73 E74N45-N70 PolarHBondContact OD1-ND2 3.14Å; H66-N70 PolarHBondContact CE1-ND2 2.98Å; H66-N70 PolarHBondContact ND1-ND2 3Å; H66-N70 PolarHBondContact O-N 3.09Å; S67-N70 PolarHBondContact O-N 3.43Å; N70-M72 VanDerWaalsContact C-N 3.29Å; N70-M72 PolarHBondContact O-N 3.46Å; N70-L73 WeakPolarHBondContact O-CB 3.28Å; N70-L73 PolarHBondContact O-N 2.85Å; N70-L73 VanDerWaalsContact O-N 3.08Å; N70-E74 WeakPolarHBondContact O-CG 3.41Å; N70-E74 PolarHBondContact O-N 3.41Å
71E92.8Very high92.6Very high114 Ų11465 Ų6553%0.53334%0.337SS..Hα-helixtrans-56.1-44.7173.8-71.1165.1-163.300111.5S67 L73 E74 E75S67-E71 WeakPolarHBondContact O-CG 3.49Å; S67-E71 PolarHBondContact O-N 2.8Å; E71-L73 VanDerWaalsContact C-N 3.33Å; E71-L73 PolarHBondContact O-N 3.37Å; E71-E74 PolarHBondContact O-N 3.24Å; E71-E75 PolarHBondContact O-N 2.87Å
72M95.6Very high93.2Very high31 Ų3162.3 Ų62.315%0.15333%0.325CS..Hα-helixtrans-67.2-33.1176.8-178.6177.7-7400112.9S68 M69 N70 G76 F128 A132 R135S68-M72 PolarHBondContact O-N 3.47Å; M69-M72 PolarHBondContact O-N 3.36Å; N70-M72 VanDerWaalsContact C-N 3.29Å; N70-M72 PolarHBondContact O-N 3.46Å; M72-G76 PolarHBondContact O-N 2.92Å; M72-F128 HydrophobicContact CG-CE2 3.89Å; M72-F128 HydrophobicContact CG-CZ 4.23Å; M72-F128 WeakPolarHBondContact O-CE2 3.41Å; M72-F128 WeakPolarHBondContact O-CZ 3.47Å; M72-A132 HydrophobicContact CG-CB 4.29Å; M72-A132 VanDerWaalsContact SD-CA 3.52Å; M72-A132 HydrophobicContact SD-CB 3.78Å; M72-R135 HydrophobicContact CE-CB 3.68Å; M72-R135 HydrophobicContact CE-CG 3.95Å; M72-R135 HydrophobicContact SD-CB 4.21Å; M72-R135 HydrophobicContact SD-CG 4.44Å
73L95.3Very high93.7Very high120 Ų12062.1 Ų62.163%0.62833%0.326SS*.Hα-helixtrans-68.1-42.1175.5-178.164.9000111.2M69 N70 E71 G76 Q77M69-L73 WeakPolarHBondContact O-CB 3.4Å; M69-L73 PolarHBondContact O-N 3.2Å; N70-L73 WeakPolarHBondContact O-CB 3.28Å; N70-L73 PolarHBondContact O-N 2.85Å; N70-L73 VanDerWaalsContact O-N 3.08Å; E71-L73 VanDerWaalsContact C-N 3.33Å; E71-L73 PolarHBondContact O-N 3.37Å; L73-G76 PolarHBondContact O-N 3Å; L73-Q77 PolarHBondContact O-N 3.16Å
74E95.1Very high94.2Very high123 Ų12371.7 Ų71.758%0.57536%0.362SS*.Hα-helixtrans-62.2-49.6174.8-72.4176.1-171.400111.2N70 E71 G76 Q77 E78N70-E74 WeakPolarHBondContact O-CG 3.41Å; N70-E74 PolarHBondContact O-N 3.41Å; E71-E74 PolarHBondContact O-N 3.24Å; E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 3.23Å; E74-Q77 WeakPolarHBondContact O-CB 3.2Å; E74-Q77 PolarHBondContact O-N 3.49Å; E74-E78 PolarHBondContact O-N 3.37Å
75E97Very high94.7Very high71 Ų7172.5 Ų72.533%0.33237%0.367SS..Hα-helixtrans-58.4-41.7175-168.4-169.7168.400111.3E71 Q77 E78 Y79 F128E71-E75 PolarHBondContact O-N 2.87Å; E75-Q77 VanDerWaalsContact C-N 3.27Å; E75-Q77 PolarHBondContact O-N 2.92Å; E75-E78 WeakPolarHBondContact O-CB 3.3Å; E75-E78 PolarHBondContact O-N 2.91Å; E75-Y79 HydrophobicContact CG-CD2 4.29Å; E75-Y79 HydrophobicContact CG-CE2 3.76Å; E75-Y79 VanDerWaalsContact O-CD2 3.26Å; E75-Y79 WeakPolarHBondContact O-CD2 3.35Å; E75-Y79 PolarHBondContact O-N 3.36Å; E75-Y79 WeakPolarHBondContact OE1-CE2 3.41Å; E75-F128 HydrophobicContact CB-CD2 4.35Å; E75-F128 HydrophobicContact CB-CE2 3.91Å; E75-F128 HydrophobicContact CG-CD2 3.89Å; E75-F128 HydrophobicContact CG-CE2 3.96Å; E75-F128 WeakPolarHBondContact OE1-CD2 2.99Å; E75-F128 WeakPolarHBondContact OE2-CD2 3.47Å
76G97.8Very high94.9Very high20 Ų2075.6 Ų75.621%0.20638%0.377CS..Hα-helixtrans-61.5-34.3175.800000113.7M72 L73 E74 Y79 A80M72-G76 PolarHBondContact O-N 2.92Å; L73-G76 PolarHBondContact O-N 3Å; E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 3.23Å; G76-Y79 PolarHBondContact O-N 3.47Å; G76-A80 PolarHBondContact O-N 3.08Å
77Q97.6Very high95.1Very high122 Ų12282.4 Ų82.457%0.5740%0.4SS*.Hα-helixtrans-67.9-37.5176.4-171.964.910.300111.5L73 E74 E75 Y79 A80 V81L73-Q77 PolarHBondContact O-N 3.16Å; E74-Q77 WeakPolarHBondContact O-CB 3.2Å; E74-Q77 PolarHBondContact O-N 3.49Å; E75-Q77 VanDerWaalsContact C-N 3.27Å; E75-Q77 PolarHBondContact O-N 2.92Å; Q77-Y79 VanDerWaalsContact C-N 3.34Å; Q77-Y79 PolarHBondContact O-N 3Å; Q77-A80 WeakPolarHBondContact O-CB 3.38Å; Q77-A80 PolarHBondContact O-N 3.35Å; Q77-V81 WeakPolarHBondContact O-CG2 3.34Å; Q77-V81 PolarHBondContact O-N 3.36Å
78E97.4Very high95Very high142 Ų14286 Ų8666%0.66443%0.425SS*.Hα-helixtrans-60.7-44.8174-61.6-173.6171.100111.3E74 E75 A80 V81 M82E74-E78 PolarHBondContact O-N 3.37Å; E75-E78 WeakPolarHBondContact O-CB 3.3Å; E75-E78 PolarHBondContact O-N 2.91Å; E78-A80 PolarHBondContact O-N 2.93Å; E78-V81 PolarHBondContact O-N 3.48Å; E78-M82 WeakPolarHBondContact O-CB 3.26Å; E78-M82 PolarHBondContact O-N 3.5Å
79Y98.1Very high94.8Very high34 Ų3486.3 Ų86.313%0.13343%0.427CS..Hα-helixtrans-65.4-36.2174.9-70.4-63.2000112.9E75 G76 Q77 V81 M82 L83 N124 F125 F128E75-Y79 HydrophobicContact CG-CD2 4.29Å; E75-Y79 HydrophobicContact CG-CE2 3.76Å; E75-Y79 VanDerWaalsContact O-CD2 3.26Å; E75-Y79 WeakPolarHBondContact O-CD2 3.35Å; E75-Y79 PolarHBondContact O-N 3.36Å; E75-Y79 WeakPolarHBondContact OE1-CE2 3.41Å; G76-Y79 PolarHBondContact O-N 3.47Å; Q77-Y79 VanDerWaalsContact C-N 3.34Å; Q77-Y79 PolarHBondContact O-N 3Å; Y79-V81 VanDerWaalsContact C-N 3.34Å; Y79-V81 PolarHBondContact O-N 3.2Å; Y79-M82 HydrophobicContact CD1-CE 3.93Å; Y79-M82 HydrophobicContact CD1-SD 4.21Å; Y79-M82 WeakPolarHBondContact O-CB 3.44Å; Y79-M82 PolarHBondContact O-N 2.91Å; Y79-L83 WeakPolarHBondContact O-CB 3.44Å; Y79-L83 WeakPolarHBondContact O-CG 3.5Å; Y79-L83 PolarHBondContact O-N 2.94Å; Y79-N124 HydrophobicContact CE1-CB 4.3Å; Y79-N124 PolarHBondContact OH-O 3.36Å; Y79-F125 HydrophobicContact CD1-CB 3.77Å; Y79-F125 AromaticContact CD1-CD2 3.8Å; Y79-F125 HydrophobicContact CD1-CD2 3.8Å; Y79-F125 HydrophobicContact CD1-CG 4.23Å; Y79-F125 HydrophobicContact CD2-CD2 4.28Å; Y79-F125 HydrophobicContact CE1-CB 3.9Å; Y79-F125 HydrophobicContact CG-CB 4.48Å; Y79-F125 AromaticContact CG-CD2 3.66Å; Y79-F125 HydrophobicContact CG-CD2 3.66Å; Y79-F125 HydrophobicContact CG-CE2 4.45Å; Y79-F128 HydrophobicContact CD2-CB 3.97Å; Y79-F128 AromaticContact CD2-CD1 3.45Å; Y79-F128 HydrophobicContact CD2-CD1 3.45Å; Y79-F128 VanDerWaalsContact CD2-CD1 3.45Å; Y79-F128 HydrophobicContact CD2-CD2 4.09Å; Y79-F128 AromaticContact CD2-CE1 3.95Å; Y79-F128 HydrophobicContact CD2-CE1 3.95Å; Y79-F128 AromaticContact CD2-CG 3.54Å; Y79-F128 HydrophobicContact CD2-CG 3.54Å; Y79-F128 HydrophobicContact CD2-CZ 4.45Å; Y79-F128 HydrophobicContact CE2-CB 3.32Å; Y79-F128 AromaticContact CE2-CD1 3.74Å; Y79-F128 HydrophobicContact CE2-CD1 3.74Å; Y79-F128 AromaticContact CE2-CD2 3.74Å; Y79-F128 HydrophobicContact CE2-CD2 3.74Å; Y79-F128 HydrophobicContact CE2-CE2 4.5Å; Y79-F128 AromaticContact CE2-CG 3.29Å; Y79-F128 HydrophobicContact CE2-CG 3.29Å; Y79-F128 HydrophobicContact CG-CD1 4.35Å
80A97.3Very high94.5Very high47 Ų4786.5 Ų86.539%0.38844%0.435SS..Hα-helixtrans-61.8-43.1174.800000111.5G76 Q77 E78 L83 Y84G76-A80 PolarHBondContact O-N 3.08Å; Q77-A80 WeakPolarHBondContact O-CB 3.38Å; Q77-A80 PolarHBondContact O-N 3.35Å; E78-A80 PolarHBondContact O-N 2.93Å; A80-L83 PolarHBondContact O-N 2.93Å; A80-Y84 WeakPolarHBondContact O-CB 3.34Å; A80-Y84 PolarHBondContact O-N 3.15Å
81V97.3Very high94.2Very high80 Ų8096.4 Ų96.449%0.48547%0.47SS..Hα-helixtrans-64.2-43.7174.4173.50000111.1Q77 E78 Y79 L83 Y84 T85Q77-V81 WeakPolarHBondContact O-CG2 3.34Å; Q77-V81 PolarHBondContact O-N 3.36Å; E78-V81 PolarHBondContact O-N 3.48Å; Y79-V81 VanDerWaalsContact C-N 3.34Å; Y79-V81 PolarHBondContact O-N 3.2Å; V81-L83 PolarHBondContact O-N 3.39Å; V81-Y84 PolarHBondContact O-N 2.9Å; V81-T85 WeakPolarHBondContact O-CG2 3.4Å; V81-T85 PolarHBondContact O-N 3.39Å; V81-T85 PolarHBondContact O-OG1 3.01Å
82M95.8Very high94Very high34 Ų3494.9 Ų94.917%0.16748%0.476CS..Hα-helixtrans-57.5-47.9176-178.1-162.773.300111.5E78 Y79 T85 W86 K121 F125E78-M82 WeakPolarHBondContact O-CB 3.26Å; E78-M82 PolarHBondContact O-N 3.5Å; Y79-M82 HydrophobicContact CD1-CE 3.93Å; Y79-M82 HydrophobicContact CD1-SD 4.21Å; Y79-M82 WeakPolarHBondContact O-CB 3.44Å; Y79-M82 PolarHBondContact O-N 2.91Å; M82-T85 CarbonylContact O-C 3.59Å; M82-T85 PolarHBondContact O-N 3.44Å; M82-T85 PolarHBondContact O-OG1 3.42Å; M82-W86 HydrophobicContact CG-CE3 4.24Å; M82-W86 HydrophobicContact CG-CZ3 4.47Å; M82-W86 PolarHBondContact O-N 3.11Å; M82-W86 HydrophobicContact SD-CZ3 4.35Å; M82-K121 HydrophobicContact SD-CB 3.78Å; M82-K121 HydrophobicContact SD-CD 4.34Å; M82-K121 HydrophobicContact SD-CG 4.22Å; M82-F125 HydrophobicContact CE-CB 4.11Å; M82-F125 HydrophobicContact CE-CG 4.44Å
83L95.4Very high93.6Very high77 Ų7795 Ų9540%0.40348%0.477SS..Hα-helixtrans-67.2-40.3179.5-70.9173.5000112.3Y79 A80 V81 T85 W86 F125Y79-L83 WeakPolarHBondContact O-CB 3.44Å; Y79-L83 WeakPolarHBondContact O-CG 3.5Å; Y79-L83 PolarHBondContact O-N 2.94Å; A80-L83 PolarHBondContact O-N 2.93Å; V81-L83 PolarHBondContact O-N 3.39Å; L83-T85 VanDerWaalsContact C-N 3.26Å; L83-T85 PolarHBondContact O-N 2.89Å; L83-W86 VanDerWaalsContact O-CB 3.25Å; L83-W86 WeakPolarHBondContact O-CB 3.45Å; L83-W86 PolarHBondContact O-N 3.46Å; L83-F125 HydrophobicContact CD1-CE1 3.99Å; L83-F125 HydrophobicContact CD1-CE2 3.98Å; L83-F125 HydrophobicContact CD1-CZ 3.66Å
84Y96.8Very high93.3Very high208 Ų20893.3 Ų93.382%0.81647%0.474SS*.Hα-helixtrans-61.6-37.2176.8178.1-103.5000112.2A80 V81A80-Y84 WeakPolarHBondContact O-CB 3.34Å; A80-Y84 PolarHBondContact O-N 3.15Å; V81-Y84 PolarHBondContact O-N 2.9Å
85T95.6Very high92.9Very high78 Ų7895 Ų9548%0.47948%0.482SS..Hα-helixtrans-90.9-1.4179.658.20000113.6V81 M82 L83 R87V81-T85 WeakPolarHBondContact O-CG2 3.4Å; V81-T85 PolarHBondContact O-N 3.39Å; V81-T85 PolarHBondContact O-OG1 3.01Å; M82-T85 CarbonylContact O-C 3.59Å; M82-T85 PolarHBondContact O-N 3.44Å; M82-T85 PolarHBondContact O-OG1 3.42Å; L83-T85 VanDerWaalsContact C-N 3.26Å; L83-T85 PolarHBondContact O-N 2.89Å; T85-R87 PolarHBondContact O-N 3.31Å
86W94.8Very high92.6Very high81 Ų8193.4 Ų93.431%0.30748%0.477SS..  trans-62.5130.3-176.2-169-91.6000111.9M82 L83 E118 K121 L122M82-W86 HydrophobicContact CG-CE3 4.24Å; M82-W86 HydrophobicContact CG-CZ3 4.47Å; M82-W86 PolarHBondContact O-N 3.11Å; M82-W86 HydrophobicContact SD-CZ3 4.35Å; L83-W86 VanDerWaalsContact O-CB 3.25Å; L83-W86 WeakPolarHBondContact O-CB 3.45Å; L83-W86 PolarHBondContact O-N 3.46Å; W86-E118 HydrophobicContact CH2-CB 3.91Å; W86-E118 WeakPolarHBondContact CH2-O 3.31Å; W86-E118 WeakPolarHBondContact CH2-OE2 3.45Å; W86-E118 HydrophobicContact CZ2-CB 4.24Å; W86-E118 WeakPolarHBondContact CZ3-OE2 3.5Å; W86-K121 HydrophobicContact CH2-CB 4.35Å; W86-K121 HydrophobicContact CZ3-CB 4Å; W86-K121 HydrophobicContact CZ3-CD 3.95Å; W86-L122 HydrophobicContact CH2-CD1 4.09Å; W86-L122 HydrophobicContact CH2-CD2 3.84Å; W86-L122 HydrophobicContact CH2-CG 3.64Å; W86-L122 HydrophobicContact CZ2-CD1 3.85Å; W86-L122 HydrophobicContact CZ2-CD2 3.97Å; W86-L122 HydrophobicContact CZ2-CG 3.88Å; W86-L122 HydrophobicContact CZ3-CD2 4.15Å; W86-L122 HydrophobicContact CZ3-CG 4.33Å
87R92.8Very high92.2Very high212 Ų212101.6 Ų101.680%0.851%0.507SS*.  trans-130.2129.5173.6-70.8-163.1170.482-0110.5T85 C89T85-R87 PolarHBondContact O-N 3.31Å; R87-C89 PolarHBondContact O-N 3.38Å
88S87.6Confident91.9Very high84 Ų8499 Ų9959%0.58750%0.501SS*.  trans-65.9127.2176.9-174.40000111.1S90S88-S90 VanDerWaalsContact C-N 3.33Å; S88-S90 WeakPolarHBondContact OG-CB 3.5Å; S88-S90 PolarHBondContact OG-N 2.93Å; S88-S90 PolarHBondContact OG-OG 3.43Å
89C86.7Confident91.3Very high36 Ų3698.3 Ų98.324%0.24350%0.502CS..  trans-86.3-1.3170.657.30000113.3R87 R91 A92 I93 L115R87-C89 PolarHBondContact O-N 3.38Å; C89-R91 PolarHBondContact O-N 3.48Å; C89-R91 VanDerWaalsContact O-N 3.08Å; C89-A92 WeakPolarHBondContact O-CA 3.25Å; C89-A92 PolarHBondContact O-N 3.43Å; C89-I93 WeakPolarHBondContact O-CG1 3.35Å; C89-I93 PolarHBondContact O-N 3.37Å; C89-I93 VanDerWaalsContact O-N 3.15Å; C89-L115 VanDerWaalsContact SG-CD2 3.6Å
90S84.9Confident90.9Very high69 Ų69105.3 Ų105.348%0.48354%0.536SS..THydrogen-bonded Turntrans-51.9-36.9-176.756.30000114.1S88S88-S90 VanDerWaalsContact C-N 3.33Å; S88-S90 WeakPolarHBondContact OG-CB 3.5Å; S88-S90 PolarHBondContact OG-N 2.93Å; S88-S90 PolarHBondContact OG-OG 3.43Å
91R87.8Confident90.6Very high241 Ų241104.8 Ų104.891%0.90953%0.526SS*.THydrogen-bonded Turntrans-79.1-22.6178-73-172.1-81.7175.4-7.1113.8C89C89-R91 PolarHBondContact O-N 3.48Å; C89-R91 VanDerWaalsContact O-N 3.08Å
92A87.6Confident90.3Very high82 Ų82107.4 Ų107.468%0.67854%0.544SS*.THydrogen-bonded Turntrans-87.5-19-179.200000112.5C89 P94C89-A92 WeakPolarHBondContact O-CA 3.25Å; C89-A92 PolarHBondContact O-N 3.43Å; A92-P94 WeakPolarHBondContact O-CD 3.37Å
93I88.3Confident90.2Very high33 Ų33108.9 Ų108.917%0.16955%0.553CS.*SBendtrans-72.2121.7-179-67.5166.1000110C89 Q95 T111 L115C89-I93 WeakPolarHBondContact O-CG1 3.35Å; C89-I93 PolarHBondContact O-N 3.37Å; C89-I93 VanDerWaalsContact O-N 3.15Å; I93-Q95 PolarHBondContact O-N 3.1Å; I93-T111 HydrophobicContact CG2-CG2 3.77Å; I93-L115 HydrophobicContact CD1-CD1 4.04Å; I93-L115 HydrophobicContact CD1-CD2 3.58Å; I93-L115 HydrophobicContact CD1-CG 3.85Å
94P88.2Confident90.1Very high86 Ų86109.7 Ų109.756%0.55855%0.55SS**PPolyproline II helixtrans-60.5134.1175-21.633.1000111.3A92 I107A92-P94 WeakPolarHBondContact O-CD 3.37Å; P94-I107 HydrophobicContact CB-CG2 4.26Å; P94-I107 WeakPolarHBondContact O-CG2 3.47Å
95Q87Confident89.9Confident159 Ų159103.6 Ų103.674%0.74354%0.535SS*.PPolyproline II helixtrans-99.4139.9174.6-63.4-159.5-7.900111.3I93 K97I93-Q95 PolarHBondContact O-N 3.1Å; Q95-K97 PolarHBondContact O-N 3.5Å
96V90.8Very high89.8Confident37 Ų37105.1 Ų105.122%0.22454%0.536CS..PPolyproline II helixtrans-67.7123.7171.9176.20000108.7C98 R104 I107 Y108V96-C98 VanDerWaalsContact CG1-O 3.29Å; V96-C98 WeakPolarHBondContact CG1-O 3.46Å; V96-R104 HydrophobicContact CG1-CB 4.48Å; V96-R104 HydrophobicContact CG1-CG 3.77Å; V96-R104 HydrophobicContact CG2-CG 3.91Å; V96-I107 HydrophobicContact CG2-CB 4.3Å; V96-I107 HydrophobicContact CG2-CG2 3.93Å; V96-Y108 HydrophobicContact CG2-CE1 4.06Å; V96-Y108 HydrophobicContact CG2-CE2 4.01Å
97K89.2Confident89.7Confident191 Ų191102.1 Ų102.183%0.8353%0.526SS*.  trans-86.1-34.1-175.8-64.9-176.1-179.61790113Q95Q95-K97 PolarHBondContact O-N 3.5Å
98C90.4Very high89.7Confident68 Ų6898 Ų9846%0.45951%0.512SS..  trans-152.7162.7177.270.70000111V96 E100 Q101V96-C98 VanDerWaalsContact CG1-O 3.29Å; V96-C98 WeakPolarHBondContact CG1-O 3.46Å; C98-E100 PolarHBondContact O-N 3.37Å; C98-Q101 WeakPolarHBondContact O-CB 3.18Å; C98-Q101 PolarHBondContact O-N 3.21Å
99N85.2Confident90.1Very high128 Ų128100 Ų10068%0.68451%0.512SS*.THydrogen-bonded Turntrans-65.3-27.5179.4-74.6-22.3000112.9Q101 R104N99-Q101 VanDerWaalsContact C-N 3.26Å; N99-Q101 PolarHBondContact O-N 2.85Å; N99-R104 PolarHBondContact O-NH1 3.49Å
100E90.1Very high90.4Very high180 Ų180103.1 Ų103.184%0.84152%0.521SS*.THydrogen-bonded Turntrans-864.3-177.5-62.2179.8166.400113.4C98 P102C98-E100 PolarHBondContact O-N 3.37Å; E100-P102 WeakPolarHBondContact O-CD 3.48Å
101Q90.8Very high90.8Very high37 Ų37101.2 Ų101.217%0.17351%0.507CS..  trans-61.5122.5-179.1-178.5170.1-8.400111.1C98 N99 N103 R104C98-Q101 WeakPolarHBondContact O-CB 3.18Å; C98-Q101 PolarHBondContact O-N 3.21Å; N99-Q101 VanDerWaalsContact C-N 3.26Å; N99-Q101 PolarHBondContact O-N 2.85Å; Q101-N103 VanDerWaalsContact C-N 3.33Å; Q101-N103 WeakPolarHBondContact CG-OD1 3.27Å; Q101-N103 PolarHBondContact NE2-OD1 2.99Å; Q101-N103 PolarHBondContact O-N 2.9Å; Q101-R104 HydrophobicContact CB-CB 4.43Å; Q101-R104 VanDerWaalsContact O-CB 3.25Å; Q101-R104 WeakPolarHBondContact O-CB 3.06Å; Q101-R104 PolarHBondContact O-N 3.23Å; Q101-R104 VanDerWaalsContact O-N 3.15Å
102P91.6Very high91.1Very high135 Ų13594.3 Ų94.388%0.87749%0.491SS*.THydrogen-bonded Turntrans-58.8-38.4-173.3-26.733.8000114.4E100E100-P102 WeakPolarHBondContact O-CD 3.48Å
103N92.9Very high91.3Very high65 Ų6595.6 Ų95.635%0.34848%0.483SS..THydrogen-bonded Turntrans-95.622.5-178.468.3-33.2000113.6Q101 V105 E106 I107Q101-N103 VanDerWaalsContact C-N 3.33Å; Q101-N103 WeakPolarHBondContact CG-OD1 3.27Å; Q101-N103 PolarHBondContact NE2-OD1 2.99Å; Q101-N103 PolarHBondContact O-N 2.9Å; N103-V105 VanDerWaalsContact C-N 3.35Å; N103-V105 PolarHBondContact O-N 3.14Å; N103-E106 HydrophobicContact CB-CB 4.45Å; N103-E106 PolarHBondContact O-N 3.49Å; N103-I107 WeakPolarHBondContact O-CG1 3.49Å; N103-I107 PolarHBondContact O-N 2.82Å
104R93.5Very high91.5Very high93 Ų9397.5 Ų97.535%0.35150%0.496SS..Hα-helixtrans-57.1-45.2-178.5-177.6-174.980.4-139.20.3113V96 N99 Q101 I107 Y108V96-R104 HydrophobicContact CG1-CB 4.48Å; V96-R104 HydrophobicContact CG1-CG 3.77Å; V96-R104 HydrophobicContact CG2-CG 3.91Å; N99-R104 PolarHBondContact O-NH1 3.49Å; Q101-R104 HydrophobicContact CB-CB 4.43Å; Q101-R104 VanDerWaalsContact O-CB 3.25Å; Q101-R104 WeakPolarHBondContact O-CB 3.06Å; Q101-R104 PolarHBondContact O-N 3.23Å; Q101-R104 VanDerWaalsContact O-N 3.15Å; R104-I107 PolarHBondContact O-N 2.97Å; R104-Y108 HydrophobicContact CG-CD2 4.01Å; R104-Y108 HydrophobicContact CG-CE2 3.55Å; R104-Y108 WeakPolarHBondContact O-CD2 3.4Å; R104-Y108 PolarHBondContact O-N 3.06Å
105V92.8Very high91.8Very high81 Ų8196.3 Ų96.349%0.49149%0.485SS..Hα-helixtrans-64.8-47.4-178.4178.40000110.2N103 I107 Y108 E109N103-V105 VanDerWaalsContact C-N 3.35Å; N103-V105 PolarHBondContact O-N 3.14Å; V105-I107 VanDerWaalsContact C-N 3.31Å; V105-I107 PolarHBondContact O-N 3.18Å; V105-Y108 PolarHBondContact O-N 3.39Å; V105-Y108 VanDerWaalsContact O-N 3.08Å; V105-E109 HydrophobicContact CG1-CG 4.32Å; V105-E109 WeakPolarHBondContact O-CG 3.49Å; V105-E109 PolarHBondContact O-N 3.37Å
106E93.8Very high92.2Very high109 Ų10994.8 Ų94.851%0.50948%0.477SS..Hα-helixtrans-57.5-42.3177-173.9-174.2179.400112N103 Y108 E109 K110N103-E106 HydrophobicContact CB-CB 4.45Å; N103-E106 PolarHBondContact O-N 3.49Å; E106-Y108 VanDerWaalsContact C-N 3.34Å; E106-Y108 PolarHBondContact O-N 3.21Å; E106-E109 PolarHBondContact O-N 2.89Å; E106-K110 HydrophobicContact CG-CG 4.48Å; E106-K110 WeakPolarHBondContact O-CB 3.44Å; E106-K110 WeakPolarHBondContact O-CG 3.39Å; E106-K110 PolarHBondContact O-N 3.42Å
107I92.9Very high92.4Very high18 Ų1895.8 Ų95.89%0.09249%0.485CS..Hα-helixtrans-60.3-43.3176.1-71168.6000111.4P94 V96 N103 R104 V105 T111P94-I107 HydrophobicContact CB-CG2 4.26Å; P94-I107 WeakPolarHBondContact O-CG2 3.47Å; V96-I107 HydrophobicContact CG2-CB 4.3Å; V96-I107 HydrophobicContact CG2-CG2 3.93Å; N103-I107 WeakPolarHBondContact O-CG1 3.49Å; N103-I107 PolarHBondContact O-N 2.82Å; R104-I107 PolarHBondContact O-N 2.97Å; V105-I107 VanDerWaalsContact C-N 3.31Å; V105-I107 PolarHBondContact O-N 3.18Å; I107-T111 WeakPolarHBondContact O-CB 3.46Å; I107-T111 PolarHBondContact O-N 3.38Å; I107-T111 PolarHBondContact O-OG1 2.93Å
108Y92.8Very high92.6Very high126 Ų12689 Ų8949%0.49446%0.456SS..Hα-helixtrans-67.9-44.9178.5-72.4-52.8000112.3V96 R104 V105 E106 K110 T111 V112V96-Y108 HydrophobicContact CG2-CE1 4.06Å; V96-Y108 HydrophobicContact CG2-CE2 4.01Å; R104-Y108 HydrophobicContact CG-CD2 4.01Å; R104-Y108 HydrophobicContact CG-CE2 3.55Å; R104-Y108 WeakPolarHBondContact O-CD2 3.4Å; R104-Y108 PolarHBondContact O-N 3.06Å; V105-Y108 PolarHBondContact O-N 3.39Å; V105-Y108 VanDerWaalsContact O-N 3.08Å; E106-Y108 VanDerWaalsContact C-N 3.34Å; E106-Y108 PolarHBondContact O-N 3.21Å; Y108-K110 VanDerWaalsContact C-N 3.34Å; Y108-K110 PolarHBondContact O-N 3.36Å; Y108-T111 WeakPolarHBondContact O-CB 3.21Å; Y108-T111 PolarHBondContact O-N 2.86Å; Y108-T111 VanDerWaalsContact O-N 3.15Å; Y108-V112 WeakPolarHBondContact O-CG2 3.43Å; Y108-V112 PolarHBondContact O-N 3.13Å
109E94.1Very high92.8Very high125 Ų12590 Ų9058%0.58446%0.46SS*.Hα-helixtrans-58.1-47.7176.7-71.7175.1164.500110.9V105 E106 T111 V112 E113V105-E109 HydrophobicContact CG1-CG 4.32Å; V105-E109 WeakPolarHBondContact O-CG 3.49Å; V105-E109 PolarHBondContact O-N 3.37Å; E106-E109 PolarHBondContact O-N 2.89Å; E109-T111 VanDerWaalsContact C-N 3.32Å; E109-T111 PolarHBondContact O-N 3.36Å; E109-V112 PolarHBondContact O-N 2.93Å; E109-E113 PolarHBondContact O-N 3.37Å
110K93.3Very high93.3Very high103 Ų10387.1 Ų87.145%0.44845%0.447SS..Hα-helixtrans-65.9-32.9176-69-53.3-175-174.70113.4E106 Y108 E113 V114E106-K110 HydrophobicContact CG-CG 4.48Å; E106-K110 WeakPolarHBondContact O-CB 3.44Å; E106-K110 WeakPolarHBondContact O-CG 3.39Å; E106-K110 PolarHBondContact O-N 3.42Å; Y108-K110 VanDerWaalsContact C-N 3.34Å; Y108-K110 PolarHBondContact O-N 3.36Å; K110-E113 WeakPolarHBondContact CD-OE2 3.49Å; K110-E113 WeakPolarHBondContact CE-OE2 3.35Å; K110-E113 IonicContact NZ-OE1 3.26Å; K110-E113 PolarHBondContact NZ-OE1 3.27Å; K110-E113 IonicContact NZ-OE2 2.65Å; K110-E113 PolarHBondContact NZ-OE2 3.12Å; K110-V114 WeakPolarHBondContact O-CB 3.3Å; K110-V114 VanDerWaalsContact O-CG2 3.26Å; K110-V114 WeakPolarHBondContact O-CG2 3.38Å; K110-V114 PolarHBondContact O-N 2.78Å
111T93.5Very high93.6Very high29 Ų2982.6 Ų82.618%0.17843%0.425CS..Hα-helixtrans-63.8-43.9174.7-62.30000111I93 I107 Y108 E109 L115I93-T111 HydrophobicContact CG2-CG2 3.77Å; I107-T111 WeakPolarHBondContact O-CB 3.46Å; I107-T111 PolarHBondContact O-N 3.38Å; I107-T111 PolarHBondContact O-OG1 2.93Å; Y108-T111 WeakPolarHBondContact O-CB 3.21Å; Y108-T111 PolarHBondContact O-N 2.86Å; Y108-T111 VanDerWaalsContact O-N 3.15Å; E109-T111 VanDerWaalsContact C-N 3.32Å; E109-T111 PolarHBondContact O-N 3.36Å; T111-L115 HydrophobicContact CG2-CD1 3.72Å; T111-L115 HydrophobicContact CG2-CG 4.35Å; T111-L115 VanDerWaalsContact O-CB 3.28Å; T111-L115 WeakPolarHBondContact O-CB 3.42Å; T111-L115 VanDerWaalsContact O-CG 3.26Å; T111-L115 WeakPolarHBondContact O-CG 3.5Å; T111-L115 PolarHBondContact O-N 2.77Å
112V93.5Very high93.8Very high95 Ų9584.5 Ų84.558%0.57644%0.435SS*.Hα-helixtrans-63.6-50176.6174.20000110.3Y108 E109 V114 L115 E116Y108-V112 WeakPolarHBondContact O-CG2 3.43Å; Y108-V112 PolarHBondContact O-N 3.13Å; E109-V112 PolarHBondContact O-N 2.93Å; V112-V114 VanDerWaalsContact C-N 3.28Å; V112-V114 PolarHBondContact O-N 3.2Å; V112-L115 PolarHBondContact O-N 3.02Å; V112-L115 VanDerWaalsContact O-N 3.15Å; V112-E116 WeakPolarHBondContact O-CB 3.27Å; V112-E116 PolarHBondContact O-N 3.32Å
113E93.5Very high94.1Very high109 Ų10981.6 Ų81.651%0.50941%0.411SS..Hα-helixtrans-55-41.5179.5-175.8-175.9149.600112.4E109 K110 P117E109-E113 PolarHBondContact O-N 3.37Å; K110-E113 WeakPolarHBondContact CD-OE2 3.49Å; K110-E113 WeakPolarHBondContact CE-OE2 3.35Å; K110-E113 IonicContact NZ-OE1 3.26Å; K110-E113 PolarHBondContact NZ-OE1 3.27Å; K110-E113 IonicContact NZ-OE2 2.65Å; K110-E113 PolarHBondContact NZ-OE2 3.12Å; E113-P117 VanDerWaalsContact O-CD 3.3Å; E113-P117 WeakPolarHBondContact O-CD 3.42Å
114V92.6Very high94.4Very high74 Ų7482.1 Ų82.145%0.44841%0.414SS..Hα-helixtrans-76.5-35.7179.7170.90000112.4K110 V112K110-V114 WeakPolarHBondContact O-CB 3.3Å; K110-V114 VanDerWaalsContact O-CG2 3.26Å; K110-V114 WeakPolarHBondContact O-CG2 3.38Å; K110-V114 PolarHBondContact O-N 2.78Å; V112-V114 VanDerWaalsContact C-N 3.28Å; V112-V114 PolarHBondContact O-N 3.2Å
115L93.6Very high94.6Very high60 Ų6080.1 Ų80.131%0.31441%0.408SS..Hα-helixtrans-81.1-30.1-177-75179.7000113.4C89 I93 T111 V112 E118 V119C89-L115 VanDerWaalsContact SG-CD2 3.6Å; I93-L115 HydrophobicContact CD1-CD1 4.04Å; I93-L115 HydrophobicContact CD1-CD2 3.58Å; I93-L115 HydrophobicContact CD1-CG 3.85Å; T111-L115 HydrophobicContact CG2-CD1 3.72Å; T111-L115 HydrophobicContact CG2-CG 4.35Å; T111-L115 VanDerWaalsContact O-CB 3.28Å; T111-L115 WeakPolarHBondContact O-CB 3.42Å; T111-L115 VanDerWaalsContact O-CG 3.26Å; T111-L115 WeakPolarHBondContact O-CG 3.5Å; T111-L115 PolarHBondContact O-N 2.77Å; V112-L115 PolarHBondContact O-N 3.02Å; V112-L115 VanDerWaalsContact O-N 3.15Å; L115-E118 PolarHBondContact O-N 3.2Å; L115-E118 VanDerWaalsContact O-N 3.11Å; L115-V119 WeakPolarHBondContact O-CG2 3.42Å; L115-V119 PolarHBondContact O-N 3.34Å
116E94.8Very high94.8Very high127 Ų12780.3 Ų80.359%0.59341%0.405SS*.Hα-helixtrans-50-51.5-178.4-177.6171.8-172.900114.3V112 E118 V119 T120V112-E116 WeakPolarHBondContact O-CB 3.27Å; V112-E116 PolarHBondContact O-N 3.32Å; E116-E118 VanDerWaalsContact C-N 3.32Å; E116-E118 PolarHBondContact O-N 3.42Å; E116-V119 PolarHBondContact O-N 2.87Å; E116-T120 WeakPolarHBondContact O-CB 3.33Å; E116-T120 PolarHBondContact O-N 3.21Å; E116-T120 PolarHBondContact O-OG1 2.86Å
117P95Very high95Very high59 Ų5980 Ų8038%0.38340%0.399SS..Hα-helixtrans-65.5-34.3178.925.2-35000112.8E113 T120 K121E113-P117 VanDerWaalsContact O-CD 3.3Å; E113-P117 WeakPolarHBondContact O-CD 3.42Å; P117-T120 PolarHBondContact O-N 3.34Å; P117-K121 WeakPolarHBondContact O-CG 3.47Å; P117-K121 PolarHBondContact O-N 2.9Å
118E94Very high95.3Very high49 Ų4980.2 Ų80.223%0.22940%0.4CS..Hα-helixtrans-71.2-41.9178.6-58.9-50.913400111.3W86 L115 E116 T120 K121 L122W86-E118 HydrophobicContact CH2-CB 3.91Å; W86-E118 WeakPolarHBondContact CH2-O 3.31Å; W86-E118 WeakPolarHBondContact CH2-OE2 3.45Å; W86-E118 HydrophobicContact CZ2-CB 4.24Å; W86-E118 WeakPolarHBondContact CZ3-OE2 3.5Å; L115-E118 PolarHBondContact O-N 3.2Å; L115-E118 VanDerWaalsContact O-N 3.11Å; E116-E118 VanDerWaalsContact C-N 3.32Å; E116-E118 PolarHBondContact O-N 3.42Å; E118-T120 VanDerWaalsContact C-N 3.3Å; E118-T120 PolarHBondContact O-N 2.89Å; E118-K121 PolarHBondContact O-N 2.88Å; E118-K121 IonicContact OE1-NZ 2.76Å; E118-K121 PolarHBondContact OE1-NZ 3.33Å; E118-K121 IonicContact OE2-NZ 3.22Å; E118-K121 PolarHBondContact OE2-NZ 3.44Å; E118-L122 WeakPolarHBondContact O-CG 3.46Å; E118-L122 PolarHBondContact O-N 3.37Å
119V94.1Very high95.5Very high88 Ų8878.8 Ų78.853%0.53340%0.398SS..Hα-helixtrans-62.5-40.6173.2173.60000110.7L115 E116 K121 L122 M123L115-V119 WeakPolarHBondContact O-CG2 3.42Å; L115-V119 PolarHBondContact O-N 3.34Å; E116-V119 PolarHBondContact O-N 2.87Å; V119-K121 PolarHBondContact O-N 3.27Å; V119-L122 PolarHBondContact O-N 3.01Å; V119-M123 WeakPolarHBondContact O-CB 3.31Å; V119-M123 PolarHBondContact O-N 3.26Å
120T96.4Very high95.7Very high68 Ų6879.4 Ų79.442%0.41739%0.394SS..Hα-helixtrans-61.3-44.7178.3-60.10000111.6E116 P117 E118 L122 M123 N124E116-T120 WeakPolarHBondContact O-CB 3.33Å; E116-T120 PolarHBondContact O-N 3.21Å; E116-T120 PolarHBondContact O-OG1 2.86Å; P117-T120 PolarHBondContact O-N 3.34Å; E118-T120 VanDerWaalsContact C-N 3.3Å; E118-T120 PolarHBondContact O-N 2.89Å; T120-L122 PolarHBondContact O-N 2.99Å; T120-M123 WeakPolarHBondContact O-CB 3.07Å; T120-M123 PolarHBondContact O-N 2.96Å; T120-N124 VanDerWaalsContact O-CG 3.25Å; T120-N124 PolarHBondContact O-N 2.79Å
121K96Very high95.9Very high85 Ų8578.4 Ų78.437%0.3739%0.394SS..Hα-helixtrans-57.4-46.4174.5-73.9171.2-167.8164.60112.2M82 W86 P117 E118 V119 M123 N124 F125M82-K121 HydrophobicContact SD-CB 3.78Å; M82-K121 HydrophobicContact SD-CD 4.34Å; M82-K121 HydrophobicContact SD-CG 4.22Å; W86-K121 HydrophobicContact CH2-CB 4.35Å; W86-K121 HydrophobicContact CZ3-CB 4Å; W86-K121 HydrophobicContact CZ3-CD 3.95Å; P117-K121 WeakPolarHBondContact O-CG 3.47Å; P117-K121 PolarHBondContact O-N 2.9Å; E118-K121 PolarHBondContact O-N 2.88Å; E118-K121 IonicContact OE1-NZ 2.76Å; E118-K121 PolarHBondContact OE1-NZ 3.33Å; E118-K121 IonicContact OE2-NZ 3.22Å; E118-K121 PolarHBondContact OE2-NZ 3.44Å; V119-K121 PolarHBondContact O-N 3.27Å; K121-M123 VanDerWaalsContact C-N 3.33Å; K121-N124 PolarHBondContact O-N 3.49Å; K121-F125 PolarHBondContact O-N 2.84Å
122L95.7Very high96.1Very high76 Ų7678.1 Ų78.140%0.39839%0.394SS..Hα-helixtrans-66.3-36.7178.3-66.5177.2000112.2W86 E118 V119 T120 F125 M126W86-L122 HydrophobicContact CH2-CD1 4.09Å; W86-L122 HydrophobicContact CH2-CD2 3.84Å; W86-L122 HydrophobicContact CH2-CG 3.64Å; W86-L122 HydrophobicContact CZ2-CD1 3.85Å; W86-L122 HydrophobicContact CZ2-CD2 3.97Å; W86-L122 HydrophobicContact CZ2-CG 3.88Å; W86-L122 HydrophobicContact CZ3-CD2 4.15Å; W86-L122 HydrophobicContact CZ3-CG 4.33Å; E118-L122 WeakPolarHBondContact O-CG 3.46Å; E118-L122 PolarHBondContact O-N 3.37Å; V119-L122 PolarHBondContact O-N 3.01Å; T120-L122 PolarHBondContact O-N 2.99Å; L122-F125 PolarHBondContact O-N 3.3Å; L122-M126 WeakPolarHBondContact O-CB 3.47Å; L122-M126 PolarHBondContact O-N 2.95Å
123M97.8Very high96.3Very high75 Ų7577.9 Ų77.937%0.36939%0.389SS..Hα-helixtrans-64.4-44.9176.3-163.870.5179.500111.2V119 T120 K121 M126 Y127V119-M123 WeakPolarHBondContact O-CB 3.31Å; V119-M123 PolarHBondContact O-N 3.26Å; T120-M123 WeakPolarHBondContact O-CB 3.07Å; T120-M123 PolarHBondContact O-N 2.96Å; K121-M123 VanDerWaalsContact C-N 3.33Å; M123-M126 HydrophobicContact CE-CE 3.54Å; M123-M126 WeakPolarHBondContact O-CB 3.2Å; M123-M126 PolarHBondContact O-N 2.82Å; M123-M126 HydrophobicContact SD-CE 3.69Å; M123-Y127 HydrophobicContact CE-CE1 4.16Å; M123-Y127 HydrophobicContact CE-CE2 3.71Å; M123-Y127 WeakPolarHBondContact CE-OH 3.01Å; M123-Y127 HydrophobicContact CG-CD2 4.05Å; M123-Y127 HydrophobicContact CG-CE2 3.55Å; M123-Y127 WeakPolarHBondContact O-CD2 3.42Å; M123-Y127 PolarHBondContact O-N 3.37Å; M123-Y127 HydrophobicContact SD-CE2 4.37Å
124N98.1Very high96.4Very high75 Ų7578.3 Ų78.340%0.40139%0.391SS..Hα-helixtrans-61.7-44.3175.9-68.4-13.5000111.1Y79 T120 K121 M126 Y127 F128Y79-N124 HydrophobicContact CE1-CB 4.3Å; Y79-N124 PolarHBondContact OH-O 3.36Å; T120-N124 VanDerWaalsContact O-CG 3.25Å; T120-N124 PolarHBondContact O-N 2.79Å; K121-N124 PolarHBondContact O-N 3.49Å; N124-M126 VanDerWaalsContact C-N 3.34Å; N124-M126 PolarHBondContact O-N 2.83Å; N124-Y127 PolarHBondContact O-N 2.72Å; N124-F128 WeakPolarHBondContact O-CB 3.08Å; N124-F128 PolarHBondContact O-N 3.31Å
125F98.1Very high96.5Very high51 Ų5178.4 Ų78.422%0.22438%0.383CS..Hα-helixtrans-59.6-42.7174.5175.8-117.5000112.7Y79 M82 L83 K121 L122 Y127 F128 Q129Y79-F125 HydrophobicContact CD1-CB 3.77Å; Y79-F125 AromaticContact CD1-CD2 3.8Å; Y79-F125 HydrophobicContact CD1-CD2 3.8Å; Y79-F125 HydrophobicContact CD1-CG 4.23Å; Y79-F125 HydrophobicContact CD2-CD2 4.28Å; Y79-F125 HydrophobicContact CE1-CB 3.9Å; Y79-F125 HydrophobicContact CG-CB 4.48Å; Y79-F125 AromaticContact CG-CD2 3.66Å; Y79-F125 HydrophobicContact CG-CD2 3.66Å; Y79-F125 HydrophobicContact CG-CE2 4.45Å; M82-F125 HydrophobicContact CE-CB 4.11Å; M82-F125 HydrophobicContact CE-CG 4.44Å; L83-F125 HydrophobicContact CD1-CE1 3.99Å; L83-F125 HydrophobicContact CD1-CE2 3.98Å; L83-F125 HydrophobicContact CD1-CZ 3.66Å; K121-F125 PolarHBondContact O-N 2.84Å; L122-F125 PolarHBondContact O-N 3.3Å; F125-Y127 PolarHBondContact O-N 3.29Å; F125-F128 HydrophobicContact CD2-CD1 4.4Å; F125-F128 PolarHBondContact O-N 3.5Å; F125-Q129 WeakPolarHBondContact O-CB 3.2Å; F125-Q129 PolarHBondContact O-N 2.86Å
126M97.9Very high96.6Very high86 Ų8682 Ų8242%0.42440%0.397SS..Hα-helixtrans-61.1-43.6176-176.8-16269.800111.6L122 M123 N124 Q129 R130L122-M126 WeakPolarHBondContact O-CB 3.47Å; L122-M126 PolarHBondContact O-N 2.95Å; M123-M126 HydrophobicContact CE-CE 3.54Å; M123-M126 WeakPolarHBondContact O-CB 3.2Å; M123-M126 PolarHBondContact O-N 2.82Å; M123-M126 HydrophobicContact SD-CE 3.69Å; N124-M126 VanDerWaalsContact C-N 3.34Å; N124-M126 PolarHBondContact O-N 2.83Å; M126-Q129 PolarHBondContact O-N 3.42Å; M126-R130 PolarHBondContact O-N 2.85Å; M126-R130 VanDerWaalsContact O-N 3.09Å
127Y98.3Very high96.6Very high102 Ų10278.2 Ų78.240%0.438%0.384SS..Hα-helixtrans-65.3-43.8177.1-71.9-49.4000112.4M123 N124 F125 R130 N131M123-Y127 HydrophobicContact CE-CE1 4.16Å; M123-Y127 HydrophobicContact CE-CE2 3.71Å; M123-Y127 WeakPolarHBondContact CE-OH 3.01Å; M123-Y127 HydrophobicContact CG-CD2 4.05Å; M123-Y127 HydrophobicContact CG-CE2 3.55Å; M123-Y127 WeakPolarHBondContact O-CD2 3.42Å; M123-Y127 PolarHBondContact O-N 3.37Å; M123-Y127 HydrophobicContact SD-CE2 4.37Å; N124-Y127 PolarHBondContact O-N 2.72Å; F125-Y127 PolarHBondContact O-N 3.29Å; Y127-R130 PolarHBondContact O-N 3.23Å; Y127-N131 WeakPolarHBondContact O-CB 3.4Å; Y127-N131 PolarHBondContact O-N 3.24Å
128F98.2Very high96.5Very high23 Ų2376.8 Ų76.810%0.10138%0.38CS..Hα-helixtrans-57.2-50.9173.4168.8-99.9000111.2M72 E75 Y79 N124 F125 R130 N131 A132M72-F128 HydrophobicContact CG-CE2 3.89Å; M72-F128 HydrophobicContact CG-CZ 4.23Å; M72-F128 WeakPolarHBondContact O-CE2 3.41Å; M72-F128 WeakPolarHBondContact O-CZ 3.47Å; E75-F128 HydrophobicContact CB-CD2 4.35Å; E75-F128 HydrophobicContact CB-CE2 3.91Å; E75-F128 HydrophobicContact CG-CD2 3.89Å; E75-F128 HydrophobicContact CG-CE2 3.96Å; E75-F128 WeakPolarHBondContact OE1-CD2 2.99Å; E75-F128 WeakPolarHBondContact OE2-CD2 3.47Å; Y79-F128 HydrophobicContact CD2-CB 3.97Å; Y79-F128 AromaticContact CD2-CD1 3.45Å; Y79-F128 HydrophobicContact CD2-CD1 3.45Å; Y79-F128 VanDerWaalsContact CD2-CD1 3.45Å; Y79-F128 HydrophobicContact CD2-CD2 4.09Å; Y79-F128 AromaticContact CD2-CE1 3.95Å; Y79-F128 HydrophobicContact CD2-CE1 3.95Å; Y79-F128 AromaticContact CD2-CG 3.54Å; Y79-F128 HydrophobicContact CD2-CG 3.54Å; Y79-F128 HydrophobicContact CD2-CZ 4.45Å; Y79-F128 HydrophobicContact CE2-CB 3.32Å; Y79-F128 AromaticContact CE2-CD1 3.74Å; Y79-F128 HydrophobicContact CE2-CD1 3.74Å; Y79-F128 AromaticContact CE2-CD2 3.74Å; Y79-F128 HydrophobicContact CE2-CD2 3.74Å; Y79-F128 HydrophobicContact CE2-CE2 4.5Å; Y79-F128 AromaticContact CE2-CG 3.29Å; Y79-F128 HydrophobicContact CE2-CG 3.29Å; Y79-F128 HydrophobicContact CG-CD1 4.35Å; N124-F128 WeakPolarHBondContact O-CB 3.08Å; N124-F128 PolarHBondContact O-N 3.31Å; F125-F128 HydrophobicContact CD2-CD1 4.4Å; F125-F128 PolarHBondContact O-N 3.5Å; F128-R130 VanDerWaalsContact C-N 3.29Å; F128-R130 PolarHBondContact O-N 2.76Å; F128-N131 PolarHBondContact O-N 3.06Å; F128-N131 VanDerWaalsContact O-N 3.14Å; F128-A132 HydrophobicContact CE1-CB 4.38Å; F128-A132 HydrophobicContact CZ-CB 4.23Å; F128-A132 WeakPolarHBondContact O-CB 3.22Å; F128-A132 PolarHBondContact O-N 3.46Å
129Q97.8Very high96.3Very high96 Ų9675.3 Ų75.345%0.44937%0.373SS..Hα-helixtrans-55.3-45.7179.8-178.7-173.2-3.600111.5F125 M126 A132 I133F125-Q129 WeakPolarHBondContact O-CB 3.2Å; F125-Q129 PolarHBondContact O-N 2.86Å; M126-Q129 PolarHBondContact O-N 3.42Å; Q129-A132 PolarHBondContact O-N 3.38Å; Q129-I133 HydrophobicContact CG-CD1 3.94Å; Q129-I133 WeakPolarHBondContact O-CD1 3.4Å; Q129-I133 VanDerWaalsContact O-CG1 3.25Å; Q129-I133 WeakPolarHBondContact O-CG1 3.43Å; Q129-I133 PolarHBondContact O-N 3.32Å
130R98Very high96.2Very high137 Ų13774 Ų7452%0.51737%0.365SS..Hα-helixtrans-61.7-49.1177.8-177.4179.264.3-168.81.6111.5M126 Y127 F128 A132 I133 E134M126-R130 PolarHBondContact O-N 2.85Å; M126-R130 VanDerWaalsContact O-N 3.09Å; Y127-R130 PolarHBondContact O-N 3.23Å; F128-R130 VanDerWaalsContact C-N 3.29Å; F128-R130 PolarHBondContact O-N 2.76Å; R130-A132 VanDerWaalsContact C-N 3.32Å; R130-A132 PolarHBondContact O-N 3.41Å; R130-I133 PolarHBondContact O-N 3.44Å; R130-E134 WeakPolarHBondContact O-CG 3.21Å; R130-E134 PolarHBondContact O-N 2.96Å
131N97.4Very high95.9Very high83 Ų8379 Ų7944%0.44438%0.376SS..Hα-helixtrans-60-43.5178.7-175.320.7000111.5Y127 F128 I133 E134 R135Y127-N131 WeakPolarHBondContact O-CB 3.4Å; Y127-N131 PolarHBondContact O-N 3.24Å; F128-N131 PolarHBondContact O-N 3.06Å; F128-N131 VanDerWaalsContact O-N 3.14Å; N131-I133 PolarHBondContact O-N 2.81Å; N131-E134 PolarHBondContact O-N 3.3Å; N131-R135 WeakPolarHBondContact O-CB 3.48Å; N131-R135 PolarHBondContact O-N 3.43Å
132A97.2Very high95.5Very high22 Ų2277.7 Ų77.718%0.18237%0.369CS..Hα-helixtrans-62.6-43.7179.200000112.4M72 F128 Q129 R130 F136M72-A132 HydrophobicContact CG-CB 4.29Å; M72-A132 VanDerWaalsContact SD-CA 3.52Å; M72-A132 HydrophobicContact SD-CB 3.78Å; F128-A132 HydrophobicContact CE1-CB 4.38Å; F128-A132 HydrophobicContact CZ-CB 4.23Å; F128-A132 WeakPolarHBondContact O-CB 3.22Å; F128-A132 PolarHBondContact O-N 3.46Å; Q129-A132 PolarHBondContact O-N 3.38Å; R130-A132 VanDerWaalsContact C-N 3.32Å; R130-A132 PolarHBondContact O-N 3.41Å; A132-F136 WeakPolarHBondContact O-CB 3.28Å; A132-F136 PolarHBondContact O-N 3.43Å
133I97.3Very high95Very high91 Ų9178.5 Ų78.547%0.46737%0.373SS..Hα-helixtrans-62.5-48.1175.4-69.2166.3000110.8Q129 R130 N131 R135 F136 C137Q129-I133 HydrophobicContact CG-CD1 3.94Å; Q129-I133 WeakPolarHBondContact O-CD1 3.4Å; Q129-I133 VanDerWaalsContact O-CG1 3.25Å; Q129-I133 WeakPolarHBondContact O-CG1 3.43Å; Q129-I133 PolarHBondContact O-N 3.32Å; R130-I133 PolarHBondContact O-N 3.44Å; N131-I133 PolarHBondContact O-N 2.81Å; I133-R135 PolarHBondContact O-N 2.96Å; I133-F136 PolarHBondContact O-N 3.16Å; I133-C137 VanDerWaalsContact O-CB 3.27Å; I133-C137 WeakPolarHBondContact O-CB 3.09Å; I133-C137 PolarHBondContact O-N 2.97Å; I133-C137 PolarHBondContact O-SG 3.41Å
134E97Very high94.4Very high118 Ų11878 Ų7855%0.55138%0.376SS*.Hα-helixtrans-59.9-47.8-179.4-77.2176.5-17100111.2R130 N131 C137 G138R130-E134 WeakPolarHBondContact O-CG 3.21Å; R130-E134 PolarHBondContact O-N 2.96Å; N131-E134 PolarHBondContact O-N 3.3Å; E134-C137 PolarHBondContact O-N 3Å; E134-G138 PolarHBondContact O-N 3.18Å
135R94.8Very high93.7Very high75 Ų7580.3 Ų80.328%0.28339%0.385SS..Hα-helixtrans-64.9-49.3179.5-174.256.6176.8-83.3-2.8111.6S68 M72 N131 I133 C137 G138 E139S68-R135 PolarHBondContact OG-NH1 3.48Å; S68-R135 PolarHBondContact OG-NH2 3.35Å; M72-R135 HydrophobicContact CE-CB 3.68Å; M72-R135 HydrophobicContact CE-CG 3.95Å; M72-R135 HydrophobicContact SD-CB 4.21Å; M72-R135 HydrophobicContact SD-CG 4.44Å; N131-R135 WeakPolarHBondContact O-CB 3.48Å; N131-R135 PolarHBondContact O-N 3.43Å; I133-R135 PolarHBondContact O-N 2.96Å; R135-C137 VanDerWaalsContact C-N 3.34Å; R135-C137 PolarHBondContact O-N 3.19Å; R135-G138 PolarHBondContact O-N 3.36Å; R135-G138 VanDerWaalsContact O-N 3.15Å; R135-E139 HydrophobicContact CG-CG 4.43Å; R135-E139 IonicContact CZ-OE1 2.79Å; R135-E139 IonicContact NE-OE1 3.27Å; R135-E139 PolarHBondContact NE-OE1 3.34Å; R135-E139 IonicContact NH2-OE1 2.82Å; R135-E139 VanDerWaalsContact O-CG 3.27Å; R135-E139 WeakPolarHBondContact O-CG 3.4Å; R135-E139 PolarHBondContact O-N 3.08Å
136F94Very high92.2Very high136 Ų13681.2 Ų81.260%0.59640%0.401SS*.Hα-helixtrans-56.8-48.5178178.6-102.1000111.5A132 I133 G138 E139 V140A132-F136 WeakPolarHBondContact O-CB 3.28Å; A132-F136 PolarHBondContact O-N 3.43Å; I133-F136 PolarHBondContact O-N 3.16Å; F136-G138 VanDerWaalsContact C-N 3.31Å; F136-G138 PolarHBondContact O-N 2.92Å; F136-E139 PolarHBondContact O-N 2.84Å; F136-V140 HydrophobicContact CD1-CG2 4.19Å; F136-V140 HydrophobicContact CD2-CG2 4.46Å; F136-V140 HydrophobicContact CE1-CG2 3.77Å; F136-V140 HydrophobicContact CE2-CG2 4.07Å; F136-V140 HydrophobicContact CZ-CG2 3.71Å; F136-V140 WeakPolarHBondContact O-CG2 3.25Å; F136-V140 PolarHBondContact O-N 2.78Å
137C94.9Very high90.8Very high48 Ų4884.7 Ų84.732%0.32442%0.417SS..Hα-helixtrans-65.1-34.8178.9-68.20000112.6I133 E134 R135 R141I133-C137 VanDerWaalsContact O-CB 3.27Å; I133-C137 WeakPolarHBondContact O-CB 3.09Å; I133-C137 PolarHBondContact O-N 2.97Å; I133-C137 PolarHBondContact O-SG 3.41Å; E134-C137 PolarHBondContact O-N 3Å; R135-C137 VanDerWaalsContact C-N 3.34Å; R135-C137 PolarHBondContact O-N 3.19Å; C137-R141 WeakPolarHBondContact O-CB 3.31Å; C137-R141 WeakPolarHBondContact O-CG 3.33Å; C137-R141 PolarHBondContact O-N 3.11Å; C137-R141 VanDerWaalsContact O-N 3.1Å; C137-R141 PolarHBondContact O-NE 2.97Å; C137-R141 VanDerWaalsContact O-NE 3.14Å
138G93.3Very high89.1Confident29 Ų2982.4 Ų82.430%0.29941%0.407SS..Hα-helixtrans-62.7-44173.600000111.7E134 R135 F136 R141 R142E134-G138 PolarHBondContact O-N 3.18Å; R135-G138 PolarHBondContact O-N 3.36Å; R135-G138 VanDerWaalsContact O-N 3.15Å; F136-G138 VanDerWaalsContact C-N 3.31Å; F136-G138 PolarHBondContact O-N 2.92Å; G138-R141 PolarHBondContact O-N 2.97Å; G138-R142 WeakPolarHBondContact O-CB 3.29Å; G138-R142 PolarHBondContact O-N 3.12Å
139E91Very high87.3Confident18 Ų1890.2 Ų90.28%0.08444%0.436CS..Hα-helixtrans-71.9-40.5-178.7-65.4-68.1167.400112.3V65 M69 R135 F136 R141 R142 L143V65-E139 VanDerWaalsContact CG1-CD 3.41Å; V65-E139 HydrophobicContact CG1-CG 4.29Å; V65-E139 WeakPolarHBondContact CG1-OE1 3.2Å; V65-E139 WeakPolarHBondContact CG1-OE2 3.48Å; M69-E139 HydrophobicContact CE-CB 3.32Å; M69-E139 HydrophobicContact CE-CG 3.31Å; R135-E139 HydrophobicContact CG-CG 4.43Å; R135-E139 IonicContact CZ-OE1 2.79Å; R135-E139 IonicContact NE-OE1 3.27Å; R135-E139 PolarHBondContact NE-OE1 3.34Å; R135-E139 IonicContact NH2-OE1 2.82Å; R135-E139 VanDerWaalsContact O-CG 3.27Å; R135-E139 WeakPolarHBondContact O-CG 3.4Å; R135-E139 PolarHBondContact O-N 3.08Å; F136-E139 PolarHBondContact O-N 2.84Å; E139-R141 VanDerWaalsContact C-N 3.32Å; E139-R141 PolarHBondContact O-N 3.34Å; E139-R142 PolarHBondContact O-N 3.11Å; E139-R142 IonicContact OE2-CZ 3.18Å; E139-R142 IonicContact OE2-NE 2.77Å; E139-R142 PolarHBondContact OE2-NE 2.98Å; E139-R142 IonicContact OE2-NH2 2.78Å; E139-R142 PolarHBondContact OE2-NH2 2.89Å; E139-L143 WeakPolarHBondContact O-CB 3.44Å; E139-L143 VanDerWaalsContact O-CG 3.31Å; E139-L143 WeakPolarHBondContact O-CG 3.5Å; E139-L143 PolarHBondContact O-N 3.01Å
140V91.2Very high85.3Confident61 Ų6195 Ų9537%0.3746%0.455SS..Hα-helixtrans-58.5-45.5171.6171.70000110.6F136 R142 L143 C144F136-V140 HydrophobicContact CD1-CG2 4.19Å; F136-V140 HydrophobicContact CD2-CG2 4.46Å; F136-V140 HydrophobicContact CE1-CG2 3.77Å; F136-V140 HydrophobicContact CE2-CG2 4.07Å; F136-V140 HydrophobicContact CZ-CG2 3.71Å; F136-V140 WeakPolarHBondContact O-CG2 3.25Å; F136-V140 PolarHBondContact O-N 2.78Å; V140-R142 PolarHBondContact O-N 2.94Å; V140-L143 PolarHBondContact O-N 3.32Å; V140-C144 VanDerWaalsContact O-CB 3.3Å; V140-C144 WeakPolarHBondContact O-CB 3.35Å; V140-C144 PolarHBondContact O-N 3.32Å; V140-C144 PolarHBondContact O-SG 3.48Å
141R90.9Very high83.3Confident172 Ų17294.9 Ų94.965%0.64947%0.465SS*.Hα-helixtrans-60.6-45.2175.3-81.9-179.7-91.3160.8-11.8111.9C137 G138 E139 L143 C144 H145C137-R141 WeakPolarHBondContact O-CB 3.31Å; C137-R141 WeakPolarHBondContact O-CG 3.33Å; C137-R141 PolarHBondContact O-N 3.11Å; C137-R141 VanDerWaalsContact O-N 3.1Å; C137-R141 PolarHBondContact O-NE 2.97Å; C137-R141 VanDerWaalsContact O-NE 3.14Å; G138-R141 PolarHBondContact O-N 2.97Å; E139-R141 VanDerWaalsContact C-N 3.32Å; E139-R141 PolarHBondContact O-N 3.34Å; R141-L143 PolarHBondContact O-N 3.4Å; R141-C144 PolarHBondContact O-N 3.41Å; R141-H145 PolarHBondContact O-N 3.3Å
142R86.1Confident82.6Confident58 Ų5895.5 Ų95.522%0.21947%0.466CS..Hα-helixtrans-61.8-41.4178.4-167.4-169.756.1107.31.1111.7E61 G138 E139 V140 R148E61-R142 IonicContact OE1-CZ 3.7Å; E61-R142 IonicContact OE1-NH1 3.24Å; E61-R142 PolarHBondContact OE1-NH1 3.41Å; G138-R142 WeakPolarHBondContact O-CB 3.29Å; G138-R142 PolarHBondContact O-N 3.12Å; E139-R142 PolarHBondContact O-N 3.11Å; E139-R142 IonicContact OE2-CZ 3.18Å; E139-R142 IonicContact OE2-NE 2.77Å; E139-R142 PolarHBondContact OE2-NE 2.98Å; E139-R142 IonicContact OE2-NH2 2.78Å; E139-R142 PolarHBondContact OE2-NH2 2.89Å; V140-R142 PolarHBondContact O-N 2.94Å; R142-R148 VanDerWaalsContact NH1-NH2 3.19Å; R142-R148 WeakPolarHBondContact O-CD 3.31Å; R142-R148 PolarHBondContact O-NH1 2.67Å
143L85.3Confident81.8Confident93 Ų9399.4 Ų99.449%0.48748%0.481SS..Hα-helixtrans-74.8-31.3179.5-69.1170.8000112.8E139 V140 R141 H145E139-L143 WeakPolarHBondContact O-CB 3.44Å; E139-L143 VanDerWaalsContact O-CG 3.31Å; E139-L143 WeakPolarHBondContact O-CG 3.5Å; E139-L143 PolarHBondContact O-N 3.01Å; V140-L143 PolarHBondContact O-N 3.32Å; R141-L143 PolarHBondContact O-N 3.4Å; L143-H145 VanDerWaalsContact C-N 3.3Å; L143-H145 PolarHBondContact O-N 3.08Å
144C85.5Confident81Confident64 Ų6499.8 Ų99.843%0.43248%0.482SS..Hα-helixtrans-79.8-5.9-179.1-68.50000114.6V140 R141 A146 R149V140-C144 VanDerWaalsContact O-CB 3.3Å; V140-C144 WeakPolarHBondContact O-CB 3.35Å; V140-C144 PolarHBondContact O-N 3.32Å; V140-C144 PolarHBondContact O-SG 3.48Å; R141-C144 PolarHBondContact O-N 3.41Å; C144-A146 PolarHBondContact O-N 3.25Å; C144-R149 PolarHBondContact O-NE 3.08Å
145H82.8Confident80Confident124 Ų12498.8 Ų98.857%0.57448%0.478SS*.  trans-59.2133.9-177.4-130.2-77.9000111.4R141 L143 E147 R148 R149R141-H145 PolarHBondContact O-N 3.3Å; L143-H145 VanDerWaalsContact C-N 3.3Å; L143-H145 PolarHBondContact O-N 3.08Å; H145-E147 VanDerWaalsContact C-N 3.26Å; H145-E147 PolarHBondContact O-N 2.89Å; H145-R148 HydrophobicContact CB-CG 4.36Å; H145-R148 WeakPolarHBondContact O-CA 3.47Å; H145-R148 WeakPolarHBondContact O-CB 3.39Å; H145-R148 PolarHBondContact O-N 3.2Å; H145-R149 PolarHBondContact O-N 3.37Å
146A68.3Low79.1Confident70 Ų70100.3 Ų100.358%0.57949%0.49SS*.G310 helixtrans-60-33.4-171.900000113.9C144 R148 R149C144-A146 PolarHBondContact O-N 3.25Å; A146-R148 PolarHBondContact O-N 3.28Å; A146-R149 PolarHBondContact O-N 3.38Å
147E68.1Low78.1Confident159 Ų15997.9 Ų97.974%0.74348%0.483SS*.G310 helixtrans-60.2-30.6172.9-69.9-74.3129.900112.3H145H145-E147 VanDerWaalsContact C-N 3.26Å; H145-E147 PolarHBondContact O-N 2.89Å
148R63.3Low76.9Confident54 Ų54101.4 Ų101.420%0.20449%0.494CS..G310 helixtrans-91.1-7.1178.6-56.4-169.381.3176.811.8114.4R142 H145 A146R142-R148 VanDerWaalsContact NH1-NH2 3.19Å; R142-R148 WeakPolarHBondContact O-CD 3.31Å; R142-R148 PolarHBondContact O-NH1 2.67Å; H145-R148 HydrophobicContact CB-CG 4.36Å; H145-R148 WeakPolarHBondContact O-CA 3.47Å; H145-R148 WeakPolarHBondContact O-CB 3.39Å; H145-R148 PolarHBondContact O-N 3.2Å; A146-R148 PolarHBondContact O-N 3.28Å
149R58.3Low75.7Confident187 Ų187107 Ų10771%0.70651%0.509SS*.SBendtrans-82.7-16.3176.2-73.4-173.8176.8-170.7-3.8113.2C144 H145 A146C144-R149 PolarHBondContact O-NE 3.08Å; H145-R149 PolarHBondContact O-N 3.37Å; A146-R149 PolarHBondContact O-N 3.38Å
150K57.3Low74.4Confident195 Ų195114.4 Ų114.485%0.84855%0.545SS*.  trans-971177.9-66-176.9179.3177.10112.7
151D55.4Low72.8Confident136 Ų136119.3 Ų119.373%0.72756%0.561SS**  trans-84.20173.4-76.7-49.4000111.4R58R58-D151 VanDerWaalsContact CZ-CG 3.44Å; R58-D151 IonicContact CZ-OD1 2.83Å; R58-D151 VanDerWaalsContact CZ-OD1 3.24Å; R58-D151 IonicContact CZ-OD2 3.74Å; R58-D151 VanDerWaalsContact CZ-OD2 3.27Å; R58-D151 IonicContact NH1-OD1 2.72Å; R58-D151 PolarHBondContact NH1-OD1 3.24Å; R58-D151 IonicContact NH1-OD2 3.02Å; R58-D151 PolarHBondContact NH1-OD2 3.11Å; R58-D151 IonicContact NH2-OD1 3.37Å; R58-D151 PolarHBondContact NH2-OD1 3.39Å; R58-D151 IonicContact NH2-OD2 3.59Å; R58-D151 PolarHBondContact NH2-OD2 3.39Å

Retrieved 151 of 151 residues in 111.5 ms (Link to these results)