A0A077ZEI4_TRITR Loading...

Sodium bile acid symporter family protein

AlphaFold DB , UniProt , Accession A0A077ZEI4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 449 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
1M35.5Very low57.4Low247 Ų247148.8 Ų148.8100%1.21776%0.761SS**  0100.40-76.2173.2177.700108.4S3M1-S3 PolarHBondContact O-N 3.35Å
2A41.9Very low59.4Low112 Ų112139.7 Ų139.793%0.92673%0.725SS**  trans-70.2114.8-179.500000110.1
3S46.2Very low61.4Low83 Ų83136.8 Ų136.858%0.5871%0.71SS**  trans-125.9101.4164145.20000105.4M1 R5M1-S3 PolarHBondContact O-N 3.35Å; S3-R5 PolarHBondContact O-N 3.08Å
4N46.1Very low63.2Low155 Ų155133.9 Ų133.983%0.82970%0.696SS**  trans-59.372.4173.7-98.3-25.4000110.7R6N4-R6 VanDerWaalsContact C-N 3.27Å; N4-R6 PolarHBondContact O-N 2.98Å; N4-R6 VanDerWaalsContact O-N 3.16Å
5R50.3Low64.9Low217 Ų217131.7 Ų131.782%0.81968%0.684SS**  trans-83.380.1163.2-77.6-173.9-169.7-156.22.6106.7S3 V7S3-R5 PolarHBondContact O-N 3.08Å; R5-V7 VanDerWaalsContact C-N 3.25Å; R5-V7 PolarHBondContact O-N 3.16Å
6R51.5Low66.2Low211 Ų211133.2 Ų133.280%0.79668%0.68SS**  trans-64.895.4165.2-117.9-173.2-83.9-162.3-4.2106.6N4 R8N4-R6 VanDerWaalsContact C-N 3.27Å; N4-R6 PolarHBondContact O-N 2.98Å; N4-R6 VanDerWaalsContact O-N 3.16Å; R6-R8 VanDerWaalsContact C-N 3.26Å; R6-R8 PolarHBondContact O-N 2.93Å
7V55.8Low67.5Low135 Ų135133.3 Ų133.382%0.81868%0.675SS**  trans-58.296.5162.9177.70000105.5R5 C9R5-V7 VanDerWaalsContact C-N 3.25Å; R5-V7 PolarHBondContact O-N 3.16Å; V7-C9 PolarHBondContact O-N 3.17Å
8R61.7Low68.8Low157 Ų157130.9 Ų130.959%0.59266%0.663SS**  trans-71.9117.6175.8-71.6-175.7179.4-168.4-0106.5R6R6-R8 VanDerWaalsContact C-N 3.26Å; R6-R8 PolarHBondContact O-N 2.93Å
9C77.3Confident69.8Low74 Ų74126.9 Ų126.950%0.565%0.652SS.*  trans-44.5132.2175.8-176.70000110.4V7 F11 A12 L13V7-C9 PolarHBondContact O-N 3.17Å; C9-F11 PolarHBondContact O-N 3.33Å; C9-F11 VanDerWaalsContact O-N 3.14Å; C9-A12 HydrophobicContact CB-CB 4.2Å; C9-A12 WeakPolarHBondContact O-CA 2.86Å; C9-A12 WeakPolarHBondContact O-CB 3.49Å; C9-A12 PolarHBondContact O-N 3.46Å; C9-L13 PolarHBondContact O-N 3.31Å; C9-L13 VanDerWaalsContact O-N 3.12Å
10P80.7Confident70.6Confident104 Ų104123.4 Ų123.468%0.67564%0.643SS**Hα-helixtrans-56.4-31.8-179.119-30.5000112.6L13 L14P10-L13 WeakPolarHBondContact O-CB 3.28Å; P10-L13 PolarHBondContact O-N 3.29Å; P10-L14 PolarHBondContact O-N 3.26Å
11F84Confident71.4Confident142 Ų142120.5 Ų120.562%0.62363%0.631SS**Hα-helixtrans-63.5-39172.2-171.6-99.8000112.6C9 L14 L15C9-F11 PolarHBondContact O-N 3.33Å; C9-F11 VanDerWaalsContact O-N 3.14Å; F11-L14 PolarHBondContact O-N 3.1Å; F11-L15 HydrophobicContact CD1-CD1 4.28Å; F11-L15 HydrophobicContact CE1-CD1 3.59Å; F11-L15 HydrophobicContact CZ-CD1 3.95Å; F11-L15 PolarHBondContact O-N 2.79Å
12A82.1Confident74Confident39 Ų39114.1 Ų114.132%0.32260%0.6SS.*Hα-helixtrans-67.9-35.2175.400000111.9C9 L15 Y16C9-A12 HydrophobicContact CB-CB 4.2Å; C9-A12 WeakPolarHBondContact O-CA 2.86Å; C9-A12 WeakPolarHBondContact O-CB 3.49Å; C9-A12 PolarHBondContact O-N 3.46Å; A12-L15 PolarHBondContact O-N 3.12Å; A12-Y16 WeakPolarHBondContact O-CB 3.41Å; A12-Y16 WeakPolarHBondContact O-CD2 3.45Å; A12-Y16 PolarHBondContact O-N 3.49Å
13L84.9Confident75.9Confident102 Ų102112.5 Ų112.553%0.53458%0.582SS.*Hα-helixtrans-63.9-43.9172.8-89.5157.2000111.9C9 P10 Y16 F17C9-L13 PolarHBondContact O-N 3.31Å; C9-L13 VanDerWaalsContact O-N 3.12Å; P10-L13 WeakPolarHBondContact O-CB 3.28Å; P10-L13 PolarHBondContact O-N 3.29Å; L13-Y16 PolarHBondContact O-N 2.91Å; L13-F17 WeakPolarHBondContact O-CB 3.43Å; L13-F17 PolarHBondContact O-N 3.29Å
14L86.6Confident77.6Confident97 Ų97111.6 Ų111.651%0.50858%0.576SS.*Hα-helixtrans-61.6-43.4174.8-177.367.4000111.5P10 F11 Y16 F17 L18P10-L14 PolarHBondContact O-N 3.26Å; F11-L14 PolarHBondContact O-N 3.1Å; L14-Y16 PolarHBondContact O-N 3.48Å; L14-F17 PolarHBondContact O-N 2.94Å; L14-L18 HydrophobicContact CG-CD1 4.27Å; L14-L18 WeakPolarHBondContact O-CG 3.2Å; L14-L18 PolarHBondContact O-N 2.92Å
15L88.3Confident79.4Confident100 Ų100109.7 Ų109.752%0.52457%0.565SS.*Hα-helixtrans-64.5-39.9177.9-137.7119.6000111.8F11 A12 A19F11-L15 HydrophobicContact CD1-CD1 4.28Å; F11-L15 HydrophobicContact CE1-CD1 3.59Å; F11-L15 HydrophobicContact CZ-CD1 3.95Å; F11-L15 PolarHBondContact O-N 2.79Å; A12-L15 PolarHBondContact O-N 3.12Å; L15-A19 VanDerWaalsContact O-CB 3.3Å; L15-A19 WeakPolarHBondContact O-CB 3.18Å; L15-A19 PolarHBondContact O-N 3.15Å
16Y86.7Confident80.9Confident156 Ų156104.6 Ų104.661%0.61255%0.553SS**Hα-helixtrans-64-41.4172.9-102.3-85.2000112.2A12 L13 L14 A19 A20A12-Y16 WeakPolarHBondContact O-CB 3.41Å; A12-Y16 WeakPolarHBondContact O-CD2 3.45Å; A12-Y16 PolarHBondContact O-N 3.49Å; L13-Y16 PolarHBondContact O-N 2.91Å; L14-Y16 PolarHBondContact O-N 3.48Å; Y16-A19 PolarHBondContact O-N 3.02Å; Y16-A20 WeakPolarHBondContact O-CB 3.32Å; Y16-A20 PolarHBondContact O-N 2.79Å
17F87.8Confident82.1Confident135 Ų13598 Ų9859%0.59254%0.539SS*.Hα-helixtrans-64.4-47.1176.7178.8-100000111.3L13 L14 A19 A20 V21L13-F17 WeakPolarHBondContact O-CB 3.43Å; L13-F17 PolarHBondContact O-N 3.29Å; L14-F17 PolarHBondContact O-N 2.94Å; F17-A19 VanDerWaalsContact C-N 3.34Å; F17-A19 PolarHBondContact O-N 3.34Å; F17-A20 PolarHBondContact O-N 2.74Å; F17-V21 HydrophobicContact CD1-CG2 4.25Å; F17-V21 HydrophobicContact CE1-CG2 3.85Å; F17-V21 HydrophobicContact CE2-CG2 4.18Å; F17-V21 HydrophobicContact CZ-CG2 3.81Å; F17-V21 WeakPolarHBondContact O-CG2 3.28Å; F17-V21 PolarHBondContact O-N 3.42Å
18L90.8Very high82.9Confident90 Ų9094.2 Ų94.247%0.47152%0.522SS..Hα-helixtrans-59.8-44.2174.9-72.2171.2000111.4L14 A20 V21 I22L14-L18 HydrophobicContact CG-CD1 4.27Å; L14-L18 WeakPolarHBondContact O-CG 3.2Å; L14-L18 PolarHBondContact O-N 2.92Å; L18-A20 VanDerWaalsContact C-N 3.33Å; L18-A20 PolarHBondContact O-N 3.5Å; L18-V21 PolarHBondContact O-N 3.41Å; L18-I22 WeakPolarHBondContact O-CB 3.33Å; L18-I22 WeakPolarHBondContact O-CD1 3.03Å; L18-I22 WeakPolarHBondContact O-CG1 3.35Å; L18-I22 PolarHBondContact O-N 3.32Å
19A87.4Confident83.6Confident55 Ų5589.6 Ų89.646%0.45551%0.512SS..Hα-helixtrans-62-39.1175.700000112.3L15 Y16 F17 S23L15-A19 VanDerWaalsContact O-CB 3.3Å; L15-A19 WeakPolarHBondContact O-CB 3.18Å; L15-A19 PolarHBondContact O-N 3.15Å; Y16-A19 PolarHBondContact O-N 3.02Å; F17-A19 VanDerWaalsContact C-N 3.34Å; F17-A19 PolarHBondContact O-N 3.34Å; A19-S23 VanDerWaalsContact O-CB 3.22Å; A19-S23 WeakPolarHBondContact O-CB 3.4Å; A19-S23 PolarHBondContact O-N 2.88Å
20A85.7Confident83.2Confident56 Ų5689.8 Ų89.846%0.46351%0.506SS..Hα-helixtrans-67-41176.200000112.3Y16 F17 L18 S23 S24Y16-A20 WeakPolarHBondContact O-CB 3.32Å; Y16-A20 PolarHBondContact O-N 2.79Å; F17-A20 PolarHBondContact O-N 2.74Å; L18-A20 VanDerWaalsContact C-N 3.33Å; L18-A20 PolarHBondContact O-N 3.5Å; A20-S23 PolarHBondContact O-N 3.5Å; A20-S24 WeakPolarHBondContact O-CB 2.87Å; A20-S24 PolarHBondContact O-N 3.46Å; A20-S24 PolarHBondContact O-OG 3.42Å
21V88.4Confident82.6Confident64 Ų6486 Ų8639%0.38848%0.483SS..Hα-helixtrans-67.2-41.6175.9172.90000111.4F17 L18 S23 S24 L25F17-V21 HydrophobicContact CD1-CG2 4.25Å; F17-V21 HydrophobicContact CE1-CG2 3.85Å; F17-V21 HydrophobicContact CE2-CG2 4.18Å; F17-V21 HydrophobicContact CZ-CG2 3.81Å; F17-V21 WeakPolarHBondContact O-CG2 3.28Å; F17-V21 PolarHBondContact O-N 3.42Å; L18-V21 PolarHBondContact O-N 3.41Å; V21-S23 VanDerWaalsContact C-N 3.33Å; V21-S24 WeakPolarHBondContact CA-OG 3.33Å; V21-S24 PolarHBondContact O-N 2.89Å; V21-S24 PolarHBondContact O-OG 3.48Å; V21-L25 VanDerWaalsContact O-CB 3.28Å; V21-L25 WeakPolarHBondContact O-CB 3.45Å; V21-L25 PolarHBondContact O-N 2.96Å
22I89.5Confident81.9Confident113 Ų11383.2 Ų83.258%0.57949%0.487SS*.Hα-helixtrans-63.8-43.1175.2-68.2164.5000110L18 L25 L26L18-I22 WeakPolarHBondContact O-CB 3.33Å; L18-I22 WeakPolarHBondContact O-CD1 3.03Å; L18-I22 WeakPolarHBondContact O-CG1 3.35Å; L18-I22 PolarHBondContact O-N 3.32Å; I22-L25 PolarHBondContact O-N 3.14Å; I22-L26 VanDerWaalsContact O-CB 3.28Å; I22-L26 WeakPolarHBondContact O-CB 2.87Å; I22-L26 PolarHBondContact O-N 3.45Å
23S82.5Confident81.3Confident78 Ų7886.8 Ų86.855%0.54550%0.5SS..Hα-helixtrans-62.8-43.6177.3-173.20000112.2A19 A20 V21 L26 S27A19-S23 VanDerWaalsContact O-CB 3.22Å; A19-S23 WeakPolarHBondContact O-CB 3.4Å; A19-S23 PolarHBondContact O-N 2.88Å; A20-S23 PolarHBondContact O-N 3.5Å; V21-S23 VanDerWaalsContact C-N 3.33Å; S23-L26 PolarHBondContact O-N 3.27Å; S23-S27 PolarHBondContact O-N 3.16Å; S23-S27 PolarHBondContact O-OG 3.19Å
24S82.5Confident80.8Confident64 Ų6482.2 Ų82.245%0.44848%0.477SS..Hα-helixtrans-70.5-35177.966.30000113A20 V21 S27 A28A20-S24 WeakPolarHBondContact O-CB 2.87Å; A20-S24 PolarHBondContact O-N 3.46Å; A20-S24 PolarHBondContact O-OG 3.42Å; V21-S24 WeakPolarHBondContact CA-OG 3.33Å; V21-S24 PolarHBondContact O-N 2.89Å; V21-S24 PolarHBondContact O-OG 3.48Å; S24-S27 WeakPolarHBondContact CA-OG 2.93Å; S24-S27 PolarHBondContact O-OG 2.88Å; S24-A28 VanDerWaalsContact O-CB 3.26Å; S24-A28 WeakPolarHBondContact O-CB 3.39Å; S24-A28 PolarHBondContact O-N 3.33Å
25L84.1Confident80.3Confident115 Ų11579.1 Ų79.160%0.60246%0.459SS*.Hα-helixtrans-68.1-39.3173.8-170.566.3000110.9V21 I22 A28 T29V21-L25 VanDerWaalsContact O-CB 3.28Å; V21-L25 WeakPolarHBondContact O-CB 3.45Å; V21-L25 PolarHBondContact O-N 2.96Å; I22-L25 PolarHBondContact O-N 3.14Å; L25-A28 PolarHBondContact O-N 2.91Å; L25-T29 WeakPolarHBondContact O-CB 3.43Å; L25-T29 VanDerWaalsContact O-CG2 3.26Å; L25-T29 WeakPolarHBondContact O-CG2 2.96Å; L25-T29 PolarHBondContact O-N 3.01Å; L25-T29 PolarHBondContact O-OG1 3.32Å
26L80.9Confident79.9Confident109 Ų10974.7 Ų74.757%0.57144%0.436SS*.Hα-helixtrans-66.3-41.3176.2-168.568.4000111.4I22 S23 T29 M30I22-L26 VanDerWaalsContact O-CB 3.28Å; I22-L26 WeakPolarHBondContact O-CB 2.87Å; I22-L26 PolarHBondContact O-N 3.45Å; S23-L26 PolarHBondContact O-N 3.27Å; L26-T29 WeakPolarHBondContact CA-OG1 3.43Å; L26-T29 PolarHBondContact O-OG1 2.9Å; L26-M30 WeakPolarHBondContact O-CB 3.4Å; L26-M30 VanDerWaalsContact O-CG 3.24Å; L26-M30 WeakPolarHBondContact O-CG 3.32Å; L26-M30 PolarHBondContact O-N 3.07Å
27S76.1Confident79.6Confident72 Ų7267.6 Ų67.650%0.50341%0.409SS..Hα-helixtrans-68.3-40.9175.865.60000112.4S23 S24 M30 A31S23-S27 PolarHBondContact O-N 3.16Å; S23-S27 PolarHBondContact O-OG 3.19Å; S24-S27 WeakPolarHBondContact CA-OG 2.93Å; S24-S27 PolarHBondContact O-OG 2.88Å; S27-M30 PolarHBondContact O-N 2.85Å; S27-A31 WeakPolarHBondContact O-CB 3.4Å; S27-A31 PolarHBondContact O-N 3.3Å
28A73.9Confident79.4Confident56 Ų5665.3 Ų65.346%0.46340%0.403SS..Hα-helixtrans-65-39.217700000112.4S24 L25 A31 A32S24-A28 VanDerWaalsContact O-CB 3.26Å; S24-A28 WeakPolarHBondContact O-CB 3.39Å; S24-A28 PolarHBondContact O-N 3.33Å; L25-A28 PolarHBondContact O-N 2.91Å; A28-A31 PolarHBondContact O-N 2.72Å; A28-A32 WeakPolarHBondContact O-CB 3.26Å; A28-A32 PolarHBondContact O-N 3.04Å
29T74.7Confident79.1Confident60 Ų6061.6 Ų61.637%0.36838%0.384SS..Hα-helixtrans-68.4-41.4175.748.60000112.1L25 L26 A32 L33L25-T29 WeakPolarHBondContact O-CB 3.43Å; L25-T29 VanDerWaalsContact O-CG2 3.26Å; L25-T29 WeakPolarHBondContact O-CG2 2.96Å; L25-T29 PolarHBondContact O-N 3.01Å; L25-T29 PolarHBondContact O-OG1 3.32Å; L26-T29 WeakPolarHBondContact CA-OG1 3.43Å; L26-T29 PolarHBondContact O-OG1 2.9Å; T29-A32 PolarHBondContact O-N 3.06Å; T29-L33 WeakPolarHBondContact O-CB 3.35Å; T29-L33 WeakPolarHBondContact O-CG 3.46Å; T29-L33 PolarHBondContact O-N 3.36Å
30M70.5Confident79.2Confident78 Ų7861.1 Ų61.138%0.38438%0.377SS..Hα-helixtrans-62.5-41.7173-71.8-66.699.400112.2L26 S27 L33 S34 Y82L26-M30 WeakPolarHBondContact O-CB 3.4Å; L26-M30 VanDerWaalsContact O-CG 3.24Å; L26-M30 WeakPolarHBondContact O-CG 3.32Å; L26-M30 PolarHBondContact O-N 3.07Å; S27-M30 PolarHBondContact O-N 2.85Å; M30-L33 HydrophobicContact CE-CD1 3.8Å; M30-L33 PolarHBondContact O-N 2.68Å; M30-S34 WeakPolarHBondContact O-CB 3.42Å; M30-S34 PolarHBondContact O-N 3.28Å; M30-S34 VanDerWaalsContact O-N 3.08Å; M30-Y82 HydrophobicContact CB-CD1 4.48Å; M30-Y82 HydrophobicContact CB-CE1 4.18Å; M30-Y82 WeakPolarHBondContact O-CE1 3.46Å
31A68Low79.4Confident24 Ų2459.7 Ų59.720%0.19836%0.36CS..Hα-helixtrans-64.1-43.2175.300000111.8S27 A28 L33 S34S27-A31 WeakPolarHBondContact O-CB 3.4Å; S27-A31 PolarHBondContact O-N 3.3Å; A28-A31 PolarHBondContact O-N 2.72Å; A31-L33 PolarHBondContact O-N 3.15Å; A31-S34 PolarHBondContact O-N 3.47Å; A31-S34 PolarHBondContact O-OG 2.94Å
32A68.3Low79.5Confident84 Ų8460.5 Ų60.569%0.69437%0.365SS*.Hα-helixtrans-66.2-24.1177.800000113.8A28 T29A28-A32 WeakPolarHBondContact O-CB 3.26Å; A28-A32 PolarHBondContact O-N 3.04Å; T29-A32 PolarHBondContact O-N 3.06Å
33L70.6Confident79.5Confident115 Ų11557.5 Ų57.560%0.60235%0.353SS*.Hα-helixtrans-88.4-13173.6-73165.2000112.9T29 M30 A31T29-L33 WeakPolarHBondContact O-CB 3.35Å; T29-L33 WeakPolarHBondContact O-CG 3.46Å; T29-L33 PolarHBondContact O-N 3.36Å; M30-L33 HydrophobicContact CE-CD1 3.8Å; M30-L33 PolarHBondContact O-N 2.68Å; A31-L33 PolarHBondContact O-N 3.15Å
34S73.6Confident79.7Confident6 Ų662.1 Ų62.14%0.04237%0.366CS..  trans-83.9149.8-18076.20000112.1M30 A31 C81M30-S34 WeakPolarHBondContact O-CB 3.42Å; M30-S34 PolarHBondContact O-N 3.28Å; M30-S34 VanDerWaalsContact O-N 3.08Å; A31-S34 PolarHBondContact O-N 3.47Å; A31-S34 PolarHBondContact O-OG 2.94Å; S34-C81 WeakPolarHBondContact CA-O 3.48Å
35Y77.2Confident79.8Confident32 Ų3267.1 Ų67.113%0.12538%0.382CS..EExtended strand (participates in β ladder)trans-142.2149.9177.456.7-88.9000109.9I37 Y63 D64 V80 C81 S83 L85 L109Y35-I37 HydrophobicContact CD2-CD1 4.41Å; Y35-I37 HydrophobicContact CD2-CG1 3.97Å; Y35-I37 HydrophobicContact CE2-CD1 3.91Å; Y35-I37 HydrophobicContact CE2-CG1 3.81Å; Y35-Y63 AromaticContact CD2-CD1 3.68Å; Y35-Y63 HydrophobicContact CD2-CD1 3.68Å; Y35-Y63 HydrophobicContact CD2-CE1 4.42Å; Y35-Y63 AromaticContact CE2-CD1 3.65Å; Y35-Y63 HydrophobicContact CE2-CD1 3.65Å; Y35-Y63 AromaticContact CE2-CE1 3.93Å; Y35-Y63 HydrophobicContact CE2-CE1 3.93Å; Y35-D64 CarbonylContact C-O 3.55Å; Y35-D64 WeakPolarHBondContact CA-O 3.05Å; Y35-V80 WeakPolarHBondContact O-CA 3.5Å; Y35-C81 HydrophobicContact CD2-CB 4.38Å; Y35-C81 HydrophobicContact CE1-CB 4.35Å; Y35-C81 HydrophobicContact CE2-CB 3.8Å; Y35-C81 PolarHBondContact N-O 3.42Å; Y35-C81 PolarHBondContact O-N 3.24Å; Y35-S83 PolarHBondContact OH-O 3.48Å; Y35-L85 HydrophobicContact CE2-CD1 3.39Å; Y35-L85 WeakPolarHBondContact OH-CD1 3.46Å; Y35-L109 HydrophobicContact CE1-CD1 4.27Å; Y35-L109 WeakPolarHBondContact OH-CD1 3.44Å
36A78.6Confident79.5Confident6 Ų663.7 Ų63.75%0.0537%0.367CS..EExtended strand (participates in β ladder)trans-93.1146.1174.100000109.8Y63 D64 V66A36-Y63 WeakPolarHBondContact O-CA 3.43Å; A36-D64 HydrophobicContact CB-CB 4.43Å; A36-D64 PolarHBondContact N-O 3.03Å; A36-D64 PolarHBondContact O-N 3.42Å; A36-V66 HydrophobicContact CB-CG2 4.13Å
37I80.1Confident79.6Confident7 Ų766.6 Ų66.64%0.03638%0.375CS..EExtended strand (participates in β ladder)trans-115.4132.3177.6-61.1139.6000110.4Y35 V39 V61 R62 Y63 K79 C81 L85Y35-I37 HydrophobicContact CD2-CD1 4.41Å; Y35-I37 HydrophobicContact CD2-CG1 3.97Å; Y35-I37 HydrophobicContact CE2-CD1 3.91Å; Y35-I37 HydrophobicContact CE2-CG1 3.81Å; I37-V39 HydrophobicContact CG2-CG2 4.02Å; I37-V61 HydrophobicContact CG2-CG1 3.68Å; I37-R62 WeakPolarHBondContact CA-O 3.32Å; I37-Y63 HydrophobicContact CG1-CD1 4.38Å; I37-K79 PolarHBondContact N-O 2.9Å; I37-K79 VanDerWaalsContact N-O 3.11Å; I37-C81 HydrophobicContact CD1-CB 3.93Å; I37-C81 WeakPolarHBondContact CD1-SG 3.26Å; I37-L85 HydrophobicContact CD1-CD1 3.48Å; I37-L85 VanDerWaalsContact CD1-CD1 3.48Å; I37-L85 HydrophobicContact CD1-CD2 3.71Å; I37-L85 HydrophobicContact CD1-CG 3.95Å; I37-L85 HydrophobicContact CG1-CD1 4.04Å; I37-L85 HydrophobicContact CG1-CD2 4.16Å; I37-L85 HydrophobicContact CG2-CD2 4.42Å
38N83.3Confident80.1Confident88 Ų8867.1 Ų67.147%0.47137%0.372SS..EExtended strand (participates in β ladder)trans-122139.6165.3-164.53.2000110.3R62N38-R62 PolarHBondContact N-O 3.24Å; N38-R62 PolarHBondContact O-N 3.1Å
39V85.6Confident80.9Confident12 Ų1265 Ų657%0.07335%0.352CS..EExtended strand (participates in β ladder)trans-121.5124.2-179.9-177.20000108.8I37 F41 A59 L60 V61 F136 F152I37-V39 HydrophobicContact CG2-CG2 4.02Å; V39-F41 HydrophobicContact CG1-CE1 4.38Å; V39-F41 HydrophobicContact CG1-CZ 4.22Å; V39-A59 HydrophobicContact CG1-CB 4.01Å; V39-L60 WeakPolarHBondContact CA-O 3.46Å; V39-V61 HydrophobicContact CG2-CG1 4.43Å; V39-V61 HydrophobicContact CG2-CG2 4.28Å; V39-F136 HydrophobicContact CG1-CD1 4.07Å; V39-F136 HydrophobicContact CG1-CE1 3.99Å; V39-F136 HydrophobicContact CG2-CD1 4.31Å; V39-F136 HydrophobicContact CG2-CE1 3.91Å; V39-F152 HydrophobicContact CB-CD1 3.87Å; V39-F152 HydrophobicContact CB-CD2 4.01Å; V39-F152 HydrophobicContact CB-CE1 3.93Å; V39-F152 HydrophobicContact CB-CE2 4.07Å; V39-F152 HydrophobicContact CB-CG 3.9Å; V39-F152 HydrophobicContact CB-CZ 4.02Å; V39-F152 HydrophobicContact CG2-CD1 4.37Å; V39-F152 HydrophobicContact CG2-CD2 3.77Å; V39-F152 HydrophobicContact CG2-CE1 4.13Å; V39-F152 HydrophobicContact CG2-CE2 3.49Å; V39-F152 VanDerWaalsContact CG2-CE2 3.49Å; V39-F152 HydrophobicContact CG2-CG 4.2Å; V39-F152 HydrophobicContact CG2-CZ 3.67Å
40S88.2Confident81.7Confident44 Ų4463.8 Ų63.831%0.30835%0.345SS..EExtended strand (participates in β ladder)trans-116.7146.7171.953.20000109.4A59 L60S40-A59 CarbonylContact O-C 3.42Å; S40-L60 PolarHBondContact N-O 3.35Å; S40-L60 PolarHBondContact O-N 2.96Å; S40-L60 WeakPolarHBondContact OG-CB 3.31Å; S40-L60 PolarHBondContact OG-O 3.24Å
41F91.4Very high82.5Confident26 Ų2661.9 Ų61.911%0.11434%0.335CS..EExtended strand (participates in β ladder)trans-104.9142.2-179.7-62.7-79.5000110.4V39 P43 E44 V57 S58 A59 F122 F136 F152 Y154V39-F41 HydrophobicContact CG1-CE1 4.38Å; V39-F41 HydrophobicContact CG1-CZ 4.22Å; F41-P43 CarbonylContact O-C 3.56Å; F41-E44 VanDerWaalsContact O-CA 3.25Å; F41-E44 WeakPolarHBondContact O-CA 3.32Å; F41-E44 PolarHBondContact O-N 2.71Å; F41-V57 HydrophobicContact CB-CG1 4.33Å; F41-V57 HydrophobicContact CD1-CG1 4.06Å; F41-S58 CarbonylContact C-O 3.57Å; F41-S58 WeakPolarHBondContact CA-O 3.38Å; F41-A59 HydrophobicContact CD1-CB 4.08Å; F41-A59 HydrophobicContact CE1-CB 3.99Å; F41-F122 HydrophobicContact CD1-CE1 4.48Å; F41-F122 HydrophobicContact CD1-CZ 4.2Å; F41-F122 HydrophobicContact CE1-CE1 4.3Å; F41-F122 HydrophobicContact CE1-CZ 4.09Å; F41-F136 HydrophobicContact CE1-CB 4.12Å; F41-F136 HydrophobicContact CE1-CG 4.36Å; F41-F136 HydrophobicContact CZ-CB 3.93Å; F41-F136 HydrophobicContact CZ-CG 4.43Å; F41-F152 HydrophobicContact CE2-CB 4.08Å; F41-F152 HydrophobicContact CZ-CB 3.93Å; F41-Y154 HydrophobicContact CB-CD2 3.52Å; F41-Y154 HydrophobicContact CB-CE2 3.52Å; F41-Y154 HydrophobicContact CB-CG 4.47Å; F41-Y154 HydrophobicContact CD1-CD2 4.08Å; F41-Y154 HydrophobicContact CD1-CG 4.28Å; F41-Y154 AromaticContact CD2-CD2 3.67Å; F41-Y154 HydrophobicContact CD2-CD2 3.67Å; F41-Y154 HydrophobicContact CD2-CE2 4.49Å; F41-Y154 HydrophobicContact CD2-CG 4.34Å; F41-Y154 HydrophobicContact CE2-CD2 4.38Å; F41-Y154 AromaticContact CG-CD2 3.48Å; F41-Y154 HydrophobicContact CG-CD2 3.48Å; F41-Y154 VanDerWaalsContact CG-CD2 3.48Å; F41-Y154 HydrophobicContact CG-CE2 4.04Å; F41-Y154 HydrophobicContact CG-CG 4.11Å
42V89.8Confident83.6Confident81 Ų8166.6 Ų66.649%0.49136%0.357SS..EExtended strand (participates in β ladder)trans-119.9122.1172-176.80000108.4V57 S58V42-V57 WeakPolarHBondContact O-CA 3.24Å; V42-S58 PolarHBondContact N-O 3.33Å; V42-S58 PolarHBondContact O-N 2.85Å
43P90.1Very high84.7Confident50 Ų5066.5 Ų66.533%0.32535%0.345SS..SBendcis-72.1148-4.532.1-34.1000111.9F41 M55 Y154F41-P43 CarbonylContact O-C 3.56Å; P43-M55 HydrophobicContact CG-CE 3.07Å; P43-Y154 WeakPolarHBondContact O-CE2 3.5Å; P43-Y154 PolarHBondContact O-OH 2.88Å
44E86.7Confident85.7Confident176 Ų17665.8 Ų65.882%0.82234%0.342SS*.SBendtrans-64.9-43.1-177.8-175.4176.7-172.500111.8F41F41-E44 VanDerWaalsContact O-CA 3.25Å; F41-E44 WeakPolarHBondContact O-CA 3.32Å; F41-E44 PolarHBondContact O-N 2.71Å
45Q83.6Confident86.6Confident169 Ų16966.5 Ų66.579%0.7935%0.345SS*.SBendtrans-98.4118.1167.1-67-171-9.100109.2K47Q45-K47 PolarHBondContact O-N 3.11Å
46P78.9Confident87.2Confident43 Ų4369.2 Ų69.228%0.27937%0.365SS..PPolyproline II helixtrans-65.1135.7176.310.4-10.9000110.7M55 Y154 K155 V156P46-M55 HydrophobicContact CB-CE 4.25Å; P46-M55 HydrophobicContact CB-SD 4.37Å; P46-Y154 WeakPolarHBondContact CA-OH 3.32Å; P46-Y154 HydrophobicContact CB-CE1 3.94Å; P46-Y154 WeakPolarHBondContact CB-OH 3.49Å; P46-Y154 HydrophobicContact CG-CE1 4.09Å; P46-Y154 HydrophobicContact CG-CE2 4.24Å; P46-K155 WeakPolarHBondContact CG-O 3.49Å; P46-V156 HydrophobicContact CB-CG2 4.28Å
47K83.3Confident87.8Confident169 Ų16968.9 Ų68.974%0.73536%0.362SS*.PPolyproline II helixtrans-64.1147.5166.5-172.6-176.5173.7-170.40108.7Q45 L49Q45-K47 PolarHBondContact O-N 3.11Å; K47-L49 PolarHBondContact O-N 2.87Å
48L85.5Confident88.2Confident84 Ų8470.1 Ų70.144%0.4437%0.371SS..PPolyproline II helixtrans-58.6121.2169.7-16263.8000109.5A157 T159L48-A157 HydrophobicContact CD1-CB 3.78Å; L48-T159 HydrophobicContact CD1-CG2 3.53Å; L48-T159 HydrophobicContact CD2-CG2 3.6Å; L48-T159 HydrophobicContact CG-CG2 3.58Å
49L90.7Very high88.5Confident10 Ų1065.9 Ų65.95%0.05235%0.349CS..EExtended strand (participates in β ladder)trans-97.4131.4-178-164.461.8000109.3K47 D53 M55 G126 V156 A157 V158 T159K47-L49 PolarHBondContact O-N 2.87Å; L49-D53 HydrophobicContact CD1-CB 3.56Å; L49-D53 WeakPolarHBondContact CD2-O 3.12Å; L49-D53 HydrophobicContact CG-CB 4.09Å; L49-M55 HydrophobicContact CD1-CB 3.89Å; L49-M55 HydrophobicContact CD2-CB 4.45Å; L49-G126 VanDerWaalsContact CD2-N 3.32Å; L49-V156 HydrophobicContact CB-CG1 4.32Å; L49-V156 HydrophobicContact CD2-CG1 4.36Å; L49-A157 PolarHBondContact N-O 3.31Å; L49-V158 HydrophobicContact CB-CG2 4.49Å; L49-V158 CarbonylContact O-C 3.47Å; L49-V158 WeakPolarHBondContact O-CA 3.3Å; L49-T159 PolarHBondContact O-N 3.5Å; L49-T159 PolarHBondContact O-OG1 2.95Å
50T90.8Very high88.6Confident36 Ų3666.7 Ų66.722%0.22135%0.352CS..EExtended strand (participates in β ladder)trans-81.7159.1170.237.70000111.3N52 D53 T159T50-N52 PolarHBondContact O-N 2.95Å; T50-D53 WeakPolarHBondContact O-CB 3.37Å; T50-D53 PolarHBondContact O-N 2.83Å; T50-D53 PolarHBondContact OG1-OD1 2.87Å; T50-D53 PolarHBondContact OG1-OD2 3.42Å; T50-T159 CarbonylContact C-O 3.55Å; T50-T159 VanDerWaalsContact CA-O 3.3Å; T50-T159 WeakPolarHBondContact CA-O 3.39Å
51E89Confident88.5Confident38 Ų3864.6 Ų64.618%0.17834%0.338CS..THydrogen-bonded Turntrans-55.7131.7173.7-76.6-179.1-178.400111D53 F128 L129 V158 T159 T161E51-D53 PolarHBondContact O-N 3.46Å; E51-F128 WeakPolarHBondContact OE1-CA 3.44Å; E51-L129 PolarHBondContact OE1-N 3.45Å; E51-V158 HydrophobicContact CG-CG1 4.18Å; E51-T159 PolarHBondContact N-O 3.07Å; E51-T161 HydrophobicContact CB-CG2 4.44Å
52N90.2Very high88.1Confident123 Ų12368.9 Ų68.966%0.65835%0.353SS*.THydrogen-bonded Turntrans68.8-0.1-173.9-45.6-66.6000116.2T50 N54 G126T50-N52 PolarHBondContact O-N 2.95Å; N52-N54 PolarHBondContact O-OD1 3.43Å; N52-G126 WeakPolarHBondContact CA-O 3.48Å; N52-G126 PolarHBondContact N-O 3.12Å
53D91.9Very high87.7Confident82 Ų8266.2 Ų66.244%0.43934%0.335SS..  trans-76.8149.7168.9-77.837.6000110.1L49 T50 E51 G126L49-D53 HydrophobicContact CD1-CB 3.56Å; L49-D53 WeakPolarHBondContact CD2-O 3.12Å; L49-D53 HydrophobicContact CG-CB 4.09Å; T50-D53 WeakPolarHBondContact O-CB 3.37Å; T50-D53 PolarHBondContact O-N 2.83Å; T50-D53 PolarHBondContact OG1-OD1 2.87Å; T50-D53 PolarHBondContact OG1-OD2 3.42Å; E51-D53 PolarHBondContact O-N 3.46Å; D53-G126 PolarHBondContact O-N 2.85Å
54N92.1Very high87.1Confident99 Ų9968 Ų6853%0.52934%0.341SS..EExtended strand (participates in β ladder)trans-112.7146179.2-65.56.1000109.7N52 V123 V124 T125N52-N54 PolarHBondContact O-OD1 3.43Å; N54-V123 HydrophobicContact CB-CG1 3.8Å; N54-V124 CarbonylContact C-O 3.58Å; N54-V124 WeakPolarHBondContact CA-O 3.24Å; N54-T125 WeakPolarHBondContact OD1-CG2 3.4Å; N54-T125 PolarHBondContact OD1-OG1 3.35Å; N54-T125 VanDerWaalsContact OD1-OG1 3.07Å
55M91.3Very high86.3Confident22 Ų2264 Ų6411%0.10834%0.338CS..EExtended strand (participates in β ladder)trans-134.7120.4177.1180-177.1177.200109.5P43 P46 L49 V57 V124P43-M55 HydrophobicContact CG-CE 3.07Å; P46-M55 HydrophobicContact CB-CE 4.25Å; P46-M55 HydrophobicContact CB-SD 4.37Å; L49-M55 HydrophobicContact CD1-CB 3.89Å; L49-M55 HydrophobicContact CD2-CB 4.45Å; M55-V57 HydrophobicContact CE-CG2 4.2Å; M55-V57 HydrophobicContact CG-CG2 4.23Å; M55-V57 HydrophobicContact SD-CG2 4.36Å; M55-V124 PolarHBondContact N-O 2.96Å; M55-V124 PolarHBondContact O-N 3.41Å
56T90.6Very high85.5Confident88 Ų8858.1 Ų58.154%0.5431%0.314SS..EExtended strand (participates in β ladder)trans-78.9123.5172.1-490000109.3
57V90.5Very high84.8Confident0 Ų060.2 Ų60.20%033%0.326CS..EExtended strand (participates in β ladder)trans-114.1133.8176.4-178.80000108F41 V42 M55 T121 F122 V124 Y154F41-V57 HydrophobicContact CB-CG1 4.33Å; F41-V57 HydrophobicContact CD1-CG1 4.06Å; V42-V57 WeakPolarHBondContact O-CA 3.24Å; M55-V57 HydrophobicContact CE-CG2 4.2Å; M55-V57 HydrophobicContact CG-CG2 4.23Å; M55-V57 HydrophobicContact SD-CG2 4.36Å; V57-T121 WeakPolarHBondContact O-CA 3.39Å; V57-F122 HydrophobicContact CB-CD2 4.15Å; V57-F122 HydrophobicContact CB-CE1 4.31Å; V57-F122 HydrophobicContact CB-CE2 3.61Å; V57-F122 HydrophobicContact CB-CZ 3.7Å; V57-F122 HydrophobicContact CG1-CE1 4.13Å; V57-F122 HydrophobicContact CG1-CE2 3.92Å; V57-F122 HydrophobicContact CG1-CZ 3.51Å; V57-F122 HydrophobicContact CG2-CE2 4.2Å; V57-F122 PolarHBondContact N-O 3.29Å; V57-F122 PolarHBondContact O-N 2.88Å; V57-V124 HydrophobicContact CG2-CG2 3.89Å; V57-Y154 HydrophobicContact CB-CE1 4.44Å; V57-Y154 HydrophobicContact CG1-CD1 4.23Å; V57-Y154 HydrophobicContact CG1-CE1 3.92Å; V57-Y154 HydrophobicContact CG1-CE2 4.47Å; V57-Y154 HydrophobicContact CG2-CD1 4.29Å; V57-Y154 HydrophobicContact CG2-CE1 3.62Å
58S88.8Confident83.5Confident32 Ų3257.3 Ų57.322%0.22432%0.324CS..EExtended strand (participates in β ladder)trans-107.6118.5175-52.80000109.7F41 V42 I120 T121F41-S58 CarbonylContact C-O 3.57Å; F41-S58 WeakPolarHBondContact CA-O 3.38Å; V42-S58 PolarHBondContact N-O 3.33Å; V42-S58 PolarHBondContact O-N 2.85Å; S58-I120 CarbonylContact C-O 3.59Å; S58-I120 WeakPolarHBondContact CA-O 3.24Å; S58-T121 WeakPolarHBondContact OG-CG2 3.43Å
59A89.4Confident81.9Confident0 Ų060.9 Ų60.90%034%0.344CS..EExtended strand (participates in β ladder)trans-84.4110.6166.700000109.3V39 S40 F41 N119 I120 F122 F136V39-A59 HydrophobicContact CG1-CB 4.01Å; S40-A59 CarbonylContact O-C 3.42Å; F41-A59 HydrophobicContact CD1-CB 4.08Å; F41-A59 HydrophobicContact CE1-CB 3.99Å; A59-N119 WeakPolarHBondContact O-CA 3.21Å; A59-I120 PolarHBondContact N-O 3.27Å; A59-I120 PolarHBondContact O-N 3.46Å; A59-F122 HydrophobicContact CB-CE1 4.13Å; A59-F136 HydrophobicContact CB-CD2 3.94Å; A59-F136 HydrophobicContact CB-CE2 3.55Å; A59-F136 HydrophobicContact CB-CZ 3.88Å
60L88.2Confident80Confident28 Ų2863 Ų6315%0.14736%0.363CS..EExtended strand (participates in β ladder)trans-86.1107172.2173.168.3000108.6V39 S40 R62 N117 N119V39-L60 WeakPolarHBondContact CA-O 3.46Å; S40-L60 PolarHBondContact N-O 3.35Å; S40-L60 PolarHBondContact O-N 2.96Å; S40-L60 WeakPolarHBondContact OG-CB 3.31Å; S40-L60 PolarHBondContact OG-O 3.24Å; L60-R62 HydrophobicContact CG-CG 4.37Å; L60-N117 HydrophobicContact CD1-CB 3.8Å; L60-N119 WeakPolarHBondContact CD1-OD1 3.41Å
61V86.1Confident77.6Confident0 Ų065.6 Ų65.60%039%0.388CS..EExtended strand (participates in β ladder)trans-93117.7177.2-171.50000108.5I37 V39 Y63 F87 N117 K118 I120 F136I37-V61 HydrophobicContact CG2-CG1 3.68Å; V39-V61 HydrophobicContact CG2-CG1 4.43Å; V39-V61 HydrophobicContact CG2-CG2 4.28Å; V61-Y63 HydrophobicContact CB-CE2 4.32Å; V61-Y63 HydrophobicContact CG1-CE1 4.34Å; V61-Y63 HydrophobicContact CG1-CE2 3.91Å; V61-F87 HydrophobicContact CB-CZ 4.46Å; V61-F87 HydrophobicContact CG1-CE1 4.14Å; V61-F87 HydrophobicContact CG1-CZ 4.1Å; V61-F87 HydrophobicContact CG2-CE1 3.7Å; V61-F87 HydrophobicContact CG2-CZ 3.96Å; V61-N117 WeakPolarHBondContact O-CA 3.34Å; V61-K118 HydrophobicContact CB-CB 4.33Å; V61-K118 PolarHBondContact N-O 2.88Å; V61-K118 PolarHBondContact O-N 2.84Å; V61-I120 HydrophobicContact CG2-CD1 4.19Å; V61-F136 HydrophobicContact CG2-CE1 4.4Å; V61-F136 HydrophobicContact CG2-CZ 4.09Å
62R82.5Confident75.4Confident117 Ų11771 Ų7144%0.44242%0.416SS..EExtended strand (participates in β ladder)trans-102.8138.9174.7-62-170.9178.6165.21.4109.7I37 N38 L60I37-R62 WeakPolarHBondContact CA-O 3.32Å; N38-R62 PolarHBondContact N-O 3.24Å; N38-R62 PolarHBondContact O-N 3.1Å; L60-R62 HydrophobicContact CG-CG 4.37Å
63Y81.1Confident73.2Confident25 Ų2569.6 Ų69.610%0.09841%0.409CS..EExtended strand (participates in β ladder)trans-114.8114.2179-58.4-95.4000108.2Y35 A36 I37 V61 L85 L109 N116 K118Y35-Y63 AromaticContact CD2-CD1 3.68Å; Y35-Y63 HydrophobicContact CD2-CD1 3.68Å; Y35-Y63 HydrophobicContact CD2-CE1 4.42Å; Y35-Y63 AromaticContact CE2-CD1 3.65Å; Y35-Y63 HydrophobicContact CE2-CD1 3.65Å; Y35-Y63 AromaticContact CE2-CE1 3.93Å; Y35-Y63 HydrophobicContact CE2-CE1 3.93Å; A36-Y63 WeakPolarHBondContact O-CA 3.43Å; I37-Y63 HydrophobicContact CG1-CD1 4.38Å; V61-Y63 HydrophobicContact CB-CE2 4.32Å; V61-Y63 HydrophobicContact CG1-CE1 4.34Å; V61-Y63 HydrophobicContact CG1-CE2 3.91Å; Y63-L85 HydrophobicContact CE1-CD1 3.88Å; Y63-L109 HydrophobicContact CE1-CD2 4.2Å; Y63-N116 WeakPolarHBondContact CD2-O 3.41Å; Y63-N116 WeakPolarHBondContact CE2-O 3.43Å; Y63-K118 HydrophobicContact CE2-CB 3.99Å
64D76.9Confident70.8Confident87 Ų8776.1 Ų76.147%0.46543%0.429SS..EExtended strand (participates in β ladder)trans-106.2130.7178.4-62.7-47.5000108.9Y35 A36 V66Y35-D64 CarbonylContact C-O 3.55Å; Y35-D64 WeakPolarHBondContact CA-O 3.05Å; A36-D64 HydrophobicContact CB-CB 4.43Å; A36-D64 PolarHBondContact N-O 3.03Å; A36-D64 PolarHBondContact O-N 3.42Å; D64-V66 PolarHBondContact O-N 3.28Å
65A70.5Confident68.4Low91 Ų9176.6 Ų76.675%0.75243%0.431SS*.EExtended strand (participates in β ladder)trans-68.3129.5175.100000109.5T67A65-T67 PolarHBondContact O-N 2.96Å
66V67.3Low66.4Low47 Ų4784.4 Ų84.429%0.28547%0.468SS..  trans-79.8115.2176.9-1800000108.6A36 D64 V80A36-V66 HydrophobicContact CB-CG2 4.13Å; D64-V66 PolarHBondContact O-N 3.28Å; V66-V80 HydrophobicContact CG2-CG1 4.34Å; V66-V80 HydrophobicContact CG2-CG2 4.32Å
67T64.2Low64.3Low87 Ų8784.5 Ų84.553%0.53447%0.468SS..  trans-80.7132.4171.952.90000110A65 D69 A70A65-T67 PolarHBondContact O-N 2.96Å; T67-D69 PolarHBondContact O-N 3.39Å; T67-D69 VanDerWaalsContact O-N 3.08Å; T67-A70 PolarHBondContact O-N 2.78Å; T67-A70 VanDerWaalsContact O-N 3.1Å
68P55.6Low62.5Low108 Ų10890.7 Ų90.770%0.70150%0.497SS*.THydrogen-bonded Turntrans-60.2-21.8-176.718.4-29.2000114.9
69D51.8Low61.5Low159 Ų15991.4 Ų91.485%0.8550%0.496SS*.THydrogen-bonded Turntrans-89.3-7-179.5-60.5-35.1000114.1T67 A71T67-D69 PolarHBondContact O-N 3.39Å; T67-D69 VanDerWaalsContact O-N 3.08Å; D69-A71 PolarHBondContact O-N 3.42Å
70A50.2Low60.8Low54 Ų5493.3 Ų93.345%0.44651%0.507SS..SBendtrans-69.7119.7171.100000107T67 I72T67-A70 PolarHBondContact O-N 2.78Å; T67-A70 VanDerWaalsContact O-N 3.1Å; A70-I72 PolarHBondContact O-N 2.94Å
71A40.3Very low60.3Low91 Ų9192 Ų9275%0.75250%0.5SS*.  trans-45.1119.816900000107D69 D73D69-A71 PolarHBondContact O-N 3.42Å; A71-D73 PolarHBondContact O-N 3.27Å
72I44.6Very low59.7Low150 Ų15095.7 Ų95.777%0.76952%0.515SS*.  trans-6289.6168.7-59.4169.8000103.5A70 Y74A70-I72 PolarHBondContact O-N 2.94Å; I72-Y74 PolarHBondContact O-N 2.99Å
73D43.8Very low59.4Low94 Ų9492 Ų9250%0.50351%0.507SS..  trans-61.8117.4177.2-166.25.8000104.6A71 D75A71-D73 PolarHBondContact O-N 3.27Å; D73-D75 PolarHBondContact O-N 2.88Å; D73-D75 VanDerWaalsContact O-N 3.17Å; D73-D75 VanDerWaalsContact O-O 3.11Å; D73-D75 PolarHBondContact OD1-N 3.11Å
74Y41.4Very low59.3Low220 Ų22095 Ų9586%0.86353%0.525SS*.SBendtrans-67.1-8.1178-82.4-91.2000110.9I72 E76I72-Y74 PolarHBondContact O-N 2.99Å; Y74-E76 PolarHBondContact O-N 3.1Å
75D41.1Very low59.3Low108 Ų10891.4 Ų91.458%0.57851%0.505SS*.SBendtrans-66.5123.5163.1-88.8-1.6000109.5D73 T77D73-D75 PolarHBondContact O-N 2.88Å; D73-D75 VanDerWaalsContact O-N 3.17Å; D73-D75 VanDerWaalsContact O-O 3.11Å; D73-D75 PolarHBondContact OD1-N 3.11Å; D75-T77 HydrophobicContact CB-CG2 4.14Å; D75-T77 PolarHBondContact O-N 3.25Å; D75-T77 PolarHBondContact O-OG1 3.04Å
76E49.1Very low59.8Low187 Ų18792.8 Ų92.887%0.87450%0.496SS*.THydrogen-bonded Turntrans-59.221.7-177.4-55.3-177147.400115.7Y74Y74-E76 PolarHBondContact O-N 3.1Å
77T46.3Very low60.6Low89 Ų8992.5 Ų92.555%0.54649%0.491SS..THydrogen-bonded Turntrans-73.7-37.7-175.5580000112.6D75D75-T77 HydrophobicContact CB-CG2 4.14Å; D75-T77 PolarHBondContact O-N 3.25Å; D75-T77 PolarHBondContact O-OG1 3.04Å
78H52.6Low61.5Low131 Ų13192.9 Ų92.961%0.60649%0.486SS*.SBendtrans-97.9104.4179.5-67.873.5000110.4V80H78-V80 PolarHBondContact O-N 2.9Å
79K69.5Low63.1Low46 Ų4688 Ų8820%0.245%0.454CS..EExtended strand (participates in β ladder)trans-83.990.4178.9-66.2-176.6-171177.10109I37 H150 T151 F152I37-K79 PolarHBondContact N-O 2.9Å; I37-K79 VanDerWaalsContact N-O 3.11Å; K79-H150 HydrophobicContact CB-CB 4.45Å; K79-H150 HydrophobicContact CD-CB 3.62Å; K79-H150 WeakPolarHBondContact CD-ND1 3.36Å; K79-H150 HydrophobicContact CG-CB 4.49Å; K79-H150 WeakPolarHBondContact CG-ND1 3.42Å; K79-T151 PolarHBondContact NZ-O 3.34Å; K79-F152 HydrophobicContact CD-CE1 4.39Å; K79-F152 HydrophobicContact CD-CE2 4.3Å; K79-F152 HydrophobicContact CD-CZ 3.77Å
80V73.3Confident64.9Low40 Ų4082.3 Ų82.324%0.24243%0.425CS..EExtended strand (participates in β ladder)trans-84.2135.8-174.7-176.40000111.5Y35 V66 H78 Y82Y35-V80 WeakPolarHBondContact O-CA 3.5Å; V66-V80 HydrophobicContact CG2-CG1 4.34Å; V66-V80 HydrophobicContact CG2-CG2 4.32Å; H78-V80 PolarHBondContact O-N 2.9Å; V80-Y82 HydrophobicContact CG1-CE2 3.91Å
81C77.6Confident66.9Low0 Ų081.2 Ų81.20%041%0.414CS..EExtended strand (participates in β ladder)trans-126.8146179.5-70.90000112.4S34 Y35 I37 C140S34-C81 WeakPolarHBondContact CA-O 3.48Å; Y35-C81 HydrophobicContact CD2-CB 4.38Å; Y35-C81 HydrophobicContact CE1-CB 4.35Å; Y35-C81 HydrophobicContact CE2-CB 3.8Å; Y35-C81 PolarHBondContact N-O 3.42Å; Y35-C81 PolarHBondContact O-N 3.24Å; I37-C81 HydrophobicContact CD1-CB 3.93Å; I37-C81 WeakPolarHBondContact CD1-SG 3.26Å; C81-C140 VanDerWaalsContact CA-SG 3.57Å; C81-C140 HydrophobicContact CB-CB 3.49Å; C81-C140 VanDerWaalsContact CB-CB 3.49Å; C81-C140 WeakPolarHBondContact CB-SG 3.31Å; C81-C140 WeakPolarHBondContact SG-CB 3.48Å; C81-C140 CovalentContact SG-SG 2.01Å; C81-C140 PolarHBondContact SG-SG 3.41Å
82Y74.7Confident69.3Low78 Ų7880.2 Ų80.231%0.30640%0.396SS..SBendtrans-117.7-3-179-63.9-97.8000113.9M30 V80 S141 D142 S143M30-Y82 HydrophobicContact CB-CD1 4.48Å; M30-Y82 HydrophobicContact CB-CE1 4.18Å; M30-Y82 WeakPolarHBondContact O-CE1 3.46Å; V80-Y82 HydrophobicContact CG1-CE2 3.91Å; Y82-S141 WeakPolarHBondContact CB-O 3.18Å; Y82-S141 PolarHBondContact N-O 3.15Å; Y82-D142 VanDerWaalsContact CD2-C 3.44Å; Y82-S143 VanDerWaalsContact CE2-N 3.26Å
83S76.1Confident71.5Confident40 Ų4074.5 Ų74.528%0.2837%0.368SS..SBendtrans-130.5175177.672.80000110.9Y35 S141Y35-S83 PolarHBondContact OH-O 3.48Å; S83-S141 PolarHBondContact OG-N 2.84Å; S83-S141 PolarHBondContact OG-OG 2.86Å
84D77.6Confident73.7Confident88 Ų8874.1 Ų74.147%0.47137%0.37SS..  trans-58.9145171.5-62.2-33.7000112.6L109D84-L109 HydrophobicContact CB-CD1 4.43Å; D84-L109 WeakPolarHBondContact OD1-CB 3.15Å; D84-L109 WeakPolarHBondContact OD1-CD1 3.41Å
85L77.3Confident76Confident11 Ų1170.3 Ų70.36%0.05836%0.358CS..  trans-78.8135.6175.2-91.282.1000112Y35 I37 Y63 F87 A138 I139Y35-L85 HydrophobicContact CE2-CD1 3.39Å; Y35-L85 WeakPolarHBondContact OH-CD1 3.46Å; I37-L85 HydrophobicContact CD1-CD1 3.48Å; I37-L85 VanDerWaalsContact CD1-CD1 3.48Å; I37-L85 HydrophobicContact CD1-CD2 3.71Å; I37-L85 HydrophobicContact CD1-CG 3.95Å; I37-L85 HydrophobicContact CG1-CD1 4.04Å; I37-L85 HydrophobicContact CG1-CD2 4.16Å; I37-L85 HydrophobicContact CG2-CD2 4.42Å; Y63-L85 HydrophobicContact CE1-CD1 3.88Å; L85-F87 HydrophobicContact CB-CD2 4.46Å; L85-F87 HydrophobicContact CB-CE1 4.36Å; L85-F87 HydrophobicContact CB-CE2 3.82Å; L85-F87 HydrophobicContact CB-CZ 3.79Å; L85-F87 HydrophobicContact CD2-CD1 4.21Å; L85-F87 HydrophobicContact CD2-CE1 3.29Å; L85-F87 HydrophobicContact CD2-CE2 4.17Å; L85-F87 HydrophobicContact CD2-CZ 3.29Å; L85-F87 HydrophobicContact CG-CE1 4.44Å; L85-F87 HydrophobicContact CG-CZ 4.18Å; L85-A138 HydrophobicContact CD2-CB 3.63Å; L85-A138 HydrophobicContact CG-CB 4.45Å; L85-I139 WeakPolarHBondContact CA-O 3.36Å
86Q80.5Confident78.4Confident120 Ų12066.7 Ų66.756%0.56134%0.339SS*.EExtended strand (participates in β ladder)trans-105.6141.3155.8-61.9-175.5100109.8A138 I139Q86-A138 CarbonylContact O-C 3.54Å; Q86-A138 WeakPolarHBondContact O-CA 3.17Å; Q86-I139 HydrophobicContact CB-CB 4.34Å; Q86-I139 PolarHBondContact N-O 3.17Å; Q86-I139 PolarHBondContact O-N 3.34Å
87F84.1Confident80.4Confident41 Ų4157.8 Ų57.818%0.1830%0.297CS..EExtended strand (participates in β ladder)trans-112.9140.5179.3-60.1-82.5000110.1V61 L85 K118 I120 F136 E137 A138V61-F87 HydrophobicContact CB-CZ 4.46Å; V61-F87 HydrophobicContact CG1-CE1 4.14Å; V61-F87 HydrophobicContact CG1-CZ 4.1Å; V61-F87 HydrophobicContact CG2-CE1 3.7Å; V61-F87 HydrophobicContact CG2-CZ 3.96Å; L85-F87 HydrophobicContact CB-CD2 4.46Å; L85-F87 HydrophobicContact CB-CE1 4.36Å; L85-F87 HydrophobicContact CB-CE2 3.82Å; L85-F87 HydrophobicContact CB-CZ 3.79Å; L85-F87 HydrophobicContact CD2-CD1 4.21Å; L85-F87 HydrophobicContact CD2-CE1 3.29Å; L85-F87 HydrophobicContact CD2-CE2 4.17Å; L85-F87 HydrophobicContact CD2-CZ 3.29Å; L85-F87 HydrophobicContact CG-CE1 4.44Å; L85-F87 HydrophobicContact CG-CZ 4.18Å; F87-K118 HydrophobicContact CE2-CD 4.1Å; F87-I120 HydrophobicContact CB-CD1 3.93Å; F87-I120 HydrophobicContact CD1-CD1 3.56Å; F87-I120 HydrophobicContact CD2-CD1 3.3Å; F87-I120 HydrophobicContact CE1-CD1 3.71Å; F87-I120 HydrophobicContact CE2-CD1 3.5Å; F87-I120 HydrophobicContact CG-CD1 3.29Å; F87-I120 HydrophobicContact CZ-CD1 3.67Å; F87-F136 HydrophobicContact CB-CZ 4.43Å; F87-F136 AromaticContact CD1-CE1 3.62Å; F87-F136 HydrophobicContact CD1-CE1 3.62Å; F87-F136 HydrophobicContact CD1-CE2 4.29Å; F87-F136 AromaticContact CD1-CZ 3.31Å; F87-F136 HydrophobicContact CD1-CZ 3.31Å; F87-F136 AromaticContact CE1-CE1 3.96Å; F87-F136 HydrophobicContact CE1-CE1 3.96Å; F87-F136 AromaticContact CE1-CZ 3.79Å; F87-F136 HydrophobicContact CE1-CZ 3.79Å; F87-F136 HydrophobicContact CG-CZ 4.16Å; F87-E137 CarbonylContact C-O 3.46Å; F87-E137 WeakPolarHBondContact CA-O 3.44Å; F87-A138 HydrophobicContact CD1-CB 4.27Å; F87-A138 HydrophobicContact CE1-CB 4.25Å
88K84.8Confident82.6Confident95 Ų9554.2 Ų54.241%0.41328%0.277SS..EExtended strand (participates in β ladder)trans-136.8129.8174.9-177.6178.5179.7-174.50109.3T90 E137K88-T90 HydrophobicContact CD-CG2 4.33Å; K88-T90 HydrophobicContact CG-CG2 4.06Å; K88-E137 HydrophobicContact CB-CB 4.33Å; K88-E137 PolarHBondContact N-O 2.74Å; K88-E137 PolarHBondContact O-N 3.23Å
89V89.1Confident84.4Confident6 Ų649.1 Ų49.14%0.03626%0.255CS..EExtended strand (participates in β ladder)trans-114.9123.7178-166.10000108.6V99 Y101 F122 V134 R135 F136V89-V99 HydrophobicContact CB-CG1 4.43Å; V89-V99 HydrophobicContact CG1-CG1 3.65Å; V89-Y101 HydrophobicContact CB-CD1 4.32Å; V89-Y101 HydrophobicContact CB-CG 4.23Å; V89-F122 HydrophobicContact CG1-CB 4.5Å; V89-F122 HydrophobicContact CG1-CD1 4.22Å; V89-F122 HydrophobicContact CG1-CD2 4.1Å; V89-F122 HydrophobicContact CG1-CE1 4.49Å; V89-F122 HydrophobicContact CG1-CE2 4.37Å; V89-F122 HydrophobicContact CG1-CG 4.02Å; V89-F122 HydrophobicContact CG2-CD1 4.25Å; V89-V134 HydrophobicContact CG1-CG1 3.5Å; V89-V134 VanDerWaalsContact CG1-CG1 3.5Å; V89-R135 WeakPolarHBondContact CA-O 3.46Å; V89-F136 HydrophobicContact CG2-CD2 3.78Å; V89-F136 HydrophobicContact CG2-CE2 4.15Å
90T89.4Confident85.2Confident40 Ų4051.6 Ų51.625%0.24527%0.27CS..EExtended strand (participates in β ladder)trans-135150.7-178.953.30000111.5K88 R135K88-T90 HydrophobicContact CD-CG2 4.33Å; K88-T90 HydrophobicContact CG-CG2 4.06Å; T90-R135 PolarHBondContact N-O 3.09Å; T90-R135 PolarHBondContact O-N 3.46Å
91S91.9Very high85.4Confident30 Ų3053.6 Ų53.621%0.2127%0.274CS..EExtended strand (participates in β ladder)trans-89.8124.1170.3176.50000109.9T93 I97S91-T93 VanDerWaalsContact C-N 3.26Å; S91-T93 VanDerWaalsContact OG-C 3.23Å; S91-T93 PolarHBondContact OG-N 3Å; S91-T93 PolarHBondContact OG-O 3.35Å; S91-I97 WeakPolarHBondContact OG-CG1 3.26Å; S91-I97 PolarHBondContact OG-O 2.8Å
92L91Very high84.6Confident70 Ų7061.4 Ų61.437%0.36631%0.31SS..SBendtrans-77.5-18.3171.8-59.8-176.6000112.7P94 F133 R135 L153L92-P94 VanDerWaalsContact C-CD 3.42Å; L92-P94 WeakPolarHBondContact O-CD 3.32Å; L92-F133 HydrophobicContact CB-CB 4.24Å; L92-F133 HydrophobicContact CD1-CB 4.17Å; L92-F133 PolarHBondContact N-O 3.28Å; L92-R135 HydrophobicContact CD1-CB 4.19Å; L92-R135 HydrophobicContact CD2-CB 3.9Å; L92-R135 VanDerWaalsContact CD2-CZ 3.48Å; L92-R135 VanDerWaalsContact CD2-NH2 3.32Å; L92-R135 HydrophobicContact CG-CB 3.9Å; L92-L153 HydrophobicContact CD1-CD2 3.64Å
93T91Very high83.5Confident31 Ų3163.1 Ų63.119%0.1933%0.325CS..  trans-128.666.7-175.150.50000109.1S91 K95 I96 I97 G132 F133S91-T93 VanDerWaalsContact C-N 3.26Å; S91-T93 VanDerWaalsContact OG-C 3.23Å; S91-T93 PolarHBondContact OG-N 3Å; S91-T93 PolarHBondContact OG-O 3.35Å; T93-K95 PolarHBondContact O-N 2.7Å; T93-I96 HydrophobicContact CG2-CD1 4.44Å; T93-I96 PolarHBondContact O-N 3.02Å; T93-I97 PolarHBondContact O-N 3.25Å; T93-G132 WeakPolarHBondContact OG1-CA 3.32Å; T93-F133 HydrophobicContact CG2-CD2 4.1Å; T93-F133 PolarHBondContact OG1-N 3.05Å
94P89.6Confident82.3Confident85 Ų8567.2 Ų67.255%0.55234%0.343SS*.THydrogen-bonded Turntrans-63.3-17.5-173.925.1-35.3000113.7L92 I97L92-P94 VanDerWaalsContact C-CD 3.42Å; L92-P94 WeakPolarHBondContact O-CD 3.32Å; P94-I97 WeakPolarHBondContact CA-O 3.26Å
95K90.3Very high80.7Confident140 Ų14067.9 Ų67.961%0.60935%0.354SS*.THydrogen-bonded Turntrans-72.5-28.8172.8-170.8177.8177.3-1740112.7T93 F128T93-K95 PolarHBondContact O-N 2.7Å; K95-F128 VanDerWaalsContact O-CB 3.3Å; K95-F128 WeakPolarHBondContact O-CB 3.22Å
96I90Very high79Confident32 Ų3271.1 Ų71.116%0.16438%0.383CS..THydrogen-bonded Turntrans-101.7-44.7-173.2-58.4175.1000110.5T93 K127 F128 H131 V158T93-I96 HydrophobicContact CG2-CD1 4.44Å; T93-I96 PolarHBondContact O-N 3.02Å; I96-K127 WeakPolarHBondContact O-CA 3.46Å; I96-K127 PolarHBondContact O-N 3.41Å; I96-F128 VanDerWaalsContact CG2-O 3.28Å; I96-F128 WeakPolarHBondContact CG2-O 3.09Å; I96-F128 PolarHBondContact O-N 3.36Å; I96-H131 VanDerWaalsContact CD1-O 3.31Å; I96-H131 WeakPolarHBondContact CD1-O 3.4Å; I96-V158 HydrophobicContact CG2-CB 4.35Å; I96-V158 HydrophobicContact CG2-CG2 4.13Å
97I92.6Very high77.2Confident0 Ų072.5 Ų72.50%039%0.391CS..EExtended strand (participates in β ladder)trans-132.8141.8179.758.3171.6000111.2S91 T93 P94 V124 T125 V134 V158S91-I97 WeakPolarHBondContact OG-CG1 3.26Å; S91-I97 PolarHBondContact OG-O 2.8Å; T93-I97 PolarHBondContact O-N 3.25Å; P94-I97 WeakPolarHBondContact CA-O 3.26Å; I97-V124 HydrophobicContact CB-CG1 4.09Å; I97-V124 HydrophobicContact CD1-CG1 4.23Å; I97-V124 HydrophobicContact CG2-CG1 4.17Å; I97-T125 WeakPolarHBondContact CA-O 3.44Å; I97-V134 HydrophobicContact CD1-CG2 3.55Å; I97-V158 HydrophobicContact CG2-CG2 3.52Å
98A92.2Very high75.1Confident15 Ų1578.4 Ų78.412%0.12442%0.419CS..EExtended strand (participates in β ladder)trans-101.8152.2161.800000109.8V124 T125 K127A98-V124 WeakPolarHBondContact O-CA 3.26Å; A98-T125 PolarHBondContact N-O 3.28Å; A98-T125 PolarHBondContact O-N 3.5Å; A98-K127 HydrophobicContact CB-CD 4.02Å; A98-K127 HydrophobicContact CB-CG 4.37Å
99V90.3Very high73.2Confident23 Ų2376.3 Ų76.314%0.13941%0.412CS..EExtended strand (participates in β ladder)trans-126.9117.9174.3-1780000106.9V89 F122 V123 V124 V134V89-V99 HydrophobicContact CB-CG1 4.43Å; V89-V99 HydrophobicContact CG1-CG1 3.65Å; V99-F122 HydrophobicContact CG1-CB 4.15Å; V99-F122 HydrophobicContact CG1-CD2 3.8Å; V99-F122 HydrophobicContact CG1-CG 4.3Å; V99-V123 WeakPolarHBondContact CA-O 3.29Å; V99-V124 HydrophobicContact CG2-CG2 4.43Å; V99-V134 HydrophobicContact CG2-CB 4.39Å; V99-V134 HydrophobicContact CG2-CG1 4Å; V99-V134 HydrophobicContact CG2-CG2 3.64Å
100D86.2Confident70.7Confident99 Ų9980.1 Ų80.153%0.52944%0.437SS..EExtended strand (participates in β ladder)trans-100.8117.1170.9-59.9-43000106.2V123D100-V123 PolarHBondContact N-O 2.73Å; D100-V123 PolarHBondContact O-N 3.3Å
101Y77.5Confident68.3Low82 Ų8284.8 Ų84.832%0.32247%0.468SS..EExtended strand (participates in β ladder)trans-123.7136.7175.483.6-85.3000107.5V89 D103V89-Y101 HydrophobicContact CB-CD1 4.32Å; V89-Y101 HydrophobicContact CB-CG 4.23Å; Y101-D103 HydrophobicContact CE2-CB 4.25Å; Y101-D103 WeakPolarHBondContact CE2-OD1 3.42Å; Y101-D103 VanDerWaalsContact CZ-OD1 3.24Å; Y101-D103 PolarHBondContact O-N 3.43Å; Y101-D103 VanDerWaalsContact OH-CG 3.29Å; Y101-D103 PolarHBondContact OH-OD1 2.84Å; Y101-D103 PolarHBondContact OH-OD2 2.94Å
102E59.6Low65.9Low163 Ų16386 Ų8676%0.76249%0.485SS*.  trans-75.3123.5167.2-71.2-179172.500107.1L104E102-L104 PolarHBondContact O-N 3.37Å
103D52.7Low63.6Low115 Ų11593.1 Ų93.162%0.61551%0.513SS*.  trans-61.282.2163.4-90.6-43.2000107.3Y101 S105Y101-D103 HydrophobicContact CE2-CB 4.25Å; Y101-D103 WeakPolarHBondContact CE2-OD1 3.42Å; Y101-D103 VanDerWaalsContact CZ-OD1 3.24Å; Y101-D103 PolarHBondContact O-N 3.43Å; Y101-D103 VanDerWaalsContact OH-CG 3.29Å; Y101-D103 PolarHBondContact OH-OD1 2.84Å; Y101-D103 PolarHBondContact OH-OD2 2.94Å; D103-S105 PolarHBondContact O-N 3.11Å
104L50.1Low61.5Low126 Ų12694.9 Ų94.966%0.6653%0.527SS*.  trans-66.977.2155.6-89.6146.6000105.8E102 A106E102-L104 PolarHBondContact O-N 3.37Å; L104-A106 PolarHBondContact O-N 3.33Å
105S45.4Very low59.7Low101 Ų10195.7 Ų95.771%0.70653%0.532SS*.  trans-33.1127.3172.815.20000109.6D103 M107D103-S105 PolarHBondContact O-N 3.11Å; S105-M107 PolarHBondContact O-N 3.38Å
106A40.4Very low58.6Low79 Ų7993.2 Ų93.265%0.65353%0.526SS*.  trans-10.785.8171.600000114.2L104 E108L104-A106 PolarHBondContact O-N 3.33Å; A106-E108 PolarHBondContact O-N 2.85Å
107M42.6Very low57.9Low149 Ų14996 Ų9673%0.73454%0.541SS*.  trans-82.4114.4170.1-170.2144.7-172.600107.8S105 L109S105-M107 PolarHBondContact O-N 3.38Å; M107-L109 PolarHBondContact O-N 3.2Å
108E40.3Very low57.2Low165 Ų16599 Ų9977%0.77155%0.554SS**PPolyproline II helixtrans-46.1129.8175.4-64.9177.6165.500110A106A106-E108 PolarHBondContact O-N 2.85Å
109L44.1Very low56.8Low52 Ų52103.3 Ų103.327%0.27258%0.575SS.*PPolyproline II helixtrans-60.9130.4169.5-75.9166.8000107.1Y35 Y63 D84 M107 P111Y35-L109 HydrophobicContact CE1-CD1 4.27Å; Y35-L109 WeakPolarHBondContact OH-CD1 3.44Å; Y63-L109 HydrophobicContact CE1-CD2 4.2Å; D84-L109 HydrophobicContact CB-CD1 4.43Å; D84-L109 WeakPolarHBondContact OD1-CB 3.15Å; D84-L109 WeakPolarHBondContact OD1-CD1 3.41Å; M107-L109 PolarHBondContact O-N 3.2Å; L109-P111 WeakPolarHBondContact O-CD 3.37Å
110P37.6Very low56.5Low85 Ų85103.2 Ų103.255%0.55257%0.573SS**PPolyproline II helixtrans-60.1127.8171.121.8-28.7000108.3G112P110-G112 PolarHBondContact O-N 3.07Å
111P38.5Very low56.6Low139 Ų139101.9 Ų101.990%0.90357%0.569SS**SBendtrans-68.5103.2176.126.9-30.8000107.9L109L109-P111 WeakPolarHBondContact O-CD 3.37Å
112G41.6Very low57.2Low55 Ų5598 Ų9857%0.56755%0.554SS**SBendtrans132.8117.9168.100000114.8P110 S114P110-G112 PolarHBondContact O-N 3.07Å; G112-S114 PolarHBondContact O-N 2.76Å
113K43.3Very low58.7Low220 Ų22092.3 Ų92.396%0.95753%0.53SS*.  trans33.770.6145.3-63.4-175.6179.4-178.90116
114S47.4Very low60.6Low67 Ų6786.8 Ų86.847%0.46950%0.5SS..  trans-153130.4146.7-172.80000108.4G112 N116G112-S114 PolarHBondContact O-N 2.76Å; S114-N116 VanDerWaalsContact CB-OD1 3.25Å; S114-N116 WeakPolarHBondContact CB-OD1 3.46Å; S114-N116 PolarHBondContact O-N 3.45Å; S114-N116 PolarHBondContact OG-OD1 3.38Å
115P52.3Low62.7Low103 Ų10381.8 Ų81.867%0.66948%0.475SS*.  trans-67.276.5165.629.6-31.6000107.9N117P115-N117 PolarHBondContact O-N 3.43Å
116N66.6Low65Low88 Ų8877 Ų7747%0.47144%0.441SS..  trans-83.6102.2178.1-76-16.3000107.3Y63 S114 K118Y63-N116 WeakPolarHBondContact CD2-O 3.41Å; Y63-N116 WeakPolarHBondContact CE2-O 3.43Å; S114-N116 VanDerWaalsContact CB-OD1 3.25Å; S114-N116 WeakPolarHBondContact CB-OD1 3.46Å; S114-N116 PolarHBondContact O-N 3.45Å; S114-N116 PolarHBondContact OG-OD1 3.38Å; N116-K118 PolarHBondContact O-N 3.26Å
117N74Confident67.4Low91 Ų9178.9 Ų78.949%0.48744%0.435SS..  trans-56.6131.7166.3-68.1-18.8000109.3L60 V61 P115L60-N117 HydrophobicContact CD1-CB 3.8Å; V61-N117 WeakPolarHBondContact O-CA 3.34Å; P115-N117 PolarHBondContact O-N 3.43Å
118K78.3Confident69.8Low62 Ų6273.2 Ų73.227%0.2741%0.406SS..EExtended strand (participates in β ladder)trans-110130.2175.9-170.9172.8-175.71730109.6V61 Y63 F87 N116 I120V61-K118 HydrophobicContact CB-CB 4.33Å; V61-K118 PolarHBondContact N-O 2.88Å; V61-K118 PolarHBondContact O-N 2.84Å; Y63-K118 HydrophobicContact CE2-CB 3.99Å; F87-K118 HydrophobicContact CE2-CD 4.1Å; N116-K118 PolarHBondContact O-N 3.26Å; K118-I120 HydrophobicContact CG-CG1 4.37Å
119N83.6Confident72.2Confident105 Ų10565.6 Ų65.656%0.56137%0.371SS*.EExtended strand (participates in β ladder)trans-103.9119.8176-67.7-0.9000108.9A59 L60A59-N119 WeakPolarHBondContact O-CA 3.21Å; L60-N119 WeakPolarHBondContact CD1-OD1 3.41Å
120I85.7Confident74.5Confident21 Ų2163.3 Ų63.311%0.10836%0.359CS..EExtended strand (participates in β ladder)trans-111.5121.1174.5-65.9164.3000107.4S58 A59 V61 F87 K118 F136S58-I120 CarbonylContact C-O 3.59Å; S58-I120 WeakPolarHBondContact CA-O 3.24Å; A59-I120 PolarHBondContact N-O 3.27Å; A59-I120 PolarHBondContact O-N 3.46Å; V61-I120 HydrophobicContact CG2-CD1 4.19Å; F87-I120 HydrophobicContact CB-CD1 3.93Å; F87-I120 HydrophobicContact CD1-CD1 3.56Å; F87-I120 HydrophobicContact CD2-CD1 3.3Å; F87-I120 HydrophobicContact CE1-CD1 3.71Å; F87-I120 HydrophobicContact CE2-CD1 3.5Å; F87-I120 HydrophobicContact CG-CD1 3.29Å; F87-I120 HydrophobicContact CZ-CD1 3.67Å; K118-I120 HydrophobicContact CG-CG1 4.37Å; I120-F136 HydrophobicContact CB-CE2 4.32Å; I120-F136 HydrophobicContact CD1-CE2 4.27Å; I120-F136 HydrophobicContact CD1-CZ 3.92Å; I120-F136 HydrophobicContact CG2-CE2 4.18Å
121T87.9Confident77.2Confident71 Ų7161.3 Ų61.344%0.43634%0.343SS..EExtended strand (participates in β ladder)trans-102.7140.3179.9650000110.1V57 S58V57-T121 WeakPolarHBondContact O-CA 3.39Å; S58-T121 WeakPolarHBondContact OG-CG2 3.43Å
122F89.5Confident79.7Confident2 Ų254.7 Ų54.71%0.00930%0.3CS..EExtended strand (participates in β ladder)trans-143151.5173.155.5-89.5000108.8F41 V57 A59 V89 V99 V124 V134 F136F41-F122 HydrophobicContact CD1-CE1 4.48Å; F41-F122 HydrophobicContact CD1-CZ 4.2Å; F41-F122 HydrophobicContact CE1-CE1 4.3Å; F41-F122 HydrophobicContact CE1-CZ 4.09Å; V57-F122 HydrophobicContact CB-CD2 4.15Å; V57-F122 HydrophobicContact CB-CE1 4.31Å; V57-F122 HydrophobicContact CB-CE2 3.61Å; V57-F122 HydrophobicContact CB-CZ 3.7Å; V57-F122 HydrophobicContact CG1-CE1 4.13Å; V57-F122 HydrophobicContact CG1-CE2 3.92Å; V57-F122 HydrophobicContact CG1-CZ 3.51Å; V57-F122 HydrophobicContact CG2-CE2 4.2Å; V57-F122 PolarHBondContact N-O 3.29Å; V57-F122 PolarHBondContact O-N 2.88Å; A59-F122 HydrophobicContact CB-CE1 4.13Å; V89-F122 HydrophobicContact CG1-CB 4.5Å; V89-F122 HydrophobicContact CG1-CD1 4.22Å; V89-F122 HydrophobicContact CG1-CD2 4.1Å; V89-F122 HydrophobicContact CG1-CE1 4.49Å; V89-F122 HydrophobicContact CG1-CE2 4.37Å; V89-F122 HydrophobicContact CG1-CG 4.02Å; V89-F122 HydrophobicContact CG2-CD1 4.25Å; V99-F122 HydrophobicContact CG1-CB 4.15Å; V99-F122 HydrophobicContact CG1-CD2 3.8Å; V99-F122 HydrophobicContact CG1-CG 4.3Å; F122-V124 HydrophobicContact CD2-CG2 3.77Å; F122-V124 HydrophobicContact CE2-CG2 3.67Å; F122-V134 HydrophobicContact CD2-CG1 4.46Å; F122-V134 HydrophobicContact CE2-CB 4.49Å; F122-V134 HydrophobicContact CE2-CG1 3.82Å; F122-V134 HydrophobicContact CE2-CG2 4.45Å; F122-V134 HydrophobicContact CZ-CG1 4.22Å; F122-F136 HydrophobicContact CE1-CD2 4.29Å
123V90.9Very high82.2Confident42 Ų4255.5 Ų55.526%0.25529%0.288SS..EExtended strand (participates in β ladder)trans-101.8125.5-179.6-177.80000108.5N54 V99 D100N54-V123 HydrophobicContact CB-CG1 3.8Å; V99-V123 WeakPolarHBondContact CA-O 3.29Å; D100-V123 PolarHBondContact N-O 2.73Å; D100-V123 PolarHBondContact O-N 3.3Å
124V93.1Very high84.5Confident0 Ų045 Ų450%024%0.242CC..EExtended strand (participates in β ladder)trans-101.5123.5173.9-173.80000108.4N54 M55 V57 I97 A98 V99 F122 V134 V156N54-V124 CarbonylContact C-O 3.58Å; N54-V124 WeakPolarHBondContact CA-O 3.24Å; M55-V124 PolarHBondContact N-O 2.96Å; M55-V124 PolarHBondContact O-N 3.41Å; V57-V124 HydrophobicContact CG2-CG2 3.89Å; I97-V124 HydrophobicContact CB-CG1 4.09Å; I97-V124 HydrophobicContact CD1-CG1 4.23Å; I97-V124 HydrophobicContact CG2-CG1 4.17Å; A98-V124 WeakPolarHBondContact O-CA 3.26Å; V99-V124 HydrophobicContact CG2-CG2 4.43Å; F122-V124 HydrophobicContact CD2-CG2 3.77Å; F122-V124 HydrophobicContact CE2-CG2 3.67Å; V124-V134 HydrophobicContact CG1-CG2 4.34Å; V124-V134 HydrophobicContact CG2-CG2 3.93Å; V124-V156 HydrophobicContact CG1-CG1 4.49Å; V124-V156 HydrophobicContact CG1-CG2 4.27Å
125T93.3Very high86.6Confident21 Ų2146 Ų4613%0.12924%0.235CC..EExtended strand (participates in β ladder)trans-111.2125.5-179.1-58.40000109.5N54 I97 A98 K127N54-T125 WeakPolarHBondContact OD1-CG2 3.4Å; N54-T125 PolarHBondContact OD1-OG1 3.35Å; N54-T125 VanDerWaalsContact OD1-OG1 3.07Å; I97-T125 WeakPolarHBondContact CA-O 3.44Å; A98-T125 PolarHBondContact N-O 3.28Å; A98-T125 PolarHBondContact O-N 3.5Å; T125-K127 PolarHBondContact O-N 2.99Å
126G93.3Very high88.4Confident0 Ų041 Ų410%020%0.204CC..EExtended strand (participates in β ladder)trans-72.8123.5175.500000110.5L49 N52 D53L49-G126 VanDerWaalsContact CD2-N 3.32Å; N52-G126 WeakPolarHBondContact CA-O 3.48Å; N52-G126 PolarHBondContact N-O 3.12Å; D53-G126 PolarHBondContact O-N 2.85Å
127K92.4Very high89.4Confident118 Ų11837.9 Ų37.951%0.51319%0.186SC..  trans-104.6-39.7177.9-77.8-173.6164173.60113.4I96 A98 T125I96-K127 WeakPolarHBondContact O-CA 3.46Å; I96-K127 PolarHBondContact O-N 3.41Å; A98-K127 HydrophobicContact CB-CD 4.02Å; A98-K127 HydrophobicContact CB-CG 4.37Å; T125-K127 PolarHBondContact O-N 2.99Å
128F92.3Very high89.9Confident31 Ų3133.5 Ų33.514%0.13616%0.163CC..SBendtrans-152.2150.9-176.8-168.7-114.2000109.8E51 K95 I96 G130 V158 K304 V305E51-F128 WeakPolarHBondContact OE1-CA 3.44Å; K95-F128 VanDerWaalsContact O-CB 3.3Å; K95-F128 WeakPolarHBondContact O-CB 3.22Å; I96-F128 VanDerWaalsContact CG2-O 3.28Å; I96-F128 WeakPolarHBondContact CG2-O 3.09Å; I96-F128 PolarHBondContact O-N 3.36Å; F128-G130 PolarHBondContact O-N 2.9Å; F128-V158 WeakPolarHBondContact O-CB 3.25Å; F128-V158 WeakPolarHBondContact O-CG1 3.32Å; F128-K304 HydrophobicContact CE2-CB 4.08Å; F128-K304 HydrophobicContact CE2-CD 4.26Å; F128-K304 HydrophobicContact CZ-CB 3.79Å; F128-V305 HydrophobicContact CE1-CG2 3.75Å; F128-V305 HydrophobicContact CZ-CG2 3.66Å
129L91.4Very high90.2Very high5 Ų532.6 Ų32.63%0.02616%0.16CC..SBendtrans-52.9137.7176.473.896.3000112.5E51 V158 Y301 V305 I369E51-L129 PolarHBondContact OE1-N 3.45Å; L129-V158 VanDerWaalsContact CA-O 3.31Å; L129-V158 WeakPolarHBondContact CA-O 3.43Å; L129-Y301 HydrophobicContact CD2-CD2 3.39Å; L129-Y301 HydrophobicContact CD2-CE2 3.9Å; L129-Y301 HydrophobicContact CD2-CG 4.14Å; L129-V305 HydrophobicContact CD1-CG2 4.06Å; L129-V305 HydrophobicContact CD2-CG2 4.16Å; L129-V305 HydrophobicContact CG-CG2 4.39Å; L129-I369 HydrophobicContact CD1-CD1 3.99Å; L129-I369 HydrophobicContact CD1-CG1 3.36Å
130G92.4Very high90.2Very high3 Ų327.7 Ų27.73%0.03113%0.134CC..EExtended strand (participates in β ladder)trans145.3-177.4179.900000114.8F128 V158F128-G130 PolarHBondContact O-N 2.9Å; G130-V158 PolarHBondContact N-O 3.34Å; G130-V158 PolarHBondContact O-N 3.49Å
131H92.8Very high90.1Very high44 Ų4427.9 Ų27.920%0.20414%0.137CC..EExtended strand (participates in β ladder)trans-96.3112173.6-76.5108.1000109.9I96 F133 K155 D366I96-H131 VanDerWaalsContact CD1-O 3.31Å; I96-H131 WeakPolarHBondContact CD1-O 3.4Å; H131-F133 HydrophobicContact CB-CE2 4.4Å; H131-K155 WeakPolarHBondContact CD2-CE 3.33Å; H131-K155 WeakPolarHBondContact NE2-CE 3.5Å; H131-D366 IonicContact CE1-OD1 3.38Å; H131-D366 PolarHBondContact CE1-OD1 3.26Å; H131-D366 IonicContact CE1-OD2 2.91Å; H131-D366 PolarHBondContact CE1-OD2 3.45Å; H131-D366 IonicContact ND1-OD1 3.48Å; H131-D366 PolarHBondContact ND1-OD1 2.74Å
132G92.3Very high89.7Confident0 Ų025.8 Ų25.80%012%0.124CC..EExtended strand (participates in β ladder)trans-96.1149.2175.300000112.2T93 K155 V156T93-G132 WeakPolarHBondContact OG1-CA 3.32Å; G132-K155 CarbonylContact O-C 3.58Å; G132-K155 WeakPolarHBondContact O-CA 3.38Å; G132-V156 PolarHBondContact N-O 3.3Å; G132-V156 PolarHBondContact O-N 3.36Å
133F93.1Very high88.9Confident72 Ų7229.1 Ų29.132%0.31615%0.147SC..EExtended strand (participates in β ladder)trans-126.3119.2176-60.3-90.7000110.2L92 T93 H131 K155L92-F133 HydrophobicContact CB-CB 4.24Å; L92-F133 HydrophobicContact CD1-CB 4.17Å; L92-F133 PolarHBondContact N-O 3.28Å; T93-F133 HydrophobicContact CG2-CD2 4.1Å; T93-F133 PolarHBondContact OG1-N 3.05Å; H131-F133 HydrophobicContact CB-CE2 4.4Å; F133-K155 HydrophobicContact CD1-CB 3.94Å; F133-K155 HydrophobicContact CD1-CG 4.09Å; F133-K155 HydrophobicContact CE1-CB 3.86Å; F133-K155 HydrophobicContact CE1-CD 3.9Å; F133-K155 HydrophobicContact CE1-CG 3.64Å; F133-K155 HydrophobicContact CZ-CD 4.28Å; F133-K155 HydrophobicContact CZ-CG 4.18Å
134V92.5Very high88.2Confident0 Ų035.4 Ų35.40%017%0.171CC..EExtended strand (participates in β ladder)trans-87.7129169.3-176.90000108.1V89 I97 V99 F122 V124 L153 Y154V89-V134 HydrophobicContact CG1-CG1 3.5Å; V89-V134 VanDerWaalsContact CG1-CG1 3.5Å; I97-V134 HydrophobicContact CD1-CG2 3.55Å; V99-V134 HydrophobicContact CG2-CB 4.39Å; V99-V134 HydrophobicContact CG2-CG1 4Å; V99-V134 HydrophobicContact CG2-CG2 3.64Å; F122-V134 HydrophobicContact CD2-CG1 4.46Å; F122-V134 HydrophobicContact CE2-CB 4.49Å; F122-V134 HydrophobicContact CE2-CG1 3.82Å; F122-V134 HydrophobicContact CE2-CG2 4.45Å; F122-V134 HydrophobicContact CZ-CG1 4.22Å; V124-V134 HydrophobicContact CG1-CG2 4.34Å; V124-V134 HydrophobicContact CG2-CG2 3.93Å; V134-L153 WeakPolarHBondContact O-CA 3.24Å; V134-Y154 PolarHBondContact N-O 2.88Å; V134-Y154 PolarHBondContact O-N 3.32Å
135R90.8Very high87.4Confident86 Ų8637.9 Ų37.933%0.32520%0.196SC..EExtended strand (participates in β ladder)trans-100.1114.1172.2-170.6-170-74.5171.76.6109.2V89 T90 L92 E137 T151 L153V89-R135 WeakPolarHBondContact CA-O 3.46Å; T90-R135 PolarHBondContact N-O 3.09Å; T90-R135 PolarHBondContact O-N 3.46Å; L92-R135 HydrophobicContact CD1-CB 4.19Å; L92-R135 HydrophobicContact CD2-CB 3.9Å; L92-R135 VanDerWaalsContact CD2-CZ 3.48Å; L92-R135 VanDerWaalsContact CD2-NH2 3.32Å; L92-R135 HydrophobicContact CG-CB 3.9Å; R135-E137 WeakPolarHBondContact CD-OE1 3.4Å; R135-E137 HydrophobicContact CG-CG 3.8Å; R135-E137 IonicContact NH1-OE1 3.29Å; R135-E137 PolarHBondContact NH1-OE1 3.13Å; R135-T151 HydrophobicContact CG-CG2 3.41Å; R135-T151 VanDerWaalsContact CG-CG2 3.41Å; R135-L153 HydrophobicContact CB-CD2 4.2Å; R135-L153 HydrophobicContact CG-CD2 4.2Å
136F90.3Very high86.9Confident0 Ų042 Ų420%022%0.217CC..EExtended strand (participates in β ladder)trans-98.6113.6170-175.2-87.3000108.6V39 F41 A59 V61 F87 V89 I120 F122 T151 F152V39-F136 HydrophobicContact CG1-CD1 4.07Å; V39-F136 HydrophobicContact CG1-CE1 3.99Å; V39-F136 HydrophobicContact CG2-CD1 4.31Å; V39-F136 HydrophobicContact CG2-CE1 3.91Å; F41-F136 HydrophobicContact CE1-CB 4.12Å; F41-F136 HydrophobicContact CE1-CG 4.36Å; F41-F136 HydrophobicContact CZ-CB 3.93Å; F41-F136 HydrophobicContact CZ-CG 4.43Å; A59-F136 HydrophobicContact CB-CD2 3.94Å; A59-F136 HydrophobicContact CB-CE2 3.55Å; A59-F136 HydrophobicContact CB-CZ 3.88Å; V61-F136 HydrophobicContact CG2-CE1 4.4Å; V61-F136 HydrophobicContact CG2-CZ 4.09Å; F87-F136 HydrophobicContact CB-CZ 4.43Å; F87-F136 AromaticContact CD1-CE1 3.62Å; F87-F136 HydrophobicContact CD1-CE1 3.62Å; F87-F136 HydrophobicContact CD1-CE2 4.29Å; F87-F136 AromaticContact CD1-CZ 3.31Å; F87-F136 HydrophobicContact CD1-CZ 3.31Å; F87-F136 AromaticContact CE1-CE1 3.96Å; F87-F136 HydrophobicContact CE1-CE1 3.96Å; F87-F136 AromaticContact CE1-CZ 3.79Å; F87-F136 HydrophobicContact CE1-CZ 3.79Å; F87-F136 HydrophobicContact CG-CZ 4.16Å; V89-F136 HydrophobicContact CG2-CD2 3.78Å; V89-F136 HydrophobicContact CG2-CE2 4.15Å; I120-F136 HydrophobicContact CB-CE2 4.32Å; I120-F136 HydrophobicContact CD1-CE2 4.27Å; I120-F136 HydrophobicContact CD1-CZ 3.92Å; I120-F136 HydrophobicContact CG2-CE2 4.18Å; F122-F136 HydrophobicContact CE1-CD2 4.29Å; F136-T151 CarbonylContact O-C 3.6Å; F136-T151 WeakPolarHBondContact O-CA 3.3Å; F136-F152 HydrophobicContact CB-CB 4.35Å; F136-F152 HydrophobicContact CD1-CD2 4.1Å; F136-F152 PolarHBondContact N-O 2.8Å; F136-F152 PolarHBondContact O-N 2.88Å
137E87.1Confident86.4Confident21 Ų2148 Ų4810%0.09825%0.249CC..EExtended strand (participates in β ladder)trans-107.5124.7-179.9-61.7-178.6137.300109.7F87 K88 R135 H150F87-E137 CarbonylContact C-O 3.46Å; F87-E137 WeakPolarHBondContact CA-O 3.44Å; K88-E137 HydrophobicContact CB-CB 4.33Å; K88-E137 PolarHBondContact N-O 2.74Å; K88-E137 PolarHBondContact O-N 3.23Å; R135-E137 WeakPolarHBondContact CD-OE1 3.4Å; R135-E137 HydrophobicContact CG-CG 3.8Å; R135-E137 IonicContact NH1-OE1 3.29Å; R135-E137 PolarHBondContact NH1-OE1 3.13Å; E137-H150 WeakPolarHBondContact CA-O 3.32Å
138A85.7Confident85.9Confident0 Ų048.7 Ų48.70%025%0.249CC..EExtended strand (participates in β ladder)trans-101.9118.316700000108.9L85 Q86 F87 S149 H150L85-A138 HydrophobicContact CD2-CB 3.63Å; L85-A138 HydrophobicContact CG-CB 4.45Å; Q86-A138 CarbonylContact O-C 3.54Å; Q86-A138 WeakPolarHBondContact O-CA 3.17Å; F87-A138 HydrophobicContact CD1-CB 4.27Å; F87-A138 HydrophobicContact CE1-CB 4.25Å; A138-S149 CarbonylContact O-C 3.59Å; A138-S149 WeakPolarHBondContact O-CA 3.05Å; A138-H150 HydrophobicContact CB-CB 4.2Å; A138-H150 PolarHBondContact N-O 3.4Å; A138-H150 WeakPolarHBondContact O-CB 3.38Å; A138-H150 PolarHBondContact O-N 2.89Å
139I84.4Confident85.5Confident43 Ų4350.6 Ų50.622%0.22127%0.266CS..EExtended strand (participates in β ladder)trans-107.5126.4-175.7-55169.9000108.4L85 Q86 N147 R148L85-I139 WeakPolarHBondContact CA-O 3.36Å; Q86-I139 HydrophobicContact CB-CB 4.34Å; Q86-I139 PolarHBondContact N-O 3.17Å; Q86-I139 PolarHBondContact O-N 3.34Å; I139-N147 HydrophobicContact CG2-CB 4.39Å; I139-R148 WeakPolarHBondContact CA-O 3.4Å
140C83.1Confident85.2Confident2 Ų251.3 Ų51.31%0.01427%0.269CS..EExtended strand (participates in β ladder)trans-151.9166.1178.571.30000110.6C81 N147 R148C81-C140 VanDerWaalsContact CA-SG 3.57Å; C81-C140 HydrophobicContact CB-CB 3.49Å; C81-C140 VanDerWaalsContact CB-CB 3.49Å; C81-C140 WeakPolarHBondContact CB-SG 3.31Å; C81-C140 WeakPolarHBondContact SG-CB 3.48Å; C81-C140 CovalentContact SG-SG 2.01Å; C81-C140 PolarHBondContact SG-SG 3.41Å; C140-N147 CarbonylContact O-C 3.59Å; C140-R148 PolarHBondContact N-O 3.17Å; C140-R148 PolarHBondContact O-N 2.69Å; C140-R148 VanDerWaalsContact O-O 3.1Å
141S82.5Confident85Confident25 Ų2553.6 Ų53.618%0.17528%0.282CS..EExtended strand (participates in β ladder)trans-85.2138.7176.3-60.20000112Y82 S83 N146Y82-S141 WeakPolarHBondContact CB-O 3.18Å; Y82-S141 PolarHBondContact N-O 3.15Å; S83-S141 PolarHBondContact OG-N 2.84Å; S83-S141 PolarHBondContact OG-OG 2.86Å; S141-N146 WeakPolarHBondContact CA-O 3.42Å
142D79.7Confident84.8Confident27 Ų2752.8 Ų52.814%0.14428%0.278CS..  trans-75.7171.3166.3-168.5-4.2000110.5Y82 K144 G145 N146 R148Y82-D142 VanDerWaalsContact CD2-C 3.44Å; D142-K144 PolarHBondContact O-N 2.93Å; D142-G145 PolarHBondContact O-N 2.51Å; D142-N146 PolarHBondContact N-O 3.4Å; D142-R148 HydrophobicContact CB-CG 4.11Å; D142-R148 IonicContact OD2-CZ 3.16Å; D142-R148 IonicContact OD2-NE 2.81Å; D142-R148 PolarHBondContact OD2-NE 3.4Å; D142-R148 IonicContact OD2-NH2 2.77Å; D142-R148 PolarHBondContact OD2-NH2 3.36Å
143S73.4Confident84.8Confident71 Ų7157.7 Ų57.750%0.49730%0.304SS..THydrogen-bonded Turntrans-47.3-26.2173.356.50000114.8Y82Y82-S143 VanDerWaalsContact CE2-N 3.26Å
144K76.8Confident84.8Confident174 Ų17454.6 Ų54.676%0.75729%0.291SS*.THydrogen-bonded Turntrans-90.9-0.4177.9-63-177.4-178.4176.70114.2D142 N146D142-K144 PolarHBondContact O-N 2.93Å; K144-N146 VanDerWaalsContact C-N 3.33Å
145G76.9Confident84.8Confident52 Ų5259.9 Ų59.954%0.53631%0.313SS..SBendtrans79.69.2-174.400000114.8D142D142-G145 PolarHBondContact O-N 2.51Å
146N82.1Confident84.9Confident107 Ų10755.8 Ų55.857%0.57230%0.298SS*.  trans-86.3136.6177.1-69.3-16.6000110.8S141 D142 K144 R148S141-N146 WeakPolarHBondContact CA-O 3.42Å; D142-N146 PolarHBondContact N-O 3.4Å; K144-N146 VanDerWaalsContact C-N 3.33Å; N146-R148 PolarHBondContact O-N 3.29Å
147N83.4Confident85.1Confident126 Ų12656.8 Ų56.867%0.67431%0.306SS*.EExtended strand (participates in β ladder)trans-65.4121.4173.5-66.4-0.9000110.5I139 C140I139-N147 HydrophobicContact CG2-CB 4.39Å; C140-N147 CarbonylContact O-C 3.59Å
148R81.4Confident85.4Confident134 Ų13455.8 Ų55.851%0.50630%0.302SS..EExtended strand (participates in β ladder)trans-107.4140.2166.6-77-166.5-177.4-147.18.9110I139 C140 D142 N146I139-R148 WeakPolarHBondContact CA-O 3.4Å; C140-R148 PolarHBondContact N-O 3.17Å; C140-R148 PolarHBondContact O-N 2.69Å; C140-R148 VanDerWaalsContact O-O 3.1Å; D142-R148 HydrophobicContact CB-CG 4.11Å; D142-R148 IonicContact OD2-CZ 3.16Å; D142-R148 IonicContact OD2-NE 2.81Å; D142-R148 PolarHBondContact OD2-NE 3.4Å; D142-R148 IonicContact OD2-NH2 2.77Å; D142-R148 PolarHBondContact OD2-NH2 3.36Å; N146-R148 PolarHBondContact O-N 3.29Å
149S83.2Confident85.7Confident70 Ų7055.9 Ų55.949%0.4930%0.302SS..EExtended strand (participates in β ladder)trans-108.4125.2171.361.50000110.7A138A138-S149 CarbonylContact O-C 3.59Å; A138-S149 WeakPolarHBondContact O-CA 3.05Å
150H85.7Confident85.8Confident20 Ų2054.2 Ų54.29%0.09329%0.293CS..EExtended strand (participates in β ladder)trans-101.5107.5178.3-72.2-47.5000108.9K79 E137 A138 F152K79-H150 HydrophobicContact CB-CB 4.45Å; K79-H150 HydrophobicContact CD-CB 3.62Å; K79-H150 WeakPolarHBondContact CD-ND1 3.36Å; K79-H150 HydrophobicContact CG-CB 4.49Å; K79-H150 WeakPolarHBondContact CG-ND1 3.42Å; E137-H150 WeakPolarHBondContact CA-O 3.32Å; A138-H150 HydrophobicContact CB-CB 4.2Å; A138-H150 PolarHBondContact N-O 3.4Å; A138-H150 WeakPolarHBondContact O-CB 3.38Å; A138-H150 PolarHBondContact O-N 2.89Å; H150-F152 HydrophobicContact CB-CE2 4.16Å
151T88Confident85.8Confident51 Ų5157.1 Ų57.131%0.31331%0.311SS..EExtended strand (participates in β ladder)trans-91.9137.2-176.5-630000111.8K79 R135 F136 L153K79-T151 PolarHBondContact NZ-O 3.34Å; R135-T151 HydrophobicContact CG-CG2 3.41Å; R135-T151 VanDerWaalsContact CG-CG2 3.41Å; F136-T151 CarbonylContact O-C 3.6Å; F136-T151 WeakPolarHBondContact O-CA 3.3Å; T151-L153 HydrophobicContact CG2-CD2 4.08Å; T151-L153 HydrophobicContact CG2-CG 4.38Å
152F89.2Confident85.2Confident27 Ų2760.1 Ų60.112%0.11832%0.322CS..EExtended strand (participates in β ladder)trans-128132.7170.4-57.9-94.2000108.5V39 F41 K79 F136 H150V39-F152 HydrophobicContact CB-CD1 3.87Å; V39-F152 HydrophobicContact CB-CD2 4.01Å; V39-F152 HydrophobicContact CB-CE1 3.93Å; V39-F152 HydrophobicContact CB-CE2 4.07Å; V39-F152 HydrophobicContact CB-CG 3.9Å; V39-F152 HydrophobicContact CB-CZ 4.02Å; V39-F152 HydrophobicContact CG2-CD1 4.37Å; V39-F152 HydrophobicContact CG2-CD2 3.77Å; V39-F152 HydrophobicContact CG2-CE1 4.13Å; V39-F152 HydrophobicContact CG2-CE2 3.49Å; V39-F152 VanDerWaalsContact CG2-CE2 3.49Å; V39-F152 HydrophobicContact CG2-CG 4.2Å; V39-F152 HydrophobicContact CG2-CZ 3.67Å; F41-F152 HydrophobicContact CE2-CB 4.08Å; F41-F152 HydrophobicContact CZ-CB 3.93Å; K79-F152 HydrophobicContact CD-CE1 4.39Å; K79-F152 HydrophobicContact CD-CE2 4.3Å; K79-F152 HydrophobicContact CD-CZ 3.77Å; F136-F152 HydrophobicContact CB-CB 4.35Å; F136-F152 HydrophobicContact CD1-CD2 4.1Å; F136-F152 PolarHBondContact N-O 2.8Å; F136-F152 PolarHBondContact O-N 2.88Å; H150-F152 HydrophobicContact CB-CE2 4.16Å
153L91.7Very high84.8Confident103 Ų10362.4 Ų62.454%0.53933%0.334SS..EExtended strand (participates in β ladder)trans-106.7130.4-176-64.2177.2000110.4L92 V134 R135 T151L92-L153 HydrophobicContact CD1-CD2 3.64Å; V134-L153 WeakPolarHBondContact O-CA 3.24Å; R135-L153 HydrophobicContact CB-CD2 4.2Å; R135-L153 HydrophobicContact CG-CD2 4.2Å; T151-L153 HydrophobicContact CG2-CD2 4.08Å; T151-L153 HydrophobicContact CG2-CG 4.38Å
154Y92.2Very high85.3Confident8 Ų864.3 Ų64.33%0.03134%0.343CS..EExtended strand (participates in β ladder)trans-115.3113.8172.4-171.7-107.1000109.3F41 P43 P46 V57 V134 V156F41-Y154 HydrophobicContact CB-CD2 3.52Å; F41-Y154 HydrophobicContact CB-CE2 3.52Å; F41-Y154 HydrophobicContact CB-CG 4.47Å; F41-Y154 HydrophobicContact CD1-CD2 4.08Å; F41-Y154 HydrophobicContact CD1-CG 4.28Å; F41-Y154 AromaticContact CD2-CD2 3.67Å; F41-Y154 HydrophobicContact CD2-CD2 3.67Å; F41-Y154 HydrophobicContact CD2-CE2 4.49Å; F41-Y154 HydrophobicContact CD2-CG 4.34Å; F41-Y154 HydrophobicContact CE2-CD2 4.38Å; F41-Y154 AromaticContact CG-CD2 3.48Å; F41-Y154 HydrophobicContact CG-CD2 3.48Å; F41-Y154 VanDerWaalsContact CG-CD2 3.48Å; F41-Y154 HydrophobicContact CG-CE2 4.04Å; F41-Y154 HydrophobicContact CG-CG 4.11Å; P43-Y154 WeakPolarHBondContact O-CE2 3.5Å; P43-Y154 PolarHBondContact O-OH 2.88Å; P46-Y154 WeakPolarHBondContact CA-OH 3.32Å; P46-Y154 HydrophobicContact CB-CE1 3.94Å; P46-Y154 WeakPolarHBondContact CB-OH 3.49Å; P46-Y154 HydrophobicContact CG-CE1 4.09Å; P46-Y154 HydrophobicContact CG-CE2 4.24Å; V57-Y154 HydrophobicContact CB-CE1 4.44Å; V57-Y154 HydrophobicContact CG1-CD1 4.23Å; V57-Y154 HydrophobicContact CG1-CE1 3.92Å; V57-Y154 HydrophobicContact CG1-CE2 4.47Å; V57-Y154 HydrophobicContact CG2-CD1 4.29Å; V57-Y154 HydrophobicContact CG2-CE1 3.62Å; V134-Y154 PolarHBondContact N-O 2.88Å; V134-Y154 PolarHBondContact O-N 3.32Å; Y154-V156 HydrophobicContact CD1-CG2 3.53Å; Y154-V156 HydrophobicContact CE1-CG2 3.52Å
155K93.2Very high85.7Confident111 Ų11158.8 Ų58.848%0.48332%0.322SS..EExtended strand (participates in β ladder)trans-90.8118.3-175.2178.2-175.1173.8-173.30109.8P46 H131 G132 F133P46-K155 WeakPolarHBondContact CG-O 3.49Å; H131-K155 WeakPolarHBondContact CD2-CE 3.33Å; H131-K155 WeakPolarHBondContact NE2-CE 3.5Å; G132-K155 CarbonylContact O-C 3.58Å; G132-K155 WeakPolarHBondContact O-CA 3.38Å; F133-K155 HydrophobicContact CD1-CB 3.94Å; F133-K155 HydrophobicContact CD1-CG 4.09Å; F133-K155 HydrophobicContact CE1-CB 3.86Å; F133-K155 HydrophobicContact CE1-CD 3.9Å; F133-K155 HydrophobicContact CE1-CG 3.64Å; F133-K155 HydrophobicContact CZ-CD 4.28Å; F133-K155 HydrophobicContact CZ-CG 4.18Å
156V93.4Very high86.2Confident0 Ų056.3 Ų56.30%030%0.296CS..EExtended strand (participates in β ladder)trans-113133.3178-178.80000109.6P46 L49 V124 G132 Y154P46-V156 HydrophobicContact CB-CG2 4.28Å; L49-V156 HydrophobicContact CB-CG1 4.32Å; L49-V156 HydrophobicContact CD2-CG1 4.36Å; V124-V156 HydrophobicContact CG1-CG1 4.49Å; V124-V156 HydrophobicContact CG1-CG2 4.27Å; G132-V156 PolarHBondContact N-O 3.3Å; G132-V156 PolarHBondContact O-N 3.36Å; Y154-V156 HydrophobicContact CD1-CG2 3.53Å; Y154-V156 HydrophobicContact CE1-CG2 3.52Å
157A93.4Very high86.5Confident21 Ų2157.1 Ų57.117%0.17429%0.292CS..EExtended strand (participates in β ladder)trans-97.4125.9173.200000109.6L48 L49L48-A157 HydrophobicContact CD1-CB 3.78Å; L49-A157 PolarHBondContact N-O 3.31Å
158V93.6Very high86.9Confident0 Ų054.4 Ų54.40%028%0.28CS..EExtended strand (participates in β ladder)trans-108.5128.3177-175.70000109L49 E51 I96 I97 F128 L129 G130 P365L49-V158 HydrophobicContact CB-CG2 4.49Å; L49-V158 CarbonylContact O-C 3.47Å; L49-V158 WeakPolarHBondContact O-CA 3.3Å; E51-V158 HydrophobicContact CG-CG1 4.18Å; I96-V158 HydrophobicContact CG2-CB 4.35Å; I96-V158 HydrophobicContact CG2-CG2 4.13Å; I97-V158 HydrophobicContact CG2-CG2 3.52Å; F128-V158 WeakPolarHBondContact O-CB 3.25Å; F128-V158 WeakPolarHBondContact O-CG1 3.32Å; L129-V158 VanDerWaalsContact CA-O 3.31Å; L129-V158 WeakPolarHBondContact CA-O 3.43Å; G130-V158 PolarHBondContact N-O 3.34Å; G130-V158 PolarHBondContact O-N 3.49Å; V158-P365 VanDerWaalsContact O-CB 3.28Å; V158-P365 WeakPolarHBondContact O-CB 3.4Å; V158-P365 WeakPolarHBondContact O-CG 3.4Å
159T91.8Very high87.3Confident2 Ų248.5 Ų48.51%0.01226%0.258CS..EExtended strand (participates in β ladder)trans-106.9151.7171.653.50000110.9L48 L49 T50 E51 K364 P365L48-T159 HydrophobicContact CD1-CG2 3.53Å; L48-T159 HydrophobicContact CD2-CG2 3.6Å; L48-T159 HydrophobicContact CG-CG2 3.58Å; L49-T159 PolarHBondContact O-N 3.5Å; L49-T159 PolarHBondContact O-OG1 2.95Å; T50-T159 CarbonylContact C-O 3.55Å; T50-T159 VanDerWaalsContact CA-O 3.3Å; T50-T159 WeakPolarHBondContact CA-O 3.39Å; E51-T159 PolarHBondContact N-O 3.07Å; T159-K364 HydrophobicContact CG2-CB 3.55Å; T159-P365 HydrophobicContact CG2-CB 4.24Å
160R87Confident87.6Confident7 Ų746.2 Ų46.23%0.02624%0.24CC..  trans-59.1155.2167.764.5-173.9-173.599.40.3110.6E162 D163 D368R160-E162 PolarHBondContact O-N 3.48Å; R160-D163 IonicContact NH1-OD2 2.78Å; R160-D163 PolarHBondContact NH1-OD2 2.63Å; R160-D368 WeakPolarHBondContact CD-OD2 3.18Å; R160-D368 IonicContact CZ-OD2 3.26Å; R160-D368 IonicContact NE-OD2 2.6Å; R160-D368 PolarHBondContact NE-OD2 2.8Å
161T82.5Confident87.9Confident64 Ų6446.8 Ų46.839%0.39325%0.252SS..  trans-55.1133.8166.2510000109.2E51 D163E51-T161 HydrophobicContact CB-CG2 4.44Å; T161-D163 PolarHBondContact O-N 3.18Å
162E69.9Low88.2Confident88 Ų8846.9 Ų46.941%0.41125%0.252SS..  trans-66.393.6-174.9-73.4-66.7177.300111.1R160 T164 Y167 K364R160-E162 PolarHBondContact O-N 3.48Å; E162-T164 PolarHBondContact O-N 3.32Å; E162-Y167 PolarHBondContact OE1-OH 2.89Å; E162-Y167 WeakPolarHBondContact OE2-CE2 3.45Å; E162-Y167 PolarHBondContact OE2-OH 3.23Å; E162-K364 IonicContact OE1-NZ 4Å; E162-K364 PolarHBondContact OE1-NZ 3.29Å; E162-K364 IonicContact OE2-NZ 3.07Å; E162-K364 PolarHBondContact OE2-NZ 2.8Å
163D70.9Confident88.3Confident74 Ų7445.6 Ų45.640%0.39625%0.246SC..  trans-79.6112.2172.4-60.9-39.3000108.8R160 T161 L165 G166R160-D163 IonicContact NH1-OD2 2.78Å; R160-D163 PolarHBondContact NH1-OD2 2.63Å; T161-D163 PolarHBondContact O-N 3.18Å; D163-L165 HydrophobicContact CB-CB 4.33Å; D163-L165 PolarHBondContact O-N 2.95Å; D163-G166 PolarHBondContact O-N 3.47Å
164T84.7Confident88.2Confident112 Ų11242.2 Ų42.269%0.68723%0.231SC*.Hα-helixtrans-45-33.8169.2-58.60000111.3E162 G166 Y167 V168E162-T164 PolarHBondContact O-N 3.32Å; T164-G166 VanDerWaalsContact C-N 3.33Å; T164-G166 PolarHBondContact O-N 3.46Å; T164-Y167 PolarHBondContact O-N 2.86Å; T164-V168 HydrophobicContact CG2-CG2 4.27Å; T164-V168 VanDerWaalsContact O-CG2 3.32Å; T164-V168 WeakPolarHBondContact O-CG2 3.33Å; T164-V168 PolarHBondContact O-N 3.44Å
165L86.2Confident88.2Confident57 Ų5746.9 Ų46.930%0.29826%0.255SS..Hα-helixtrans-58.4-37.6177.2-168.367.6000113.9D163 V168 F169 F294 Y297D163-L165 HydrophobicContact CB-CB 4.33Å; D163-L165 PolarHBondContact O-N 2.95Å; L165-V168 PolarHBondContact O-N 3.32Å; L165-F169 WeakPolarHBondContact O-CB 3.39Å; L165-F169 PolarHBondContact O-N 3.13Å; L165-F294 HydrophobicContact CD1-CE2 3.59Å; L165-F294 HydrophobicContact CD1-CZ 3.47Å; L165-F294 VanDerWaalsContact CD1-CZ 3.47Å; L165-F294 HydrophobicContact CG-CZ 4.34Å; L165-Y297 HydrophobicContact CD2-CD1 3.91Å; L165-Y297 HydrophobicContact CD2-CE1 3.84Å
166G85.9Confident88Confident0 Ų042.4 Ų42.40%024%0.237CC..Hα-helixtrans-68.6-40.5178.700000112.3D163 T164 F169 I170D163-G166 PolarHBondContact O-N 3.47Å; T164-G166 VanDerWaalsContact C-N 3.33Å; T164-G166 PolarHBondContact O-N 3.46Å; G166-F169 WeakPolarHBondContact O-CB 3.37Å; G166-F169 PolarHBondContact O-N 3.12Å; G166-I170 WeakPolarHBondContact O-CG1 3.23Å; G166-I170 PolarHBondContact O-N 2.97Å
167Y88.4Confident87.7Confident124 Ų12443.3 Ų43.349%0.48624%0.241SC..Hα-helixtrans-66.7-42173.9-70.5-69.4000112.2E162 T164 F169 I170 G171 K364E162-Y167 PolarHBondContact OE1-OH 2.89Å; E162-Y167 WeakPolarHBondContact OE2-CE2 3.45Å; E162-Y167 PolarHBondContact OE2-OH 3.23Å; T164-Y167 PolarHBondContact O-N 2.86Å; Y167-F169 VanDerWaalsContact C-N 3.31Å; Y167-F169 PolarHBondContact O-N 3.39Å; Y167-I170 PolarHBondContact O-N 2.88Å; Y167-G171 PolarHBondContact O-N 3.2Å; Y167-K364 VanDerWaalsContact CZ-NZ 3.34Å; Y167-K364 PolarHBondContact OH-NZ 3.39Å
168V91.7Very high87.4Confident69 Ų6946.5 Ų46.542%0.41826%0.262SS..Hα-helixtrans-59.5-44173.5172.30000110.3T164 L165 G171 V172 F294T164-V168 HydrophobicContact CG2-CG2 4.27Å; T164-V168 VanDerWaalsContact O-CG2 3.32Å; T164-V168 WeakPolarHBondContact O-CG2 3.33Å; T164-V168 PolarHBondContact O-N 3.44Å; L165-V168 PolarHBondContact O-N 3.32Å; V168-G171 PolarHBondContact O-N 3.47Å; V168-V172 HydrophobicContact CG1-CG2 4.15Å; V168-V172 WeakPolarHBondContact O-CB 3.38Å; V168-V172 VanDerWaalsContact O-CG2 3.26Å; V168-V172 WeakPolarHBondContact O-CG2 3.34Å; V168-V172 PolarHBondContact O-N 3.28Å; V168-F294 HydrophobicContact CG1-CZ 4.23Å
169F90.1Very high87Confident10 Ų1050 Ų504%0.04428%0.28CS..Hα-helixtrans-58.1-50.3175.5170.6-106.1000112.3L165 G166 Y167 G171 V172 L173 F290 F294 N299L165-F169 WeakPolarHBondContact O-CB 3.39Å; L165-F169 PolarHBondContact O-N 3.13Å; G166-F169 WeakPolarHBondContact O-CB 3.37Å; G166-F169 PolarHBondContact O-N 3.12Å; Y167-F169 VanDerWaalsContact C-N 3.31Å; Y167-F169 PolarHBondContact O-N 3.39Å; F169-G171 VanDerWaalsContact C-N 3.34Å; F169-G171 PolarHBondContact O-N 2.87Å; F169-V172 PolarHBondContact O-N 3.14Å; F169-L173 HydrophobicContact CE1-CD2 4.06Å; F169-L173 HydrophobicContact CZ-CD2 3.9Å; F169-L173 WeakPolarHBondContact O-CB 3.46Å; F169-L173 PolarHBondContact O-N 3.13Å; F169-F290 HydrophobicContact CD2-CE1 4.01Å; F169-F290 HydrophobicContact CD2-CZ 4.24Å; F169-F290 HydrophobicContact CE2-CE1 4.02Å; F169-F294 HydrophobicContact CB-CD1 4.46Å; F169-F294 HydrophobicContact CB-CE1 3.86Å; F169-F294 AromaticContact CD2-CD1 3.91Å; F169-F294 HydrophobicContact CD2-CD1 3.91Å; F169-F294 HydrophobicContact CD2-CE1 4.14Å; F169-N299 VanDerWaalsContact CD1-ND2 3.31Å; F169-N299 WeakPolarHBondContact CD1-ND2 3.18Å; F169-N299 WeakPolarHBondContact CE1-ND2 3.43Å
170I89.9Confident86.5Confident22 Ų2250 Ų5011%0.11328%0.279CS..Hα-helixtrans-62.2-43.2179.6-65.7160.4000110.6G166 Y167 S174 Q359G166-I170 WeakPolarHBondContact O-CG1 3.23Å; G166-I170 PolarHBondContact O-N 2.97Å; Y167-I170 PolarHBondContact O-N 2.88Å; I170-S174 WeakPolarHBondContact O-CB 3.05Å; I170-S174 PolarHBondContact O-N 2.91Å; I170-S174 PolarHBondContact O-OG 3.29Å; I170-Q359 HydrophobicContact CD1-CB 3.9Å; I170-Q359 HydrophobicContact CD1-CG 3.67Å; I170-Q359 HydrophobicContact CG1-CB 4.5Å; I170-Q359 HydrophobicContact CG1-CG 4.21Å
171G93.1Very high86.1Confident33 Ų3350.3 Ų50.334%0.3428%0.282SS..Hα-helixtrans-61.4-50.217700000112.6Y167 V168 F169 S174 I175Y167-G171 PolarHBondContact O-N 3.2Å; V168-G171 PolarHBondContact O-N 3.47Å; F169-G171 VanDerWaalsContact C-N 3.34Å; F169-G171 PolarHBondContact O-N 2.87Å; G171-S174 PolarHBondContact O-N 3.43Å; G171-I175 WeakPolarHBondContact O-CG1 3.47Å; G171-I175 PolarHBondContact O-N 3.14Å
172V93.5Very high86.1Confident52 Ų5253.9 Ų53.932%0.31529%0.292SS..Hα-helixtrans-64.5-43.5178.1175.10000111V168 F169 S174 I175 L176 F290V168-V172 HydrophobicContact CG1-CG2 4.15Å; V168-V172 WeakPolarHBondContact O-CB 3.38Å; V168-V172 VanDerWaalsContact O-CG2 3.26Å; V168-V172 WeakPolarHBondContact O-CG2 3.34Å; V168-V172 PolarHBondContact O-N 3.28Å; F169-V172 PolarHBondContact O-N 3.14Å; V172-S174 VanDerWaalsContact C-N 3.3Å; V172-S174 PolarHBondContact O-N 3.46Å; V172-I175 PolarHBondContact O-N 3.29Å; V172-L176 HydrophobicContact CG1-CD1 3.85Å; V172-L176 HydrophobicContact CG1-CG 4.11Å; V172-L176 WeakPolarHBondContact O-CB 3.43Å; V172-L176 VanDerWaalsContact O-CG 3.3Å; V172-L176 WeakPolarHBondContact O-CG 3.45Å; V172-L176 PolarHBondContact O-N 2.75Å; V172-F290 HydrophobicContact CB-CE1 4.48Å; V172-F290 HydrophobicContact CB-CZ 3.88Å; V172-F290 HydrophobicContact CG1-CE1 3.89Å; V172-F290 HydrophobicContact CG1-CE2 3.82Å; V172-F290 HydrophobicContact CG1-CZ 3.33Å
173L90.6Very high86.6Confident1 Ų152.1 Ų52.11%0.00529%0.285CS..Hα-helixtrans-58.5-44175.8179.162.8000110.9F169 L176 L177 I291 I355 V356F169-L173 HydrophobicContact CE1-CD2 4.06Å; F169-L173 HydrophobicContact CZ-CD2 3.9Å; F169-L173 WeakPolarHBondContact O-CB 3.46Å; F169-L173 PolarHBondContact O-N 3.13Å; L173-L176 PolarHBondContact O-N 2.9Å; L173-L177 HydrophobicContact CD1-CD1 4.09Å; L173-L177 HydrophobicContact CD1-CG 4.12Å; L173-L177 HydrophobicContact CG-CD1 3.95Å; L173-L177 HydrophobicContact CG-CG 4.39Å; L173-L177 WeakPolarHBondContact O-CB 3.31Å; L173-L177 WeakPolarHBondContact O-CG 3.28Å; L173-L177 PolarHBondContact O-N 3.29Å; L173-I291 HydrophobicContact CD1-CD1 4.22Å; L173-I291 HydrophobicContact CD1-CG1 4.33Å; L173-I355 HydrophobicContact CD2-CG2 4.34Å; L173-V356 HydrophobicContact CD2-CG2 4.12Å; L173-V356 HydrophobicContact CG-CG2 4.28Å
174S90.9Very high86.8Confident31 Ų3148.8 Ų48.822%0.21727%0.267CS..Hα-helixtrans-62.5-45.4179-56.70000111.3I170 G171 V172 L177 C178 V356I170-S174 WeakPolarHBondContact O-CB 3.05Å; I170-S174 PolarHBondContact O-N 2.91Å; I170-S174 PolarHBondContact O-OG 3.29Å; G171-S174 PolarHBondContact O-N 3.43Å; V172-S174 VanDerWaalsContact C-N 3.3Å; V172-S174 PolarHBondContact O-N 3.46Å; S174-L177 PolarHBondContact O-N 2.88Å; S174-C178 PolarHBondContact O-N 3.23Å; S174-C178 PolarHBondContact O-SG 3.44Å; S174-V356 WeakPolarHBondContact OG-CG1 3.35Å; S174-V356 WeakPolarHBondContact OG-CG2 2.98Å
175I92.2Very high86.4Confident106 Ų10645.2 Ų45.254%0.54425%0.249SC..Hα-helixtrans-62.4-47.3176-67.6166.2000110.9G171 V172 L177 C178 I179G171-I175 WeakPolarHBondContact O-CG1 3.47Å; G171-I175 PolarHBondContact O-N 3.14Å; V172-I175 PolarHBondContact O-N 3.29Å; I175-L177 VanDerWaalsContact C-N 3.32Å; I175-L177 PolarHBondContact O-N 3.43Å; I175-C178 PolarHBondContact O-N 3.33Å; I175-I179 HydrophobicContact CG2-CD1 3.75Å; I175-I179 HydrophobicContact CG2-CG1 4.39Å; I175-I179 WeakPolarHBondContact O-CG1 3.26Å; I175-I179 PolarHBondContact O-N 3.4Å
176L89Confident86Confident18 Ų1846.3 Ų46.39%0.09426%0.261CS..Hα-helixtrans-61.5-39.9179-73.7177.4000111.9V172 L173 I179 A180 F283 F286 V287 F290V172-L176 HydrophobicContact CG1-CD1 3.85Å; V172-L176 HydrophobicContact CG1-CG 4.11Å; V172-L176 WeakPolarHBondContact O-CB 3.43Å; V172-L176 VanDerWaalsContact O-CG 3.3Å; V172-L176 WeakPolarHBondContact O-CG 3.45Å; V172-L176 PolarHBondContact O-N 2.75Å; L173-L176 PolarHBondContact O-N 2.9Å; L176-I179 PolarHBondContact O-N 2.89Å; L176-A180 VanDerWaalsContact O-CB 3.24Å; L176-A180 WeakPolarHBondContact O-CB 3.41Å; L176-A180 PolarHBondContact O-N 2.81Å; L176-F283 HydrophobicContact CD2-CE2 4.38Å; L176-F283 HydrophobicContact CD2-CZ 3.93Å; L176-F286 HydrophobicContact CD2-CE1 4.12Å; L176-V287 HydrophobicContact CB-CG2 4.23Å; L176-V287 HydrophobicContact CD1-CG2 4.47Å; L176-F290 HydrophobicContact CD1-CD1 3.6Å; L176-F290 HydrophobicContact CD1-CE1 3.88Å; L176-F290 HydrophobicContact CD1-CG 3.97Å; L176-F290 HydrophobicContact CD1-CZ 4.46Å
177L86.5Confident85.5Confident18 Ų1849 Ų499%0.09427%0.274CS..Hα-helixtrans-66.9-42.3175.7-70.3172.1000111.5L173 S174 I175 I179 A180 N181 G352 I353 V356L173-L177 HydrophobicContact CD1-CD1 4.09Å; L173-L177 HydrophobicContact CD1-CG 4.12Å; L173-L177 HydrophobicContact CG-CD1 3.95Å; L173-L177 HydrophobicContact CG-CG 4.39Å; L173-L177 WeakPolarHBondContact O-CB 3.31Å; L173-L177 WeakPolarHBondContact O-CG 3.28Å; L173-L177 PolarHBondContact O-N 3.29Å; S174-L177 PolarHBondContact O-N 2.88Å; I175-L177 VanDerWaalsContact C-N 3.32Å; I175-L177 PolarHBondContact O-N 3.43Å; L177-I179 PolarHBondContact O-N 2.92Å; L177-A180 PolarHBondContact O-N 3.49Å; L177-N181 WeakPolarHBondContact O-CB 3.14Å; L177-N181 PolarHBondContact O-N 2.94Å; L177-N181 PolarHBondContact O-ND2 3.07Å; L177-G352 VanDerWaalsContact CD1-C 3.46Å; L177-I353 HydrophobicContact CD1-CG1 4.17Å; L177-V356 HydrophobicContact CD1-CG2 4.25Å
178C86.3Confident85.1Confident89 Ų8944.2 Ų44.260%0.60126%0.257SS*.Hα-helixtrans-59.9-45.1174-720000111.9S174 I175 F182S174-C178 PolarHBondContact O-N 3.23Å; S174-C178 PolarHBondContact O-SG 3.44Å; I175-C178 PolarHBondContact O-N 3.33Å; C178-F182 WeakPolarHBondContact O-CB 3.38Å; C178-F182 PolarHBondContact O-N 3.02Å
179I86.7Confident84.8Confident73 Ų7347.3 Ų47.337%0.37426%0.264SS..Hα-helixtrans-67.1-46.4177.5-66.5172.3000110.7I175 L176 L177 N181 F182 I183 F283I175-I179 HydrophobicContact CG2-CD1 3.75Å; I175-I179 HydrophobicContact CG2-CG1 4.39Å; I175-I179 WeakPolarHBondContact O-CG1 3.26Å; I175-I179 PolarHBondContact O-N 3.4Å; L176-I179 PolarHBondContact O-N 2.89Å; L177-I179 PolarHBondContact O-N 2.92Å; I179-N181 VanDerWaalsContact C-N 3.26Å; I179-N181 PolarHBondContact O-N 3.19Å; I179-F182 PolarHBondContact O-N 3.38Å; I179-I183 HydrophobicContact CG2-CD1 3.57Å; I179-I183 HydrophobicContact CG2-CG1 4.13Å; I179-I183 WeakPolarHBondContact O-CG1 3.31Å; I179-I183 PolarHBondContact O-N 2.67Å; I179-F283 HydrophobicContact CB-CZ 4.07Å; I179-F283 HydrophobicContact CG2-CE1 4.22Å; I179-F283 HydrophobicContact CG2-CE2 4.07Å; I179-F283 HydrophobicContact CG2-CZ 3.64Å
180A81.2Confident84.6Confident1 Ų152.7 Ų52.71%0.00829%0.293CS..Hα-helixtrans-51.7-52.5177.200000109.6L176 L177 M184 F283 F284L176-A180 VanDerWaalsContact O-CB 3.24Å; L176-A180 WeakPolarHBondContact O-CB 3.41Å; L176-A180 PolarHBondContact O-N 2.81Å; L177-A180 PolarHBondContact O-N 3.49Å; A180-M184 WeakPolarHBondContact O-CB 3.36Å; A180-M184 WeakPolarHBondContact O-CG 3.26Å; A180-M184 PolarHBondContact O-N 3.49Å; A180-F283 VanDerWaalsContact CA-CE1 3.47Å; A180-F283 HydrophobicContact CB-CD1 4.09Å; A180-F283 HydrophobicContact CB-CE1 3.63Å; A180-F284 HydrophobicContact CB-CE1 4.3Å; A180-F284 HydrophobicContact CB-CE2 4.31Å; A180-F284 HydrophobicContact CB-CZ 3.88Å
181N79Confident84.7Confident14 Ų1458.3 Ų58.38%0.07532%0.319CS..Hα-helixtrans-61-49179.9-77.1-8.7000111.2L177 I179 I183 M184 A185 F274L177-N181 WeakPolarHBondContact O-CB 3.14Å; L177-N181 PolarHBondContact O-N 2.94Å; L177-N181 PolarHBondContact O-ND2 3.07Å; I179-N181 VanDerWaalsContact C-N 3.26Å; I179-N181 PolarHBondContact O-N 3.19Å; N181-I183 PolarHBondContact O-N 3.42Å; N181-M184 CarbonylContact O-C 3.56Å; N181-M184 WeakPolarHBondContact O-CA 3.3Å; N181-M184 WeakPolarHBondContact O-CB 3.44Å; N181-M184 PolarHBondContact O-N 2.92Å; N181-M184 VanDerWaalsContact O-N 3.14Å; N181-A185 PolarHBondContact O-N 3.47Å; N181-F274 HydrophobicContact CB-CB 4.14Å; N181-F274 HydrophobicContact CB-CD1 3.58Å; N181-F274 HydrophobicContact CB-CD2 3.41Å; N181-F274 VanDerWaalsContact CB-CD2 3.41Å; N181-F274 HydrophobicContact CB-CE1 3.75Å; N181-F274 HydrophobicContact CB-CE2 3.57Å; N181-F274 HydrophobicContact CB-CG 3.42Å; N181-F274 VanDerWaalsContact CB-CG 3.42Å; N181-F274 HydrophobicContact CB-CZ 3.74Å; N181-F274 VanDerWaalsContact CG-CD2 3.44Å; N181-F274 WeakPolarHBondContact O-CB 3.42Å; N181-F274 WeakPolarHBondContact O-CD1 3.42Å; N181-F274 WeakPolarHBondContact O-CG 3.47Å
182F81.2Confident84.4Confident140 Ų14058.5 Ų58.561%0.61431%0.313SS*.Hα-helixtrans-60.3-46.2179.6-179-95.7000113.4C178 I179 M184 A185 S186C178-F182 WeakPolarHBondContact O-CB 3.38Å; C178-F182 PolarHBondContact O-N 3.02Å; I179-F182 PolarHBondContact O-N 3.38Å; F182-M184 VanDerWaalsContact C-N 3.26Å; F182-M184 PolarHBondContact O-N 3.37Å; F182-A185 PolarHBondContact O-N 2.9Å; F182-S186 PolarHBondContact O-N 2.93Å; F182-S186 VanDerWaalsContact O-N 3.16Å; F182-S186 PolarHBondContact O-OG 3.48Å
183I80Confident84.2Confident50 Ų5056.3 Ų56.326%0.25630%0.3SS..Hα-helixtrans-63.7-38.8177.2-58.3168.9000109.2I179 N181 S186 L280I179-I183 HydrophobicContact CG2-CD1 3.57Å; I179-I183 HydrophobicContact CG2-CG1 4.13Å; I179-I183 WeakPolarHBondContact O-CG1 3.31Å; I179-I183 PolarHBondContact O-N 2.67Å; N181-I183 PolarHBondContact O-N 3.42Å; I183-S186 PolarHBondContact O-N 3Å; I183-L280 HydrophobicContact CB-CD2 3.5Å; I183-L280 HydrophobicContact CG2-CD2 3.24Å; I183-L280 HydrophobicContact CG2-CG 3.87Å
184M76.7Confident84.3Confident5 Ų563.8 Ų63.83%0.02533%0.328CS..Hα-helixtrans-58.6-53.6172.6-65.5-129.5-72.800111.5A180 N181 F182 S186 E187 F274 A275 L280 F284A180-M184 WeakPolarHBondContact O-CB 3.36Å; A180-M184 WeakPolarHBondContact O-CG 3.26Å; A180-M184 PolarHBondContact O-N 3.49Å; N181-M184 CarbonylContact O-C 3.56Å; N181-M184 WeakPolarHBondContact O-CA 3.3Å; N181-M184 WeakPolarHBondContact O-CB 3.44Å; N181-M184 PolarHBondContact O-N 2.92Å; N181-M184 VanDerWaalsContact O-N 3.14Å; F182-M184 VanDerWaalsContact C-N 3.26Å; F182-M184 PolarHBondContact O-N 3.37Å; M184-S186 PolarHBondContact O-N 3.32Å; M184-S186 VanDerWaalsContact O-N 3.1Å; M184-E187 PolarHBondContact O-N 3.45Å; M184-F274 HydrophobicContact CB-CB 4.04Å; M184-F274 HydrophobicContact CE-CB 4.28Å; M184-A275 VanDerWaalsContact C-N 3.27Å; M184-A275 CarbonylContact C-O 3.55Å; M184-A275 CarbonylContact O-C 3.37Å; M184-A275 PolarHBondContact O-N 2.95Å; M184-L280 HydrophobicContact CB-CD1 4.03Å; M184-L280 HydrophobicContact CG-CD1 3.65Å; M184-L280 HydrophobicContact CG-CD2 3.79Å; M184-L280 HydrophobicContact CG-CG 4.31Å; M184-L280 HydrophobicContact SD-CD1 4.28Å; M184-F284 HydrophobicContact CE-CE2 4.26Å; M184-F284 HydrophobicContact CE-CZ 3.76Å; M184-F284 HydrophobicContact CG-CE2 3.55Å; M184-F284 HydrophobicContact CG-CZ 3.88Å; M184-F284 HydrophobicContact SD-CE2 3.4Å; M184-F284 WeakPolarHBondContact SD-CE2 3.31Å; M184-F284 HydrophobicContact SD-CZ 3.54Å; M184-F284 VanDerWaalsContact SD-CZ 3.54Å
185A75.2Confident84.4Confident37 Ų3765.2 Ų65.231%0.30634%0.338SS..Hα-helixtrans-55.3-33.8179.400000113.8N181 F182 E187 F274N181-A185 PolarHBondContact O-N 3.47Å; F182-A185 PolarHBondContact O-N 2.9Å; A185-E187 VanDerWaalsContact C-N 3.25Å; A185-E187 PolarHBondContact O-N 2.82Å; A185-F274 HydrophobicContact CB-CD1 3.63Å; A185-F274 HydrophobicContact CB-CE1 4.31Å
186S78.2Confident84.4Confident80 Ų8061 Ų6156%0.55932%0.317SS*.Hα-helixtrans-69.5-20.8-175.5-58.50000113.7F182 I183 M184F182-S186 PolarHBondContact O-N 2.93Å; F182-S186 VanDerWaalsContact O-N 3.16Å; F182-S186 PolarHBondContact O-OG 3.48Å; I183-S186 PolarHBondContact O-N 3Å; M184-S186 PolarHBondContact O-N 3.32Å; M184-S186 VanDerWaalsContact O-N 3.1Å
187E76.3Confident84.5Confident56 Ų5663 Ų6326%0.26233%0.328SS..Hα-helixtrans-100.2-3-175.3-65.1-171.9139.100113.4M184 A185 K189 Y276 G277 L280M184-E187 PolarHBondContact O-N 3.45Å; A185-E187 VanDerWaalsContact C-N 3.25Å; A185-E187 PolarHBondContact O-N 2.82Å; E187-K189 PolarHBondContact O-N 3.32Å; E187-Y276 WeakPolarHBondContact CB-O 3.42Å; E187-G277 VanDerWaalsContact OE2-C 3.29Å; E187-G277 WeakPolarHBondContact OE2-CA 3.28Å; E187-G277 PolarHBondContact OE2-N 3.21Å; E187-L280 WeakPolarHBondContact OE2-CD1 3.38Å; E187-L280 VanDerWaalsContact OE2-CG 3.28Å; E187-L280 WeakPolarHBondContact OE2-CG 3.39Å
188I78.6Confident84.9Confident24 Ų2469 Ų6912%0.12335%0.353CS..  trans-68.2122.6178.8-55.5-177.6000111.5L190 V193 F269 A275I188-L190 PolarHBondContact O-N 2.96Å; I188-V193 HydrophobicContact CG2-CG2 3.45Å; I188-V193 VanDerWaalsContact CG2-CG2 3.45Å; I188-F269 HydrophobicContact CD1-CB 4.15Å; I188-F269 HydrophobicContact CD1-CD2 3.21Å; I188-F269 HydrophobicContact CD1-CE2 3.86Å; I188-F269 HydrophobicContact CD1-CG 3.96Å; I188-A275 HydrophobicContact CD1-CB 3.63Å; I188-A275 VanDerWaalsContact CD1-N 3.33Å; I188-A275 HydrophobicContact CG1-CB 3.69Å; I188-A275 WeakPolarHBondContact CG1-O 3.38Å; I188-A275 PolarHBondContact N-O 2.85Å
189K85.1Confident85.1Confident134 Ų13474.4 Ų74.458%0.58336%0.361SS*.  trans-80.1103.6163.4-64.9-174.3178.9-168.80110.2E187 E191 V192 V193E187-K189 PolarHBondContact O-N 3.32Å; K189-E191 HydrophobicContact CB-CG 3.96Å; K189-E191 PolarHBondContact O-N 3Å; K189-E191 VanDerWaalsContact O-N 3.12Å; K189-V192 HydrophobicContact CB-CB 4.26Å; K189-V192 HydrophobicContact CB-CG2 3.8Å; K189-V192 HydrophobicContact CD-CG2 4.25Å; K189-V192 WeakPolarHBondContact O-CB 3.3Å; K189-V192 PolarHBondContact O-N 2.85Å; K189-V193 PolarHBondContact O-N 3.46Å
190L87Confident85.2Confident122 Ų12274.8 Ų74.864%0.63937%0.368SS*.Hα-helixtrans-55.6-30.5178.7-67.2176.1000113I188 V192 V193 W194 F269I188-L190 PolarHBondContact O-N 2.96Å; L190-V192 PolarHBondContact O-N 2.98Å; L190-V193 PolarHBondContact O-N 3.17Å; L190-W194 VanDerWaalsContact O-CB 3.28Å; L190-W194 WeakPolarHBondContact O-CB 3.43Å; L190-W194 PolarHBondContact O-N 3.25Å; L190-F269 HydrophobicContact CD2-CZ 4.48Å
191E90.7Very high85.8Confident141 Ų14180 Ų8066%0.65940%0.395SS*.Hα-helixtrans-60.9-39.3173.754.5175.6-170.600113.4K189 W194 S195K189-E191 HydrophobicContact CB-CG 3.96Å; K189-E191 PolarHBondContact O-N 3Å; K189-E191 VanDerWaalsContact O-N 3.12Å; E191-W194 PolarHBondContact O-N 2.82Å; E191-S195 WeakPolarHBondContact O-CB 3.2Å; E191-S195 PolarHBondContact O-N 3.47Å
192V88.7Confident86.5Confident36 Ų3679.7 Ų79.722%0.21839%0.394CS..Hα-helixtrans-70.8-47.5179.7176.80000109.3K189 L190 W194 S195 V196 D262K189-V192 HydrophobicContact CB-CB 4.26Å; K189-V192 HydrophobicContact CB-CG2 3.8Å; K189-V192 HydrophobicContact CD-CG2 4.25Å; K189-V192 WeakPolarHBondContact O-CB 3.3Å; K189-V192 PolarHBondContact O-N 2.85Å; L190-V192 PolarHBondContact O-N 2.98Å; V192-W194 VanDerWaalsContact C-N 3.29Å; V192-W194 PolarHBondContact O-N 2.85Å; V192-S195 WeakPolarHBondContact O-CB 3.32Å; V192-S195 PolarHBondContact O-N 3.09Å; V192-S195 PolarHBondContact O-OG 3.22Å; V192-V196 WeakPolarHBondContact O-CG2 3.19Å; V192-V196 PolarHBondContact O-N 3.33Å; V192-D262 HydrophobicContact CG1-CB 3.66Å
193V88.8Confident87Confident6 Ų673.4 Ų73.44%0.03637%0.367CS..Hα-helixtrans-54.4-48.2174.61720000110.6I188 K189 L190 S195 V196 I197 T266 F269I188-V193 HydrophobicContact CG2-CG2 3.45Å; I188-V193 VanDerWaalsContact CG2-CG2 3.45Å; K189-V193 PolarHBondContact O-N 3.46Å; L190-V193 PolarHBondContact O-N 3.17Å; V193-S195 VanDerWaalsContact C-N 3.33Å; V193-S195 PolarHBondContact O-N 3.35Å; V193-V196 PolarHBondContact O-N 3.21Å; V193-I197 HydrophobicContact CG1-CD1 3.71Å; V193-I197 HydrophobicContact CG1-CG1 4.43Å; V193-I197 WeakPolarHBondContact O-CG1 3.35Å; V193-I197 PolarHBondContact O-N 3.48Å; V193-T266 HydrophobicContact CG1-CG2 4.23Å; V193-F269 HydrophobicContact CG1-CD1 3.55Å; V193-F269 HydrophobicContact CG1-CE1 3.76Å; V193-F269 HydrophobicContact CG1-CG 4.48Å; V193-F269 HydrophobicContact CG2-CD1 4.3Å; V193-F269 HydrophobicContact CG2-CG 4.48Å
194W92.2Very high87.5Confident158 Ų15873.7 Ų73.760%0.59838%0.377SS*.Hα-helixtrans-62.3-39.1177.6-171.8-118.4000112.7L190 E191 V192 V196 I197 K198L190-W194 VanDerWaalsContact O-CB 3.28Å; L190-W194 WeakPolarHBondContact O-CB 3.43Å; L190-W194 PolarHBondContact O-N 3.25Å; E191-W194 PolarHBondContact O-N 2.82Å; V192-W194 VanDerWaalsContact C-N 3.29Å; V192-W194 PolarHBondContact O-N 2.85Å; W194-V196 VanDerWaalsContact C-N 3.29Å; W194-V196 PolarHBondContact O-N 2.84Å; W194-I197 PolarHBondContact O-N 2.83Å; W194-K198 WeakPolarHBondContact O-CG 3.47Å; W194-K198 PolarHBondContact O-N 3.39Å; W194-K198 VanDerWaalsContact O-N 3.15Å
195S93.7Very high88.3Confident61 Ų6174 Ų7443%0.42738%0.378SS..Hα-helixtrans-64.3-34.1177.7820000113E191 V192 V193E191-S195 WeakPolarHBondContact O-CB 3.2Å; E191-S195 PolarHBondContact O-N 3.47Å; V192-S195 WeakPolarHBondContact O-CB 3.32Å; V192-S195 PolarHBondContact O-N 3.09Å; V192-S195 PolarHBondContact O-OG 3.22Å; V193-S195 VanDerWaalsContact C-N 3.33Å; V193-S195 PolarHBondContact O-N 3.35Å
196V91.8Very high89.1Confident18 Ų1872.3 Ų72.311%0.10936%0.364CS..Hα-helixtrans-78.6-42178.3173.60000110.9V192 V193 W194 K198 R199 P203 D262 L263 T266V192-V196 WeakPolarHBondContact O-CG2 3.19Å; V192-V196 PolarHBondContact O-N 3.33Å; V193-V196 PolarHBondContact O-N 3.21Å; W194-V196 VanDerWaalsContact C-N 3.29Å; W194-V196 PolarHBondContact O-N 2.84Å; V196-K198 PolarHBondContact O-N 3.1Å; V196-R199 CarbonylContact O-C 3.44Å; V196-R199 WeakPolarHBondContact O-CA 3.35Å; V196-R199 PolarHBondContact O-N 3.33Å; V196-P203 HydrophobicContact CG1-CG 3.67Å; V196-D262 HydrophobicContact CG2-CB 3.89Å; V196-L263 HydrophobicContact CG1-CD1 3.79Å; V196-T266 HydrophobicContact CB-CG2 4Å; V196-T266 WeakPolarHBondContact CB-OG1 3.27Å; V196-T266 HydrophobicContact CG1-CG2 3.71Å
197I91.1Very high89.5Confident61 Ų6173.4 Ų73.431%0.31336%0.36SS..Hα-helixtrans-59.2-34.8176.3-71.2171.9000111.5V193 W194 R199 T266 L270V193-I197 HydrophobicContact CG1-CD1 3.71Å; V193-I197 HydrophobicContact CG1-CG1 4.43Å; V193-I197 WeakPolarHBondContact O-CG1 3.35Å; V193-I197 PolarHBondContact O-N 3.48Å; W194-I197 PolarHBondContact O-N 2.83Å; I197-R199 PolarHBondContact O-N 3.45Å; I197-R199 VanDerWaalsContact O-N 3.1Å; I197-T266 HydrophobicContact CG1-CG2 3.98Å; I197-L270 HydrophobicContact CD1-CD2 4.22Å; I197-L270 HydrophobicContact CG1-CD1 4.46Å
198K93.9Very high90.2Very high144 Ų14475.6 Ų75.663%0.62637%0.368SS*.THydrogen-bonded Turntrans-60.1-17.1172.9-77.3179.7178.6178.70114.1W194 V196 P200W194-K198 WeakPolarHBondContact O-CG 3.47Å; W194-K198 PolarHBondContact O-N 3.39Å; W194-K198 VanDerWaalsContact O-N 3.15Å; V196-K198 PolarHBondContact O-N 3.1Å; K198-P200 VanDerWaalsContact C-CD 3.46Å; K198-P200 VanDerWaalsContact O-CD 3.26Å; K198-P200 WeakPolarHBondContact O-CD 3.21Å
199R91.5Very high90.8Very high202 Ų20274.5 Ų74.576%0.76236%0.363SS*.SBendtrans-111.673.4172.7-62.4-174.1-179-154.51.3109V196 I197 I201 P203V196-R199 CarbonylContact O-C 3.44Å; V196-R199 WeakPolarHBondContact O-CA 3.35Å; V196-R199 PolarHBondContact O-N 3.33Å; I197-R199 PolarHBondContact O-N 3.45Å; I197-R199 VanDerWaalsContact O-N 3.1Å; R199-I201 PolarHBondContact O-N 2.99Å; R199-P203 WeakPolarHBondContact O-CD 3.45Å
200P88.8Confident90.9Very high81 Ų8168.2 Ų68.253%0.52634%0.335SS..THydrogen-bonded Turntrans-68.7-16.9-160.127.8-37.6000114.6K198 A202 P203 A204K198-P200 VanDerWaalsContact C-CD 3.46Å; K198-P200 VanDerWaalsContact O-CD 3.26Å; K198-P200 WeakPolarHBondContact O-CD 3.21Å; P200-A202 PolarHBondContact O-N 3.29Å; P200-P203 WeakPolarHBondContact O-CD 3.34Å; P200-A204 WeakPolarHBondContact O-CB 3.26Å; P200-A204 PolarHBondContact O-N 3.37Å
201I93.5Very high90.9Very high111 Ų11166.7 Ų66.757%0.56932%0.324SS*.Hα-helixtrans-58.6-52.2-173.8-57173.1000111.1R199 I205R199-I201 PolarHBondContact O-N 2.99Å; I201-I205 HydrophobicContact CG2-CD1 4.03Å; I201-I205 WeakPolarHBondContact O-CD1 3.43Å; I201-I205 WeakPolarHBondContact O-CG1 3.42Å; I201-I205 PolarHBondContact O-N 2.86Å; I201-I205 VanDerWaalsContact O-N 3.13Å
202A93.4Very high90.9Very high7 Ų762.7 Ų62.76%0.05831%0.309CS..Hα-helixtrans-70-46.3-176.100000112.9P200 A204 I205 G206 L263 I342P200-A202 PolarHBondContact O-N 3.29Å; A202-A204 VanDerWaalsContact C-N 3.34Å; A202-A204 PolarHBondContact O-N 3Å; A202-I205 PolarHBondContact O-N 3.48Å; A202-G206 PolarHBondContact O-N 3.33Å; A202-G206 VanDerWaalsContact O-N 3.14Å; A202-L263 HydrophobicContact CB-CD1 3.83Å; A202-L263 HydrophobicContact CB-CD2 3.64Å; A202-L263 HydrophobicContact CB-CG 4.4Å; A202-I342 HydrophobicContact CB-CD1 4.36Å
203P91.7Very high91.1Very high8 Ų863 Ų635%0.05231%0.309CS..Hα-helixtrans-59.8-39.3173.1-25.836.1000113.6V196 R199 P200 I205 G206 F207 L263 L270V196-P203 HydrophobicContact CG1-CG 3.67Å; R199-P203 WeakPolarHBondContact O-CD 3.45Å; P200-P203 WeakPolarHBondContact O-CD 3.34Å; P203-I205 VanDerWaalsContact C-N 3.33Å; P203-I205 PolarHBondContact O-N 2.83Å; P203-G206 PolarHBondContact O-N 3.07Å; P203-F207 WeakPolarHBondContact O-CB 3.31Å; P203-F207 PolarHBondContact O-N 3.3Å; P203-L263 HydrophobicContact CB-CD1 4.49Å; P203-L263 HydrophobicContact CG-CD1 3.75Å; P203-L270 HydrophobicContact CB-CD1 4.28Å
204A91.3Very high91.2Very high56 Ų5662.7 Ų62.746%0.46331%0.307SS..Hα-helixtrans-65-37.1178.600000112.2P200 A202 F208P200-A204 WeakPolarHBondContact O-CB 3.26Å; P200-A204 PolarHBondContact O-N 3.37Å; A202-A204 VanDerWaalsContact C-N 3.34Å; A202-A204 PolarHBondContact O-N 3Å; A204-F208 VanDerWaalsContact O-CB 3.31Å; A204-F208 WeakPolarHBondContact O-CB 3.39Å; A204-F208 PolarHBondContact O-N 3.34Å
205I93.5Very high91Very high10 Ų1056.4 Ų56.45%0.05129%0.287CS..Hα-helixtrans-63-48.5173.6-64.8164.4000110.1I201 A202 P203 F207 F208 C209 L328 L332 Q334 I342I201-I205 HydrophobicContact CG2-CD1 4.03Å; I201-I205 WeakPolarHBondContact O-CD1 3.43Å; I201-I205 WeakPolarHBondContact O-CG1 3.42Å; I201-I205 PolarHBondContact O-N 2.86Å; I201-I205 VanDerWaalsContact O-N 3.13Å; A202-I205 PolarHBondContact O-N 3.48Å; P203-I205 VanDerWaalsContact C-N 3.33Å; P203-I205 PolarHBondContact O-N 2.83Å; I205-F207 PolarHBondContact O-N 3.01Å; I205-F208 PolarHBondContact O-N 3.35Å; I205-C209 WeakPolarHBondContact O-CB 3.44Å; I205-C209 PolarHBondContact O-N 3.37Å; I205-C209 PolarHBondContact O-SG 3.42Å; I205-C209 VanDerWaalsContact O-SG 3.35Å; I205-L328 HydrophobicContact CG2-CD2 3.95Å; I205-L328 HydrophobicContact CG2-CG 4Å; I205-L332 HydrophobicContact CD1-CB 3.76Å; I205-L332 HydrophobicContact CD1-CD1 3.46Å; I205-L332 VanDerWaalsContact CD1-CD1 3.46Å; I205-L332 HydrophobicContact CD1-CG 4.26Å; I205-L332 HydrophobicContact CG1-CD1 3.47Å; I205-L332 VanDerWaalsContact CG1-CD1 3.47Å; I205-Q334 HydrophobicContact CD1-CG 3.78Å; I205-I342 HydrophobicContact CB-CD1 4.19Å; I205-I342 HydrophobicContact CG2-CD1 4.08Å; I205-I342 HydrophobicContact CG2-CG2 3.92Å
206G90.7Very high91.1Very high2 Ų258.6 Ų58.62%0.02129%0.293CS..Hα-helixtrans-58.9-46177.300000112.6A202 P203 F208 C209 Q210A202-G206 PolarHBondContact O-N 3.33Å; A202-G206 VanDerWaalsContact O-N 3.14Å; P203-G206 PolarHBondContact O-N 3.07Å; G206-F208 PolarHBondContact O-N 3.07Å; G206-C209 WeakPolarHBondContact O-CB 3.46Å; G206-C209 PolarHBondContact O-N 3.02Å; G206-Q210 PolarHBondContact O-N 3.5Å
207F88Confident91.2Very high104 Ų10458.9 Ų58.946%0.45629%0.294SS..Hα-helixtrans-60.8-45.3176.8-171.7-90.1000112P203 I205 C209 Q210 F211P203-F207 WeakPolarHBondContact O-CB 3.31Å; P203-F207 PolarHBondContact O-N 3.3Å; I205-F207 PolarHBondContact O-N 3.01Å; F207-C209 VanDerWaalsContact C-N 3.34Å; F207-C209 PolarHBondContact O-N 2.86Å; F207-Q210 PolarHBondContact O-N 2.87Å; F207-F211 HydrophobicContact CD1-CD2 4.03Å; F207-F211 AromaticContact CD2-CD2 3.52Å; F207-F211 HydrophobicContact CD2-CD2 3.52Å; F207-F211 AromaticContact CD2-CE2 3.48Å; F207-F211 HydrophobicContact CD2-CE2 3.48Å; F207-F211 VanDerWaalsContact CD2-CE2 3.48Å; F207-F211 HydrophobicContact CE1-CB 4.5Å; F207-F211 AromaticContact CE1-CD2 3.88Å; F207-F211 HydrophobicContact CE1-CD2 3.88Å; F207-F211 HydrophobicContact CE1-CG 4.45Å; F207-F211 AromaticContact CE2-CD2 3.36Å; F207-F211 HydrophobicContact CE2-CD2 3.36Å; F207-F211 AromaticContact CE2-CE2 3.23Å; F207-F211 HydrophobicContact CE2-CE2 3.23Å; F207-F211 HydrophobicContact CE2-CG 4.41Å; F207-F211 HydrophobicContact CE2-CZ 4.21Å; F207-F211 AromaticContact CG-CD2 3.85Å; F207-F211 HydrophobicContact CG-CD2 3.85Å; F207-F211 HydrophobicContact CG-CE2 4.27Å; F207-F211 AromaticContact CZ-CD2 3.54Å; F207-F211 HydrophobicContact CZ-CD2 3.54Å; F207-F211 AromaticContact CZ-CE2 3.85Å; F207-F211 HydrophobicContact CZ-CE2 3.85Å; F207-F211 HydrophobicContact CZ-CG 4.23Å; F207-F211 WeakPolarHBondContact O-CD2 3.48Å; F207-F211 PolarHBondContact O-N 3.35Å
208F90.9Very high91.3Very high102 Ų10256 Ų5645%0.44728%0.279SS..Hα-helixtrans-61.2-43.3175179.5-91.6000111.7A204 I205 G206 Q210 V212 L213 L328A204-F208 VanDerWaalsContact O-CB 3.31Å; A204-F208 WeakPolarHBondContact O-CB 3.39Å; A204-F208 PolarHBondContact O-N 3.34Å; I205-F208 PolarHBondContact O-N 3.35Å; G206-F208 PolarHBondContact O-N 3.07Å; F208-Q210 VanDerWaalsContact C-N 3.33Å; F208-Q210 PolarHBondContact O-N 3.42Å; F208-V212 HydrophobicContact CD2-CB 4.04Å; F208-V212 HydrophobicContact CD2-CG1 4.47Å; F208-V212 HydrophobicContact CD2-CG2 3.92Å; F208-V212 HydrophobicContact CE2-CB 3.89Å; F208-V212 HydrophobicContact CE2-CG1 3.82Å; F208-V212 HydrophobicContact CE2-CG2 4.01Å; F208-V212 HydrophobicContact CG-CB 4.44Å; F208-V212 HydrophobicContact CZ-CB 4.15Å; F208-V212 HydrophobicContact CZ-CG1 3.87Å; F208-V212 WeakPolarHBondContact O-CA 3.27Å; F208-V212 VanDerWaalsContact O-CB 3.27Å; F208-V212 WeakPolarHBondContact O-CB 3.41Å; F208-V212 PolarHBondContact O-N 3.26Å; F208-L213 PolarHBondContact O-N 3.01Å; F208-L213 VanDerWaalsContact O-N 3.1Å; F208-L328 HydrophobicContact CD1-CD2 3.74Å; F208-L328 HydrophobicContact CE1-CD2 4.13Å
209C90.8Very high91.3Very high0 Ų054.1 Ų54.10%027%0.271CS..Iπ-helixtrans-59.4-44.7175.8-77.50000111.9I205 G206 F207 L213 M214 T346I205-C209 WeakPolarHBondContact O-CB 3.44Å; I205-C209 PolarHBondContact O-N 3.37Å; I205-C209 PolarHBondContact O-SG 3.42Å; I205-C209 VanDerWaalsContact O-SG 3.35Å; G206-C209 WeakPolarHBondContact O-CB 3.46Å; G206-C209 PolarHBondContact O-N 3.02Å; F207-C209 VanDerWaalsContact C-N 3.34Å; F207-C209 PolarHBondContact O-N 2.86Å; C209-L213 HydrophobicContact CB-CD2 4.47Å; C209-L213 WeakPolarHBondContact O-CB 3.24Å; C209-L213 PolarHBondContact O-N 3.29Å; C209-M214 WeakPolarHBondContact O-CB 3.32Å; C209-M214 PolarHBondContact O-N 3.41Å; C209-T346 HydrophobicContact CB-CG2 3.69Å; C209-T346 WeakPolarHBondContact CB-OG1 3.36Å
210Q87.4Confident91.6Very high2 Ų246.6 Ų46.61%0.00925%0.252CS..Iπ-helixtrans-74.3-39.1-174.9-166.158.142.200113.3G206 F207 F208 P215 S244 P245 E345 Q349G206-Q210 PolarHBondContact O-N 3.5Å; F207-Q210 PolarHBondContact O-N 2.87Å; F208-Q210 VanDerWaalsContact C-N 3.33Å; F208-Q210 PolarHBondContact O-N 3.42Å; Q210-P215 VanDerWaalsContact O-CD 3.31Å; Q210-P215 WeakPolarHBondContact O-CD 3.47Å; Q210-S244 PolarHBondContact NE2-O 2.97Å; Q210-P245 HydrophobicContact CG-CB 4.43Å; Q210-P245 VanDerWaalsContact NE2-CA 3.3Å; Q210-E345 PolarHBondContact OE1-O 3.32Å; Q210-Q349 VanDerWaalsContact NE2-OE1 3.14Å
211F87.5Confident91.9Very high91 Ų9143.6 Ų43.640%0.39923%0.232SC..Iπ-helixtrans-102.9-10-172.7-67.1-73.2000114.5F207F207-F211 HydrophobicContact CD1-CD2 4.03Å; F207-F211 AromaticContact CD2-CD2 3.52Å; F207-F211 HydrophobicContact CD2-CD2 3.52Å; F207-F211 AromaticContact CD2-CE2 3.48Å; F207-F211 HydrophobicContact CD2-CE2 3.48Å; F207-F211 VanDerWaalsContact CD2-CE2 3.48Å; F207-F211 HydrophobicContact CE1-CB 4.5Å; F207-F211 AromaticContact CE1-CD2 3.88Å; F207-F211 HydrophobicContact CE1-CD2 3.88Å; F207-F211 HydrophobicContact CE1-CG 4.45Å; F207-F211 AromaticContact CE2-CD2 3.36Å; F207-F211 HydrophobicContact CE2-CD2 3.36Å; F207-F211 AromaticContact CE2-CE2 3.23Å; F207-F211 HydrophobicContact CE2-CE2 3.23Å; F207-F211 HydrophobicContact CE2-CG 4.41Å; F207-F211 HydrophobicContact CE2-CZ 4.21Å; F207-F211 AromaticContact CG-CD2 3.85Å; F207-F211 HydrophobicContact CG-CD2 3.85Å; F207-F211 HydrophobicContact CG-CE2 4.27Å; F207-F211 AromaticContact CZ-CD2 3.54Å; F207-F211 HydrophobicContact CZ-CD2 3.54Å; F207-F211 AromaticContact CZ-CE2 3.85Å; F207-F211 HydrophobicContact CZ-CE2 3.85Å; F207-F211 HydrophobicContact CZ-CG 4.23Å; F207-F211 WeakPolarHBondContact O-CD2 3.48Å; F207-F211 PolarHBondContact O-N 3.35Å
212V89.3Confident91.9Very high57 Ų5738.5 Ų38.535%0.34521%0.207SC..Iπ-helixtrans-123.4-58.4177.5-175.10000110.9F208 L216F208-V212 HydrophobicContact CD2-CB 4.04Å; F208-V212 HydrophobicContact CD2-CG1 4.47Å; F208-V212 HydrophobicContact CD2-CG2 3.92Å; F208-V212 HydrophobicContact CE2-CB 3.89Å; F208-V212 HydrophobicContact CE2-CG1 3.82Å; F208-V212 HydrophobicContact CE2-CG2 4.01Å; F208-V212 HydrophobicContact CG-CB 4.44Å; F208-V212 HydrophobicContact CZ-CB 4.15Å; F208-V212 HydrophobicContact CZ-CG1 3.87Å; F208-V212 WeakPolarHBondContact O-CA 3.27Å; F208-V212 VanDerWaalsContact O-CB 3.27Å; F208-V212 WeakPolarHBondContact O-CB 3.41Å; F208-V212 PolarHBondContact O-N 3.26Å; V212-L216 HydrophobicContact CG1-CD1 3.91Å; V212-L216 WeakPolarHBondContact O-CB 3.25Å; V212-L216 WeakPolarHBondContact O-CG 3.43Å; V212-L216 PolarHBondContact O-N 2.95Å; V212-L216 VanDerWaalsContact O-N 3.15Å
213L92.5Very high92Very high42 Ų4242 Ų4222%0.2222%0.222CC..Iπ-helixtrans-64.4-48.1-173.2-174.564.7000112.3F208 C209 L216 I217 T346F208-L213 PolarHBondContact O-N 3.01Å; F208-L213 VanDerWaalsContact O-N 3.1Å; C209-L213 HydrophobicContact CB-CD2 4.47Å; C209-L213 WeakPolarHBondContact O-CB 3.24Å; C209-L213 PolarHBondContact O-N 3.29Å; L213-L216 PolarHBondContact O-N 3.29Å; L213-I217 HydrophobicContact CD1-CD1 4.13Å; L213-I217 HydrophobicContact CD1-CG1 4.46Å; L213-I217 HydrophobicContact CD2-CD1 4.43Å; L213-I217 HydrophobicContact CG-CD1 3.79Å; L213-I217 HydrophobicContact CG-CG1 4.47Å; L213-I217 VanDerWaalsContact O-CG1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.28Å; L213-I217 PolarHBondContact O-N 3.13Å; L213-T346 HydrophobicContact CD2-CG2 4.49Å
214M91.6Very high92.2Very high0 Ų047.9 Ų47.90%025%0.252CS..Hα-helixtrans-67.3-44.6-177.4-82.7-61.3-57.700114C209 L216 I217 S218 G242 V317 G321 T346 Q349C209-M214 WeakPolarHBondContact O-CB 3.32Å; C209-M214 PolarHBondContact O-N 3.41Å; M214-L216 VanDerWaalsContact C-N 3.29Å; M214-L216 PolarHBondContact O-N 3.38Å; M214-I217 PolarHBondContact O-N 3.33Å; M214-I217 HydrophobicContact SD-CD1 4.44Å; M214-S218 WeakPolarHBondContact O-CB 3.15Å; M214-S218 PolarHBondContact O-N 2.99Å; M214-S218 PolarHBondContact O-OG 2.73Å; M214-G242 WeakPolarHBondContact CB-O 3.44Å; M214-V317 HydrophobicContact CE-CG1 3.71Å; M214-G321 WeakPolarHBondContact SD-CA 3.44Å; M214-T346 HydrophobicContact CG-CG2 3.71Å; M214-T346 WeakPolarHBondContact CG-O 3.4Å; M214-T346 HydrophobicContact SD-CG2 4.09Å; M214-Q349 VanDerWaalsContact CE-CD 3.48Å; M214-Q349 HydrophobicContact CE-CG 4.04Å; M214-Q349 VanDerWaalsContact CE-NE2 3.33Å
215P89.1Confident92.3Very high26 Ų2646 Ų4617%0.16924%0.237CC..Hα-helixtrans-56.8-40.6169.7-30.137.4000113.1Q210 S218 F219 F239Q210-P215 VanDerWaalsContact O-CD 3.31Å; Q210-P215 WeakPolarHBondContact O-CD 3.47Å; P215-S218 WeakPolarHBondContact CA-OG 3.43Å; P215-S218 PolarHBondContact O-OG 3.32Å; P215-S218 VanDerWaalsContact O-OG 3.1Å; P215-F219 WeakPolarHBondContact O-CB 3.2Å; P215-F219 PolarHBondContact O-N 3.4Å; P215-F239 HydrophobicContact CB-CE2 4.39Å
216L94.1Very high92.3Very high107 Ų10745.6 Ų45.656%0.5623%0.234SC*.Hα-helixtrans-67.3-43.8177.1-71.5173.5000112.5V212 L213 M214 A220V212-L216 HydrophobicContact CG1-CD1 3.91Å; V212-L216 WeakPolarHBondContact O-CB 3.25Å; V212-L216 WeakPolarHBondContact O-CG 3.43Å; V212-L216 PolarHBondContact O-N 2.95Å; V212-L216 VanDerWaalsContact O-N 3.15Å; L213-L216 PolarHBondContact O-N 3.29Å; M214-L216 VanDerWaalsContact C-N 3.29Å; M214-L216 PolarHBondContact O-N 3.38Å; L216-A220 VanDerWaalsContact O-CB 3.3Å; L216-A220 WeakPolarHBondContact O-CB 3.08Å; L216-A220 PolarHBondContact O-N 2.67Å
217I95.3Very high92.3Very high24 Ų2449 Ų4912%0.12325%0.251CS..Hα-helixtrans-60.5-51.1176.3-72.8169.1000110.1L213 M214 F219 A220 V221 L320L213-I217 HydrophobicContact CD1-CD1 4.13Å; L213-I217 HydrophobicContact CD1-CG1 4.46Å; L213-I217 HydrophobicContact CD2-CD1 4.43Å; L213-I217 HydrophobicContact CG-CD1 3.79Å; L213-I217 HydrophobicContact CG-CG1 4.47Å; L213-I217 VanDerWaalsContact O-CG1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.28Å; L213-I217 PolarHBondContact O-N 3.13Å; M214-I217 PolarHBondContact O-N 3.33Å; M214-I217 HydrophobicContact SD-CD1 4.44Å; I217-F219 PolarHBondContact O-N 2.94Å; I217-A220 PolarHBondContact O-N 2.97Å; I217-V221 VanDerWaalsContact O-CG2 3.31Å; I217-V221 WeakPolarHBondContact O-CG2 3.36Å; I217-V221 PolarHBondContact O-N 3.47Å; I217-L320 HydrophobicContact CD1-CB 4.17Å; I217-L320 HydrophobicContact CG2-CB 3.76Å; I217-L320 HydrophobicContact CG2-CD1 3.99Å
218S93.3Very high92.5Very high0 Ų048.4 Ų48.40%026%0.258CS..Hα-helixtrans-66.7-37.1-176.961.90000112.5M214 P215 V221 A222M214-S218 WeakPolarHBondContact O-CB 3.15Å; M214-S218 PolarHBondContact O-N 2.99Å; M214-S218 PolarHBondContact O-OG 2.73Å; P215-S218 WeakPolarHBondContact CA-OG 3.43Å; P215-S218 PolarHBondContact O-OG 3.32Å; P215-S218 VanDerWaalsContact O-OG 3.1Å; S218-V221 PolarHBondContact O-N 3.34Å; S218-A222 WeakPolarHBondContact O-CB 3.32Å; S218-A222 PolarHBondContact O-N 2.96Å
219F93.6Very high92.4Very high104 Ų10449.6 Ų49.646%0.45626%0.26SS..Hα-helixtrans-64.3-45.1171.8-178-103.7000112.2P215 I217 V221 A222 Q223 F239P215-F219 WeakPolarHBondContact O-CB 3.2Å; P215-F219 PolarHBondContact O-N 3.4Å; I217-F219 PolarHBondContact O-N 2.94Å; F219-V221 VanDerWaalsContact C-N 3.34Å; F219-V221 PolarHBondContact O-N 3.34Å; F219-A222 WeakPolarHBondContact O-CB 3.34Å; F219-A222 PolarHBondContact O-N 2.99Å; F219-A222 VanDerWaalsContact O-N 3.15Å; F219-Q223 HydrophobicContact CD1-CG 4.06Å; F219-Q223 HydrophobicContact CE1-CG 3.77Å; F219-Q223 HydrophobicContact CE2-CG 4.24Å; F219-Q223 HydrophobicContact CG-CG 4.44Å; F219-Q223 HydrophobicContact CZ-CG 3.89Å; F219-Q223 VanDerWaalsContact O-CG 3.29Å; F219-Q223 WeakPolarHBondContact O-CG 3.47Å; F219-Q223 PolarHBondContact O-N 2.92Å; F219-F239 HydrophobicContact CB-CD2 3.96Å; F219-F239 HydrophobicContact CB-CE2 4.06Å; F219-F239 HydrophobicContact CD2-CD2 4.47Å
220A96.8Very high92.2Very high45 Ų4552.3 Ų52.337%0.37229%0.289SS..Hα-helixtrans-61.4-43.117700000111.5L216 I217 A222 Q223 I224L216-A220 VanDerWaalsContact O-CB 3.3Å; L216-A220 WeakPolarHBondContact O-CB 3.08Å; L216-A220 PolarHBondContact O-N 2.67Å; I217-A220 PolarHBondContact O-N 2.97Å; A220-A222 VanDerWaalsContact C-N 3.33Å; A220-A222 PolarHBondContact O-N 3.19Å; A220-Q223 PolarHBondContact O-N 3.21Å; A220-I224 VanDerWaalsContact O-CG1 3.31Å; A220-I224 WeakPolarHBondContact O-CG1 3.48Å; A220-I224 PolarHBondContact O-N 2.97Å
221V96.4Very high92.2Very high17 Ų1754.7 Ų54.710%0.10330%0.3CS..Hα-helixtrans-60.7-43.2173.6171.60000110.7I217 S218 F219 Q223 I224 A225 V238 A313 C316 V317 L320I217-V221 VanDerWaalsContact O-CG2 3.31Å; I217-V221 WeakPolarHBondContact O-CG2 3.36Å; I217-V221 PolarHBondContact O-N 3.47Å; S218-V221 PolarHBondContact O-N 3.34Å; F219-V221 VanDerWaalsContact C-N 3.34Å; F219-V221 PolarHBondContact O-N 3.34Å; V221-Q223 PolarHBondContact O-N 2.97Å; V221-I224 PolarHBondContact O-N 2.92Å; V221-A225 WeakPolarHBondContact O-CB 3.24Å; V221-A225 PolarHBondContact O-N 2.68Å; V221-V238 HydrophobicContact CG1-CG2 4.15Å; V221-A313 HydrophobicContact CG1-CB 3.68Å; V221-C316 HydrophobicContact CG2-CB 4.17Å; V221-V317 HydrophobicContact CB-CG2 4.43Å; V221-V317 HydrophobicContact CG1-CG2 4.29Å; V221-V317 HydrophobicContact CG2-CG2 4.41Å; V221-L320 HydrophobicContact CG2-CD1 4.4Å
222A93.8Very high92.4Very high5 Ų554.5 Ų54.54%0.04131%0.307CS..Hα-helixtrans-61-45.4177.200000112.4S218 F219 A220 I224 F226 I227 V238S218-A222 WeakPolarHBondContact O-CB 3.32Å; S218-A222 PolarHBondContact O-N 2.96Å; F219-A222 WeakPolarHBondContact O-CB 3.34Å; F219-A222 PolarHBondContact O-N 2.99Å; F219-A222 VanDerWaalsContact O-N 3.15Å; A220-A222 VanDerWaalsContact C-N 3.33Å; A220-A222 PolarHBondContact O-N 3.19Å; A222-I224 VanDerWaalsContact C-N 3.31Å; A222-I224 PolarHBondContact O-N 3.16Å; A222-F226 PolarHBondContact O-N 3.35Å; A222-I227 PolarHBondContact O-N 3.22Å; A222-V238 HydrophobicContact CB-CG1 3.7Å
223Q94.8Very high92.5Very high79 Ų7952.2 Ų52.237%0.36929%0.294SS..Hα-helixtrans-65.4-31.5179.9-70.9-70.617.700113.1F219 A220 V221 P228F219-Q223 HydrophobicContact CD1-CG 4.06Å; F219-Q223 HydrophobicContact CE1-CG 3.77Å; F219-Q223 HydrophobicContact CE2-CG 4.24Å; F219-Q223 HydrophobicContact CG-CG 4.44Å; F219-Q223 HydrophobicContact CZ-CG 3.89Å; F219-Q223 VanDerWaalsContact O-CG 3.29Å; F219-Q223 WeakPolarHBondContact O-CG 3.47Å; F219-Q223 PolarHBondContact O-N 2.92Å; A220-Q223 PolarHBondContact O-N 3.21Å; V221-Q223 PolarHBondContact O-N 2.97Å; Q223-P228 WeakPolarHBondContact O-CD 3.3Å; Q223-P228 VanDerWaalsContact O-CG 3.3Å; Q223-P228 WeakPolarHBondContact O-CG 3.13Å
224I95.2Very high92.6Very high132 Ų13250.4 Ų50.468%0.67728%0.284SS*.Hα-helixtrans-85.5-43.4178.9-65166.7000111A220 V221 A222A220-I224 VanDerWaalsContact O-CG1 3.31Å; A220-I224 WeakPolarHBondContact O-CG1 3.48Å; A220-I224 PolarHBondContact O-N 2.97Å; V221-I224 PolarHBondContact O-N 2.92Å; A222-I224 VanDerWaalsContact C-N 3.31Å; A222-I224 PolarHBondContact O-N 3.16Å
225A94.2Very high92.6Very high18 Ų1850.6 Ų50.615%0.14929%0.286CS..Hα-helixtrans-87.7-29.6-168.400000114.2V221 Y229 A313V221-A225 WeakPolarHBondContact O-CB 3.24Å; V221-A225 PolarHBondContact O-N 2.68Å; A225-Y229 WeakPolarHBondContact O-CD2 3.35Å; A225-A313 HydrophobicContact CB-CB 3.9Å
226F94.2Very high92.7Very high0 Ų051.7 Ų51.70%029%0.29CS..THydrogen-bonded Turntrans-127.4-47-165.2-61-58.4000115A222 Y229 G230 M231 M234 V238 A310 A313 M373A222-F226 PolarHBondContact O-N 3.35Å; F226-Y229 CarbonylContact O-C 3.49Å; F226-Y229 PolarHBondContact O-N 3.45Å; F226-G230 PolarHBondContact O-N 3.47Å; F226-M231 HydrophobicContact CB-CB 4.05Å; F226-M231 HydrophobicContact CD1-CB 4.03Å; F226-M231 HydrophobicContact CD1-CE 4.03Å; F226-M231 HydrophobicContact CD1-SD 4.33Å; F226-M231 HydrophobicContact CE1-CE 4.18Å; F226-M231 HydrophobicContact CG-CB 4.47Å; F226-M231 PolarHBondContact O-N 2.87Å; F226-M231 VanDerWaalsContact O-N 3.1Å; F226-M234 HydrophobicContact CD1-CB 3.61Å; F226-M234 HydrophobicContact CD2-CB 4.25Å; F226-M234 HydrophobicContact CE1-CB 3.65Å; F226-M234 HydrophobicContact CE1-CG 4.42Å; F226-M234 HydrophobicContact CE2-CB 4.27Å; F226-M234 HydrophobicContact CG-CB 3.92Å; F226-M234 HydrophobicContact CZ-CB 3.98Å; F226-V238 HydrophobicContact CD2-CG1 3.88Å; F226-V238 HydrophobicContact CE2-CB 4.09Å; F226-V238 HydrophobicContact CE2-CG1 3.69Å; F226-A310 HydrophobicContact CE1-CB 4.34Å; F226-A310 HydrophobicContact CZ-CB 4.37Å; F226-A313 HydrophobicContact CE2-CB 3.73Å; F226-A313 HydrophobicContact CZ-CB 3.7Å; F226-M373 HydrophobicContact CE2-SD 4.01Å; F226-M373 HydrophobicContact CZ-CE 4.03Å; F226-M373 HydrophobicContact CZ-CG 4.48Å; F226-M373 HydrophobicContact CZ-SD 3.57Å; F226-M373 VanDerWaalsContact CZ-SD 3.57Å
227I89.9Confident92.7Very high73 Ų7346.6 Ų46.637%0.37426%0.264SS..G310 helixtrans-58.1-44.1-174.5-58.3-56.8000113.3A222 Y229 G230 T232A222-I227 PolarHBondContact O-N 3.22Å; I227-Y229 PolarHBondContact O-N 3.28Å; I227-Y229 VanDerWaalsContact O-N 3.08Å; I227-G230 PolarHBondContact O-N 3.22Å; I227-G230 VanDerWaalsContact O-N 3.1Å; I227-T232 HydrophobicContact CD1-CG2 4.17Å
228P91.6Very high92.6Very high92 Ų9245.5 Ų45.560%0.59726%0.258SS*.G310 helixtrans-64.3-17.4178.8-22.835.3000113.7Q223Q223-P228 WeakPolarHBondContact O-CD 3.3Å; Q223-P228 VanDerWaalsContact O-CG 3.3Å; Q223-P228 WeakPolarHBondContact O-CG 3.13Å
229Y88.9Confident92.6Very high127 Ų12749 Ų4950%0.49827%0.273SS..G310 helixtrans-1069-178.4-55.5-76.1000112.7A225 F226 I227 M231A225-Y229 WeakPolarHBondContact O-CD2 3.35Å; F226-Y229 CarbonylContact O-C 3.49Å; F226-Y229 PolarHBondContact O-N 3.45Å; I227-Y229 PolarHBondContact O-N 3.28Å; I227-Y229 VanDerWaalsContact O-N 3.08Å; Y229-M231 PolarHBondContact O-N 2.91Å
230G86.4Confident92.4Very high58 Ų5844.4 Ų44.460%0.59825%0.254SS*.THydrogen-bonded Turntrans68.714.3-179.600000114.6F226 I227 T232F226-G230 PolarHBondContact O-N 3.47Å; I227-G230 PolarHBondContact O-N 3.22Å; I227-G230 VanDerWaalsContact O-N 3.1Å; G230-T232 PolarHBondContact O-N 2.92Å; G230-T232 VanDerWaalsContact O-N 3.12Å
231M89Confident92.1Very high52 Ų5242.3 Ų42.326%0.25624%0.236SC..  trans-88.650.9-178.4-65.3178.861.500111.7F226 Y229 A233 M234 G235F226-M231 HydrophobicContact CB-CB 4.05Å; F226-M231 HydrophobicContact CD1-CB 4.03Å; F226-M231 HydrophobicContact CD1-CE 4.03Å; F226-M231 HydrophobicContact CD1-SD 4.33Å; F226-M231 HydrophobicContact CE1-CE 4.18Å; F226-M231 HydrophobicContact CG-CB 4.47Å; F226-M231 PolarHBondContact O-N 2.87Å; F226-M231 VanDerWaalsContact O-N 3.1Å; Y229-M231 PolarHBondContact O-N 2.91Å; M231-A233 VanDerWaalsContact C-N 3.33Å; M231-A233 PolarHBondContact O-N 3.1Å; M231-M234 HydrophobicContact CB-CB 4.35Å; M231-M234 HydrophobicContact CB-CG 4.48Å; M231-M234 HydrophobicContact CE-CB 4.3Å; M231-M234 HydrophobicContact CE-CE 4.18Å; M231-M234 HydrophobicContact CE-CG 3.74Å; M231-M234 PolarHBondContact O-N 3.35Å; M231-M234 VanDerWaalsContact O-N 3.08Å; M231-G235 PolarHBondContact O-N 3.32Å
232T91.6Very high91.7Very high87 Ų8741.5 Ų41.553%0.53423%0.231SC..Hα-helixtrans-58.3-38.9-17152.30000113.6I227 G230 M234 G235 L236I227-T232 HydrophobicContact CD1-CG2 4.17Å; G230-T232 PolarHBondContact O-N 2.92Å; G230-T232 VanDerWaalsContact O-N 3.12Å; T232-M234 VanDerWaalsContact C-N 3.33Å; T232-M234 PolarHBondContact O-N 2.97Å; T232-G235 WeakPolarHBondContact O-CA 3.45Å; T232-G235 PolarHBondContact O-N 3.34Å; T232-G235 VanDerWaalsContact O-N 3.14Å; T232-L236 WeakPolarHBondContact O-CB 3.28Å; T232-L236 PolarHBondContact O-N 3.3Å
233A91.4Very high91.3Very high9 Ų943.2 Ų43.27%0.07424%0.243CC..Hα-helixtrans-59.9-40.3176.100000112.7M231 L236 G237 D366 I369 A370M231-A233 VanDerWaalsContact C-N 3.33Å; M231-A233 PolarHBondContact O-N 3.1Å; A233-L236 PolarHBondContact O-N 3.48Å; A233-G237 PolarHBondContact O-N 3.32Å; A233-D366 HydrophobicContact CB-CB 4.18Å; A233-I369 HydrophobicContact CB-CB 4.15Å; A233-I369 HydrophobicContact CB-CG2 3.85Å; A233-A370 WeakPolarHBondContact O-CA 3.4Å; A233-A370 WeakPolarHBondContact O-CB 3.49Å
234M93.3Very high90.8Very high4 Ų439.8 Ų39.82%0.0223%0.227CC..Hα-helixtrans-69.9-39.1175.3-61.9-73.3-111.800110.9F226 M231 T232 L236 G237 V238 V305 A310 I369 V372 M373F226-M234 HydrophobicContact CD1-CB 3.61Å; F226-M234 HydrophobicContact CD2-CB 4.25Å; F226-M234 HydrophobicContact CE1-CB 3.65Å; F226-M234 HydrophobicContact CE1-CG 4.42Å; F226-M234 HydrophobicContact CE2-CB 4.27Å; F226-M234 HydrophobicContact CG-CB 3.92Å; F226-M234 HydrophobicContact CZ-CB 3.98Å; M231-M234 HydrophobicContact CB-CB 4.35Å; M231-M234 HydrophobicContact CB-CG 4.48Å; M231-M234 HydrophobicContact CE-CB 4.3Å; M231-M234 HydrophobicContact CE-CE 4.18Å; M231-M234 HydrophobicContact CE-CG 3.74Å; M231-M234 PolarHBondContact O-N 3.35Å; M231-M234 VanDerWaalsContact O-N 3.08Å; T232-M234 VanDerWaalsContact C-N 3.33Å; T232-M234 PolarHBondContact O-N 2.97Å; M234-L236 VanDerWaalsContact C-N 3.33Å; M234-L236 PolarHBondContact O-N 3.41Å; M234-G237 PolarHBondContact O-N 3.47Å; M234-V238 PolarHBondContact O-N 3.22Å; M234-V305 HydrophobicContact CE-CG1 3.84Å; M234-A310 HydrophobicContact CE-CB 3.96Å; M234-I369 HydrophobicContact CG-CG2 3.71Å; M234-I369 HydrophobicContact SD-CG2 3.52Å; M234-I369 VanDerWaalsContact SD-CG2 3.52Å; M234-V372 HydrophobicContact CE-CG1 4.49Å; M234-V372 HydrophobicContact SD-CB 4.39Å; M234-M373 HydrophobicContact CB-CE 4.2Å; M234-M373 HydrophobicContact CB-CG 4.44Å; M234-M373 HydrophobicContact CE-CE 3.18Å; M234-M373 HydrophobicContact CG-CE 4.25Å; M234-M373 WeakPolarHBondContact O-CG 3.47Å; M234-M373 HydrophobicContact SD-CE 3.25Å; M234-M373 WeakPolarHBondContact SD-CE 3.11Å; M234-M373 HydrophobicContact SD-CG 4.47Å
235G92.9Very high90Very high3 Ų334.6 Ų34.63%0.03120%0.202CC..Hα-helixtrans-57.7-44.717300000113M231 T232 V238 F239M231-G235 PolarHBondContact O-N 3.32Å; T232-G235 WeakPolarHBondContact O-CA 3.45Å; T232-G235 PolarHBondContact O-N 3.34Å; T232-G235 VanDerWaalsContact O-N 3.14Å; G235-V238 WeakPolarHBondContact O-CG1 3.25Å; G235-F239 WeakPolarHBondContact O-CB 3.48Å; G235-F239 PolarHBondContact O-N 3.26Å; G235-F239 VanDerWaalsContact O-N 3.08Å
236L91.2Very high89Confident50 Ų5033.7 Ų33.726%0.26220%0.195SC..Hα-helixtrans-63.7-44.8173.8175.367.7000111.3T232 A233 M234 V238 F239 T240 L358 F362T232-L236 WeakPolarHBondContact O-CB 3.28Å; T232-L236 PolarHBondContact O-N 3.3Å; A233-L236 PolarHBondContact O-N 3.48Å; M234-L236 VanDerWaalsContact C-N 3.33Å; M234-L236 PolarHBondContact O-N 3.41Å; L236-V238 PolarHBondContact O-N 2.92Å; L236-F239 PolarHBondContact O-N 3.21Å; L236-T240 WeakPolarHBondContact O-CB 3.41Å; L236-T240 PolarHBondContact O-N 2.84Å; L236-T240 PolarHBondContact O-OG1 3.39Å; L236-T240 VanDerWaalsContact O-OG1 3.07Å; L236-L358 HydrophobicContact CD2-CD2 4.3Å; L236-L358 HydrophobicContact CG-CD2 4.06Å; L236-F362 HydrophobicContact CD1-CE2 4.26Å; L236-F362 HydrophobicContact CD1-CZ 3.88Å; L236-F362 HydrophobicContact CD2-CD1 3.79Å; L236-F362 HydrophobicContact CD2-CD2 3.83Å; L236-F362 HydrophobicContact CD2-CE1 3.39Å; L236-F362 HydrophobicContact CD2-CE2 3.45Å; L236-F362 VanDerWaalsContact CD2-CE2 3.45Å; L236-F362 HydrophobicContact CD2-CG 4.01Å; L236-F362 HydrophobicContact CD2-CZ 3.21Å; L236-F362 HydrophobicContact CG-CE2 4.19Å; L236-F362 HydrophobicContact CG-CZ 4.07Å
237G93.1Very high88.1Confident0 Ų034 Ų340%020%0.198CC..Hα-helixtrans-57.8-44.7177.700000113.5A233 M234 A241 A370A233-G237 PolarHBondContact O-N 3.32Å; M234-G237 PolarHBondContact O-N 3.47Å; G237-A241 WeakPolarHBondContact O-CB 3.24Å; G237-A241 PolarHBondContact O-N 2.97Å; G237-A370 VanDerWaalsContact CA-O 3.31Å; G237-A370 WeakPolarHBondContact CA-O 3.47Å
238V93.9Very high87.4Confident0 Ų031 Ų310%019%0.185CC..Hα-helixtrans-70.5-36.3178.969.60000111.6V221 A222 F226 M234 G235 L236 A241 G242 V317 M373V221-V238 HydrophobicContact CG1-CG2 4.15Å; A222-V238 HydrophobicContact CB-CG1 3.7Å; F226-V238 HydrophobicContact CD2-CG1 3.88Å; F226-V238 HydrophobicContact CE2-CB 4.09Å; F226-V238 HydrophobicContact CE2-CG1 3.69Å; M234-V238 PolarHBondContact O-N 3.22Å; G235-V238 WeakPolarHBondContact O-CG1 3.25Å; L236-V238 PolarHBondContact O-N 2.92Å; V238-A241 PolarHBondContact O-N 3.36Å; V238-G242 PolarHBondContact O-N 3.36Å; V238-V317 HydrophobicContact CG2-CG2 3.42Å; V238-V317 VanDerWaalsContact CG2-CG2 3.42Å; V238-M373 HydrophobicContact CB-CB 4.19Å; V238-M373 HydrophobicContact CB-CG 3.93Å; V238-M373 HydrophobicContact CB-SD 4.43Å
239F92.9Very high86.9Confident74 Ų7428.4 Ų28.433%0.32517%0.171SC..Hα-helixtrans-64.7-50174.9178.7-107.1000111.3P215 F219 G235 L236 A241 G242 C243P215-F239 HydrophobicContact CB-CE2 4.39Å; F219-F239 HydrophobicContact CB-CD2 3.96Å; F219-F239 HydrophobicContact CB-CE2 4.06Å; F219-F239 HydrophobicContact CD2-CD2 4.47Å; G235-F239 WeakPolarHBondContact O-CB 3.48Å; G235-F239 PolarHBondContact O-N 3.26Å; G235-F239 VanDerWaalsContact O-N 3.08Å; L236-F239 PolarHBondContact O-N 3.21Å; F239-A241 VanDerWaalsContact C-N 3.28Å; F239-A241 PolarHBondContact O-N 3.03Å; F239-G242 PolarHBondContact O-N 2.84Å; F239-G242 VanDerWaalsContact O-N 3.1Å; F239-C243 VanDerWaalsContact CE2-SG 3.51Å; F239-C243 WeakPolarHBondContact CZ-SG 3.3Å; F239-C243 WeakPolarHBondContact O-CB 2.93Å; F239-C243 PolarHBondContact O-N 2.6Å; F239-C243 PolarHBondContact O-SG 3.4Å; F239-C243 VanDerWaalsContact O-SG 3.35Å
240T89.6Confident86.8Confident8 Ų822.3 Ų22.35%0.04915%0.147CC..Hα-helixtrans-60.8-38.5177-58.90000111.7L236 C243 S244 A354 M357 L358L236-T240 WeakPolarHBondContact O-CB 3.41Å; L236-T240 PolarHBondContact O-N 2.84Å; L236-T240 PolarHBondContact O-OG1 3.39Å; L236-T240 VanDerWaalsContact O-OG1 3.07Å; T240-C243 PolarHBondContact O-N 3.24Å; T240-S244 PolarHBondContact O-N 2.91Å; T240-S244 VanDerWaalsContact O-N 3.16Å; T240-S244 PolarHBondContact O-OG 3.24Å; T240-A354 HydrophobicContact CG2-CB 4.15Å; T240-M357 HydrophobicContact CG2-SD 3.59Å; T240-M357 VanDerWaalsContact CG2-SD 3.59Å; T240-L358 HydrophobicContact CG2-CD1 4.35Å; T240-L358 HydrophobicContact CG2-CD2 4.16Å; T240-L358 HydrophobicContact CG2-CG 3.97Å
241A91.2Very high86.7Confident0 Ų020 Ų200%012%0.121CC..Hα-helixtrans-61-43173.900000112.3G237 V238 F239 S244 Q349 P374 V377G237-A241 WeakPolarHBondContact O-CB 3.24Å; G237-A241 PolarHBondContact O-N 2.97Å; V238-A241 PolarHBondContact O-N 3.36Å; F239-A241 VanDerWaalsContact C-N 3.28Å; F239-A241 PolarHBondContact O-N 3.03Å; A241-S244 PolarHBondContact O-N 2.84Å; A241-Q349 WeakPolarHBondContact O-CB 3.46Å; A241-Q349 WeakPolarHBondContact O-CG 3.25Å; A241-P374 HydrophobicContact CB-CB 4.34Å; A241-P374 HydrophobicContact CB-CG 4.09Å; A241-V377 HydrophobicContact CB-CB 4.5Å; A241-V377 HydrophobicContact CB-CG2 4.08Å
242G87.5Confident86.5Confident0 Ų019.3 Ų19.30%012%0.124CC..Hα-helixtrans-77.1-21.7178.600000114.9M214 V238 F239 S244 Q349M214-G242 WeakPolarHBondContact CB-O 3.44Å; V238-G242 PolarHBondContact O-N 3.36Å; F239-G242 PolarHBondContact O-N 2.84Å; F239-G242 VanDerWaalsContact O-N 3.1Å; G242-S244 VanDerWaalsContact C-N 3.33Å; G242-Q349 PolarHBondContact O-OE1 3Å; G242-Q349 VanDerWaalsContact O-OE1 3.13Å
243C85.1Confident86.4Confident42 Ų4217.7 Ų17.728%0.28411%0.108SC..Hα-helixtrans-83.6-11.2173-69.50000112.9F239 T240F239-C243 VanDerWaalsContact CE2-SG 3.51Å; F239-C243 WeakPolarHBondContact CZ-SG 3.3Å; F239-C243 WeakPolarHBondContact O-CB 2.93Å; F239-C243 PolarHBondContact O-N 2.6Å; F239-C243 PolarHBondContact O-SG 3.4Å; F239-C243 VanDerWaalsContact O-SG 3.35Å; T240-C243 PolarHBondContact O-N 3.24Å
244S85Confident86.3Confident7 Ų717.2 Ų17.25%0.04911%0.105CC..SBendtrans-76.6118.4-177-67.20000110.2Q210 T240 A241 G242 Q349 N350 A354Q210-S244 PolarHBondContact NE2-O 2.97Å; T240-S244 PolarHBondContact O-N 2.91Å; T240-S244 VanDerWaalsContact O-N 3.16Å; T240-S244 PolarHBondContact O-OG 3.24Å; A241-S244 PolarHBondContact O-N 2.84Å; G242-S244 VanDerWaalsContact C-N 3.33Å; S244-Q349 PolarHBondContact O-OE1 3.13Å; S244-N350 WeakPolarHBondContact CB-O 3.49Å; S244-A354 VanDerWaalsContact OG-CB 3.32Å; S244-A354 WeakPolarHBondContact OG-CB 3.34Å
245P77.8Confident86Confident22 Ų2222.5 Ų22.514%0.14313%0.125CC..PPolyproline II helixtrans-52153.8-17822.8-33.5000112.8Q210 M272 N350Q210-P245 HydrophobicContact CG-CB 4.43Å; Q210-P245 VanDerWaalsContact NE2-CA 3.3Å; P245-M272 HydrophobicContact CB-CG 3.71Å; P245-M272 HydrophobicContact CB-SD 4.49Å; P245-M272 HydrophobicContact CG-CE 4.03Å; P245-M272 HydrophobicContact CG-CG 3.48Å; P245-M272 VanDerWaalsContact CG-CG 3.48Å; P245-M272 HydrophobicContact CG-SD 3.93Å; P245-N350 WeakPolarHBondContact O-CB 3.43Å; P245-N350 PolarHBondContact O-N 3.05Å
246G72.5Confident85.8Confident0 Ų025.1 Ų25.10%014%0.138CC..PPolyproline II helixtrans-54.8165.2169.700000112.5I348G246-I348 VanDerWaalsContact CA-O 3.25Å; G246-I348 WeakPolarHBondContact CA-O 3.32Å
247G76.1Confident85.8Confident6 Ų623.8 Ų23.86%0.06213%0.131CC..  trans-148.3-175.3-174.400000113A249 S250G247-A249 PolarHBondContact O-N 3.36Å; G247-S250 PolarHBondContact O-N 3.33Å; G247-S250 PolarHBondContact O-OG 2.92Å
248G74.4Confident85.6Confident11 Ų1127.5 Ų27.511%0.11315%0.151CC..Hα-helixtrans-54.3-21.9-170.400000116.6S250 N251 A252G248-S250 VanDerWaalsContact C-N 3.33Å; G248-S250 PolarHBondContact O-N 3.36Å; G248-N251 PolarHBondContact O-N 3.49Å; G248-A252 PolarHBondContact O-N 3.26Å
249A81.3Confident85.5Confident36 Ų3627.8 Ų27.830%0.29816%0.155SC..Hα-helixtrans-63.4-34.9173.100000112.9G247 N251 A252 Y253 I348G247-A249 PolarHBondContact O-N 3.36Å; A249-N251 VanDerWaalsContact C-N 3.34Å; A249-N251 PolarHBondContact O-N 3.43Å; A249-A252 PolarHBondContact O-N 3.32Å; A249-Y253 WeakPolarHBondContact O-CD2 3.38Å; A249-Y253 PolarHBondContact O-N 2.78Å; A249-Y253 VanDerWaalsContact O-N 3.13Å; A249-I348 HydrophobicContact CB-CG2 4.2Å
250S86Confident85.5Confident0 Ų026.4 Ų26.40%015%0.151CC..Hα-helixtrans-62.3-42.8175.866.90000111G247 G248 A252 Y253 T254 E345G247-S250 PolarHBondContact O-N 3.33Å; G247-S250 PolarHBondContact O-OG 2.92Å; G248-S250 VanDerWaalsContact C-N 3.33Å; G248-S250 PolarHBondContact O-N 3.36Å; S250-A252 VanDerWaalsContact C-N 3.32Å; S250-A252 PolarHBondContact O-N 2.88Å; S250-Y253 PolarHBondContact O-N 3.34Å; S250-T254 WeakPolarHBondContact O-CB 3.2Å; S250-T254 PolarHBondContact O-N 2.85Å; S250-T254 PolarHBondContact O-OG1 3.19Å; S250-E345 VanDerWaalsContact CB-OE2 3.29Å; S250-E345 WeakPolarHBondContact CB-OE2 3.35Å; S250-E345 PolarHBondContact OG-OE2 3.05Å
251N85.6Confident85.5Confident8 Ų826.6 Ų26.64%0.04315%0.151CC..Hα-helixtrans-59.6-41.1177-63.7-34.1000112.3G248 A249 Y255 S264 V265G248-N251 PolarHBondContact O-N 3.49Å; A249-N251 VanDerWaalsContact C-N 3.34Å; A249-N251 PolarHBondContact O-N 3.43Å; N251-Y255 PolarHBondContact O-N 3.01Å; N251-Y255 VanDerWaalsContact O-N 3.11Å; N251-S264 WeakPolarHBondContact OD1-CB 3.42Å; N251-S264 PolarHBondContact OD1-OG 3.39Å; N251-V265 PolarHBondContact OD1-N 3.4Å
252A83.9Confident85.5Confident39 Ų3930.1 Ų30.132%0.32217%0.17SC..Hα-helixtrans-64.3-45.2177.200000111.9G248 A249 S250 Y255 L256G248-A252 PolarHBondContact O-N 3.26Å; A249-A252 PolarHBondContact O-N 3.32Å; S250-A252 VanDerWaalsContact C-N 3.32Å; S250-A252 PolarHBondContact O-N 2.88Å; A252-Y255 WeakPolarHBondContact O-CB 3.4Å; A252-Y255 PolarHBondContact O-N 2.88Å; A252-L256 WeakPolarHBondContact O-CG 3.21Å; A252-L256 PolarHBondContact O-N 3.22Å; A252-L256 VanDerWaalsContact O-N 3.15Å
253Y88.9Confident85.8Confident52 Ų5230.2 Ų30.220%0.20417%0.17CC..Hα-helixtrans-72.2-34.5178.5-70-60.1000113.1A249 S250 Y255 L256 L257 I348 V385 M389A249-Y253 WeakPolarHBondContact O-CD2 3.38Å; A249-Y253 PolarHBondContact O-N 2.78Å; A249-Y253 VanDerWaalsContact O-N 3.13Å; S250-Y253 PolarHBondContact O-N 3.34Å; Y253-Y255 VanDerWaalsContact C-N 3.26Å; Y253-Y255 PolarHBondContact O-N 3.43Å; Y253-L256 HydrophobicContact CD1-CD1 4.24Å; Y253-L256 PolarHBondContact O-N 3.44Å; Y253-L257 WeakPolarHBondContact O-CB 3.47Å; Y253-L257 PolarHBondContact O-N 2.93Å; Y253-I348 HydrophobicContact CD2-CD1 3.69Å; Y253-I348 HydrophobicContact CE2-CD1 4.42Å; Y253-V385 HydrophobicContact CD1-CB 4.4Å; Y253-V385 HydrophobicContact CD1-CG1 3.28Å; Y253-V385 HydrophobicContact CD2-CG1 4.11Å; Y253-V385 HydrophobicContact CE1-CB 4.45Å; Y253-V385 HydrophobicContact CE1-CG1 3.71Å; Y253-V385 HydrophobicContact CE2-CG1 4.47Å; Y253-V385 HydrophobicContact CG-CG1 3.5Å; Y253-V385 VanDerWaalsContact CG-CG1 3.5Å; Y253-M389 HydrophobicContact CD1-SD 4.02Å; Y253-M389 HydrophobicContact CE1-SD 4.16Å
254T90.8Very high86Confident0 Ų028.2 Ų28.20%016%0.157CC..Hα-helixtrans-58.9-41.8173-63.80000110.2S250 D258 G259 S264 A341S250-T254 WeakPolarHBondContact O-CB 3.2Å; S250-T254 PolarHBondContact O-N 2.85Å; S250-T254 PolarHBondContact O-OG1 3.19Å; T254-D258 PolarHBondContact O-N 2.9Å; T254-G259 WeakPolarHBondContact O-CA 3.36Å; T254-G259 PolarHBondContact O-N 3.4Å; T254-S264 PolarHBondContact OG1-OG 3.02Å; T254-A341 HydrophobicContact CG2-CB 3.97Å
255Y87.1Confident86.1Confident114 Ų11428.3 Ų28.345%0.44716%0.157SC..Hα-helixtrans-62.3-47.1173.9179.6-96.8000112.3N251 A252 Y253 L257 D258 I261N251-Y255 PolarHBondContact O-N 3.01Å; N251-Y255 VanDerWaalsContact O-N 3.11Å; A252-Y255 WeakPolarHBondContact O-CB 3.4Å; A252-Y255 PolarHBondContact O-N 2.88Å; Y253-Y255 VanDerWaalsContact C-N 3.26Å; Y253-Y255 PolarHBondContact O-N 3.43Å; Y255-L257 VanDerWaalsContact C-N 3.28Å; Y255-L257 PolarHBondContact O-N 2.66Å; Y255-D258 PolarHBondContact O-N 3.28Å; Y255-I261 HydrophobicContact CD2-CD1 4.08Å
256L87.8Confident86.6Confident58 Ų5827.3 Ų27.330%0.30415%0.151SC..Hα-helixtrans-68.2-24.3-177.7-68.3170000113.9A252 Y253 M389 Y393A252-L256 WeakPolarHBondContact O-CG 3.21Å; A252-L256 PolarHBondContact O-N 3.22Å; A252-L256 VanDerWaalsContact O-N 3.15Å; Y253-L256 HydrophobicContact CD1-CD1 4.24Å; Y253-L256 PolarHBondContact O-N 3.44Å; L256-M389 HydrophobicContact CB-CE 4.08Å; L256-M389 HydrophobicContact CB-SD 4.44Å; L256-M389 HydrophobicContact CD1-CE 3.84Å; L256-M389 HydrophobicContact CD1-SD 4.31Å; L256-M389 HydrophobicContact CG-CE 4.4Å; L256-Y393 PolarHBondContact O-OH 2.91Å
257L91.6Very high87.3Confident22 Ų2227.4 Ų27.412%0.11515%0.151CC..THydrogen-bonded Turntrans-102.417.2179.3-71172.3000113.1Y253 Y255 G259 V340 L344 V385 A388 M389 Y392Y253-L257 WeakPolarHBondContact O-CB 3.47Å; Y253-L257 PolarHBondContact O-N 2.93Å; Y255-L257 VanDerWaalsContact C-N 3.28Å; Y255-L257 PolarHBondContact O-N 2.66Å; L257-G259 PolarHBondContact O-N 3.47Å; L257-V340 HydrophobicContact CB-CG1 3.84Å; L257-L344 HydrophobicContact CD1-CD1 4.09Å; L257-L344 HydrophobicContact CD1-CD2 4.27Å; L257-V385 HydrophobicContact CD1-CG1 4.06Å; L257-A388 HydrophobicContact CD1-CB 4.45Å; L257-A388 HydrophobicContact CD2-CB 4.47Å; L257-M389 HydrophobicContact CD1-CG 4.42Å; L257-M389 HydrophobicContact CD2-CB 4.34Å; L257-M389 HydrophobicContact CD2-CG 3.6Å; L257-M389 HydrophobicContact CG-CG 3.98Å; L257-Y392 HydrophobicContact CD2-CG 4.49Å
258D89.1Confident87.7Confident78 Ų7827.2 Ų27.242%0.41715%0.149SC..THydrogen-bonded Turntrans52.835.5-179.2-70.4-52.6000113.7T254 Y255 Y392T254-D258 PolarHBondContact O-N 2.9Å; Y255-D258 PolarHBondContact O-N 3.28Å; D258-Y392 WeakPolarHBondContact OD2-CE1 3.42Å; D258-Y392 VanDerWaalsContact OD2-CZ 3.28Å; D258-Y392 PolarHBondContact OD2-OH 2.9Å
259G91.6Very high88.2Confident7 Ų729 Ų297%0.07215%0.153CC..  trans-79.1169.6173.800000113.1T254 L257 I261 A337T254-G259 WeakPolarHBondContact O-CA 3.36Å; T254-G259 PolarHBondContact O-N 3.4Å; L257-G259 PolarHBondContact O-N 3.47Å; G259-I261 PolarHBondContact O-N 2.87Å; G259-A337 WeakPolarHBondContact CA-O 3.5Å
260N92.7Very high88.2Confident45 Ų4530.8 Ų30.824%0.24116%0.157CC..  trans-74.895.4177.1-174.5-17.1000109.9D262 L263 S264 A337 N338 A341N260-D262 PolarHBondContact OD1-N 3.26Å; N260-L263 HydrophobicContact CB-CB 3.91Å; N260-L263 VanDerWaalsContact CG-CB 3.46Å; N260-L263 PolarHBondContact O-N 3.1Å; N260-L263 PolarHBondContact OD1-N 3.45Å; N260-S264 PolarHBondContact O-N 3.34Å; N260-A337 HydrophobicContact CB-CB 4.06Å; N260-A337 PolarHBondContact N-O 3.07Å; N260-N338 VanDerWaalsContact CB-OD1 3.32Å; N260-N338 WeakPolarHBondContact CB-OD1 3.5Å; N260-N338 PolarHBondContact ND2-OD1 3.36Å; N260-A341 HydrophobicContact CB-CB 4.41Å; N260-A341 WeakPolarHBondContact O-CB 3.25Å
261I90.5Very high87.7Confident12 Ų1231.5 Ų31.56%0.06216%0.162CC..Hα-helixtrans-64.9-40.7-178.2-164.6162.8000112.5Y255 G259 L263 S264 V265 Y276Y255-I261 HydrophobicContact CD2-CD1 4.08Å; G259-I261 PolarHBondContact O-N 2.87Å; I261-L263 PolarHBondContact O-N 3.47Å; I261-S264 WeakPolarHBondContact O-CB 3.4Å; I261-S264 PolarHBondContact O-N 3Å; I261-S264 VanDerWaalsContact O-N 3.09Å; I261-V265 HydrophobicContact CG1-CG2 4.12Å; I261-V265 WeakPolarHBondContact O-CB 3.41Å; I261-V265 VanDerWaalsContact O-CG2 3.24Å; I261-V265 WeakPolarHBondContact O-CG2 3.4Å; I261-V265 PolarHBondContact O-N 2.9Å; I261-Y276 HydrophobicContact CD1-CD2 3.99Å; I261-Y276 HydrophobicContact CD1-CE2 3.31Å; I261-Y276 HydrophobicContact CG1-CD2 4.4Å; I261-Y276 HydrophobicContact CG1-CE2 4.13Å
262D91.1Very high87Confident74 Ų7432.4 Ų32.440%0.39617%0.167SC..Hα-helixtrans-60.7-38.2179.3-61-25.7000110.7V192 V196 N260 T266V192-D262 HydrophobicContact CG1-CB 3.66Å; V196-D262 HydrophobicContact CG2-CB 3.89Å; N260-D262 PolarHBondContact OD1-N 3.26Å; D262-T266 VanDerWaalsContact O-CB 3.31Å; D262-T266 WeakPolarHBondContact O-CB 3.46Å; D262-T266 PolarHBondContact O-N 2.97Å; D262-T266 PolarHBondContact O-OG1 3.05Å
263L92Very high85.2Confident1 Ų135.3 Ų35.31%0.00518%0.181CC..Hα-helixtrans-66.7-47.7172.9178.662.8000112.2V196 A202 P203 N260 I261 V265 T266 M267 N338 A341 I342V196-L263 HydrophobicContact CG1-CD1 3.79Å; A202-L263 HydrophobicContact CB-CD1 3.83Å; A202-L263 HydrophobicContact CB-CD2 3.64Å; A202-L263 HydrophobicContact CB-CG 4.4Å; P203-L263 HydrophobicContact CB-CD1 4.49Å; P203-L263 HydrophobicContact CG-CD1 3.75Å; N260-L263 HydrophobicContact CB-CB 3.91Å; N260-L263 VanDerWaalsContact CG-CB 3.46Å; N260-L263 PolarHBondContact O-N 3.1Å; N260-L263 PolarHBondContact OD1-N 3.45Å; I261-L263 PolarHBondContact O-N 3.47Å; L263-V265 PolarHBondContact O-N 3.43Å; L263-T266 PolarHBondContact O-N 2.77Å; L263-M267 HydrophobicContact CD1-CG 4.11Å; L263-M267 HydrophobicContact CD1-SD 4.18Å; L263-M267 HydrophobicContact CD2-CE 4.48Å; L263-M267 HydrophobicContact CG-CE 3.92Å; L263-M267 HydrophobicContact CG-CG 4.43Å; L263-M267 HydrophobicContact CG-SD 4.13Å; L263-M267 WeakPolarHBondContact O-CG 3.49Å; L263-M267 PolarHBondContact O-N 2.98Å; L263-N338 HydrophobicContact CD2-CB 3.81Å; L263-A341 HydrophobicContact CD2-CB 4.27Å; L263-I342 HydrophobicContact CD2-CD1 4.45Å; L263-I342 HydrophobicContact CD2-CG1 4.23Å
264S90.5Very high83.1Confident0 Ų035.7 Ų35.70%018%0.183CC..Hα-helixtrans-55.5-51.1177.2-168.60000111.2N251 T254 N260 I261 T266 M267 T268N251-S264 WeakPolarHBondContact OD1-CB 3.42Å; N251-S264 PolarHBondContact OD1-OG 3.39Å; T254-S264 PolarHBondContact OG1-OG 3.02Å; N260-S264 PolarHBondContact O-N 3.34Å; I261-S264 WeakPolarHBondContact O-CB 3.4Å; I261-S264 PolarHBondContact O-N 3Å; I261-S264 VanDerWaalsContact O-N 3.09Å; S264-T266 VanDerWaalsContact C-N 3.3Å; S264-T266 PolarHBondContact O-N 2.81Å; S264-M267 PolarHBondContact O-N 2.82Å; S264-M267 VanDerWaalsContact O-N 3.17Å; S264-T268 PolarHBondContact O-N 3.5Å; S264-T268 PolarHBondContact O-OG1 3.07Å; S264-T268 VanDerWaalsContact O-OG1 3.1Å
265V86.8Confident80.8Confident10 Ų1035.7 Ų35.76%0.06118%0.183CC..Hα-helixtrans-59-41.3177.4171.80000111.5N251 I261 L263 F269 A275 Y276N251-V265 PolarHBondContact OD1-N 3.4Å; I261-V265 HydrophobicContact CG1-CG2 4.12Å; I261-V265 WeakPolarHBondContact O-CB 3.41Å; I261-V265 VanDerWaalsContact O-CG2 3.24Å; I261-V265 WeakPolarHBondContact O-CG2 3.4Å; I261-V265 PolarHBondContact O-N 2.9Å; L263-V265 PolarHBondContact O-N 3.43Å; V265-F269 VanDerWaalsContact O-CB 3.24Å; V265-F269 WeakPolarHBondContact O-CB 3.46Å; V265-F269 PolarHBondContact O-N 3.24Å; V265-A275 HydrophobicContact CB-CB 4.45Å; V265-A275 HydrophobicContact CG1-CB 3.63Å; V265-Y276 VanDerWaalsContact CG2-CB 3.46Å; V265-Y276 HydrophobicContact CG2-CD1 4.42Å; V265-Y276 HydrophobicContact CG2-CD2 3.95Å; V265-Y276 HydrophobicContact CG2-CG 3.67Å
266T87.9Confident78.8Confident0 Ų034.2 Ų34.20%018%0.178CC..Hα-helixtrans-67.3-42.2176.9-59.50000112.1V193 V196 I197 D262 L263 S264 F269 L270V193-T266 HydrophobicContact CG1-CG2 4.23Å; V196-T266 HydrophobicContact CB-CG2 4Å; V196-T266 WeakPolarHBondContact CB-OG1 3.27Å; V196-T266 HydrophobicContact CG1-CG2 3.71Å; I197-T266 HydrophobicContact CG1-CG2 3.98Å; D262-T266 VanDerWaalsContact O-CB 3.31Å; D262-T266 WeakPolarHBondContact O-CB 3.46Å; D262-T266 PolarHBondContact O-N 2.97Å; D262-T266 PolarHBondContact O-OG1 3.05Å; L263-T266 PolarHBondContact O-N 2.77Å; S264-T266 VanDerWaalsContact C-N 3.3Å; S264-T266 PolarHBondContact O-N 2.81Å; T266-F269 PolarHBondContact O-N 2.88Å; T266-L270 HydrophobicContact CG2-CD1 4.05Å; T266-L270 HydrophobicContact CG2-CG 4.45Å; T266-L270 WeakPolarHBondContact O-CB 3.44Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.27Å; T266-L270 PolarHBondContact O-N 2.9Å
267M87.8Confident77.1Confident3 Ų332 Ų322%0.01517%0.169CC..Hα-helixtrans-65.4-46.7177.2-68.9-178.9-56.100110.7L263 S264 F269 L270 S271 A341 I342 E345L263-M267 HydrophobicContact CD1-CG 4.11Å; L263-M267 HydrophobicContact CD1-SD 4.18Å; L263-M267 HydrophobicContact CD2-CE 4.48Å; L263-M267 HydrophobicContact CG-CE 3.92Å; L263-M267 HydrophobicContact CG-CG 4.43Å; L263-M267 HydrophobicContact CG-SD 4.13Å; L263-M267 WeakPolarHBondContact O-CG 3.49Å; L263-M267 PolarHBondContact O-N 2.98Å; S264-M267 PolarHBondContact O-N 2.82Å; S264-M267 VanDerWaalsContact O-N 3.17Å; M267-F269 VanDerWaalsContact C-N 3.29Å; M267-F269 PolarHBondContact O-N 3.35Å; M267-L270 PolarHBondContact O-N 3.32Å; M267-L270 VanDerWaalsContact O-N 3.11Å; M267-S271 WeakPolarHBondContact O-CB 3.41Å; M267-S271 PolarHBondContact O-N 2.94Å; M267-S271 PolarHBondContact O-OG 2.99Å; M267-A341 HydrophobicContact CE-CB 4.19Å; M267-I342 HydrophobicContact CE-CG1 4.33Å; M267-I342 HydrophobicContact SD-CG1 4.01Å; M267-E345 HydrophobicContact CB-CG 3.93Å; M267-E345 HydrophobicContact CE-CB 3.72Å; M267-E345 HydrophobicContact CE-CG 4.03Å; M267-E345 HydrophobicContact SD-CG 4.46Å
268T85Confident75.3Confident1 Ų136 Ų361%0.00619%0.19CC..Hα-helixtrans-58.9-43.7175.3-53.60000110.4S264 L270 S271 M272 E345S264-T268 PolarHBondContact O-N 3.5Å; S264-T268 PolarHBondContact O-OG1 3.07Å; S264-T268 VanDerWaalsContact O-OG1 3.1Å; T268-L270 VanDerWaalsContact C-N 3.35Å; T268-L270 PolarHBondContact O-N 3.38Å; T268-S271 PolarHBondContact O-N 3.48Å; T268-M272 CarbonylContact C-O 3.33Å; T268-M272 CarbonylContact O-C 3.53Å; T268-M272 WeakPolarHBondContact O-CA 3.43Å; T268-M272 PolarHBondContact O-N 3.45Å; T268-E345 VanDerWaalsContact CA-OE1 3.32Å; T268-E345 WeakPolarHBondContact CA-OE1 3.47Å; T268-E345 PolarHBondContact N-OE1 3.08Å; T268-E345 PolarHBondContact OG1-OE1 2.83Å; T268-E345 PolarHBondContact OG1-OE2 3.4Å
269F83.7Confident73.9Confident48 Ų4838 Ų3821%0.21120%0.2CC..Hα-helixtrans-60.8-37.3175.6174.9-105.4000114I188 L190 V193 V265 T266 M267 M272 V273I188-F269 HydrophobicContact CD1-CB 4.15Å; I188-F269 HydrophobicContact CD1-CD2 3.21Å; I188-F269 HydrophobicContact CD1-CE2 3.86Å; I188-F269 HydrophobicContact CD1-CG 3.96Å; L190-F269 HydrophobicContact CD2-CZ 4.48Å; V193-F269 HydrophobicContact CG1-CD1 3.55Å; V193-F269 HydrophobicContact CG1-CE1 3.76Å; V193-F269 HydrophobicContact CG1-CG 4.48Å; V193-F269 HydrophobicContact CG2-CD1 4.3Å; V193-F269 HydrophobicContact CG2-CG 4.48Å; V265-F269 VanDerWaalsContact O-CB 3.24Å; V265-F269 WeakPolarHBondContact O-CB 3.46Å; V265-F269 PolarHBondContact O-N 3.24Å; T266-F269 PolarHBondContact O-N 2.88Å; M267-F269 VanDerWaalsContact C-N 3.29Å; M267-F269 PolarHBondContact O-N 3.35Å; F269-M272 CarbonylContact C-O 3.04Å; F269-M272 WeakPolarHBondContact CA-O 3.2Å; F269-M272 CarbonylContact O-C 3.56Å; F269-V273 HydrophobicContact CE2-CG1 3.97Å
270L81.8Confident72.5Confident74 Ų7438 Ų3839%0.38720%0.198SC..Hα-helixtrans-76.6-32.9177.7-70.8173000112.2I197 P203 T266 M267 T268I197-L270 HydrophobicContact CD1-CD2 4.22Å; I197-L270 HydrophobicContact CG1-CD1 4.46Å; P203-L270 HydrophobicContact CB-CD1 4.28Å; T266-L270 HydrophobicContact CG2-CD1 4.05Å; T266-L270 HydrophobicContact CG2-CG 4.45Å; T266-L270 WeakPolarHBondContact O-CB 3.44Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.27Å; T266-L270 PolarHBondContact O-N 2.9Å; M267-L270 PolarHBondContact O-N 3.32Å; M267-L270 VanDerWaalsContact O-N 3.11Å; T268-L270 VanDerWaalsContact C-N 3.35Å; T268-L270 PolarHBondContact O-N 3.38Å
271S76Confident71.3Confident15 Ų1541.3 Ų41.311%0.10521%0.207CC..Hα-helixtrans-85-24.5179-69.80000113.1M267 T268M267-S271 WeakPolarHBondContact O-CB 3.41Å; M267-S271 PolarHBondContact O-N 2.94Å; M267-S271 PolarHBondContact O-OG 2.99Å; T268-S271 PolarHBondContact O-N 3.48Å
272M70.1Confident70.6Confident28 Ų2844.6 Ų44.614%0.13823%0.229CC..SBendtrans-149138.8172.6-57.6-154.887.300108.8P245 T268 F269 F274 I353P245-M272 HydrophobicContact CB-CG 3.71Å; P245-M272 HydrophobicContact CB-SD 4.49Å; P245-M272 HydrophobicContact CG-CE 4.03Å; P245-M272 HydrophobicContact CG-CG 3.48Å; P245-M272 VanDerWaalsContact CG-CG 3.48Å; P245-M272 HydrophobicContact CG-SD 3.93Å; T268-M272 CarbonylContact C-O 3.33Å; T268-M272 CarbonylContact O-C 3.53Å; T268-M272 WeakPolarHBondContact O-CA 3.43Å; T268-M272 PolarHBondContact O-N 3.45Å; F269-M272 CarbonylContact C-O 3.04Å; F269-M272 WeakPolarHBondContact CA-O 3.2Å; F269-M272 CarbonylContact O-C 3.56Å; M272-F274 HydrophobicContact CB-CD2 4.21Å; M272-F274 PolarHBondContact O-N 3.05Å; M272-I353 HydrophobicContact CE-CD1 3.06Å; M272-I353 HydrophobicContact SD-CD1 3.9Å
273V47.5Very low70Confident100 Ų10043.1 Ų43.161%0.60622%0.219SC*.SBendtrans-74.654.2-179.4-1700000113.1F269F269-V273 HydrophobicContact CE2-CG1 3.97Å
274F44Very low69.2Low59 Ų5945 Ų4526%0.25923%0.228SC..  trans-155.5123.9-173.2-56.7-61.9000114.2N181 M184 A185 M272N181-F274 HydrophobicContact CB-CB 4.14Å; N181-F274 HydrophobicContact CB-CD1 3.58Å; N181-F274 HydrophobicContact CB-CD2 3.41Å; N181-F274 VanDerWaalsContact CB-CD2 3.41Å; N181-F274 HydrophobicContact CB-CE1 3.75Å; N181-F274 HydrophobicContact CB-CE2 3.57Å; N181-F274 HydrophobicContact CB-CG 3.42Å; N181-F274 VanDerWaalsContact CB-CG 3.42Å; N181-F274 HydrophobicContact CB-CZ 3.74Å; N181-F274 VanDerWaalsContact CG-CD2 3.44Å; N181-F274 WeakPolarHBondContact O-CB 3.42Å; N181-F274 WeakPolarHBondContact O-CD1 3.42Å; N181-F274 WeakPolarHBondContact O-CG 3.47Å; M184-F274 HydrophobicContact CB-CB 4.04Å; M184-F274 HydrophobicContact CE-CB 4.28Å; A185-F274 HydrophobicContact CB-CD1 3.63Å; A185-F274 HydrophobicContact CB-CE1 4.31Å; M272-F274 HydrophobicContact CB-CD2 4.21Å; M272-F274 PolarHBondContact O-N 3.05Å
275A42.5Very low68.5Low0 Ų051.8 Ų51.80%026%0.257CS..  trans-162139.8174.800000121.2M184 I188 V265M184-A275 VanDerWaalsContact C-N 3.27Å; M184-A275 CarbonylContact C-O 3.55Å; M184-A275 CarbonylContact O-C 3.37Å; M184-A275 PolarHBondContact O-N 2.95Å; I188-A275 HydrophobicContact CD1-CB 3.63Å; I188-A275 VanDerWaalsContact CD1-N 3.33Å; I188-A275 HydrophobicContact CG1-CB 3.69Å; I188-A275 WeakPolarHBondContact CG1-O 3.38Å; I188-A275 PolarHBondContact N-O 2.85Å; V265-A275 HydrophobicContact CB-CB 4.45Å; V265-A275 HydrophobicContact CG1-CB 3.63Å
276Y44.7Very low68.4Low84 Ų8456.7 Ų56.733%0.32928%0.278SS..  trans63.8125.3148.2-173.2-103.4000125E187 I261 V265E187-Y276 WeakPolarHBondContact CB-O 3.42Å; I261-Y276 HydrophobicContact CD1-CD2 3.99Å; I261-Y276 HydrophobicContact CD1-CE2 3.31Å; I261-Y276 HydrophobicContact CG1-CD2 4.4Å; I261-Y276 HydrophobicContact CG1-CE2 4.13Å; V265-Y276 VanDerWaalsContact CG2-CB 3.46Å; V265-Y276 HydrophobicContact CG2-CD1 4.42Å; V265-Y276 HydrophobicContact CG2-CD2 3.95Å; V265-Y276 HydrophobicContact CG2-CG 3.67Å
277G51.5Low68.1Low12 Ų1257 Ų5712%0.12428%0.28CS..  trans165.9179.7156.100000114.2E187 I279 L280E187-G277 VanDerWaalsContact OE2-C 3.29Å; E187-G277 WeakPolarHBondContact OE2-CA 3.28Å; E187-G277 PolarHBondContact OE2-N 3.21Å; G277-I279 PolarHBondContact O-N 3.4Å; G277-L280 PolarHBondContact O-N 2.89Å
278N53.7Low67.9Low104 Ų10461.1 Ų61.156%0.55630%0.301SS*.THydrogen-bonded Turntrans-73.3-25.9-166.8-75.1-47.4000113.7L280 R281N278-L280 VanDerWaalsContact C-N 3.34Å; N278-R281 VanDerWaalsContact OD1-CZ 3.3Å; N278-R281 PolarHBondContact OD1-NH1 3.38Å; N278-R281 PolarHBondContact OD1-NH2 3.47Å
279I59.7Low67.9Low121 Ų12163.9 Ų63.962%0.62132%0.318SS*.THydrogen-bonded Turntrans-76.8-24.5178.9-67.5166.5000111G277 P282G277-I279 PolarHBondContact O-N 3.4Å; I279-P282 WeakPolarHBondContact O-CD 3.37Å; I279-P282 WeakPolarHBondContact O-CG 3.36Å
280L62.7Low68.1Low6 Ų663 Ų633%0.03131%0.314CS..Hα-helixtrans-74.1-30.6-177.1-73.9164000114.5I183 M184 E187 G277 N278 F283 F284I183-L280 HydrophobicContact CB-CD2 3.5Å; I183-L280 HydrophobicContact CG2-CD2 3.24Å; I183-L280 HydrophobicContact CG2-CG 3.87Å; M184-L280 HydrophobicContact CB-CD1 4.03Å; M184-L280 HydrophobicContact CG-CD1 3.65Å; M184-L280 HydrophobicContact CG-CD2 3.79Å; M184-L280 HydrophobicContact CG-CG 4.31Å; M184-L280 HydrophobicContact SD-CD1 4.28Å; E187-L280 WeakPolarHBondContact OE2-CD1 3.38Å; E187-L280 VanDerWaalsContact OE2-CG 3.28Å; E187-L280 WeakPolarHBondContact OE2-CG 3.39Å; G277-L280 PolarHBondContact O-N 2.89Å; N278-L280 VanDerWaalsContact C-N 3.34Å; L280-F283 PolarHBondContact O-N 3.45Å; L280-F283 VanDerWaalsContact O-N 3.07Å; L280-F284 HydrophobicContact CB-CD2 4.22Å; L280-F284 HydrophobicContact CB-CE2 4.46Å; L280-F284 HydrophobicContact CD2-CE2 4.22Å; L280-F284 WeakPolarHBondContact O-CD2 3.34Å; L280-F284 PolarHBondContact O-N 3.15Å
281R68.4Low68.3Low116 Ų11662.6 Ų62.644%0.43831%0.311SS..Hα-helixtrans-53.8-50.4-179.5-70-168.5-65.5-120.8-5.6113N278 F283 F285N278-R281 VanDerWaalsContact OD1-CZ 3.3Å; N278-R281 PolarHBondContact OD1-NH1 3.38Å; N278-R281 PolarHBondContact OD1-NH2 3.47Å; R281-F283 VanDerWaalsContact C-N 3.33Å; R281-F283 PolarHBondContact O-N 2.86Å; R281-F285 WeakPolarHBondContact O-CB 3.33Å; R281-F285 PolarHBondContact O-N 3.34Å
282P75.3Confident68.6Low81 Ų8165.7 Ų65.753%0.52633%0.332SS..Hα-helixtrans-65.8-32.4176.224.9-34.7000113.1I279 F285 F286I279-P282 WeakPolarHBondContact O-CD 3.37Å; I279-P282 WeakPolarHBondContact O-CG 3.36Å; P282-F285 WeakPolarHBondContact O-CB 3.48Å; P282-F285 PolarHBondContact O-N 3.34Å; P282-F286 WeakPolarHBondContact O-CB 3.43Å; P282-F286 PolarHBondContact O-N 2.99Å
283F77.8Confident69.5Low43 Ų4368.4 Ų68.419%0.18935%0.351CS..Hα-helixtrans-68.3-46.5176.4-173.6-96.9000112.1L176 I179 A180 L280 R281 F285 F286 V287L176-F283 HydrophobicContact CD2-CE2 4.38Å; L176-F283 HydrophobicContact CD2-CZ 3.93Å; I179-F283 HydrophobicContact CB-CZ 4.07Å; I179-F283 HydrophobicContact CG2-CE1 4.22Å; I179-F283 HydrophobicContact CG2-CE2 4.07Å; I179-F283 HydrophobicContact CG2-CZ 3.64Å; A180-F283 VanDerWaalsContact CA-CE1 3.47Å; A180-F283 HydrophobicContact CB-CD1 4.09Å; A180-F283 HydrophobicContact CB-CE1 3.63Å; L280-F283 PolarHBondContact O-N 3.45Å; L280-F283 VanDerWaalsContact O-N 3.07Å; R281-F283 VanDerWaalsContact C-N 3.33Å; R281-F283 PolarHBondContact O-N 2.86Å; F283-F285 VanDerWaalsContact C-N 3.29Å; F283-F285 PolarHBondContact O-N 2.83Å; F283-F286 WeakPolarHBondContact O-CA 3.28Å; F283-F286 WeakPolarHBondContact O-CB 3.01Å; F283-F286 PolarHBondContact O-N 3.35Å; F283-F286 VanDerWaalsContact O-N 3.11Å; F283-V287 HydrophobicContact CD1-CG2 4.04Å; F283-V287 HydrophobicContact CE1-CG2 3.63Å; F283-V287 HydrophobicContact CZ-CG2 4.05Å; F283-V287 WeakPolarHBondContact O-CG2 3.35Å; F283-V287 PolarHBondContact O-N 2.89Å
284F75.4Confident71.5Confident41 Ų4166.4 Ų66.418%0.1833%0.334CS..Hα-helixtrans-62.4-38.5173.8-88.5-84000111.9A180 M184 L280 F286 V287 I288A180-F284 HydrophobicContact CB-CE1 4.3Å; A180-F284 HydrophobicContact CB-CE2 4.31Å; A180-F284 HydrophobicContact CB-CZ 3.88Å; M184-F284 HydrophobicContact CE-CE2 4.26Å; M184-F284 HydrophobicContact CE-CZ 3.76Å; M184-F284 HydrophobicContact CG-CE2 3.55Å; M184-F284 HydrophobicContact CG-CZ 3.88Å; M184-F284 HydrophobicContact SD-CE2 3.4Å; M184-F284 WeakPolarHBondContact SD-CE2 3.31Å; M184-F284 HydrophobicContact SD-CZ 3.54Å; M184-F284 VanDerWaalsContact SD-CZ 3.54Å; L280-F284 HydrophobicContact CB-CD2 4.22Å; L280-F284 HydrophobicContact CB-CE2 4.46Å; L280-F284 HydrophobicContact CD2-CE2 4.22Å; L280-F284 WeakPolarHBondContact O-CD2 3.34Å; L280-F284 PolarHBondContact O-N 3.15Å; F284-F286 VanDerWaalsContact C-N 3.33Å; F284-F286 PolarHBondContact O-N 3.37Å; F284-V287 PolarHBondContact O-N 3.37Å; F284-I288 VanDerWaalsContact O-CG1 3.26Å; F284-I288 WeakPolarHBondContact O-CG1 3.41Å; F284-I288 PolarHBondContact O-N 3.29Å
285F77.4Confident73.4Confident141 Ų14163.9 Ų63.962%0.61832%0.324SS*.Hα-helixtrans-59-45171.6-179.8-98.4000111.4R281 P282 F283 V287 I288 V289R281-F285 WeakPolarHBondContact O-CB 3.33Å; R281-F285 PolarHBondContact O-N 3.34Å; P282-F285 WeakPolarHBondContact O-CB 3.48Å; P282-F285 PolarHBondContact O-N 3.34Å; F283-F285 VanDerWaalsContact C-N 3.29Å; F283-F285 PolarHBondContact O-N 2.83Å; F285-V287 PolarHBondContact O-N 3.22Å; F285-I288 PolarHBondContact O-N 2.95Å; F285-V289 HydrophobicContact CD1-CG2 4.17Å; F285-V289 HydrophobicContact CE1-CG2 3.77Å; F285-V289 HydrophobicContact CE2-CG2 4.32Å; F285-V289 HydrophobicContact CZ-CG2 3.86Å; F285-V289 WeakPolarHBondContact O-CG2 3.46Å; F285-V289 PolarHBondContact O-N 2.95Å
286F83.3Confident75.6Confident113 Ų11366.6 Ų66.650%0.49634%0.341SS..Hα-helixtrans-59.7-45174173.4-94.8000112.4L176 P282 F283 F284 I288 V289 F290L176-F286 HydrophobicContact CD2-CE1 4.12Å; P282-F286 WeakPolarHBondContact O-CB 3.43Å; P282-F286 PolarHBondContact O-N 2.99Å; F283-F286 WeakPolarHBondContact O-CA 3.28Å; F283-F286 WeakPolarHBondContact O-CB 3.01Å; F283-F286 PolarHBondContact O-N 3.35Å; F283-F286 VanDerWaalsContact O-N 3.11Å; F284-F286 VanDerWaalsContact C-N 3.33Å; F284-F286 PolarHBondContact O-N 3.37Å; F286-I288 VanDerWaalsContact C-N 3.34Å; F286-I288 PolarHBondContact O-N 2.87Å; F286-V289 PolarHBondContact O-N 3.44Å; F286-F290 WeakPolarHBondContact O-CB 3.16Å; F286-F290 PolarHBondContact O-N 3.1Å
287V82.9Confident77.7Confident8 Ų870.4 Ų70.45%0.04836%0.356CS..Hα-helixtrans-61.2-42.4176.2174.70000111.1L176 F283 F284 F285 F290 I291L176-V287 HydrophobicContact CB-CG2 4.23Å; L176-V287 HydrophobicContact CD1-CG2 4.47Å; F283-V287 HydrophobicContact CD1-CG2 4.04Å; F283-V287 HydrophobicContact CE1-CG2 3.63Å; F283-V287 HydrophobicContact CZ-CG2 4.05Å; F283-V287 WeakPolarHBondContact O-CG2 3.35Å; F283-V287 PolarHBondContact O-N 2.89Å; F284-V287 PolarHBondContact O-N 3.37Å; F285-V287 PolarHBondContact O-N 3.22Å; V287-F290 PolarHBondContact O-N 3.45Å; V287-I291 HydrophobicContact CG1-CD1 3.89Å; V287-I291 VanDerWaalsContact O-CG1 3.26Å; V287-I291 WeakPolarHBondContact O-CG1 3.35Å; V287-I291 PolarHBondContact O-N 3.04Å
288I82.7Confident79.2Confident89 Ų8970 Ų7046%0.45635%0.351SS..Hα-helixtrans-62.3-46.8175.4-69.3165.4000110.5F284 F285 F286 F290 I291 C292F284-I288 VanDerWaalsContact O-CG1 3.26Å; F284-I288 WeakPolarHBondContact O-CG1 3.41Å; F284-I288 PolarHBondContact O-N 3.29Å; F285-I288 PolarHBondContact O-N 2.95Å; F286-I288 VanDerWaalsContact C-N 3.34Å; F286-I288 PolarHBondContact O-N 2.87Å; I288-F290 VanDerWaalsContact C-N 3.34Å; I288-F290 PolarHBondContact O-N 3.22Å; I288-I291 PolarHBondContact O-N 3.39Å; I288-C292 WeakPolarHBondContact O-CB 3.15Å; I288-C292 PolarHBondContact O-N 3.36Å; I288-C292 PolarHBondContact O-SG 2.99Å; I288-C292 VanDerWaalsContact O-SG 3.33Å
289V85.1Confident80.9Confident58 Ų5865.7 Ų65.735%0.35233%0.328SS..Hα-helixtrans-61-43.2177.6171.20000111F285 F286 I291 C292 T293F285-V289 HydrophobicContact CD1-CG2 4.17Å; F285-V289 HydrophobicContact CE1-CG2 3.77Å; F285-V289 HydrophobicContact CE2-CG2 4.32Å; F285-V289 HydrophobicContact CZ-CG2 3.86Å; F285-V289 WeakPolarHBondContact O-CG2 3.46Å; F285-V289 PolarHBondContact O-N 2.95Å; F286-V289 PolarHBondContact O-N 3.44Å; V289-I291 PolarHBondContact O-N 3.46Å; V289-C292 PolarHBondContact O-N 3.16Å; V289-T293 HydrophobicContact CG1-CG2 4.35Å; V289-T293 WeakPolarHBondContact O-CB 3.31Å; V289-T293 WeakPolarHBondContact O-CG2 3.18Å; V289-T293 PolarHBondContact O-N 3.17Å; V289-T293 PolarHBondContact O-OG1 3.1Å
290F87.2Confident82.2Confident29 Ų2964.5 Ų64.513%0.12732%0.322CS..Hα-helixtrans-58.8-45174.9172.7-97.9000111.8F169 V172 L176 F286 V287 I288 T293 F294 G295F169-F290 HydrophobicContact CD2-CE1 4.01Å; F169-F290 HydrophobicContact CD2-CZ 4.24Å; F169-F290 HydrophobicContact CE2-CE1 4.02Å; V172-F290 HydrophobicContact CB-CE1 4.48Å; V172-F290 HydrophobicContact CB-CZ 3.88Å; V172-F290 HydrophobicContact CG1-CE1 3.89Å; V172-F290 HydrophobicContact CG1-CE2 3.82Å; V172-F290 HydrophobicContact CG1-CZ 3.33Å; L176-F290 HydrophobicContact CD1-CD1 3.6Å; L176-F290 HydrophobicContact CD1-CE1 3.88Å; L176-F290 HydrophobicContact CD1-CG 3.97Å; L176-F290 HydrophobicContact CD1-CZ 4.46Å; F286-F290 WeakPolarHBondContact O-CB 3.16Å; F286-F290 PolarHBondContact O-N 3.1Å; V287-F290 PolarHBondContact O-N 3.45Å; I288-F290 VanDerWaalsContact C-N 3.34Å; I288-F290 PolarHBondContact O-N 3.22Å; F290-T293 PolarHBondContact O-N 3.38Å; F290-F294 HydrophobicContact CD2-CB 3.86Å; F290-F294 HydrophobicContact CD2-CD1 4.3Å; F290-F294 HydrophobicContact CD2-CG 4.3Å; F290-F294 HydrophobicContact CE1-CD1 4.17Å; F290-F294 HydrophobicContact CE2-CB 3.72Å; F290-F294 AromaticContact CE2-CD1 3.35Å; F290-F294 HydrophobicContact CE2-CD1 3.35Å; F290-F294 HydrophobicContact CE2-CE1 4.07Å; F290-F294 AromaticContact CE2-CG 3.65Å; F290-F294 HydrophobicContact CE2-CG 3.65Å; F290-F294 HydrophobicContact CZ-CB 4.31Å; F290-F294 AromaticContact CZ-CD1 3.27Å; F290-F294 HydrophobicContact CZ-CD1 3.27Å; F290-F294 AromaticContact CZ-CE1 3.82Å; F290-F294 HydrophobicContact CZ-CE1 3.82Å; F290-F294 HydrophobicContact CZ-CG 4.06Å; F290-F294 WeakPolarHBondContact O-CA 3.19Å; F290-F294 WeakPolarHBondContact O-CB 3.3Å; F290-F294 PolarHBondContact O-N 3.43Å; F290-G295 PolarHBondContact O-N 3.05Å
291I85.6Confident83.3Confident66 Ų6665.5 Ų65.534%0.33833%0.326SS..Iπ-helixtrans-64.4-46.3176.6-67.6165.7000110.9L173 V287 I288 V289 T293 G295 V296L173-I291 HydrophobicContact CD1-CD1 4.22Å; L173-I291 HydrophobicContact CD1-CG1 4.33Å; V287-I291 HydrophobicContact CG1-CD1 3.89Å; V287-I291 VanDerWaalsContact O-CG1 3.26Å; V287-I291 WeakPolarHBondContact O-CG1 3.35Å; V287-I291 PolarHBondContact O-N 3.04Å; I288-I291 PolarHBondContact O-N 3.39Å; V289-I291 PolarHBondContact O-N 3.46Å; I291-T293 VanDerWaalsContact C-N 3.29Å; I291-T293 PolarHBondContact O-N 3.09Å; I291-G295 CarbonylContact O-C 3.09Å; I291-G295 WeakPolarHBondContact O-CA 3.45Å; I291-G295 PolarHBondContact O-N 2.81Å; I291-V296 PolarHBondContact O-N 3.05Å; I291-V296 VanDerWaalsContact O-N 3.09Å
292C83.6Confident84.3Confident80 Ų8060.2 Ų60.254%0.54131%0.306SS..Iπ-helixtrans-67.3-26.7-179.1-71.20000113.7I288 V289 V296I288-C292 WeakPolarHBondContact O-CB 3.15Å; I288-C292 PolarHBondContact O-N 3.36Å; I288-C292 PolarHBondContact O-SG 2.99Å; I288-C292 VanDerWaalsContact O-SG 3.33Å; V289-C292 PolarHBondContact O-N 3.16Å; C292-V296 WeakPolarHBondContact O-CB 3.32Å; C292-V296 WeakPolarHBondContact O-CG2 3.21Å
293T88.9Confident84.9Confident86 Ų8660.8 Ų60.853%0.52830%0.301SS..Iπ-helixtrans-100.6-77.1-178.755.20000110.9V289 F290 I291 G295 V296 Y297V289-T293 HydrophobicContact CG1-CG2 4.35Å; V289-T293 WeakPolarHBondContact O-CB 3.31Å; V289-T293 WeakPolarHBondContact O-CG2 3.18Å; V289-T293 PolarHBondContact O-N 3.17Å; V289-T293 PolarHBondContact O-OG1 3.1Å; F290-T293 PolarHBondContact O-N 3.38Å; I291-T293 VanDerWaalsContact C-N 3.29Å; I291-T293 PolarHBondContact O-N 3.09Å; T293-G295 PolarHBondContact O-N 3.05Å; T293-V296 PolarHBondContact O-N 3.12Å; T293-Y297 WeakPolarHBondContact O-CB 3.17Å; T293-Y297 PolarHBondContact O-N 2.89Å
294F88.5Confident85.4Confident57 Ų5765.7 Ų65.725%0.2532%0.322CS..Iπ-helixtrans-63.4-43-178.3-175-98000111.7L165 V168 F169 F290 V296 Y297 S298L165-F294 HydrophobicContact CD1-CE2 3.59Å; L165-F294 HydrophobicContact CD1-CZ 3.47Å; L165-F294 VanDerWaalsContact CD1-CZ 3.47Å; L165-F294 HydrophobicContact CG-CZ 4.34Å; V168-F294 HydrophobicContact CG1-CZ 4.23Å; F169-F294 HydrophobicContact CB-CD1 4.46Å; F169-F294 HydrophobicContact CB-CE1 3.86Å; F169-F294 AromaticContact CD2-CD1 3.91Å; F169-F294 HydrophobicContact CD2-CD1 3.91Å; F169-F294 HydrophobicContact CD2-CE1 4.14Å; F290-F294 HydrophobicContact CD2-CB 3.86Å; F290-F294 HydrophobicContact CD2-CD1 4.3Å; F290-F294 HydrophobicContact CD2-CG 4.3Å; F290-F294 HydrophobicContact CE1-CD1 4.17Å; F290-F294 HydrophobicContact CE2-CB 3.72Å; F290-F294 AromaticContact CE2-CD1 3.35Å; F290-F294 HydrophobicContact CE2-CD1 3.35Å; F290-F294 HydrophobicContact CE2-CE1 4.07Å; F290-F294 AromaticContact CE2-CG 3.65Å; F290-F294 HydrophobicContact CE2-CG 3.65Å; F290-F294 HydrophobicContact CZ-CB 4.31Å; F290-F294 AromaticContact CZ-CD1 3.27Å; F290-F294 HydrophobicContact CZ-CD1 3.27Å; F290-F294 AromaticContact CZ-CE1 3.82Å; F290-F294 HydrophobicContact CZ-CE1 3.82Å; F290-F294 HydrophobicContact CZ-CG 4.06Å; F290-F294 WeakPolarHBondContact O-CA 3.19Å; F290-F294 WeakPolarHBondContact O-CB 3.3Å; F290-F294 PolarHBondContact O-N 3.43Å; F294-V296 PolarHBondContact O-N 3.38Å; F294-Y297 PolarHBondContact O-N 2.97Å; F294-S298 WeakPolarHBondContact O-CB 3.5Å; F294-S298 PolarHBondContact O-N 3.18Å; F294-S298 PolarHBondContact O-OG 3.28Å
295G85.6Confident86Confident6 Ų664.6 Ų64.66%0.06232%0.318CS..Iπ-helixtrans-63.2-39.8178.800000113.9F290 I291 T293 S298 N299F290-G295 PolarHBondContact O-N 3.05Å; I291-G295 CarbonylContact O-C 3.09Å; I291-G295 WeakPolarHBondContact O-CA 3.45Å; I291-G295 PolarHBondContact O-N 2.81Å; T293-G295 PolarHBondContact O-N 3.05Å; G295-S298 PolarHBondContact O-OG 2.93Å; G295-N299 WeakPolarHBondContact O-CB 3.37Å; G295-N299 PolarHBondContact O-N 2.83Å; G295-N299 PolarHBondContact O-ND2 3.46Å
296V88.4Confident86.6Confident57 Ų5759.4 Ų59.435%0.34530%0.297SS..Hα-helixtrans-67-47174.1170.10000110.6I291 C292 T293 F294 S298 N299 L300 F303I291-V296 PolarHBondContact O-N 3.05Å; I291-V296 VanDerWaalsContact O-N 3.09Å; C292-V296 WeakPolarHBondContact O-CB 3.32Å; C292-V296 WeakPolarHBondContact O-CG2 3.21Å; T293-V296 PolarHBondContact O-N 3.12Å; F294-V296 PolarHBondContact O-N 3.38Å; V296-S298 PolarHBondContact O-N 3.2Å; V296-N299 CarbonylContact O-C 3.42Å; V296-N299 PolarHBondContact O-N 3.44Å; V296-L300 HydrophobicContact CG1-CD2 4.14Å; V296-L300 WeakPolarHBondContact O-CD2 3.21Å; V296-L300 WeakPolarHBondContact O-CG 3.3Å; V296-L300 PolarHBondContact O-N 2.93Å; V296-F303 HydrophobicContact CG1-CE2 3.97Å; V296-F303 HydrophobicContact CG1-CZ 4.23Å; V296-F303 HydrophobicContact CG2-CZ 4.43Å
297Y87.6Confident87Confident164 Ų16456.6 Ų56.664%0.64329%0.289SS*.Hα-helixtrans-60.9-43.2178.8179.1-103.1000112.2L165 T293 F294 N299L165-Y297 HydrophobicContact CD2-CD1 3.91Å; L165-Y297 HydrophobicContact CD2-CE1 3.84Å; T293-Y297 WeakPolarHBondContact O-CB 3.17Å; T293-Y297 PolarHBondContact O-N 2.89Å; F294-Y297 PolarHBondContact O-N 2.97Å; Y297-N299 VanDerWaalsContact C-N 3.3Å; Y297-N299 PolarHBondContact O-N 3.41Å
298S84.4Confident87.5Confident5 Ų562.2 Ų62.24%0.03532%0.318CS..Hα-helixtrans-73.3-19.7-179.263.60000114.2F294 G295 V296F294-S298 WeakPolarHBondContact O-CB 3.5Å; F294-S298 PolarHBondContact O-N 3.18Å; F294-S298 PolarHBondContact O-OG 3.28Å; G295-S298 PolarHBondContact O-OG 2.93Å; V296-S298 PolarHBondContact O-N 3.2Å
299N87.8Confident88Confident12 Ų1263.6 Ų63.66%0.06432%0.317CS..THydrogen-bonded Turntrans-127.433.6-172.7-60.2-77.6000113.3F169 G295 V296 Y297 Y301 M302F169-N299 VanDerWaalsContact CD1-ND2 3.31Å; F169-N299 WeakPolarHBondContact CD1-ND2 3.18Å; F169-N299 WeakPolarHBondContact CE1-ND2 3.43Å; G295-N299 WeakPolarHBondContact O-CB 3.37Å; G295-N299 PolarHBondContact O-N 2.83Å; G295-N299 PolarHBondContact O-ND2 3.46Å; V296-N299 CarbonylContact O-C 3.42Å; V296-N299 PolarHBondContact O-N 3.44Å; Y297-N299 VanDerWaalsContact C-N 3.3Å; Y297-N299 PolarHBondContact O-N 3.41Å; N299-Y301 HydrophobicContact CB-CE1 4.12Å; N299-Y301 PolarHBondContact O-N 2.84Å; N299-M302 HydrophobicContact CB-CE 3.82Å; N299-M302 HydrophobicContact CB-CG 3.98Å; N299-M302 HydrophobicContact CB-SD 3.75Å; N299-M302 WeakPolarHBondContact O-CB 3.4Å; N299-M302 WeakPolarHBondContact O-CG 3.31Å; N299-M302 PolarHBondContact O-N 3.44Å
300L88.2Confident88.4Confident96 Ų9660.9 Ų60.950%0.50330%0.301SS..THydrogen-bonded Turntrans-55.9-25.8179.2-72.5175.9000113.8V296 M302 F303V296-L300 HydrophobicContact CG1-CD2 4.14Å; V296-L300 WeakPolarHBondContact O-CD2 3.21Å; V296-L300 WeakPolarHBondContact O-CG 3.3Å; V296-L300 PolarHBondContact O-N 2.93Å; L300-M302 PolarHBondContact O-N 3.26Å; L300-F303 HydrophobicContact CD2-CD2 4.39Å; L300-F303 HydrophobicContact CD2-CE2 4.45Å; L300-F303 PolarHBondContact O-N 3.47Å
301Y86.2Confident88.8Confident27 Ų2761.9 Ų61.911%0.10631%0.307CS..Hα-helixtrans-59.5-32.3175.677.9-94.8000112.5L129 N299 F303 K304 V305 D368L129-Y301 HydrophobicContact CD2-CD2 3.39Å; L129-Y301 HydrophobicContact CD2-CE2 3.9Å; L129-Y301 HydrophobicContact CD2-CG 4.14Å; N299-Y301 HydrophobicContact CB-CE1 4.12Å; N299-Y301 PolarHBondContact O-N 2.84Å; Y301-F303 PolarHBondContact O-N 3.1Å; Y301-K304 WeakPolarHBondContact O-CA 3.3Å; Y301-K304 WeakPolarHBondContact O-CB 3.35Å; Y301-K304 PolarHBondContact O-N 2.9Å; Y301-V305 HydrophobicContact CD2-CG2 4.24Å; Y301-V305 PolarHBondContact O-N 2.91Å; Y301-D368 HydrophobicContact CE2-CB 4.16Å; Y301-D368 PolarHBondContact OH-OD1 3.08Å
302M89.2Confident89.3Confident6 Ų663.4 Ų63.43%0.0332%0.315CS..Hα-helixtrans-59-37.6-176.1-67.3-174.8178.300110.7N299 L300 K304 V305 M306 V372 V375N299-M302 HydrophobicContact CB-CE 3.82Å; N299-M302 HydrophobicContact CB-CG 3.98Å; N299-M302 HydrophobicContact CB-SD 3.75Å; N299-M302 WeakPolarHBondContact O-CB 3.4Å; N299-M302 WeakPolarHBondContact O-CG 3.31Å; N299-M302 PolarHBondContact O-N 3.44Å; L300-M302 PolarHBondContact O-N 3.26Å; M302-K304 VanDerWaalsContact C-N 3.27Å; M302-K304 PolarHBondContact O-N 3.48Å; M302-V305 WeakPolarHBondContact O-CB 3.38Å; M302-V305 PolarHBondContact O-N 3.27Å; M302-V305 VanDerWaalsContact O-N 3.08Å; M302-M306 VanDerWaalsContact O-CG 3.3Å; M302-M306 WeakPolarHBondContact O-CG 3.16Å; M302-M306 PolarHBondContact O-N 2.92Å; M302-M306 VanDerWaalsContact O-N 3.08Å; M302-V372 HydrophobicContact CB-CG2 4.07Å; M302-V372 HydrophobicContact CG-CG2 4Å; M302-V375 HydrophobicContact SD-CB 4.45Å; M302-V375 HydrophobicContact SD-CG2 3.74Å
303F87.6Confident89.8Confident92 Ų9259.8 Ų59.840%0.40429%0.291SS..Hα-helixtrans-64.4-28176.4-61.1-78.1000113.3V296 L300 Y301 M306V296-F303 HydrophobicContact CG1-CE2 3.97Å; V296-F303 HydrophobicContact CG1-CZ 4.23Å; V296-F303 HydrophobicContact CG2-CZ 4.43Å; L300-F303 HydrophobicContact CD2-CD2 4.39Å; L300-F303 HydrophobicContact CD2-CE2 4.45Å; L300-F303 PolarHBondContact O-N 3.47Å; Y301-F303 PolarHBondContact O-N 3.1Å; F303-M306 HydrophobicContact CD1-CE 3.89Å; F303-M306 HydrophobicContact CD1-SD 3.95Å; F303-M306 HydrophobicContact CE1-CE 4.03Å
304K87.1Confident90.1Very high147 Ų14755.7 Ų55.764%0.63927%0.266SS*.Hα-helixtrans-77.2-23.6174.6-61.3-179.1-179.4176.60112.8F128 Y301 M302F128-K304 HydrophobicContact CE2-CB 4.08Å; F128-K304 HydrophobicContact CE2-CD 4.26Å; F128-K304 HydrophobicContact CZ-CB 3.79Å; Y301-K304 WeakPolarHBondContact O-CA 3.3Å; Y301-K304 WeakPolarHBondContact O-CB 3.35Å; Y301-K304 PolarHBondContact O-N 2.9Å; M302-K304 VanDerWaalsContact C-N 3.27Å; M302-K304 PolarHBondContact O-N 3.48Å
305V88.2Confident90.4Very high17 Ų1755.3 Ų55.310%0.10327%0.266CS..Hα-helixtrans-81.8-27.5174.8-1750000111.2F128 L129 M234 Y301 M302 T307 V372F128-V305 HydrophobicContact CE1-CG2 3.75Å; F128-V305 HydrophobicContact CZ-CG2 3.66Å; L129-V305 HydrophobicContact CD1-CG2 4.06Å; L129-V305 HydrophobicContact CD2-CG2 4.16Å; L129-V305 HydrophobicContact CG-CG2 4.39Å; M234-V305 HydrophobicContact CE-CG1 3.84Å; Y301-V305 HydrophobicContact CD2-CG2 4.24Å; Y301-V305 PolarHBondContact O-N 2.91Å; M302-V305 WeakPolarHBondContact O-CB 3.38Å; M302-V305 PolarHBondContact O-N 3.27Å; M302-V305 VanDerWaalsContact O-N 3.08Å; V305-T307 PolarHBondContact O-N 2.77Å; V305-T307 VanDerWaalsContact O-N 3.16Å; V305-V372 HydrophobicContact CB-CG2 4.03Å; V305-V372 HydrophobicContact CG1-CG2 4.02Å; V305-V372 HydrophobicContact CG2-CG2 4.44Å
306M90.9Very high90.8Very high33 Ų3357.2 Ų57.216%0.16328%0.279CS..  trans-57121179.8-63.4-167.918000111.1M302 F303 L311 V372 V375 I376M302-M306 VanDerWaalsContact O-CG 3.3Å; M302-M306 WeakPolarHBondContact O-CG 3.16Å; M302-M306 PolarHBondContact O-N 2.92Å; M302-M306 VanDerWaalsContact O-N 3.08Å; F303-M306 HydrophobicContact CD1-CE 3.89Å; F303-M306 HydrophobicContact CD1-SD 3.95Å; F303-M306 HydrophobicContact CE1-CE 4.03Å; M306-L311 HydrophobicContact CB-CD2 4.5Å; M306-L311 HydrophobicContact SD-CD2 3.97Å; M306-V372 HydrophobicContact CE-CG1 4.44Å; M306-V372 HydrophobicContact CG-CG1 3.96Å; M306-V375 HydrophobicContact CE-CG1 4.1Å; M306-I376 HydrophobicContact CE-CD1 4.41Å; M306-I376 HydrophobicContact CE-CG1 3.59Å; M306-I376 HydrophobicContact CG-CD1 3.96Å; M306-I376 HydrophobicContact CG-CG1 4.14Å; M306-I376 HydrophobicContact SD-CD1 4.27Å; M306-I376 HydrophobicContact SD-CG1 3.86Å
307T91.3Very high91.1Very high53 Ų5354.5 Ų54.533%0.32526%0.262SS..  trans-108.4159.9171.4620000109.3V305 R309 A310 L311V305-T307 PolarHBondContact O-N 2.77Å; V305-T307 VanDerWaalsContact O-N 3.16Å; T307-R309 PolarHBondContact O-N 2.89Å; T307-A310 WeakPolarHBondContact O-CA 3.49Å; T307-A310 WeakPolarHBondContact O-CB 3.39Å; T307-A310 PolarHBondContact O-N 2.91Å; T307-A310 WeakPolarHBondContact OG1-CB 3.45Å; T307-A310 PolarHBondContact OG1-N 3.33Å; T307-L311 WeakPolarHBondContact O-CG 3.3Å; T307-L311 PolarHBondContact O-N 3.3Å
308L93.1Very high91.5Very high127 Ų12746.7 Ų46.767%0.66523%0.232SC*.Hα-helixtrans-54.8-38.3174.9-179.460.7000112.1A310 L311 L312L308-A310 PolarHBondContact O-N 3.32Å; L308-L311 PolarHBondContact O-N 3.04Å; L308-L312 HydrophobicContact CD1-CD1 4.41Å; L308-L312 HydrophobicContact CD1-CG 4.26Å; L308-L312 HydrophobicContact CG-CD1 4.13Å; L308-L312 HydrophobicContact CG-CG 4.41Å; L308-L312 VanDerWaalsContact O-CG 3.29Å; L308-L312 WeakPolarHBondContact O-CG 3.3Å; L308-L312 PolarHBondContact O-N 3.35Å
309R92.7Very high92Very high118 Ų11851.9 Ų51.945%0.44525%0.25SS..Hα-helixtrans-61.4-45.1176.2-65.7179.7-176.6166-1.1112T307 L312 A313T307-R309 PolarHBondContact O-N 2.89Å; R309-L312 PolarHBondContact O-N 2.77Å; R309-A313 VanDerWaalsContact O-CB 3.31Å; R309-A313 WeakPolarHBondContact O-CB 3.45Å; R309-A313 PolarHBondContact O-N 2.98Å
310A94.6Very high92.4Very high0 Ų055.2 Ų55.20%027%0.268CS..Hα-helixtrans-60.7-43.7175.100000112.5F226 M234 T307 L308 A313 G314 M373 I376F226-A310 HydrophobicContact CE1-CB 4.34Å; F226-A310 HydrophobicContact CZ-CB 4.37Å; M234-A310 HydrophobicContact CE-CB 3.96Å; T307-A310 WeakPolarHBondContact O-CA 3.49Å; T307-A310 WeakPolarHBondContact O-CB 3.39Å; T307-A310 PolarHBondContact O-N 2.91Å; T307-A310 WeakPolarHBondContact OG1-CB 3.45Å; T307-A310 PolarHBondContact OG1-N 3.33Å; L308-A310 PolarHBondContact O-N 3.32Å; A310-A313 PolarHBondContact O-N 2.91Å; A310-G314 PolarHBondContact O-N 3.08Å; A310-M373 HydrophobicContact CB-CE 3.4Å; A310-M373 VanDerWaalsContact CB-CE 3.4Å; A310-M373 HydrophobicContact CB-SD 4.23Å; A310-I376 HydrophobicContact CB-CD1 3.74Å
311L95.7Very high92.8Very high50 Ų5050.7 Ų50.726%0.26224%0.244SC..Hα-helixtrans-61.9-46.3176-66.4172.9000111.7M306 T307 L308 G314 L315 I376 F380M306-L311 HydrophobicContact CB-CD2 4.5Å; M306-L311 HydrophobicContact SD-CD2 3.97Å; T307-L311 WeakPolarHBondContact O-CG 3.3Å; T307-L311 PolarHBondContact O-N 3.3Å; L308-L311 PolarHBondContact O-N 3.04Å; L311-G314 PolarHBondContact O-N 3.29Å; L311-L315 VanDerWaalsContact O-CB 3.31Å; L311-L315 WeakPolarHBondContact O-CB 3.45Å; L311-L315 PolarHBondContact O-N 3.08Å; L311-I376 HydrophobicContact CD2-CD1 4.33Å; L311-I376 HydrophobicContact CD2-CG1 4.33Å; L311-I376 HydrophobicContact CD2-CG2 4.09Å; L311-F380 HydrophobicContact CB-CE2 4.21Å; L311-F380 HydrophobicContact CB-CZ 4.42Å; L311-F380 HydrophobicContact CD2-CE2 3.99Å; L311-F380 HydrophobicContact CD2-CZ 4.32Å; L311-F380 WeakPolarHBondContact O-CE2 3.03Å
312L95.5Very high93.2Very high98 Ų9850.1 Ų50.151%0.51324%0.242SC..Hα-helixtrans-64-43.8177.5-67.9174000111.8L308 R309 L315 C316L308-L312 HydrophobicContact CD1-CD1 4.41Å; L308-L312 HydrophobicContact CD1-CG 4.26Å; L308-L312 HydrophobicContact CG-CD1 4.13Å; L308-L312 HydrophobicContact CG-CG 4.41Å; L308-L312 VanDerWaalsContact O-CG 3.29Å; L308-L312 WeakPolarHBondContact O-CG 3.3Å; L308-L312 PolarHBondContact O-N 3.35Å; R309-L312 PolarHBondContact O-N 2.77Å; L312-L315 PolarHBondContact O-N 3.16Å; L312-C316 PolarHBondContact O-N 2.93Å; L312-C316 PolarHBondContact O-SG 2.89Å
313A94.6Very high93.6Very high4 Ų452.5 Ų52.53%0.03326%0.263CS..Hα-helixtrans-61.8-48.2176.700000111.8V221 A225 F226 R309 A310 L315 C316 V317V221-A313 HydrophobicContact CG1-CB 3.68Å; A225-A313 HydrophobicContact CB-CB 3.9Å; F226-A313 HydrophobicContact CE2-CB 3.73Å; F226-A313 HydrophobicContact CZ-CB 3.7Å; R309-A313 VanDerWaalsContact O-CB 3.31Å; R309-A313 WeakPolarHBondContact O-CB 3.45Å; R309-A313 PolarHBondContact O-N 2.98Å; A310-A313 PolarHBondContact O-N 2.91Å; A313-L315 VanDerWaalsContact C-N 3.29Å; A313-L315 PolarHBondContact O-N 3.05Å; A313-C316 PolarHBondContact O-N 2.84Å; A313-V317 PolarHBondContact O-N 2.89Å
314G94.1Very high93.9Very high0 Ų049 Ų490%025%0.253CS..Hα-helixtrans-68.9-25178.800000113.8A310 L311 P318A310-G314 PolarHBondContact O-N 3.08Å; L311-G314 PolarHBondContact O-N 3.29Å; G314-P318 WeakPolarHBondContact O-CD 3.42Å
315L95Very high94.4Very high49 Ų4942 Ų4226%0.25722%0.223SC..Hα-helixtrans-70.1-45168.3178.9150.6000111.5L311 L312 A313 V317 P318 W319 F380L311-L315 VanDerWaalsContact O-CB 3.31Å; L311-L315 WeakPolarHBondContact O-CB 3.45Å; L311-L315 PolarHBondContact O-N 3.08Å; L312-L315 PolarHBondContact O-N 3.16Å; A313-L315 VanDerWaalsContact C-N 3.29Å; A313-L315 PolarHBondContact O-N 3.05Å; L315-V317 VanDerWaalsContact C-N 3.35Å; L315-V317 PolarHBondContact O-N 2.79Å; L315-P318 WeakPolarHBondContact O-CD 3.28Å; L315-W319 HydrophobicContact CD2-CD2 4.27Å; L315-W319 HydrophobicContact CD2-CG 4.22Å; L315-W319 HydrophobicContact CG-CG 4.49Å; L315-W319 WeakPolarHBondContact O-CB 3.31Å; L315-W319 PolarHBondContact O-N 3.23Å; L315-F380 HydrophobicContact CB-CB 4.33Å; L315-F380 HydrophobicContact CB-CD1 4.23Å; L315-F380 HydrophobicContact CB-CD2 3.85Å; L315-F380 HydrophobicContact CB-CE2 4.18Å; L315-F380 HydrophobicContact CB-CG 3.88Å; L315-F380 HydrophobicContact CD1-CD1 3.87Å; L315-F380 HydrophobicContact CD1-CE1 3.93Å; L315-F380 HydrophobicContact CD1-CG 4.37Å; L315-F380 HydrophobicContact CD1-CZ 4.45Å; L315-F380 HydrophobicContact CG-CD1 4.28Å; L315-F380 HydrophobicContact CG-CG 4.3Å
316C95.2Very high94.8Very high47 Ų4745 Ų4532%0.31824%0.236SC..Hα-helixtrans-61.3-39.7-176.2-75.70000112.9V221 L312 A313 W319 L320V221-C316 HydrophobicContact CG2-CB 4.17Å; L312-C316 PolarHBondContact O-N 2.93Å; L312-C316 PolarHBondContact O-SG 2.89Å; A313-C316 PolarHBondContact O-N 2.84Å; C316-W319 PolarHBondContact O-N 3.28Å; C316-L320 HydrophobicContact CB-CD1 4.15Å; C316-L320 WeakPolarHBondContact O-CB 3.25Å; C316-L320 WeakPolarHBondContact O-CG 3.37Å; C316-L320 PolarHBondContact O-N 2.98Å
317V94.5Very high95.1Very high0 Ų046.1 Ų46.10%025%0.251CS..Hα-helixtrans-57-60.3-175.8173.70000113.1M214 V221 V238 A313 L315 W319 G321 V377M214-V317 HydrophobicContact CE-CG1 3.71Å; V221-V317 HydrophobicContact CB-CG2 4.43Å; V221-V317 HydrophobicContact CG1-CG2 4.29Å; V221-V317 HydrophobicContact CG2-CG2 4.41Å; V238-V317 HydrophobicContact CG2-CG2 3.42Å; V238-V317 VanDerWaalsContact CG2-CG2 3.42Å; A313-V317 PolarHBondContact O-N 2.89Å; L315-V317 VanDerWaalsContact C-N 3.35Å; L315-V317 PolarHBondContact O-N 2.79Å; V317-W319 VanDerWaalsContact C-N 3.34Å; V317-W319 PolarHBondContact O-N 3.43Å; V317-G321 PolarHBondContact O-N 3.36Å; V317-V377 HydrophobicContact CB-CG2 4.34Å
318P94.7Very high95.3Very high0 Ų045.6 Ų45.60%025%0.246CC..Hα-helixtrans-65.5-38.1-179.422.3-29000111.7G314 L315 G321 F322 G347 V377 F380G314-P318 WeakPolarHBondContact O-CD 3.42Å; L315-P318 WeakPolarHBondContact O-CD 3.28Å; P318-G321 PolarHBondContact O-N 3.48Å; P318-F322 HydrophobicContact CB-CD2 4.46Å; P318-F322 HydrophobicContact CB-CE2 4.03Å; P318-F322 WeakPolarHBondContact O-CD2 3.31Å; P318-F322 WeakPolarHBondContact O-CG 3.48Å; P318-F322 PolarHBondContact O-N 3.23Å; P318-G347 WeakPolarHBondContact CB-O 3.21Å; P318-V377 HydrophobicContact CG-CG1 4.32Å; P318-F380 HydrophobicContact CG-CB 4.46Å
319W95.7Very high95.5Very high113 Ų11339.5 Ų39.543%0.42821%0.214SC..Hα-helixtrans-65.6-45-178.8-76.456.4000112.6L315 C316 V317 G321 F322 A323 V383 P384L315-W319 HydrophobicContact CD2-CD2 4.27Å; L315-W319 HydrophobicContact CD2-CG 4.22Å; L315-W319 HydrophobicContact CG-CG 4.49Å; L315-W319 WeakPolarHBondContact O-CB 3.31Å; L315-W319 PolarHBondContact O-N 3.23Å; C316-W319 PolarHBondContact O-N 3.28Å; V317-W319 VanDerWaalsContact C-N 3.34Å; V317-W319 PolarHBondContact O-N 3.43Å; W319-G321 VanDerWaalsContact C-N 3.31Å; W319-F322 PolarHBondContact O-N 3.39Å; W319-A323 VanDerWaalsContact O-CB 3.3Å; W319-A323 WeakPolarHBondContact O-CB 3.29Å; W319-A323 PolarHBondContact O-N 3.45Å; W319-V383 HydrophobicContact CZ2-CG1 4.1Å; W319-P384 HydrophobicContact CD2-CG 3.85Å; W319-P384 VanDerWaalsContact CE2-CG 3.42Å; W319-P384 HydrophobicContact CG-CG 3.99Å; W319-P384 HydrophobicContact CZ2-CG 3.9Å; W319-P384 VanDerWaalsContact NE1-CG 3.25Å
320L96.3Very high95.7Very high83 Ų8339.5 Ų39.544%0.43522%0.221SC..Hα-helixtrans-68.3-33.2174-67.7174.7000111.2I217 V221 C316 G324I217-L320 HydrophobicContact CD1-CB 4.17Å; I217-L320 HydrophobicContact CG2-CB 3.76Å; I217-L320 HydrophobicContact CG2-CD1 3.99Å; V221-L320 HydrophobicContact CG2-CD1 4.4Å; C316-L320 HydrophobicContact CB-CD1 4.15Å; C316-L320 WeakPolarHBondContact O-CB 3.25Å; C316-L320 WeakPolarHBondContact O-CG 3.37Å; C316-L320 PolarHBondContact O-N 2.98Å; L320-G324 WeakPolarHBondContact O-CA 3.4Å; L320-G324 PolarHBondContact O-N 3.2Å
321G95.7Very high95.8Very high0 Ų045.9 Ų45.90%025%0.254CS..Hα-helixtrans-61.7-5217200000112.4M214 V317 P318 W319 A323 G324 G325 T346M214-G321 WeakPolarHBondContact SD-CA 3.44Å; V317-G321 PolarHBondContact O-N 3.36Å; P318-G321 PolarHBondContact O-N 3.48Å; W319-G321 VanDerWaalsContact C-N 3.31Å; G321-A323 PolarHBondContact O-N 2.91Å; G321-G324 PolarHBondContact O-N 3.42Å; G321-G325 PolarHBondContact O-N 2.88Å; G321-T346 WeakPolarHBondContact O-CB 3.31Å; G321-T346 WeakPolarHBondContact O-CG2 3.49Å
322F96Very high95.9Very high16 Ų1647.5 Ų47.57%0.0726%0.263CS..Hα-helixtrans-56.6-49.8175.6-69.6-56.7000111.4P318 W319 M326 S343 L344 I348 T381 P384 V385P318-F322 HydrophobicContact CB-CD2 4.46Å; P318-F322 HydrophobicContact CB-CE2 4.03Å; P318-F322 WeakPolarHBondContact O-CD2 3.31Å; P318-F322 WeakPolarHBondContact O-CG 3.48Å; P318-F322 PolarHBondContact O-N 3.23Å; W319-F322 PolarHBondContact O-N 3.39Å; F322-M326 VanDerWaalsContact O-CB 3.25Å; F322-M326 WeakPolarHBondContact O-CB 3.05Å; F322-M326 PolarHBondContact O-N 2.91Å; F322-S343 VanDerWaalsContact CD1-O 3.3Å; F322-S343 WeakPolarHBondContact CD1-O 3.42Å; F322-S343 PolarHBondContact O-OG 3.18Å; F322-L344 HydrophobicContact CD1-CD2 4.39Å; F322-L344 HydrophobicContact CE1-CD2 3.93Å; F322-I348 HydrophobicContact CE1-CD1 4.33Å; F322-I348 HydrophobicContact CE1-CG1 3.78Å; F322-I348 HydrophobicContact CZ-CG1 3.72Å; F322-T381 HydrophobicContact CZ-CG2 4.09Å; F322-P384 HydrophobicContact CD2-CB 3.9Å; F322-P384 HydrophobicContact CD2-CG 3.89Å; F322-P384 HydrophobicContact CE2-CB 4Å; F322-P384 HydrophobicContact CE2-CG 3.88Å; F322-V385 HydrophobicContact CE1-CG2 4.04Å; F322-V385 HydrophobicContact CE2-CG2 4.35Å; F322-V385 HydrophobicContact CZ-CG2 3.67Å
323A96.2Very high95.9Very high56 Ų5653.7 Ų53.746%0.46328%0.279SS..Hα-helixtrans-65.8-43.1-178.300000112.1W319 G321 M326 A327W319-A323 VanDerWaalsContact O-CB 3.3Å; W319-A323 WeakPolarHBondContact O-CB 3.29Å; W319-A323 PolarHBondContact O-N 3.45Å; G321-A323 PolarHBondContact O-N 2.91Å; A323-M326 PolarHBondContact O-N 3.4Å; A323-A327 WeakPolarHBondContact O-CB 3.17Å; A323-A327 PolarHBondContact O-N 3.07Å
324G95.9Very high96Very high19 Ų1954.9 Ų54.920%0.19628%0.284CS..Hα-helixtrans-65.3-46.917900000112.4L320 G321 M326 A327 L328L320-G324 WeakPolarHBondContact O-CA 3.4Å; L320-G324 PolarHBondContact O-N 3.2Å; G321-G324 PolarHBondContact O-N 3.42Å; G324-M326 PolarHBondContact O-N 3.08Å; G324-A327 PolarHBondContact O-N 3.07Å; G324-L328 WeakPolarHBondContact O-CB 3.35Å; G324-L328 PolarHBondContact O-N 3.38Å
325G96.1Very high96.1Very high0 Ų058.7 Ų58.70%031%0.308CS..Hα-helixtrans-62-41.9175.200000112.4G321 A329G321-G325 PolarHBondContact O-N 2.88Å; G325-A329 VanDerWaalsContact O-CB 3.26Å; G325-A329 WeakPolarHBondContact O-CB 3.43Å; G325-A329 PolarHBondContact O-N 3.48Å
326M96.7Very high96.1Very high78 Ų7867 Ų6738%0.38434%0.337SS..Hα-helixtrans-63.4-50.1174.9179.8170-70.900111.8F322 A323 G324 L328 A329 M330 V339F322-M326 VanDerWaalsContact O-CB 3.25Å; F322-M326 WeakPolarHBondContact O-CB 3.05Å; F322-M326 PolarHBondContact O-N 2.91Å; A323-M326 PolarHBondContact O-N 3.4Å; G324-M326 PolarHBondContact O-N 3.08Å; M326-L328 PolarHBondContact O-N 3.47Å; M326-A329 PolarHBondContact O-N 3.49Å; M326-M330 HydrophobicContact CG-CG 4.38Å; M326-M330 HydrophobicContact CG-SD 3.79Å; M326-M330 WeakPolarHBondContact O-CB 3.42Å; M326-M330 VanDerWaalsContact O-CG 3.27Å; M326-M330 WeakPolarHBondContact O-CG 3.28Å; M326-M330 PolarHBondContact O-N 3Å; M326-M330 HydrophobicContact SD-SD 4.46Å; M326-V339 HydrophobicContact CB-CG1 4.45Å; M326-V339 HydrophobicContact CG-CG1 3.81Å
327A97.2Very high96.1Very high58 Ų5866.5 Ų66.548%0.47934%0.336SS..Hα-helixtrans-61-44.7-178.100000111.6A323 G324 M330 L331A323-A327 WeakPolarHBondContact O-CB 3.17Å; A323-A327 PolarHBondContact O-N 3.07Å; G324-A327 PolarHBondContact O-N 3.07Å; A327-M330 PolarHBondContact O-N 3.42Å; A327-L331 VanDerWaalsContact O-CB 3.27Å; A327-L331 WeakPolarHBondContact O-CB 3.4Å; A327-L331 PolarHBondContact O-N 3.14Å
328L96.6Very high96.2Very high41 Ų4167.6 Ų67.622%0.21534%0.341CS..Hα-helixtrans-66.5-42.6178.6-173.959.9000111.8I205 F208 G324 M326 M330 L331 L332I205-L328 HydrophobicContact CG2-CD2 3.95Å; I205-L328 HydrophobicContact CG2-CG 4Å; F208-L328 HydrophobicContact CD1-CD2 3.74Å; F208-L328 HydrophobicContact CE1-CD2 4.13Å; G324-L328 WeakPolarHBondContact O-CB 3.35Å; G324-L328 PolarHBondContact O-N 3.38Å; M326-L328 PolarHBondContact O-N 3.47Å; L328-M330 VanDerWaalsContact C-N 3.34Å; L328-M330 PolarHBondContact O-N 3.18Å; L328-L331 HydrophobicContact CD1-CD2 4.49Å; L328-L331 PolarHBondContact O-N 3.27Å; L328-L332 HydrophobicContact CD1-CD1 3.93Å; L328-L332 HydrophobicContact CD1-CG 4.36Å; L328-L332 HydrophobicContact CG-CD1 4.11Å; L328-L332 WeakPolarHBondContact O-CB 3.5Å; L328-L332 WeakPolarHBondContact O-CG 3.3Å; L328-L332 PolarHBondContact O-N 3.12Å
329A97Very high96.3Very high0 Ų068.3 Ų68.30%035%0.346CS..Hα-helixtrans-64-38.8176.500000112.2G325 M326 L332 R333 Q334 V339 I342G325-A329 VanDerWaalsContact O-CB 3.26Å; G325-A329 WeakPolarHBondContact O-CB 3.43Å; G325-A329 PolarHBondContact O-N 3.48Å; M326-A329 PolarHBondContact O-N 3.49Å; A329-L332 CarbonylContact O-C 3.5Å; A329-R333 PolarHBondContact O-N 2.89Å; A329-Q334 HydrophobicContact CB-CB 4.24Å; A329-Q334 HydrophobicContact CB-CG 4.25Å; A329-Q334 WeakPolarHBondContact O-CB 3.34Å; A329-Q334 WeakPolarHBondContact O-CG 3.31Å; A329-Q334 PolarHBondContact O-N 3.34Å; A329-V339 HydrophobicContact CB-CB 4.25Å; A329-V339 HydrophobicContact CB-CG1 4.3Å; A329-V339 HydrophobicContact CB-CG2 3.9Å; A329-I342 HydrophobicContact CB-CB 4.21Å; A329-I342 HydrophobicContact CB-CD1 3.87Å; A329-I342 HydrophobicContact CB-CG2 4.13Å
330M97.1Very high96.3Very high118 Ų11864.6 Ų64.658%0.58134%0.336SS*.Hα-helixtrans-68-43174.9-73178.865.800112.1M326 A327 L328 L332 R333 V339M326-M330 HydrophobicContact CG-CG 4.38Å; M326-M330 HydrophobicContact CG-SD 3.79Å; M326-M330 WeakPolarHBondContact O-CB 3.42Å; M326-M330 VanDerWaalsContact O-CG 3.27Å; M326-M330 WeakPolarHBondContact O-CG 3.28Å; M326-M330 PolarHBondContact O-N 3Å; M326-M330 HydrophobicContact SD-SD 4.46Å; A327-M330 PolarHBondContact O-N 3.42Å; L328-M330 VanDerWaalsContact C-N 3.34Å; L328-M330 PolarHBondContact O-N 3.18Å; M330-L332 VanDerWaalsContact C-N 3.25Å; M330-L332 PolarHBondContact O-N 3.15Å; M330-R333 WeakPolarHBondContact O-CA 3.49Å; M330-R333 PolarHBondContact O-N 3.47Å; M330-V339 HydrophobicContact CG-CG1 3.91Å; M330-V339 HydrophobicContact CG-CG2 4.21Å
331L96.9Very high96.2Very high133 Ų13360.7 Ų60.770%0.69632%0.315SS*.Hα-helixtrans-58.6-40.9176.7-178.565.2000111.1A327 L328 R333A327-L331 VanDerWaalsContact O-CB 3.27Å; A327-L331 WeakPolarHBondContact O-CB 3.4Å; A327-L331 PolarHBondContact O-N 3.14Å; L328-L331 HydrophobicContact CD1-CD2 4.49Å; L328-L331 PolarHBondContact O-N 3.27Å; L331-R333 PolarHBondContact O-N 2.88Å
332L96.2Very high96.2Very high85 Ų8560.7 Ų60.745%0.44532%0.315SS..THydrogen-bonded Turntrans-87.618.3176.5-61.6173.4000113.3I205 L328 A329 M330 Q334I205-L332 HydrophobicContact CD1-CB 3.76Å; I205-L332 HydrophobicContact CD1-CD1 3.46Å; I205-L332 VanDerWaalsContact CD1-CD1 3.46Å; I205-L332 HydrophobicContact CD1-CG 4.26Å; I205-L332 HydrophobicContact CG1-CD1 3.47Å; I205-L332 VanDerWaalsContact CG1-CD1 3.47Å; L328-L332 HydrophobicContact CD1-CD1 3.93Å; L328-L332 HydrophobicContact CD1-CG 4.36Å; L328-L332 HydrophobicContact CG-CD1 4.11Å; L328-L332 WeakPolarHBondContact O-CB 3.5Å; L328-L332 WeakPolarHBondContact O-CG 3.3Å; L328-L332 PolarHBondContact O-N 3.12Å; A329-L332 CarbonylContact O-C 3.5Å; M330-L332 VanDerWaalsContact C-N 3.25Å; M330-L332 PolarHBondContact O-N 3.15Å; L332-Q334 VanDerWaalsContact C-N 3.29Å; L332-Q334 PolarHBondContact O-N 3.36Å; L332-Q334 PolarHBondContact O-NE2 3.45Å
333R95.9Very high96.2Very high227 Ų22760.3 Ų60.386%0.85731%0.314SS*.THydrogen-bonded Turntrans54.138.9169.5-58.6-177.5175.1178-1.7114.2A329 M330 L331A329-R333 PolarHBondContact O-N 2.89Å; M330-R333 WeakPolarHBondContact O-CA 3.49Å; M330-R333 PolarHBondContact O-N 3.47Å; L331-R333 PolarHBondContact O-N 2.88Å
334Q96.6Very high96.1Very high30 Ų3058 Ų5814%0.1429%0.294CS..  trans-70.2145.5175.9-66.4-55.3-56.800111.7I205 A329 L332 N338 V339 I342I205-Q334 HydrophobicContact CD1-CG 3.78Å; A329-Q334 HydrophobicContact CB-CB 4.24Å; A329-Q334 HydrophobicContact CB-CG 4.25Å; A329-Q334 WeakPolarHBondContact O-CB 3.34Å; A329-Q334 WeakPolarHBondContact O-CG 3.31Å; A329-Q334 PolarHBondContact O-N 3.34Å; L332-Q334 VanDerWaalsContact C-N 3.29Å; L332-Q334 PolarHBondContact O-N 3.36Å; L332-Q334 PolarHBondContact O-NE2 3.45Å; Q334-N338 HydrophobicContact CB-CB 3.98Å; Q334-N338 PolarHBondContact OE1-ND2 3.47Å; Q334-V339 HydrophobicContact CB-CG2 3.89Å; Q334-V339 WeakPolarHBondContact O-CG2 3.42Å; Q334-I342 HydrophobicContact CG-CD1 4.2Å
335P96.3Very high95.9Very high79 Ų7957.2 Ų57.251%0.51329%0.285SS..  trans-56.9151.3170.8-23.633000111.7A337 N338 V339P335-A337 VanDerWaalsContact C-N 3.26Å; P335-A337 PolarHBondContact O-N 3.49Å; P335-A337 VanDerWaalsContact O-N 3.12Å; P335-N338 WeakPolarHBondContact O-CA 3.29Å; P335-N338 WeakPolarHBondContact O-CB 3.31Å; P335-N338 PolarHBondContact O-N 2.98Å; P335-V339 PolarHBondContact O-N 3.05Å
336R95.1Very high95.8Very high225 Ų22557.2 Ų57.285%0.84929%0.286SS*.Hα-helixtrans-50.2-44-176.1-68-173.5175.4104.30.9113.5N338 V339 V340R336-N338 VanDerWaalsContact C-N 3.31Å; R336-N338 PolarHBondContact O-N 2.9Å; R336-V339 PolarHBondContact O-N 3.2Å; R336-V340 WeakPolarHBondContact O-CG2 3.35Å; R336-V340 PolarHBondContact O-N 2.79Å
337A95.6Very high95.6Very high36 Ų3653.5 Ų53.530%0.29827%0.267SS..Hα-helixtrans-61.2-38.3178.400000112.6G259 N260 P335 A341G259-A337 WeakPolarHBondContact CA-O 3.5Å; N260-A337 HydrophobicContact CB-CB 4.06Å; N260-A337 PolarHBondContact N-O 3.07Å; P335-A337 VanDerWaalsContact C-N 3.26Å; P335-A337 PolarHBondContact O-N 3.49Å; P335-A337 VanDerWaalsContact O-N 3.12Å; A337-A341 PolarHBondContact O-N 3.05Å; A337-A341 VanDerWaalsContact O-N 3.13Å
338N96.4Very high95.4Very high22 Ų2251.1 Ų51.112%0.11825%0.246CC..Hα-helixtrans-71.7-38.8175.4-69.37.6000111.5N260 L263 Q334 P335 R336 V340 A341 I342N260-N338 VanDerWaalsContact CB-OD1 3.32Å; N260-N338 WeakPolarHBondContact CB-OD1 3.5Å; N260-N338 PolarHBondContact ND2-OD1 3.36Å; L263-N338 HydrophobicContact CD2-CB 3.81Å; Q334-N338 HydrophobicContact CB-CB 3.98Å; Q334-N338 PolarHBondContact OE1-ND2 3.47Å; P335-N338 WeakPolarHBondContact O-CA 3.29Å; P335-N338 WeakPolarHBondContact O-CB 3.31Å; P335-N338 PolarHBondContact O-N 2.98Å; R336-N338 VanDerWaalsContact C-N 3.31Å; R336-N338 PolarHBondContact O-N 2.9Å; N338-V340 VanDerWaalsContact C-N 3.32Å; N338-V340 PolarHBondContact O-N 3.49Å; N338-A341 PolarHBondContact O-N 3.2Å; N338-I342 WeakPolarHBondContact O-CB 3.37Å; N338-I342 WeakPolarHBondContact O-CD1 2.88Å; N338-I342 VanDerWaalsContact O-CG1 3.24Å; N338-I342 WeakPolarHBondContact O-CG1 3.34Å; N338-I342 PolarHBondContact O-N 2.8Å
339V97.2Very high95Very high15 Ų1549.6 Ų49.69%0.09124%0.238CC..Hα-helixtrans-59.9-44.6176.4175.30000110.7M326 A329 M330 Q334 P335 R336 S343M326-V339 HydrophobicContact CB-CG1 4.45Å; M326-V339 HydrophobicContact CG-CG1 3.81Å; A329-V339 HydrophobicContact CB-CB 4.25Å; A329-V339 HydrophobicContact CB-CG1 4.3Å; A329-V339 HydrophobicContact CB-CG2 3.9Å; M330-V339 HydrophobicContact CG-CG1 3.91Å; M330-V339 HydrophobicContact CG-CG2 4.21Å; Q334-V339 HydrophobicContact CB-CG2 3.89Å; Q334-V339 WeakPolarHBondContact O-CG2 3.42Å; P335-V339 PolarHBondContact O-N 3.05Å; R336-V339 PolarHBondContact O-N 3.2Å; V339-S343 WeakPolarHBondContact O-CB 3.35Å; V339-S343 PolarHBondContact O-N 2.7Å
340V95.7Very high94.5Very high36 Ų3650.7 Ų50.722%0.21824%0.244CC..Hα-helixtrans-61.6-50.4176172.80000110.6L257 R336 N338 I342 S343 L344L257-V340 HydrophobicContact CB-CG1 3.84Å; R336-V340 WeakPolarHBondContact O-CG2 3.35Å; R336-V340 PolarHBondContact O-N 2.79Å; N338-V340 VanDerWaalsContact C-N 3.32Å; N338-V340 PolarHBondContact O-N 3.49Å; V340-I342 PolarHBondContact O-N 3.27Å; V340-S343 PolarHBondContact O-N 2.82Å; V340-L344 HydrophobicContact CG1-CD1 3.76Å; V340-L344 HydrophobicContact CG1-CG 4.35Å; V340-L344 WeakPolarHBondContact O-CB 3.25Å; V340-L344 VanDerWaalsContact O-CG 3.3Å; V340-L344 WeakPolarHBondContact O-CG 3.08Å; V340-L344 PolarHBondContact O-N 3.1Å
341A94.8Very high94.2Very high0 Ų046.2 Ų46.20%022%0.223CC..Hα-helixtrans-59.7-47179.800000112.4T254 N260 L263 M267 A337 N338 L344 E345T254-A341 HydrophobicContact CG2-CB 3.97Å; N260-A341 HydrophobicContact CB-CB 4.41Å; N260-A341 WeakPolarHBondContact O-CB 3.25Å; L263-A341 HydrophobicContact CD2-CB 4.27Å; M267-A341 HydrophobicContact CE-CB 4.19Å; A337-A341 PolarHBondContact O-N 3.05Å; A337-A341 VanDerWaalsContact O-N 3.13Å; N338-A341 PolarHBondContact O-N 3.2Å; A341-L344 PolarHBondContact O-N 2.93Å; A341-E345 WeakPolarHBondContact O-CB 3.3Å; A341-E345 PolarHBondContact O-N 2.8Å
342I95.2Very high93.9Very high0 Ų040.1 Ų40.10%019%0.193CC..Hα-helixtrans-64.9-43.4179.2-67.8164.7000110.8A202 I205 L263 M267 A329 Q334 N338 V340 T346A202-I342 HydrophobicContact CB-CD1 4.36Å; I205-I342 HydrophobicContact CB-CD1 4.19Å; I205-I342 HydrophobicContact CG2-CD1 4.08Å; I205-I342 HydrophobicContact CG2-CG2 3.92Å; L263-I342 HydrophobicContact CD2-CD1 4.45Å; L263-I342 HydrophobicContact CD2-CG1 4.23Å; M267-I342 HydrophobicContact CE-CG1 4.33Å; M267-I342 HydrophobicContact SD-CG1 4.01Å; A329-I342 HydrophobicContact CB-CB 4.21Å; A329-I342 HydrophobicContact CB-CD1 3.87Å; A329-I342 HydrophobicContact CB-CG2 4.13Å; Q334-I342 HydrophobicContact CG-CD1 4.2Å; N338-I342 WeakPolarHBondContact O-CB 3.37Å; N338-I342 WeakPolarHBondContact O-CD1 2.88Å; N338-I342 VanDerWaalsContact O-CG1 3.24Å; N338-I342 WeakPolarHBondContact O-CG1 3.34Å; N338-I342 PolarHBondContact O-N 2.8Å; V340-I342 PolarHBondContact O-N 3.27Å; I342-T346 WeakPolarHBondContact O-CB 3.19Å; I342-T346 PolarHBondContact O-N 2.86Å; I342-T346 PolarHBondContact O-OG1 3.49Å
343S96Very high93.5Very high8 Ų838.3 Ų38.36%0.05618%0.183CC..Hα-helixtrans-60.4-48.2177.8-179.80000111.3F322 V339 V340 T346 G347F322-S343 VanDerWaalsContact CD1-O 3.3Å; F322-S343 WeakPolarHBondContact CD1-O 3.42Å; F322-S343 PolarHBondContact O-OG 3.18Å; V339-S343 WeakPolarHBondContact O-CB 3.35Å; V339-S343 PolarHBondContact O-N 2.7Å; V340-S343 PolarHBondContact O-N 2.82Å; S343-T346 PolarHBondContact O-N 2.8Å; S343-G347 PolarHBondContact O-N 2.78Å
344L94.1Very high93.2Very high8 Ų827.5 Ų27.54%0.04214%0.142CC..Hα-helixtrans-65.2-43.3-179.5-69.7174.6000112.5L257 F322 V340 A341 T346 G347 I348 V385L257-L344 HydrophobicContact CD1-CD1 4.09Å; L257-L344 HydrophobicContact CD1-CD2 4.27Å; F322-L344 HydrophobicContact CD1-CD2 4.39Å; F322-L344 HydrophobicContact CE1-CD2 3.93Å; V340-L344 HydrophobicContact CG1-CD1 3.76Å; V340-L344 HydrophobicContact CG1-CG 4.35Å; V340-L344 WeakPolarHBondContact O-CB 3.25Å; V340-L344 VanDerWaalsContact O-CG 3.3Å; V340-L344 WeakPolarHBondContact O-CG 3.08Å; V340-L344 PolarHBondContact O-N 3.1Å; A341-L344 PolarHBondContact O-N 2.93Å; L344-T346 VanDerWaalsContact C-N 3.31Å; L344-T346 PolarHBondContact O-N 2.91Å; L344-G347 PolarHBondContact O-N 3.1Å; L344-I348 HydrophobicContact CB-CD1 4.29Å; L344-I348 HydrophobicContact CD2-CD1 4.24Å; L344-I348 VanDerWaalsContact O-CB 3.31Å; L344-I348 WeakPolarHBondContact O-CB 3.45Å; L344-I348 WeakPolarHBondContact O-CG1 3.12Å; L344-I348 PolarHBondContact O-N 3.05Å; L344-V385 HydrophobicContact CD2-CG1 4.27Å; L344-V385 HydrophobicContact CD2-CG2 3.88Å
345E91.7Very high93Very high2 Ų226.7 Ų26.71%0.00914%0.139CC..Hα-helixtrans-62.6-39.9176.5-168.768.2-176.400111.5Q210 S250 M267 T268 A341Q210-E345 PolarHBondContact OE1-O 3.32Å; S250-E345 VanDerWaalsContact CB-OE2 3.29Å; S250-E345 WeakPolarHBondContact CB-OE2 3.35Å; S250-E345 PolarHBondContact OG-OE2 3.05Å; M267-E345 HydrophobicContact CB-CG 3.93Å; M267-E345 HydrophobicContact CE-CB 3.72Å; M267-E345 HydrophobicContact CE-CG 4.03Å; M267-E345 HydrophobicContact SD-CG 4.46Å; T268-E345 VanDerWaalsContact CA-OE1 3.32Å; T268-E345 WeakPolarHBondContact CA-OE1 3.47Å; T268-E345 PolarHBondContact N-OE1 3.08Å; T268-E345 PolarHBondContact OG1-OE1 2.83Å; T268-E345 PolarHBondContact OG1-OE2 3.4Å; A341-E345 WeakPolarHBondContact O-CB 3.3Å; A341-E345 PolarHBondContact O-N 2.8Å
346T92.8Very high92.8Very high1 Ų124 Ų241%0.00612%0.121CC..Hα-helixtrans-70.7-37.9179.2-51.40000112.3C209 L213 M214 G321 I342 S343 L344 Q349C209-T346 HydrophobicContact CB-CG2 3.69Å; C209-T346 WeakPolarHBondContact CB-OG1 3.36Å; L213-T346 HydrophobicContact CD2-CG2 4.49Å; M214-T346 HydrophobicContact CG-CG2 3.71Å; M214-T346 WeakPolarHBondContact CG-O 3.4Å; M214-T346 HydrophobicContact SD-CG2 4.09Å; G321-T346 WeakPolarHBondContact O-CB 3.31Å; G321-T346 WeakPolarHBondContact O-CG2 3.49Å; I342-T346 WeakPolarHBondContact O-CB 3.19Å; I342-T346 PolarHBondContact O-N 2.86Å; I342-T346 PolarHBondContact O-OG1 3.49Å; S343-T346 PolarHBondContact O-N 2.8Å; L344-T346 VanDerWaalsContact C-N 3.31Å; L344-T346 PolarHBondContact O-N 2.91Å; T346-Q349 PolarHBondContact O-NE2 2.85Å
347G93.2Very high92.4Very high0 Ų017.9 Ų17.90%010%0.103CC..Hα-helixtrans-87.3-28.1-174.900000114.9P318 S343 L344P318-G347 WeakPolarHBondContact CB-O 3.21Å; S343-G347 PolarHBondContact O-N 2.78Å; L344-G347 PolarHBondContact O-N 3.1Å
348I92.4Very high92.2Very high7 Ų716.1 Ų16.14%0.0369%0.089CC..  trans-89.5117.2179.9-64.5165000109.1G246 A249 Y253 F322 L344 T381G246-I348 VanDerWaalsContact CA-O 3.25Å; G246-I348 WeakPolarHBondContact CA-O 3.32Å; A249-I348 HydrophobicContact CB-CG2 4.2Å; Y253-I348 HydrophobicContact CD2-CD1 3.69Å; Y253-I348 HydrophobicContact CE2-CD1 4.42Å; F322-I348 HydrophobicContact CE1-CD1 4.33Å; F322-I348 HydrophobicContact CE1-CG1 3.78Å; F322-I348 HydrophobicContact CZ-CG1 3.72Å; L344-I348 HydrophobicContact CB-CD1 4.29Å; L344-I348 HydrophobicContact CD2-CD1 4.24Å; L344-I348 VanDerWaalsContact O-CB 3.31Å; L344-I348 WeakPolarHBondContact O-CB 3.45Å; L344-I348 WeakPolarHBondContact O-CG1 3.12Å; L344-I348 PolarHBondContact O-N 3.05Å; I348-T381 HydrophobicContact CB-CG2 4.23Å; I348-T381 HydrophobicContact CG1-CG2 3.7Å; I348-T381 HydrophobicContact CG2-CG2 4.34Å
349Q87.9Confident91.9Very high10 Ų1016.2 Ų16.25%0.0479%0.088CC..  trans-104.2150.5178.2-53.3-57.9-64.900111Q210 M214 A241 G242 S244 T346 T351Q210-Q349 VanDerWaalsContact NE2-OE1 3.14Å; M214-Q349 VanDerWaalsContact CE-CD 3.48Å; M214-Q349 HydrophobicContact CE-CG 4.04Å; M214-Q349 VanDerWaalsContact CE-NE2 3.33Å; A241-Q349 WeakPolarHBondContact O-CB 3.46Å; A241-Q349 WeakPolarHBondContact O-CG 3.25Å; G242-Q349 PolarHBondContact O-OE1 3Å; G242-Q349 VanDerWaalsContact O-OE1 3.13Å; S244-Q349 PolarHBondContact O-OE1 3.13Å; T346-Q349 PolarHBondContact O-NE2 2.85Å; Q349-T351 PolarHBondContact O-N 2.9Å
350N88.1Confident91.5Very high22 Ų2221.8 Ų21.812%0.11812%0.117CC..  trans-80.483.6170.1-168.3-23.5000111.1S244 P245 G352 I353 A354S244-N350 WeakPolarHBondContact CB-O 3.49Å; P245-N350 WeakPolarHBondContact O-CB 3.43Å; P245-N350 PolarHBondContact O-N 3.05Å; N350-G352 PolarHBondContact O-N 2.79Å; N350-G352 PolarHBondContact OD1-N 3.36Å; N350-I353 HydrophobicContact CB-CD1 4.44Å; N350-I353 WeakPolarHBondContact ND2-CD1 3.39Å; N350-I353 PolarHBondContact O-N 2.83Å; N350-I353 PolarHBondContact OD1-N 3.34Å; N350-A354 PolarHBondContact O-N 2.88Å
351T90.6Very high91.1Very high25 Ų2523.4 Ų23.415%0.15313%0.13CC..Hα-helixtrans-66.5-24.8-177.257.20000113.4Q349 A354 I355 P374 V377 A378Q349-T351 PolarHBondContact O-N 2.9Å; T351-A354 WeakPolarHBondContact O-CB 3.38Å; T351-A354 PolarHBondContact O-N 2.86Å; T351-I355 VanDerWaalsContact O-CG1 3.26Å; T351-I355 WeakPolarHBondContact O-CG1 3.44Å; T351-I355 PolarHBondContact O-N 3.26Å; T351-P374 WeakPolarHBondContact CB-O 3.46Å; T351-P374 HydrophobicContact CG2-CB 4.44Å; T351-P374 VanDerWaalsContact CG2-O 3.25Å; T351-P374 WeakPolarHBondContact CG2-O 2.98Å; T351-V377 HydrophobicContact CG2-CB 4.36Å; T351-V377 HydrophobicContact CG2-CG1 4.1Å; T351-A378 HydrophobicContact CG2-CB 3.91Å
352G89.9Confident90.9Very high5 Ų526.8 Ų26.85%0.05215%0.145CC..Hα-helixtrans-62.9-44.4175.900000112.3L177 N350 A354 I355 V356L177-G352 VanDerWaalsContact CD1-C 3.46Å; N350-G352 PolarHBondContact O-N 2.79Å; N350-G352 PolarHBondContact OD1-N 3.36Å; G352-A354 VanDerWaalsContact C-N 3.35Å; G352-I355 PolarHBondContact O-N 2.76Å; G352-V356 WeakPolarHBondContact O-CG2 3.49Å; G352-V356 PolarHBondContact O-N 3.44Å
353I87.6Confident90.6Very high46 Ų4631.1 Ų31.124%0.23617%0.173CC..Hα-helixtrans-67.2-39.2176.8-66.4178.6000110.9L177 M272 N350 I355 V356 M357L177-I353 HydrophobicContact CD1-CG1 4.17Å; M272-I353 HydrophobicContact CE-CD1 3.06Å; M272-I353 HydrophobicContact SD-CD1 3.9Å; N350-I353 HydrophobicContact CB-CD1 4.44Å; N350-I353 WeakPolarHBondContact ND2-CD1 3.39Å; N350-I353 PolarHBondContact O-N 2.83Å; N350-I353 PolarHBondContact OD1-N 3.34Å; I353-I355 VanDerWaalsContact C-N 3.31Å; I353-I355 PolarHBondContact O-N 2.95Å; I353-V356 PolarHBondContact O-N 2.75Å; I353-M357 VanDerWaalsContact O-CB 3.3Å; I353-M357 WeakPolarHBondContact O-CB 3.5Å; I353-M357 PolarHBondContact O-N 2.87Å
354A91Very high90.3Very high0 Ų032.3 Ų32.30%018%0.177CC..Hα-helixtrans-56.7-46.1174.300000111.7T240 S244 N350 T351 G352 M357 L358 P374T240-A354 HydrophobicContact CG2-CB 4.15Å; S244-A354 VanDerWaalsContact OG-CB 3.32Å; S244-A354 WeakPolarHBondContact OG-CB 3.34Å; N350-A354 PolarHBondContact O-N 2.88Å; T351-A354 WeakPolarHBondContact O-CB 3.38Å; T351-A354 PolarHBondContact O-N 2.86Å; G352-A354 VanDerWaalsContact C-N 3.35Å; A354-M357 PolarHBondContact O-N 2.76Å; A354-L358 WeakPolarHBondContact O-CB 2.99Å; A354-L358 WeakPolarHBondContact O-CD1 3.36Å; A354-L358 WeakPolarHBondContact O-CG 3.45Å; A354-L358 PolarHBondContact O-N 2.82Å; A354-P374 HydrophobicContact CB-CB 3.95Å; A354-P374 HydrophobicContact CB-CG 3.68Å
355I92.2Very high90.1Very high14 Ų1432 Ų327%0.07218%0.175CC..Hα-helixtrans-62.5-50.7178.8-67.6163.6000110.6L173 T351 G352 I353 M357 L358 Q359 P374 V375L173-I355 HydrophobicContact CD2-CG2 4.34Å; T351-I355 VanDerWaalsContact O-CG1 3.26Å; T351-I355 WeakPolarHBondContact O-CG1 3.44Å; T351-I355 PolarHBondContact O-N 3.26Å; G352-I355 PolarHBondContact O-N 2.76Å; I353-I355 VanDerWaalsContact C-N 3.31Å; I353-I355 PolarHBondContact O-N 2.95Å; I355-M357 VanDerWaalsContact C-N 3.33Å; I355-M357 PolarHBondContact O-N 2.9Å; I355-L358 PolarHBondContact O-N 2.87Å; I355-Q359 HydrophobicContact CG2-CG 4.29Å; I355-Q359 WeakPolarHBondContact O-CB 3.16Å; I355-Q359 VanDerWaalsContact O-CG 3.25Å; I355-Q359 WeakPolarHBondContact O-CG 3.47Å; I355-Q359 PolarHBondContact O-N 2.92Å; I355-P374 HydrophobicContact CD1-CB 4.24Å; I355-P374 HydrophobicContact CG1-CB 3.67Å; I355-P374 HydrophobicContact CG1-CG 4.12Å; I355-V375 HydrophobicContact CD1-CG2 3.86Å
356V90.6Very high90.1Very high22 Ų2233.8 Ų33.813%0.13319%0.185CC..Hα-helixtrans-61-43.6-179.11730000110.9L173 S174 L177 G352 I353 Q359 L360L173-V356 HydrophobicContact CD2-CG2 4.12Å; L173-V356 HydrophobicContact CG-CG2 4.28Å; S174-V356 WeakPolarHBondContact OG-CG1 3.35Å; S174-V356 WeakPolarHBondContact OG-CG2 2.98Å; L177-V356 HydrophobicContact CD1-CG2 4.25Å; G352-V356 WeakPolarHBondContact O-CG2 3.49Å; G352-V356 PolarHBondContact O-N 3.44Å; I353-V356 PolarHBondContact O-N 2.75Å; V356-Q359 PolarHBondContact O-N 2.91Å; V356-L360 HydrophobicContact CG1-CD1 3.71Å; V356-L360 HydrophobicContact CG1-CG 4.35Å; V356-L360 WeakPolarHBondContact O-CB 3.44Å; V356-L360 VanDerWaalsContact O-CG 3.28Å; V356-L360 WeakPolarHBondContact O-CG 3.25Å; V356-L360 PolarHBondContact O-N 2.89Å
357M87.2Confident90.1Very high96 Ų9633.8 Ų33.847%0.47319%0.185SC..Hα-helixtrans-59.6-50.7176.1-177.5-166.1174.700111.4T240 I353 A354 I355 Q359 L360 S361T240-M357 HydrophobicContact CG2-SD 3.59Å; T240-M357 VanDerWaalsContact CG2-SD 3.59Å; I353-M357 VanDerWaalsContact O-CB 3.3Å; I353-M357 WeakPolarHBondContact O-CB 3.5Å; I353-M357 PolarHBondContact O-N 2.87Å; A354-M357 PolarHBondContact O-N 2.76Å; I355-M357 VanDerWaalsContact C-N 3.33Å; I355-M357 PolarHBondContact O-N 2.9Å; M357-Q359 VanDerWaalsContact C-N 3.3Å; M357-Q359 PolarHBondContact O-N 2.81Å; M357-L360 PolarHBondContact O-N 2.8Å; M357-S361 WeakPolarHBondContact O-CB 3.44Å; M357-S361 PolarHBondContact O-N 2.81Å; M357-S361 PolarHBondContact O-OG 2.95Å
358L91.9Very high90Very high0 Ų033.9 Ų33.90%019%0.185CC..Hα-helixtrans-61.1-40.4-179-72167.3000112L236 T240 A354 I355 F362 S367 A370 P374L236-L358 HydrophobicContact CD2-CD2 4.3Å; L236-L358 HydrophobicContact CG-CD2 4.06Å; T240-L358 HydrophobicContact CG2-CD1 4.35Å; T240-L358 HydrophobicContact CG2-CD2 4.16Å; T240-L358 HydrophobicContact CG2-CG 3.97Å; A354-L358 WeakPolarHBondContact O-CB 2.99Å; A354-L358 WeakPolarHBondContact O-CD1 3.36Å; A354-L358 WeakPolarHBondContact O-CG 3.45Å; A354-L358 PolarHBondContact O-N 2.82Å; I355-L358 PolarHBondContact O-N 2.87Å; L358-F362 HydrophobicContact CD2-CD2 4.08Å; L358-F362 HydrophobicContact CD2-CE2 4.08Å; L358-F362 PolarHBondContact O-N 3.47Å; L358-S367 WeakPolarHBondContact O-CB 3.1Å; L358-A370 HydrophobicContact CD1-CB 4.06Å; L358-A370 HydrophobicContact CD2-CB 3.86Å; L358-A370 HydrophobicContact CG-CB 4.37Å; L358-P374 HydrophobicContact CD1-CG 3.78Å
359Q90.5Very high90.1Very high24 Ų2434.5 Ų34.511%0.11219%0.189CC..Hα-helixtrans-67.9-34.8179-73.2-69.1-20.500113.3I170 I355 V356 M357 S367 D368 S371I170-Q359 HydrophobicContact CD1-CB 3.9Å; I170-Q359 HydrophobicContact CD1-CG 3.67Å; I170-Q359 HydrophobicContact CG1-CB 4.5Å; I170-Q359 HydrophobicContact CG1-CG 4.21Å; I355-Q359 HydrophobicContact CG2-CG 4.29Å; I355-Q359 WeakPolarHBondContact O-CB 3.16Å; I355-Q359 VanDerWaalsContact O-CG 3.25Å; I355-Q359 WeakPolarHBondContact O-CG 3.47Å; I355-Q359 PolarHBondContact O-N 2.92Å; V356-Q359 PolarHBondContact O-N 2.91Å; M357-Q359 VanDerWaalsContact C-N 3.3Å; M357-Q359 PolarHBondContact O-N 2.81Å; Q359-S367 PolarHBondContact NE2-O 2.72Å; Q359-D368 PolarHBondContact NE2-OD1 3.11Å; Q359-D368 PolarHBondContact OE1-OD1 3.28Å; Q359-S371 PolarHBondContact NE2-OG 2.71Å
360L88.7Confident90.4Very high132 Ų13234 Ų3469%0.69119%0.187SC*.Hα-helixtrans-88.2-24.5179.9-65177.6000113.6V356 M357V356-L360 HydrophobicContact CG1-CD1 3.71Å; V356-L360 HydrophobicContact CG1-CG 4.35Å; V356-L360 WeakPolarHBondContact O-CB 3.44Å; V356-L360 VanDerWaalsContact O-CG 3.28Å; V356-L360 WeakPolarHBondContact O-CG 3.25Å; V356-L360 PolarHBondContact O-N 2.89Å; M357-L360 PolarHBondContact O-N 2.8Å
361S87.2Confident90.6Very high70 Ų7033 Ų3349%0.4918%0.181SC..Hα-helixtrans-93.7-23.7-174.7-63.10000114.7M357M357-S361 WeakPolarHBondContact O-CB 3.44Å; M357-S361 PolarHBondContact O-N 2.81Å; M357-S361 PolarHBondContact O-OG 2.95Å
362F89Confident90.8Very high71 Ų7131.8 Ų31.831%0.31117%0.174SC..SBendtrans-119.8144.5-173.1-65.6-82.7000112.8L236 L358 S367L236-F362 HydrophobicContact CD1-CE2 4.26Å; L236-F362 HydrophobicContact CD1-CZ 3.88Å; L236-F362 HydrophobicContact CD2-CD1 3.79Å; L236-F362 HydrophobicContact CD2-CD2 3.83Å; L236-F362 HydrophobicContact CD2-CE1 3.39Å; L236-F362 HydrophobicContact CD2-CE2 3.45Å; L236-F362 VanDerWaalsContact CD2-CE2 3.45Å; L236-F362 HydrophobicContact CD2-CG 4.01Å; L236-F362 HydrophobicContact CD2-CZ 3.21Å; L236-F362 HydrophobicContact CG-CE2 4.19Å; L236-F362 HydrophobicContact CG-CZ 4.07Å; L358-F362 HydrophobicContact CD2-CD2 4.08Å; L358-F362 HydrophobicContact CD2-CE2 4.08Å; L358-F362 PolarHBondContact O-N 3.47Å; F362-S367 VanDerWaalsContact O-CB 3.32Å; F362-S367 WeakPolarHBondContact O-CB 3.49Å; F362-S367 PolarHBondContact O-OG 2.88Å
363P89.7Confident91.1Very high91 Ų9131.6 Ų31.659%0.59117%0.171SC*.  trans-69.5154.8173.730.6-34.6000110.8D366 S367P363-D366 PolarHBondContact O-N 2.68Å; P363-S367 PolarHBondContact O-N 3.06Å
364K89.1Confident91.4Very high32 Ų3229.4 Ų29.414%0.13916%0.16CC..THydrogen-bonded Turntrans-71.2146.6169.7-67.5-176.8180172.70110.3T159 E162 Y167 S367T159-K364 HydrophobicContact CG2-CB 3.55Å; E162-K364 IonicContact OE1-NZ 4Å; E162-K364 PolarHBondContact OE1-NZ 3.29Å; E162-K364 IonicContact OE2-NZ 3.07Å; E162-K364 PolarHBondContact OE2-NZ 2.8Å; Y167-K364 VanDerWaalsContact CZ-NZ 3.34Å; Y167-K364 PolarHBondContact OH-NZ 3.39Å; K364-S367 WeakPolarHBondContact CG-OG 3.37Å
365P91.2Very high91.5Very high2 Ų231.3 Ų31.31%0.01317%0.172CC..THydrogen-bonded Turncis-86.5-0.7434.4-36.2000115V158 T159 S367 D368 I369V158-P365 VanDerWaalsContact O-CB 3.28Å; V158-P365 WeakPolarHBondContact O-CB 3.4Å; V158-P365 WeakPolarHBondContact O-CG 3.4Å; T159-P365 HydrophobicContact CG2-CB 4.24Å; P365-S367 PolarHBondContact O-N 2.93Å; P365-D368 PolarHBondContact O-N 2.93Å; P365-I369 HydrophobicContact CB-CD1 4.16Å; P365-I369 HydrophobicContact CG-CD1 4.37Å; P365-I369 VanDerWaalsContact O-CG1 3.31Å; P365-I369 WeakPolarHBondContact O-CG1 3.32Å; P365-I369 PolarHBondContact O-N 2.89Å
366D92.3Very high91.6Very high40 Ų4030.7 Ų30.721%0.21417%0.168CC..Hα-helixtrans-63.7-38.2-173-72.8-31.3000112.9H131 A233 P363 I369 A370H131-D366 IonicContact CE1-OD1 3.38Å; H131-D366 PolarHBondContact CE1-OD1 3.26Å; H131-D366 IonicContact CE1-OD2 2.91Å; H131-D366 PolarHBondContact CE1-OD2 3.45Å; H131-D366 IonicContact ND1-OD1 3.48Å; H131-D366 PolarHBondContact ND1-OD1 2.74Å; A233-D366 HydrophobicContact CB-CB 4.18Å; P363-D366 PolarHBondContact O-N 2.68Å; D366-I369 PolarHBondContact O-N 2.66Å; D366-A370 WeakPolarHBondContact O-CB 2.89Å; D366-A370 PolarHBondContact O-N 3.43Å
367S91.2Very high91.8Very high1 Ų129.6 Ų29.61%0.00716%0.162CC..Hα-helixtrans-58.9-45.9173.947.10000112.9L358 Q359 F362 P363 K364 P365 S371L358-S367 WeakPolarHBondContact O-CB 3.1Å; Q359-S367 PolarHBondContact NE2-O 2.72Å; F362-S367 VanDerWaalsContact O-CB 3.32Å; F362-S367 WeakPolarHBondContact O-CB 3.49Å; F362-S367 PolarHBondContact O-OG 2.88Å; P363-S367 PolarHBondContact O-N 3.06Å; K364-S367 WeakPolarHBondContact CG-OG 3.37Å; P365-S367 PolarHBondContact O-N 2.93Å; S367-S371 VanDerWaalsContact O-CB 3.28Å; S367-S371 WeakPolarHBondContact O-CB 3.48Å; S367-S371 PolarHBondContact O-N 2.75Å; S367-S371 PolarHBondContact O-OG 2.83Å
368D92.3Very high92.1Very high1 Ų126.9 Ų26.91%0.00515%0.154CC..Hα-helixtrans-66-38179.1-79.6-11.4000112.1R160 Y301 Q359 P365R160-D368 WeakPolarHBondContact CD-OD2 3.18Å; R160-D368 IonicContact CZ-OD2 3.26Å; R160-D368 IonicContact NE-OD2 2.6Å; R160-D368 PolarHBondContact NE-OD2 2.8Å; Y301-D368 HydrophobicContact CE2-CB 4.16Å; Y301-D368 PolarHBondContact OH-OD1 3.08Å; Q359-D368 PolarHBondContact NE2-OD1 3.11Å; Q359-D368 PolarHBondContact OE1-OD1 3.28Å; P365-D368 PolarHBondContact O-N 2.93Å
369I93.4Very high92.1Very high21 Ų2131.6 Ų31.611%0.10818%0.179CC..Hα-helixtrans-71-48.8177.2-65.1164.9000110.6L129 A233 M234 P365 D366 S371 V372L129-I369 HydrophobicContact CD1-CD1 3.99Å; L129-I369 HydrophobicContact CD1-CG1 3.36Å; A233-I369 HydrophobicContact CB-CB 4.15Å; A233-I369 HydrophobicContact CB-CG2 3.85Å; M234-I369 HydrophobicContact CG-CG2 3.71Å; M234-I369 HydrophobicContact SD-CG2 3.52Å; M234-I369 VanDerWaalsContact SD-CG2 3.52Å; P365-I369 HydrophobicContact CB-CD1 4.16Å; P365-I369 HydrophobicContact CG-CD1 4.37Å; P365-I369 VanDerWaalsContact O-CG1 3.31Å; P365-I369 WeakPolarHBondContact O-CG1 3.32Å; P365-I369 PolarHBondContact O-N 2.89Å; D366-I369 PolarHBondContact O-N 2.66Å; I369-S371 VanDerWaalsContact C-N 3.28Å; I369-S371 PolarHBondContact O-N 3.36Å; I369-V372 VanDerWaalsContact O-CB 3.28Å; I369-V372 WeakPolarHBondContact O-CB 3.43Å; I369-V372 WeakPolarHBondContact O-CG2 3.36Å; I369-V372 PolarHBondContact O-N 3.4Å; I369-V372 VanDerWaalsContact O-N 3.17Å
370A94.3Very high92.3Very high0 Ų032.6 Ų32.60%018%0.183CC..Hα-helixtrans-61.8-38.2-178.800000111.5A233 G237 L358 D366 V372 M373 P374A233-A370 WeakPolarHBondContact O-CA 3.4Å; A233-A370 WeakPolarHBondContact O-CB 3.49Å; G237-A370 VanDerWaalsContact CA-O 3.31Å; G237-A370 WeakPolarHBondContact CA-O 3.47Å; L358-A370 HydrophobicContact CD1-CB 4.06Å; L358-A370 HydrophobicContact CD2-CB 3.86Å; L358-A370 HydrophobicContact CG-CB 4.37Å; D366-A370 WeakPolarHBondContact O-CB 2.89Å; D366-A370 PolarHBondContact O-N 3.43Å; A370-V372 PolarHBondContact O-N 2.78Å; A370-V372 VanDerWaalsContact O-N 3.12Å; A370-M373 PolarHBondContact O-N 2.76Å; A370-M373 VanDerWaalsContact O-N 3.09Å; A370-P374 VanDerWaalsContact O-CD 3.24Å; A370-P374 WeakPolarHBondContact O-CD 3.45Å
371S93.3Very high92.6Very high0 Ų026.9 Ų26.90%015%0.154CC..THydrogen-bonded Turntrans-63-17179.3-61.40000114Q359 S367 I369 M373 P374Q359-S371 PolarHBondContact NE2-OG 2.71Å; S367-S371 VanDerWaalsContact O-CB 3.28Å; S367-S371 WeakPolarHBondContact O-CB 3.48Å; S367-S371 PolarHBondContact O-N 2.75Å; S367-S371 PolarHBondContact O-OG 2.83Å; I369-S371 VanDerWaalsContact C-N 3.28Å; I369-S371 PolarHBondContact O-N 3.36Å; S371-M373 VanDerWaalsContact C-N 3.28Å; S371-M373 PolarHBondContact O-N 3.36Å; S371-P374 WeakPolarHBondContact O-CD 3.4Å
372V94.7Very high92.8Very high0 Ų025.4 Ų25.40%014%0.143CC..Hα-helixtrans-63.8-35.3174.1-179.10000111.1M234 M302 V305 M306 I369 A370 V375 I376M234-V372 HydrophobicContact CE-CG1 4.49Å; M234-V372 HydrophobicContact SD-CB 4.39Å; M302-V372 HydrophobicContact CB-CG2 4.07Å; M302-V372 HydrophobicContact CG-CG2 4Å; V305-V372 HydrophobicContact CB-CG2 4.03Å; V305-V372 HydrophobicContact CG1-CG2 4.02Å; V305-V372 HydrophobicContact CG2-CG2 4.44Å; M306-V372 HydrophobicContact CE-CG1 4.44Å; M306-V372 HydrophobicContact CG-CG1 3.96Å; I369-V372 VanDerWaalsContact O-CB 3.28Å; I369-V372 WeakPolarHBondContact O-CB 3.43Å; I369-V372 WeakPolarHBondContact O-CG2 3.36Å; I369-V372 PolarHBondContact O-N 3.4Å; I369-V372 VanDerWaalsContact O-N 3.17Å; A370-V372 PolarHBondContact O-N 2.78Å; A370-V372 VanDerWaalsContact O-N 3.12Å; V372-V375 PolarHBondContact O-N 2.01Å; V372-I376 HydrophobicContact CG1-CD1 3.91Å; V372-I376 HydrophobicContact CG1-CG1 4.28Å; V372-I376 WeakPolarHBondContact O-CG1 3.45Å; V372-I376 PolarHBondContact O-N 2.95Å
373M95.3Very high93Very high0 Ų024.9 Ų24.90%015%0.145CC..Hα-helixtrans-65.5-50-176.7-76.8-48.4111.600113.7F226 M234 V238 A310 A370 S371 V375 I376 V377F226-M373 HydrophobicContact CE2-SD 4.01Å; F226-M373 HydrophobicContact CZ-CE 4.03Å; F226-M373 HydrophobicContact CZ-CG 4.48Å; F226-M373 HydrophobicContact CZ-SD 3.57Å; F226-M373 VanDerWaalsContact CZ-SD 3.57Å; M234-M373 HydrophobicContact CB-CE 4.2Å; M234-M373 HydrophobicContact CB-CG 4.44Å; M234-M373 HydrophobicContact CE-CE 3.18Å; M234-M373 HydrophobicContact CG-CE 4.25Å; M234-M373 WeakPolarHBondContact O-CG 3.47Å; M234-M373 HydrophobicContact SD-CE 3.25Å; M234-M373 WeakPolarHBondContact SD-CE 3.11Å; M234-M373 HydrophobicContact SD-CG 4.47Å; V238-M373 HydrophobicContact CB-CB 4.19Å; V238-M373 HydrophobicContact CB-CG 3.93Å; V238-M373 HydrophobicContact CB-SD 4.43Å; A310-M373 HydrophobicContact CB-CE 3.4Å; A310-M373 VanDerWaalsContact CB-CE 3.4Å; A310-M373 HydrophobicContact CB-SD 4.23Å; A370-M373 PolarHBondContact O-N 2.76Å; A370-M373 VanDerWaalsContact O-N 3.09Å; S371-M373 VanDerWaalsContact C-N 3.28Å; S371-M373 PolarHBondContact O-N 3.36Å; M373-V375 PolarHBondContact O-N 2.84Å; M373-I376 HydrophobicContact CE-CD1 3.75Å; M373-I376 PolarHBondContact O-N 2.91Å; M373-I376 VanDerWaalsContact O-N 3.1Å; M373-I376 HydrophobicContact SD-CD1 4.24Å; M373-V377 WeakPolarHBondContact O-CG2 3.42Å; M373-V377 PolarHBondContact O-N 3.17Å
374P94Very high93.1Very high0 Ų021.9 Ų21.90%013%0.126CC..Hα-helixtrans-53.1-36.3172.3-28.432.5000114A241 T351 A354 I355 L358 A370 S371 V377 A378A241-P374 HydrophobicContact CB-CB 4.34Å; A241-P374 HydrophobicContact CB-CG 4.09Å; T351-P374 WeakPolarHBondContact CB-O 3.46Å; T351-P374 HydrophobicContact CG2-CB 4.44Å; T351-P374 VanDerWaalsContact CG2-O 3.25Å; T351-P374 WeakPolarHBondContact CG2-O 2.98Å; A354-P374 HydrophobicContact CB-CB 3.95Å; A354-P374 HydrophobicContact CB-CG 3.68Å; I355-P374 HydrophobicContact CD1-CB 4.24Å; I355-P374 HydrophobicContact CG1-CB 3.67Å; I355-P374 HydrophobicContact CG1-CG 4.12Å; L358-P374 HydrophobicContact CD1-CG 3.78Å; A370-P374 VanDerWaalsContact O-CD 3.24Å; A370-P374 WeakPolarHBondContact O-CD 3.45Å; S371-P374 WeakPolarHBondContact O-CD 3.4Å; P374-V377 PolarHBondContact O-N 3.17Å; P374-A378 WeakPolarHBondContact O-CB 3.42Å; P374-A378 PolarHBondContact O-N 3.1Å
375V93.6Very high93.3Very high41 Ų4120.4 Ų20.425%0.24812%0.12CC..Hα-helixtrans-66.8-44177175.20000111.3M302 M306 I355 V372 M373 A378 L379M302-V375 HydrophobicContact SD-CB 4.45Å; M302-V375 HydrophobicContact SD-CG2 3.74Å; M306-V375 HydrophobicContact CE-CG1 4.1Å; I355-V375 HydrophobicContact CD1-CG2 3.86Å; V372-V375 PolarHBondContact O-N 2.01Å; M373-V375 PolarHBondContact O-N 2.84Å; V375-A378 WeakPolarHBondContact O-CB 3.45Å; V375-A378 PolarHBondContact O-N 3.43Å; V375-L379 PolarHBondContact O-N 3.08Å
376I95.3Very high93.4Very high0 Ų024.9 Ų24.90%014%0.143CC..Hα-helixtrans-63.8-43.8175.7-64.7172.5000111M306 A310 L311 V372 M373 A378 L379 F380M306-I376 HydrophobicContact CE-CD1 4.41Å; M306-I376 HydrophobicContact CE-CG1 3.59Å; M306-I376 HydrophobicContact CG-CD1 3.96Å; M306-I376 HydrophobicContact CG-CG1 4.14Å; M306-I376 HydrophobicContact SD-CD1 4.27Å; M306-I376 HydrophobicContact SD-CG1 3.86Å; A310-I376 HydrophobicContact CB-CD1 3.74Å; L311-I376 HydrophobicContact CD2-CD1 4.33Å; L311-I376 HydrophobicContact CD2-CG1 4.33Å; L311-I376 HydrophobicContact CD2-CG2 4.09Å; V372-I376 HydrophobicContact CG1-CD1 3.91Å; V372-I376 HydrophobicContact CG1-CG1 4.28Å; V372-I376 WeakPolarHBondContact O-CG1 3.45Å; V372-I376 PolarHBondContact O-N 2.95Å; M373-I376 HydrophobicContact CE-CD1 3.75Å; M373-I376 PolarHBondContact O-N 2.91Å; M373-I376 VanDerWaalsContact O-N 3.1Å; M373-I376 HydrophobicContact SD-CD1 4.24Å; I376-A378 VanDerWaalsContact C-N 3.32Å; I376-A378 PolarHBondContact O-N 3.2Å; I376-L379 WeakPolarHBondContact O-CB 3.48Å; I376-L379 PolarHBondContact O-N 2.98Å; I376-L379 VanDerWaalsContact O-N 3.13Å; I376-F380 HydrophobicContact CG2-CD2 3.74Å; I376-F380 HydrophobicContact CG2-CE2 3.71Å; I376-F380 WeakPolarHBondContact O-CD2 3.45Å; I376-F380 PolarHBondContact O-N 3.38Å; I376-F380 VanDerWaalsContact O-N 3.16Å
377V94.9Very high93.4Very high0 Ų027.5 Ų27.50%016%0.16CC..Hα-helixtrans-56.8-49.6175.4169.50000109.6A241 V317 P318 T351 M373 P374 L379 F380 T381A241-V377 HydrophobicContact CB-CB 4.5Å; A241-V377 HydrophobicContact CB-CG2 4.08Å; V317-V377 HydrophobicContact CB-CG2 4.34Å; P318-V377 HydrophobicContact CG-CG1 4.32Å; T351-V377 HydrophobicContact CG2-CB 4.36Å; T351-V377 HydrophobicContact CG2-CG1 4.1Å; M373-V377 WeakPolarHBondContact O-CG2 3.42Å; M373-V377 PolarHBondContact O-N 3.17Å; P374-V377 PolarHBondContact O-N 3.17Å; V377-L379 PolarHBondContact O-N 2.68Å; V377-F380 PolarHBondContact O-N 3.07Å; V377-F380 VanDerWaalsContact O-N 3.1Å; V377-T381 PolarHBondContact O-N 3.23Å; V377-T381 PolarHBondContact O-OG1 3.41Å
378A92.5Very high93.4Very high38 Ų3829.5 Ų29.531%0.31418%0.177SC..Hα-helixtrans-57.9-35177.200000113.1T351 P374 V375 I376 P382T351-A378 HydrophobicContact CG2-CB 3.91Å; P374-A378 WeakPolarHBondContact O-CB 3.42Å; P374-A378 PolarHBondContact O-N 3.1Å; V375-A378 WeakPolarHBondContact O-CB 3.45Å; V375-A378 PolarHBondContact O-N 3.43Å; I376-A378 VanDerWaalsContact C-N 3.32Å; I376-A378 PolarHBondContact O-N 3.2Å; A378-P382 WeakPolarHBondContact O-CD 3.38Å
379L92.8Very high93.4Very high100 Ų10030.9 Ų30.952%0.52418%0.183SC..Hα-helixtrans-66.8-38.3178.1-169.972000112V375 I376 V377V375-L379 PolarHBondContact O-N 3.08Å; I376-L379 WeakPolarHBondContact O-CB 3.48Å; I376-L379 PolarHBondContact O-N 2.98Å; I376-L379 VanDerWaalsContact O-N 3.13Å; V377-L379 PolarHBondContact O-N 2.68Å
380F94.4Very high93.4Very high44 Ų4433.1 Ų33.119%0.19321%0.205CC..Hα-helixtrans-92.4-16.7-177.2-71.7-65.2000114.4L311 L315 P318 I376 V377 V383 P384L311-F380 HydrophobicContact CB-CE2 4.21Å; L311-F380 HydrophobicContact CB-CZ 4.42Å; L311-F380 HydrophobicContact CD2-CE2 3.99Å; L311-F380 HydrophobicContact CD2-CZ 4.32Å; L311-F380 WeakPolarHBondContact O-CE2 3.03Å; L315-F380 HydrophobicContact CB-CB 4.33Å; L315-F380 HydrophobicContact CB-CD1 4.23Å; L315-F380 HydrophobicContact CB-CD2 3.85Å; L315-F380 HydrophobicContact CB-CE2 4.18Å; L315-F380 HydrophobicContact CB-CG 3.88Å; L315-F380 HydrophobicContact CD1-CD1 3.87Å; L315-F380 HydrophobicContact CD1-CE1 3.93Å; L315-F380 HydrophobicContact CD1-CG 4.37Å; L315-F380 HydrophobicContact CD1-CZ 4.45Å; L315-F380 HydrophobicContact CG-CD1 4.28Å; L315-F380 HydrophobicContact CG-CG 4.3Å; P318-F380 HydrophobicContact CG-CB 4.46Å; I376-F380 HydrophobicContact CG2-CD2 3.74Å; I376-F380 HydrophobicContact CG2-CE2 3.71Å; I376-F380 WeakPolarHBondContact O-CD2 3.45Å; I376-F380 PolarHBondContact O-N 3.38Å; I376-F380 VanDerWaalsContact O-N 3.16Å; V377-F380 PolarHBondContact O-N 3.07Å; V377-F380 VanDerWaalsContact O-N 3.1Å; F380-V383 PolarHBondContact O-N 3.43Å; F380-P384 VanDerWaalsContact O-CD 3.24Å; F380-P384 WeakPolarHBondContact O-CD 3.37Å
381T93.8Very high93.3Very high12 Ų1238.7 Ų38.77%0.07423%0.229CC..THydrogen-bonded Turntrans-58.6-43.6178.6-63.10000114.1F322 I348 V377 V383 P384F322-T381 HydrophobicContact CZ-CG2 4.09Å; I348-T381 HydrophobicContact CB-CG2 4.23Å; I348-T381 HydrophobicContact CG1-CG2 3.7Å; I348-T381 HydrophobicContact CG2-CG2 4.34Å; V377-T381 PolarHBondContact O-N 3.23Å; V377-T381 PolarHBondContact O-OG1 3.41Å; T381-V383 VanDerWaalsContact C-N 3.29Å; T381-V383 PolarHBondContact O-N 2.84Å; T381-P384 WeakPolarHBondContact O-CD 3.5Å
382P92.2Very high93.2Very high39 Ų3942.4 Ų42.425%0.25324%0.244SC..Hα-helixtrans-68.7-24.9-178.7-22.133.9000113.7A378 V385 L386A378-P382 WeakPolarHBondContact O-CD 3.38Å; P382-V385 PolarHBondContact O-N 3.44Å; P382-L386 HydrophobicContact CB-CD1 4.2Å; P382-L386 WeakPolarHBondContact O-CB 3.46Å; P382-L386 VanDerWaalsContact O-CG 3.28Å; P382-L386 WeakPolarHBondContact O-CG 3.4Å; P382-L386 PolarHBondContact O-N 2.98Å
383V93.6Very high93Very high61 Ų6146 Ų4637%0.3726%0.258SS..Hα-helixtrans-60.5-53-170176.70000112.4W319 F380 T381 V385 L386 V387W319-V383 HydrophobicContact CZ2-CG1 4.1Å; F380-V383 PolarHBondContact O-N 3.43Å; T381-V383 VanDerWaalsContact C-N 3.29Å; T381-V383 PolarHBondContact O-N 2.84Å; V383-V385 VanDerWaalsContact C-N 3.27Å; V383-V385 PolarHBondContact O-N 2.56Å; V383-L386 PolarHBondContact O-N 2.74Å; V383-V387 VanDerWaalsContact O-CG2 3.3Å; V383-V387 WeakPolarHBondContact O-CG2 3.5Å; V383-V387 PolarHBondContact O-N 3.18Å
384P91.3Very high92.9Very high27 Ų2746.9 Ų46.918%0.17527%0.266CS..Hα-helixtrans-57.9-39.1175.3-26.935.9000113.5W319 F322 F380 T381 V387 A388W319-P384 HydrophobicContact CD2-CG 3.85Å; W319-P384 VanDerWaalsContact CE2-CG 3.42Å; W319-P384 HydrophobicContact CG-CG 3.99Å; W319-P384 HydrophobicContact CZ2-CG 3.9Å; W319-P384 VanDerWaalsContact NE1-CG 3.25Å; F322-P384 HydrophobicContact CD2-CB 3.9Å; F322-P384 HydrophobicContact CD2-CG 3.89Å; F322-P384 HydrophobicContact CE2-CB 4Å; F322-P384 HydrophobicContact CE2-CG 3.88Å; F380-P384 VanDerWaalsContact O-CD 3.24Å; F380-P384 WeakPolarHBondContact O-CD 3.37Å; T381-P384 WeakPolarHBondContact O-CD 3.5Å; P384-V387 PolarHBondContact O-N 3.08Å; P384-A388 WeakPolarHBondContact O-CB 3.34Å; P384-A388 PolarHBondContact O-N 2.95Å
385V92.7Very high92.8Very high2 Ų255.2 Ų55.21%0.01230%0.298CS..Hα-helixtrans-69.3-44.3-176.6-173.40000110.6Y253 L257 F322 L344 P382 V383 V387 A388 M389Y253-V385 HydrophobicContact CD1-CB 4.4Å; Y253-V385 HydrophobicContact CD1-CG1 3.28Å; Y253-V385 HydrophobicContact CD2-CG1 4.11Å; Y253-V385 HydrophobicContact CE1-CB 4.45Å; Y253-V385 HydrophobicContact CE1-CG1 3.71Å; Y253-V385 HydrophobicContact CE2-CG1 4.47Å; Y253-V385 HydrophobicContact CG-CG1 3.5Å; Y253-V385 VanDerWaalsContact CG-CG1 3.5Å; L257-V385 HydrophobicContact CD1-CG1 4.06Å; F322-V385 HydrophobicContact CE1-CG2 4.04Å; F322-V385 HydrophobicContact CE2-CG2 4.35Å; F322-V385 HydrophobicContact CZ-CG2 3.67Å; L344-V385 HydrophobicContact CD2-CG1 4.27Å; L344-V385 HydrophobicContact CD2-CG2 3.88Å; P382-V385 PolarHBondContact O-N 3.44Å; V383-V385 VanDerWaalsContact C-N 3.27Å; V383-V385 PolarHBondContact O-N 2.56Å; V385-V387 VanDerWaalsContact C-N 3.35Å; V385-V387 PolarHBondContact O-N 3.06Å; V385-A388 PolarHBondContact O-N 2.94Å; V385-M389 HydrophobicContact CG1-SD 4.32Å; V385-M389 WeakPolarHBondContact O-CB 3.44Å; V385-M389 VanDerWaalsContact O-CG 3.28Å; V385-M389 WeakPolarHBondContact O-CG 3.26Å; V385-M389 PolarHBondContact O-N 2.77Å
386L93Very high92.5Very high96 Ų9655.4 Ų55.450%0.50330%0.297SS..Hα-helixtrans-64.3-38.9175.4-69.1175000111.9P382 V383 M389 A390P382-L386 HydrophobicContact CB-CD1 4.2Å; P382-L386 WeakPolarHBondContact O-CB 3.46Å; P382-L386 VanDerWaalsContact O-CG 3.28Å; P382-L386 WeakPolarHBondContact O-CG 3.4Å; P382-L386 PolarHBondContact O-N 2.98Å; V383-L386 PolarHBondContact O-N 2.74Å; L386-M389 HydrophobicContact CD2-SD 4.47Å; L386-M389 PolarHBondContact O-N 3.29Å; L386-A390 VanDerWaalsContact O-CB 3.32Å; L386-A390 WeakPolarHBondContact O-CB 3.32Å; L386-A390 PolarHBondContact O-N 2.88Å
387V92.6Very high92.1Very high95 Ų9558.5 Ų58.558%0.57631%0.309SS*.Hα-helixtrans-63.7-44.7173.6171.20000110.9V383 P384 V385 M389 A390 F391V383-V387 VanDerWaalsContact O-CG2 3.3Å; V383-V387 WeakPolarHBondContact O-CG2 3.5Å; V383-V387 PolarHBondContact O-N 3.18Å; P384-V387 PolarHBondContact O-N 3.08Å; V385-V387 VanDerWaalsContact C-N 3.35Å; V385-V387 PolarHBondContact O-N 3.06Å; V387-M389 VanDerWaalsContact C-N 3.35Å; V387-M389 PolarHBondContact O-N 2.81Å; V387-A390 PolarHBondContact O-N 3.34Å; V387-F391 WeakPolarHBondContact O-CB 3.26Å; V387-F391 PolarHBondContact O-N 3.05Å
388A91.5Very high91.8Very high43 Ų4364.1 Ų64.136%0.35534%0.338SS..Hα-helixtrans-61.9-42.117600000111.7L257 P384 V385 F391 Y392L257-A388 HydrophobicContact CD1-CB 4.45Å; L257-A388 HydrophobicContact CD2-CB 4.47Å; P384-A388 WeakPolarHBondContact O-CB 3.34Å; P384-A388 PolarHBondContact O-N 2.95Å; V385-A388 PolarHBondContact O-N 2.94Å; A388-F391 PolarHBondContact O-N 3.31Å; A388-Y392 VanDerWaalsContact O-CB 3.26Å; A388-Y392 WeakPolarHBondContact O-CB 3.36Å; A388-Y392 PolarHBondContact O-N 3.36Å
389M91.9Very high91.5Very high30 Ų3065.7 Ų65.715%0.14835%0.345CS..Hα-helixtrans-64.1-46.4175.3-74.1176.867.200111.9Y253 L256 L257 V385 L386 V387 F391 Y392 Y393Y253-M389 HydrophobicContact CD1-SD 4.02Å; Y253-M389 HydrophobicContact CE1-SD 4.16Å; L256-M389 HydrophobicContact CB-CE 4.08Å; L256-M389 HydrophobicContact CB-SD 4.44Å; L256-M389 HydrophobicContact CD1-CE 3.84Å; L256-M389 HydrophobicContact CD1-SD 4.31Å; L256-M389 HydrophobicContact CG-CE 4.4Å; L257-M389 HydrophobicContact CD1-CG 4.42Å; L257-M389 HydrophobicContact CD2-CB 4.34Å; L257-M389 HydrophobicContact CD2-CG 3.6Å; L257-M389 HydrophobicContact CG-CG 3.98Å; V385-M389 HydrophobicContact CG1-SD 4.32Å; V385-M389 WeakPolarHBondContact O-CB 3.44Å; V385-M389 VanDerWaalsContact O-CG 3.28Å; V385-M389 WeakPolarHBondContact O-CG 3.26Å; V385-M389 PolarHBondContact O-N 2.77Å; L386-M389 HydrophobicContact CD2-SD 4.47Å; L386-M389 PolarHBondContact O-N 3.29Å; V387-M389 VanDerWaalsContact C-N 3.35Å; V387-M389 PolarHBondContact O-N 2.81Å; M389-F391 VanDerWaalsContact C-N 3.25Å; M389-F391 PolarHBondContact O-N 2.72Å; M389-Y392 PolarHBondContact O-N 2.82Å; M389-Y393 HydrophobicContact CB-CD2 4.28Å; M389-Y393 HydrophobicContact CE-CE2 4.02Å; M389-Y393 WeakPolarHBondContact O-CB 3.46Å; M389-Y393 WeakPolarHBondContact O-CD2 3.5Å; M389-Y393 PolarHBondContact O-N 2.97Å
390A92.8Very high91.2Very high67 Ų6765 Ų6555%0.55434%0.338SS*.Hα-helixtrans-59.2-39.9177.500000111.3L386 V387 G394L386-A390 VanDerWaalsContact O-CB 3.32Å; L386-A390 WeakPolarHBondContact O-CB 3.32Å; L386-A390 PolarHBondContact O-N 2.88Å; V387-A390 PolarHBondContact O-N 3.34Å; A390-G394 WeakPolarHBondContact O-CA 3.24Å; A390-G394 PolarHBondContact O-N 2.83Å
391F92.5Very high90.7Very high118 Ų11867.1 Ų67.152%0.51835%0.351SS..Hα-helixtrans-68.6-45.3174.7-177.6-101.6000112.7V387 A388 M389 R395V387-F391 WeakPolarHBondContact O-CB 3.26Å; V387-F391 PolarHBondContact O-N 3.05Å; A388-F391 PolarHBondContact O-N 3.31Å; M389-F391 VanDerWaalsContact C-N 3.25Å; M389-F391 PolarHBondContact O-N 2.72Å; F391-R395 VanDerWaalsContact CE1-CZ 3.49Å; F391-R395 VanDerWaalsContact CE1-NH1 3.3Å; F391-R395 VanDerWaalsContact CZ-NH2 3.29Å; F391-R395 PolarHBondContact O-N 3.39Å
392Y90.9Very high90.2Very high77 Ų7774.8 Ų74.830%0.30238%0.379SS..Hα-helixtrans-61.6-58.2-179.8-178.1-112.5000111.7L257 D258 A388 M389 G394 R395 I396L257-Y392 HydrophobicContact CD2-CG 4.49Å; D258-Y392 WeakPolarHBondContact OD2-CE1 3.42Å; D258-Y392 VanDerWaalsContact OD2-CZ 3.28Å; D258-Y392 PolarHBondContact OD2-OH 2.9Å; A388-Y392 VanDerWaalsContact O-CB 3.26Å; A388-Y392 WeakPolarHBondContact O-CB 3.36Å; A388-Y392 PolarHBondContact O-N 3.36Å; M389-Y392 PolarHBondContact O-N 2.82Å; Y392-G394 VanDerWaalsContact C-N 3.33Å; Y392-G394 PolarHBondContact O-N 2.93Å; Y392-R395 PolarHBondContact O-N 2.92Å; Y392-I396 HydrophobicContact CD1-CD1 4.3Å; Y392-I396 HydrophobicContact CE1-CD1 3.87Å; Y392-I396 HydrophobicContact CE2-CD1 4.31Å; Y392-I396 PolarHBondContact O-N 3.46Å
393Y92.3Very high89.8Confident77 Ų7778.6 Ų78.630%0.30239%0.393SS..Hα-helixtrans-68.6-33.4177.5-71.6-66.9000111.9L256 M389 R395 I396 W397L256-Y393 PolarHBondContact O-OH 2.91Å; M389-Y393 HydrophobicContact CB-CD2 4.28Å; M389-Y393 HydrophobicContact CE-CE2 4.02Å; M389-Y393 WeakPolarHBondContact O-CB 3.46Å; M389-Y393 WeakPolarHBondContact O-CD2 3.5Å; M389-Y393 PolarHBondContact O-N 2.97Å; Y393-R395 VanDerWaalsContact C-N 3.32Å; Y393-R395 PolarHBondContact O-N 3.41Å; Y393-I396 PolarHBondContact O-N 3.03Å; Y393-I396 VanDerWaalsContact O-N 3.1Å; Y393-W397 WeakPolarHBondContact O-CB 3.28Å; Y393-W397 VanDerWaalsContact O-CD1 3.29Å; Y393-W397 PolarHBondContact O-N 3.49Å
394G91.9Very high89.1Confident17 Ų1783.5 Ų83.518%0.17541%0.406CS..Hα-helixtrans-55.8-45.8173.600000111.9A390 Y392 I396 W397 L398A390-G394 WeakPolarHBondContact O-CA 3.24Å; A390-G394 PolarHBondContact O-N 2.83Å; Y392-G394 VanDerWaalsContact C-N 3.33Å; Y392-G394 PolarHBondContact O-N 2.93Å; G394-I396 VanDerWaalsContact C-N 3.28Å; G394-I396 PolarHBondContact O-N 2.89Å; G394-W397 PolarHBondContact O-N 2.92Å; G394-L398 WeakPolarHBondContact O-CB 3.48Å; G394-L398 WeakPolarHBondContact O-CD1 3.22Å; G394-L398 WeakPolarHBondContact O-CG 3.28Å; G394-L398 PolarHBondContact O-N 2.95Å
395R91.2Very high88.5Confident175 Ų17589.9 Ų89.966%0.6643%0.427SS*.Hα-helixtrans-62.4-33.3176.2-83.8-170.8170159.6-3.7114F391 Y392 Y393 P399F391-R395 VanDerWaalsContact CE1-CZ 3.49Å; F391-R395 VanDerWaalsContact CE1-NH1 3.3Å; F391-R395 VanDerWaalsContact CZ-NH2 3.29Å; F391-R395 PolarHBondContact O-N 3.39Å; Y392-R395 PolarHBondContact O-N 2.92Å; Y393-R395 VanDerWaalsContact C-N 3.32Å; Y393-R395 PolarHBondContact O-N 3.41Å; R395-P399 VanDerWaalsContact O-CD 3.23Å; R395-P399 WeakPolarHBondContact O-CD 3.48Å; R395-P399 WeakPolarHBondContact O-CG 3.35Å
396I88.8Confident87.6Confident46 Ų4696.3 Ų96.324%0.23645%0.454CS..Hα-helixtrans-78.4-43.7-179.5-63.2169.4000110.8Y392 Y393 G394Y392-I396 HydrophobicContact CD1-CD1 4.3Å; Y392-I396 HydrophobicContact CE1-CD1 3.87Å; Y392-I396 HydrophobicContact CE2-CD1 4.31Å; Y392-I396 PolarHBondContact O-N 3.46Å; Y393-I396 PolarHBondContact O-N 3.03Å; Y393-I396 VanDerWaalsContact O-N 3.1Å; G394-I396 VanDerWaalsContact C-N 3.28Å; G394-I396 PolarHBondContact O-N 2.89Å
397W87.3Confident86.5Confident64 Ų6499.3 Ų99.324%0.24246%0.464CS..Hα-helixtrans-95.2-31.4-168.6-74.294.2000114Y393 G394 K400 L401 I427Y393-W397 WeakPolarHBondContact O-CB 3.28Å; Y393-W397 VanDerWaalsContact O-CD1 3.29Å; Y393-W397 PolarHBondContact O-N 3.49Å; G394-W397 PolarHBondContact O-N 2.92Å; W397-K400 PolarHBondContact O-N 3.43Å; W397-L401 HydrophobicContact CB-CD1 4.18Å; W397-L401 WeakPolarHBondContact O-CB 3.21Å; W397-L401 WeakPolarHBondContact O-CG 3.44Å; W397-L401 PolarHBondContact O-N 2.98Å; W397-I427 HydrophobicContact CE3-CG2 4.43Å; W397-I427 HydrophobicContact CH2-CB 4.11Å; W397-I427 HydrophobicContact CH2-CG2 3.29Å; W397-I427 HydrophobicContact CZ2-CG2 4.33Å; W397-I427 HydrophobicContact CZ3-CB 4.17Å; W397-I427 HydrophobicContact CZ3-CD1 3.95Å; W397-I427 HydrophobicContact CZ3-CG2 3.37Å
398L87.4Confident85Confident118 Ų11897.3 Ų97.362%0.61846%0.462SS*.Hα-helixtrans-57.9-43.1179.6-75.3163.6000112.8G394 R402G394-L398 WeakPolarHBondContact O-CB 3.48Å; G394-L398 WeakPolarHBondContact O-CD1 3.22Å; G394-L398 WeakPolarHBondContact O-CG 3.28Å; G394-L398 PolarHBondContact O-N 2.95Å; L398-R402 VanDerWaalsContact O-CB 3.24Å; L398-R402 WeakPolarHBondContact O-CB 3.3Å; L398-R402 PolarHBondContact O-N 2.89Å
399P86.6Confident83.3Confident71 Ų71103 Ų10346%0.46148%0.479SS..Hα-helixtrans-63.1-45.7175.2-22.434.8000112.4R395 L401 R402 E403R395-P399 VanDerWaalsContact O-CD 3.23Å; R395-P399 WeakPolarHBondContact O-CD 3.48Å; R395-P399 WeakPolarHBondContact O-CG 3.35Å; P399-L401 PolarHBondContact O-N 3.38Å; P399-R402 WeakPolarHBondContact O-CB 3.34Å; P399-R402 PolarHBondContact O-N 3.44Å; P399-E403 PolarHBondContact O-N 3.29Å
400K86Confident81.2Confident86 Ų86104.5 Ų104.537%0.37450%0.503SS..Hα-helixtrans-61.7-44.2178.1-67-174.6177.6-173.50112.2W397 R402 E403 Y404W397-K400 PolarHBondContact O-N 3.43Å; K400-R402 VanDerWaalsContact C-N 3.34Å; K400-E403 PolarHBondContact O-N 2.9Å; K400-Y404 WeakPolarHBondContact O-CB 3.38Å; K400-Y404 PolarHBondContact O-N 2.87Å
401L84.4Confident78.9Confident89 Ų89106.7 Ų106.747%0.46651%0.508SS..Hα-helixtrans-62.9-40.4174.8-84.2155.8000111.6W397 P399 Y404 W405W397-L401 HydrophobicContact CB-CD1 4.18Å; W397-L401 WeakPolarHBondContact O-CB 3.21Å; W397-L401 WeakPolarHBondContact O-CG 3.44Å; W397-L401 PolarHBondContact O-N 2.98Å; P399-L401 PolarHBondContact O-N 3.38Å; L401-Y404 PolarHBondContact O-N 3.02Å; L401-W405 WeakPolarHBondContact O-CB 3.43Å; L401-W405 PolarHBondContact O-N 2.9Å
402R84.1Confident76.6Confident173 Ų173105 Ų10565%0.65351%0.512SS*.Hα-helixtrans-66.7-39.3177.8-171.1177.4-172.9-178.51.5111.6L398 P399 K400 K406L398-R402 VanDerWaalsContact O-CB 3.24Å; L398-R402 WeakPolarHBondContact O-CB 3.3Å; L398-R402 PolarHBondContact O-N 2.89Å; P399-R402 WeakPolarHBondContact O-CB 3.34Å; P399-R402 PolarHBondContact O-N 3.44Å; K400-R402 VanDerWaalsContact C-N 3.34Å; R402-K406 WeakPolarHBondContact O-CB 3.46Å; R402-K406 VanDerWaalsContact O-CG 3.25Å; R402-K406 WeakPolarHBondContact O-CG 3.4Å; R402-K406 PolarHBondContact O-N 2.9Å
403E82.2Confident74.5Confident119 Ų119108.3 Ų108.356%0.55654%0.54SS*.Hα-helixtrans-64.3-49.1171.9-76.1-179.4173.600111.2P399 K400 W405 K406 F407P399-E403 PolarHBondContact O-N 3.29Å; K400-E403 PolarHBondContact O-N 2.9Å; E403-W405 VanDerWaalsContact C-N 3.29Å; E403-W405 PolarHBondContact O-N 3.4Å; E403-K406 PolarHBondContact O-N 3.18Å; E403-F407 VanDerWaalsContact O-CD2 3.3Å; E403-F407 WeakPolarHBondContact O-CD2 3.47Å; E403-F407 PolarHBondContact O-N 2.88Å
404Y79Confident72.1Confident163 Ų163115.4 Ų115.464%0.63957%0.566SS**Hα-helixtrans-55.3-43.1176.6-172.8-90.4000112.1K400 L401 G408K400-Y404 WeakPolarHBondContact O-CB 3.38Å; K400-Y404 PolarHBondContact O-N 2.87Å; L401-Y404 PolarHBondContact O-N 3.02Å; Y404-G408 VanDerWaalsContact O-CA 3.32Å; Y404-G408 WeakPolarHBondContact O-CA 3.33Å; Y404-G408 PolarHBondContact O-N 3.31Å
405W78.3Confident69.5Low162 Ų162121.3 Ų121.361%0.61459%0.593SS**Hα-helixtrans-70.1-33.8176.4-96.379.8000114L401 E403 K409L401-W405 WeakPolarHBondContact O-CB 3.43Å; L401-W405 PolarHBondContact O-N 2.9Å; E403-W405 VanDerWaalsContact C-N 3.29Å; E403-W405 PolarHBondContact O-N 3.4Å; W405-K409 HydrophobicContact CE3-CD 4.17Å; W405-K409 HydrophobicContact CE3-CG 4.39Å; W405-K409 HydrophobicContact CZ3-CD 4.34Å; W405-K409 PolarHBondContact O-N 3.44Å
406K75.2Confident66.9Low136 Ų136122.2 Ų122.259%0.59160%0.602SS**Hα-helixtrans-68.1-44.1176.1-79.6176.7177.1-173.90111.7R402 E403R402-K406 WeakPolarHBondContact O-CB 3.46Å; R402-K406 VanDerWaalsContact O-CG 3.25Å; R402-K406 WeakPolarHBondContact O-CG 3.4Å; R402-K406 PolarHBondContact O-N 2.9Å; E403-K406 PolarHBondContact O-N 3.18Å
407F70.2Confident64.4Low160 Ų160123.6 Ų123.670%0.70263%0.627SS**Hα-helixtrans-81.8-34.8179.6-72-74.9000112.6E403 K409 G410E403-F407 VanDerWaalsContact O-CD2 3.3Å; E403-F407 WeakPolarHBondContact O-CD2 3.47Å; E403-F407 PolarHBondContact O-N 2.88Å; F407-K409 PolarHBondContact O-N 3.45Å; F407-G410 PolarHBondContact O-N 3.43Å; F407-G410 VanDerWaalsContact O-N 3.14Å
408G61.5Low61.8Low52 Ų52127.3 Ų127.354%0.53665%0.652SS.*Hα-helixtrans-69.1-26.3179.800000114.6Y404Y404-G408 VanDerWaalsContact O-CA 3.32Å; Y404-G408 WeakPolarHBondContact O-CA 3.33Å; Y404-G408 PolarHBondContact O-N 3.31Å
409K54.5Low59.4Low162 Ų162127.4 Ų127.470%0.70466%0.662SS**THydrogen-bonded Turntrans-79.5-18170.8-81.9-168.9169.6176.50114.2W405 F407W405-K409 HydrophobicContact CE3-CD 4.17Å; W405-K409 HydrophobicContact CE3-CG 4.39Å; W405-K409 HydrophobicContact CZ3-CD 4.34Å; W405-K409 PolarHBondContact O-N 3.44Å; F407-K409 PolarHBondContact O-N 3.45Å
410G48Very low56.8Low63 Ų63133.6 Ų133.665%0.64968%0.682SS**THydrogen-bonded Turntrans-85.7-15.3-175.900000114.5F407 S412F407-G410 PolarHBondContact O-N 3.43Å; F407-G410 VanDerWaalsContact O-N 3.14Å; G410-S412 PolarHBondContact O-N 2.91Å
411V45.3Very low54.3Low112 Ų112134.2 Ų134.268%0.67970%0.698SS**  trans-95.483.7-179.8-172.30000109.2V413V411-V413 PolarHBondContact O-N 2.88Å
412S43.4Very low52Low84 Ų84135.6 Ų135.659%0.58772%0.715SS**  trans-63127.7156.583.10000107.5G410 R414G410-S412 PolarHBondContact O-N 2.91Å; S412-R414 PolarHBondContact O-N 3.25Å
413V47.1Very low49.7Very low146 Ų146131.1 Ų131.189%0.88571%0.714SS**THydrogen-bonded Turntrans-69.532.4-174.9-178.50000112.4V411V411-V413 PolarHBondContact O-N 2.88Å
414R42.2Very low47.6Very low226 Ų226129.6 Ų129.685%0.85372%0.722SS**THydrogen-bonded Turntrans-118.1-8-177.6-98.2-175179.2167.21117.4S412S412-R414 PolarHBondContact O-N 3.25Å
415D37.3Very low45.6Very low141 Ų141128.7 Ų128.775%0.75472%0.724SS**SBendtrans-125.295.2177.4-78.9-36.8000112.2
416K35.4Very low43.8Very low194 Ų194125.7 Ų125.784%0.84373%0.725SS**  143.598.4125.7-77.4176.3-177.5-179.10111.1N418K416-N418 PolarHBondContact O-N 2.89Å; K416-N418 VanDerWaalsContact O-N 3.15Å
417G37.8Very low42.4Very low74 Ų74124.3 Ų124.376%0.76372%0.723SS**  trans-55.7111.414500000108.2
418N32.9Very low41.1Very low143 Ų143124.3 Ų124.377%0.76572%0.718SS**SBendtrans164.499.3149-84.9-10.7000105.9K416 F420K416-N418 PolarHBondContact O-N 2.89Å; K416-N418 VanDerWaalsContact O-N 3.15Å; N418-F420 PolarHBondContact O-N 3.5Å
419S35.7Very low40.3Very low119 Ų119128.4 Ų128.483%0.83273%0.727SS**  trans16.782.7148.657.60000114.9
420F33Very low39.9Very low202 Ų202123.9 Ų123.989%0.88671%0.714SS**  trans-123.5122.8155.1-135.5-96.8000108.8N418 S422N418-F420 PolarHBondContact O-N 3.5Å; F420-S422 PolarHBondContact O-N 2.92Å
421S32.1Very low39.7Very low99 Ų99128.7 Ų128.769%0.69272%0.72SS**  trans-34.5122.6178.9-172.70000112.2A423S421-A423 PolarHBondContact O-N 3.34Å
422S35.8Very low39.8Very low118 Ų118129.2 Ų129.283%0.82571%0.71SS**  trans-63.675.8164.6169.10000109.3F420F420-S422 PolarHBondContact O-N 2.92Å
423A36.8Very low39.7Very low78 Ų78133 Ų13365%0.64572%0.724SS**  trans-105.358.1164.100000108.5S421 E425S421-A423 PolarHBondContact O-N 3.34Å; A423-E425 PolarHBondContact O-N 2.98Å
424A39.1Very low39.2Very low87 Ų87131.7 Ų131.772%0.71971%0.708SS**  trans-67.683.5142.300000104.8P426A424-P426 WeakPolarHBondContact O-CD 3.41Å; A424-P426 VanDerWaalsContact O-N 3.08Å
425E36.7Very low38.6Very low145 Ų145123.5 Ų123.568%0.67869%0.694SS**  trans-54.3119.4176.6-160.1166.8-161.300106.5A423 I427A423-E425 PolarHBondContact O-N 2.98Å; E425-I427 PolarHBondContact O-N 3.38Å
426P39Very low38.4Very low99 Ų99123.1 Ų123.164%0.64370%0.699SS**  trans-56.8134.1-177.121.6-31.8000107.3A424 R428A424-P426 WeakPolarHBondContact O-CD 3.41Å; A424-P426 VanDerWaalsContact O-N 3.08Å; P426-R428 VanDerWaalsContact C-N 3.29Å; P426-R428 PolarHBondContact O-N 3.44Å
427I46.2Very low38.4Very low106 Ų106118.2 Ų118.254%0.54469%0.689SS.*  trans-61.696.2-176.5-50.3170.4000107.9W397 E425W397-I427 HydrophobicContact CE3-CG2 4.43Å; W397-I427 HydrophobicContact CH2-CB 4.11Å; W397-I427 HydrophobicContact CH2-CG2 3.29Å; W397-I427 HydrophobicContact CZ2-CG2 4.33Å; W397-I427 HydrophobicContact CZ3-CB 4.17Å; W397-I427 HydrophobicContact CZ3-CD1 3.95Å; W397-I427 HydrophobicContact CZ3-CG2 3.37Å; E425-I427 PolarHBondContact O-N 3.38Å
428R42.4Very low38Very low160 Ų160122 Ų12260%0.60469%0.692SS**PPolyproline II helixtrans-68.6137.3175.9-65.2-172-166.3-173.45.9107.9P426P426-R428 VanDerWaalsContact C-N 3.29Å; P426-R428 PolarHBondContact O-N 3.44Å
429L46Very low37.7Very low138 Ų138119.1 Ų119.172%0.72370%0.696SS**PPolyproline II helixtrans-51.8140.6165.6-68.5170000107.9E431L429-E431 PolarHBondContact O-N 3.28Å; L429-E431 VanDerWaalsContact O-N 3.12Å
430P44.9Very low37.4Very low67 Ų67121.2 Ų121.244%0.43570%0.697SS.*PPolyproline II helixtrans-52.9124.217620.4-29.4000109.4R432P430-R432 PolarHBondContact O-N 3.01Å
431E45.6Very low37.2Very low164 Ų164116.5 Ų116.577%0.76670%0.695SS**PPolyproline II helixtrans-63.2132.3172.6-77.8178.5-178.800108.8L429L429-E431 PolarHBondContact O-N 3.28Å; L429-E431 VanDerWaalsContact O-N 3.12Å
432R46.6Very low37.3Very low124 Ų124121.3 Ų121.347%0.46870%0.703SS.*PPolyproline II helixtrans-64.1132.8-173.5-172.2178.8-176.3-114.7-2.3110.2P430 E434P430-R432 PolarHBondContact O-N 3.01Å; R432-E434 HydrophobicContact CB-CG 4.3Å; R432-E434 HydrophobicContact CG-CG 4.13Å; R432-E434 IonicContact CZ-OE1 3.98Å; R432-E434 IonicContact NH1-OE1 2.9Å; R432-E434 PolarHBondContact NH1-OE1 2.89Å; R432-E434 PolarHBondContact O-N 3.12Å
433N41.2Very low36.9Very low164 Ų164121 Ų12188%0.87770%0.701SS**  trans-70.783.2160-85.3-20.9000107.9G435N433-G435 PolarHBondContact O-N 3.16Å; N433-G435 VanDerWaalsContact O-N 3.07Å
434E35.9Very low36.6Very low117 Ų117126.6 Ų126.655%0.54771%0.714SS.*  trans-64.1110.9165.2-55-146.5136.400106.9R432R432-E434 HydrophobicContact CB-CG 4.3Å; R432-E434 HydrophobicContact CG-CG 4.13Å; R432-E434 IonicContact CZ-OE1 3.98Å; R432-E434 IonicContact NH1-OE1 2.9Å; R432-E434 PolarHBondContact NH1-OE1 2.89Å; R432-E434 PolarHBondContact O-N 3.12Å
435G30.8Very low36Very low55 Ų55126.1 Ų126.157%0.56772%0.718SS**  trans-52.5158.9166.800000110.1N433 S437N433-G435 PolarHBondContact O-N 3.16Å; N433-G435 VanDerWaalsContact O-N 3.07Å; G435-S437 PolarHBondContact O-N 2.7Å
436P32.8Very low35.8Very low132 Ų132123.2 Ų123.286%0.85772%0.718SS**  trans-56.2101.5-162.423.4-33.1000111N438P436-N438 PolarHBondContact O-N 3.35Å
437S36.2Very low35.2Very low92 Ų92124.8 Ų124.864%0.64373%0.726SS**  trans-73.5108.6164.944.60000105.8G435 G439G435-S437 PolarHBondContact O-N 2.7Å; S437-G439 PolarHBondContact O-N 2.85Å; S437-G439 VanDerWaalsContact O-N 3.16Å
438N28.7Very low34.6Very low154 Ų154129.9 Ų129.982%0.82474%0.74SS**  trans-48.8125.4167.9-78.9-21.7000108.1P436 L440P436-N438 PolarHBondContact O-N 3.35Å; N438-L440 PolarHBondContact O-N 3.14Å
439G27.3Very low34.3Very low81 Ų81136.5 Ų136.584%0.83577%0.767SS**SBendtrans-46.9107.5-170.400000113.2S437S437-G439 PolarHBondContact O-N 2.85Å; S437-G439 VanDerWaalsContact O-N 3.16Å
440L27.9Very low33.7Very low163 Ų163136.5 Ų136.585%0.85377%0.769SS**  trans-134.8104.6153.5-94.1158.6000105.1N438 K442N438-L440 PolarHBondContact O-N 3.14Å; L440-K442 PolarHBondContact O-N 3.28Å; L440-K442 VanDerWaalsContact O-N 3.08Å
441A30.1Very low33.1Very low103 Ų103140.1 Ų140.185%0.85179%0.787SS**  trans-44.3113.5178.100000110.6S443A441-S443 PolarHBondContact O-N 2.87Å
442K33.2Very low32.4Very low200 Ų200138.8 Ų138.887%0.8779%0.788SS**  trans-81.8103.6158-83.5-175.6178174.30106.5L440L440-K442 PolarHBondContact O-N 3.28Å; L440-K442 VanDerWaalsContact O-N 3.08Å
443S28.8Very low31.6Very low111 Ų111139.6 Ų139.678%0.77681%0.807SS**  trans-52.2136.7168.359.40000110.4A441A441-S443 PolarHBondContact O-N 2.87Å
444E28.5Very low31Very low196 Ų196138.1 Ų138.192%0.91680%0.803SS**SBendtrans-48.3144.5162.3-61.2174.2147.500111.1
445G28Very low30.7Very low78 Ų78139.5 Ų139.580%0.80482%0.82SS**  trans116.285.9158.700000116.3
446A31.1Very low30.6Very low83 Ų83145.6 Ų145.669%0.68684%0.838SS**  trans-157.480.9143.600000109.1Y448A446-Y448 HydrophobicContact CB-CD2 4.24Å; A446-Y448 HydrophobicContact CB-CE2 4.27Å
447V27.9Very low30.5Very low132 Ų132146.6 Ų146.680%0.884%0.836SS**  trans-79.6112.5158.7177.20000105.9
448Y32.7Very low30Very low214 Ų214151.2 Ų151.284%0.83985%0.852SS**  trans-116.4128.2162.7-79.8-82.1000107.9A446A446-Y448 HydrophobicContact CB-CD2 4.24Å; A446-Y448 HydrophobicContact CB-CE2 4.27Å
449Y36Very low30.1Very low299 Ų299150.9 Ų150.9100%1.17386%0.855SS**  trans-54.90-178-74.4-88.7000113.9

Retrieved 449 of 449 residues in 356.1 ms (Link to these results)