A0A087YDT0_POEFO Loading...

Rhomboid domain containing 1

AlphaFold DB , UniProt , Accession A0A087YDT0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 317 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
1M33.3Very low58.5Low238 Ų238140.5 Ų140.5100%1.17266%0.664SS**  0980-73.5159.277.200108.5R3M1-R3 PolarHBondContact O-N 3.03Å; M1-R3 VanDerWaalsContact O-N 3.07Å
2N38.6Very low61.3Low165 Ų165131.2 Ų131.288%0.88262%0.622SS**  trans-70.897.3176.7-95.2-10000109.4R4N2-R4 PolarHBondContact O-N 3.29Å
3R36.4Very low63.8Low248 Ų248130.8 Ų130.894%0.93663%0.625SS**  trans-69.183.3158.8-88.8-178.8169.7174.2-2.9107.4M1 S5M1-R3 PolarHBondContact O-N 3.03Å; M1-R3 VanDerWaalsContact O-N 3.07Å; R3-S5 PolarHBondContact O-N 2.89Å
4R44.6Very low66Low231 Ų231127 Ų12787%0.87261%0.607SS**  trans-61.695.2150.7-82.6-179.2172.2170.7-2.8104.9N2 R6N2-R4 PolarHBondContact O-N 3.29Å; R4-R6 PolarHBondContact O-N 2.92Å; R4-R6 VanDerWaalsContact O-N 3.16Å
5S47.6Very low68Low103 Ų103118.9 Ų118.972%0.7257%0.569SS**  trans-52.1125.7165.9600000105.8R3 S7R3-S5 PolarHBondContact O-N 2.89Å; S5-S7 VanDerWaalsContact C-N 3.32Å; S5-S7 PolarHBondContact O-N 3.45Å
6R47.7Very low69.7Low242 Ų242113.4 Ų113.491%0.91355%0.554SS**  trans-51.3107.1165.1-85.2173.2154.6172.5-7.6105.8R4 S8R4-R6 PolarHBondContact O-N 2.92Å; R4-R6 VanDerWaalsContact O-N 3.16Å; R6-S8 PolarHBondContact O-N 3.47Å
7S57.7Low71.1Confident60 Ų60110.2 Ų110.242%0.4255%0.55SS..  trans-59.694.3167.9158.60000105.2S5 H9S5-S7 VanDerWaalsContact C-N 3.32Å; S5-S7 PolarHBondContact O-N 3.45Å; S7-H9 PolarHBondContact O-N 3.42Å
8S68.4Low72.5Confident63 Ų63106.1 Ų106.144%0.44153%0.529SS..  trans-62.3110.1166.3510000104.8R6 L10R6-S8 PolarHBondContact O-N 3.47Å; S8-L10 PolarHBondContact O-N 3.28Å
9H84.6Confident73.7Confident113 Ų113101.4 Ų101.452%0.52351%0.506SS..THydrogen-bonded Turntrans-66.727172.9-63-77.8000112.2S7 L13 D78S7-H9 PolarHBondContact O-N 3.42Å; H9-L13 VanDerWaalsContact O-CG 3.26Å; H9-L13 WeakPolarHBondContact O-CG 3.25Å; H9-L13 PolarHBondContact O-N 3.12Å; H9-D78 WeakPolarHBondContact CA-OD2 3.3Å
10L92.3Very high74.8Confident82 Ų82103 Ų10343%0.42952%0.516SS..Hα-helixtrans-71.3-41.7-171.8178.961.5000110.6S8 L13 M14 D78 W79S8-L10 PolarHBondContact O-N 3.28Å; L10-L13 PolarHBondContact O-N 2.68Å; L10-M14 HydrophobicContact CD1-CG 4.23Å; L10-M14 HydrophobicContact CD1-SD 4.38Å; L10-M14 HydrophobicContact CG-CG 4.43Å; L10-M14 HydrophobicContact CG-SD 4.18Å; L10-M14 WeakPolarHBondContact O-CB 3.33Å; L10-M14 VanDerWaalsContact O-CG 3.24Å; L10-M14 WeakPolarHBondContact O-CG 3.34Å; L10-M14 PolarHBondContact O-N 3.07Å; L10-D78 PolarHBondContact N-OD2 3.12Å; L10-D78 VanDerWaalsContact N-OD2 3.1Å; L10-W79 HydrophobicContact CD2-CH2 4.15Å; L10-W79 HydrophobicContact CD2-CZ2 3.87Å; L10-W79 HydrophobicContact CG-CH2 4.31Å; L10-W79 HydrophobicContact CG-CZ2 4.29Å
11G91.8Very high75.8Confident0 Ų0106.1 Ų106.10%053%0.529CS..Hα-helixtrans-60.3-45.4173.600000111.7L13 M14 L15 D78 Y82G11-L13 PolarHBondContact O-N 2.85Å; G11-M14 PolarHBondContact O-N 3.3Å; G11-L15 WeakPolarHBondContact O-CB 3.43Å; G11-L15 PolarHBondContact O-N 2.87Å; G11-D78 WeakPolarHBondContact CA-OD2 3.46Å; G11-D78 PolarHBondContact N-OD2 3.06Å; G11-Y82 VanDerWaalsContact O-CD2 3.24Å; G11-Y82 WeakPolarHBondContact O-CD2 3.46Å
12L92.4Very high78.7Confident29 Ų2996.1 Ų96.115%0.15248%0.481CS..Hα-helixtrans-59.8-44.2172.3-85.9167000113L15 G16 V39 Y42 L43 D78 L81L12-L15 PolarHBondContact O-N 3.49Å; L12-G16 PolarHBondContact O-N 3.18Å; L12-V39 HydrophobicContact CD2-CG1 3.95Å; L12-Y42 HydrophobicContact CD1-CD1 3.97Å; L12-Y42 HydrophobicContact CD1-CE1 3.7Å; L12-Y42 HydrophobicContact CD2-CD1 4.37Å; L12-Y42 HydrophobicContact CG-CD1 4.37Å; L12-Y42 HydrophobicContact CG-CE1 4.2Å; L12-L43 HydrophobicContact CD1-CD2 3.8Å; L12-D78 WeakPolarHBondContact CG-OD1 3.43Å; L12-D78 PolarHBondContact N-OD1 2.92Å; L12-D78 PolarHBondContact N-OD2 3.17Å; L12-L81 HydrophobicContact CD2-CD2 3.73Å; L12-L81 HydrophobicContact CG-CD2 4.3Å
13L93.6Very high81.4Confident126 Ų12689.3 Ų89.366%0.6645%0.45SS*.Hα-helixtrans-64.7-42.6177.7-72.7171.3000111.9H9 L10 G11 G16 A17H9-L13 VanDerWaalsContact O-CG 3.26Å; H9-L13 WeakPolarHBondContact O-CG 3.25Å; H9-L13 PolarHBondContact O-N 3.12Å; L10-L13 PolarHBondContact O-N 2.68Å; G11-L13 PolarHBondContact O-N 2.85Å; L13-G16 PolarHBondContact O-N 2.88Å; L13-A17 PolarHBondContact O-N 3.41Å
14M95.1Very high84Confident78 Ų7882.3 Ų82.338%0.38443%0.431SS..Hα-helixtrans-65.2-39.3176.1-72-175.775.600111.5L10 G11 G16 A17 Q18 W79 Y82L10-M14 HydrophobicContact CD1-CG 4.23Å; L10-M14 HydrophobicContact CD1-SD 4.38Å; L10-M14 HydrophobicContact CG-CG 4.43Å; L10-M14 HydrophobicContact CG-SD 4.18Å; L10-M14 WeakPolarHBondContact O-CB 3.33Å; L10-M14 VanDerWaalsContact O-CG 3.24Å; L10-M14 WeakPolarHBondContact O-CG 3.34Å; L10-M14 PolarHBondContact O-N 3.07Å; G11-M14 PolarHBondContact O-N 3.3Å; M14-G16 VanDerWaalsContact C-N 3.33Å; M14-G16 PolarHBondContact O-N 3.08Å; M14-A17 PolarHBondContact O-N 3.36Å; M14-Q18 WeakPolarHBondContact O-CB 3.45Å; M14-Q18 PolarHBondContact O-N 2.98Å; M14-W79 HydrophobicContact SD-CH2 3.8Å; M14-W79 HydrophobicContact SD-CZ3 4.05Å; M14-Y82 HydrophobicContact CB-CD2 4.01Å; M14-Y82 HydrophobicContact CB-CE2 3.58Å
15L95.4Very high86.3Confident5 Ų575.4 Ų75.43%0.02643%0.431CS..Hα-helixtrans-60.3-45.9173.2-178.261.2000110.6G11 L12 Q18 V19 V39 Y82 M85 V86G11-L15 WeakPolarHBondContact O-CB 3.43Å; G11-L15 PolarHBondContact O-N 2.87Å; L12-L15 PolarHBondContact O-N 3.49Å; L15-Q18 PolarHBondContact O-N 3.31Å; L15-V19 HydrophobicContact CD1-CG2 4.39Å; L15-V19 WeakPolarHBondContact O-CG2 3.5Å; L15-V19 PolarHBondContact O-N 2.97Å; L15-V39 HydrophobicContact CD2-CG2 3.63Å; L15-Y82 HydrophobicContact CB-CD2 3.99Å; L15-M85 HydrophobicContact CD1-CB 3.63Å; L15-M85 HydrophobicContact CD2-CB 3.61Å; L15-M85 HydrophobicContact CD2-CG 3.96Å; L15-M85 HydrophobicContact CG-CB 4.29Å; L15-V86 HydrophobicContact CD1-CG2 4Å
16G94.9Very high88.6Confident32 Ų3273.2 Ų73.233%0.3342%0.416SS..Hα-helixtrans-57.9-48175.600000112.2L12 L13 M14 Q18 V19 L20L12-G16 PolarHBondContact O-N 3.18Å; L13-G16 PolarHBondContact O-N 2.88Å; M14-G16 VanDerWaalsContact C-N 3.33Å; M14-G16 PolarHBondContact O-N 3.08Å; G16-Q18 VanDerWaalsContact C-N 3.3Å; G16-Q18 PolarHBondContact O-N 3.49Å; G16-V19 PolarHBondContact O-N 2.91Å; G16-L20 WeakPolarHBondContact O-CB 3.16Å; G16-L20 VanDerWaalsContact O-CG 3.27Å; G16-L20 WeakPolarHBondContact O-CG 3.17Å; G16-L20 PolarHBondContact O-N 3.49Å
17A94.9Very high90.9Very high59 Ų5962.2 Ų62.249%0.48838%0.375SS..Hα-helixtrans-57.9-42.6176.400000112.1L13 M14 L20 E21L13-A17 PolarHBondContact O-N 3.41Å; M14-A17 PolarHBondContact O-N 3.36Å; A17-L20 PolarHBondContact O-N 3.24Å; A17-E21 WeakPolarHBondContact O-CB 3.34Å; A17-E21 PolarHBondContact O-N 3.13Å
18Q95.1Very high92.8Very high36 Ų3660 Ų6017%0.16836%0.36CS..Hα-helixtrans-71-36.9-178.6-155.8161.39.100112.6M14 L15 G16 E21 V22 Y82M14-Q18 WeakPolarHBondContact O-CB 3.45Å; M14-Q18 PolarHBondContact O-N 2.98Å; L15-Q18 PolarHBondContact O-N 3.31Å; G16-Q18 VanDerWaalsContact C-N 3.3Å; G16-Q18 PolarHBondContact O-N 3.49Å; Q18-E21 PolarHBondContact O-N 3.24Å; Q18-V22 WeakPolarHBondContact O-CG2 3.33Å; Q18-V22 PolarHBondContact O-N 3.27Å; Q18-Y82 PolarHBondContact OE1-OH 3.46Å
19V95.9Very high94.2Very high16 Ų1661.4 Ų61.410%0.09737%0.367CS..Hα-helixtrans-65.7-39.6172.5169.10000111.1L15 G16 G23 L24 I27 L35 L89L15-V19 HydrophobicContact CD1-CG2 4.39Å; L15-V19 WeakPolarHBondContact O-CG2 3.5Å; L15-V19 PolarHBondContact O-N 2.97Å; G16-V19 PolarHBondContact O-N 2.91Å; V19-G23 PolarHBondContact O-N 2.99Å; V19-L24 HydrophobicContact CG1-CD2 3.51Å; V19-L24 HydrophobicContact CG1-CG 4.42Å; V19-I27 HydrophobicContact CG1-CD1 3.91Å; V19-L35 HydrophobicContact CG2-CD1 4.16Å; V19-L35 HydrophobicContact CG2-CD2 4.4Å; V19-L89 HydrophobicContact CG2-CD2 4.42Å
20L95Very high94.9Very high134 Ų13456.9 Ų56.970%0.70235%0.347SS*.Hα-helixtrans-67.2-40.7175.6-70173000112.1G16 A17 G23G16-L20 WeakPolarHBondContact O-CB 3.16Å; G16-L20 VanDerWaalsContact O-CG 3.27Å; G16-L20 WeakPolarHBondContact O-CG 3.17Å; G16-L20 PolarHBondContact O-N 3.49Å; A17-L20 PolarHBondContact O-N 3.24Å; L20-G23 PolarHBondContact O-N 3.09Å
21E95.7Very high95.1Very high168 Ų16853 Ų5379%0.78533%0.327SS*.Hα-helixtrans-62.1-44.1176.4-174.7-175.9175.600111.9A17 Q18 G23A17-E21 WeakPolarHBondContact O-CB 3.34Å; A17-E21 PolarHBondContact O-N 3.13Å; Q18-E21 PolarHBondContact O-N 3.24Å; E21-G23 VanDerWaalsContact C-N 3.29Å
22V95Very high95.4Very high28 Ų2855.4 Ų55.417%0.1734%0.339CS..Hα-helixtrans-68.2-33174.5171.30000111.6Q18 S26 I27 L89 M93Q18-V22 WeakPolarHBondContact O-CG2 3.33Å; Q18-V22 PolarHBondContact O-N 3.27Å; V22-S26 VanDerWaalsContact O-CB 3.24Å; V22-S26 WeakPolarHBondContact O-CB 3.48Å; V22-S26 PolarHBondContact O-OG 2.92Å; V22-I27 HydrophobicContact CG1-CD1 4.31Å; V22-I27 HydrophobicContact CG1-CG1 3.79Å; V22-L89 HydrophobicContact CG2-CD2 4.1Å; V22-M93 HydrophobicContact CG1-CE 3.67Å; V22-M93 HydrophobicContact CG1-SD 3.8Å
23G94.2Very high95.7Very high23 Ų2356.2 Ų56.224%0.23735%0.351CS..  trans82.7129.7-176.800000112.5V19 L20 E21 G25 S26V19-G23 PolarHBondContact O-N 2.99Å; L20-G23 PolarHBondContact O-N 3.09Å; E21-G23 VanDerWaalsContact C-N 3.29Å; G23-G25 VanDerWaalsContact C-N 3.26Å; G23-G25 PolarHBondContact O-N 3.23Å; G23-S26 VanDerWaalsContact O-CB 3.31Å; G23-S26 WeakPolarHBondContact O-CB 3.26Å; G23-S26 PolarHBondContact O-N 3.34Å
24L92.6Very high95.9Very high101 Ų10151 Ų5153%0.52932%0.324SS..G310 helixtrans-57.7-36-176.8-69.2172.9000113.5V19 S26 I27 L32V19-L24 HydrophobicContact CG1-CD2 3.51Å; V19-L24 HydrophobicContact CG1-CG 4.42Å; L24-S26 PolarHBondContact O-N 2.71Å; L24-I27 PolarHBondContact O-N 3.18Å; L24-L32 HydrophobicContact CD2-CD1 3.87Å; L24-L32 HydrophobicContact CD2-CD2 4.42Å
25G92.5Very high96Very high86 Ų8647.8 Ų47.889%0.88731%0.308SS*.G310 helixtrans-69.4-18177.600000114.2G23G23-G25 VanDerWaalsContact C-N 3.26Å; G23-G25 PolarHBondContact O-N 3.23Å
26S94.8Very high96.1Very high57 Ų5749.9 Ų49.940%0.39933%0.327SS..G310 helixtrans-83.5-23.5177-550000112.1V22 G23 L24 P28 R97V22-S26 VanDerWaalsContact O-CB 3.24Å; V22-S26 WeakPolarHBondContact O-CB 3.48Å; V22-S26 PolarHBondContact O-OG 2.92Å; G23-S26 VanDerWaalsContact O-CB 3.31Å; G23-S26 WeakPolarHBondContact O-CB 3.26Å; G23-S26 PolarHBondContact O-N 3.34Å; L24-S26 PolarHBondContact O-N 2.71Å; S26-P28 WeakPolarHBondContact O-CD 3.45Å; S26-R97 PolarHBondContact O-NH2 3.06Å
27I97.4Very high96.2Very high10 Ų1052.3 Ų52.35%0.05133%0.331CS..SBendtrans-84.6122.9-173.5-53.7171.8000108.7V19 V22 L24 T31 L32 L89 M93V19-I27 HydrophobicContact CG1-CD1 3.91Å; V22-I27 HydrophobicContact CG1-CD1 4.31Å; V22-I27 HydrophobicContact CG1-CG1 3.79Å; L24-I27 PolarHBondContact O-N 3.18Å; I27-T31 HydrophobicContact CG2-CG2 4.08Å; I27-L32 HydrophobicContact CB-CB 4.36Å; I27-L32 HydrophobicContact CD1-CD1 4.29Å; I27-L32 HydrophobicContact CG2-CB 3.81Å; I27-L32 HydrophobicContact CG2-CD1 4.43Å; I27-L89 HydrophobicContact CD1-CD1 3.55Å; I27-L89 HydrophobicContact CG1-CD1 3.77Å; I27-L89 HydrophobicContact CG2-CD1 3.91Å; I27-M93 HydrophobicContact CG2-CG 4.44Å
28P97.8Very high96.3Very high15 Ų1549.5 Ų49.510%0.09731%0.308CS..  trans-57.2148.4175.5-28.839.4000112.8S26 V30 T31 L32 E96 R97S26-P28 WeakPolarHBondContact O-CD 3.45Å; P28-V30 PolarHBondContact O-N 3.3Å; P28-T31 PolarHBondContact O-N 3.05Å; P28-L32 WeakPolarHBondContact O-CB 3.44Å; P28-L32 PolarHBondContact O-N 3.29Å; P28-E96 HydrophobicContact CB-CB 3.91Å; P28-E96 HydrophobicContact CB-CG 3.73Å; P28-E96 WeakPolarHBondContact CB-OE1 3.35Å; P28-E96 VanDerWaalsContact CB-OE2 3.24Å; P28-E96 WeakPolarHBondContact CB-OE2 3.49Å; P28-E96 HydrophobicContact CG-CB 4.29Å; P28-R97 HydrophobicContact CG-CG 3.82Å
29P97.5Very high96.3Very high91 Ų9149.2 Ų49.259%0.59131%0.308SS*.Hα-helixtrans-63.7-38.9-166.324.1-34.8000114A33 E96P29-A33 VanDerWaalsContact O-CB 3.26Å; P29-A33 WeakPolarHBondContact O-CB 3.3Å; P29-A33 PolarHBondContact O-N 2.92Å; P29-E96 VanDerWaalsContact CD-OE1 3.26Å; P29-E96 WeakPolarHBondContact CD-OE1 3.37Å
30V98.3Very high96.3Very high19 Ų1954.9 Ų54.912%0.11533%0.329CS..Hα-helixtrans-70.9-43-179.4176.40000110.3P28 L32 A33 V34 E96 A101 F104 L105 L108P28-V30 PolarHBondContact O-N 3.3Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.08Å; V30-A33 PolarHBondContact O-N 2.89Å; V30-V34 HydrophobicContact CG1-CG2 4.28Å; V30-V34 WeakPolarHBondContact O-CB 3.28Å; V30-V34 VanDerWaalsContact O-CG2 3.3Å; V30-V34 WeakPolarHBondContact O-CG2 3.18Å; V30-V34 PolarHBondContact O-N 3.37Å; V30-E96 WeakPolarHBondContact CB-OE1 3.28Å; V30-E96 WeakPolarHBondContact CB-OE2 3.28Å; V30-E96 PolarHBondContact N-OE1 2.86Å; V30-E96 PolarHBondContact N-OE2 2.92Å; V30-A101 HydrophobicContact CG2-CB 3.83Å; V30-F104 HydrophobicContact CB-CD1 4.22Å; V30-F104 HydrophobicContact CG1-CD1 3.98Å; V30-F104 HydrophobicContact CG1-CE1 4.41Å; V30-L105 HydrophobicContact CG1-CB 3.95Å; V30-L105 HydrophobicContact CG1-CD1 3.94Å; V30-L105 HydrophobicContact CG2-CB 4.29Å; V30-L108 HydrophobicContact CG1-CD1 4Å
31T98Very high96.2Very high0 Ų050.1 Ų50.10%030%0.304CS..Hα-helixtrans-58.9-47175.7-59.60000110.4I27 P28 V34 L35 L88 G92 E96 F104I27-T31 HydrophobicContact CG2-CG2 4.08Å; P28-T31 PolarHBondContact O-N 3.05Å; T31-V34 PolarHBondContact O-N 2.98Å; T31-L35 VanDerWaalsContact O-CB 3.28Å; T31-L35 WeakPolarHBondContact O-CB 3.41Å; T31-L35 PolarHBondContact O-N 3.36Å; T31-L88 HydrophobicContact CG2-CG 4.49Å; T31-G92 WeakPolarHBondContact OG1-CA 3.22Å; T31-G92 PolarHBondContact OG1-O 2.95Å; T31-E96 WeakPolarHBondContact CB-OE2 3.12Å; T31-E96 PolarHBondContact N-OE2 2.92Å; T31-E96 PolarHBondContact OG1-OE2 3.47Å; T31-F104 WeakPolarHBondContact OG1-CE1 3.42Å
32L97.9Very high96.1Very high50 Ų5044.3 Ų44.326%0.26228%0.275SS..Hα-helixtrans-62.9-44.8177.5-177.260.3000111.6L24 I27 P28 V30 L35 A36L24-L32 HydrophobicContact CD2-CD1 3.87Å; L24-L32 HydrophobicContact CD2-CD2 4.42Å; I27-L32 HydrophobicContact CB-CB 4.36Å; I27-L32 HydrophobicContact CD1-CD1 4.29Å; I27-L32 HydrophobicContact CG2-CB 3.81Å; I27-L32 HydrophobicContact CG2-CD1 4.43Å; P28-L32 WeakPolarHBondContact O-CB 3.44Å; P28-L32 PolarHBondContact O-N 3.29Å; V30-L32 VanDerWaalsContact C-N 3.33Å; V30-L32 PolarHBondContact O-N 3.08Å; L32-L35 PolarHBondContact O-N 3.35Å; L32-A36 VanDerWaalsContact O-CB 3.31Å; L32-A36 WeakPolarHBondContact O-CB 3.32Å; L32-A36 PolarHBondContact O-N 3.34Å
33A97.8Very high96Very high47 Ų4747.2 Ų47.239%0.38829%0.29SS..Hα-helixtrans-62.5-45.917900000111.9P29 V30 A36 I37P29-A33 VanDerWaalsContact O-CB 3.26Å; P29-A33 WeakPolarHBondContact O-CB 3.3Å; P29-A33 PolarHBondContact O-N 2.92Å; V30-A33 PolarHBondContact O-N 2.89Å; A33-A36 PolarHBondContact O-N 3.06Å; A33-I37 WeakPolarHBondContact O-CB 3.48Å; A33-I37 VanDerWaalsContact O-CG1 3.23Å; A33-I37 WeakPolarHBondContact O-CG1 3.23Å; A33-I37 PolarHBondContact O-N 3.42Å
34V97.9Very high95.9Very high15 Ų1552.2 Ų52.29%0.09131%0.305CS..Hα-helixtrans-66.9-39.8178.8175.90000111V30 T31 I37 N38 L88 L108 F143V30-V34 HydrophobicContact CG1-CG2 4.28Å; V30-V34 WeakPolarHBondContact O-CB 3.28Å; V30-V34 VanDerWaalsContact O-CG2 3.3Å; V30-V34 WeakPolarHBondContact O-CG2 3.18Å; V30-V34 PolarHBondContact O-N 3.37Å; T31-V34 PolarHBondContact O-N 2.98Å; V34-I37 PolarHBondContact O-N 3.48Å; V34-N38 PolarHBondContact O-N 3.43Å; V34-N38 PolarHBondContact O-ND2 3.42Å; V34-L88 HydrophobicContact CB-CD2 4.24Å; V34-L88 HydrophobicContact CG1-CD2 3.73Å; V34-L108 HydrophobicContact CG2-CD1 3.97Å; V34-F143 HydrophobicContact CG1-CE2 4.36Å; V34-F143 HydrophobicContact CG1-CZ 4.01Å
35L97.6Very high95.7Very high11 Ų1151.2 Ų51.26%0.05830%0.304CS..Hα-helixtrans-59-49.3172.5-175.4156.4000110.7V19 T31 L32 I37 N38 V39 M85 L88 L89V19-L35 HydrophobicContact CG2-CD1 4.16Å; V19-L35 HydrophobicContact CG2-CD2 4.4Å; T31-L35 VanDerWaalsContact O-CB 3.28Å; T31-L35 WeakPolarHBondContact O-CB 3.41Å; T31-L35 PolarHBondContact O-N 3.36Å; L32-L35 PolarHBondContact O-N 3.35Å; L35-I37 PolarHBondContact O-N 3.39Å; L35-N38 PolarHBondContact O-N 3.37Å; L35-V39 HydrophobicContact CD2-CG2 4.12Å; L35-V39 WeakPolarHBondContact O-CG2 3.49Å; L35-V39 PolarHBondContact O-N 3.36Å; L35-M85 HydrophobicContact CB-SD 4.47Å; L35-M85 HydrophobicContact CG-CB 4.37Å; L35-M85 HydrophobicContact CG-SD 4.23Å; L35-L88 HydrophobicContact CB-CD2 4.35Å; L35-L89 HydrophobicContact CD1-CB 4.32Å; L35-L89 HydrophobicContact CD1-CD1 4.34Å
36A97Very high95.4Very high50 Ų5050.6 Ų50.641%0.41329%0.291SS..Hα-helixtrans-61.9-41.5179.500000112.3L32 A33 V39 Y40L32-A36 VanDerWaalsContact O-CB 3.31Å; L32-A36 WeakPolarHBondContact O-CB 3.32Å; L32-A36 PolarHBondContact O-N 3.34Å; A33-A36 PolarHBondContact O-N 3.06Å; A36-V39 PolarHBondContact O-N 3.23Å; A36-Y40 VanDerWaalsContact O-CB 3.25Å; A36-Y40 WeakPolarHBondContact O-CB 3.49Å; A36-Y40 PolarHBondContact O-N 2.92Å
37I96.5Very high95Very high82 Ų8248.8 Ų48.842%0.42128%0.279SS..Hα-helixtrans-62.1-43.8176.6-72.7164.1000111A33 V34 L35 Y40 L41 F73A33-I37 WeakPolarHBondContact O-CB 3.48Å; A33-I37 VanDerWaalsContact O-CG1 3.23Å; A33-I37 WeakPolarHBondContact O-CG1 3.23Å; A33-I37 PolarHBondContact O-N 3.42Å; V34-I37 PolarHBondContact O-N 3.48Å; L35-I37 PolarHBondContact O-N 3.39Å; I37-Y40 PolarHBondContact O-N 2.83Å; I37-L41 HydrophobicContact CG2-CD1 3.75Å; I37-L41 HydrophobicContact CG2-CG 4.37Å; I37-L41 WeakPolarHBondContact O-CB 3.46Å; I37-L41 WeakPolarHBondContact O-CG 3.36Å; I37-L41 PolarHBondContact O-N 3.15Å; I37-F73 HydrophobicContact CG2-CD1 4.05Å; I37-F73 HydrophobicContact CG2-CE1 4.27Å
38N96.9Very high94.6Very high0 Ų052.1 Ų52.10%030%0.302CS..Hα-helixtrans-65.5-42.1178-82.2-80.8000112.1V34 L35 Y42 F73 H75 L81 M85V34-N38 PolarHBondContact O-N 3.43Å; V34-N38 PolarHBondContact O-ND2 3.42Å; L35-N38 PolarHBondContact O-N 3.37Å; N38-Y42 WeakPolarHBondContact O-CB 3.45Å; N38-Y42 PolarHBondContact O-N 3.47Å; N38-F73 WeakPolarHBondContact OD1-CA 3.1Å; N38-H75 PolarHBondContact OD1-CE1 3.46Å; N38-H75 VanDerWaalsContact OD1-CE1 3.28Å; N38-L81 HydrophobicContact CB-CD1 4.37Å; N38-M85 HydrophobicContact CB-CE 3.71Å; N38-M85 HydrophobicContact CB-SD 3.4Å; N38-M85 WeakPolarHBondContact CB-SD 3.48Å
39V95.8Very high93.9Very high30 Ų3054.9 Ų54.918%0.18232%0.315CS..Hα-helixtrans-64.2-44.2175172.60000110.9L12 L15 L35 A36 Y42 L43 L81L12-V39 HydrophobicContact CD2-CG1 3.95Å; L15-V39 HydrophobicContact CD2-CG2 3.63Å; L35-V39 HydrophobicContact CD2-CG2 4.12Å; L35-V39 WeakPolarHBondContact O-CG2 3.49Å; L35-V39 PolarHBondContact O-N 3.36Å; A36-V39 PolarHBondContact O-N 3.23Å; V39-Y42 PolarHBondContact O-N 3.06Å; V39-L43 HydrophobicContact CG1-CD1 4.3Å; V39-L43 WeakPolarHBondContact O-CG 3.29Å; V39-L43 PolarHBondContact O-N 3.18Å; V39-L43 VanDerWaalsContact O-N 3.1Å; V39-L81 HydrophobicContact CG2-CD2 4.44Å
40Y95.6Very high93.4Very high135 Ų13557.4 Ų57.453%0.52932%0.323SS..Hα-helixtrans-60.9-49.2177.5175.5-97.2000111.6A36 I37 Y42 L43 F44A36-Y40 VanDerWaalsContact O-CB 3.25Å; A36-Y40 WeakPolarHBondContact O-CB 3.49Å; A36-Y40 PolarHBondContact O-N 2.92Å; I37-Y40 PolarHBondContact O-N 2.83Å; Y40-Y42 PolarHBondContact O-N 3.31Å; Y40-L43 PolarHBondContact O-N 3.42Å; Y40-L43 VanDerWaalsContact O-N 3.15Å; Y40-F44 AromaticContact CD2-CD2 3.71Å; Y40-F44 HydrophobicContact CD2-CD2 3.71Å; Y40-F44 HydrophobicContact CD2-CE2 4.29Å; Y40-F44 HydrophobicContact CE1-CB 4.41Å; Y40-F44 HydrophobicContact CE2-CB 4.38Å; Y40-F44 AromaticContact CE2-CD2 3.5Å; Y40-F44 HydrophobicContact CE2-CD2 3.5Å; Y40-F44 HydrophobicContact CE2-CE2 4.11Å; Y40-F44 HydrophobicContact CE2-CG 4.18Å; Y40-F44 HydrophobicContact CG-CD2 4.48Å; Y40-F44 PolarHBondContact O-N 3.34Å
41L94Very high92.8Very high35 Ų3564.9 Ų64.918%0.18335%0.349CS..Hα-helixtrans-68.9-22.3179.4-71.3173.7000112.9I37 F44 P45 A46 F73I37-L41 HydrophobicContact CG2-CD1 3.75Å; I37-L41 HydrophobicContact CG2-CG 4.37Å; I37-L41 WeakPolarHBondContact O-CB 3.46Å; I37-L41 WeakPolarHBondContact O-CG 3.36Å; I37-L41 PolarHBondContact O-N 3.15Å; L41-F44 CarbonylContact O-C 3.05Å; L41-P45 WeakPolarHBondContact O-CA 3.37Å; L41-A46 HydrophobicContact CD2-CB 4.22Å; L41-F73 HydrophobicContact CD1-CB 3.6Å; L41-F73 HydrophobicContact CD1-CD1 4.48Å; L41-F73 HydrophobicContact CD1-CG 4.16Å
42Y93.1Very high92.3Very high45 Ų4564.9 Ų64.918%0.17635%0.349CS..Hα-helixtrans-71.7-41.8169.5179.3-105.8000112.3L12 N38 V39 Y40 H75 D78 L81L12-Y42 HydrophobicContact CD1-CD1 3.97Å; L12-Y42 HydrophobicContact CD1-CE1 3.7Å; L12-Y42 HydrophobicContact CD2-CD1 4.37Å; L12-Y42 HydrophobicContact CG-CD1 4.37Å; L12-Y42 HydrophobicContact CG-CE1 4.2Å; N38-Y42 WeakPolarHBondContact O-CB 3.45Å; N38-Y42 PolarHBondContact O-N 3.47Å; V39-Y42 PolarHBondContact O-N 3.06Å; Y40-Y42 PolarHBondContact O-N 3.31Å; Y42-H75 HydrophobicContact CD2-CB 3.93Å; Y42-H75 HydrophobicContact CE2-CB 4.38Å; Y42-D78 WeakPolarHBondContact OH-CA 3.09Å; Y42-D78 WeakPolarHBondContact OH-CB 3.42Å; Y42-D78 PolarHBondContact OH-N 3.35Å; Y42-L81 HydrophobicContact CD1-CD2 3.52Å; Y42-L81 HydrophobicContact CD2-CB 4.47Å; Y42-L81 HydrophobicContact CD2-CD2 4.31Å; Y42-L81 HydrophobicContact CE1-CD2 4.13Å; Y42-L81 HydrophobicContact CG-CD2 3.61Å; Y42-L81 HydrophobicContact CG-CG 4.46Å
43L92.4Very high92Very high90 Ų9062.9 Ų62.947%0.47134%0.34SS..Hα-helixtrans-73.9-35.7177.4-65.9174.3000112.6L12 V39 Y40L12-L43 HydrophobicContact CD1-CD2 3.8Å; V39-L43 HydrophobicContact CG1-CD1 4.3Å; V39-L43 WeakPolarHBondContact O-CG 3.29Å; V39-L43 PolarHBondContact O-N 3.18Å; V39-L43 VanDerWaalsContact O-N 3.1Å; Y40-L43 PolarHBondContact O-N 3.42Å; Y40-L43 VanDerWaalsContact O-N 3.15Å
44F92.9Very high91.8Very high128 Ų12861 Ų6156%0.56132%0.323SS*.SBendtrans-127.175.2-177.8-56.8-77.5000109.8Y40 L41 A46Y40-F44 AromaticContact CD2-CD2 3.71Å; Y40-F44 HydrophobicContact CD2-CD2 3.71Å; Y40-F44 HydrophobicContact CD2-CE2 4.29Å; Y40-F44 HydrophobicContact CE1-CB 4.41Å; Y40-F44 HydrophobicContact CE2-CB 4.38Å; Y40-F44 AromaticContact CE2-CD2 3.5Å; Y40-F44 HydrophobicContact CE2-CD2 3.5Å; Y40-F44 HydrophobicContact CE2-CE2 4.11Å; Y40-F44 HydrophobicContact CE2-CG 4.18Å; Y40-F44 HydrophobicContact CG-CD2 4.48Å; Y40-F44 PolarHBondContact O-N 3.34Å; L41-F44 CarbonylContact O-C 3.05Å; F44-A46 PolarHBondContact O-N 2.92Å
45P88.1Confident91.6Very high79 Ų7960.4 Ų60.451%0.51332%0.32SS..  trans-64.9127.3-175.324.8-33.3000111.7L41 A47L41-P45 WeakPolarHBondContact O-CA 3.37Å; P45-A47 PolarHBondContact O-N 3.48Å
46A85.3Confident91.3Very high73 Ų7360.1 Ų60.160%0.60332%0.318SS*.SBendtrans-66.8-27.7177.900000112.3L41 F44L41-A46 HydrophobicContact CD2-CB 4.22Å; F44-A46 PolarHBondContact O-N 2.92Å
47A87.3Confident90.9Very high19 Ų1961 Ų6116%0.15731%0.314CS..SBendtrans-146.5155.8173.500000111P45 R51 A52 H74P45-A47 PolarHBondContact O-N 3.48Å; A47-R51 HydrophobicContact CB-CB 4.27Å; A47-A52 HydrophobicContact CB-CB 4.44Å; A47-H74 PolarHBondContact N-NE2 3.14Å; A47-H74 PolarHBondContact O-NE2 3.21Å
48P88Confident90.5Very high80 Ų8059.3 Ų59.352%0.51930%0.304SS..  trans-56.3145167.6-21.732.2000110.9L50 R51 A52P48-L50 PolarHBondContact O-N 2.81Å; P48-L50 VanDerWaalsContact O-N 3.09Å; P48-R51 WeakPolarHBondContact O-CA 3.45Å; P48-R51 PolarHBondContact O-N 3.35Å; P48-A52 PolarHBondContact O-N 3.45Å; P48-A52 VanDerWaalsContact O-N 3.11Å
49L85Confident90Very high74 Ų7459.3 Ų59.339%0.38730%0.304SS..Hα-helixtrans-49.3-41.9-176.8-77.7165.2000113.7R51 A52 C53 H74 V141L49-R51 PolarHBondContact O-N 2.95Å; L49-A52 PolarHBondContact O-N 3.47Å; L49-A52 VanDerWaalsContact O-N 3.13Å; L49-C53 WeakPolarHBondContact O-CB 3.4Å; L49-C53 PolarHBondContact O-N 3.22Å; L49-H74 HydrophobicContact CD2-CB 4.11Å; L49-V141 HydrophobicContact CD2-CG1 4.45Å; L49-V141 HydrophobicContact CD2-CG2 4.39Å
50L85.7Confident89.5Confident144 Ų14465 Ų6575%0.75432%0.324SS*.Hα-helixtrans-63.8-24.2178.8-63.8173.7000113.9P48 R67P48-L50 PolarHBondContact O-N 2.81Å; P48-L50 VanDerWaalsContact O-N 3.09Å; L50-R67 PolarHBondContact O-NH1 3.35Å
51R85.9Confident89Confident175 Ų17564.6 Ų64.666%0.6632%0.321SS*.Hα-helixtrans-93.6-19.8175.7-66.6-171.3-177.9175.4-0113A47 P48 L49 R67A47-R51 HydrophobicContact CB-CB 4.27Å; P48-R51 WeakPolarHBondContact O-CA 3.45Å; P48-R51 PolarHBondContact O-N 3.35Å; L49-R51 PolarHBondContact O-N 2.95Å; R51-R67 PolarHBondContact O-NH1 3.01Å
52A88.1Confident88.7Confident0 Ų068.7 Ų68.70%034%0.339CS..Hα-helixtrans-91.1-28.1178.400000113A47 P48 L49 L70 A71 H74A47-A52 HydrophobicContact CB-CB 4.44Å; P48-A52 PolarHBondContact O-N 3.45Å; P48-A52 VanDerWaalsContact O-N 3.11Å; L49-A52 PolarHBondContact O-N 3.47Å; L49-A52 VanDerWaalsContact O-N 3.13Å; A52-L70 HydrophobicContact CB-CB 4.37Å; A52-A71 WeakPolarHBondContact O-CA 3.36Å; A52-A71 WeakPolarHBondContact O-CB 3.45Å; A52-A71 PolarHBondContact O-N 2.99Å; A52-H74 HydrophobicContact CB-CB 4.01Å; A52-H74 VanDerWaalsContact CB-CG 3.44Å
53C91.7Very high88.5Confident9 Ų968.4 Ų68.46%0.06135%0.35CS..SBendtrans-66.3146.1-177.271.70000112.4L49 R67 C139 A140 V141L49-C53 WeakPolarHBondContact O-CB 3.4Å; L49-C53 PolarHBondContact O-N 3.22Å; C53-R67 WeakPolarHBondContact O-CD 3.49Å; C53-R67 PolarHBondContact O-NH1 2.92Å; C53-C139 HydrophobicContact CB-CB 3.76Å; C53-C139 WeakPolarHBondContact CB-SG 3.27Å; C53-C139 WeakPolarHBondContact SG-CB 3.34Å; C53-C139 CovalentContact SG-SG 2.01Å; C53-C139 PolarHBondContact SG-SG 3.31Å; C53-A140 WeakPolarHBondContact CA-O 3.5Å; C53-V141 VanDerWaalsContact CA-CG1 3.41Å; C53-V141 HydrophobicContact CB-CG1 3.31Å
54V92.9Very high88.4Confident7 Ų766.4 Ų66.44%0.04234%0.34CS..BIsolated β-bridgetrans-97.4130.2179.868.80000109.8A59 R67 L68 A71 Y119 L120 C139 A140V54-A59 HydrophobicContact CG2-CB 4.12Å; V54-R67 HydrophobicContact CB-CB 4.41Å; V54-L68 HydrophobicContact CG2-CD2 3.99Å; V54-A71 HydrophobicContact CB-CB 3.98Å; V54-A71 HydrophobicContact CG1-CB 3.99Å; V54-Y119 HydrophobicContact CG1-CD1 3.77Å; V54-Y119 HydrophobicContact CG1-CE1 3.81Å; V54-Y119 WeakPolarHBondContact O-CE1 3.41Å; V54-L120 HydrophobicContact CG2-CD1 4.19Å; V54-L120 HydrophobicContact CG2-CD2 3.77Å; V54-L120 HydrophobicContact CG2-CG 4.01Å; V54-C139 WeakPolarHBondContact O-CA 3.34Å; V54-A140 HydrophobicContact CG1-CB 4.2Å; V54-A140 PolarHBondContact N-O 3.14Å; V54-A140 PolarHBondContact O-N 3.07Å
55S93.8Very high88.3Confident3 Ų367.1 Ų67.12%0.02134%0.339CS..  trans-146.4158.1172.969.90000109.4Q57 Q58 A59 L120 S138S55-Q57 VanDerWaalsContact C-N 3.31Å; S55-Q57 PolarHBondContact O-N 3.47Å; S55-Q58 PolarHBondContact O-N 3.32Å; S55-Q58 WeakPolarHBondContact OG-CB 3.44Å; S55-Q58 WeakPolarHBondContact OG-CG 3.35Å; S55-Q58 PolarHBondContact OG-N 3.26Å; S55-A59 VanDerWaalsContact O-CB 3.29Å; S55-A59 WeakPolarHBondContact O-CB 3.46Å; S55-A59 PolarHBondContact O-N 3.48Å; S55-L120 VanDerWaalsContact C-CD2 3.43Å; S55-L120 WeakPolarHBondContact O-CD2 2.93Å; S55-S138 WeakPolarHBondContact CB-O 3.43Å
56V90.4Very high88.5Confident5 Ų572.5 Ų72.53%0.0335%0.349CS..Hα-helixtrans-59.1-45.9179.5179.90000110.3Q58 Y60 W61 L120 E123 A124 S136V56-Q58 PolarHBondContact O-N 2.85Å; V56-Y60 WeakPolarHBondContact O-CA 3.37Å; V56-Y60 VanDerWaalsContact O-CB 3.23Å; V56-Y60 WeakPolarHBondContact O-CB 3.39Å; V56-Y60 PolarHBondContact O-N 3.21Å; V56-W61 HydrophobicContact CG1-CH2 4.3Å; V56-W61 HydrophobicContact CG1-CZ2 4.23Å; V56-W61 PolarHBondContact O-N 3.5Å; V56-L120 HydrophobicContact CG2-CD2 4.17Å; V56-E123 HydrophobicContact CG2-CB 3.57Å; V56-A124 HydrophobicContact CG1-CB 4.23Å; V56-A124 HydrophobicContact CG2-CB 4.22Å; V56-S136 PolarHBondContact N-O 3.39Å
57Q89.9Confident88.8Confident69 Ų6969.5 Ų69.532%0.32232%0.322SS..Iπ-helixtrans-59.2-46.2-179.717717866.900113.1S55 W61 Q62 S136 L137S55-Q57 VanDerWaalsContact C-N 3.31Å; S55-Q57 PolarHBondContact O-N 3.47Å; Q57-W61 HydrophobicContact CB-CE3 3.64Å; Q57-W61 HydrophobicContact CB-CZ3 3.84Å; Q57-W61 HydrophobicContact CG-CE3 3.87Å; Q57-W61 HydrophobicContact CG-CZ3 4.35Å; Q57-W61 WeakPolarHBondContact O-CB 3.27Å; Q57-W61 PolarHBondContact O-N 3.36Å; Q57-Q62 WeakPolarHBondContact O-CG 3.4Å; Q57-Q62 PolarHBondContact O-N 3.02Å; Q57-S136 PolarHBondContact N-O 2.76Å; Q57-S136 VanDerWaalsContact N-O 3.08Å; Q57-L137 HydrophobicContact CB-CD2 4.15Å; Q57-L137 HydrophobicContact CG-CD2 4.35Å
58Q87.7Confident89Confident46 Ų4669.4 Ų69.422%0.21532%0.319CS..Iπ-helixtrans-79-44.4-174.6-67.9-79.7-100112S55 V56 Q62 D64 R67S55-Q58 PolarHBondContact O-N 3.32Å; S55-Q58 WeakPolarHBondContact OG-CB 3.44Å; S55-Q58 WeakPolarHBondContact OG-CG 3.35Å; S55-Q58 PolarHBondContact OG-N 3.26Å; V56-Q58 PolarHBondContact O-N 2.85Å; Q58-Q62 WeakPolarHBondContact O-CB 3.44Å; Q58-D64 WeakPolarHBondContact O-CB 3.4Å; Q58-D64 PolarHBondContact O-N 3.45Å; Q58-D64 VanDerWaalsContact O-N 3.15Å; Q58-R67 VanDerWaalsContact OE1-NH2 3.12Å
59A85.6Confident89.2Confident0 Ų070.9 Ų70.90%032%0.321CS..Iπ-helixtrans-79.4-43.6-174.900000112.3V54 S55 G63 D64 L120V54-A59 HydrophobicContact CG2-CB 4.12Å; S55-A59 VanDerWaalsContact O-CB 3.29Å; S55-A59 WeakPolarHBondContact O-CB 3.46Å; S55-A59 PolarHBondContact O-N 3.48Å; A59-G63 CarbonylContact O-C 3.37Å; A59-G63 WeakPolarHBondContact O-CA 3.04Å; A59-G63 PolarHBondContact O-N 3.29Å; A59-D64 PolarHBondContact O-N 3.19Å; A59-L120 HydrophobicContact CB-CD1 3.71Å; A59-L120 HydrophobicContact CB-CD2 4.02Å
60Y85.2Confident89.5Confident150 Ų15070 Ų7059%0.58832%0.317SS*.Iπ-helixtrans-89.8-58-174.7-172.9-104000111.9V56 G63 W65V56-Y60 WeakPolarHBondContact O-CA 3.37Å; V56-Y60 VanDerWaalsContact O-CB 3.23Å; V56-Y60 WeakPolarHBondContact O-CB 3.39Å; V56-Y60 PolarHBondContact O-N 3.21Å; Y60-G63 PolarHBondContact O-N 2.95Å; Y60-W65 AromaticContact CD2-CH2 3.81Å; Y60-W65 HydrophobicContact CD2-CH2 3.81Å; Y60-W65 HydrophobicContact CD2-CZ2 4.33Å; Y60-W65 HydrophobicContact CE2-CH2 4.47Å
61W86.1Confident89.9Confident125 Ų12563.5 Ų63.547%0.47328%0.284SS..Iπ-helixtrans-73.4-38.1-175.6-64.2-40.2000113.5V56 Q57V56-W61 HydrophobicContact CG1-CH2 4.3Å; V56-W61 HydrophobicContact CG1-CZ2 4.23Å; V56-W61 PolarHBondContact O-N 3.5Å; Q57-W61 HydrophobicContact CB-CE3 3.64Å; Q57-W61 HydrophobicContact CB-CZ3 3.84Å; Q57-W61 HydrophobicContact CG-CE3 3.87Å; Q57-W61 HydrophobicContact CG-CZ3 4.35Å; Q57-W61 WeakPolarHBondContact O-CB 3.27Å; Q57-W61 PolarHBondContact O-N 3.36Å
62Q88.2Confident90.3Very high122 Ų12255.6 Ų55.657%0.5726%0.255SS*.SBendtrans-88.7-5.5176.1-59.8-177.419.900113.3Q57 Q58 D64Q57-Q62 WeakPolarHBondContact O-CG 3.4Å; Q57-Q62 PolarHBondContact O-N 3.02Å; Q58-Q62 WeakPolarHBondContact O-CB 3.44Å; Q62-D64 VanDerWaalsContact C-N 3.31Å; Q62-D64 PolarHBondContact O-N 2.92Å
63G88.2Confident90.6Very high38 Ų3858 Ų5839%0.39227%0.266SS..  trans7019.617600000115.2A59 Y60 W65A59-G63 CarbonylContact O-C 3.37Å; A59-G63 WeakPolarHBondContact O-CA 3.04Å; A59-G63 PolarHBondContact O-N 3.29Å; Y60-G63 PolarHBondContact O-N 2.95Å; G63-W65 VanDerWaalsContact C-N 3.28Å; G63-W65 PolarHBondContact O-N 2.88Å
64D90.6Very high90.7Very high49 Ų4957.8 Ų57.826%0.26226%0.264SS..  trans-85.666.8-179.5-167.52.5000112.2Q58 A59 Q62 R66 R67Q58-D64 WeakPolarHBondContact O-CB 3.4Å; Q58-D64 PolarHBondContact O-N 3.45Å; Q58-D64 VanDerWaalsContact O-N 3.15Å; A59-D64 PolarHBondContact O-N 3.19Å; Q62-D64 VanDerWaalsContact C-N 3.31Å; Q62-D64 PolarHBondContact O-N 2.92Å; D64-R66 PolarHBondContact O-N 2.96Å; D64-R66 VanDerWaalsContact O-N 3.12Å; D64-R67 HydrophobicContact CB-CG 4.42Å; D64-R67 WeakPolarHBondContact O-CB 3.32Å; D64-R67 WeakPolarHBondContact O-CG 3.44Å; D64-R67 PolarHBondContact O-N 3.36Å; D64-R67 IonicContact OD2-CZ 3.62Å; D64-R67 IonicContact OD2-NE 2.78Å; D64-R67 PolarHBondContact OD2-NE 2.98Å; D64-R67 IonicContact OD2-NH2 3.64Å
65W90.5Very high90.7Very high142 Ų14257.8 Ų57.854%0.53826%0.263SS..THydrogen-bonded Turntrans-62.8-17.2-179.2-57.5102.4000113.8Y60 G63 R67 L68Y60-W65 AromaticContact CD2-CH2 3.81Å; Y60-W65 HydrophobicContact CD2-CH2 3.81Å; Y60-W65 HydrophobicContact CD2-CZ2 4.33Å; Y60-W65 HydrophobicContact CE2-CH2 4.47Å; G63-W65 VanDerWaalsContact C-N 3.28Å; G63-W65 PolarHBondContact O-N 2.88Å; W65-R67 PolarHBondContact O-N 3.27Å; W65-L68 HydrophobicContact CE3-CD1 3.86Å; W65-L68 HydrophobicContact CZ3-CD1 4.43Å; W65-L68 WeakPolarHBondContact O-CB 3.35Å; W65-L68 PolarHBondContact O-N 2.85Å
66R92.1Very high90.4Very high192 Ų19260.2 Ų60.273%0.72528%0.284SS*.THydrogen-bonded Turntrans-61-25.5177.1-61177.7179-173.50111.7D64 L68 L69 L70D64-R66 PolarHBondContact O-N 2.96Å; D64-R66 VanDerWaalsContact O-N 3.12Å; R66-L68 PolarHBondContact O-N 3.34Å; R66-L69 PolarHBondContact O-N 2.88Å; R66-L70 HydrophobicContact CB-CD1 4.44Å; R66-L70 PolarHBondContact O-N 3.34Å
67R92.1Very high90.4Very high10 Ų1063.3 Ų63.34%0.03830%0.3CS..Hα-helixtrans-60.5-30.3175-67.5170.2178.3-1037.5113.1L50 R51 C53 V54 Q58 D64 W65 L69 L70 A71L50-R67 PolarHBondContact O-NH1 3.35Å; R51-R67 PolarHBondContact O-NH1 3.01Å; C53-R67 WeakPolarHBondContact O-CD 3.49Å; C53-R67 PolarHBondContact O-NH1 2.92Å; V54-R67 HydrophobicContact CB-CB 4.41Å; Q58-R67 VanDerWaalsContact OE1-NH2 3.12Å; D64-R67 HydrophobicContact CB-CG 4.42Å; D64-R67 WeakPolarHBondContact O-CB 3.32Å; D64-R67 WeakPolarHBondContact O-CG 3.44Å; D64-R67 PolarHBondContact O-N 3.36Å; D64-R67 IonicContact OD2-CZ 3.62Å; D64-R67 IonicContact OD2-NE 2.78Å; D64-R67 PolarHBondContact OD2-NE 2.98Å; D64-R67 IonicContact OD2-NH2 3.64Å; W65-R67 PolarHBondContact O-N 3.27Å; R67-L69 PolarHBondContact O-N 2.01Å; R67-L70 PolarHBondContact O-N 3.23Å; R67-A71 WeakPolarHBondContact O-CB 3.47Å; R67-A71 PolarHBondContact O-N 3.46Å
68L91.9Very high90.5Very high18 Ų1860.4 Ų60.49%0.09429%0.287CS..Hα-helixtrans-63.2-31.5174.2-71.2172.6000112.5V54 W65 R66 P72 L120V54-L68 HydrophobicContact CG2-CD2 3.99Å; W65-L68 HydrophobicContact CE3-CD1 3.86Å; W65-L68 HydrophobicContact CZ3-CD1 4.43Å; W65-L68 WeakPolarHBondContact O-CB 3.35Å; W65-L68 PolarHBondContact O-N 2.85Å; R66-L68 PolarHBondContact O-N 3.34Å; L68-P72 WeakPolarHBondContact O-CD 3.28Å; L68-L120 HydrophobicContact CD2-CD1 3.88Å; L68-L120 HydrophobicContact CG-CD1 4.42Å
69L92Very high90.6Very high110 Ų11062.9 Ų62.958%0.57629%0.294SS*.Hα-helixtrans-86.3-35.3177.4-63.3174.7000111.9R66 R67 F73 V113R66-L69 PolarHBondContact O-N 2.88Å; R67-L69 PolarHBondContact O-N 2.01Å; L69-F73 VanDerWaalsContact O-CD2 3.23Å; L69-F73 WeakPolarHBondContact O-CD2 2.92Å; L69-V113 HydrophobicContact CD2-CG2 3.66Å
70L92Very high90.9Very high57 Ų5764 Ų6430%0.29830%0.299SS..Hα-helixtrans-80.8-39.2-176.2-71165.8000113.2A52 R66 R67 F73 H74A52-L70 HydrophobicContact CB-CB 4.37Å; R66-L70 HydrophobicContact CB-CD1 4.44Å; R66-L70 PolarHBondContact O-N 3.34Å; R67-L70 PolarHBondContact O-N 3.23Å; L70-F73 PolarHBondContact O-N 3.43Å; L70-F73 VanDerWaalsContact O-N 3.1Å; L70-H74 PolarHBondContact O-N 2.9Å; L70-H74 PolarHBondContact O-ND1 3.28Å
71A93.3Very high91.3Very high6 Ų657 Ų575%0.0527%0.272CS..G310 helixtrans-57-42.6-172.600000113.7A52 V54 R67 F73 H74 G142A52-A71 WeakPolarHBondContact O-CA 3.36Å; A52-A71 WeakPolarHBondContact O-CB 3.45Å; A52-A71 PolarHBondContact O-N 2.99Å; V54-A71 HydrophobicContact CB-CB 3.98Å; V54-A71 HydrophobicContact CG1-CB 3.99Å; R67-A71 WeakPolarHBondContact O-CB 3.47Å; R67-A71 PolarHBondContact O-N 3.46Å; A71-F73 PolarHBondContact O-N 2.87Å; A71-F73 VanDerWaalsContact O-N 3.17Å; A71-H74 PolarHBondContact O-N 3.17Å; A71-G142 PolarHBondContact O-N 3.15Å
72P94.8Very high91.8Very high9 Ų952.2 Ų52.26%0.05825%0.254CS..G310 helixtrans-60.5-26.7178.9-25.235.7000114L68 G142 F143L68-P72 WeakPolarHBondContact O-CD 3.28Å; P72-G142 CarbonylContact O-C 3.55Å; P72-G142 VanDerWaalsContact O-C 3.31Å; P72-F143 HydrophobicContact CB-CD2 3.96Å; P72-F143 HydrophobicContact CB-CE2 4.46Å; P72-F143 VanDerWaalsContact O-CA 3.26Å; P72-F143 WeakPolarHBondContact O-CA 3.38Å; P72-F143 WeakPolarHBondContact O-CB 3.49Å; P72-F143 WeakPolarHBondContact O-CD2 3.13Å; P72-F143 PolarHBondContact O-N 3.5Å
73F94.4Very high92Very high51 Ų5152.4 Ų52.422%0.22425%0.253CS..G310 helixtrans-98.4-5.8-175.3-60.1-81.3000114.3I37 N38 L41 L69 L70 A71 F143I37-F73 HydrophobicContact CG2-CD1 4.05Å; I37-F73 HydrophobicContact CG2-CE1 4.27Å; N38-F73 WeakPolarHBondContact OD1-CA 3.1Å; L41-F73 HydrophobicContact CD1-CB 3.6Å; L41-F73 HydrophobicContact CD1-CD1 4.48Å; L41-F73 HydrophobicContact CD1-CG 4.16Å; L69-F73 VanDerWaalsContact O-CD2 3.23Å; L69-F73 WeakPolarHBondContact O-CD2 2.92Å; L70-F73 PolarHBondContact O-N 3.43Å; L70-F73 VanDerWaalsContact O-N 3.1Å; A71-F73 PolarHBondContact O-N 2.87Å; A71-F73 VanDerWaalsContact O-N 3.17Å; F73-F143 HydrophobicContact CE1-CE2 4.3Å
74H93.2Very high92.4Very high4 Ų451.2 Ų51.22%0.01924%0.238CC..  trans-98.3138.3176.2-72.371.3000110.4A47 L49 A52 L70 A71 V141 G142A47-H74 PolarHBondContact N-NE2 3.14Å; A47-H74 PolarHBondContact O-NE2 3.21Å; L49-H74 HydrophobicContact CD2-CB 4.11Å; A52-H74 HydrophobicContact CB-CB 4.01Å; A52-H74 VanDerWaalsContact CB-CG 3.44Å; L70-H74 PolarHBondContact O-N 2.9Å; L70-H74 PolarHBondContact O-ND1 3.28Å; A71-H74 PolarHBondContact O-N 3.17Å; H74-V141 HydrophobicContact CB-CG1 4.46Å; H74-V141 WeakPolarHBondContact O-CB 3.33Å; H74-G142 VanDerWaalsContact O-CA 3.24Å; H74-G142 WeakPolarHBondContact O-CA 3.47Å; H74-G142 PolarHBondContact O-N 3.37Å
75H92.8Very high92.7Very high8 Ų848.9 Ų48.94%0.03723%0.225CC..  trans-125.9138.3-177.9-66.276.1000109.7N38 Y42 L81 N84N38-H75 PolarHBondContact OD1-CE1 3.46Å; N38-H75 VanDerWaalsContact OD1-CE1 3.28Å; Y42-H75 HydrophobicContact CD2-CB 3.93Å; Y42-H75 HydrophobicContact CE2-CB 4.38Å; H75-L81 HydrophobicContact CB-CB 4.11Å; H75-L81 HydrophobicContact CB-CD1 4.32Å; H75-N84 PolarHBondContact CD2-ND2 3.15Å; H75-N84 PolarHBondContact NE2-ND2 3.47Å
76A88.5Confident92.9Very high54 Ų5443 Ų4345%0.44621%0.205SC..SBendtrans-72.5-33.7-174.400000113.1V141A76-V141 HydrophobicContact CB-CG2 4.42Å
77D89.3Confident93.1Very high70 Ų7035.3 Ų35.337%0.37418%0.181SC..SBendtrans-156.2171.6-173.265.688.7000112.1W79 H80 L81D77-W79 WeakPolarHBondContact OD1-CB 3.16Å; D77-W79 PolarHBondContact OD1-N 3.35Å; D77-H80 PolarHBondContact O-N 3.03Å; D77-H80 PolarHBondContact OD1-N 3.21Å; D77-H80 VanDerWaalsContact OD2-CB 3.28Å; D77-H80 WeakPolarHBondContact OD2-CB 3.36Å; D77-L81 PolarHBondContact O-N 2.78Å
78D91.4Very high93.4Very high8 Ų834.9 Ų34.94%0.04318%0.179CC..Hα-helixtrans-67.3-37.5-172.2-163.249.1000112.8H9 L10 G11 L12 Y42 Y82H9-D78 WeakPolarHBondContact CA-OD2 3.3Å; L10-D78 PolarHBondContact N-OD2 3.12Å; L10-D78 VanDerWaalsContact N-OD2 3.1Å; G11-D78 WeakPolarHBondContact CA-OD2 3.46Å; G11-D78 PolarHBondContact N-OD2 3.06Å; L12-D78 WeakPolarHBondContact CG-OD1 3.43Å; L12-D78 PolarHBondContact N-OD1 2.92Å; L12-D78 PolarHBondContact N-OD2 3.17Å; Y42-D78 WeakPolarHBondContact OH-CA 3.09Å; Y42-D78 WeakPolarHBondContact OH-CB 3.42Å; Y42-D78 PolarHBondContact OH-N 3.35Å; D78-Y82 WeakPolarHBondContact O-CB 3.38Å; D78-Y82 PolarHBondContact O-N 3.43Å
79W91.1Very high93.6Very high97 Ų9734 Ų3437%0.36717%0.174SC..Hα-helixtrans-73.7-39.6178.2-74.6114.8000111.4L10 M14 D77 L81 Y82 F83L10-W79 HydrophobicContact CD2-CH2 4.15Å; L10-W79 HydrophobicContact CD2-CZ2 3.87Å; L10-W79 HydrophobicContact CG-CH2 4.31Å; L10-W79 HydrophobicContact CG-CZ2 4.29Å; M14-W79 HydrophobicContact SD-CH2 3.8Å; M14-W79 HydrophobicContact SD-CZ3 4.05Å; D77-W79 WeakPolarHBondContact OD1-CB 3.16Å; D77-W79 PolarHBondContact OD1-N 3.35Å; W79-L81 VanDerWaalsContact C-N 3.33Å; W79-L81 PolarHBondContact O-N 3.01Å; W79-Y82 AromaticContact CE3-CD1 3.84Å; W79-Y82 HydrophobicContact CE3-CD1 3.84Å; W79-Y82 HydrophobicContact CE3-CG 4.35Å; W79-Y82 AromaticContact CZ3-CD1 3.91Å; W79-Y82 HydrophobicContact CZ3-CD1 3.91Å; W79-Y82 HydrophobicContact CZ3-CE1 4.22Å; W79-Y82 HydrophobicContact CZ3-CG 4.47Å; W79-Y82 PolarHBondContact O-N 3.16Å; W79-F83 HydrophobicContact CB-CD2 4.46Å; W79-F83 HydrophobicContact CB-CE2 4.31Å; W79-F83 AromaticContact CE3-CE2 3.95Å; W79-F83 HydrophobicContact CE3-CE2 3.95Å; W79-F83 HydrophobicContact CE3-CZ 4.22Å; W79-F83 WeakPolarHBondContact O-CD2 3.41Å; W79-F83 PolarHBondContact O-N 2.93Å
80H91.9Very high93.8Very high25 Ų2534.9 Ų34.912%0.11617%0.17CC..Hα-helixtrans-60.2-43.2174.3-176.3-167.2000111.3D77 N84D77-H80 PolarHBondContact O-N 3.03Å; D77-H80 PolarHBondContact OD1-N 3.21Å; D77-H80 VanDerWaalsContact OD2-CB 3.28Å; D77-H80 WeakPolarHBondContact OD2-CB 3.36Å; H80-N84 PolarHBondContact CD2-ND2 3.41Å; H80-N84 PolarHBondContact NE2-ND2 3.39Å; H80-N84 WeakPolarHBondContact O-CB 3.26Å; H80-N84 VanDerWaalsContact O-CG 3.31Å; H80-N84 PolarHBondContact O-N 2.87Å; H80-N84 PolarHBondContact O-ND2 3Å
81L94.1Very high93.9Very high1 Ų133.6 Ų33.61%0.00516%0.162CC..Hα-helixtrans-61.5-50.2171.7-178.974.4000111.5L12 N38 V39 Y42 H75 D77 W79 F83 N84 M85L12-L81 HydrophobicContact CD2-CD2 3.73Å; L12-L81 HydrophobicContact CG-CD2 4.3Å; N38-L81 HydrophobicContact CB-CD1 4.37Å; V39-L81 HydrophobicContact CG2-CD2 4.44Å; Y42-L81 HydrophobicContact CD1-CD2 3.52Å; Y42-L81 HydrophobicContact CD2-CB 4.47Å; Y42-L81 HydrophobicContact CD2-CD2 4.31Å; Y42-L81 HydrophobicContact CE1-CD2 4.13Å; Y42-L81 HydrophobicContact CG-CD2 3.61Å; Y42-L81 HydrophobicContact CG-CG 4.46Å; H75-L81 HydrophobicContact CB-CB 4.11Å; H75-L81 HydrophobicContact CB-CD1 4.32Å; D77-L81 PolarHBondContact O-N 2.78Å; W79-L81 VanDerWaalsContact C-N 3.33Å; W79-L81 PolarHBondContact O-N 3.01Å; L81-F83 PolarHBondContact O-N 3.03Å; L81-N84 PolarHBondContact O-N 3.14Å; L81-M85 HydrophobicContact CD1-CG 3.75Å; L81-M85 HydrophobicContact CD1-SD 4.49Å; L81-M85 HydrophobicContact CG-CG 4.04Å; L81-M85 WeakPolarHBondContact O-CB 3.44Å; L81-M85 WeakPolarHBondContact O-CG 3.5Å; L81-M85 PolarHBondContact O-N 3.3Å
82Y95.3Very high94.1Very high26 Ų2633.3 Ų33.310%0.10216%0.16CC..Hα-helixtrans-53-56.4-178.2170.7-103.8000111.9G11 M14 L15 Q18 D78 W79 N84 M85 V86G11-Y82 VanDerWaalsContact O-CD2 3.24Å; G11-Y82 WeakPolarHBondContact O-CD2 3.46Å; M14-Y82 HydrophobicContact CB-CD2 4.01Å; M14-Y82 HydrophobicContact CB-CE2 3.58Å; L15-Y82 HydrophobicContact CB-CD2 3.99Å; Q18-Y82 PolarHBondContact OE1-OH 3.46Å; D78-Y82 WeakPolarHBondContact O-CB 3.38Å; D78-Y82 PolarHBondContact O-N 3.43Å; W79-Y82 AromaticContact CE3-CD1 3.84Å; W79-Y82 HydrophobicContact CE3-CD1 3.84Å; W79-Y82 HydrophobicContact CE3-CG 4.35Å; W79-Y82 AromaticContact CZ3-CD1 3.91Å; W79-Y82 HydrophobicContact CZ3-CD1 3.91Å; W79-Y82 HydrophobicContact CZ3-CE1 4.22Å; W79-Y82 HydrophobicContact CZ3-CG 4.47Å; W79-Y82 PolarHBondContact O-N 3.16Å; Y82-N84 VanDerWaalsContact C-N 3.32Å; Y82-N84 PolarHBondContact O-N 3.28Å; Y82-M85 PolarHBondContact O-N 3.11Å; Y82-V86 HydrophobicContact CD2-CG2 3.89Å; Y82-V86 HydrophobicContact CE1-CG2 4.35Å; Y82-V86 HydrophobicContact CE2-CG2 3.48Å; Y82-V86 VanDerWaalsContact CE2-CG2 3.48Å; Y82-V86 HydrophobicContact CG-CG2 4.45Å; Y82-V86 VanDerWaalsContact O-CG2 3.28Å; Y82-V86 WeakPolarHBondContact O-CG2 3.42Å; Y82-V86 PolarHBondContact O-N 3.37Å
83F93.1Very high94.2Very high126 Ų12633.6 Ų33.655%0.55316%0.161SC*.Hα-helixtrans-64.1-36.9-177.4-70.6-61.4000112.6W79 L81 S87W79-F83 HydrophobicContact CB-CD2 4.46Å; W79-F83 HydrophobicContact CB-CE2 4.31Å; W79-F83 AromaticContact CE3-CE2 3.95Å; W79-F83 HydrophobicContact CE3-CE2 3.95Å; W79-F83 HydrophobicContact CE3-CZ 4.22Å; W79-F83 WeakPolarHBondContact O-CD2 3.41Å; W79-F83 PolarHBondContact O-N 2.93Å; L81-F83 PolarHBondContact O-N 3.03Å; F83-S87 WeakPolarHBondContact O-CB 3.46Å; F83-S87 PolarHBondContact O-N 3.38Å
84N95.7Very high94.2Very high13 Ų1334.8 Ų34.87%0.0717%0.169CC..Hα-helixtrans-63.9-47174.9-77.9-13.5000111.4H75 H80 L81 Y82 S87 L88 S144 L147H75-N84 PolarHBondContact CD2-ND2 3.15Å; H75-N84 PolarHBondContact NE2-ND2 3.47Å; H80-N84 PolarHBondContact CD2-ND2 3.41Å; H80-N84 PolarHBondContact NE2-ND2 3.39Å; H80-N84 WeakPolarHBondContact O-CB 3.26Å; H80-N84 VanDerWaalsContact O-CG 3.31Å; H80-N84 PolarHBondContact O-N 2.87Å; H80-N84 PolarHBondContact O-ND2 3Å; L81-N84 PolarHBondContact O-N 3.14Å; Y82-N84 VanDerWaalsContact C-N 3.32Å; Y82-N84 PolarHBondContact O-N 3.28Å; N84-S87 PolarHBondContact O-N 3.44Å; N84-L88 WeakPolarHBondContact O-CB 3.39Å; N84-L88 PolarHBondContact O-N 3.29Å; N84-S144 WeakPolarHBondContact OD1-CB 3.27Å; N84-L147 VanDerWaalsContact CA-CD1 3.49Å; N84-L147 HydrophobicContact CB-CD1 3.74Å; N84-L147 WeakPolarHBondContact O-CD1 3.16Å
85M96.9Very high94.4Very high0 Ų034.6 Ų34.60%017%0.169CC..Hα-helixtrans-72.9-34.6-175.6-66.7-55.3102.200112.8L15 L35 N38 L81 Y82 L88 L89 F143L15-M85 HydrophobicContact CD1-CB 3.63Å; L15-M85 HydrophobicContact CD2-CB 3.61Å; L15-M85 HydrophobicContact CD2-CG 3.96Å; L15-M85 HydrophobicContact CG-CB 4.29Å; L35-M85 HydrophobicContact CB-SD 4.47Å; L35-M85 HydrophobicContact CG-CB 4.37Å; L35-M85 HydrophobicContact CG-SD 4.23Å; N38-M85 HydrophobicContact CB-CE 3.71Å; N38-M85 HydrophobicContact CB-SD 3.4Å; N38-M85 WeakPolarHBondContact CB-SD 3.48Å; L81-M85 HydrophobicContact CD1-CG 3.75Å; L81-M85 HydrophobicContact CD1-SD 4.49Å; L81-M85 HydrophobicContact CG-CG 4.04Å; L81-M85 WeakPolarHBondContact O-CB 3.44Å; L81-M85 WeakPolarHBondContact O-CG 3.5Å; L81-M85 PolarHBondContact O-N 3.3Å; Y82-M85 PolarHBondContact O-N 3.11Å; M85-L88 HydrophobicContact CE-CD2 4.28Å; M85-L88 WeakPolarHBondContact O-CB 3.13Å; M85-L88 PolarHBondContact O-N 3.13Å; M85-L88 HydrophobicContact SD-CD2 4.11Å; M85-L89 WeakPolarHBondContact O-CB 3.45Å; M85-L89 PolarHBondContact O-N 3.3Å; M85-F143 HydrophobicContact CE-CB 4.21Å
86V95.9Very high94.7Very high18 Ų1834.5 Ų34.511%0.10917%0.168CC..Hα-helixtrans-65.1-43.4171.7174.10000110.8L15 Y82 L88 L89 W90L15-V86 HydrophobicContact CD1-CG2 4Å; Y82-V86 HydrophobicContact CD2-CG2 3.89Å; Y82-V86 HydrophobicContact CE1-CG2 4.35Å; Y82-V86 HydrophobicContact CE2-CG2 3.48Å; Y82-V86 VanDerWaalsContact CE2-CG2 3.48Å; Y82-V86 HydrophobicContact CG-CG2 4.45Å; Y82-V86 VanDerWaalsContact O-CG2 3.28Å; Y82-V86 WeakPolarHBondContact O-CG2 3.42Å; Y82-V86 PolarHBondContact O-N 3.37Å; V86-L88 VanDerWaalsContact C-N 3.33Å; V86-L88 PolarHBondContact O-N 3.4Å; V86-L89 WeakPolarHBondContact O-CB 3.48Å; V86-L89 PolarHBondContact O-N 3.48Å; V86-W90 PolarHBondContact O-N 2.8Å
87S95.6Very high95Very high31 Ų3139 Ų3922%0.21717%0.173CC..Hα-helixtrans-61.5-41.4174.8-179.70000111.7F83 N84 K91F83-S87 WeakPolarHBondContact O-CB 3.46Å; F83-S87 PolarHBondContact O-N 3.38Å; N84-S87 PolarHBondContact O-N 3.44Å; S87-K91 WeakPolarHBondContact O-CB 3.46Å; S87-K91 VanDerWaalsContact O-CG 3.27Å; S87-K91 WeakPolarHBondContact O-CG 3.47Å; S87-K91 PolarHBondContact O-N 3.31Å; S87-K91 WeakPolarHBondContact OG-CE 3.18Å
88L97.7Very high95.4Very high0 Ų041.8 Ų41.80%018%0.179CC..Hα-helixtrans-62.1-44.8173.5-179.656.4000111.6T31 V34 L35 N84 M85 V86 W90 K91 G92 F143 L147 L150T31-L88 HydrophobicContact CG2-CG 4.49Å; V34-L88 HydrophobicContact CB-CD2 4.24Å; V34-L88 HydrophobicContact CG1-CD2 3.73Å; L35-L88 HydrophobicContact CB-CD2 4.35Å; N84-L88 WeakPolarHBondContact O-CB 3.39Å; N84-L88 PolarHBondContact O-N 3.29Å; M85-L88 HydrophobicContact CE-CD2 4.28Å; M85-L88 WeakPolarHBondContact O-CB 3.13Å; M85-L88 PolarHBondContact O-N 3.13Å; M85-L88 HydrophobicContact SD-CD2 4.11Å; V86-L88 VanDerWaalsContact C-N 3.33Å; V86-L88 PolarHBondContact O-N 3.4Å; L88-W90 PolarHBondContact O-N 3.42Å; L88-K91 PolarHBondContact O-N 3.02Å; L88-G92 VanDerWaalsContact O-CA 3.26Å; L88-G92 WeakPolarHBondContact O-CA 3.39Å; L88-G92 PolarHBondContact O-N 3.34Å; L88-F143 HydrophobicContact CD1-CE1 3.95Å; L88-F143 HydrophobicContact CD2-CE1 4.27Å; L88-L147 HydrophobicContact CB-CD2 3.82Å; L88-L147 HydrophobicContact CD1-CD2 4.2Å; L88-L150 HydrophobicContact CD1-CD1 4.35Å
89L97.2Very high95.6Very high0 Ų042.9 Ų42.90%018%0.184CC..Hα-helixtrans-55.5-55.5-178.5-179.460.5000110.5V19 V22 I27 L35 M85 V86 M93V19-L89 HydrophobicContact CG2-CD2 4.42Å; V22-L89 HydrophobicContact CG2-CD2 4.1Å; I27-L89 HydrophobicContact CD1-CD1 3.55Å; I27-L89 HydrophobicContact CG1-CD1 3.77Å; I27-L89 HydrophobicContact CG2-CD1 3.91Å; L35-L89 HydrophobicContact CD1-CB 4.32Å; L35-L89 HydrophobicContact CD1-CD1 4.34Å; M85-L89 WeakPolarHBondContact O-CB 3.45Å; M85-L89 PolarHBondContact O-N 3.3Å; V86-L89 WeakPolarHBondContact O-CB 3.48Å; V86-L89 PolarHBondContact O-N 3.48Å; L89-M93 HydrophobicContact CD1-CG 4.32Å; L89-M93 HydrophobicContact CD1-SD 3.76Å; L89-M93 HydrophobicContact CG-SD 4Å; L89-M93 VanDerWaalsContact O-CB 3.26Å; L89-M93 WeakPolarHBondContact O-CB 3.36Å; L89-M93 WeakPolarHBondContact O-CG 3.46Å; L89-M93 PolarHBondContact O-N 3.17Å
90W94.9Very high96Very high128 Ų12839.9 Ų39.949%0.48518%0.184SC..Hα-helixtrans-67.9-44.5-179.1-66.6108.5000113.2V86 L88 N94V86-W90 PolarHBondContact O-N 2.8Å; L88-W90 PolarHBondContact O-N 3.42Å; W90-N94 PolarHBondContact O-N 2.96Å; W90-N94 PolarHBondContact O-ND2 3.11Å
91K95.4Very high96.2Very high30 Ų3040.6 Ų40.613%0.1319%0.194CC..Hα-helixtrans-70.3-42.5-178.8-66.6-179.3-159.2-510111.5S87 L88 N94 L95 L150 K151S87-K91 WeakPolarHBondContact O-CB 3.46Å; S87-K91 VanDerWaalsContact O-CG 3.27Å; S87-K91 WeakPolarHBondContact O-CG 3.47Å; S87-K91 PolarHBondContact O-N 3.31Å; S87-K91 WeakPolarHBondContact OG-CE 3.18Å; L88-K91 PolarHBondContact O-N 3.02Å; K91-N94 PolarHBondContact O-N 3.42Å; K91-L95 VanDerWaalsContact O-CB 3.28Å; K91-L95 WeakPolarHBondContact O-CB 3.41Å; K91-L95 VanDerWaalsContact O-CG 3.28Å; K91-L95 WeakPolarHBondContact O-CG 3.39Å; K91-L95 PolarHBondContact O-N 3.11Å; K91-L150 HydrophobicContact CD-CB 4.31Å; K91-K151 HydrophobicContact CD-CB 4.22Å
92G96.8Very high96.3Very high0 Ų044.6 Ų44.60%023%0.227CC..Hα-helixtrans-63.8-47178.200000111.9T31 L88 N94 L95 E96T31-G92 WeakPolarHBondContact OG1-CA 3.22Å; T31-G92 PolarHBondContact OG1-O 2.95Å; L88-G92 VanDerWaalsContact O-CA 3.26Å; L88-G92 WeakPolarHBondContact O-CA 3.39Å; L88-G92 PolarHBondContact O-N 3.34Å; G92-N94 VanDerWaalsContact C-N 3.3Å; G92-N94 PolarHBondContact O-N 3.1Å; G92-L95 PolarHBondContact O-N 3.2Å; G92-E96 WeakPolarHBondContact O-CB 3.09Å; G92-E96 PolarHBondContact O-N 3.23Å
93M96.5Very high96.5Very high16 Ų1645.7 Ų45.78%0.07923%0.231CC..Hα-helixtrans-55.6-44.3174.7-74.7170.270.800112.6V22 I27 L89 R97V22-M93 HydrophobicContact CG1-CE 3.67Å; V22-M93 HydrophobicContact CG1-SD 3.8Å; I27-M93 HydrophobicContact CG2-CG 4.44Å; L89-M93 HydrophobicContact CD1-CG 4.32Å; L89-M93 HydrophobicContact CD1-SD 3.76Å; L89-M93 HydrophobicContact CG-SD 4Å; L89-M93 VanDerWaalsContact O-CB 3.26Å; L89-M93 WeakPolarHBondContact O-CB 3.36Å; L89-M93 WeakPolarHBondContact O-CG 3.46Å; L89-M93 PolarHBondContact O-N 3.17Å; M93-R97 WeakPolarHBondContact O-CB 3.42Å; M93-R97 VanDerWaalsContact O-CD 3.25Å; M93-R97 WeakPolarHBondContact O-CD 3.2Å; M93-R97 WeakPolarHBondContact O-CG 3.44Å
94N95.1Very high96.7Very high76 Ų7639.7 Ų39.741%0.40621%0.205SC..Hα-helixtrans-70.8-43.8179.8-75.4-53.3000112.6W90 K91 G92 R98W90-N94 PolarHBondContact O-N 2.96Å; W90-N94 PolarHBondContact O-ND2 3.11Å; K91-N94 PolarHBondContact O-N 3.42Å; G92-N94 VanDerWaalsContact C-N 3.3Å; G92-N94 PolarHBondContact O-N 3.1Å; N94-R98 WeakPolarHBondContact O-CB 3.43Å; N94-R98 PolarHBondContact O-N 3.46Å
95L97.4Very high96.8Very high0 Ų043 Ų430%022%0.222CC..Hα-helixtrans-77.4-43.3-175.3-71.6173.7000112.4K91 G92 R97 R98 L99 F104 L150 L153 N154 Y157K91-L95 VanDerWaalsContact O-CB 3.28Å; K91-L95 WeakPolarHBondContact O-CB 3.41Å; K91-L95 VanDerWaalsContact O-CG 3.28Å; K91-L95 WeakPolarHBondContact O-CG 3.39Å; K91-L95 PolarHBondContact O-N 3.11Å; G92-L95 PolarHBondContact O-N 3.2Å; L95-R97 PolarHBondContact O-N 3.08Å; L95-R98 PolarHBondContact O-N 3.47Å; L95-R98 VanDerWaalsContact O-N 3.12Å; L95-L99 HydrophobicContact CB-CD1 4.35Å; L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.26Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.33Å; L95-L99 PolarHBondContact O-N 3.35Å; L95-F104 HydrophobicContact CB-CD2 4Å; L95-F104 HydrophobicContact CB-CE2 3.68Å; L95-F104 HydrophobicContact CB-CZ 4.46Å; L95-F104 HydrophobicContact CD1-CE2 4.25Å; L95-L150 HydrophobicContact CD1-CB 3.89Å; L95-L150 HydrophobicContact CD1-CD2 3.79Å; L95-L150 HydrophobicContact CD1-CG 4.32Å; L95-L153 HydrophobicContact CD1-CD2 4.46Å; L95-L153 HydrophobicContact CD2-CD2 4.36Å; L95-L153 HydrophobicContact CD2-CG 4.05Å; L95-N154 HydrophobicContact CD1-CB 4.29Å; L95-N154 HydrophobicContact CD2-CB 4.08Å; L95-N154 HydrophobicContact CG-CB 4.27Å; L95-Y157 HydrophobicContact CD2-CD2 3.83Å; L95-Y157 HydrophobicContact CD2-CE2 4.24Å
96E98.2Very high96.9Very high6 Ų646.2 Ų46.23%0.02824%0.235CC..Hα-helixtrans-64.2-42.1-179.2-170173.3160.600111.8P28 P29 V30 T31 G92 R98 L99 G100 F104P28-E96 HydrophobicContact CB-CB 3.91Å; P28-E96 HydrophobicContact CB-CG 3.73Å; P28-E96 WeakPolarHBondContact CB-OE1 3.35Å; P28-E96 VanDerWaalsContact CB-OE2 3.24Å; P28-E96 WeakPolarHBondContact CB-OE2 3.49Å; P28-E96 HydrophobicContact CG-CB 4.29Å; P29-E96 VanDerWaalsContact CD-OE1 3.26Å; P29-E96 WeakPolarHBondContact CD-OE1 3.37Å; V30-E96 WeakPolarHBondContact CB-OE1 3.28Å; V30-E96 WeakPolarHBondContact CB-OE2 3.28Å; V30-E96 PolarHBondContact N-OE1 2.86Å; V30-E96 PolarHBondContact N-OE2 2.92Å; T31-E96 WeakPolarHBondContact CB-OE2 3.12Å; T31-E96 PolarHBondContact N-OE2 2.92Å; T31-E96 PolarHBondContact OG1-OE2 3.47Å; G92-E96 WeakPolarHBondContact O-CB 3.09Å; G92-E96 PolarHBondContact O-N 3.23Å; E96-R98 PolarHBondContact O-N 2.92Å; E96-L99 PolarHBondContact O-N 3.45Å; E96-G100 CarbonylContact O-C 3.45Å; E96-G100 VanDerWaalsContact O-CA 3.28Å; E96-G100 WeakPolarHBondContact O-CA 3.36Å; E96-G100 PolarHBondContact O-N 3.36Å; E96-F104 HydrophobicContact CB-CB 4.28Å; E96-F104 HydrophobicContact CB-CD1 3.51Å; E96-F104 HydrophobicContact CB-CE1 3.94Å; E96-F104 HydrophobicContact CB-CG 3.9Å; E96-F104 HydrophobicContact CG-CB 4.13Å; E96-F104 HydrophobicContact CG-CD1 3.68Å; E96-F104 HydrophobicContact CG-CE1 4.45Å; E96-F104 HydrophobicContact CG-CG 4.15Å
97R96.6Very high97Very high148 Ų14845.3 Ų45.356%0.55823%0.23SC*.Hα-helixtrans-61.7-31.3174.9-71.1175.5-175.2164.7-3.4112.4S26 P28 M93 L95S26-R97 PolarHBondContact O-NH2 3.06Å; P28-R97 HydrophobicContact CG-CG 3.82Å; M93-R97 WeakPolarHBondContact O-CB 3.42Å; M93-R97 VanDerWaalsContact O-CD 3.25Å; M93-R97 WeakPolarHBondContact O-CD 3.2Å; M93-R97 WeakPolarHBondContact O-CG 3.44Å; L95-R97 PolarHBondContact O-N 3.08Å
98R96.4Very high97.1Very high128 Ų12844.1 Ų44.148%0.48322%0.221SC..Hα-helixtrans-85.8-36.5-178.9-171.9169.9-179.1162.7-5.3113.2N94 L95 E96 Y157N94-R98 WeakPolarHBondContact O-CB 3.43Å; N94-R98 PolarHBondContact O-N 3.46Å; L95-R98 PolarHBondContact O-N 3.47Å; L95-R98 VanDerWaalsContact O-N 3.12Å; E96-R98 PolarHBondContact O-N 2.92Å; R98-Y157 VanDerWaalsContact NH1-CB 3.31Å; R98-Y157 PolarHBondContact NH1-O 3.17Å; R98-Y157 VanDerWaalsContact NH2-CD1 3.32Å; R98-Y157 PolarHBondContact NH2-O 3.1Å
99L96.8Very high97.1Very high31 Ų3147 Ų4716%0.16224%0.241CC..Hα-helixtrans-93.8-21.4-174.6-67.6176.8000113.2L95 E96 F104 L153 Y157L95-L99 HydrophobicContact CB-CD1 4.35Å; L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.26Å; L95-L99 VanDerWaalsContact O-CG 3.29Å; L95-L99 WeakPolarHBondContact O-CG 3.33Å; L95-L99 PolarHBondContact O-N 3.35Å; E96-L99 PolarHBondContact O-N 3.45Å; L99-F104 HydrophobicContact CB-CB 4.35Å; L99-F104 HydrophobicContact CD1-CD2 4.11Å; L99-L153 HydrophobicContact CD1-CD2 4.24Å; L99-Y157 HydrophobicContact CD2-CE2 3.84Å; L99-Y157 VanDerWaalsContact CD2-OH 3.28Å; L99-Y157 WeakPolarHBondContact CD2-OH 3.38Å; L99-Y157 HydrophobicContact CG-CE2 4.44Å
100G97.7Very high97.1Very high35 Ų3548.5 Ų48.536%0.36125%0.25SS..  trans81.1152.1-165.400000112.2E96 A102 F104E96-G100 CarbonylContact O-C 3.45Å; E96-G100 VanDerWaalsContact O-CA 3.28Å; E96-G100 WeakPolarHBondContact O-CA 3.36Å; E96-G100 PolarHBondContact O-N 3.36Å; G100-A102 PolarHBondContact O-N 3.49Å; G100-F104 VanDerWaalsContact O-CB 3.23Å; G100-F104 WeakPolarHBondContact O-CB 3.35Å; G100-F104 PolarHBondContact O-N 3.47Å
101A97.5Very high97.3Very high40 Ų4042.4 Ų42.433%0.33123%0.227SC..Hα-helixtrans-57-49.6-174.500000113.3V30 F104 L105V30-A101 HydrophobicContact CG2-CB 3.83Å; A101-F104 PolarHBondContact O-N 3.37Å; A101-L105 WeakPolarHBondContact O-CB 3.47Å; A101-L105 PolarHBondContact O-N 3.45Å
102A96.8Very high97.4Very high85 Ų8541.5 Ų41.570%0.70223%0.225SC*.Hα-helixtrans-63.8-47.8-17600000112.5G100 L105 Y106G100-A102 PolarHBondContact O-N 3.49Å; A102-L105 PolarHBondContact O-N 3.36Å; A102-Y106 PolarHBondContact O-N 3.33Å
103W97.6Very high97.4Very high48 Ų4844.4 Ų44.418%0.18224%0.242CC..Hα-helixtrans-67.4-38.7178.2-172.6-99.3000111.6Y106 V107 Y205 M214 R215 A218W103-Y106 AromaticContact CE3-CD1 3.96Å; W103-Y106 HydrophobicContact CE3-CD1 3.96Å; W103-Y106 HydrophobicContact CH2-CD1 4.07Å; W103-Y106 HydrophobicContact CH2-CE1 4.16Å; W103-Y106 AromaticContact CZ3-CD1 3.65Å; W103-Y106 HydrophobicContact CZ3-CD1 3.65Å; W103-Y106 AromaticContact CZ3-CE1 3.97Å; W103-Y106 HydrophobicContact CZ3-CE1 3.97Å; W103-Y106 PolarHBondContact O-N 2.84Å; W103-V107 WeakPolarHBondContact O-CG2 3.03Å; W103-V107 PolarHBondContact O-N 2.91Å; W103-Y205 PolarHBondContact NE1-OH 2.83Å; W103-M214 HydrophobicContact CH2-CB 3.91Å; W103-M214 HydrophobicContact CH2-CE 4.5Å; W103-M214 HydrophobicContact CZ2-CB 4.38Å; W103-M214 HydrophobicContact CZ2-CE 4.32Å; W103-R215 HydrophobicContact CH2-CB 4.47Å; W103-R215 HydrophobicContact CH2-CG 3.62Å; W103-R215 HydrophobicContact CZ2-CG 4.12Å; W103-R215 HydrophobicContact CZ3-CG 4.4Å; W103-A218 HydrophobicContact CZ3-CB 4.03Å
104F98.4Very high97.4Very high0 Ų046 Ų460%025%0.251CS..Hα-helixtrans-62.7-43.2175.9-176.5-119.5000112.1V30 T31 L95 E96 L99 G100 A101 Y106 V107 L108 L150V30-F104 HydrophobicContact CB-CD1 4.22Å; V30-F104 HydrophobicContact CG1-CD1 3.98Å; V30-F104 HydrophobicContact CG1-CE1 4.41Å; T31-F104 WeakPolarHBondContact OG1-CE1 3.42Å; L95-F104 HydrophobicContact CB-CD2 4Å; L95-F104 HydrophobicContact CB-CE2 3.68Å; L95-F104 HydrophobicContact CB-CZ 4.46Å; L95-F104 HydrophobicContact CD1-CE2 4.25Å; E96-F104 HydrophobicContact CB-CB 4.28Å; E96-F104 HydrophobicContact CB-CD1 3.51Å; E96-F104 HydrophobicContact CB-CE1 3.94Å; E96-F104 HydrophobicContact CB-CG 3.9Å; E96-F104 HydrophobicContact CG-CB 4.13Å; E96-F104 HydrophobicContact CG-CD1 3.68Å; E96-F104 HydrophobicContact CG-CE1 4.45Å; E96-F104 HydrophobicContact CG-CG 4.15Å; L99-F104 HydrophobicContact CB-CB 4.35Å; L99-F104 HydrophobicContact CD1-CD2 4.11Å; G100-F104 VanDerWaalsContact O-CB 3.23Å; G100-F104 WeakPolarHBondContact O-CB 3.35Å; G100-F104 PolarHBondContact O-N 3.47Å; A101-F104 PolarHBondContact O-N 3.37Å; F104-Y106 VanDerWaalsContact C-N 3.3Å; F104-Y106 PolarHBondContact O-N 2.87Å; F104-V107 PolarHBondContact O-N 2.95Å; F104-L108 HydrophobicContact CD1-CD1 3.97Å; F104-L108 HydrophobicContact CD1-CG 4.41Å; F104-L108 HydrophobicContact CD2-CG 4.47Å; F104-L108 HydrophobicContact CE1-CD1 3.53Å; F104-L108 HydrophobicContact CE1-CD2 4.47Å; F104-L108 HydrophobicContact CE1-CG 4.07Å; F104-L108 HydrophobicContact CE2-CD1 4.46Å; F104-L108 HydrophobicContact CE2-CD2 4.12Å; F104-L108 HydrophobicContact CE2-CG 4.12Å; F104-L108 HydrophobicContact CZ-CD1 3.8Å; F104-L108 HydrophobicContact CZ-CD2 3.88Å; F104-L108 HydrophobicContact CZ-CG 3.91Å; F104-L108 WeakPolarHBondContact O-CG 3.45Å; F104-L108 PolarHBondContact O-N 3.11Å; F104-L150 HydrophobicContact CE2-CD2 4.02Å
105L98Very high97.5Very high83 Ų8342.9 Ų42.944%0.43523%0.234SC..Hα-helixtrans-60.1-40.6174179.560.9000112V30 A101 A102 L108 S109V30-L105 HydrophobicContact CG1-CB 3.95Å; V30-L105 HydrophobicContact CG1-CD1 3.94Å; V30-L105 HydrophobicContact CG2-CB 4.29Å; A101-L105 WeakPolarHBondContact O-CB 3.47Å; A101-L105 PolarHBondContact O-N 3.45Å; A102-L105 PolarHBondContact O-N 3.36Å; L105-L108 PolarHBondContact O-N 3.24Å; L105-S109 WeakPolarHBondContact O-CB 3.5Å; L105-S109 PolarHBondContact O-N 2.89Å; L105-S109 PolarHBondContact O-OG 3.13Å
106Y98Very high97.5Very high67 Ų6743.3 Ų43.326%0.26324%0.239SC..Hα-helixtrans-65.2-43.3176-177.1-142.3000111.8A102 W103 F104 L108 S109 V110 M214 A218A102-Y106 PolarHBondContact O-N 3.33Å; W103-Y106 AromaticContact CE3-CD1 3.96Å; W103-Y106 HydrophobicContact CE3-CD1 3.96Å; W103-Y106 HydrophobicContact CH2-CD1 4.07Å; W103-Y106 HydrophobicContact CH2-CE1 4.16Å; W103-Y106 AromaticContact CZ3-CD1 3.65Å; W103-Y106 HydrophobicContact CZ3-CD1 3.65Å; W103-Y106 AromaticContact CZ3-CE1 3.97Å; W103-Y106 HydrophobicContact CZ3-CE1 3.97Å; W103-Y106 PolarHBondContact O-N 2.84Å; F104-Y106 VanDerWaalsContact C-N 3.3Å; F104-Y106 PolarHBondContact O-N 2.87Å; Y106-L108 PolarHBondContact O-N 2.82Å; Y106-S109 PolarHBondContact O-N 2.86Å; Y106-V110 HydrophobicContact CD2-CG2 3.86Å; Y106-V110 HydrophobicContact CE2-CG2 3.47Å; Y106-V110 VanDerWaalsContact CE2-CG2 3.47Å; Y106-V110 WeakPolarHBondContact O-CG2 3.25Å; Y106-V110 PolarHBondContact O-N 3.35Å; Y106-M214 HydrophobicContact CD1-CE 3.67Å; Y106-M214 HydrophobicContact CE1-CB 3.72Å; Y106-M214 HydrophobicContact CE1-CE 3.69Å; Y106-M214 HydrophobicContact CE1-CG 4.1Å; Y106-M214 HydrophobicContact CG-CE 4.12Å; Y106-A218 HydrophobicContact CE1-CB 4.46Å
107V98.3Very high97.4Very high0 Ų044.9 Ų44.90%025%0.253CS..Hα-helixtrans-58.8-47.1173.2169.30000111.3W103 F104 S109 V110 F111 L150 L153 Y205 M214W103-V107 WeakPolarHBondContact O-CG2 3.03Å; W103-V107 PolarHBondContact O-N 2.91Å; F104-V107 PolarHBondContact O-N 2.95Å; V107-S109 VanDerWaalsContact C-N 3.34Å; V107-S109 PolarHBondContact O-N 3.2Å; V107-V110 PolarHBondContact O-N 3.13Å; V107-F111 HydrophobicContact CG1-CD1 4.23Å; V107-F111 HydrophobicContact CG1-CD2 3.92Å; V107-F111 HydrophobicContact CG1-CE1 4.07Å; V107-F111 HydrophobicContact CG1-CE2 3.76Å; V107-F111 HydrophobicContact CG1-CG 4.17Å; V107-F111 HydrophobicContact CG1-CZ 3.84Å; V107-F111 VanDerWaalsContact O-CB 3.28Å; V107-F111 WeakPolarHBondContact O-CB 3.48Å; V107-F111 WeakPolarHBondContact O-CD1 3.32Å; V107-F111 WeakPolarHBondContact O-CG 3.32Å; V107-F111 PolarHBondContact O-N 3.33Å; V107-L150 HydrophobicContact CG1-CD2 4.29Å; V107-L153 HydrophobicContact CG1-CD2 4.07Å; V107-Y205 HydrophobicContact CG2-CE2 3.97Å; V107-M214 HydrophobicContact CG2-CE 3.95Å
108L98.1Very high97.5Very high5 Ų538.8 Ų38.83%0.02623%0.232CC..Hα-helixtrans-60.4-44177.7-72.3-179.6000111.9V30 V34 F104 L105 Y106 F111 S112 F143 V146 L150V30-L108 HydrophobicContact CG1-CD1 4Å; V34-L108 HydrophobicContact CG2-CD1 3.97Å; F104-L108 HydrophobicContact CD1-CD1 3.97Å; F104-L108 HydrophobicContact CD1-CG 4.41Å; F104-L108 HydrophobicContact CD2-CG 4.47Å; F104-L108 HydrophobicContact CE1-CD1 3.53Å; F104-L108 HydrophobicContact CE1-CD2 4.47Å; F104-L108 HydrophobicContact CE1-CG 4.07Å; F104-L108 HydrophobicContact CE2-CD1 4.46Å; F104-L108 HydrophobicContact CE2-CD2 4.12Å; F104-L108 HydrophobicContact CE2-CG 4.12Å; F104-L108 HydrophobicContact CZ-CD1 3.8Å; F104-L108 HydrophobicContact CZ-CD2 3.88Å; F104-L108 HydrophobicContact CZ-CG 3.91Å; F104-L108 WeakPolarHBondContact O-CG 3.45Å; F104-L108 PolarHBondContact O-N 3.11Å; L105-L108 PolarHBondContact O-N 3.24Å; Y106-L108 PolarHBondContact O-N 2.82Å; L108-F111 PolarHBondContact O-N 2.97Å; L108-S112 WeakPolarHBondContact O-CB 3.45Å; L108-S112 PolarHBondContact O-N 3.04Å; L108-S112 PolarHBondContact O-OG 3.09Å; L108-F143 HydrophobicContact CD2-CZ 4.22Å; L108-V146 HydrophobicContact CD2-CG1 4.18Å; L108-L150 HydrophobicContact CD2-CD1 3.66Å; L108-L150 HydrophobicContact CD2-CD2 4.04Å; L108-L150 HydrophobicContact CD2-CG 4.29Å
109S97.3Very high97.5Very high62 Ų6232.9 Ų32.943%0.43421%0.21SC..Hα-helixtrans-61.2-49.6178.8-57.70000111.4L105 Y106 V107 S112 V113L105-S109 WeakPolarHBondContact O-CB 3.5Å; L105-S109 PolarHBondContact O-N 2.89Å; L105-S109 PolarHBondContact O-OG 3.13Å; Y106-S109 PolarHBondContact O-N 2.86Å; V107-S109 VanDerWaalsContact C-N 3.34Å; V107-S109 PolarHBondContact O-N 3.2Å; S109-S112 PolarHBondContact O-N 3.32Å; S109-V113 PolarHBondContact O-N 3.45Å
110V98.1Very high97.4Very high31 Ų3132.2 Ų32.219%0.18821%0.206CC..Hα-helixtrans-66.1-43.9179.5172.70000111.2Y106 V107 S112 V113 L114 L210 M214Y106-V110 HydrophobicContact CD2-CG2 3.86Å; Y106-V110 HydrophobicContact CE2-CG2 3.47Å; Y106-V110 VanDerWaalsContact CE2-CG2 3.47Å; Y106-V110 WeakPolarHBondContact O-CG2 3.25Å; Y106-V110 PolarHBondContact O-N 3.35Å; V107-V110 PolarHBondContact O-N 3.13Å; V110-S112 VanDerWaalsContact C-N 3.34Å; V110-S112 PolarHBondContact O-N 3.49Å; V110-V113 PolarHBondContact O-N 2.93Å; V110-L114 WeakPolarHBondContact O-CB 3.32Å; V110-L114 PolarHBondContact O-N 3.25Å; V110-L210 HydrophobicContact CG1-CD1 4.13Å; V110-M214 HydrophobicContact CB-CE 4.06Å; V110-M214 HydrophobicContact CB-SD 4.13Å; V110-M214 HydrophobicContact CG1-CE 4.43Å; V110-M214 HydrophobicContact CG1-CG 4.46Å; V110-M214 HydrophobicContact CG1-SD 3.82Å; V110-M214 HydrophobicContact CG2-CE 3.89Å; V110-M214 HydrophobicContact CG2-CG 4.42Å; V110-M214 HydrophobicContact CG2-SD 4.21Å
111F98.4Very high97.4Very high0 Ų036.3 Ų36.30%022%0.219CC..Hα-helixtrans-62.3-43.7179.1-77.411000110.8V107 L108 V113 L114 T115 V146 A149 L150 L153 V201 Y205 L210V107-F111 HydrophobicContact CG1-CD1 4.23Å; V107-F111 HydrophobicContact CG1-CD2 3.92Å; V107-F111 HydrophobicContact CG1-CE1 4.07Å; V107-F111 HydrophobicContact CG1-CE2 3.76Å; V107-F111 HydrophobicContact CG1-CG 4.17Å; V107-F111 HydrophobicContact CG1-CZ 3.84Å; V107-F111 VanDerWaalsContact O-CB 3.28Å; V107-F111 WeakPolarHBondContact O-CB 3.48Å; V107-F111 WeakPolarHBondContact O-CD1 3.32Å; V107-F111 WeakPolarHBondContact O-CG 3.32Å; V107-F111 PolarHBondContact O-N 3.33Å; L108-F111 PolarHBondContact O-N 2.97Å; F111-V113 PolarHBondContact O-N 3.02Å; F111-L114 PolarHBondContact O-N 3.46Å; F111-T115 WeakPolarHBondContact O-CB 3.34Å; F111-T115 VanDerWaalsContact O-CG2 3.26Å; F111-T115 WeakPolarHBondContact O-CG2 3.36Å; F111-T115 PolarHBondContact O-N 3.05Å; F111-T115 PolarHBondContact O-OG1 3.21Å; F111-V146 HydrophobicContact CB-CG1 3.99Å; F111-A149 HydrophobicContact CD2-CB 3.4Å; F111-A149 VanDerWaalsContact CD2-CB 3.4Å; F111-A149 HydrophobicContact CE2-CB 3.66Å; F111-A149 HydrophobicContact CG-CB 4.06Å; F111-A149 HydrophobicContact CZ-CB 4.49Å; F111-L150 HydrophobicContact CD2-CD2 3.95Å; F111-L150 HydrophobicContact CD2-CG 4.41Å; F111-L150 HydrophobicContact CE2-CD2 4.09Å; F111-L153 HydrophobicContact CE2-CD2 4.32Å; F111-L153 HydrophobicContact CZ-CD2 4.41Å; F111-V201 HydrophobicContact CD1-CG1 3.77Å; F111-V201 HydrophobicContact CE1-CG1 4.07Å; F111-V201 HydrophobicContact CG-CG1 4.15Å; F111-Y205 AromaticContact CE1-CD2 3.63Å; F111-Y205 HydrophobicContact CE1-CD2 3.63Å; F111-Y205 HydrophobicContact CE1-CE2 4.45Å; F111-Y205 AromaticContact CE1-CG 3.75Å; F111-Y205 HydrophobicContact CE1-CG 3.75Å; F111-Y205 HydrophobicContact CZ-CD1 4.18Å; F111-Y205 AromaticContact CZ-CD2 3.91Å; F111-Y205 HydrophobicContact CZ-CD2 3.91Å; F111-Y205 AromaticContact CZ-CG 3.63Å; F111-Y205 HydrophobicContact CZ-CG 3.63Å; F111-L210 HydrophobicContact CE1-CD2 4.27Å
112S96.9Very high97.3Very high11 Ų1136 Ų368%0.07721%0.212CC..Hα-helixtrans-55-48.9179.8-59.60000112.6L108 S109 V110 T115L108-S112 WeakPolarHBondContact O-CB 3.45Å; L108-S112 PolarHBondContact O-N 3.04Å; L108-S112 PolarHBondContact O-OG 3.09Å; S109-S112 PolarHBondContact O-N 3.32Å; V110-S112 VanDerWaalsContact C-N 3.34Å; V110-S112 PolarHBondContact O-N 3.49Å; S112-T115 PolarHBondContact O-OG1 3.12Å
113V96.6Very high97.3Very high60 Ų6032.1 Ų32.136%0.36418%0.179SC..Hα-helixtrans-72.3-47179.3178.80000111.2L69 S109 V110 F111 T115 G116 A117L69-V113 HydrophobicContact CD2-CG2 3.66Å; S109-V113 PolarHBondContact O-N 3.45Å; V110-V113 PolarHBondContact O-N 2.93Å; F111-V113 PolarHBondContact O-N 3.02Å; V113-T115 PolarHBondContact O-N 3.29Å; V113-G116 PolarHBondContact O-N 2.71Å; V113-A117 PolarHBondContact O-N 2.97Å
114L97.6Very high97.1Very high50 Ų5031.4 Ų31.426%0.26218%0.183SC..Hα-helixtrans-69.3-34-172.2-168.662000112.1V110 F111 G116 A117 V118 V201 L210V110-L114 WeakPolarHBondContact O-CB 3.32Å; V110-L114 PolarHBondContact O-N 3.25Å; F111-L114 PolarHBondContact O-N 3.46Å; L114-G116 VanDerWaalsContact C-N 3.3Å; L114-G116 PolarHBondContact O-N 3.03Å; L114-A117 PolarHBondContact O-N 3.13Å; L114-V118 HydrophobicContact CG-CG2 4.41Å; L114-V118 WeakPolarHBondContact O-CG2 3.4Å; L114-V118 PolarHBondContact O-N 3.22Å; L114-V201 HydrophobicContact CB-CG1 4.37Å; L114-V201 HydrophobicContact CB-CG2 4.28Å; L114-V201 HydrophobicContact CD2-CG1 4.06Å; L114-V201 HydrophobicContact CD2-CG2 4.18Å; L114-V201 HydrophobicContact CG-CG1 4.37Å; L114-V201 HydrophobicContact CG-CG2 3.86Å; L114-L210 HydrophobicContact CD2-CD1 4.01Å; L114-L210 HydrophobicContact CD2-CD2 3.45Å; L114-L210 VanDerWaalsContact CD2-CD2 3.45Å; L114-L210 HydrophobicContact CD2-CG 4.37Å
115T97.8Very high96.9Very high10 Ų1035.9 Ų35.96%0.06121%0.207CC..Hα-helixtrans-63.6-38.3173.752.80000111.7F111 S112 V113 Y119 A149 V201F111-T115 WeakPolarHBondContact O-CB 3.34Å; F111-T115 VanDerWaalsContact O-CG2 3.26Å; F111-T115 WeakPolarHBondContact O-CG2 3.36Å; F111-T115 PolarHBondContact O-N 3.05Å; F111-T115 PolarHBondContact O-OG1 3.21Å; S112-T115 PolarHBondContact O-OG1 3.12Å; V113-T115 PolarHBondContact O-N 3.29Å; T115-Y119 VanDerWaalsContact O-CB 3.28Å; T115-Y119 WeakPolarHBondContact O-CB 3.42Å; T115-Y119 PolarHBondContact O-N 3.2Å; T115-A149 HydrophobicContact CG2-CB 4.34Å; T115-V201 HydrophobicContact CG2-CB 3.86Å; T115-V201 HydrophobicContact CG2-CG1 4.04Å; T115-V201 HydrophobicContact CG2-CG2 3.86Å
116G95.9Very high96.8Very high9 Ų934.7 Ų34.79%0.09320%0.201CC..Hα-helixtrans-66.8-41.2174.100000112.2V113 L114 Y119 L120V113-G116 PolarHBondContact O-N 2.71Å; L114-G116 VanDerWaalsContact C-N 3.3Å; L114-G116 PolarHBondContact O-N 3.03Å; G116-Y119 WeakPolarHBondContact O-CB 3.39Å; G116-Y119 PolarHBondContact O-N 3.2Å; G116-L120 WeakPolarHBondContact O-CG 3.33Å; G116-L120 PolarHBondContact O-N 3.49Å
117A96.8Very high96.6Very high40 Ų4031.9 Ų31.933%0.33119%0.19SC..Hα-helixtrans-64.9-43.7177.100000112.5V113 L114 L120 L121V113-A117 PolarHBondContact O-N 2.97Å; L114-A117 PolarHBondContact O-N 3.13Å; A117-L120 PolarHBondContact O-N 2.82Å; A117-L121 PolarHBondContact O-N 3.44Å
118V97.8Very high96.3Very high20 Ų2039 Ų3912%0.12122%0.224CC..Hα-helixtrans-66.3-38.6175.6173.70000110.8L114 L121 L122 A197 L200 V201L114-V118 HydrophobicContact CG-CG2 4.41Å; L114-V118 WeakPolarHBondContact O-CG2 3.4Å; L114-V118 PolarHBondContact O-N 3.22Å; V118-L121 PolarHBondContact O-N 3.38Å; V118-L122 HydrophobicContact CG1-CD1 4.08Å; V118-L122 HydrophobicContact CG1-CG 4.27Å; V118-L122 VanDerWaalsContact O-CG 3.3Å; V118-L122 WeakPolarHBondContact O-CG 3.37Å; V118-L122 PolarHBondContact O-N 3.4Å; V118-A197 HydrophobicContact CB-CB 4.08Å; V118-A197 HydrophobicContact CG1-CB 3.78Å; V118-L200 HydrophobicContact CG1-CB 4.41Å; V118-L200 HydrophobicContact CG1-CD1 4.21Å; V118-V201 HydrophobicContact CB-CG2 4.22Å; V118-V201 HydrophobicContact CG2-CG2 3.76Å
119Y97Very high96.2Very high4 Ų445.2 Ų45.22%0.01626%0.256CS..Hα-helixtrans-56.9-49.9172.5167.1-96.9000111.7V54 T115 G116 L121 L122 E123 S138 A140 V193V54-Y119 HydrophobicContact CG1-CD1 3.77Å; V54-Y119 HydrophobicContact CG1-CE1 3.81Å; V54-Y119 WeakPolarHBondContact O-CE1 3.41Å; T115-Y119 VanDerWaalsContact O-CB 3.28Å; T115-Y119 WeakPolarHBondContact O-CB 3.42Å; T115-Y119 PolarHBondContact O-N 3.2Å; G116-Y119 WeakPolarHBondContact O-CB 3.39Å; G116-Y119 PolarHBondContact O-N 3.2Å; Y119-L121 VanDerWaalsContact C-N 3.3Å; Y119-L121 PolarHBondContact O-N 3.49Å; Y119-L122 PolarHBondContact O-N 2.98Å; Y119-E123 HydrophobicContact CD1-CG 4.45Å; Y119-E123 HydrophobicContact CD2-CG 4.02Å; Y119-E123 HydrophobicContact CE1-CG 3.99Å; Y119-E123 HydrophobicContact CE2-CG 3.53Å; Y119-E123 VanDerWaalsContact CE2-OE1 3.27Å; Y119-E123 WeakPolarHBondContact CE2-OE1 3.37Å; Y119-E123 HydrophobicContact CG-CG 4.47Å; Y119-E123 PolarHBondContact O-N 3.46Å; Y119-E123 PolarHBondContact OH-OE1 3.35Å; Y119-S138 PolarHBondContact OH-O 3.04Å; Y119-A140 HydrophobicContact CD2-CB 4.44Å; Y119-A140 HydrophobicContact CE1-CB 4.02Å; Y119-A140 HydrophobicContact CE2-CB 3.8Å; Y119-V193 HydrophobicContact CD2-CB 4.18Å; Y119-V193 HydrophobicContact CD2-CG1 3.93Å; Y119-V193 HydrophobicContact CE2-CB 4.17Å; Y119-V193 HydrophobicContact CE2-CG1 4.25Å
120L95.9Very high96Very high17 Ų1744.8 Ų44.89%0.08926%0.257CS..Hα-helixtrans-59-41.8177.7-71.8179000112.3V54 S55 V56 A59 L68 G116 A117 A124V54-L120 HydrophobicContact CG2-CD1 4.19Å; V54-L120 HydrophobicContact CG2-CD2 3.77Å; V54-L120 HydrophobicContact CG2-CG 4.01Å; S55-L120 VanDerWaalsContact C-CD2 3.43Å; S55-L120 WeakPolarHBondContact O-CD2 2.93Å; V56-L120 HydrophobicContact CG2-CD2 4.17Å; A59-L120 HydrophobicContact CB-CD1 3.71Å; A59-L120 HydrophobicContact CB-CD2 4.02Å; L68-L120 HydrophobicContact CD2-CD1 3.88Å; L68-L120 HydrophobicContact CG-CD1 4.42Å; G116-L120 WeakPolarHBondContact O-CG 3.33Å; G116-L120 PolarHBondContact O-N 3.49Å; A117-L120 PolarHBondContact O-N 2.82Å; L120-A124 VanDerWaalsContact O-CB 3.26Å; L120-A124 WeakPolarHBondContact O-CB 3.31Å; L120-A124 PolarHBondContact O-N 3.27Å
121L96.5Very high95.7Very high121 Ų12150.8 Ų50.863%0.63429%0.287SS*.Hα-helixtrans-63.5-43.4176.6179.164.1000111.8A117 V118 Y119 L125A117-L121 PolarHBondContact O-N 3.44Å; V118-L121 PolarHBondContact O-N 3.38Å; Y119-L121 VanDerWaalsContact C-N 3.3Å; Y119-L121 PolarHBondContact O-N 3.49Å; L121-L125 WeakPolarHBondContact O-CB 3.36Å; L121-L125 PolarHBondContact O-N 3.04Å
122L96.4Very high95.4Very high33 Ų3354 Ų5417%0.17330%0.304CS..Hα-helixtrans-66.4-46.3179.1-71.2175000111.8V118 Y119 L125 L126 V193 L196 A197 L200V118-L122 HydrophobicContact CG1-CD1 4.08Å; V118-L122 HydrophobicContact CG1-CG 4.27Å; V118-L122 VanDerWaalsContact O-CG 3.3Å; V118-L122 WeakPolarHBondContact O-CG 3.37Å; V118-L122 PolarHBondContact O-N 3.4Å; Y119-L122 PolarHBondContact O-N 2.98Å; L122-L125 PolarHBondContact O-N 3.14Å; L122-L126 WeakPolarHBondContact O-CB 3.27Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.44Å; L122-L126 PolarHBondContact O-N 2.87Å; L122-V193 HydrophobicContact CB-CG1 3.6Å; L122-V193 HydrophobicContact CD1-CG1 3.96Å; L122-V193 HydrophobicContact CG-CG1 4.46Å; L122-L196 HydrophobicContact CD1-CD2 4.33Å; L122-L196 HydrophobicContact CD1-CG 4.34Å; L122-A197 HydrophobicContact CD1-CB 4.12Å; L122-L200 HydrophobicContact CD1-CD1 4.08Å; L122-L200 HydrophobicContact CD2-CD1 4.35Å
123E95.4Very high95.1Very high3 Ų358 Ų581%0.01432%0.322CS..Hα-helixtrans-63.9-40.4177.7-70.2-70.9-178.400111.4V56 Y119 L126 T127 Y135 V193V56-E123 HydrophobicContact CG2-CB 3.57Å; Y119-E123 HydrophobicContact CD1-CG 4.45Å; Y119-E123 HydrophobicContact CD2-CG 4.02Å; Y119-E123 HydrophobicContact CE1-CG 3.99Å; Y119-E123 HydrophobicContact CE2-CG 3.53Å; Y119-E123 VanDerWaalsContact CE2-OE1 3.27Å; Y119-E123 WeakPolarHBondContact CE2-OE1 3.37Å; Y119-E123 HydrophobicContact CG-CG 4.47Å; Y119-E123 PolarHBondContact O-N 3.46Å; Y119-E123 PolarHBondContact OH-OE1 3.35Å; E123-L126 PolarHBondContact O-N 3.3Å; E123-T127 PolarHBondContact O-N 3.34Å; E123-T127 PolarHBondContact O-OG1 2.85Å; E123-Y135 WeakPolarHBondContact OE2-CA 3.24Å; E123-Y135 WeakPolarHBondContact OE2-CB 3.49Å; E123-Y135 WeakPolarHBondContact OE2-CD1 3.33Å; E123-V193 HydrophobicContact CG-CG1 4.12Å
124A93.9Very high94.9Very high33 Ų3358.1 Ų58.127%0.27333%0.325SS..Hα-helixtrans-63.4-43.2175.300000111.7V56 L120 L126 T127 E128V56-A124 HydrophobicContact CG1-CB 4.23Å; V56-A124 HydrophobicContact CG2-CB 4.22Å; L120-A124 VanDerWaalsContact O-CB 3.26Å; L120-A124 WeakPolarHBondContact O-CB 3.31Å; L120-A124 PolarHBondContact O-N 3.27Å; A124-L126 VanDerWaalsContact C-N 3.34Å; A124-L126 PolarHBondContact O-N 2.92Å; A124-T127 PolarHBondContact O-N 2.86Å; A124-E128 WeakPolarHBondContact O-CG 3.43Å; A124-E128 PolarHBondContact O-N 2.82Å; A124-E128 VanDerWaalsContact O-N 3.12Å
125L95.3Very high94.5Very high94 Ų9459.6 Ų59.649%0.49233%0.328SS..Hα-helixtrans-63-41175.4-179.164.1000111.7L121 L122 E128 L129L121-L125 WeakPolarHBondContact O-CB 3.36Å; L121-L125 PolarHBondContact O-N 3.04Å; L122-L125 PolarHBondContact O-N 3.14Å; L125-E128 PolarHBondContact O-N 3.48Å; L125-L129 HydrophobicContact CD1-CD1 3.76Å; L125-L129 HydrophobicContact CD1-CG 3.92Å; L125-L129 HydrophobicContact CD2-CD1 4.29Å; L125-L129 HydrophobicContact CG-CD1 3.7Å; L125-L129 HydrophobicContact CG-CG 4.21Å; L125-L129 WeakPolarHBondContact O-CB 3.2Å; L125-L129 VanDerWaalsContact O-CG 3.25Å; L125-L129 WeakPolarHBondContact O-CG 3.45Å; L125-L129 PolarHBondContact O-N 3.03Å
126L94.6Very high94.1Very high59 Ų5959.1 Ų59.131%0.30933%0.325SS..Hα-helixtrans-65.6-40.9177-73.7170.6000111.8L122 E123 A124 E128 L129 A130 Y135 V193L122-L126 WeakPolarHBondContact O-CB 3.27Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.44Å; L122-L126 PolarHBondContact O-N 2.87Å; E123-L126 PolarHBondContact O-N 3.3Å; A124-L126 VanDerWaalsContact C-N 3.34Å; A124-L126 PolarHBondContact O-N 2.92Å; L126-E128 PolarHBondContact O-N 3.05Å; L126-L129 PolarHBondContact O-N 3.33Å; L126-A130 WeakPolarHBondContact O-CB 3.28Å; L126-A130 PolarHBondContact O-N 3.17Å; L126-Y135 HydrophobicContact CB-CD1 4.09Å; L126-Y135 HydrophobicContact CB-CD2 4.16Å; L126-Y135 HydrophobicContact CB-CE1 4.49Å; L126-Y135 HydrophobicContact CB-CG 3.92Å; L126-Y135 HydrophobicContact CD1-CD1 4.18Å; L126-Y135 HydrophobicContact CD1-CE1 4.29Å; L126-V193 HydrophobicContact CD1-CG2 3.91Å
127T93.3Very high93.8Very high7 Ų763 Ų634%0.04334%0.343CS..Hα-helixtrans-55.9-49.5173.3-69.60000111.6E123 A124 D131 D132 Y135 S136E123-T127 PolarHBondContact O-N 3.34Å; E123-T127 PolarHBondContact O-OG1 2.85Å; A124-T127 PolarHBondContact O-N 2.86Å; T127-D131 WeakPolarHBondContact O-CA 3.34Å; T127-D131 PolarHBondContact O-N 3.05Å; T127-D132 WeakPolarHBondContact CA-O 3.37Å; T127-D132 PolarHBondContact O-N 3.16Å; T127-D132 PolarHBondContact OG1-O 3.4Å; T127-Y135 WeakPolarHBondContact OG1-CB 3.39Å; T127-S136 PolarHBondContact OG1-N 2.93Å; T127-S136 VanDerWaalsContact OG1-N 3.08Å
128E93.1Very high93.5Very high151 Ų15163.2 Ų63.271%0.70634%0.343SS*.Hα-helixtrans-70.2-39.3-178.4-65.3-66.2146.800112.7A124 L125 L126A124-E128 WeakPolarHBondContact O-CG 3.43Å; A124-E128 PolarHBondContact O-N 2.82Å; A124-E128 VanDerWaalsContact O-N 3.12Å; L125-E128 PolarHBondContact O-N 3.48Å; L126-E128 PolarHBondContact O-N 3.05Å
129L94.8Very high93.2Very high135 Ų13565 Ų6571%0.70736%0.355SS*.Hα-helixtrans-76.4-34-178-71.1178.5000113.4L125 L126L125-L129 HydrophobicContact CD1-CD1 3.76Å; L125-L129 HydrophobicContact CD1-CG 3.92Å; L125-L129 HydrophobicContact CD2-CD1 4.29Å; L125-L129 HydrophobicContact CG-CD1 3.7Å; L125-L129 HydrophobicContact CG-CG 4.21Å; L125-L129 WeakPolarHBondContact O-CB 3.2Å; L125-L129 VanDerWaalsContact O-CG 3.25Å; L125-L129 WeakPolarHBondContact O-CG 3.45Å; L125-L129 PolarHBondContact O-N 3.03Å; L126-L129 PolarHBondContact O-N 3.33Å
130A93.3Very high93Very high53 Ų5365.3 Ų65.344%0.43836%0.358SS..Hα-helixtrans-93.1-8.2-179.100000113.2L126 D132 Y135L126-A130 WeakPolarHBondContact O-CB 3.28Å; L126-A130 PolarHBondContact O-N 3.17Å; A130-D132 HydrophobicContact CB-CB 4.32Å; A130-D132 PolarHBondContact O-N 2.99Å; A130-Y135 HydrophobicContact CB-CD2 4.34Å; A130-Y135 HydrophobicContact CB-CE2 3.82Å
131D92.1Very high92.8Very high156 Ų15666 Ų6683%0.83436%0.363SS*.THydrogen-bonded Turntrans50.739.6-170.6-163.333.1000111.9T127T127-D131 WeakPolarHBondContact O-CA 3.34Å; T127-D131 PolarHBondContact O-N 3.05Å
132D91.9Very high92.6Very high67 Ų6760.8 Ų60.836%0.35834%0.339SS..  trans-127.2112.9-177.7-174.12.1000111.5T127 A130 S134 Y135T127-D132 WeakPolarHBondContact CA-O 3.37Å; T127-D132 PolarHBondContact O-N 3.16Å; T127-D132 PolarHBondContact OG1-O 3.4Å; A130-D132 HydrophobicContact CB-CB 4.32Å; A130-D132 PolarHBondContact O-N 2.99Å; D132-S134 PolarHBondContact O-N 2.94Å; D132-S134 WeakPolarHBondContact OD1-CB 3.35Å; D132-S134 PolarHBondContact OD1-N 3.08Å; D132-S134 PolarHBondContact OD1-OG 3.16Å; D132-S134 VanDerWaalsContact OD1-OG 3.07Å; D132-S134 PolarHBondContact OD2-OG 3.16Å; D132-Y135 HydrophobicContact CB-CD2 3.98Å; D132-Y135 HydrophobicContact CB-CE2 4.05Å; D132-Y135 WeakPolarHBondContact O-CD2 3.45Å
133Q91.2Very high92.6Very high97 Ų9759.2 Ų59.245%0.45333%0.331SS..THydrogen-bonded Turntrans-69.5-15.1-179.9-155.565.1-8.100113Y135 S136 L137Q133-Y135 PolarHBondContact O-N 3.33Å; Q133-S136 WeakPolarHBondContact CG-OG 3.23Å; Q133-S136 PolarHBondContact NE2-OG 3Å; Q133-S136 PolarHBondContact O-N 2.59Å; Q133-S136 VanDerWaalsContact O-N 3.09Å; Q133-S136 PolarHBondContact O-OG 3.35Å; Q133-L137 WeakPolarHBondContact O-CG 3.26Å; Q133-L137 PolarHBondContact O-N 3.33Å
134S91.6Very high92.6Very high61 Ų6159.8 Ų59.843%0.42734%0.335SS..Hα-helixtrans-56.6-37178.277.80000112.4D132 S136 L137 S138D132-S134 PolarHBondContact O-N 2.94Å; D132-S134 WeakPolarHBondContact OD1-CB 3.35Å; D132-S134 PolarHBondContact OD1-N 3.08Å; D132-S134 PolarHBondContact OD1-OG 3.16Å; D132-S134 VanDerWaalsContact OD1-OG 3.07Å; D132-S134 PolarHBondContact OD2-OG 3.16Å; S134-S136 PolarHBondContact O-N 3.02Å; S134-L137 PolarHBondContact O-N 3.45Å; S134-S138 PolarHBondContact O-N 3.46Å
135Y89.9Confident92.8Very high82 Ų8258.6 Ų58.632%0.32233%0.326SS..Hα-helixtrans-61.7-42.5175.6-68.2-68.1000112.3E123 L126 T127 A130 D132 Q133 L137 S138E123-Y135 WeakPolarHBondContact OE2-CA 3.24Å; E123-Y135 WeakPolarHBondContact OE2-CB 3.49Å; E123-Y135 WeakPolarHBondContact OE2-CD1 3.33Å; L126-Y135 HydrophobicContact CB-CD1 4.09Å; L126-Y135 HydrophobicContact CB-CD2 4.16Å; L126-Y135 HydrophobicContact CB-CE1 4.49Å; L126-Y135 HydrophobicContact CB-CG 3.92Å; L126-Y135 HydrophobicContact CD1-CD1 4.18Å; L126-Y135 HydrophobicContact CD1-CE1 4.29Å; T127-Y135 WeakPolarHBondContact OG1-CB 3.39Å; A130-Y135 HydrophobicContact CB-CD2 4.34Å; A130-Y135 HydrophobicContact CB-CE2 3.82Å; D132-Y135 HydrophobicContact CB-CD2 3.98Å; D132-Y135 HydrophobicContact CB-CE2 4.05Å; D132-Y135 WeakPolarHBondContact O-CD2 3.45Å; Q133-Y135 PolarHBondContact O-N 3.33Å; Y135-L137 PolarHBondContact O-N 2.88Å; Y135-S138 WeakPolarHBondContact O-CB 3.36Å; Y135-S138 PolarHBondContact O-N 3.38Å; Y135-S138 VanDerWaalsContact O-N 3.13Å
136S89.2Confident92.9Very high0 Ų054.2 Ų54.20%030%0.303CS..Hα-helixtrans-66.6-25.6178.576.60000113.7V56 Q57 T127 Q133 S134V56-S136 PolarHBondContact N-O 3.39Å; Q57-S136 PolarHBondContact N-O 2.76Å; Q57-S136 VanDerWaalsContact N-O 3.08Å; T127-S136 PolarHBondContact OG1-N 2.93Å; T127-S136 VanDerWaalsContact OG1-N 3.08Å; Q133-S136 WeakPolarHBondContact CG-OG 3.23Å; Q133-S136 PolarHBondContact NE2-OG 3Å; Q133-S136 PolarHBondContact O-N 2.59Å; Q133-S136 VanDerWaalsContact O-N 3.09Å; Q133-S136 PolarHBondContact O-OG 3.35Å; S134-S136 PolarHBondContact O-N 3.02Å
137L90.2Very high93.1Very high89 Ų8951.7 Ų51.747%0.46629%0.29SS..Hα-helixtrans-90.2-16.6178.3-58.8178.5000112.4Q57 Q133 S134 Y135 C139Q57-L137 HydrophobicContact CB-CD2 4.15Å; Q57-L137 HydrophobicContact CG-CD2 4.35Å; Q133-L137 WeakPolarHBondContact O-CG 3.26Å; Q133-L137 PolarHBondContact O-N 3.33Å; S134-L137 PolarHBondContact O-N 3.45Å; Y135-L137 PolarHBondContact O-N 2.88Å; L137-C139 PolarHBondContact O-N 3.33Å
138S90.2Very high93.3Very high46 Ų4651.7 Ų51.732%0.32229%0.289SS..  trans-57.5122.8177.9-175.30000110.2S55 Y119 S134 Y135S55-S138 WeakPolarHBondContact CB-O 3.43Å; Y119-S138 PolarHBondContact OH-O 3.04Å; S134-S138 PolarHBondContact O-N 3.46Å; Y135-S138 WeakPolarHBondContact O-CB 3.36Å; Y135-S138 PolarHBondContact O-N 3.38Å; Y135-S138 VanDerWaalsContact O-N 3.13Å
139C90.6Very high93.5Very high56 Ų5644.5 Ų44.538%0.37826%0.256SS..  trans-110.4124.3-175.9-133.20000111.3C53 V54 L137C53-C139 HydrophobicContact CB-CB 3.76Å; C53-C139 WeakPolarHBondContact CB-SG 3.27Å; C53-C139 WeakPolarHBondContact SG-CB 3.34Å; C53-C139 CovalentContact SG-SG 2.01Å; C53-C139 PolarHBondContact SG-SG 3.31Å; V54-C139 WeakPolarHBondContact O-CA 3.34Å; L137-C139 PolarHBondContact O-N 3.33Å
140A92.8Very high93.7Very high11 Ų1138 Ų389%0.09122%0.222CC..BIsolated β-bridgetrans-110.2143.6178.700000111.9C53 V54 Y119C53-A140 WeakPolarHBondContact CA-O 3.5Å; V54-A140 HydrophobicContact CG1-CB 4.2Å; V54-A140 PolarHBondContact N-O 3.14Å; V54-A140 PolarHBondContact O-N 3.07Å; Y119-A140 HydrophobicContact CD2-CB 4.44Å; Y119-A140 HydrophobicContact CE1-CB 4.02Å; Y119-A140 HydrophobicContact CE2-CB 3.8Å
141V93.4Very high93.8Very high31 Ų3135.7 Ų35.719%0.18820%0.202CC..  trans-141160.8171.1-68.40000109.4L49 C53 H74 A76L49-V141 HydrophobicContact CD2-CG1 4.45Å; L49-V141 HydrophobicContact CD2-CG2 4.39Å; C53-V141 VanDerWaalsContact CA-CG1 3.41Å; C53-V141 HydrophobicContact CB-CG1 3.31Å; H74-V141 HydrophobicContact CB-CG1 4.46Å; H74-V141 WeakPolarHBondContact O-CB 3.33Å; A76-V141 HydrophobicContact CB-CG2 4.42Å
142G92.7Very high94Very high12 Ų1228.9 Ų28.912%0.12417%0.166CC..SBendtrans110.3155.3170.500000113.3A71 P72 H74 S144A71-G142 PolarHBondContact O-N 3.15Å; P72-G142 CarbonylContact O-C 3.55Å; P72-G142 VanDerWaalsContact O-C 3.31Å; H74-G142 VanDerWaalsContact O-CA 3.24Å; H74-G142 WeakPolarHBondContact O-CA 3.47Å; H74-G142 PolarHBondContact O-N 3.37Å; G142-S144 PolarHBondContact O-N 3.29Å
143F95.9Very high94.3Very high1 Ų125.7 Ų25.70%0.00415%0.149CC..THydrogen-bonded Turntrans-76.1-2.2-177.6-154.3-108.3000112.9V34 P72 F73 M85 L88 L108 G145 V146 L147V34-F143 HydrophobicContact CG1-CE2 4.36Å; V34-F143 HydrophobicContact CG1-CZ 4.01Å; P72-F143 HydrophobicContact CB-CD2 3.96Å; P72-F143 HydrophobicContact CB-CE2 4.46Å; P72-F143 VanDerWaalsContact O-CA 3.26Å; P72-F143 WeakPolarHBondContact O-CA 3.38Å; P72-F143 WeakPolarHBondContact O-CB 3.49Å; P72-F143 WeakPolarHBondContact O-CD2 3.13Å; P72-F143 PolarHBondContact O-N 3.5Å; F73-F143 HydrophobicContact CE1-CE2 4.3Å; M85-F143 HydrophobicContact CE-CB 4.21Å; L88-F143 HydrophobicContact CD1-CE1 3.95Å; L88-F143 HydrophobicContact CD2-CE1 4.27Å; L108-F143 HydrophobicContact CD2-CZ 4.22Å; F143-G145 PolarHBondContact O-N 3.38Å; F143-V146 HydrophobicContact CD1-CB 4.11Å; F143-V146 HydrophobicContact CD1-CG1 4.46Å; F143-V146 HydrophobicContact CD2-CB 4.37Å; F143-V146 HydrophobicContact CD2-CG2 4.21Å; F143-V146 HydrophobicContact CE1-CB 3.88Å; F143-V146 HydrophobicContact CE1-CG1 3.74Å; F143-V146 HydrophobicContact CE2-CB 4.17Å; F143-V146 HydrophobicContact CE2-CG1 4.2Å; F143-V146 HydrophobicContact CE2-CG2 4.06Å; F143-V146 HydrophobicContact CG-CB 4.34Å; F143-V146 HydrophobicContact CZ-CB 3.93Å; F143-V146 HydrophobicContact CZ-CG1 3.59Å; F143-V146 HydrophobicContact CZ-CG2 4.29Å; F143-V146 WeakPolarHBondContact O-CB 3.33Å; F143-V146 PolarHBondContact O-N 3.04Å; F143-V146 VanDerWaalsContact O-N 3.08Å; F143-L147 HydrophobicContact CD1-CD1 4.27Å; F143-L147 HydrophobicContact CD1-CD2 3.93Å; F143-L147 HydrophobicContact CD1-CG 3.79Å; F143-L147 HydrophobicContact CE1-CD2 4.22Å; F143-L147 HydrophobicContact CE1-CG 4.45Å; F143-L147 WeakPolarHBondContact O-CG 3.42Å; F143-L147 PolarHBondContact O-N 3.41Å
144S95.8Very high94.4Very high14 Ų1422.2 Ų22.210%0.09813%0.133CC..Hα-helixtrans-61.9-38.1-17064.80000114N84 G142 V146 L147 F148 H195N84-S144 WeakPolarHBondContact OD1-CB 3.27Å; G142-S144 PolarHBondContact O-N 3.29Å; S144-V146 VanDerWaalsContact C-N 3.3Å; S144-V146 PolarHBondContact O-N 2.8Å; S144-L147 WeakPolarHBondContact O-CB 3.19Å; S144-L147 PolarHBondContact O-N 3.45Å; S144-L147 VanDerWaalsContact O-N 3.09Å; S144-F148 WeakPolarHBondContact O-CD2 3.45Å; S144-F148 PolarHBondContact O-N 3.2Å; S144-H195 WeakPolarHBondContact CB-NE2 3.16Å; S144-H195 PolarHBondContact OG-CD2 2.89Å; S144-H195 PolarHBondContact OG-NE2 3.28Å
145G96.9Very high94.5Very high8 Ų820 Ų208%0.08212%0.117CC..Hα-helixtrans-57.8-43.1173.400000112.1F143 L147 F148 A149 G198F143-G145 PolarHBondContact O-N 3.38Å; G145-L147 VanDerWaalsContact C-N 3.33Å; G145-L147 PolarHBondContact O-N 3.04Å; G145-F148 PolarHBondContact O-N 3.31Å; G145-A149 PolarHBondContact O-N 3.45Å; G145-A149 VanDerWaalsContact O-N 3.1Å; G145-G198 WeakPolarHBondContact O-CA 3.07Å
146V98Very high94.7Very high2 Ų220.8 Ų20.81%0.01212%0.123CC..Hα-helixtrans-63.3-41.7174.8-172.80000110.5L108 F111 F143 S144 F148 A149 L150L108-V146 HydrophobicContact CD2-CG1 4.18Å; F111-V146 HydrophobicContact CB-CG1 3.99Å; F143-V146 HydrophobicContact CD1-CB 4.11Å; F143-V146 HydrophobicContact CD1-CG1 4.46Å; F143-V146 HydrophobicContact CD2-CB 4.37Å; F143-V146 HydrophobicContact CD2-CG2 4.21Å; F143-V146 HydrophobicContact CE1-CB 3.88Å; F143-V146 HydrophobicContact CE1-CG1 3.74Å; F143-V146 HydrophobicContact CE2-CB 4.17Å; F143-V146 HydrophobicContact CE2-CG1 4.2Å; F143-V146 HydrophobicContact CE2-CG2 4.06Å; F143-V146 HydrophobicContact CG-CB 4.34Å; F143-V146 HydrophobicContact CZ-CB 3.93Å; F143-V146 HydrophobicContact CZ-CG1 3.59Å; F143-V146 HydrophobicContact CZ-CG2 4.29Å; F143-V146 WeakPolarHBondContact O-CB 3.33Å; F143-V146 PolarHBondContact O-N 3.04Å; F143-V146 VanDerWaalsContact O-N 3.08Å; S144-V146 VanDerWaalsContact C-N 3.3Å; S144-V146 PolarHBondContact O-N 2.8Å; V146-F148 PolarHBondContact O-N 2.83Å; V146-A149 WeakPolarHBondContact O-CB 3.28Å; V146-A149 PolarHBondContact O-N 2.86Å; V146-A149 VanDerWaalsContact O-N 3.17Å; V146-L150 HydrophobicContact CG1-CD1 4.43Å; V146-L150 HydrophobicContact CG1-CG 4.41Å; V146-L150 WeakPolarHBondContact O-CG 3.29Å; V146-L150 PolarHBondContact O-N 3.45Å
147L97.9Very high94.7Very high6 Ų623.4 Ų23.43%0.03113%0.133CC..Hα-helixtrans-64.7-36.5178.8-64.2169.6000113.2N84 L88 F143 S144 G145 L150 K151N84-L147 VanDerWaalsContact CA-CD1 3.49Å; N84-L147 HydrophobicContact CB-CD1 3.74Å; N84-L147 WeakPolarHBondContact O-CD1 3.16Å; L88-L147 HydrophobicContact CB-CD2 3.82Å; L88-L147 HydrophobicContact CD1-CD2 4.2Å; F143-L147 HydrophobicContact CD1-CD1 4.27Å; F143-L147 HydrophobicContact CD1-CD2 3.93Å; F143-L147 HydrophobicContact CD1-CG 3.79Å; F143-L147 HydrophobicContact CE1-CD2 4.22Å; F143-L147 HydrophobicContact CE1-CG 4.45Å; F143-L147 WeakPolarHBondContact O-CG 3.42Å; F143-L147 PolarHBondContact O-N 3.41Å; S144-L147 WeakPolarHBondContact O-CB 3.19Å; S144-L147 PolarHBondContact O-N 3.45Å; S144-L147 VanDerWaalsContact O-N 3.09Å; G145-L147 VanDerWaalsContact C-N 3.33Å; G145-L147 PolarHBondContact O-N 3.04Å; L147-L150 HydrophobicContact CD2-CD1 4.39Å; L147-L150 PolarHBondContact O-N 2.91Å; L147-K151 WeakPolarHBondContact O-CB 3.26Å; L147-K151 PolarHBondContact O-N 3.35Å
148F97.6Very high94.5Very high7 Ų721.1 Ų21.13%0.03112%0.12CC..Hα-helixtrans-65.1-41.7172-92-86000111.5S144 G145 V146 K151 V152 E179 L180 I183 H195 I199S144-F148 WeakPolarHBondContact O-CD2 3.45Å; S144-F148 PolarHBondContact O-N 3.2Å; G145-F148 PolarHBondContact O-N 3.31Å; V146-F148 PolarHBondContact O-N 2.83Å; F148-K151 WeakPolarHBondContact O-CB 3.28Å; F148-K151 PolarHBondContact O-N 3.09Å; F148-V152 PolarHBondContact O-N 3.08Å; F148-E179 HydrophobicContact CE1-CB 4.38Å; F148-E179 HydrophobicContact CE1-CG 4.29Å; F148-E179 HydrophobicContact CZ-CG 4.04Å; F148-L180 HydrophobicContact CE1-CB 4.12Å; F148-L180 HydrophobicContact CZ-CB 4.48Å; F148-I183 HydrophobicContact CE2-CD1 4Å; F148-I183 HydrophobicContact CZ-CD1 3.88Å; F148-H195 HydrophobicContact CD2-CB 3.69Å; F148-H195 AromaticContact CD2-CD2 3.44Å; F148-H195 VanDerWaalsContact CD2-CD2 3.44Å; F148-H195 WeakPolarHBondContact CD2-CD2 3.25Å; F148-H195 AromaticContact CD2-CG 3.67Å; F148-H195 HydrophobicContact CE1-CB 4.48Å; F148-H195 HydrophobicContact CE2-CB 3.61Å; F148-H195 AromaticContact CE2-CD2 3.37Å; F148-H195 WeakPolarHBondContact CE2-CD2 3.38Å; F148-H195 AromaticContact CE2-CG 3.35Å; F148-H195 AromaticContact CE2-ND1 3.9Å; F148-H195 AromaticContact CE2-NE2 3.93Å; F148-H195 HydrophobicContact CG-CB 4.16Å; F148-H195 HydrophobicContact CZ-CB 4.01Å; F148-I199 HydrophobicContact CB-CG1 4.24Å; F148-I199 HydrophobicContact CD1-CD1 3.87Å; F148-I199 HydrophobicContact CD1-CG1 3.64Å; F148-I199 HydrophobicContact CE1-CD1 4.19Å; F148-I199 HydrophobicContact CE1-CG1 4.45Å; F148-I199 HydrophobicContact CG-CG1 4.33Å
149A98.3Very high94.1Very high0 Ų022.7 Ų22.70%014%0.136CC..Hα-helixtrans-61.9-45.417400000111.9F111 T115 G145 V146 K151 V152 L153 G198 V201F111-A149 HydrophobicContact CD2-CB 3.4Å; F111-A149 VanDerWaalsContact CD2-CB 3.4Å; F111-A149 HydrophobicContact CE2-CB 3.66Å; F111-A149 HydrophobicContact CG-CB 4.06Å; F111-A149 HydrophobicContact CZ-CB 4.49Å; T115-A149 HydrophobicContact CG2-CB 4.34Å; G145-A149 PolarHBondContact O-N 3.45Å; G145-A149 VanDerWaalsContact O-N 3.1Å; V146-A149 WeakPolarHBondContact O-CB 3.28Å; V146-A149 PolarHBondContact O-N 2.86Å; V146-A149 VanDerWaalsContact O-N 3.17Å; A149-K151 VanDerWaalsContact C-N 3.29Å; A149-K151 PolarHBondContact O-N 3.38Å; A149-V152 PolarHBondContact O-N 3.06Å; A149-L153 PolarHBondContact O-N 3.08Å; A149-G198 WeakPolarHBondContact CA-O 3.4Å; A149-G198 VanDerWaalsContact CB-O 3.22Å; A149-G198 WeakPolarHBondContact CB-O 3.28Å; A149-G198 PolarHBondContact N-O 3.34Å; A149-V201 HydrophobicContact CB-CB 4.41Å; A149-V201 HydrophobicContact CB-CG1 4.23Å
150L97.9Very high93.5Very high0 Ų023.9 Ų23.90%016%0.158CC..Hα-helixtrans-63-34.4174.1-67.1-179.7000112.2L88 K91 L95 F104 V107 L108 F111 V146 L147 L153 N154L88-L150 HydrophobicContact CD1-CD1 4.35Å; K91-L150 HydrophobicContact CD-CB 4.31Å; L95-L150 HydrophobicContact CD1-CB 3.89Å; L95-L150 HydrophobicContact CD1-CD2 3.79Å; L95-L150 HydrophobicContact CD1-CG 4.32Å; F104-L150 HydrophobicContact CE2-CD2 4.02Å; V107-L150 HydrophobicContact CG1-CD2 4.29Å; L108-L150 HydrophobicContact CD2-CD1 3.66Å; L108-L150 HydrophobicContact CD2-CD2 4.04Å; L108-L150 HydrophobicContact CD2-CG 4.29Å; F111-L150 HydrophobicContact CD2-CD2 3.95Å; F111-L150 HydrophobicContact CD2-CG 4.41Å; F111-L150 HydrophobicContact CE2-CD2 4.09Å; V146-L150 HydrophobicContact CG1-CD1 4.43Å; V146-L150 HydrophobicContact CG1-CG 4.41Å; V146-L150 WeakPolarHBondContact O-CG 3.29Å; V146-L150 PolarHBondContact O-N 3.45Å; L147-L150 HydrophobicContact CD2-CD1 4.39Å; L147-L150 PolarHBondContact O-N 2.91Å; L150-L153 PolarHBondContact O-N 3.21Å; L150-N154 VanDerWaalsContact O-CB 3.27Å; L150-N154 WeakPolarHBondContact O-CB 3.46Å; L150-N154 PolarHBondContact O-N 2.89Å
151K95.9Very high93.3Very high4 Ų430.6 Ų30.62%0.01718%0.181CC..Hα-helixtrans-64.7-46175.9-176.2173.3176.1175.60111.2K91 L147 F148 A149 L153 N154 N155 A175 E179K91-K151 HydrophobicContact CD-CB 4.22Å; L147-K151 WeakPolarHBondContact O-CB 3.26Å; L147-K151 PolarHBondContact O-N 3.35Å; F148-K151 WeakPolarHBondContact O-CB 3.28Å; F148-K151 PolarHBondContact O-N 3.09Å; A149-K151 VanDerWaalsContact C-N 3.29Å; A149-K151 PolarHBondContact O-N 3.38Å; K151-L153 VanDerWaalsContact C-N 3.31Å; K151-L153 PolarHBondContact O-N 2.99Å; K151-N154 PolarHBondContact O-N 3.01Å; K151-N155 WeakPolarHBondContact O-CB 3.33Å; K151-N155 PolarHBondContact O-N 2.86Å; K151-N155 PolarHBondContact O-OD1 3.41Å; K151-A175 WeakPolarHBondContact CE-O 3.42Å; K151-A175 PolarHBondContact NZ-O 3.29Å; K151-E179 WeakPolarHBondContact CD-OE2 3.5Å; K151-E179 WeakPolarHBondContact CE-OE2 3.41Å; K151-E179 IonicContact NZ-OE1 2.59Å; K151-E179 PolarHBondContact NZ-OE1 2.88Å; K151-E179 IonicContact NZ-OE2 3.02Å; K151-E179 PolarHBondContact NZ-OE2 2.8Å
152V97.1Very high93Very high12 Ų1233.3 Ų33.37%0.07320%0.197CC..Hα-helixtrans-58.4-46174.7174.20000110.5F148 A149 N154 N155 H156 I199 G202 L203 T206F148-V152 PolarHBondContact O-N 3.08Å; A149-V152 PolarHBondContact O-N 3.06Å; V152-N154 PolarHBondContact O-N 2.94Å; V152-N155 PolarHBondContact O-N 3.5Å; V152-H156 WeakPolarHBondContact O-CB 3.23Å; V152-H156 PolarHBondContact O-N 2.89Å; V152-I199 HydrophobicContact CG2-CB 4.39Å; V152-I199 HydrophobicContact CG2-CG1 4.46Å; V152-I199 HydrophobicContact CG2-CG2 4.08Å; V152-G202 VanDerWaalsContact CG1-C 3.48Å; V152-L203 HydrophobicContact CG1-CD2 3.94Å; V152-L203 HydrophobicContact CG1-CG 4.2Å; V152-T206 HydrophobicContact CG1-CG2 4.43Å
153L96.7Very high92.8Very high1 Ų135.1 Ų35.11%0.00520%0.204CC..Hα-helixtrans-60.5-46.1176.4179.255.6000112.7L95 L99 V107 F111 A149 L150 K151 N155 H156 Y157 Y205 T206L95-L153 HydrophobicContact CD1-CD2 4.46Å; L95-L153 HydrophobicContact CD2-CD2 4.36Å; L95-L153 HydrophobicContact CD2-CG 4.05Å; L99-L153 HydrophobicContact CD1-CD2 4.24Å; V107-L153 HydrophobicContact CG1-CD2 4.07Å; F111-L153 HydrophobicContact CE2-CD2 4.32Å; F111-L153 HydrophobicContact CZ-CD2 4.41Å; A149-L153 PolarHBondContact O-N 3.08Å; L150-L153 PolarHBondContact O-N 3.21Å; K151-L153 VanDerWaalsContact C-N 3.31Å; K151-L153 PolarHBondContact O-N 2.99Å; L153-N155 VanDerWaalsContact C-N 3.34Å; L153-N155 PolarHBondContact O-N 3.39Å; L153-H156 WeakPolarHBondContact O-CB 3.48Å; L153-H156 PolarHBondContact O-N 3.23Å; L153-Y157 HydrophobicContact CD1-CD2 3.91Å; L153-Y157 HydrophobicContact CD1-CE2 3.44Å; L153-Y157 VanDerWaalsContact CD1-CE2 3.44Å; L153-Y157 HydrophobicContact CG-CD2 4.12Å; L153-Y157 HydrophobicContact CG-CE2 3.88Å; L153-Y157 WeakPolarHBondContact O-CD2 3.28Å; L153-Y157 PolarHBondContact O-N 3.25Å; L153-Y157 VanDerWaalsContact O-N 3.15Å; L153-Y205 HydrophobicContact CD1-CD1 3.68Å; L153-Y205 HydrophobicContact CD1-CE1 3.51Å; L153-Y205 HydrophobicContact CD2-CD1 4.35Å; L153-Y205 HydrophobicContact CD2-CE1 4.07Å; L153-Y205 HydrophobicContact CG-CE1 4.43Å; L153-T206 HydrophobicContact CB-CG2 4.36Å; L153-T206 HydrophobicContact CD1-CG2 3.8Å
154N94.8Very high92.4Very high23 Ų2343 Ų4312%0.12323%0.234CC..Hα-helixtrans-64.3-38.9178.6-175.368000112.2L95 L150 K151 V152 Y157 H158L95-N154 HydrophobicContact CD1-CB 4.29Å; L95-N154 HydrophobicContact CD2-CB 4.08Å; L95-N154 HydrophobicContact CG-CB 4.27Å; L150-N154 VanDerWaalsContact O-CB 3.27Å; L150-N154 WeakPolarHBondContact O-CB 3.46Å; L150-N154 PolarHBondContact O-N 2.89Å; K151-N154 PolarHBondContact O-N 3.01Å; V152-N154 PolarHBondContact O-N 2.94Å; N154-Y157 PolarHBondContact O-N 2.68Å; N154-H158 PolarHBondContact O-N 3.31Å; N154-H158 VanDerWaalsContact O-N 3.16Å; N154-H158 PolarHBondContact O-ND1 3.44Å; N154-H158 PolarHBondContact OD1-ND1 3.32Å
155N93.3Very high91.8Very high15 Ų1543.1 Ų43.18%0.0823%0.234CC..Hα-helixtrans-69.4-36.5177.5-69.3-6.3000111.8K151 V152 L153 Y157 H158 A159 I163 S172K151-N155 WeakPolarHBondContact O-CB 3.33Å; K151-N155 PolarHBondContact O-N 2.86Å; K151-N155 PolarHBondContact O-OD1 3.41Å; V152-N155 PolarHBondContact O-N 3.5Å; L153-N155 VanDerWaalsContact C-N 3.34Å; L153-N155 PolarHBondContact O-N 3.39Å; N155-Y157 VanDerWaalsContact C-N 3.29Å; N155-Y157 PolarHBondContact O-N 3.45Å; N155-H158 CarbonylContact O-C 3.31Å; N155-H158 PolarHBondContact O-N 2.86Å; N155-H158 VanDerWaalsContact O-N 3.16Å; N155-A159 PolarHBondContact O-N 3.06Å; N155-A159 VanDerWaalsContact O-N 3.08Å; N155-I163 VanDerWaalsContact OD1-CD1 3.27Å; N155-I163 WeakPolarHBondContact OD1-CD1 3.3Å; N155-S172 PolarHBondContact ND2-O 2.94Å
156H93.2Very high91.2Very high99 Ų9949.1 Ų49.146%0.45826%0.261SS..Hα-helixtrans-59.2-43.2173.2176.780.5000111.3V152 L153 H158 T206V152-H156 WeakPolarHBondContact O-CB 3.23Å; V152-H156 PolarHBondContact O-N 2.89Å; L153-H156 WeakPolarHBondContact O-CB 3.48Å; L153-H156 PolarHBondContact O-N 3.23Å; H156-H158 VanDerWaalsContact C-N 3.26Å; H156-H158 PolarHBondContact O-N 3.37Å; H156-T206 HydrophobicContact CB-CG2 3.62Å
157Y90.3Very high90.4Very high54 Ų5451.9 Ų51.921%0.21229%0.291CS..Hα-helixtrans-69.9-18.9176.7-85.6-39.7000115.1L95 R98 L99 L153 N154 N155L95-Y157 HydrophobicContact CD2-CD2 3.83Å; L95-Y157 HydrophobicContact CD2-CE2 4.24Å; R98-Y157 VanDerWaalsContact NH1-CB 3.31Å; R98-Y157 PolarHBondContact NH1-O 3.17Å; R98-Y157 VanDerWaalsContact NH2-CD1 3.32Å; R98-Y157 PolarHBondContact NH2-O 3.1Å; L99-Y157 HydrophobicContact CD2-CE2 3.84Å; L99-Y157 VanDerWaalsContact CD2-OH 3.28Å; L99-Y157 WeakPolarHBondContact CD2-OH 3.38Å; L99-Y157 HydrophobicContact CG-CE2 4.44Å; L153-Y157 HydrophobicContact CD1-CD2 3.91Å; L153-Y157 HydrophobicContact CD1-CE2 3.44Å; L153-Y157 VanDerWaalsContact CD1-CE2 3.44Å; L153-Y157 HydrophobicContact CG-CD2 4.12Å; L153-Y157 HydrophobicContact CG-CE2 3.88Å; L153-Y157 WeakPolarHBondContact O-CD2 3.28Å; L153-Y157 PolarHBondContact O-N 3.25Å; L153-Y157 VanDerWaalsContact O-N 3.15Å; N154-Y157 PolarHBondContact O-N 2.68Å; N155-Y157 VanDerWaalsContact C-N 3.29Å; N155-Y157 PolarHBondContact O-N 3.45Å
158H85.1Confident89.9Confident41 Ų4156.1 Ų56.119%0.1931%0.313CS..THydrogen-bonded Turntrans-126.348.1179.4-5897.7000110.4N154 N155 H156 R161 S172N154-H158 PolarHBondContact O-N 3.31Å; N154-H158 VanDerWaalsContact O-N 3.16Å; N154-H158 PolarHBondContact O-ND1 3.44Å; N154-H158 PolarHBondContact OD1-ND1 3.32Å; N155-H158 CarbonylContact O-C 3.31Å; N155-H158 PolarHBondContact O-N 2.86Å; N155-H158 VanDerWaalsContact O-N 3.16Å; H156-H158 VanDerWaalsContact C-N 3.26Å; H156-H158 PolarHBondContact O-N 3.37Å; H158-R161 PolarHBondContact CD2-NH1 3.49Å; H158-S172 PolarHBondContact O-OG 2.94Å
159A81.5Confident89.6Confident79 Ų7959.8 Ų59.865%0.65334%0.337SS*.THydrogen-bonded Turntrans-59.3145.7178.600000111.2N155 R161N155-A159 PolarHBondContact O-N 3.06Å; N155-A159 VanDerWaalsContact O-N 3.08Å; A159-R161 VanDerWaalsContact C-N 3.32Å; A159-R161 PolarHBondContact O-N 2.78Å
160G79.3Confident89.3Confident81 Ų8160.7 Ų60.784%0.83534%0.343SS*.THydrogen-bonded Turntrans82.5-2.5176.200000115.9S172G160-S172 PolarHBondContact N-OG 2.94Å
161R87.3Confident88.9Confident152 Ų15262.3 Ų62.357%0.57436%0.356SS*.  trans-80.8152.3174.7-63.6-168.1-178.2177.9-3.6112.4H158 A159 S172H158-R161 PolarHBondContact CD2-NH1 3.49Å; A159-R161 VanDerWaalsContact C-N 3.32Å; A159-R161 PolarHBondContact O-N 2.78Å; R161-S172 WeakPolarHBondContact O-CB 3.14Å; R161-S172 PolarHBondContact O-N 2.85Å; R161-S172 PolarHBondContact O-OG 2.84Å
162V87.9Confident88.6Confident89 Ų8962.4 Ų62.454%0.53936%0.357SS..EExtended strand (participates in β ladder)trans-89.6127.8163.61790000108Y164 P169V162-Y164 HydrophobicContact CG1-CE2 4.45Å; V162-P169 HydrophobicContact CG1-CB 3.6Å
163I88.8Confident88.2Confident50 Ų5070.1 Ų70.126%0.25639%0.385SS..EExtended strand (participates in β ladder)trans-109.9135.5174.4-61.6168.8000107.4N155 L165 V170 A175N155-I163 VanDerWaalsContact OD1-CD1 3.27Å; N155-I163 WeakPolarHBondContact OD1-CD1 3.3Å; I163-L165 HydrophobicContact CG2-CG 4.49Å; I163-V170 PolarHBondContact N-O 3.13Å; I163-V170 PolarHBondContact O-N 3.37Å; I163-A175 HydrophobicContact CD1-CB 4.01Å
164Y86.4Confident88Confident165 Ų16575.8 Ų75.865%0.64741%0.407SS*.EExtended strand (participates in β ladder)trans-88.9117.2174.1-70.3-92.3000109.9V162 L168 P169V162-Y164 HydrophobicContact CG1-CE2 4.45Å; Y164-L168 WeakPolarHBondContact CA-O 3.49Å; Y164-P169 HydrophobicContact CD1-CB 4.25Å; Y164-P169 HydrophobicContact CE1-CB 3.82Å; Y164-P169 HydrophobicContact CE1-CG 4.44Å
165L84.8Confident87.9Confident18 Ų1874.7 Ų74.79%0.09440%0.401CS..EExtended strand (participates in β ladder)trans-110.9112.1174.7-78.1159.7000108.1I163 G167 L168 V170 A175 V178 E179 L182I163-L165 HydrophobicContact CG2-CG 4.49Å; L165-G167 PolarHBondContact O-N 3.38Å; L165-L168 PolarHBondContact N-O 3.16Å; L165-L168 WeakPolarHBondContact O-CB 3.46Å; L165-L168 PolarHBondContact O-N 3.47Å; L165-V170 HydrophobicContact CD1-CB 4.26Å; L165-V170 HydrophobicContact CD1-CG2 4.21Å; L165-A175 HydrophobicContact CD1-CB 3.93Å; L165-A175 WeakPolarHBondContact CD1-O 3.46Å; L165-V178 HydrophobicContact CD1-CB 4.29Å; L165-V178 HydrophobicContact CD1-CG1 4.29Å; L165-E179 HydrophobicContact CD1-CB 4.48Å; L165-E179 HydrophobicContact CD2-CB 4.12Å; L165-E179 HydrophobicContact CD2-CG 4.39Å; L165-L182 HydrophobicContact CB-CD1 4.27Å
166M82.8Confident87.9Confident133 Ų13374.2 Ų74.266%0.65540%0.399SS*.THydrogen-bonded Turntrans50.939.1-175.4-59.2-179.9177.600112.9L168 L182 T186M166-L168 VanDerWaalsContact C-N 3.27Å; M166-L168 PolarHBondContact O-N 2.89Å; M166-L182 HydrophobicContact SD-CD1 4.16Å; M166-L182 HydrophobicContact SD-CD2 4.31Å; M166-T186 HydrophobicContact CE-CG2 4.07Å
167G82.2Confident88Confident61 Ų6174.8 Ų74.863%0.62940%0.397SS*.THydrogen-bonded Turntrans82-6.9-177.800000115.3L165L165-G167 PolarHBondContact O-N 3.38Å
168L85.9Confident88.1Confident95 Ų9574.4 Ų74.450%0.49740%0.401SS..EExtended strand (participates in β ladder)trans-87.9125.4177.9-59.5173.1000111Y164 L165 M166 V170Y164-L168 WeakPolarHBondContact CA-O 3.49Å; L165-L168 PolarHBondContact N-O 3.16Å; L165-L168 WeakPolarHBondContact O-CB 3.46Å; L165-L168 PolarHBondContact O-N 3.47Å; M166-L168 VanDerWaalsContact C-N 3.27Å; M166-L168 PolarHBondContact O-N 2.89Å; L168-V170 HydrophobicContact CB-CG2 4.48Å; L168-V170 PolarHBondContact O-N 3.33Å
169P91.9Very high88.5Confident84 Ų8474.3 Ų74.355%0.54540%0.4SS..EExtended strand (participates in β ladder)trans-73.3118.817528.7-32.1000110.3V162 Y164V162-P169 HydrophobicContact CG1-CB 3.6Å; Y164-P169 HydrophobicContact CD1-CB 4.25Å; Y164-P169 HydrophobicContact CE1-CB 3.82Å; Y164-P169 HydrophobicContact CE1-CG 4.44Å
170V91.7Very high89.1Confident18 Ų1870.8 Ų70.811%0.10937%0.37CS..EExtended strand (participates in β ladder)trans-127.4132.7-178.8-177.20000109.7I163 L165 L168 S172 A175 V178I163-V170 PolarHBondContact N-O 3.13Å; I163-V170 PolarHBondContact O-N 3.37Å; L165-V170 HydrophobicContact CD1-CB 4.26Å; L165-V170 HydrophobicContact CD1-CG2 4.21Å; L168-V170 HydrophobicContact CB-CG2 4.48Å; L168-V170 PolarHBondContact O-N 3.33Å; V170-S172 PolarHBondContact O-N 3.02Å; V170-A175 HydrophobicContact CG1-CB 4.4Å; V170-V178 HydrophobicContact CG1-CB 4.29Å; V170-V178 HydrophobicContact CG1-CG2 3.84Å; V170-V178 HydrophobicContact CG2-CG1 4.15Å; V170-V178 HydrophobicContact CG2-CG2 4.48Å
171A91.3Very high89.8Confident34 Ų3470.6 Ų70.628%0.28135%0.353SS..EExtended strand (participates in β ladder)trans-60.6135.9172.400000110.4R173 Y174 A175A171-R173 HydrophobicContact CB-CG 4.25Å; A171-R173 PolarHBondContact O-N 3.36Å; A171-Y174 HydrophobicContact CB-CD2 4.13Å; A171-Y174 PolarHBondContact O-N 2.93Å; A171-A175 PolarHBondContact O-N 3.36Å
172S89.6Confident89.9Confident6 Ų665.1 Ų65.14%0.04234%0.335CS..THydrogen-bonded Turntrans-55.9-28.3-171.764.20000114.3N155 H158 G160 R161 V170 Y174 A175N155-S172 PolarHBondContact ND2-O 2.94Å; H158-S172 PolarHBondContact O-OG 2.94Å; G160-S172 PolarHBondContact N-OG 2.94Å; R161-S172 WeakPolarHBondContact O-CB 3.14Å; R161-S172 PolarHBondContact O-N 2.85Å; R161-S172 PolarHBondContact O-OG 2.84Å; V170-S172 PolarHBondContact O-N 3.02Å; S172-Y174 VanDerWaalsContact C-N 3.3Å; S172-Y174 PolarHBondContact O-N 2.91Å; S172-A175 PolarHBondContact O-N 3.01Å
173R88.1Confident90Very high175 Ų17562.7 Ų62.766%0.6632%0.318SS*.THydrogen-bonded Turntrans-62.4-30.1174.467.4-178.8-178.4-108.70114.4A171A171-R173 HydrophobicContact CB-CG 4.25Å; A171-R173 PolarHBondContact O-N 3.36Å
174Y91.1Very high90Very high120 Ų12064.6 Ų64.647%0.47133%0.326SS..THydrogen-bonded Turntrans-101.1-9.7179.3-55.8-57.5000112.9A171 S172 S176 W177 V178A171-Y174 HydrophobicContact CB-CD2 4.13Å; A171-Y174 PolarHBondContact O-N 2.93Å; S172-Y174 VanDerWaalsContact C-N 3.3Å; S172-Y174 PolarHBondContact O-N 2.91Å; Y174-S176 VanDerWaalsContact C-N 3.28Å; Y174-S176 PolarHBondContact O-N 3.38Å; Y174-S176 VanDerWaalsContact O-N 3.16Å; Y174-W177 PolarHBondContact O-N 3.18Å; Y174-V178 PolarHBondContact O-N 3.01Å
175A92.7Very high90.1Very high0 Ų064.1 Ų64.10%033%0.328CS..Hα-helixtrans-59.3-33.2-170.800000114.1K151 I163 L165 V170 A171 S172 E179K151-A175 WeakPolarHBondContact CE-O 3.42Å; K151-A175 PolarHBondContact NZ-O 3.29Å; I163-A175 HydrophobicContact CD1-CB 4.01Å; L165-A175 HydrophobicContact CD1-CB 3.93Å; L165-A175 WeakPolarHBondContact CD1-O 3.46Å; V170-A175 HydrophobicContact CG1-CB 4.4Å; A171-A175 PolarHBondContact O-N 3.36Å; S172-A175 PolarHBondContact O-N 3.01Å; A175-E179 WeakPolarHBondContact O-CB 3.46Å; A175-E179 PolarHBondContact O-N 3.48Å; A175-E179 VanDerWaalsContact O-N 3.14Å
176S94.3Very high90.1Very high5 Ų567.6 Ų67.64%0.03535%0.349CS..Hα-helixtrans-71.2-39.3176-56.20000112.1Y174 L180Y174-S176 VanDerWaalsContact C-N 3.28Å; Y174-S176 PolarHBondContact O-N 3.38Å; Y174-S176 VanDerWaalsContact O-N 3.16Å; S176-L180 WeakPolarHBondContact O-CB 3.33Å; S176-L180 PolarHBondContact O-N 3.41Å
177W94.8Very high90.2Very high111 Ų11163 Ų6342%0.4233%0.332SS..Hα-helixtrans-70-43.2178.4-62.2105.5000112Y174 L180 V181 L196 I199 L203Y174-W177 PolarHBondContact O-N 3.18Å; W177-L180 HydrophobicContact CE3-CD2 4.34Å; W177-L180 WeakPolarHBondContact O-CB 3.15Å; W177-L180 PolarHBondContact O-N 3.03Å; W177-V181 WeakPolarHBondContact O-CG2 3.49Å; W177-V181 PolarHBondContact O-N 3.03Å; W177-V181 VanDerWaalsContact O-N 3.14Å; W177-L196 HydrophobicContact CH2-CD1 4.21Å; W177-L196 HydrophobicContact CZ3-CD1 3.92Å; W177-I199 HydrophobicContact CE3-CD1 4.36Å; W177-I199 HydrophobicContact CH2-CG2 4.11Å; W177-I199 HydrophobicContact CZ2-CG2 3.86Å; W177-L203 HydrophobicContact CZ2-CD1 4.31Å
178V93.6Very high90Very high46 Ų4664.8 Ų64.828%0.27933%0.333SS..Hα-helixtrans-63.4-43.2176.5175.20000110.7L165 V170 Y174 L180 V181 L182L165-V178 HydrophobicContact CD1-CB 4.29Å; L165-V178 HydrophobicContact CD1-CG1 4.29Å; V170-V178 HydrophobicContact CG1-CB 4.29Å; V170-V178 HydrophobicContact CG1-CG2 3.84Å; V170-V178 HydrophobicContact CG2-CG1 4.15Å; V170-V178 HydrophobicContact CG2-CG2 4.48Å; Y174-V178 PolarHBondContact O-N 3.01Å; V178-L180 VanDerWaalsContact C-N 3.34Å; V178-L180 PolarHBondContact O-N 3.07Å; V178-V181 PolarHBondContact O-N 3.08Å; V178-L182 HydrophobicContact CG1-CD1 3.94Å; V178-L182 HydrophobicContact CG1-CG 4.3Å; V178-L182 VanDerWaalsContact O-CG 3.32Å; V178-L182 WeakPolarHBondContact O-CG 3.45Å; V178-L182 PolarHBondContact O-N 3.43Å
179E93.3Very high89.7Confident38 Ų3864.3 Ų64.318%0.17835%0.351CS..Hα-helixtrans-64.8-36.7176-176.9179-104.700112.8F148 K151 L165 A175 V181 L182 I183F148-E179 HydrophobicContact CE1-CB 4.38Å; F148-E179 HydrophobicContact CE1-CG 4.29Å; F148-E179 HydrophobicContact CZ-CG 4.04Å; K151-E179 WeakPolarHBondContact CD-OE2 3.5Å; K151-E179 WeakPolarHBondContact CE-OE2 3.41Å; K151-E179 IonicContact NZ-OE1 2.59Å; K151-E179 PolarHBondContact NZ-OE1 2.88Å; K151-E179 IonicContact NZ-OE2 3.02Å; K151-E179 PolarHBondContact NZ-OE2 2.8Å; L165-E179 HydrophobicContact CD1-CB 4.48Å; L165-E179 HydrophobicContact CD2-CB 4.12Å; L165-E179 HydrophobicContact CD2-CG 4.39Å; A175-E179 WeakPolarHBondContact O-CB 3.46Å; A175-E179 PolarHBondContact O-N 3.48Å; A175-E179 VanDerWaalsContact O-N 3.14Å; E179-V181 VanDerWaalsContact C-N 3.31Å; E179-V181 PolarHBondContact O-N 3.47Å; E179-L182 PolarHBondContact O-N 2.9Å; E179-I183 HydrophobicContact CG-CD1 3.71Å; E179-I183 HydrophobicContact CG-CG1 4.11Å; E179-I183 WeakPolarHBondContact O-CB 3.36Å; E179-I183 WeakPolarHBondContact O-CG1 3.28Å; E179-I183 PolarHBondContact O-N 3.36Å
180L94.1Very high89.3Confident5 Ų562 Ų623%0.02634%0.336CS..Hα-helixtrans-57.3-46.6174.2177.767.2000111.2F148 S176 W177 V178 H184 F192 H195 L196 I199F148-L180 HydrophobicContact CE1-CB 4.12Å; F148-L180 HydrophobicContact CZ-CB 4.48Å; S176-L180 WeakPolarHBondContact O-CB 3.33Å; S176-L180 PolarHBondContact O-N 3.41Å; W177-L180 HydrophobicContact CE3-CD2 4.34Å; W177-L180 WeakPolarHBondContact O-CB 3.15Å; W177-L180 PolarHBondContact O-N 3.03Å; V178-L180 VanDerWaalsContact C-N 3.34Å; V178-L180 PolarHBondContact O-N 3.07Å; L180-H184 PolarHBondContact O-N 3.11Å; L180-H184 VanDerWaalsContact O-N 3.15Å; L180-F192 HydrophobicContact CD1-CD2 3.8Å; L180-F192 HydrophobicContact CD1-CE2 3.83Å; L180-F192 HydrophobicContact CD1-CG 4.46Å; L180-F192 HydrophobicContact CD1-CZ 4.49Å; L180-F192 HydrophobicContact CD2-CD2 4.49Å; L180-F192 HydrophobicContact CD2-CE2 3.72Å; L180-F192 HydrophobicContact CD2-CZ 3.77Å; L180-F192 HydrophobicContact CG-CD2 4.02Å; L180-F192 HydrophobicContact CG-CE2 3.54Å; L180-F192 HydrophobicContact CG-CZ 4.14Å; L180-H195 HydrophobicContact CD1-CB 3.42Å; L180-H195 VanDerWaalsContact CD1-CB 3.42Å; L180-L196 HydrophobicContact CD2-CD1 4.47Å; L180-I199 HydrophobicContact CB-CD1 4.12Å; L180-I199 HydrophobicContact CD2-CD1 4.01Å
181V92.8Very high89.3Confident77 Ų7762.6 Ų62.647%0.46734%0.341SS..Hα-helixtrans-65.4-45.8177.31760000111W177 V178 E179 I183 H184 F185W177-V181 WeakPolarHBondContact O-CG2 3.49Å; W177-V181 PolarHBondContact O-N 3.03Å; W177-V181 VanDerWaalsContact O-N 3.14Å; V178-V181 PolarHBondContact O-N 3.08Å; E179-V181 VanDerWaalsContact C-N 3.31Å; E179-V181 PolarHBondContact O-N 3.47Å; V181-I183 PolarHBondContact O-N 2.84Å; V181-H184 WeakPolarHBondContact O-CB 3.45Å; V181-H184 PolarHBondContact O-N 3.35Å; V181-F185 HydrophobicContact CG1-CD2 4.08Å; V181-F185 HydrophobicContact CG1-CE2 3.64Å; V181-F185 WeakPolarHBondContact O-CD2 3.21Å; V181-F185 PolarHBondContact O-N 3.05Å
182L91.2Very high89.4Confident37 Ų3765 Ų6519%0.19435%0.345CS..Hα-helixtrans-60-47.9179.3-72.2172.2000111.9L165 M166 V178 E179 H184 F185 T186L165-L182 HydrophobicContact CB-CD1 4.27Å; M166-L182 HydrophobicContact SD-CD1 4.16Å; M166-L182 HydrophobicContact SD-CD2 4.31Å; V178-L182 HydrophobicContact CG1-CD1 3.94Å; V178-L182 HydrophobicContact CG1-CG 4.3Å; V178-L182 VanDerWaalsContact O-CG 3.32Å; V178-L182 WeakPolarHBondContact O-CG 3.45Å; V178-L182 PolarHBondContact O-N 3.43Å; E179-L182 PolarHBondContact O-N 2.9Å; L182-H184 VanDerWaalsContact C-N 3.28Å; L182-H184 PolarHBondContact O-N 2.84Å; L182-F185 PolarHBondContact O-N 3.21Å; L182-F185 VanDerWaalsContact O-N 3.11Å; L182-T186 PolarHBondContact O-N 3.07Å; L182-T186 PolarHBondContact O-OG1 3.22Å
183I88.8Confident89.7Confident39 Ų3965.6 Ų65.620%0.235%0.348CS..Hα-helixtrans-64-35.2-179.3-71.6-178.6000111.4F148 E179 V181 F185 T186 A187F148-I183 HydrophobicContact CE2-CD1 4Å; F148-I183 HydrophobicContact CZ-CD1 3.88Å; E179-I183 HydrophobicContact CG-CD1 3.71Å; E179-I183 HydrophobicContact CG-CG1 4.11Å; E179-I183 WeakPolarHBondContact O-CB 3.36Å; E179-I183 WeakPolarHBondContact O-CG1 3.28Å; E179-I183 PolarHBondContact O-N 3.36Å; V181-I183 PolarHBondContact O-N 2.84Å; I183-F185 PolarHBondContact O-N 3.42Å; I183-T186 PolarHBondContact O-N 3.24Å; I183-A187 HydrophobicContact CG2-CB 4.33Å; I183-A187 CarbonylContact O-C 3.52Å; I183-A187 WeakPolarHBondContact O-CA 3.2Å; I183-A187 PolarHBondContact O-N 3.04Å
184H88.8Confident90Very high89 Ų8957.9 Ų57.941%0.41232%0.323SS..Hα-helixtrans-58.4-37.1175.2-175.964.5000112.4L180 V181 L182 P188 F192L180-H184 PolarHBondContact O-N 3.11Å; L180-H184 VanDerWaalsContact O-N 3.15Å; V181-H184 WeakPolarHBondContact O-CB 3.45Å; V181-H184 PolarHBondContact O-N 3.35Å; L182-H184 VanDerWaalsContact C-N 3.28Å; L182-H184 PolarHBondContact O-N 2.84Å; H184-P188 WeakPolarHBondContact O-CA 3.4Å; H184-F192 HydrophobicContact CB-CD2 4.2Å
185F88.3Confident90.3Very high156 Ų15652.4 Ų52.468%0.68430%0.302SS*.Hα-helixtrans-82.4-40.7177.2-67.8-65.9000113.4V181 L182 I183V181-F185 HydrophobicContact CG1-CD2 4.08Å; V181-F185 HydrophobicContact CG1-CE2 3.64Å; V181-F185 WeakPolarHBondContact O-CD2 3.21Å; V181-F185 PolarHBondContact O-N 3.05Å; L182-F185 PolarHBondContact O-N 3.21Å; L182-F185 VanDerWaalsContact O-N 3.11Å; I183-F185 PolarHBondContact O-N 3.42Å
186T85.8Confident90.5Very high90 Ų9054.3 Ų54.355%0.55231%0.312SS*.Hα-helixtrans-82.7-24.4-175.159.80000113.5M166 L182 I183M166-T186 HydrophobicContact CE-CG2 4.07Å; L182-T186 PolarHBondContact O-N 3.07Å; L182-T186 PolarHBondContact O-OG1 3.22Å; I183-T186 PolarHBondContact O-N 3.24Å
187A84.5Confident90.7Very high36 Ų3654 Ų5430%0.29831%0.31SS..  trans-140.965.7-17800000111I183 G189 T190I183-A187 HydrophobicContact CG2-CB 4.33Å; I183-A187 CarbonylContact O-C 3.52Å; I183-A187 WeakPolarHBondContact O-CA 3.2Å; I183-A187 PolarHBondContact O-N 3.04Å; A187-G189 PolarHBondContact O-N 3.28Å; A187-T190 HydrophobicContact CB-CG2 3.96Å; A187-T190 PolarHBondContact O-N 3.06Å; A187-T190 PolarHBondContact O-OG1 3.47Å
188P77.9Confident90.8Very high100 Ų10048.8 Ų48.865%0.64929%0.29SS*.THydrogen-bonded Turntrans-63.7-15.1-175.326.5-35.7000113.9H184 T190H184-P188 WeakPolarHBondContact O-CA 3.4Å; P188-T190 PolarHBondContact O-N 3.35Å
189G78.6Confident91Very high85 Ų8546.6 Ų46.688%0.87628%0.277SS*.THydrogen-bonded Turntrans-76.4-2.1173.300000114.8A187A187-G189 PolarHBondContact O-N 3.28Å
190T85.1Confident91.3Very high35 Ų3547.5 Ų47.522%0.21528%0.283CS..SBendtrans-95.8149.817864.10000111.4A187 P188 F192 H195A187-T190 HydrophobicContact CB-CG2 3.96Å; A187-T190 PolarHBondContact O-N 3.06Å; A187-T190 PolarHBondContact O-OG1 3.47Å; P188-T190 PolarHBondContact O-N 3.35Å; T190-F192 PolarHBondContact O-N 2.86Å; T190-F192 VanDerWaalsContact O-N 3.13Å; T190-H195 PolarHBondContact OG1-CE1 3.38Å
191S90.9Very high91.5Very high31 Ų3147.3 Ų47.322%0.21728%0.281CS..  trans-74.1106.6-176.2179.70000111.8V193 G194 H195S191-V193 VanDerWaalsContact C-N 3.33Å; S191-V193 PolarHBondContact O-N 2.91Å; S191-G194 PolarHBondContact O-N 3.12Å; S191-G194 PolarHBondContact OG-N 3.48Å; S191-H195 PolarHBondContact O-N 2.8Å; S191-H195 VanDerWaalsContact O-N 3.08Å; S191-H195 PolarHBondContact O-ND1 3.28Å
192F93.3Very high91.7Very high85 Ų8543.6 Ų43.637%0.37326%0.259SS..Hα-helixtrans-56.7-46.5172.4177.9-90.3000111.6L180 H184 T190 G194 H195 L196L180-F192 HydrophobicContact CD1-CD2 3.8Å; L180-F192 HydrophobicContact CD1-CE2 3.83Å; L180-F192 HydrophobicContact CD1-CG 4.46Å; L180-F192 HydrophobicContact CD1-CZ 4.49Å; L180-F192 HydrophobicContact CD2-CD2 4.49Å; L180-F192 HydrophobicContact CD2-CE2 3.72Å; L180-F192 HydrophobicContact CD2-CZ 3.77Å; L180-F192 HydrophobicContact CG-CD2 4.02Å; L180-F192 HydrophobicContact CG-CE2 3.54Å; L180-F192 HydrophobicContact CG-CZ 4.14Å; H184-F192 HydrophobicContact CB-CD2 4.2Å; T190-F192 PolarHBondContact O-N 2.86Å; T190-F192 VanDerWaalsContact O-N 3.13Å; F192-G194 VanDerWaalsContact C-N 3.3Å; F192-G194 PolarHBondContact O-N 3.42Å; F192-H195 PolarHBondContact O-N 3.07Å; F192-L196 HydrophobicContact CE1-CD2 4.39Å; F192-L196 WeakPolarHBondContact O-CB 3.16Å; F192-L196 PolarHBondContact O-N 2.94Å
193V95.1Very high92Very high17 Ų1744.9 Ų44.910%0.10327%0.266CS..Hα-helixtrans-63.3-38.2179.4-176.30000110.8Y119 L122 E123 L126 S191 L196 A197Y119-V193 HydrophobicContact CD2-CB 4.18Å; Y119-V193 HydrophobicContact CD2-CG1 3.93Å; Y119-V193 HydrophobicContact CE2-CB 4.17Å; Y119-V193 HydrophobicContact CE2-CG1 4.25Å; L122-V193 HydrophobicContact CB-CG1 3.6Å; L122-V193 HydrophobicContact CD1-CG1 3.96Å; L122-V193 HydrophobicContact CG-CG1 4.46Å; E123-V193 HydrophobicContact CG-CG1 4.12Å; L126-V193 HydrophobicContact CD1-CG2 3.91Å; S191-V193 VanDerWaalsContact C-N 3.33Å; S191-V193 PolarHBondContact O-N 2.91Å; V193-L196 PolarHBondContact O-N 2.97Å; V193-A197 WeakPolarHBondContact O-CB 3.33Å; V193-A197 PolarHBondContact O-N 2.82Å
194G95.4Very high92.5Very high13 Ų1346.4 Ų46.413%0.13427%0.274CS..Hα-helixtrans-62.4-42.5174.600000113.2S191 F192 A197 G198S191-G194 PolarHBondContact O-N 3.12Å; S191-G194 PolarHBondContact OG-N 3.48Å; F192-G194 VanDerWaalsContact C-N 3.3Å; F192-G194 PolarHBondContact O-N 3.42Å; G194-A197 PolarHBondContact O-N 3.46Å; G194-G198 PolarHBondContact O-N 3.41Å; G194-G198 VanDerWaalsContact O-N 3.11Å
195H96.4Very high92.9Very high6 Ų642.3 Ų42.33%0.02826%0.255CS..Hα-helixtrans-67.4-41.6174.7-62146.8000112.3S144 F148 L180 T190 S191 F192 A197 G198 I199S144-H195 WeakPolarHBondContact CB-NE2 3.16Å; S144-H195 PolarHBondContact OG-CD2 2.89Å; S144-H195 PolarHBondContact OG-NE2 3.28Å; F148-H195 HydrophobicContact CD2-CB 3.69Å; F148-H195 AromaticContact CD2-CD2 3.44Å; F148-H195 VanDerWaalsContact CD2-CD2 3.44Å; F148-H195 WeakPolarHBondContact CD2-CD2 3.25Å; F148-H195 AromaticContact CD2-CG 3.67Å; F148-H195 HydrophobicContact CE1-CB 4.48Å; F148-H195 HydrophobicContact CE2-CB 3.61Å; F148-H195 AromaticContact CE2-CD2 3.37Å; F148-H195 WeakPolarHBondContact CE2-CD2 3.38Å; F148-H195 AromaticContact CE2-CG 3.35Å; F148-H195 AromaticContact CE2-ND1 3.9Å; F148-H195 AromaticContact CE2-NE2 3.93Å; F148-H195 HydrophobicContact CG-CB 4.16Å; F148-H195 HydrophobicContact CZ-CB 4.01Å; L180-H195 HydrophobicContact CD1-CB 3.42Å; L180-H195 VanDerWaalsContact CD1-CB 3.42Å; T190-H195 PolarHBondContact OG1-CE1 3.38Å; S191-H195 PolarHBondContact O-N 2.8Å; S191-H195 VanDerWaalsContact O-N 3.08Å; S191-H195 PolarHBondContact O-ND1 3.28Å; F192-H195 PolarHBondContact O-N 3.07Å; H195-A197 VanDerWaalsContact C-N 3.35Å; H195-A197 PolarHBondContact O-N 3.41Å; H195-G198 WeakPolarHBondContact O-CA 3.26Å; H195-G198 PolarHBondContact O-N 2.9Å; H195-G198 VanDerWaalsContact O-N 3.11Å; H195-I199 PolarHBondContact O-N 3.2Å
196L97.2Very high93.3Very high39 Ų3936 Ų3620%0.20423%0.229CC..Hα-helixtrans-59.2-45.6174.3177.261.6000111.1L122 W177 L180 F192 V193 G198 I199 L200L122-L196 HydrophobicContact CD1-CD2 4.33Å; L122-L196 HydrophobicContact CD1-CG 4.34Å; W177-L196 HydrophobicContact CH2-CD1 4.21Å; W177-L196 HydrophobicContact CZ3-CD1 3.92Å; L180-L196 HydrophobicContact CD2-CD1 4.47Å; F192-L196 HydrophobicContact CE1-CD2 4.39Å; F192-L196 WeakPolarHBondContact O-CB 3.16Å; F192-L196 PolarHBondContact O-N 2.94Å; V193-L196 PolarHBondContact O-N 2.97Å; L196-G198 PolarHBondContact O-N 3.37Å; L196-I199 PolarHBondContact O-N 3.45Å; L196-I199 VanDerWaalsContact O-N 3.07Å; L196-L200 HydrophobicContact CD1-CG 4.42Å; L196-L200 HydrophobicContact CG-CD1 4.45Å; L196-L200 WeakPolarHBondContact O-CG 3.26Å; L196-L200 PolarHBondContact O-N 3.43Å
197A97.9Very high93.8Very high0 Ų036.3 Ų36.30%024%0.235CC..Hα-helixtrans-55.7-41.7173.700000111.5V118 L122 V193 G194 H195 L200 V201V118-A197 HydrophobicContact CB-CB 4.08Å; V118-A197 HydrophobicContact CG1-CB 3.78Å; L122-A197 HydrophobicContact CD1-CB 4.12Å; V193-A197 WeakPolarHBondContact O-CB 3.33Å; V193-A197 PolarHBondContact O-N 2.82Å; G194-A197 PolarHBondContact O-N 3.46Å; H195-A197 VanDerWaalsContact C-N 3.35Å; H195-A197 PolarHBondContact O-N 3.41Å; A197-L200 PolarHBondContact O-N 3.04Å; A197-V201 WeakPolarHBondContact O-CG2 3.26Å; A197-V201 PolarHBondContact O-N 2.79Å
198G98.1Very high94.3Very high0 Ų035.8 Ų35.80%023%0.233CC..Hα-helixtrans-54.1-51.7170.600000113.8G145 A149 G194 H195 L196 L200 V201 G202G145-G198 WeakPolarHBondContact O-CA 3.07Å; A149-G198 WeakPolarHBondContact CA-O 3.4Å; A149-G198 VanDerWaalsContact CB-O 3.22Å; A149-G198 WeakPolarHBondContact CB-O 3.28Å; A149-G198 PolarHBondContact N-O 3.34Å; G194-G198 PolarHBondContact O-N 3.41Å; G194-G198 VanDerWaalsContact O-N 3.11Å; H195-G198 WeakPolarHBondContact O-CA 3.26Å; H195-G198 PolarHBondContact O-N 2.9Å; H195-G198 VanDerWaalsContact O-N 3.11Å; L196-G198 PolarHBondContact O-N 3.37Å; G198-L200 VanDerWaalsContact C-N 3.35Å; G198-L200 PolarHBondContact O-N 3.17Å; G198-V201 PolarHBondContact O-N 2.69Å; G198-G202 PolarHBondContact O-N 3.11Å
199I98.1Very high95.1Very high1 Ų134.5 Ų34.51%0.00523%0.225CC..Hα-helixtrans-59.5-47178.3-64.4176.4000110.6F148 V152 W177 L180 H195 L196 V201 G202 L203F148-I199 HydrophobicContact CB-CG1 4.24Å; F148-I199 HydrophobicContact CD1-CD1 3.87Å; F148-I199 HydrophobicContact CD1-CG1 3.64Å; F148-I199 HydrophobicContact CE1-CD1 4.19Å; F148-I199 HydrophobicContact CE1-CG1 4.45Å; F148-I199 HydrophobicContact CG-CG1 4.33Å; V152-I199 HydrophobicContact CG2-CB 4.39Å; V152-I199 HydrophobicContact CG2-CG1 4.46Å; V152-I199 HydrophobicContact CG2-CG2 4.08Å; W177-I199 HydrophobicContact CE3-CD1 4.36Å; W177-I199 HydrophobicContact CH2-CG2 4.11Å; W177-I199 HydrophobicContact CZ2-CG2 3.86Å; L180-I199 HydrophobicContact CB-CD1 4.12Å; L180-I199 HydrophobicContact CD2-CD1 4.01Å; H195-I199 PolarHBondContact O-N 3.2Å; L196-I199 PolarHBondContact O-N 3.45Å; L196-I199 VanDerWaalsContact O-N 3.07Å; I199-V201 PolarHBondContact O-N 3.45Å; I199-G202 PolarHBondContact O-N 3.02Å; I199-L203 HydrophobicContact CG2-CD1 4.04Å; I199-L203 HydrophobicContact CG2-CG 4.44Å; I199-L203 WeakPolarHBondContact O-CG 3.36Å; I199-L203 PolarHBondContact O-N 2.81Å
200L98.4Very high96Very high57 Ų5731.5 Ų31.530%0.29819%0.188SC..Hα-helixtrans-60.8-44.3179.6-65.5-179.4000111.8V118 L122 L196 A197 G198 G202 L203 L204V118-L200 HydrophobicContact CG1-CB 4.41Å; V118-L200 HydrophobicContact CG1-CD1 4.21Å; L122-L200 HydrophobicContact CD1-CD1 4.08Å; L122-L200 HydrophobicContact CD2-CD1 4.35Å; L196-L200 HydrophobicContact CD1-CG 4.42Å; L196-L200 HydrophobicContact CG-CD1 4.45Å; L196-L200 WeakPolarHBondContact O-CG 3.26Å; L196-L200 PolarHBondContact O-N 3.43Å; A197-L200 PolarHBondContact O-N 3.04Å; G198-L200 VanDerWaalsContact C-N 3.35Å; G198-L200 PolarHBondContact O-N 3.17Å; L200-G202 VanDerWaalsContact C-N 3.34Å; L200-G202 PolarHBondContact O-N 3.3Å; L200-L203 PolarHBondContact O-N 3.31Å; L200-L204 WeakPolarHBondContact O-CB 3.24Å; L200-L204 WeakPolarHBondContact O-CD1 3.34Å; L200-L204 WeakPolarHBondContact O-CG 3.44Å; L200-L204 PolarHBondContact O-N 3.48Å
201V98.5Very high96.6Very high0 Ų031.7 Ų31.70%019%0.188CC..Hα-helixtrans-61.9-42175.4168.80000111.7F111 L114 T115 V118 A149 A197 G198 I199 L203 L204 Y205 L210F111-V201 HydrophobicContact CD1-CG1 3.77Å; F111-V201 HydrophobicContact CE1-CG1 4.07Å; F111-V201 HydrophobicContact CG-CG1 4.15Å; L114-V201 HydrophobicContact CB-CG1 4.37Å; L114-V201 HydrophobicContact CB-CG2 4.28Å; L114-V201 HydrophobicContact CD2-CG1 4.06Å; L114-V201 HydrophobicContact CD2-CG2 4.18Å; L114-V201 HydrophobicContact CG-CG1 4.37Å; L114-V201 HydrophobicContact CG-CG2 3.86Å; T115-V201 HydrophobicContact CG2-CB 3.86Å; T115-V201 HydrophobicContact CG2-CG1 4.04Å; T115-V201 HydrophobicContact CG2-CG2 3.86Å; V118-V201 HydrophobicContact CB-CG2 4.22Å; V118-V201 HydrophobicContact CG2-CG2 3.76Å; A149-V201 HydrophobicContact CB-CB 4.41Å; A149-V201 HydrophobicContact CB-CG1 4.23Å; A197-V201 WeakPolarHBondContact O-CG2 3.26Å; A197-V201 PolarHBondContact O-N 2.79Å; G198-V201 PolarHBondContact O-N 2.69Å; I199-V201 PolarHBondContact O-N 3.45Å; V201-L203 VanDerWaalsContact C-N 3.31Å; V201-L203 PolarHBondContact O-N 3.47Å; V201-L204 WeakPolarHBondContact O-CB 3.34Å; V201-L204 PolarHBondContact O-N 3.35Å; V201-Y205 PolarHBondContact O-N 2.92Å; V201-L210 HydrophobicContact CG1-CD2 4.5Å
202G98Very high96.8Very high0 Ų039.2 Ų39.20%021%0.212CC..Hα-helixtrans-60.6-39.3173.800000112.9V152 G198 I199 L200 Y205 T206V152-G202 VanDerWaalsContact CG1-C 3.48Å; G198-G202 PolarHBondContact O-N 3.11Å; I199-G202 PolarHBondContact O-N 3.02Å; L200-G202 VanDerWaalsContact C-N 3.34Å; L200-G202 PolarHBondContact O-N 3.3Å; G202-Y205 PolarHBondContact O-N 3.42Å; G202-T206 WeakPolarHBondContact O-CB 3.33Å; G202-T206 WeakPolarHBondContact O-CG2 3.36Å; G202-T206 PolarHBondContact O-N 3.46Å; G202-T206 PolarHBondContact O-OG1 3.21Å
203L97.8Very high97Very high64 Ų6439.5 Ų39.534%0.33522%0.216SC..Hα-helixtrans-69.7-41.4175.3-68.9172.5000111.8V152 W177 I199 L200 V201 Y205 T206 S207 G208V152-L203 HydrophobicContact CG1-CD2 3.94Å; V152-L203 HydrophobicContact CG1-CG 4.2Å; W177-L203 HydrophobicContact CZ2-CD1 4.31Å; I199-L203 HydrophobicContact CG2-CD1 4.04Å; I199-L203 HydrophobicContact CG2-CG 4.44Å; I199-L203 WeakPolarHBondContact O-CG 3.36Å; I199-L203 PolarHBondContact O-N 2.81Å; L200-L203 PolarHBondContact O-N 3.31Å; V201-L203 VanDerWaalsContact C-N 3.31Å; V201-L203 PolarHBondContact O-N 3.47Å; L203-Y205 PolarHBondContact O-N 3.21Å; L203-T206 PolarHBondContact O-N 3.46Å; L203-S207 WeakPolarHBondContact O-CA 3.25Å; L203-S207 PolarHBondContact O-N 2.88Å; L203-G208 PolarHBondContact O-N 3.47Å
204L98Very high97.1Very high71 Ų7138.8 Ų38.837%0.37221%0.212SC..Hα-helixtrans-57.1-37.3173.1-83.8150.2000111.6L200 V201 G208 L210L200-L204 WeakPolarHBondContact O-CB 3.24Å; L200-L204 WeakPolarHBondContact O-CD1 3.34Å; L200-L204 WeakPolarHBondContact O-CG 3.44Å; L200-L204 PolarHBondContact O-N 3.48Å; V201-L204 WeakPolarHBondContact O-CB 3.34Å; V201-L204 PolarHBondContact O-N 3.35Å; L204-G208 CarbonylContact O-C 3.11Å; L204-G208 WeakPolarHBondContact O-CA 3.45Å; L204-G208 PolarHBondContact O-N 3.45Å; L204-L210 HydrophobicContact CB-CB 4.4Å; L204-L210 HydrophobicContact CB-CD2 4.41Å; L204-L210 WeakPolarHBondContact O-CB 3.28Å; L204-L210 PolarHBondContact O-N 3.25Å
205Y98.3Very high97.1Very high3 Ų343.9 Ų43.91%0.01223%0.227CC..Hα-helixtrans-73.7-49.6175.4-173.7-88.2000113.3W103 V107 F111 L153 V201 G202 L203 L210 N211 M214W103-Y205 PolarHBondContact NE1-OH 2.83Å; V107-Y205 HydrophobicContact CG2-CE2 3.97Å; F111-Y205 AromaticContact CE1-CD2 3.63Å; F111-Y205 HydrophobicContact CE1-CD2 3.63Å; F111-Y205 HydrophobicContact CE1-CE2 4.45Å; F111-Y205 AromaticContact CE1-CG 3.75Å; F111-Y205 HydrophobicContact CE1-CG 3.75Å; F111-Y205 HydrophobicContact CZ-CD1 4.18Å; F111-Y205 AromaticContact CZ-CD2 3.91Å; F111-Y205 HydrophobicContact CZ-CD2 3.91Å; F111-Y205 AromaticContact CZ-CG 3.63Å; F111-Y205 HydrophobicContact CZ-CG 3.63Å; L153-Y205 HydrophobicContact CD1-CD1 3.68Å; L153-Y205 HydrophobicContact CD1-CE1 3.51Å; L153-Y205 HydrophobicContact CD2-CD1 4.35Å; L153-Y205 HydrophobicContact CD2-CE1 4.07Å; L153-Y205 HydrophobicContact CG-CE1 4.43Å; V201-Y205 PolarHBondContact O-N 2.92Å; G202-Y205 PolarHBondContact O-N 3.42Å; L203-Y205 PolarHBondContact O-N 3.21Å; Y205-L210 HydrophobicContact CD2-CD2 4.28Å; Y205-L210 HydrophobicContact CD2-CG 4.24Å; Y205-N211 HydrophobicContact CD1-CB 4.35Å; Y205-N211 HydrophobicContact CD2-CB 4.04Å; Y205-N211 HydrophobicContact CE1-CB 4.2Å; Y205-N211 HydrophobicContact CE2-CB 3.89Å; Y205-N211 HydrophobicContact CG-CB 4.29Å; Y205-N211 WeakPolarHBondContact O-CB 3.38Å; Y205-N211 PolarHBondContact OH-OD1 3Å; Y205-M214 HydrophobicContact CD2-SD 3.75Å; Y205-M214 HydrophobicContact CE2-CE 4Å; Y205-M214 HydrophobicContact CE2-SD 3.61Å
206T96.6Very high97.1Very high24 Ų2450.7 Ų50.715%0.14726%0.257CS..Hα-helixtrans-79.7-38.1-17151.50000113.4V152 L153 H156 G202 L203V152-T206 HydrophobicContact CG1-CG2 4.43Å; L153-T206 HydrophobicContact CB-CG2 4.36Å; L153-T206 HydrophobicContact CD1-CG2 3.8Å; H156-T206 HydrophobicContact CB-CG2 3.62Å; G202-T206 WeakPolarHBondContact O-CB 3.33Å; G202-T206 WeakPolarHBondContact O-CG2 3.36Å; G202-T206 PolarHBondContact O-N 3.46Å; G202-T206 PolarHBondContact O-OG1 3.21Å; L203-T206 PolarHBondContact O-N 3.46Å
207S95.3Very high96.9Very high96 Ų9650.9 Ų50.967%0.67126%0.261SS*.THydrogen-bonded Turntrans-116.8-21.9-174.6-51.20000112.5L203L203-S207 WeakPolarHBondContact O-CA 3.25Å; L203-S207 PolarHBondContact O-N 2.88Å
208G95.2Very high96.7Very high25 Ų2552.1 Ų52.126%0.25827%0.271SS..SBendtrans-93.8-167.5-179.800000114.7L203 L204 L210L203-G208 PolarHBondContact O-N 3.47Å; L204-G208 CarbonylContact O-C 3.11Å; L204-G208 WeakPolarHBondContact O-CA 3.45Å; L204-G208 PolarHBondContact O-N 3.45Å; G208-L210 VanDerWaalsContact C-N 3.34Å; G208-L210 PolarHBondContact O-N 2.97Å
209P95.9Very high96.4Very high72 Ų7257 Ų5747%0.46830%0.297SS..SBendtrans-80.1-11.8-174.832.5-35.9000114N211 R212 I213P209-N211 PolarHBondContact O-N 2.97Å; P209-R212 WeakPolarHBondContact O-CB 3.38Å; P209-R212 PolarHBondContact O-N 2.82Å; P209-I213 HydrophobicContact CB-CD1 4.15Å; P209-I213 HydrophobicContact CG-CD1 4.42Å; P209-I213 WeakPolarHBondContact O-CG1 3.26Å; P209-I213 PolarHBondContact O-N 3.21Å
210L96.8Very high96Very high22 Ų2262.5 Ų62.512%0.11533%0.326CS..Hα-helixtrans-61.3-43.7-166.3175.464.6000112.7V110 F111 L114 V201 L204 Y205 G208 R212 I213 M214V110-L210 HydrophobicContact CG1-CD1 4.13Å; F111-L210 HydrophobicContact CE1-CD2 4.27Å; L114-L210 HydrophobicContact CD2-CD1 4.01Å; L114-L210 HydrophobicContact CD2-CD2 3.45Å; L114-L210 VanDerWaalsContact CD2-CD2 3.45Å; L114-L210 HydrophobicContact CD2-CG 4.37Å; V201-L210 HydrophobicContact CG1-CD2 4.5Å; L204-L210 HydrophobicContact CB-CB 4.4Å; L204-L210 HydrophobicContact CB-CD2 4.41Å; L204-L210 WeakPolarHBondContact O-CB 3.28Å; L204-L210 PolarHBondContact O-N 3.25Å; Y205-L210 HydrophobicContact CD2-CD2 4.28Å; Y205-L210 HydrophobicContact CD2-CG 4.24Å; G208-L210 VanDerWaalsContact C-N 3.34Å; G208-L210 PolarHBondContact O-N 2.97Å; L210-R212 VanDerWaalsContact C-N 3.28Å; L210-R212 PolarHBondContact O-N 3.16Å; L210-I213 PolarHBondContact O-N 3.48Å; L210-M214 HydrophobicContact CD1-CG 4.11Å; L210-M214 HydrophobicContact CD1-SD 4.11Å; L210-M214 HydrophobicContact CG-CG 4.42Å; L210-M214 HydrophobicContact CG-SD 3.94Å; L210-M214 WeakPolarHBondContact O-CB 3.23Å; L210-M214 VanDerWaalsContact O-CG 3.3Å; L210-M214 WeakPolarHBondContact O-CG 3.45Å; L210-M214 PolarHBondContact O-N 3.23Å
211N96.6Very high95.4Very high40 Ų4066.8 Ų66.821%0.21434%0.342CS..Hα-helixtrans-61.3-36.8176176.331.3000112Y205 P209 R215Y205-N211 HydrophobicContact CD1-CB 4.35Å; Y205-N211 HydrophobicContact CD2-CB 4.04Å; Y205-N211 HydrophobicContact CE1-CB 4.2Å; Y205-N211 HydrophobicContact CE2-CB 3.89Å; Y205-N211 HydrophobicContact CG-CB 4.29Å; Y205-N211 WeakPolarHBondContact O-CB 3.38Å; Y205-N211 PolarHBondContact OH-OD1 3Å; P209-N211 PolarHBondContact O-N 2.97Å; N211-R215 VanDerWaalsContact O-CG 3.28Å; N211-R215 WeakPolarHBondContact O-CG 3.39Å; N211-R215 PolarHBondContact O-N 3.25Å; N211-R215 PolarHBondContact OD1-NE 2.72Å
212R96.6Very high94.6Very high188 Ų18870 Ų7071%0.70936%0.362SS*.Hα-helixtrans-68.3-41.9176.4-59.4-177.5-167.2162.94.3111.6P209 L210 R215 K216P209-R212 WeakPolarHBondContact O-CB 3.38Å; P209-R212 PolarHBondContact O-N 2.82Å; L210-R212 VanDerWaalsContact C-N 3.28Å; L210-R212 PolarHBondContact O-N 3.16Å; R212-R215 PolarHBondContact O-N 3.25Å; R212-K216 WeakPolarHBondContact O-CG 3.24Å; R212-K216 PolarHBondContact O-N 2.88Å; R212-K216 VanDerWaalsContact O-N 3.14Å
213I96.9Very high93.3Very high91 Ų9173.3 Ų73.347%0.46739%0.385SS..Hα-helixtrans-62.3-49.5177-66167.2000109.7P209 L210 R215 K216 C217P209-I213 HydrophobicContact CB-CD1 4.15Å; P209-I213 HydrophobicContact CG-CD1 4.42Å; P209-I213 WeakPolarHBondContact O-CG1 3.26Å; P209-I213 PolarHBondContact O-N 3.21Å; L210-I213 PolarHBondContact O-N 3.48Å; I213-R215 VanDerWaalsContact C-N 3.32Å; I213-R215 PolarHBondContact O-N 3.29Å; I213-K216 PolarHBondContact O-N 3.29Å; I213-C217 PolarHBondContact O-N 2.78Å; I213-C217 PolarHBondContact O-SG 3.28Å; I213-C217 VanDerWaalsContact O-SG 3.35Å
214M97.1Very high91.8Very high3 Ų376.7 Ų76.72%0.01540%0.404CS..Hα-helixtrans-58-42.3178.9-75175.964.300112.5W103 Y106 V107 V110 Y205 L210 C217 A218W103-M214 HydrophobicContact CH2-CB 3.91Å; W103-M214 HydrophobicContact CH2-CE 4.5Å; W103-M214 HydrophobicContact CZ2-CB 4.38Å; W103-M214 HydrophobicContact CZ2-CE 4.32Å; Y106-M214 HydrophobicContact CD1-CE 3.67Å; Y106-M214 HydrophobicContact CE1-CB 3.72Å; Y106-M214 HydrophobicContact CE1-CE 3.69Å; Y106-M214 HydrophobicContact CE1-CG 4.1Å; Y106-M214 HydrophobicContact CG-CE 4.12Å; V107-M214 HydrophobicContact CG2-CE 3.95Å; V110-M214 HydrophobicContact CB-CE 4.06Å; V110-M214 HydrophobicContact CB-SD 4.13Å; V110-M214 HydrophobicContact CG1-CE 4.43Å; V110-M214 HydrophobicContact CG1-CG 4.46Å; V110-M214 HydrophobicContact CG1-SD 3.82Å; V110-M214 HydrophobicContact CG2-CE 3.89Å; V110-M214 HydrophobicContact CG2-CG 4.42Å; V110-M214 HydrophobicContact CG2-SD 4.21Å; Y205-M214 HydrophobicContact CD2-SD 3.75Å; Y205-M214 HydrophobicContact CE2-CE 4Å; Y205-M214 HydrophobicContact CE2-SD 3.61Å; L210-M214 HydrophobicContact CD1-CG 4.11Å; L210-M214 HydrophobicContact CD1-SD 4.11Å; L210-M214 HydrophobicContact CG-CG 4.42Å; L210-M214 HydrophobicContact CG-SD 3.94Å; L210-M214 WeakPolarHBondContact O-CB 3.23Å; L210-M214 VanDerWaalsContact O-CG 3.3Å; L210-M214 WeakPolarHBondContact O-CG 3.45Å; L210-M214 PolarHBondContact O-N 3.23Å; M214-C217 PolarHBondContact O-N 2.96Å; M214-A218 PolarHBondContact O-N 3.36Å
215R96.1Very high89.9Confident119 Ų11980.8 Ų80.845%0.44942%0.421SS..Hα-helixtrans-62-48.3176.7-74.8172.6-175.3-88.4-4.2111.7W103 N211 R212 I213 C217 A218 D219W103-R215 HydrophobicContact CH2-CB 4.47Å; W103-R215 HydrophobicContact CH2-CG 3.62Å; W103-R215 HydrophobicContact CZ2-CG 4.12Å; W103-R215 HydrophobicContact CZ3-CG 4.4Å; N211-R215 VanDerWaalsContact O-CG 3.28Å; N211-R215 WeakPolarHBondContact O-CG 3.39Å; N211-R215 PolarHBondContact O-N 3.25Å; N211-R215 PolarHBondContact OD1-NE 2.72Å; R212-R215 PolarHBondContact O-N 3.25Å; I213-R215 VanDerWaalsContact C-N 3.32Å; I213-R215 PolarHBondContact O-N 3.29Å; R215-C217 VanDerWaalsContact C-N 3.3Å; R215-C217 PolarHBondContact O-N 2.7Å; R215-A218 PolarHBondContact O-N 2.64Å; R215-A218 VanDerWaalsContact O-N 3.13Å; R215-D219 PolarHBondContact O-N 3.41Å
216K95.4Very high87.8Confident150 Ų15088.1 Ų88.165%0.65246%0.455SS*.Hα-helixtrans-58.5-41.8175.4-72.5-173.7175.5-170.50112.4R212 I213 D219 L220R212-K216 WeakPolarHBondContact O-CG 3.24Å; R212-K216 PolarHBondContact O-N 2.88Å; R212-K216 VanDerWaalsContact O-N 3.14Å; I213-K216 PolarHBondContact O-N 3.29Å; K216-D219 PolarHBondContact O-N 2.9Å; K216-L220 VanDerWaalsContact O-CG 3.26Å; K216-L220 WeakPolarHBondContact O-CG 3.36Å; K216-L220 PolarHBondContact O-N 3.46Å
217C94.3Very high85.6Confident43 Ų4389.9 Ų89.929%0.29148%0.478SS..Hα-helixtrans-61.3-46.8175.3-68.90000111.3I213 M214 R215 D219 L220 F221I213-C217 PolarHBondContact O-N 2.78Å; I213-C217 PolarHBondContact O-SG 3.28Å; I213-C217 VanDerWaalsContact O-SG 3.35Å; M214-C217 PolarHBondContact O-N 2.96Å; R215-C217 VanDerWaalsContact C-N 3.3Å; R215-C217 PolarHBondContact O-N 2.7Å; C217-D219 PolarHBondContact O-N 2.89Å; C217-L220 WeakPolarHBondContact O-CB 3.39Å; C217-L220 PolarHBondContact O-N 3.44Å; C217-F221 WeakPolarHBondContact O-CD2 3.39Å; C217-F221 PolarHBondContact O-N 2.94Å; C217-F221 VanDerWaalsContact O-N 3.12Å
218A93Very high83.2Confident26 Ų2690.1 Ų90.122%0.21548%0.48CS..Hα-helixtrans-61-42.2177.600000112.5W103 Y106 M214 R215 L220 F221 T222W103-A218 HydrophobicContact CZ3-CB 4.03Å; Y106-A218 HydrophobicContact CE1-CB 4.46Å; M214-A218 PolarHBondContact O-N 3.36Å; R215-A218 PolarHBondContact O-N 2.64Å; R215-A218 VanDerWaalsContact O-N 3.13Å; A218-L220 VanDerWaalsContact C-N 3.32Å; A218-L220 PolarHBondContact O-N 3.42Å; A218-F221 PolarHBondContact O-N 2.94Å; A218-T222 WeakPolarHBondContact O-CG2 3.21Å; A218-T222 PolarHBondContact O-N 3.49Å; A218-T222 PolarHBondContact O-OG1 3.33Å
219D91.3Very high80.7Confident102 Ų10296.5 Ų96.555%0.54550%0.502SS..Hα-helixtrans-64.4-36176.9-62.1-25.4000112.1R215 K216 C217 T222 S223R215-D219 PolarHBondContact O-N 3.41Å; K216-D219 PolarHBondContact O-N 2.9Å; C217-D219 PolarHBondContact O-N 2.89Å; D219-T222 WeakPolarHBondContact CA-OG1 3.41Å; D219-T222 PolarHBondContact O-OG1 3.4Å; D219-T222 VanDerWaalsContact O-OG1 3.13Å; D219-S223 VanDerWaalsContact O-CB 3.25Å; D219-S223 WeakPolarHBondContact O-CB 3.47Å; D219-S223 PolarHBondContact O-N 3.04Å; D219-S223 PolarHBondContact O-OG 2.82Å
220L89.7Confident77.9Confident116 Ų116101.1 Ų101.161%0.60752%0.517SS*.Hα-helixtrans-65.8-40.7175-74.2168.5000112.2K216 C217 A218 S223 N224K216-L220 VanDerWaalsContact O-CG 3.26Å; K216-L220 WeakPolarHBondContact O-CG 3.36Å; K216-L220 PolarHBondContact O-N 3.46Å; C217-L220 WeakPolarHBondContact O-CB 3.39Å; C217-L220 PolarHBondContact O-N 3.44Å; A218-L220 VanDerWaalsContact C-N 3.32Å; A218-L220 PolarHBondContact O-N 3.42Å; L220-S223 WeakPolarHBondContact CA-OG 3.26Å; L220-S223 PolarHBondContact O-OG 3.38Å; L220-N224 WeakPolarHBondContact O-CB 3.45Å; L220-N224 PolarHBondContact O-N 2.85Å
221F85.3Confident75.1Confident147 Ų147105.2 Ų105.265%0.64554%0.539SS*.Hα-helixtrans-69.2-41.3177.3-73.8-69.1000112.2C217 A218 N224 E225C217-F221 WeakPolarHBondContact O-CD2 3.39Å; C217-F221 PolarHBondContact O-N 2.94Å; C217-F221 VanDerWaalsContact O-N 3.12Å; A218-F221 PolarHBondContact O-N 2.94Å; F221-N224 PolarHBondContact O-N 2.86Å; F221-E225 PolarHBondContact O-N 3.29Å
222T82.7Confident72.1Confident68 Ų68112.9 Ų112.942%0.41757%0.567SS.*Hα-helixtrans-71.3-35.2179.755.50000113A218 D219 N224 E225 H226A218-T222 WeakPolarHBondContact O-CG2 3.21Å; A218-T222 PolarHBondContact O-N 3.49Å; A218-T222 PolarHBondContact O-OG1 3.33Å; D219-T222 WeakPolarHBondContact CA-OG1 3.41Å; D219-T222 PolarHBondContact O-OG1 3.4Å; D219-T222 VanDerWaalsContact O-OG1 3.13Å; T222-N224 VanDerWaalsContact C-N 3.34Å; T222-E225 PolarHBondContact O-N 2.99Å; T222-H226 PolarHBondContact O-N 3.27Å; T222-H226 VanDerWaalsContact O-N 3.16Å; T222-H226 PolarHBondContact O-ND1 2.87Å
223S71.5Confident69.2Low70 Ų70113.5 Ų113.549%0.4957%0.57SS.*Hα-helixtrans-67.4-33.317455.10000112.5D219 L220 H226 G227D219-S223 VanDerWaalsContact O-CB 3.25Å; D219-S223 WeakPolarHBondContact O-CB 3.47Å; D219-S223 PolarHBondContact O-N 3.04Å; D219-S223 PolarHBondContact O-OG 2.82Å; L220-S223 WeakPolarHBondContact CA-OG 3.26Å; L220-S223 PolarHBondContact O-OG 3.38Å; S223-H226 PolarHBondContact O-N 3.39Å; S223-G227 PolarHBondContact O-N 3.1Å
224N65.6Low66.2Low134 Ų134120.3 Ų120.372%0.71759%0.59SS**Hα-helixtrans-69.9-32.4174.2-12315.2000112.9L220 F221 T222L220-N224 WeakPolarHBondContact O-CB 3.45Å; L220-N224 PolarHBondContact O-N 2.85Å; F221-N224 PolarHBondContact O-N 2.86Å; T222-N224 VanDerWaalsContact C-N 3.34Å
225E58.9Low63.4Low158 Ų158125.7 Ų125.774%0.73863%0.628SS**Hα-helixtrans-73.1-34174.7-75.2-173.5144.800112.8F221 T222 G227F221-E225 PolarHBondContact O-N 3.29Å; T222-E225 PolarHBondContact O-N 2.99Å; E225-G227 VanDerWaalsContact C-N 3.31Å
226H53.2Low60.7Low157 Ų157124.9 Ų124.973%0.72765%0.647SS**G310 helixtrans-84.3-2.5176.9-68.877.4000113.8T222 S223 S228T222-H226 PolarHBondContact O-N 3.27Å; T222-H226 VanDerWaalsContact O-N 3.16Å; T222-H226 PolarHBondContact O-ND1 2.87Å; S223-H226 PolarHBondContact O-N 3.39Å; H226-S228 PolarHBondContact O-N 2.98Å
227G49.9Very low57.7Low61 Ų61121.1 Ų121.163%0.62965%0.65SS**G310 helixtrans-72.7-5.6175.500000115.5S223 E225S223-G227 PolarHBondContact O-N 3.1Å; E225-G227 VanDerWaalsContact C-N 3.31Å
228S45.6Very low54.9Low101 Ų101125.8 Ų125.871%0.70668%0.678SS**G310 helixtrans-108.913.3-174-710000116H226H226-S228 PolarHBondContact O-N 2.98Å
229H42.2Very low52.1Low158 Ų158130.2 Ų130.273%0.73171%0.707SS**  trans-133.964.4169.3-90.3-80.4000112N231H229-N231 PolarHBondContact O-N 3.15Å; H229-N231 VanDerWaalsContact O-N 3.13Å
230H37.7Very low49.3Very low170 Ų170128.6 Ų128.679%0.78772%0.715SS**  trans-78.781.8155.5-114.331000108.8Y232H230-Y232 VanDerWaalsContact C-N 3.3Å; H230-Y232 PolarHBondContact O-N 3.29Å
231N37.9Very low46.5Very low107 Ų107134.5 Ų134.557%0.57273%0.731SS**  trans-64.597.6161.5-85.6-9.3000107.6H229 Y233H229-N231 PolarHBondContact O-N 3.15Å; H229-N231 VanDerWaalsContact O-N 3.13Å; N231-Y233 HydrophobicContact CB-CD2 4.11Å; N231-Y233 HydrophobicContact CB-CE2 3.98Å; N231-Y233 PolarHBondContact O-N 3.34Å
232Y34Very low44Very low202 Ų202132.3 Ų132.379%0.79274%0.74SS**  trans-60.588.3158.8-91.6-91.1000108.2H230 R234H230-Y232 VanDerWaalsContact C-N 3.3Å; H230-Y232 PolarHBondContact O-N 3.29Å; Y232-R234 PolarHBondContact O-N 3.01Å
233Y34.9Very low41.5Very low200 Ų200132.7 Ų132.778%0.78476%0.757SS**  trans-70.387.1156.2-77.9-78.4000107.5N231 S235N231-Y233 HydrophobicContact CB-CD2 4.11Å; N231-Y233 HydrophobicContact CB-CE2 3.98Å; N231-Y233 PolarHBondContact O-N 3.34Å; Y233-S235 VanDerWaalsContact C-N 3.27Å; Y233-S235 PolarHBondContact O-N 2.79Å
234R35.1Very low39.5Very low235 Ų235141 Ų14189%0.88778%0.777SS**  trans-65.693.2156.2-86.4-173178.9-173.90.6107.2Y232Y232-R234 PolarHBondContact O-N 3.01Å
235S37.6Very low38Very low115 Ų115140.5 Ų140.580%0.80479%0.785SS**  trans-89.199.1155.9-168.80000107.7Y233Y233-S235 VanDerWaalsContact C-N 3.27Å; Y233-S235 PolarHBondContact O-N 2.79Å
236A39.2Very low36.6Very low103 Ų103136.3 Ų136.385%0.85178%0.784SS**  trans-87.3113.5158.900000106.7
237G32.8Very low35.9Very low70 Ų70135.5 Ų135.572%0.72279%0.789SS**  trans-169.2104.8178.500000110.7
238T35.3Very low34.9Very low142 Ų142143.2 Ų143.287%0.87180%0.801SS**  trans-65.6147.1-171.1-53.90000115.2
239S33.4Very low34.3Very low119 Ų119148.9 Ų148.983%0.83281%0.809SS**  trans130.8117.915163.90000109.2
240G32.3Very low33.6Very low68 Ų68145 Ų14570%0.70181%0.811SS**  cis114.485.43100000107.1
241Y30.9Very low33.2Very low240 Ų240147.7 Ų147.794%0.94182%0.816SS**  trans-170.9121.4146.5-115.7-81.6000109.9
242A34.1Very low32.7Very low101 Ų101151.9 Ų151.984%0.83583%0.829SS**  trans-80.5141.7172.500000110.1
243G30Very low32.6Very low75 Ų75151.1 Ų151.177%0.77383%0.833SS**  trans-175.879.9178.900000115.2
244R29.6Very low32.5Very low244 Ų244148.3 Ų148.392%0.92183%0.831SS**  trans12.4126.8142.8-156.3176.7-168.9-168.63.3120
245S33.3Very low32.4Very low125 Ų125142.3 Ų142.387%0.87482%0.823SS**  trans61.8133.1143.4-161.50000120.3
246G29Very low32.3Very low70 Ų70142.5 Ų142.572%0.72282%0.821SS**  trans150108.9156.900000114.8
247V39Very low32.2Very low139 Ų139143.6 Ų143.684%0.84281%0.813SS**  trans-55.8127.9161.1172.60000109
248Y28.4Very low32.2Very low223 Ų223151 Ų15188%0.87582%0.821SS**  trans-151130.8163.8-124.3-90.9000113G250Y248-G250 PolarHBondContact O-N 3.15Å
249Y34.2Very low32.5Very low221 Ų221151.8 Ų151.887%0.86781%0.814SS**  trans-60.7123.8168.9-88.7-101.2000110.1
250G27.6Very low32.9Very low75 Ų75151.9 Ų151.977%0.77381%0.81SS**  trans-90.9103.1177.100000112Y248 F252Y248-G250 PolarHBondContact O-N 3.15Å; G250-F252 PolarHBondContact O-N 3.29Å
251Y28.1Very low33.8Very low227 Ų227152.6 Ų152.689%0.8981%0.809SS**  trans-56.4123.7158.8-104-102.1000109.5
252F28.9Very low34.9Very low195 Ų195145.3 Ų145.386%0.85579%0.793SS**  trans-79.2125.6161.2-107.3-96000108.4G250G250-F252 PolarHBondContact O-N 3.29Å
253Q30.4Very low35.5Very low187 Ų187149.4 Ų149.487%0.87479%0.793SS**  trans-97.2102.1179.1-162.3157.313.100107.4
254D33.7Very low37.1Very low140 Ų140148.4 Ų148.475%0.74977%0.772SS**PPolyproline II helixtrans-70.7142.9174.5-82.9-39.6000110.8
255P32.4Very low38Very low110 Ų110139 Ų13971%0.71475%0.751SS**PPolyproline II helixtrans-66150.417527.7-33000111.3
256P36.2Very low39.4Very low118 Ų118137 Ų13777%0.76675%0.749SS**SBendtrans-77149.2-174.332.5-32.1000111
257D37.3Very low41.5Very low126 Ų126137.4 Ų137.467%0.67474%0.735SS**SBendtrans85.761.2168-60.4-23.8000118.5
258Y32.8Very low43.2Very low225 Ų225134.8 Ų134.888%0.88272%0.719SS**  trans-154.8108.5135.8-83.4-74.7000108.8T260Y258-T260 VanDerWaalsContact C-N 3.28Å; Y258-T260 PolarHBondContact O-N 3.4Å
259H41.1Very low45Very low159 Ų159132.3 Ų132.374%0.73672%0.716SS**  trans-77.479.7171.9-73.1-75.4000109.6R286H259-R286 PolarHBondContact NE2-NH1 3.19Å
260T42.8Very low46.5Very low121 Ų121129.4 Ų129.474%0.74271%0.71SS**PPolyproline II helixtrans-84.4122.9164.418.30000108.8Y258 S262Y258-T260 VanDerWaalsContact C-N 3.28Å; Y258-T260 PolarHBondContact O-N 3.4Å; T260-S262 PolarHBondContact O-N 2.93Å
261A49.2Very low48.7Very low83 Ų83130.4 Ų130.469%0.68669%0.694SS**PPolyproline II helixtrans-51.2126.7170.600000109.3F263A261-F263 PolarHBondContact O-N 3.25Å
262S54.8Low50.9Low87 Ų87122.9 Ų122.961%0.60867%0.667SS**PPolyproline II helixtrans-52.3127178.9-31.80000109.3T260 T264T260-S262 PolarHBondContact O-N 2.93Å; S262-T264 WeakPolarHBondContact O-CG2 3.31Å; S262-T264 PolarHBondContact O-N 2.85Å; S262-T264 VanDerWaalsContact O-N 3.08Å
263F47.4Very low52.9Low187 Ų187119 Ų11982%0.8266%0.655SS**  trans-58.4113.8178.6179.6-99.5000110.1A261 G265A261-F263 PolarHBondContact O-N 3.25Å; F263-G265 VanDerWaalsContact CE1-O 3.31Å; F263-G265 WeakPolarHBondContact CE1-O 3.24Å
264T63.4Low54.8Low55 Ų55115.6 Ų115.634%0.33764%0.639SS.*  trans-90.92.5-176.352.30000113.7S262 G266 L267 Q272 A275S262-T264 WeakPolarHBondContact O-CG2 3.31Å; S262-T264 PolarHBondContact O-N 2.85Å; S262-T264 VanDerWaalsContact O-N 3.08Å; T264-G266 PolarHBondContact O-N 3.38Å; T264-G266 VanDerWaalsContact O-N 3.14Å; T264-L267 PolarHBondContact O-N 3.38Å; T264-Q272 PolarHBondContact O-NE2 2.7Å; T264-A275 HydrophobicContact CG2-CB 4.42Å
265G48.1Very low56.6Low47 Ų47110 Ų11049%0.48561%0.612SS.*THydrogen-bonded Turntrans-68.4107.8-178.900000112.1F263F263-G265 VanDerWaalsContact CE1-O 3.31Å; F263-G265 WeakPolarHBondContact CE1-O 3.24Å
266G63.5Low58.4Low81 Ų81107.5 Ų107.584%0.83560%0.601SS**THydrogen-bonded Turntrans122.1-8.5-179.200000114.6T264T264-G266 PolarHBondContact O-N 3.38Å; T264-G266 VanDerWaalsContact O-N 3.14Å
267L72.9Confident60Low79 Ų79106.2 Ų106.241%0.41459%0.586SS.*SBendtrans-83.2154.2173-64.8175.5000111.5T264 Q271 Q272T264-L267 PolarHBondContact O-N 3.38Å; L267-Q271 HydrophobicContact CB-CB 4.02Å; L267-Q271 HydrophobicContact CD1-CB 4.41Å; L267-Q271 HydrophobicContact CD2-CB 4.39Å; L267-Q272 HydrophobicContact CB-CG 3.69Å
268T74.2Confident61.5Low84 Ų84107.1 Ų107.152%0.51558%0.58SS.*  trans-67.5155.816957.50000110.5E270 Q271 Q272T268-E270 PolarHBondContact O-N 2.68Å; T268-Q271 PolarHBondContact O-N 2.82Å; T268-Q271 VanDerWaalsContact OG1-CD 3.31Å; T268-Q271 WeakPolarHBondContact OG1-CG 3.36Å; T268-Q271 PolarHBondContact OG1-OE1 3.3Å; T268-Q272 PolarHBondContact O-N 3.49Å
269E66.2Low63.2Low172 Ų17299.7 Ų99.780%0.80456%0.556SS**Hα-helixtrans-53.6-39.5-175.7-78.6-173.4146.900113.1Q271 Q272 L273E269-Q271 PolarHBondContact O-N 2.99Å; E269-Q272 PolarHBondContact O-N 2.79Å; E269-L273 PolarHBondContact O-N 2.99Å
270E65.6Low64.2Low160 Ų16095.3 Ų95.375%0.74854%0.543SS*.Hα-helixtrans-64.1-41179.2-66.5-179.1163.100112.2T268 L273 E274T268-E270 PolarHBondContact O-N 2.68Å; E270-L273 PolarHBondContact O-N 3.1Å; E270-E274 PolarHBondContact O-N 3.26Å
271Q73Confident65Low96 Ų9695 Ų9545%0.44954%0.537SS..Hα-helixtrans-72.4-32.5179.4-70.3173.4-32.400112.2L267 T268 E269 A275L267-Q271 HydrophobicContact CB-CB 4.02Å; L267-Q271 HydrophobicContact CD1-CB 4.41Å; L267-Q271 HydrophobicContact CD2-CB 4.39Å; T268-Q271 PolarHBondContact O-N 2.82Å; T268-Q271 VanDerWaalsContact OG1-CD 3.31Å; T268-Q271 WeakPolarHBondContact OG1-CG 3.36Å; T268-Q271 PolarHBondContact OG1-OE1 3.3Å; E269-Q271 PolarHBondContact O-N 2.99Å; Q271-A275 WeakPolarHBondContact O-CB 3.27Å; Q271-A275 PolarHBondContact O-N 3.45Å; Q271-A275 VanDerWaalsContact O-N 3.11Å
272Q74.4Confident65.3Low68 Ų6897.8 Ų97.832%0.31854%0.535SS..Hα-helixtrans-66.5-41172.4-66-172.4-2000111.2T264 L267 T268 E269 A275 A276T264-Q272 PolarHBondContact O-NE2 2.7Å; L267-Q272 HydrophobicContact CB-CG 3.69Å; T268-Q272 PolarHBondContact O-N 3.49Å; E269-Q272 PolarHBondContact O-N 2.79Å; Q272-A275 PolarHBondContact O-N 3.05Å; Q272-A276 WeakPolarHBondContact O-CB 3.4Å; Q272-A276 PolarHBondContact O-N 2.81Å
273L70.6Confident65.3Low115 Ų115100.4 Ų100.460%0.60254%0.542SS*.Hα-helixtrans-64.6-43.7178.2-172.566.1000111.5E269 E270 A276 I277E269-L273 PolarHBondContact O-N 2.99Å; E270-L273 PolarHBondContact O-N 3.1Å; L273-A276 PolarHBondContact O-N 3.36Å; L273-I277 HydrophobicContact CG-CD1 4.28Å; L273-I277 WeakPolarHBondContact O-CG1 3.31Å; L273-I277 PolarHBondContact O-N 3.2Å
274E71.8Confident65.5Low114 Ų114102.4 Ų102.453%0.53354%0.544SS..Hα-helixtrans-66.5-39.4179.1-158.3-172.3158.600112.4E270 A276 I277 R278E270-E274 PolarHBondContact O-N 3.26Å; E274-A276 VanDerWaalsContact C-N 3.35Å; E274-I277 PolarHBondContact O-N 3.43Å; E274-R278 WeakPolarHBondContact O-CB 3.24Å; E274-R278 PolarHBondContact O-N 3.48Å; E274-R278 IonicContact OE1-NH2 3.33Å; E274-R278 PolarHBondContact OE1-NH2 3.03Å
275A70.5Confident64.8Low23 Ų23102.9 Ų102.919%0.1956%0.561CS.*Hα-helixtrans-63.3-40.2174.200000112T264 Q271 Q272 R278 N279T264-A275 HydrophobicContact CG2-CB 4.42Å; Q271-A275 WeakPolarHBondContact O-CB 3.27Å; Q271-A275 PolarHBondContact O-N 3.45Å; Q271-A275 VanDerWaalsContact O-N 3.11Å; Q272-A275 PolarHBondContact O-N 3.05Å; A275-R278 PolarHBondContact O-N 2.91Å; A275-N279 VanDerWaalsContact O-CG 3.31Å; A275-N279 PolarHBondContact O-N 3.3Å; A275-N279 PolarHBondContact O-ND2 2.92Å
276A69.6Low64.6Low57 Ų57107.7 Ų107.747%0.47156%0.564SS.*Hα-helixtrans-64.4-42.5175.800000112.1Q272 L273 E274 N279 S280Q272-A276 WeakPolarHBondContact O-CB 3.4Å; Q272-A276 PolarHBondContact O-N 2.81Å; L273-A276 PolarHBondContact O-N 3.36Å; E274-A276 VanDerWaalsContact C-N 3.35Å; A276-N279 PolarHBondContact O-N 2.87Å; A276-S280 PolarHBondContact O-N 3.33Å
277I71Confident63.7Low91 Ų91107.8 Ų107.847%0.46757%0.565SS.*Hα-helixtrans-61.4-46.1176.4-68.6166.7000110.4L273 E274 N279 S280 L281L273-I277 HydrophobicContact CG-CD1 4.28Å; L273-I277 WeakPolarHBondContact O-CG1 3.31Å; L273-I277 PolarHBondContact O-N 3.2Å; E274-I277 PolarHBondContact O-N 3.43Å; I277-N279 PolarHBondContact O-N 3.37Å; I277-S280 PolarHBondContact O-N 2.97Å; I277-S280 PolarHBondContact O-OG 3.32Å; I277-L281 HydrophobicContact CG2-CD1 4.15Å; I277-L281 WeakPolarHBondContact O-CG 3.5Å; I277-L281 PolarHBondContact O-N 3.34Å; I277-L281 VanDerWaalsContact O-N 3.11Å
278R69Low62Low145 Ų145111.5 Ų111.555%0.54758%0.58SS.*Hα-helixtrans-61.7-43.4179.8-167.5179.1-61.3151.54.8112.5E274 A275 S280 L281 H282E274-R278 WeakPolarHBondContact O-CB 3.24Å; E274-R278 PolarHBondContact O-N 3.48Å; E274-R278 IonicContact OE1-NH2 3.33Å; E274-R278 PolarHBondContact OE1-NH2 3.03Å; A275-R278 PolarHBondContact O-N 2.91Å; R278-S280 VanDerWaalsContact C-N 3.33Å; R278-S280 PolarHBondContact O-N 3.5Å; R278-L281 PolarHBondContact O-N 3.27Å; R278-H282 PolarHBondContact O-N 2.96Å
279N69.1Low60.3Low69 Ų69112.4 Ų112.437%0.36959%0.59SS.*Hα-helixtrans-64.4-38.3176.6-71.2-14.5000111.6A275 A276 I277 L281 H282 D283A275-N279 VanDerWaalsContact O-CG 3.31Å; A275-N279 PolarHBondContact O-N 3.3Å; A275-N279 PolarHBondContact O-ND2 2.92Å; A276-N279 PolarHBondContact O-N 2.87Å; I277-N279 PolarHBondContact O-N 3.37Å; N279-L281 VanDerWaalsContact C-N 3.31Å; N279-L281 PolarHBondContact O-N 3.33Å; N279-H282 PolarHBondContact O-N 2.96Å; N279-D283 PolarHBondContact O-N 3.21Å; N279-D283 VanDerWaalsContact O-N 3.15Å
280S60.5Low58.8Low67 Ų67109.2 Ų109.247%0.46959%0.586SS.*Hα-helixtrans-65.5-31.617780.80000113.7A276 I277 R278A276-S280 PolarHBondContact O-N 3.33Å; I277-S280 PolarHBondContact O-N 2.97Å; I277-S280 PolarHBondContact O-OG 3.32Å; R278-S280 VanDerWaalsContact C-N 3.33Å; R278-S280 PolarHBondContact O-N 3.5Å
281L59.5Low57.3Low116 Ų116113.3 Ų113.361%0.60760%0.595SS**Hα-helixtrans-74.3-35.6176.8-71.4168.2000111.7I277 R278 N279I277-L281 HydrophobicContact CG2-CD1 4.15Å; I277-L281 WeakPolarHBondContact O-CG 3.5Å; I277-L281 PolarHBondContact O-N 3.34Å; I277-L281 VanDerWaalsContact O-N 3.11Å; R278-L281 PolarHBondContact O-N 3.27Å; N279-L281 VanDerWaalsContact C-N 3.31Å; N279-L281 PolarHBondContact O-N 3.33Å
282H56.7Low55.2Low141 Ų141112.2 Ų112.265%0.65361%0.609SS**Hα-helixtrans-69.7-34.4177.8-114.8-72.7000112.8R278 N279 R284 G285R278-H282 PolarHBondContact O-N 2.96Å; N279-H282 PolarHBondContact O-N 2.96Å; H282-R284 VanDerWaalsContact C-N 3.32Å; H282-R284 PolarHBondContact O-N 2.93Å; H282-G285 PolarHBondContact O-N 2.96Å
283D55.1Low53Low141 Ų141121 Ų12175%0.75464%0.639SS**Hα-helixtrans-68.6-31.2179.2-154.331.5000112.2N279 G285N279-D283 PolarHBondContact O-N 3.21Å; N279-D283 VanDerWaalsContact O-N 3.15Å; D283-G285 VanDerWaalsContact C-N 3.3Å; D283-G285 PolarHBondContact O-N 3.04Å
284R51.2Low51.5Low229 Ų229120.8 Ų120.886%0.86465%0.645SS**THydrogen-bonded Turntrans-73.4-16.7173.4-84.2-178.5166.6174.1-3114.4H282H282-R284 VanDerWaalsContact C-N 3.32Å; H282-R284 PolarHBondContact O-N 2.93Å
285G49.3Very low49.5Very low66 Ų66124.1 Ų124.168%0.6866%0.66SS**THydrogen-bonded Turntrans-91.8-15.6-17500000115.4H282 D283H282-G285 PolarHBondContact O-N 2.96Å; D283-G285 VanDerWaalsContact C-N 3.3Å; D283-G285 PolarHBondContact O-N 3.04Å
286R43.9Very low47.6Very low148 Ų148133.9 Ų133.956%0.55869%0.692SS**  trans-107.779.8-179.5-91.7-173.7174.5-161.61.5111.3H259 H288H259-R286 PolarHBondContact NE2-NH1 3.19Å; R286-H288 PolarHBondContact O-N 3.08Å; R286-H288 VanDerWaalsContact O-N 3.08Å
287G43.2Very low46Very low82 Ų82138.1 Ų138.185%0.84571%0.706SS**  trans-67.299.4158.400000109.5
288H37.7Very low44.2Very low157 Ų157142.1 Ų142.173%0.72772%0.721SS**  trans-94.7110.3177.9-124.6-46.9000111.3R286R286-H288 PolarHBondContact O-N 3.08Å; R286-H288 VanDerWaalsContact O-N 3.08Å
289S38.3Very low42.7Very low104 Ų104140.2 Ų140.273%0.72773%0.73SS**  trans-71.7120.8155.939.50000110.5
290S34.6Very low41.3Very low104 Ų104142.1 Ų142.173%0.72774%0.74SS**  171.3124.2129.6-169.50000112.7
291R33.8Very low40.5Very low247 Ų247147.3 Ų147.393%0.93276%0.763SS**  trans21132.5144.2-66.4169.2161.4164.3-5.8118.4
292G30.4Very low40.2Very low72 Ų72146.1 Ų146.174%0.74275%0.753SS**  cis150.5144.19.300000109.6
293R27.6Very low40.8Very low252 Ų252142.7 Ų142.795%0.95175%0.745SS**  trans-176.2157.6151.6-100.6178.1-168.4-142.23.7109.6
294P39.2Very low41Very low111 Ų111140.2 Ų140.272%0.72174%0.744SS**  -107.8167-124.539-35.7000117
295H29.8Very low41.3Very low185 Ų185136.4 Ų136.486%0.85674%0.736SS**  trans69.1113.3160.7-83.4-46.8000119.6
296R29.2Very low42.1Very low228 Ų228137 Ų13786%0.8672%0.721SS**  -167.6127.991.7-132172.1-177.6159.9-0.9109.6F298R296-F298 PolarHBondContact O-N 3.22Å
297D36.3Very low43.2Very low145 Ų145132.8 Ų132.878%0.77571%0.712SS**  trans-67.3118.4173.5-128.4-20000109
298F33.2Very low44.4Very low175 Ų175137.8 Ų137.877%0.76871%0.705SS**  trans-14894.1156.7-92.6-79.3000106.9R296 D300R296-F298 PolarHBondContact O-N 3.22Å; F298-D300 PolarHBondContact O-N 3.35Å
299S38.6Very low45.8Very low106 Ų106137.9 Ų137.974%0.74170%0.699SS**  trans-69.1105.915932.70000107.9
300D39.6Very low47.1Very low108 Ų108139.5 Ų139.558%0.57869%0.689SS**  trans-147.798155.1-94-28.1000107.1F298 F302F298-D300 PolarHBondContact O-N 3.35Å; D300-F302 VanDerWaalsContact C-N 3.29Å; D300-F302 HydrophobicContact CB-CD2 3.99Å; D300-F302 HydrophobicContact CB-CE1 4.35Å; D300-F302 HydrophobicContact CB-CE2 3.4Å; D300-F302 HydrophobicContact CB-CZ 3.6Å; D300-F302 WeakPolarHBondContact O-CD2 3.47Å; D300-F302 PolarHBondContact O-N 3Å
301D42.7Very low48.8Very low177 Ų177143.1 Ų143.195%0.94769%0.687SS**  trans-75.683.8175.5-131.6-1.5000107.8
302F54.7Low50.1Low91 Ų91137 Ų13740%0.39967%0.67SS.*  trans-73.2128.7176.4-67.1-71.1000110.1D300 E306D300-F302 VanDerWaalsContact C-N 3.29Å; D300-F302 HydrophobicContact CB-CD2 3.99Å; D300-F302 HydrophobicContact CB-CE1 4.35Å; D300-F302 HydrophobicContact CB-CE2 3.4Å; D300-F302 HydrophobicContact CB-CZ 3.6Å; D300-F302 WeakPolarHBondContact O-CD2 3.47Å; D300-F302 PolarHBondContact O-N 3Å; F302-E306 WeakPolarHBondContact CD1-OE2 3.45Å
303S67.8Low51.6Low69 Ų69141.9 Ų141.948%0.48367%0.666SS.*  trans-60.8151.5177.5101.30000111.2E305 E306 T307S303-E305 PolarHBondContact O-N 3.3Å; S303-E305 PolarHBondContact OG-N 3.31Å; S303-E306 PolarHBondContact O-N 3.46Å; S303-T307 PolarHBondContact O-N 3.46Å
304A59.3Low53.2Low89 Ų89139.8 Ų139.874%0.73666%0.659SS**Hα-helixtrans-55.5-27.1-179.100000113.1R308A304-R308 PolarHBondContact O-N 3.46Å
305E58.7Low54Low148 Ų148143 Ų14369%0.69266%0.661SS**Hα-helixtrans-71.8-36.2176.4-72.7-166.2137.100112.9S303 T307 R308 W309S303-E305 PolarHBondContact O-N 3.3Å; S303-E305 PolarHBondContact OG-N 3.31Å; E305-T307 VanDerWaalsContact C-N 3.35Å; E305-R308 WeakPolarHBondContact O-CB 3.38Å; E305-R308 PolarHBondContact O-N 3.33Å; E305-W309 PolarHBondContact O-N 3.04Å
306E64.8Low55.1Low79 Ų79141.2 Ų141.237%0.36966%0.658SS.*Hα-helixtrans-70.9-36179.8-163.1174.1162.500111.3F302 S303 R308 W309 R310F302-E306 WeakPolarHBondContact CD1-OE2 3.45Å; S303-E306 PolarHBondContact O-N 3.46Å; E306-R308 VanDerWaalsContact C-N 3.32Å; E306-R308 PolarHBondContact O-N 3.25Å; E306-W309 PolarHBondContact O-N 3.34Å; E306-R310 WeakPolarHBondContact O-CG 3.43Å; E306-R310 PolarHBondContact O-N 3.25Å; E306-R310 VanDerWaalsContact O-N 3.08Å; E306-R310 IonicContact OE1-CZ 3.61Å; E306-R310 IonicContact OE1-NE 3.63Å; E306-R310 IonicContact OE1-NH2 2.82Å; E306-R310 PolarHBondContact OE1-NH2 3.43Å
307T67.6Low56Low60 Ų60138.5 Ų138.537%0.36867%0.674SS.*Hα-helixtrans-64.1-37.9172.8-54.70000111.6S303 E305 R311S303-T307 PolarHBondContact O-N 3.46Å; E305-T307 VanDerWaalsContact C-N 3.35Å; T307-R311 WeakPolarHBondContact O-CG 3.39Å; T307-R311 PolarHBondContact O-N 3.08Å
308R68.1Low56.9Low187 Ų187138.2 Ų138.271%0.70667%0.669SS**Hα-helixtrans-65.6-44.2175.9-173.6179.9-179.9-179.30.5111.4A304 E305 E306 R310 R311 M312A304-R308 PolarHBondContact O-N 3.46Å; E305-R308 WeakPolarHBondContact O-CB 3.38Å; E305-R308 PolarHBondContact O-N 3.33Å; E306-R308 VanDerWaalsContact C-N 3.32Å; E306-R308 PolarHBondContact O-N 3.25Å; R308-R310 PolarHBondContact O-N 3.23Å; R308-R311 PolarHBondContact O-N 2.96Å; R308-M312 PolarHBondContact O-N 3.4Å
309W67Low58.2Low158 Ų158136.2 Ų136.260%0.59866%0.664SS**Hα-helixtrans-63-38.6178.6-102.5106.7000113.4E305 E306 M312 R313E305-W309 PolarHBondContact O-N 3.04Å; E306-W309 PolarHBondContact O-N 3.34Å; W309-M312 PolarHBondContact O-N 2.99Å; W309-R313 PolarHBondContact O-N 3.32Å
310R66.4Low59.3Low139 Ų139137.9 Ų137.953%0.52566%0.659SS.*Hα-helixtrans-71.7-29.9177.9-69.3-176.3-172.9-161.67.5113.1E306 R308E306-R310 WeakPolarHBondContact O-CG 3.43Å; E306-R310 PolarHBondContact O-N 3.25Å; E306-R310 VanDerWaalsContact O-N 3.08Å; E306-R310 IonicContact OE1-CZ 3.61Å; E306-R310 IonicContact OE1-NE 3.63Å; E306-R310 IonicContact OE1-NH2 2.82Å; E306-R310 PolarHBondContact OE1-NH2 3.43Å; R308-R310 PolarHBondContact O-N 3.23Å
311R69.8Low60.4Low179 Ų179139.6 Ų139.668%0.67566%0.664SS**Hα-helixtrans-68.2-36.4173.9-73.5179.2-171-1804112.5T307 R308 R313 R314T307-R311 WeakPolarHBondContact O-CG 3.39Å; T307-R311 PolarHBondContact O-N 3.08Å; R308-R311 PolarHBondContact O-N 2.96Å; R311-R313 VanDerWaalsContact C-N 3.34Å; R311-R314 PolarHBondContact O-N 2.82Å
312M60.7Low61.6Low120 Ų120137.3 Ų137.359%0.59165%0.647SS**Hα-helixtrans-67.1-35.7178.2-64.3-122.7-68.900112R308 W309 R314R308-M312 PolarHBondContact O-N 3.4Å; W309-M312 PolarHBondContact O-N 2.99Å; M312-R314 PolarHBondContact O-N 3.4Å
313R62.5Low62Low174 Ų174140.4 Ų140.466%0.65766%0.663SS**G310 helixtrans-74.1-2.6177.5-81.5-168.1-96.8-169.9-7.9115.4W309 R311 F315W309-R313 PolarHBondContact O-N 3.32Å; R311-R313 VanDerWaalsContact C-N 3.34Å; R313-F315 VanDerWaalsContact C-N 3.3Å
314R60.9Low61.6Low208 Ų208145.5 Ų145.579%0.78568%0.676SS**G310 helixtrans-83.5-4.9-178.9-137.3-176.1-156.9-172.15.5114R311 M312R311-R314 PolarHBondContact O-N 2.82Å; M312-R314 PolarHBondContact O-N 3.4Å
315F56.3Low61.8Low178 Ų178149.8 Ų149.878%0.78167%0.671SS**G310 helixtrans-112.42.5-176.6-68.2-76.4000113.9R313R313-F315 VanDerWaalsContact C-N 3.3Å
316D53.8Low62Low147 Ų147150 Ų15079%0.78667%0.67SS**  trans-107.435.7179-71.2-27.4000112.9
317S46.7Very low61.8Low171 Ų171156.5 Ų156.5100%1.19670%0.697SS**  trans-140.50171.863.10000112

Retrieved 317 of 317 residues in 216.5 ms (Link to these results)

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