A0A077YWL6_TRITR Loading...

Somatostatin receptor type 1

AlphaFold DB , UniProt , Accession A0A077YWL6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 352 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
1M32Very low36.8Very low247 Ų247162.7 Ų162.7100%1.21786%0.861SS**  0100.40-87.9170.118000107.8
2C30.6Very low37.3Very low123 Ų123158 Ų15883%0.83185%0.847SS**  trans-132.7112.1166.4-82.80000106.1
3E36.1Very low37.9Very low197 Ų197159.7 Ų159.792%0.92184%0.842SS**  trans-129.2109.2159.4-84.1-176.4161.600106.9
4I39.4Very low38.5Very low147 Ų147156.8 Ų156.875%0.75483%0.834SS**  trans-96.2116.4173.1-64.3170.3000105.1E6I4-E6 HydrophobicContact CG2-CG 4.35Å
5N36.8Very low39.2Very low166 Ų166152.7 Ų152.789%0.88881%0.812SS**  trans-101.3104.8171.6-105.9-15000109.2
6E36.7Very low40.2Very low160 Ų160154.6 Ų154.675%0.74881%0.805SS**  trans-89.6158.9168.8-85.9-174.315100111.7I4I4-E6 HydrophobicContact CG2-CG 4.35Å
7T36.1Very low41.3Very low124 Ų124149.4 Ų149.476%0.76179%0.785SS**  trans89.5108.115471.30000119.4
8R39.8Very low42.5Very low258 Ų258143.4 Ų143.497%0.97476%0.76SS**  trans-155.374.4131.3-100.7-178.7-163.6-174.14.6109.2
9G39.5Very low43.5Very low68 Ų68139.4 Ų139.470%0.70174%0.742SS**  trans-98.7107.1163.100000108.5I11G9-I11 PolarHBondContact O-N 3.42Å
10T37.7Very low44.3Very low142 Ų142138.3 Ų138.387%0.87173%0.732SS**  trans-63.5111.9173.636.20000110.3
11I40Very low45Very low158 Ų158134.1 Ų134.181%0.8171%0.714SS**  trans-67.2130.1170.2-60.8172.3000107.7G9 F13G9-I11 PolarHBondContact O-N 3.42Å; I11-F13 PolarHBondContact O-N 3.22Å
12P43.1Very low46.8Very low106 Ų106128.4 Ų128.469%0.68868%0.684SS**  trans-66.5133.2-176.725.6-31.2000110.5V14P12-V14 PolarHBondContact O-N 2.89Å
13F44.5Very low48.8Very low180 Ų180126.2 Ų126.279%0.78967%0.667SS**  trans-60.394173.6-156.7-95.6000108.3I11 D15I11-F13 PolarHBondContact O-N 3.22Å; F13-D15 PolarHBondContact O-N 2.8Å; F13-D15 VanDerWaalsContact O-N 3.1Å
14V46.8Very low50.5Low119 Ų119121.4 Ų121.472%0.72165%0.648SS**  trans-61.9115.1169174.80000106.4P12 R16P12-V14 PolarHBondContact O-N 2.89Å; V14-R16 PolarHBondContact O-N 3.3Å
15D49.2Very low52.1Low95 Ų95120.8 Ų120.851%0.50864%0.642SS.*  trans-57109.1-172.1-126.3-39.1000110.7F13 S17 A18 T19F13-D15 PolarHBondContact O-N 2.8Å; F13-D15 VanDerWaalsContact O-N 3.1Å; D15-S17 PolarHBondContact O-N 3.13Å; D15-S17 PolarHBondContact OD1-OG 3.07Å; D15-A18 HydrophobicContact CB-CB 4.07Å; D15-A18 PolarHBondContact O-N 3.22Å; D15-A18 VanDerWaalsContact O-N 3.13Å; D15-T19 PolarHBondContact O-N 3.06Å; D15-T19 PolarHBondContact O-OG1 3.11Å; D15-T19 VanDerWaalsContact O-OG1 3.11Å
16R55.6Low54.1Low184 Ų184117.1 Ų117.169%0.69462%0.622SS**Hα-helixtrans-55.2-33.6172.4-86.8-174-172.5162.52.6111.5V14 A18 T19 E20V14-R16 PolarHBondContact O-N 3.3Å; R16-A18 VanDerWaalsContact C-N 3.34Å; R16-A18 PolarHBondContact O-N 3.33Å; R16-T19 WeakPolarHBondContact CA-OG1 3.35Å; R16-T19 PolarHBondContact O-N 2.9Å; R16-T19 PolarHBondContact O-OG1 2.85Å; R16-E20 WeakPolarHBondContact O-CB 3.18Å; R16-E20 WeakPolarHBondContact O-CG 3.38Å; R16-E20 PolarHBondContact O-N 3.15Å
17S58.9Low56.2Low66 Ų66113.4 Ų113.446%0.46261%0.61SS.*Hα-helixtrans-58.5-43.9177.762.60000112.1D15 S21D15-S17 PolarHBondContact O-N 3.13Å; D15-S17 PolarHBondContact OD1-OG 3.07Å; S17-S21 WeakPolarHBondContact O-CB 3.38Å; S17-S21 PolarHBondContact O-N 3.1Å; S17-S21 PolarHBondContact O-OG 3.46Å
18A61.8Low58.3Low41 Ų41112.7 Ų112.734%0.33960%0.602SS.*Hα-helixtrans-71.5-34.1179.300000112.4D15 R16 S21 Q22D15-A18 HydrophobicContact CB-CB 4.07Å; D15-A18 PolarHBondContact O-N 3.22Å; D15-A18 VanDerWaalsContact O-N 3.13Å; R16-A18 VanDerWaalsContact C-N 3.34Å; R16-A18 PolarHBondContact O-N 3.33Å; A18-S21 PolarHBondContact O-OG 3.43Å; A18-S21 VanDerWaalsContact O-OG 3.07Å; A18-Q22 WeakPolarHBondContact O-CB 3.39Å; A18-Q22 WeakPolarHBondContact O-CG 3.34Å; A18-Q22 PolarHBondContact O-N 3.13Å; A18-Q22 VanDerWaalsContact O-N 3.13Å
19T62.1Low60.4Low68 Ų68103 Ų10342%0.41757%0.574SS.*Hα-helixtrans-72.2-44175.117.90000111.2D15 R16 Q22 T23D15-T19 PolarHBondContact O-N 3.06Å; D15-T19 PolarHBondContact O-OG1 3.11Å; D15-T19 VanDerWaalsContact O-OG1 3.11Å; R16-T19 WeakPolarHBondContact CA-OG1 3.35Å; R16-T19 PolarHBondContact O-N 2.9Å; R16-T19 PolarHBondContact O-OG1 2.85Å; T19-Q22 PolarHBondContact O-N 2.92Å; T19-T23 VanDerWaalsContact O-CG2 3.3Å; T19-T23 WeakPolarHBondContact O-CG2 3.38Å; T19-T23 PolarHBondContact O-N 3.42Å; T19-T23 PolarHBondContact O-OG1 2.77Å
20E59.5Low62.7Low117 Ų117102.1 Ų102.155%0.54755%0.552SS.*Hα-helixtrans-61.6-45.7175-76.4175.3-169.100111.6R16 Q22 T23 N24R16-E20 WeakPolarHBondContact O-CB 3.18Å; R16-E20 WeakPolarHBondContact O-CG 3.38Å; R16-E20 PolarHBondContact O-N 3.15Å; E20-Q22 PolarHBondContact O-N 3.28Å; E20-T23 WeakPolarHBondContact CA-OG1 3.36Å; E20-T23 PolarHBondContact O-N 2.92Å; E20-T23 PolarHBondContact O-OG1 3.19Å; E20-N24 WeakPolarHBondContact O-CB 3.49Å; E20-N24 VanDerWaalsContact O-CG 3.28Å; E20-N24 PolarHBondContact O-N 3.24Å; E20-N24 PolarHBondContact O-ND2 3.05Å
21S59.6Low65.1Low51 Ų51100.8 Ų100.836%0.35754%0.536SS..Hα-helixtrans-61-45.6177.8730000111.8S17 A18 T23 N24 E25S17-S21 WeakPolarHBondContact O-CB 3.38Å; S17-S21 PolarHBondContact O-N 3.1Å; S17-S21 PolarHBondContact O-OG 3.46Å; A18-S21 PolarHBondContact O-OG 3.43Å; A18-S21 VanDerWaalsContact O-OG 3.07Å; S21-T23 VanDerWaalsContact C-N 3.34Å; S21-T23 PolarHBondContact O-N 3.28Å; S21-N24 PolarHBondContact O-N 3.44Å; S21-E25 WeakPolarHBondContact O-CB 3.3Å; S21-E25 WeakPolarHBondContact O-CG 3.34Å; S21-E25 PolarHBondContact O-N 3.38Å
22Q69Low67.6Low127 Ų12799.8 Ų99.859%0.59353%0.526SS*.Hα-helixtrans-61.8-40.3176.4-76.3177.2400112.3A18 T19 E20 L26A18-Q22 WeakPolarHBondContact O-CB 3.39Å; A18-Q22 WeakPolarHBondContact O-CG 3.34Å; A18-Q22 PolarHBondContact O-N 3.13Å; A18-Q22 VanDerWaalsContact O-N 3.13Å; T19-Q22 PolarHBondContact O-N 2.92Å; E20-Q22 PolarHBondContact O-N 3.28Å; Q22-L26 VanDerWaalsContact O-CB 3.31Å; Q22-L26 WeakPolarHBondContact O-CB 3.45Å; Q22-L26 PolarHBondContact O-N 2.86Å
23T72.4Confident69.8Low77 Ų7796.2 Ų96.247%0.47250%0.502SS..Hα-helixtrans-68.2-37.4177.456.50000112.7T19 E20 S21 T27T19-T23 VanDerWaalsContact O-CG2 3.3Å; T19-T23 WeakPolarHBondContact O-CG2 3.38Å; T19-T23 PolarHBondContact O-N 3.42Å; T19-T23 PolarHBondContact O-OG1 2.77Å; E20-T23 WeakPolarHBondContact CA-OG1 3.36Å; E20-T23 PolarHBondContact O-N 2.92Å; E20-T23 PolarHBondContact O-OG1 3.19Å; S21-T23 VanDerWaalsContact C-N 3.34Å; S21-T23 PolarHBondContact O-N 3.28Å; T23-T27 WeakPolarHBondContact O-CB 3.47Å; T23-T27 PolarHBondContact O-N 2.74Å; T23-T27 PolarHBondContact O-OG1 3.37Å
24N72.1Confident72.1Confident95 Ų9591.5 Ų91.551%0.50848%0.479SS..Hα-helixtrans-68.8-48.2177.3-71.8-21.6000111E20 S21 L26 T27 D28E20-N24 WeakPolarHBondContact O-CB 3.49Å; E20-N24 VanDerWaalsContact O-CG 3.28Å; E20-N24 PolarHBondContact O-N 3.24Å; E20-N24 PolarHBondContact O-ND2 3.05Å; S21-N24 PolarHBondContact O-N 3.44Å; N24-L26 VanDerWaalsContact C-N 3.32Å; N24-L26 PolarHBondContact O-N 3.06Å; N24-T27 PolarHBondContact O-N 2.97Å; N24-D28 PolarHBondContact O-N 3.36Å
25E73.3Confident74.3Confident135 Ų13589.1 Ų89.163%0.63147%0.465SS*.Hα-helixtrans-59.2-41.3176.5-73.8179.8-177.600112.4S21 T27 S29S21-E25 WeakPolarHBondContact O-CB 3.3Å; S21-E25 WeakPolarHBondContact O-CG 3.34Å; S21-E25 PolarHBondContact O-N 3.38Å; E25-T27 VanDerWaalsContact C-N 3.34Å; E25-S29 WeakPolarHBondContact O-CB 3.31Å; E25-S29 PolarHBondContact O-N 2.98Å; E25-S29 PolarHBondContact O-OG 2.88Å
26L79.2Confident76.5Confident88 Ų8888.4 Ų88.446%0.46146%0.461SS..Hα-helixtrans-65-39.7175.1-177.463.3000111.5Q22 N24 S29 L30 T293Q22-L26 VanDerWaalsContact O-CB 3.31Å; Q22-L26 WeakPolarHBondContact O-CB 3.45Å; Q22-L26 PolarHBondContact O-N 2.86Å; N24-L26 VanDerWaalsContact C-N 3.32Å; N24-L26 PolarHBondContact O-N 3.06Å; L26-S29 WeakPolarHBondContact CA-OG 3.37Å; L26-S29 PolarHBondContact O-OG 2.87Å; L26-L30 HydrophobicContact CD1-CD1 3.75Å; L26-L30 HydrophobicContact CG-CD1 4.3Å; L26-L30 WeakPolarHBondContact O-CB 3.43Å; L26-L30 VanDerWaalsContact O-CD1 3.28Å; L26-L30 WeakPolarHBondContact O-CD1 3.48Å; L26-L30 PolarHBondContact O-N 3.02Å; L26-L30 VanDerWaalsContact O-N 3.09Å; L26-T293 HydrophobicContact CD1-CG2 4.4Å
27T80.7Confident78.4Confident82 Ų8280.1 Ų80.150%0.50343%0.43SS..Hα-helixtrans-67.8-43.7179.3-59.60000111.5T23 N24 E25 L30 H31T23-T27 WeakPolarHBondContact O-CB 3.47Å; T23-T27 PolarHBondContact O-N 2.74Å; T23-T27 PolarHBondContact O-OG1 3.37Å; N24-T27 PolarHBondContact O-N 2.97Å; E25-T27 VanDerWaalsContact C-N 3.34Å; T27-L30 PolarHBondContact O-N 3.01Å; T27-H31 WeakPolarHBondContact O-CB 3.28Å; T27-H31 PolarHBondContact O-N 3.19Å
28D80.7Confident80.1Confident110 Ų11077.4 Ų77.459%0.58841%0.411SS*.Hα-helixtrans-66.4-44.3179.3-74.7-18.1000111.8N24 L30 H31 F32N24-D28 PolarHBondContact O-N 3.36Å; D28-L30 PolarHBondContact O-N 2.88Å; D28-H31 PolarHBondContact O-N 2.9Å; D28-F32 WeakPolarHBondContact O-CB 3.4Å; D28-F32 PolarHBondContact O-N 2.96Å
29S83.8Confident81.8Confident55 Ų5579 Ų7939%0.38542%0.417SS..Hα-helixtrans-62-42.1175.458.20000111.9E25 L26 H31 F32 V33E25-S29 WeakPolarHBondContact O-CB 3.31Å; E25-S29 PolarHBondContact O-N 2.98Å; E25-S29 PolarHBondContact O-OG 2.88Å; L26-S29 WeakPolarHBondContact CA-OG 3.37Å; L26-S29 PolarHBondContact O-OG 2.87Å; S29-H31 VanDerWaalsContact C-N 3.35Å; S29-H31 PolarHBondContact O-N 3.19Å; S29-F32 PolarHBondContact O-N 3.49Å; S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.32Å; S29-V33 PolarHBondContact O-N 3.09Å
30L86.3Confident83.5Confident49 Ų4978.5 Ų78.526%0.25741%0.411SS..Hα-helixtrans-63.6-39.6173.7-98.865.5000112.2L26 T27 D28 R34 T293L26-L30 HydrophobicContact CD1-CD1 3.75Å; L26-L30 HydrophobicContact CG-CD1 4.3Å; L26-L30 WeakPolarHBondContact O-CB 3.43Å; L26-L30 VanDerWaalsContact O-CD1 3.28Å; L26-L30 WeakPolarHBondContact O-CD1 3.48Å; L26-L30 PolarHBondContact O-N 3.02Å; L26-L30 VanDerWaalsContact O-N 3.09Å; T27-L30 PolarHBondContact O-N 3.01Å; D28-L30 PolarHBondContact O-N 2.88Å; L30-R34 VanDerWaalsContact O-CG 3.24Å; L30-R34 WeakPolarHBondContact O-CG 3.45Å; L30-R34 PolarHBondContact O-N 3.35Å; L30-T293 HydrophobicContact CD1-CG2 3.72Å
31H89.1Confident85.3Confident113 Ų11373.1 Ų73.152%0.52339%0.386SS..Hα-helixtrans-64.3-48176.8-177.5-91.6000111.3T27 D28 S29 V33 R34 V35T27-H31 WeakPolarHBondContact O-CB 3.28Å; T27-H31 PolarHBondContact O-N 3.19Å; D28-H31 PolarHBondContact O-N 2.9Å; S29-H31 VanDerWaalsContact C-N 3.35Å; S29-H31 PolarHBondContact O-N 3.19Å; H31-V33 PolarHBondContact O-N 2.94Å; H31-R34 WeakPolarHBondContact O-CB 3.41Å; H31-R34 PolarHBondContact O-N 2.99Å; H31-R34 VanDerWaalsContact O-N 3.16Å; H31-V35 WeakPolarHBondContact O-CG2 3.45Å; H31-V35 PolarHBondContact O-N 2.91Å
32F91.1Very high87.1Confident137 Ų13772.9 Ų72.960%0.60139%0.386SS*.Hα-helixtrans-55.9-48.6175.6175.4-98.8000111.8D28 S29 R34 V35 L36D28-F32 WeakPolarHBondContact O-CB 3.4Å; D28-F32 PolarHBondContact O-N 2.96Å; S29-F32 PolarHBondContact O-N 3.49Å; F32-R34 VanDerWaalsContact C-N 3.31Å; F32-R34 PolarHBondContact O-N 2.85Å; F32-V35 PolarHBondContact O-N 3.46Å; F32-L36 HydrophobicContact CE1-CD2 4.18Å; F32-L36 WeakPolarHBondContact O-CB 3.28Å; F32-L36 PolarHBondContact O-N 3.4Å
33V91.2Very high88.5Confident32 Ų3271.2 Ų71.219%0.19438%0.381CS..Hα-helixtrans-59.6-41.8178171.30000111.2S29 H31 L36 L37 I297S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.32Å; S29-V33 PolarHBondContact O-N 3.09Å; H31-V33 PolarHBondContact O-N 2.94Å; V33-L36 PolarHBondContact O-N 3.03Å; V33-L37 HydrophobicContact CG1-CD1 3.95Å; V33-L37 HydrophobicContact CG1-CG 4.31Å; V33-L37 WeakPolarHBondContact O-CG 3.33Å; V33-L37 PolarHBondContact O-N 3.2Å; V33-I297 HydrophobicContact CG1-CG1 4.24Å; V33-I297 HydrophobicContact CG1-CG2 4.11Å; V33-I297 HydrophobicContact CG2-CD1 4.26Å
34R91.4Very high89.7Confident81 Ų8168 Ų6831%0.30636%0.361SS..Hα-helixtrans-62.3-46.5177.4-73.1169.2-174156.22.9112.3L30 H31 F32 L36 L37 A38 R96L30-R34 VanDerWaalsContact O-CG 3.24Å; L30-R34 WeakPolarHBondContact O-CG 3.45Å; L30-R34 PolarHBondContact O-N 3.35Å; H31-R34 WeakPolarHBondContact O-CB 3.41Å; H31-R34 PolarHBondContact O-N 2.99Å; H31-R34 VanDerWaalsContact O-N 3.16Å; F32-R34 VanDerWaalsContact C-N 3.31Å; F32-R34 PolarHBondContact O-N 2.85Å; R34-L36 VanDerWaalsContact C-N 3.34Å; R34-L37 PolarHBondContact O-N 3.19Å; R34-A38 WeakPolarHBondContact O-CB 3.38Å; R34-A38 PolarHBondContact O-N 3.15Å; R34-R96 VanDerWaalsContact NH1-CD 3.26Å
35V93.9Very high90.8Very high68 Ų6866 Ų6641%0.41235%0.348SS..Hα-helixtrans-62.9-43.6177.9174.80000110.3H31 F32 L37 A38 V39H31-V35 WeakPolarHBondContact O-CG2 3.45Å; H31-V35 PolarHBondContact O-N 2.91Å; F32-V35 PolarHBondContact O-N 3.46Å; V35-L37 PolarHBondContact O-N 3.41Å; V35-A38 WeakPolarHBondContact O-CB 3.46Å; V35-A38 PolarHBondContact O-N 3.22Å; V35-V39 HydrophobicContact CG1-CG2 4.49Å; V35-V39 WeakPolarHBondContact O-CG2 3.48Å; V35-V39 PolarHBondContact O-N 3.16Å
36L95.1Very high91.9Very high81 Ų8162.5 Ų62.542%0.42434%0.341SS..Hα-helixtrans-59.3-47.2176.7179.261.8000112F32 V33 R34 A38 V39 I40F32-L36 HydrophobicContact CE1-CD2 4.18Å; F32-L36 WeakPolarHBondContact O-CB 3.28Å; F32-L36 PolarHBondContact O-N 3.4Å; V33-L36 PolarHBondContact O-N 3.03Å; R34-L36 VanDerWaalsContact C-N 3.34Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-A38 PolarHBondContact O-N 2.85Å; L36-V39 PolarHBondContact O-N 3.17Å; L36-I40 HydrophobicContact CD1-CD1 4.3Å; L36-I40 HydrophobicContact CG-CD1 4.09Å; L36-I40 WeakPolarHBondContact O-CG1 3.49Å; L36-I40 PolarHBondContact O-N 3.04Å
37L94.4Very high92.6Very high10 Ų1062 Ų625%0.05234%0.339CS..Hα-helixtrans-60.9-42.3176.6-67.1170.2000111.4V33 R34 V35 V39 I40 Y41 N300 V301 I304V33-L37 HydrophobicContact CG1-CD1 3.95Å; V33-L37 HydrophobicContact CG1-CG 4.31Å; V33-L37 WeakPolarHBondContact O-CG 3.33Å; V33-L37 PolarHBondContact O-N 3.2Å; R34-L37 PolarHBondContact O-N 3.19Å; V35-L37 PolarHBondContact O-N 3.41Å; L37-V39 PolarHBondContact O-N 2.8Å; L37-I40 PolarHBondContact O-N 3.48Å; L37-Y41 HydrophobicContact CB-CE2 4.38Å; L37-Y41 WeakPolarHBondContact O-CD2 3.24Å; L37-Y41 PolarHBondContact O-N 2.88Å; L37-N300 HydrophobicContact CD1-CB 3.97Å; L37-V301 HydrophobicContact CD2-CG2 4.16Å; L37-I304 HydrophobicContact CD2-CD1 3.39Å
38A96.2Very high93.2Very high8 Ų858 Ų587%0.06632%0.315CS..Hα-helixtrans-61.1-42.2176.300000112.3R34 V35 L36 Y41 A42 I90 I94R34-A38 WeakPolarHBondContact O-CB 3.38Å; R34-A38 PolarHBondContact O-N 3.15Å; V35-A38 WeakPolarHBondContact O-CB 3.46Å; V35-A38 PolarHBondContact O-N 3.22Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-A38 PolarHBondContact O-N 2.85Å; A38-Y41 PolarHBondContact O-N 3.1Å; A38-A42 PolarHBondContact O-N 2.74Å; A38-I90 HydrophobicContact CB-CG2 4.31Å; A38-I94 HydrophobicContact CB-CD1 4.34Å; A38-I94 HydrophobicContact CB-CG1 4.08Å
39V97.3Very high93.8Very high75 Ų7556.1 Ų56.146%0.45530%0.304SS..Hα-helixtrans-63.2-43174.8171.60000111.2V35 L36 L37 Y41 A42 I43V35-V39 HydrophobicContact CG1-CG2 4.49Å; V35-V39 WeakPolarHBondContact O-CG2 3.48Å; V35-V39 PolarHBondContact O-N 3.16Å; L36-V39 PolarHBondContact O-N 3.17Å; L37-V39 PolarHBondContact O-N 2.8Å; V39-Y41 PolarHBondContact O-N 3.25Å; V39-A42 WeakPolarHBondContact O-CB 3.43Å; V39-A42 PolarHBondContact O-N 2.75Å; V39-A42 VanDerWaalsContact O-N 3.16Å; V39-I43 HydrophobicContact CG1-CD1 4.03Å; V39-I43 WeakPolarHBondContact O-CG1 3.46Å; V39-I43 PolarHBondContact O-N 2.86Å
40I97.4Very high94.1Very high57 Ų5755.2 Ų55.229%0.29230%0.298SS..Hα-helixtrans-60.9-46176.7-67.5165000110.7L36 L37 A42 I43 L44 I304L36-I40 HydrophobicContact CD1-CD1 4.3Å; L36-I40 HydrophobicContact CG-CD1 4.09Å; L36-I40 WeakPolarHBondContact O-CG1 3.49Å; L36-I40 PolarHBondContact O-N 3.04Å; L37-I40 PolarHBondContact O-N 3.48Å; I40-A42 VanDerWaalsContact C-N 3.3Å; I40-A42 PolarHBondContact O-N 3.16Å; I40-I43 PolarHBondContact O-N 2.99Å; I40-L44 HydrophobicContact CG2-CD1 3.9Å; I40-L44 HydrophobicContact CG2-CG 4.43Å; I40-L44 VanDerWaalsContact O-CG 3.29Å; I40-L44 WeakPolarHBondContact O-CG 3.36Å; I40-L44 PolarHBondContact O-N 3.05Å; I40-I304 HydrophobicContact CG2-CD1 4.05Å; I40-I304 HydrophobicContact CG2-CG2 3.87Å
41Y97.5Very high94.3Very high5 Ų553 Ų532%0.0229%0.286CS..Hα-helixtrans-61.1-37.7175.1-71.9-56.9000112.4L37 A38 V39 L44 F45 L86 V89 I90 R93 I304 Y307L37-Y41 HydrophobicContact CB-CE2 4.38Å; L37-Y41 WeakPolarHBondContact O-CD2 3.24Å; L37-Y41 PolarHBondContact O-N 2.88Å; A38-Y41 PolarHBondContact O-N 3.1Å; V39-Y41 PolarHBondContact O-N 3.25Å; Y41-L44 PolarHBondContact O-N 3.27Å; Y41-F45 WeakPolarHBondContact O-CB 3.48Å; Y41-F45 PolarHBondContact O-N 3.37Å; Y41-L86 HydrophobicContact CD1-CD2 3.5Å; Y41-L86 HydrophobicContact CE1-CD2 4.09Å; Y41-L86 HydrophobicContact CG-CD2 4.25Å; Y41-V89 HydrophobicContact CD2-CG1 4.03Å; Y41-V89 HydrophobicContact CE1-CG1 4.29Å; Y41-V89 HydrophobicContact CE2-CG1 3.77Å; Y41-V89 HydrophobicContact CG-CG1 4.43Å; Y41-I90 HydrophobicContact CG-CG1 4.49Å; Y41-R93 HydrophobicContact CE2-CG 4.25Å; Y41-I304 HydrophobicContact CD1-CG1 4.47Å; Y41-I304 HydrophobicContact CE1-CD1 4.41Å; Y41-I304 HydrophobicContact CE1-CG1 3.67Å; Y41-I304 HydrophobicContact CE2-CD1 4.48Å; Y41-I304 HydrophobicContact CE2-CG1 4.44Å; Y41-Y307 HydrophobicContact CE1-CD2 4.23Å; Y41-Y307 HydrophobicContact CE1-CE2 4.22Å
42A98Very high94.4Very high45 Ų4549.4 Ų49.437%0.37227%0.272SS..Hα-helixtrans-65.1-41.5176.400000112.2A38 V39 I40 F45 A46 I90A38-A42 PolarHBondContact O-N 2.74Å; V39-A42 WeakPolarHBondContact O-CB 3.43Å; V39-A42 PolarHBondContact O-N 2.75Å; V39-A42 VanDerWaalsContact O-N 3.16Å; I40-A42 VanDerWaalsContact C-N 3.3Å; I40-A42 PolarHBondContact O-N 3.16Å; A42-F45 PolarHBondContact O-N 3.07Å; A42-A46 PolarHBondContact O-N 3.42Å; A42-I90 HydrophobicContact CB-CD1 4.04Å
43I97.5Very high94.4Very high93 Ų9348.5 Ų48.548%0.47727%0.273SS..Hα-helixtrans-62.2-45.4174.1-67.4166.4000110.4V39 I40 F45 A46 L47V39-I43 HydrophobicContact CG1-CD1 4.03Å; V39-I43 WeakPolarHBondContact O-CG1 3.46Å; V39-I43 PolarHBondContact O-N 2.86Å; I40-I43 PolarHBondContact O-N 2.99Å; I43-F45 VanDerWaalsContact C-N 3.34Å; I43-F45 PolarHBondContact O-N 3.44Å; I43-A46 PolarHBondContact O-N 3.01Å; I43-L47 HydrophobicContact CG2-CD1 3.96Å; I43-L47 HydrophobicContact CG2-CG 4.31Å; I43-L47 WeakPolarHBondContact O-CG 3.32Å; I43-L47 PolarHBondContact O-N 2.89Å
44L96.8Very high94.2Very high10 Ų1047.5 Ų47.55%0.05227%0.266CS..Hα-helixtrans-63-40.9178.2-69.8168.7000111.9I40 Y41 L47 G48 L86 I304 V308 V311I40-L44 HydrophobicContact CG2-CD1 3.9Å; I40-L44 HydrophobicContact CG2-CG 4.43Å; I40-L44 VanDerWaalsContact O-CG 3.29Å; I40-L44 WeakPolarHBondContact O-CG 3.36Å; I40-L44 PolarHBondContact O-N 3.05Å; Y41-L44 PolarHBondContact O-N 3.27Å; L44-L47 PolarHBondContact O-N 2.86Å; L44-G48 WeakPolarHBondContact O-CA 3.39Å; L44-G48 PolarHBondContact O-N 3.09Å; L44-L86 HydrophobicContact CB-CD1 4.03Å; L44-I304 HydrophobicContact CD1-CG2 3.48Å; L44-I304 VanDerWaalsContact CD1-CG2 3.48Å; L44-V308 HydrophobicContact CD1-CG2 4.5Å; L44-V308 HydrophobicContact CD2-CG2 4.05Å; L44-V311 HydrophobicContact CD2-CG1 4.4Å; L44-V311 HydrophobicContact CD2-CG2 3.71Å; L44-V311 WeakPolarHBondContact O-CG1 3.43Å
45F97.1Very high94.1Very high53 Ų5344.1 Ų44.123%0.23226%0.255CS..Hα-helixtrans-58.2-50.1173.2179.6-104.5000111.1Y41 A42 I43 L47 G48 L49 I83 M84 L86 P87Y41-F45 WeakPolarHBondContact O-CB 3.48Å; Y41-F45 PolarHBondContact O-N 3.37Å; A42-F45 PolarHBondContact O-N 3.07Å; I43-F45 VanDerWaalsContact C-N 3.34Å; I43-F45 PolarHBondContact O-N 3.44Å; F45-L47 PolarHBondContact O-N 2.97Å; F45-G48 PolarHBondContact O-N 3.12Å; F45-L49 HydrophobicContact CE1-CD1 4.5Å; F45-L49 HydrophobicContact CE1-CD2 4.3Å; F45-L49 HydrophobicContact CZ-CD2 4.08Å; F45-L49 WeakPolarHBondContact O-CG 3.05Å; F45-L49 PolarHBondContact O-N 2.88Å; F45-I83 WeakPolarHBondContact CD2-O 3.27Å; F45-M84 HydrophobicContact CE2-SD 4.26Å; F45-L86 HydrophobicContact CB-CB 4.21Å; F45-L86 HydrophobicContact CB-CD1 4.04Å; F45-L86 HydrophobicContact CD2-CB 4.26Å; F45-P87 HydrophobicContact CD2-CG 4.13Å; F45-P87 HydrophobicContact CE2-CG 3.86Å; F45-P87 HydrophobicContact CZ-CG 4.1Å
46A95.7Very high93.9Very high60 Ų6045.2 Ų45.250%0.49626%0.257SS..Hα-helixtrans-60.9-44.9179.200000113A42 I43 G48 L49A42-A46 PolarHBondContact O-N 3.42Å; I43-A46 PolarHBondContact O-N 3.01Å; A46-G48 VanDerWaalsContact C-N 3.31Å; A46-G48 PolarHBondContact O-N 2.89Å; A46-L49 WeakPolarHBondContact O-CB 3.4Å; A46-L49 PolarHBondContact O-N 3.3Å
47L93.9Very high93.5Very high77 Ų7744.3 Ų44.340%0.40325%0.25SS..Hα-helixtrans-63.7-40.4175.1-69.1175.8000111.4I43 L44 F45 L49 S50 V311I43-L47 HydrophobicContact CG2-CD1 3.96Å; I43-L47 HydrophobicContact CG2-CG 4.31Å; I43-L47 WeakPolarHBondContact O-CG 3.32Å; I43-L47 PolarHBondContact O-N 2.89Å; L44-L47 PolarHBondContact O-N 2.86Å; F45-L47 PolarHBondContact O-N 2.97Å; L47-L49 VanDerWaalsContact C-N 3.26Å; L47-L49 PolarHBondContact O-N 3.18Å; L47-S50 WeakPolarHBondContact O-CB 3.43Å; L47-S50 PolarHBondContact O-N 3.4Å; L47-S50 PolarHBondContact O-OG 3.32Å; L47-V311 HydrophobicContact CB-CB 4.08Å; L47-V311 HydrophobicContact CB-CG1 4.47Å; L47-V311 HydrophobicContact CB-CG2 4.35Å; L47-V311 HydrophobicContact CD1-CG2 4.45Å
48G93.2Very high92.9Very high0 Ų044.3 Ų44.30%025%0.25CS..Hα-helixtrans-64.8-25.9179.700000113.7L44 F45 A46 S50 N51 I83L44-G48 WeakPolarHBondContact O-CA 3.39Å; L44-G48 PolarHBondContact O-N 3.09Å; F45-G48 PolarHBondContact O-N 3.12Å; A46-G48 VanDerWaalsContact C-N 3.31Å; A46-G48 PolarHBondContact O-N 2.89Å; G48-S50 PolarHBondContact O-N 3.35Å; G48-N51 VanDerWaalsContact O-CB 3.27Å; G48-N51 WeakPolarHBondContact O-CB 3.39Å; G48-N51 PolarHBondContact O-N 3.07Å; G48-I83 WeakPolarHBondContact O-CD1 3.5Å
49L93Very high92.4Very high70 Ų7047.7 Ų47.737%0.36627%0.266SS..Hα-helixtrans-54.8-25.6173.9-67176.7000112.1F45 A46 L47 N51 V52 L53F45-L49 HydrophobicContact CE1-CD1 4.5Å; F45-L49 HydrophobicContact CE1-CD2 4.3Å; F45-L49 HydrophobicContact CZ-CD2 4.08Å; F45-L49 WeakPolarHBondContact O-CG 3.05Å; F45-L49 PolarHBondContact O-N 2.88Å; A46-L49 WeakPolarHBondContact O-CB 3.4Å; A46-L49 PolarHBondContact O-N 3.3Å; L47-L49 VanDerWaalsContact C-N 3.26Å; L47-L49 PolarHBondContact O-N 3.18Å; L49-N51 PolarHBondContact O-N 3.46Å; L49-V52 HydrophobicContact CD2-CG2 4.29Å; L49-V52 VanDerWaalsContact O-CB 3.27Å; L49-V52 WeakPolarHBondContact O-CB 3.39Å; L49-V52 PolarHBondContact O-N 2.79Å; L49-L53 WeakPolarHBondContact O-CD1 3.19Å; L49-L53 PolarHBondContact O-N 2.85Å
50S90Very high91.9Very high36 Ų3650.4 Ų50.425%0.25228%0.278SS..Hα-helixtrans-57-31.1171.6670000113.9L47 G48 L53 I54 P314L47-S50 WeakPolarHBondContact O-CB 3.43Å; L47-S50 PolarHBondContact O-N 3.4Å; L47-S50 PolarHBondContact O-OG 3.32Å; G48-S50 PolarHBondContact O-N 3.35Å; S50-L53 PolarHBondContact O-N 2.92Å; S50-I54 WeakPolarHBondContact O-CG1 3.32Å; S50-I54 PolarHBondContact O-N 2.96Å; S50-I54 VanDerWaalsContact O-N 3.14Å; S50-P314 WeakPolarHBondContact OG-CB 3.36Å; S50-P314 WeakPolarHBondContact OG-CG 3.39Å
51N91.5Very high91.3Very high3 Ų353.3 Ų53.32%0.01629%0.285CS..Hα-helixtrans-64.6-41.5172.2-76.4-53.3000111.5G48 L49 L53 I54 T55 D79 T80 C310 P314G48-N51 VanDerWaalsContact O-CB 3.27Å; G48-N51 WeakPolarHBondContact O-CB 3.39Å; G48-N51 PolarHBondContact O-N 3.07Å; L49-N51 PolarHBondContact O-N 3.46Å; N51-L53 VanDerWaalsContact C-N 3.32Å; N51-L53 PolarHBondContact O-N 2.86Å; N51-I54 WeakPolarHBondContact O-CB 3.33Å; N51-I54 PolarHBondContact O-N 3.26Å; N51-I54 VanDerWaalsContact O-N 3.12Å; N51-T55 PolarHBondContact O-N 3.39Å; N51-T55 PolarHBondContact O-OG1 3.22Å; N51-D79 HydrophobicContact CB-CB 4.32Å; N51-D79 WeakPolarHBondContact ND2-CB 3.39Å; N51-T80 WeakPolarHBondContact CB-OG1 3.4Å; N51-C310 PolarHBondContact ND2-O 3.44Å; N51-P314 HydrophobicContact CB-CG 4.44Å; N51-P314 VanDerWaalsContact CG-CG 3.46Å; N51-P314 WeakPolarHBondContact OD1-CD 3.24Å; N51-P314 WeakPolarHBondContact OD1-CG 3.48Å
52V91.3Very high90.6Very high37 Ų3760.9 Ų60.922%0.22432%0.318CS..Hα-helixtrans-57.9-47175.9-177.70000110.2L49 I54 T55 L56 T80L49-V52 HydrophobicContact CD2-CG2 4.29Å; L49-V52 VanDerWaalsContact O-CB 3.27Å; L49-V52 WeakPolarHBondContact O-CB 3.39Å; L49-V52 PolarHBondContact O-N 2.79Å; V52-I54 VanDerWaalsContact C-N 3.29Å; V52-I54 PolarHBondContact O-N 3.44Å; V52-T55 PolarHBondContact O-N 2.94Å; V52-L56 HydrophobicContact CG1-CD1 3.9Å; V52-L56 HydrophobicContact CG1-CG 4.24Å; V52-L56 WeakPolarHBondContact O-CB 3.25Å; V52-L56 WeakPolarHBondContact O-CG 3.34Å; V52-L56 PolarHBondContact O-N 2.77Å; V52-T80 HydrophobicContact CG2-CG2 3.6Å; V52-T80 PolarHBondContact N-OG1 3.49Å
53L89.7Confident89.7Confident117 Ų11760.7 Ų60.761%0.61331%0.312SS*.Hα-helixtrans-59.8-40.9178.2-78.980.3000111.5L49 S50 N51 F57L49-L53 WeakPolarHBondContact O-CD1 3.19Å; L49-L53 PolarHBondContact O-N 2.85Å; S50-L53 PolarHBondContact O-N 2.92Å; N51-L53 VanDerWaalsContact C-N 3.32Å; N51-L53 PolarHBondContact O-N 2.86Å; L53-F57 WeakPolarHBondContact O-CB 3.35Å; L53-F57 PolarHBondContact O-N 3.03Å
54I87.9Confident88.8Confident12 Ų1260.2 Ų60.26%0.06231%0.307CS..Hα-helixtrans-66.3-47.8177.3-71.5165.5000111.2S50 N51 V52 F57 I58 I72 P314 F324S50-I54 WeakPolarHBondContact O-CG1 3.32Å; S50-I54 PolarHBondContact O-N 2.96Å; S50-I54 VanDerWaalsContact O-N 3.14Å; N51-I54 WeakPolarHBondContact O-CB 3.33Å; N51-I54 PolarHBondContact O-N 3.26Å; N51-I54 VanDerWaalsContact O-N 3.12Å; V52-I54 VanDerWaalsContact C-N 3.29Å; V52-I54 PolarHBondContact O-N 3.44Å; I54-F57 PolarHBondContact O-N 3.12Å; I54-I58 HydrophobicContact CG2-CD1 3.87Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 3.43Å; I54-I72 HydrophobicContact CG2-CG2 4.08Å; I54-P314 HydrophobicContact CD1-CB 3.5Å; I54-P314 HydrophobicContact CD1-CG 3.67Å; I54-F324 HydrophobicContact CD1-CE2 4.31Å; I54-F324 HydrophobicContact CD1-CZ 3.87Å; I54-F324 HydrophobicContact CG1-CE2 3.94Å; I54-F324 HydrophobicContact CG1-CZ 3.68Å
55T88.5Confident87.9Confident10 Ų1063.5 Ų63.56%0.06133%0.327CS..Hα-helixtrans-57.4-51.9178.1-57.70000110.5N51 V52 F57 I58 I59 L73 S76 L77N51-T55 PolarHBondContact O-N 3.39Å; N51-T55 PolarHBondContact O-OG1 3.22Å; V52-T55 PolarHBondContact O-N 2.94Å; T55-F57 PolarHBondContact O-N 2.9Å; T55-I58 PolarHBondContact O-N 2.97Å; T55-I59 HydrophobicContact CG2-CD1 3.8Å; T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.47Å; T55-I59 PolarHBondContact O-N 3.47Å; T55-I59 VanDerWaalsContact O-N 3.08Å; T55-L73 HydrophobicContact CG2-CD1 3.86Å; T55-S76 VanDerWaalsContact OG1-C 3.31Å; T55-S76 VanDerWaalsContact OG1-CB 3.26Å; T55-S76 WeakPolarHBondContact OG1-CB 3.5Å; T55-S76 PolarHBondContact OG1-O 3Å; T55-S76 PolarHBondContact OG1-OG 3.39Å; T55-L77 HydrophobicContact CG2-CB 4.49Å; T55-L77 HydrophobicContact CG2-CD1 4.35Å
56L89.4Confident87.3Confident90 Ų9063.1 Ų63.147%0.47133%0.329SS..Hα-helixtrans-61.4-44.4177.9-70178.8000111.9V52 I58 I59 L60V52-L56 HydrophobicContact CG1-CD1 3.9Å; V52-L56 HydrophobicContact CG1-CG 4.24Å; V52-L56 WeakPolarHBondContact O-CB 3.25Å; V52-L56 WeakPolarHBondContact O-CG 3.34Å; V52-L56 PolarHBondContact O-N 2.77Å; L56-I58 PolarHBondContact O-N 2.93Å; L56-I59 PolarHBondContact O-N 2.84Å; L56-L60 HydrophobicContact CB-CD1 4.38Å; L56-L60 VanDerWaalsContact O-CB 3.26Å; L56-L60 WeakPolarHBondContact O-CB 3.4Å; L56-L60 VanDerWaalsContact O-CG 3.22Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 3.28Å
57F86.4Confident86.9Confident63 Ų6360.8 Ų60.828%0.27631%0.309SS..Hα-helixtrans-57.6-47.8178.2175.5-91.9000111.7L53 I54 T55 R61 V63 V327L53-F57 WeakPolarHBondContact O-CB 3.35Å; L53-F57 PolarHBondContact O-N 3.03Å; I54-F57 PolarHBondContact O-N 3.12Å; T55-F57 PolarHBondContact O-N 2.9Å; F57-R61 HydrophobicContact CD2-CG 3.99Å; F57-R61 HydrophobicContact CE2-CG 3.82Å; F57-R61 HydrophobicContact CG-CG 4.47Å; F57-R61 HydrophobicContact CZ-CG 4.15Å; F57-R61 WeakPolarHBondContact O-CB 3.42Å; F57-R61 VanDerWaalsContact O-CG 3.24Å; F57-R61 WeakPolarHBondContact O-CG 3.25Å; F57-R61 PolarHBondContact O-N 3.42Å; F57-V63 HydrophobicContact CE1-CG2 4.47Å; F57-V327 HydrophobicContact CD2-CG1 4.49Å; F57-V327 HydrophobicContact CE1-CG1 4.01Å; F57-V327 HydrophobicContact CE2-CG1 3.57Å; F57-V327 HydrophobicContact CZ-CG1 3.3Å
58I81.9Confident86.7Confident10 Ų1058 Ų585%0.05130%0.295CS..Hα-helixtrans-65.4-43.3-178.4-65168.8000110.9I54 T55 L56 K62 V63 F64 I72 L73I54-I58 HydrophobicContact CG2-CD1 3.87Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 3.43Å; T55-I58 PolarHBondContact O-N 2.97Å; L56-I58 PolarHBondContact O-N 2.93Å; I58-K62 WeakPolarHBondContact O-CA 3.22Å; I58-K62 PolarHBondContact O-N 2.83Å; I58-K62 VanDerWaalsContact O-N 3.07Å; I58-V63 HydrophobicContact CG2-CB 4.47Å; I58-V63 PolarHBondContact O-N 3.47Å; I58-F64 HydrophobicContact CG2-CE1 4.43Å; I58-I72 HydrophobicContact CD1-CB 4.46Å; I58-I72 HydrophobicContact CD1-CG2 3.87Å; I58-L73 HydrophobicContact CB-CD1 4.26Å; I58-L73 HydrophobicContact CD1-CB 4.21Å; I58-L73 HydrophobicContact CG2-CB 4.09Å; I58-L73 HydrophobicContact CG2-CD1 4.3Å; I58-L73 HydrophobicContact CG2-CD2 4.26Å; I58-L73 HydrophobicContact CG2-CG 4.47Å
59I87.1Confident86.4Confident78 Ų7859.6 Ų59.640%0.430%0.304SS..Hα-helixtrans-65.5-56-179.8-67.6170.9000110.7T55 L56 R61 K62 L73T55-I59 HydrophobicContact CG2-CD1 3.8Å; T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.47Å; T55-I59 PolarHBondContact O-N 3.47Å; T55-I59 VanDerWaalsContact O-N 3.08Å; L56-I59 PolarHBondContact O-N 2.84Å; I59-R61 VanDerWaalsContact C-N 3.31Å; I59-R61 PolarHBondContact O-N 3.42Å; I59-K62 PolarHBondContact O-N 3.21Å; I59-L73 HydrophobicContact CD1-CD1 4.14Å; I59-L73 HydrophobicContact CG1-CD1 3.86Å; I59-L73 HydrophobicContact CG1-CD2 4.36Å
60L87.1Confident86.3Confident132 Ų13256.8 Ų56.869%0.69129%0.289SS*.Hα-helixtrans-64.4-36.2-175.2-66.2175.2000112L56 K62L56-L60 HydrophobicContact CB-CD1 4.38Å; L56-L60 VanDerWaalsContact O-CB 3.26Å; L56-L60 WeakPolarHBondContact O-CB 3.4Å; L56-L60 VanDerWaalsContact O-CG 3.22Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 3.28Å; L60-K62 VanDerWaalsContact C-N 3.3Å
61R84Confident86.5Confident118 Ų11855.3 Ų55.345%0.44528%0.278SS..THydrogen-bonded Turntrans-86.90.7177.5-57.1-63.4-116-156.2-4.7113.2F57 I59 V63F57-R61 HydrophobicContact CD2-CG 3.99Å; F57-R61 HydrophobicContact CE2-CG 3.82Å; F57-R61 HydrophobicContact CG-CG 4.47Å; F57-R61 HydrophobicContact CZ-CG 4.15Å; F57-R61 WeakPolarHBondContact O-CB 3.42Å; F57-R61 VanDerWaalsContact O-CG 3.24Å; F57-R61 WeakPolarHBondContact O-CG 3.25Å; F57-R61 PolarHBondContact O-N 3.42Å; I59-R61 VanDerWaalsContact C-N 3.31Å; I59-R61 PolarHBondContact O-N 3.42Å; R61-V63 HydrophobicContact CB-CG2 3.49Å; R61-V63 VanDerWaalsContact CB-CG2 3.49Å; R61-V63 WeakPolarHBondContact O-CG2 3.03Å; R61-V63 PolarHBondContact O-N 3.27Å
62K82.7Confident86.5Confident164 Ų16456.5 Ų56.571%0.71328%0.284SS*.THydrogen-bonded Turntrans49.343.2-179-59.1-177.3179.2-179.20113I58 I59 L60 F64I58-K62 WeakPolarHBondContact O-CA 3.22Å; I58-K62 PolarHBondContact O-N 2.83Å; I58-K62 VanDerWaalsContact O-N 3.07Å; I59-K62 PolarHBondContact O-N 3.21Å; L60-K62 VanDerWaalsContact C-N 3.3Å; K62-F64 VanDerWaalsContact C-CD2 3.5Å; K62-F64 HydrophobicContact CB-CD2 4.17Å; K62-F64 HydrophobicContact CB-CE2 4.13Å; K62-F64 HydrophobicContact CG-CE2 4.45Å; K62-F64 PolarHBondContact O-N 2.78Å
63V79.1Confident86.5Confident42 Ų4255.7 Ų55.726%0.25528%0.278SS..  trans-83.244.6-171.1-176.20000111.7F57 I58 R61 T65 N69F57-V63 HydrophobicContact CE1-CG2 4.47Å; I58-V63 HydrophobicContact CG2-CB 4.47Å; I58-V63 PolarHBondContact O-N 3.47Å; R61-V63 HydrophobicContact CB-CG2 3.49Å; R61-V63 VanDerWaalsContact CB-CG2 3.49Å; R61-V63 WeakPolarHBondContact O-CG2 3.03Å; R61-V63 PolarHBondContact O-N 3.27Å; V63-T65 PolarHBondContact O-N 3.36Å; V63-N69 VanDerWaalsContact CG1-ND2 3.27Å; V63-N69 WeakPolarHBondContact CG1-ND2 3.32Å; V63-N69 WeakPolarHBondContact O-CB 3.32Å; V63-N69 PolarHBondContact O-ND2 2.86Å
64F78.7Confident86.8Confident83 Ų8351.2 Ų51.236%0.36426%0.255SS..THydrogen-bonded Turntrans-85.624.5-178.9-51.7-80.4000113.6I58 K62 L73I58-F64 HydrophobicContact CG2-CE1 4.43Å; K62-F64 VanDerWaalsContact C-CD2 3.5Å; K62-F64 HydrophobicContact CB-CD2 4.17Å; K62-F64 HydrophobicContact CB-CE2 4.13Å; K62-F64 HydrophobicContact CG-CE2 4.45Å; K62-F64 PolarHBondContact O-N 2.78Å; F64-L73 HydrophobicContact CD1-CD2 4.19Å; F64-L73 HydrophobicContact CE1-CD2 3.38Å; F64-L73 HydrophobicContact CZ-CD2 4.24Å
65T77.1Confident87.2Confident79 Ų7950.8 Ų50.849%0.48525%0.253SS..THydrogen-bonded Turntrans-79.4-21-16951.70000113.8V63 R146V63-T65 PolarHBondContact O-N 3.36Å; T65-R146 WeakPolarHBondContact O-CD 3.29Å
66T84.5Confident87.4Confident44 Ų4450.5 Ų50.527%0.2725%0.251SS..SBendtrans-126.2153.6-177710000111.2T68 N69 I70T66-T68 VanDerWaalsContact C-N 3.31Å; T66-T68 PolarHBondContact O-N 3.07Å; T66-N69 PolarHBondContact O-N 2.96Å; T66-N69 VanDerWaalsContact O-N 3.13Å; T66-N69 PolarHBondContact OG1-N 3.46Å; T66-N69 VanDerWaalsContact OG1-N 3.12Å; T66-N69 PolarHBondContact OG1-ND2 2.98Å; T66-N69 VanDerWaalsContact OG1-ND2 3.08Å; T66-N69 PolarHBondContact OG1-OD1 3.35Å; T66-I70 PolarHBondContact O-N 2.74Å
67V88.9Confident87.7Confident11 Ų1149.4 Ų49.47%0.06725%0.246CC..Hα-helixtrans-55.4-49.1174170.60000110.2N69 I70 L71 D129 K145 A149V67-N69 VanDerWaalsContact C-N 3.31Å; V67-N69 PolarHBondContact O-N 3.38Å; V67-I70 WeakPolarHBondContact O-CB 3.32Å; V67-I70 PolarHBondContact O-N 2.94Å; V67-I70 VanDerWaalsContact O-N 3.17Å; V67-L71 HydrophobicContact CG1-CD1 3.99Å; V67-L71 HydrophobicContact CG1-CG 4.4Å; V67-L71 WeakPolarHBondContact O-CG 3.29Å; V67-L71 PolarHBondContact O-N 3.06Å; V67-D129 WeakPolarHBondContact CG1-OD1 3.14Å; V67-K145 HydrophobicContact CG2-CB 4.04Å; V67-A149 HydrophobicContact CB-CB 4.45Å; V67-A149 HydrophobicContact CG1-CB 3.87Å; V67-A149 HydrophobicContact CG2-CB 4.38Å
68T87.6Confident88.2Confident19 Ų1946.4 Ų46.412%0.11723%0.232CC..Hα-helixtrans-44.7-51.4171-700000113.2T66 I70 L71 I72 D129 R130T66-T68 VanDerWaalsContact C-N 3.31Å; T66-T68 PolarHBondContact O-N 3.07Å; T68-I70 VanDerWaalsContact C-N 3.31Å; T68-I70 PolarHBondContact O-N 3.09Å; T68-L71 PolarHBondContact O-N 3.33Å; T68-I72 HydrophobicContact CG2-CD1 3.49Å; T68-I72 VanDerWaalsContact CG2-CD1 3.49Å; T68-I72 HydrophobicContact CG2-CG1 4.11Å; T68-I72 WeakPolarHBondContact O-CB 3.39Å; T68-I72 WeakPolarHBondContact O-CG1 3.33Å; T68-I72 PolarHBondContact O-N 3.31Å; T68-D129 PolarHBondContact OG1-OD2 3.18Å; T68-R130 PolarHBondContact OG1-NH1 3.19Å; T68-R130 PolarHBondContact OG1-NH2 3.34Å
69N87.6Confident88.9Confident34 Ų3445.9 Ų45.918%0.18223%0.23CC..Hα-helixtrans-68.5-33.7-173.2-64.8-16.4000112.1V63 T66 V67 L73V63-N69 VanDerWaalsContact CG1-ND2 3.27Å; V63-N69 WeakPolarHBondContact CG1-ND2 3.32Å; V63-N69 WeakPolarHBondContact O-CB 3.32Å; V63-N69 PolarHBondContact O-ND2 2.86Å; T66-N69 PolarHBondContact O-N 2.96Å; T66-N69 VanDerWaalsContact O-N 3.13Å; T66-N69 PolarHBondContact OG1-N 3.46Å; T66-N69 VanDerWaalsContact OG1-N 3.12Å; T66-N69 PolarHBondContact OG1-ND2 2.98Å; T66-N69 VanDerWaalsContact OG1-ND2 3.08Å; T66-N69 PolarHBondContact OG1-OD1 3.35Å; V67-N69 VanDerWaalsContact C-N 3.31Å; V67-N69 PolarHBondContact O-N 3.38Å; N69-L73 WeakPolarHBondContact O-CB 3.46Å; N69-L73 PolarHBondContact O-N 3.07Å
70I91.4Very high89.3Confident10 Ų1043 Ų435%0.05122%0.216CC..Hα-helixtrans-64.1-44.3174-64.3162.3000109.7T66 V67 T68 L73 N74 R146 A149 V150T66-I70 PolarHBondContact O-N 2.74Å; V67-I70 WeakPolarHBondContact O-CB 3.32Å; V67-I70 PolarHBondContact O-N 2.94Å; V67-I70 VanDerWaalsContact O-N 3.17Å; T68-I70 VanDerWaalsContact C-N 3.31Å; T68-I70 PolarHBondContact O-N 3.09Å; I70-L73 PolarHBondContact O-N 3.37Å; I70-N74 PolarHBondContact O-N 2.95Å; I70-N74 PolarHBondContact O-ND2 3.38Å; I70-R146 HydrophobicContact CD1-CB 4.06Å; I70-R146 HydrophobicContact CD1-CG 4.28Å; I70-A149 HydrophobicContact CD1-CB 4.36Å; I70-A149 HydrophobicContact CG2-CB 4.25Å; I70-V150 HydrophobicContact CD1-CG2 4.21Å; I70-V150 HydrophobicContact CG2-CG2 4.13Å
71L93.3Very high89.7Confident5 Ų539 Ų393%0.02620%0.197CC..Hα-helixtrans-70-42.7179-63.2178.1000112.7V67 T68 L73 N74 L75 F122 L125 L126 D129V67-L71 HydrophobicContact CG1-CD1 3.99Å; V67-L71 HydrophobicContact CG1-CG 4.4Å; V67-L71 WeakPolarHBondContact O-CG 3.29Å; V67-L71 PolarHBondContact O-N 3.06Å; T68-L71 PolarHBondContact O-N 3.33Å; L71-L73 VanDerWaalsContact C-N 3.29Å; L71-L73 PolarHBondContact O-N 3.02Å; L71-N74 PolarHBondContact O-N 3.5Å; L71-L75 WeakPolarHBondContact O-CB 3.34Å; L71-L75 PolarHBondContact O-N 3.16Å; L71-F122 HydrophobicContact CD2-CD1 4.25Å; L71-L125 HydrophobicContact CD1-CB 3.93Å; L71-L125 HydrophobicContact CD2-CB 3.91Å; L71-L125 HydrophobicContact CD2-CD1 3.67Å; L71-L125 HydrophobicContact CD2-CG 4.47Å; L71-L126 HydrophobicContact CB-CD1 4.5Å; L71-L126 HydrophobicContact CB-CD2 3.54Å; L71-L126 HydrophobicContact CB-CG 3.82Å; L71-L126 HydrophobicContact CD1-CD2 4.11Å; L71-L126 HydrophobicContact CD1-CG 4.31Å; L71-D129 HydrophobicContact CD1-CB 4.09Å
72I91.6Very high90.3Very high28 Ų2833.6 Ų33.614%0.14418%0.177CC..Hα-helixtrans-61.9-39.6175.3-70.4176.9000110.5I54 I58 T68 L75 S76 L126 Y317I54-I72 HydrophobicContact CG2-CG2 4.08Å; I58-I72 HydrophobicContact CD1-CB 4.46Å; I58-I72 HydrophobicContact CD1-CG2 3.87Å; T68-I72 HydrophobicContact CG2-CD1 3.49Å; T68-I72 VanDerWaalsContact CG2-CD1 3.49Å; T68-I72 HydrophobicContact CG2-CG1 4.11Å; T68-I72 WeakPolarHBondContact O-CB 3.39Å; T68-I72 WeakPolarHBondContact O-CG1 3.33Å; T68-I72 PolarHBondContact O-N 3.31Å; I72-L75 PolarHBondContact O-N 2.9Å; I72-S76 WeakPolarHBondContact O-CB 3.33Å; I72-S76 PolarHBondContact O-N 2.96Å; I72-S76 PolarHBondContact O-OG 3.41Å; I72-S76 VanDerWaalsContact O-OG 3.1Å; I72-L126 HydrophobicContact CG1-CD1 4.33Å; I72-L126 HydrophobicContact CG1-CD2 3.89Å; I72-Y317 HydrophobicContact CD1-CD1 4.06Å; I72-Y317 HydrophobicContact CD1-CE1 4.12Å; I72-Y317 HydrophobicContact CG1-CE1 4.3Å
73L92.2Very high90.9Very high20 Ų2025.8 Ų25.811%0.10514%0.143CC..Hα-helixtrans-59-52.4175.6173.962.5000111T55 I58 I59 F64 N69 I70 L71 L75 S76 L77T55-L73 HydrophobicContact CG2-CD1 3.86Å; I58-L73 HydrophobicContact CB-CD1 4.26Å; I58-L73 HydrophobicContact CD1-CB 4.21Å; I58-L73 HydrophobicContact CG2-CB 4.09Å; I58-L73 HydrophobicContact CG2-CD1 4.3Å; I58-L73 HydrophobicContact CG2-CD2 4.26Å; I58-L73 HydrophobicContact CG2-CG 4.47Å; I59-L73 HydrophobicContact CD1-CD1 4.14Å; I59-L73 HydrophobicContact CG1-CD1 3.86Å; I59-L73 HydrophobicContact CG1-CD2 4.36Å; F64-L73 HydrophobicContact CD1-CD2 4.19Å; F64-L73 HydrophobicContact CE1-CD2 3.38Å; F64-L73 HydrophobicContact CZ-CD2 4.24Å; N69-L73 WeakPolarHBondContact O-CB 3.46Å; N69-L73 PolarHBondContact O-N 3.07Å; I70-L73 PolarHBondContact O-N 3.37Å; L71-L73 VanDerWaalsContact C-N 3.29Å; L71-L73 PolarHBondContact O-N 3.02Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 2.8Å; L73-S76 PolarHBondContact O-N 3.38Å; L73-S76 PolarHBondContact O-OG 3.18Å; L73-L77 WeakPolarHBondContact O-CB 3.25Å; L73-L77 PolarHBondContact O-N 3.26Å
74N95.8Very high91.7Very high24 Ų2428.1 Ų28.113%0.12815%0.152CC..Hα-helixtrans-62.9-39-179-80.1-84.2000112.3I70 L71 L77 A78 F122 W157I70-N74 PolarHBondContact O-N 2.95Å; I70-N74 PolarHBondContact O-ND2 3.38Å; L71-N74 PolarHBondContact O-N 3.5Å; N74-L77 PolarHBondContact O-N 2.88Å; N74-A78 WeakPolarHBondContact O-CB 3.44Å; N74-A78 PolarHBondContact O-N 3.4Å; N74-F122 HydrophobicContact CB-CD1 3.72Å; N74-F122 HydrophobicContact CB-CD2 3.86Å; N74-F122 HydrophobicContact CB-CE1 3.44Å; N74-F122 VanDerWaalsContact CB-CE1 3.44Å; N74-F122 HydrophobicContact CB-CE2 3.61Å; N74-F122 HydrophobicContact CB-CG 3.96Å; N74-F122 HydrophobicContact CB-CZ 3.42Å; N74-F122 VanDerWaalsContact CB-CZ 3.42Å; N74-W157 PolarHBondContact OD1-NE1 3.36Å
75L95.4Very high92.6Very high3 Ų325.6 Ų25.62%0.01614%0.141CC..Hα-helixtrans-58.8-53.6171.9177.958.8000111.3L71 I72 L73 L77 A78 D79 S119 F122 I123 L126 N313 Y317L71-L75 WeakPolarHBondContact O-CB 3.34Å; L71-L75 PolarHBondContact O-N 3.16Å; I72-L75 PolarHBondContact O-N 2.9Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 2.8Å; L75-L77 VanDerWaalsContact C-N 3.25Å; L75-L77 PolarHBondContact O-N 3.48Å; L75-A78 PolarHBondContact O-N 3.48Å; L75-D79 VanDerWaalsContact O-CG 3.3Å; L75-D79 PolarHBondContact O-N 2.91Å; L75-S119 WeakPolarHBondContact CD1-O 3.34Å; L75-S119 VanDerWaalsContact CD1-OG 3.26Å; L75-S119 WeakPolarHBondContact CD1-OG 3.42Å; L75-F122 HydrophobicContact CB-CB 3.85Å; L75-F122 HydrophobicContact CD1-CB 4.2Å; L75-I123 HydrophobicContact CD1-CD1 4.34Å; L75-I123 HydrophobicContact CD1-CG1 3.84Å; L75-I123 HydrophobicContact CD2-CG1 3.99Å; L75-L126 HydrophobicContact CB-CD1 4.37Å; L75-L126 HydrophobicContact CD2-CD1 3.56Å; L75-N313 HydrophobicContact CD2-CB 4.45Å; L75-Y317 HydrophobicContact CD2-CE2 3.95Å
76S94.4Very high93.5Very high3 Ų321.9 Ų21.92%0.02112%0.118CC..Hα-helixtrans-63.5-32-179.366.80000112.7T55 I72 L73 T80T55-S76 VanDerWaalsContact OG1-C 3.31Å; T55-S76 VanDerWaalsContact OG1-CB 3.26Å; T55-S76 WeakPolarHBondContact OG1-CB 3.5Å; T55-S76 PolarHBondContact OG1-O 3Å; T55-S76 PolarHBondContact OG1-OG 3.39Å; I72-S76 WeakPolarHBondContact O-CB 3.33Å; I72-S76 PolarHBondContact O-N 2.96Å; I72-S76 PolarHBondContact O-OG 3.41Å; I72-S76 VanDerWaalsContact O-OG 3.1Å; L73-S76 PolarHBondContact O-N 3.38Å; L73-S76 PolarHBondContact O-OG 3.18Å; S76-T80 WeakPolarHBondContact O-CB 3.47Å; S76-T80 PolarHBondContact O-N 3.4Å; S76-T80 PolarHBondContact O-OG1 2.83Å
77L95.4Very high94.1Very high67 Ų6722.4 Ų22.435%0.35112%0.122SC..Hα-helixtrans-68-47.3174.9178.163.5000110.6T55 L73 N74 L75 T80 V81T55-L77 HydrophobicContact CG2-CB 4.49Å; T55-L77 HydrophobicContact CG2-CD1 4.35Å; L73-L77 WeakPolarHBondContact O-CB 3.25Å; L73-L77 PolarHBondContact O-N 3.26Å; N74-L77 PolarHBondContact O-N 2.88Å; L75-L77 VanDerWaalsContact C-N 3.25Å; L75-L77 PolarHBondContact O-N 3.48Å; L77-T80 PolarHBondContact O-N 2.97Å; L77-V81 HydrophobicContact CD1-CG2 4.32Å; L77-V81 WeakPolarHBondContact O-CG2 3.29Å; L77-V81 PolarHBondContact O-N 3.48Å
78A97.1Very high94.5Very high0 Ų024.5 Ų24.50%013%0.131CC..Hα-helixtrans-59.2-50.6174.900000111N74 L75 T80 V81 F82 T115 A118 W157N74-A78 WeakPolarHBondContact O-CB 3.44Å; N74-A78 PolarHBondContact O-N 3.4Å; L75-A78 PolarHBondContact O-N 3.48Å; A78-T80 VanDerWaalsContact C-N 3.29Å; A78-T80 PolarHBondContact O-N 3.5Å; A78-V81 PolarHBondContact O-N 2.76Å; A78-F82 WeakPolarHBondContact O-CB 3.26Å; A78-F82 PolarHBondContact O-N 2.95Å; A78-T115 WeakPolarHBondContact O-CB 3.46Å; A78-A118 HydrophobicContact CB-CB 4.02Å; A78-W157 HydrophobicContact CB-CH2 3.74Å; A78-W157 HydrophobicContact CB-CZ2 4.02Å
79D95.9Very high94.9Very high0 Ų024 Ų240%013%0.127CC..Hα-helixtrans-61.2-38.3179.1-66.2-19.1000111.9N51 L75 F82 I83 S119 C310 N313N51-D79 HydrophobicContact CB-CB 4.32Å; N51-D79 WeakPolarHBondContact ND2-CB 3.39Å; L75-D79 VanDerWaalsContact O-CG 3.3Å; L75-D79 PolarHBondContact O-N 2.91Å; D79-F82 PolarHBondContact O-N 2.94Å; D79-I83 WeakPolarHBondContact O-CG1 3.26Å; D79-I83 WeakPolarHBondContact O-CG2 3.31Å; D79-I83 PolarHBondContact O-N 3.07Å; D79-I83 VanDerWaalsContact O-N 3.11Å; D79-S119 WeakPolarHBondContact OD1-CB 3.27Å; D79-S119 PolarHBondContact OD1-OG 3.46Å; D79-C310 HydrophobicContact CB-CB 3.97Å; D79-C310 WeakPolarHBondContact OD1-CB 3.44Å; D79-N313 PolarHBondContact OD2-ND2 3.26Å
80T95.1Very high95.3Very high17 Ų1723.8 Ų23.810%0.10413%0.126CC..Hα-helixtrans-63.5-52.3175.8-670000111.4N51 V52 S76 L77 A78 F82 I83 M84N51-T80 WeakPolarHBondContact CB-OG1 3.4Å; V52-T80 HydrophobicContact CG2-CG2 3.6Å; V52-T80 PolarHBondContact N-OG1 3.49Å; S76-T80 WeakPolarHBondContact O-CB 3.47Å; S76-T80 PolarHBondContact O-N 3.4Å; S76-T80 PolarHBondContact O-OG1 2.83Å; L77-T80 PolarHBondContact O-N 2.97Å; A78-T80 VanDerWaalsContact C-N 3.29Å; A78-T80 PolarHBondContact O-N 3.5Å; T80-F82 PolarHBondContact O-N 3.48Å; T80-I83 WeakPolarHBondContact O-CG1 3.46Å; T80-I83 PolarHBondContact O-N 3.24Å; T80-M84 HydrophobicContact CG2-CG 4.24Å; T80-M84 WeakPolarHBondContact O-CG 3.43Å; T80-M84 PolarHBondContact O-N 3.41Å; T80-M84 VanDerWaalsContact O-N 3.09Å
81V96.3Very high95.6Very high49 Ų4924.7 Ų24.730%0.29713%0.133SC..Hα-helixtrans-62.9-36.7-179.2177.70000110.3L77 A78 M84 F85 T115L77-V81 HydrophobicContact CD1-CG2 4.32Å; L77-V81 WeakPolarHBondContact O-CG2 3.29Å; L77-V81 PolarHBondContact O-N 3.48Å; A78-V81 PolarHBondContact O-N 2.76Å; V81-M84 PolarHBondContact O-N 3.1Å; V81-F85 HydrophobicContact CG1-CE2 4.4Å; V81-F85 WeakPolarHBondContact O-CD2 3.5Å; V81-T115 HydrophobicContact CB-CG2 3.78Å; V81-T115 HydrophobicContact CG1-CG2 3.68Å
82F96.5Very high95.7Very high3 Ų326 Ų261%0.01314%0.138CC..Hα-helixtrans-60-48.7177-175.6-150.9000112.7A78 D79 T80 M84 E112 T115 K116 P306 Y307 C310A78-F82 WeakPolarHBondContact O-CB 3.26Å; A78-F82 PolarHBondContact O-N 2.95Å; D79-F82 PolarHBondContact O-N 2.94Å; T80-F82 PolarHBondContact O-N 3.48Å; F82-M84 PolarHBondContact O-N 2.81Å; F82-E112 HydrophobicContact CD2-CG 4.39Å; F82-E112 HydrophobicContact CE2-CB 4.44Å; F82-E112 HydrophobicContact CE2-CG 3.85Å; F82-T115 WeakPolarHBondContact CA-OG1 3.03Å; F82-T115 WeakPolarHBondContact CB-OG1 3.03Å; F82-T115 PolarHBondContact N-OG1 3.35Å; F82-K116 HydrophobicContact CD1-CB 4.35Å; F82-K116 HydrophobicContact CD1-CG 4.42Å; F82-K116 HydrophobicContact CD2-CB 4.26Å; F82-K116 HydrophobicContact CE1-CB 4.17Å; F82-K116 HydrophobicContact CE1-CD 4.42Å; F82-K116 HydrophobicContact CE1-CG 3.8Å; F82-K116 HydrophobicContact CE2-CB 4.08Å; F82-K116 HydrophobicContact CE2-CD 4.28Å; F82-K116 HydrophobicContact CE2-CG 4.19Å; F82-K116 HydrophobicContact CG-CB 4.42Å; F82-K116 HydrophobicContact CZ-CB 4.04Å; F82-K116 HydrophobicContact CZ-CD 3.83Å; F82-K116 HydrophobicContact CZ-CG 3.67Å; F82-P306 HydrophobicContact CE1-CB 4.34Å; F82-P306 HydrophobicContact CZ-CB 4.3Å; F82-Y307 HydrophobicContact CD1-CD1 4.2Å; F82-Y307 HydrophobicContact CD1-CE1 4.43Å; F82-Y307 HydrophobicContact CD2-CD1 4.3Å; F82-Y307 AromaticContact CD2-CE1 3.72Å; F82-Y307 HydrophobicContact CD2-CE1 3.72Å; F82-Y307 AromaticContact CE1-CD1 3.64Å; F82-Y307 HydrophobicContact CE1-CD1 3.64Å; F82-Y307 AromaticContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CG 4.01Å; F82-Y307 AromaticContact CE2-CD1 3.75Å; F82-Y307 HydrophobicContact CE2-CD1 3.75Å; F82-Y307 AromaticContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE2 4.13Å; F82-Y307 HydrophobicContact CE2-CG 4.49Å; F82-Y307 AromaticContact CE2-CZ 3.33Å; F82-Y307 WeakPolarHBondContact CE2-OH 3.13Å; F82-Y307 HydrophobicContact CG-CD1 4.49Å; F82-Y307 HydrophobicContact CG-CE1 4.33Å; F82-Y307 AromaticContact CZ-CD1 3.38Å; F82-Y307 HydrophobicContact CZ-CD1 3.38Å; F82-Y307 AromaticContact CZ-CD2 3.97Å; F82-Y307 HydrophobicContact CZ-CD2 3.97Å; F82-Y307 AromaticContact CZ-CE1 3.23Å; F82-Y307 HydrophobicContact CZ-CE1 3.23Å; F82-Y307 AromaticContact CZ-CE2 3.82Å; F82-Y307 HydrophobicContact CZ-CE2 3.82Å; F82-Y307 AromaticContact CZ-CG 3.76Å; F82-Y307 HydrophobicContact CZ-CG 3.76Å; F82-Y307 AromaticContact CZ-CZ 3.45Å; F82-Y307 VanDerWaalsContact CZ-CZ 3.45Å; F82-C310 HydrophobicContact CD1-CB 4.04Å; F82-C310 HydrophobicContact CE1-CB 4.47Å
83I95.7Very high95.8Very high0 Ų027.5 Ų27.50%014%0.142CC..Hα-helixtrans-73.7-24.1-179.264172.9000113.5F45 G48 D79 T80 F85 L86 V311F45-I83 WeakPolarHBondContact CD2-O 3.27Å; G48-I83 WeakPolarHBondContact O-CD1 3.5Å; D79-I83 WeakPolarHBondContact O-CG1 3.26Å; D79-I83 WeakPolarHBondContact O-CG2 3.31Å; D79-I83 PolarHBondContact O-N 3.07Å; D79-I83 VanDerWaalsContact O-N 3.11Å; T80-I83 WeakPolarHBondContact O-CG1 3.46Å; T80-I83 PolarHBondContact O-N 3.24Å; I83-F85 PolarHBondContact O-N 2.93Å; I83-L86 HydrophobicContact CB-CD1 4.2Å; I83-L86 HydrophobicContact CG2-CD1 4.36Å; I83-L86 VanDerWaalsContact O-CB 3.28Å; I83-L86 WeakPolarHBondContact O-CB 3.36Å; I83-L86 WeakPolarHBondContact O-CG 3.43Å; I83-L86 PolarHBondContact O-N 2.85Å; I83-V311 HydrophobicContact CG2-CG1 4.21Å
84M95.8Very high95.9Very high92 Ų9231.5 Ų31.545%0.45316%0.163SC..Hα-helixtrans-63-18.5-174.9-80.5-62.9-65.200112.8F45 T80 V81 F82 P87F45-M84 HydrophobicContact CE2-SD 4.26Å; T80-M84 HydrophobicContact CG2-CG 4.24Å; T80-M84 WeakPolarHBondContact O-CG 3.43Å; T80-M84 PolarHBondContact O-N 3.41Å; T80-M84 VanDerWaalsContact O-N 3.09Å; V81-M84 PolarHBondContact O-N 3.1Å; F82-M84 PolarHBondContact O-N 2.81Å; M84-P87 WeakPolarHBondContact O-CD 2.89Å
85F96Very high95.8Very high30 Ų3036.5 Ų36.513%0.13218%0.183CC..THydrogen-bonded Turntrans-90-6.1175.1-70.2-90000114.8V81 I83 P87 F88 V89 L107 F108 S111V81-F85 HydrophobicContact CG1-CE2 4.4Å; V81-F85 WeakPolarHBondContact O-CD2 3.5Å; I83-F85 PolarHBondContact O-N 2.93Å; F85-P87 VanDerWaalsContact C-CD 3.42Å; F85-P87 VanDerWaalsContact C-N 3.34Å; F85-F88 HydrophobicContact CB-CD2 4.38Å; F85-F88 AromaticContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CE2 4.18Å; F85-F88 WeakPolarHBondContact O-CB 3.13Å; F85-F88 PolarHBondContact O-N 3.33Å; F85-V89 PolarHBondContact O-N 3.48Å; F85-L107 HydrophobicContact CE1-CB 4.2Å; F85-L107 HydrophobicContact CZ-CB 4.33Å; F85-F108 HydrophobicContact CB-CD2 3.66Å; F85-F108 HydrophobicContact CB-CE2 4.18Å; F85-F108 HydrophobicContact CD1-CB 4.06Å; F85-F108 HydrophobicContact CD1-CD2 4.23Å; F85-F108 HydrophobicContact CE1-CB 4.49Å; F85-F108 HydrophobicContact CG-CD2 4.12Å; F85-S111 VanDerWaalsContact CE2-OG 3.25Å; F85-S111 WeakPolarHBondContact CE2-OG 3.24Å; F85-S111 WeakPolarHBondContact CZ-OG 3.42Å
86L96.8Very high95.6Very high0 Ų043.7 Ų43.70%021%0.21CC..Hα-helixtrans-56.4-36.5177.5-73.6-179.5000114.4Y41 L44 F45 I83 F88 V89 I90 Y307Y41-L86 HydrophobicContact CD1-CD2 3.5Å; Y41-L86 HydrophobicContact CE1-CD2 4.09Å; Y41-L86 HydrophobicContact CG-CD2 4.25Å; L44-L86 HydrophobicContact CB-CD1 4.03Å; F45-L86 HydrophobicContact CB-CB 4.21Å; F45-L86 HydrophobicContact CB-CD1 4.04Å; F45-L86 HydrophobicContact CD2-CB 4.26Å; I83-L86 HydrophobicContact CB-CD1 4.2Å; I83-L86 HydrophobicContact CG2-CD1 4.36Å; I83-L86 VanDerWaalsContact O-CB 3.28Å; I83-L86 WeakPolarHBondContact O-CB 3.36Å; I83-L86 WeakPolarHBondContact O-CG 3.43Å; I83-L86 PolarHBondContact O-N 2.85Å; L86-F88 PolarHBondContact O-N 3.38Å; L86-V89 WeakPolarHBondContact O-CB 3.13Å; L86-V89 PolarHBondContact O-N 2.72Å; L86-V89 VanDerWaalsContact O-N 3.13Å; L86-I90 VanDerWaalsContact O-CG1 3.27Å; L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 2.99Å; L86-Y307 HydrophobicContact CD1-CD1 4.1Å; L86-Y307 HydrophobicContact CD2-CD1 3.62Å; L86-Y307 HydrophobicContact CD2-CE1 3.35Å; L86-Y307 HydrophobicContact CD2-CE2 4.46Å; L86-Y307 HydrophobicContact CD2-CG 4.26Å; L86-Y307 HydrophobicContact CG-CD1 4.06Å; L86-Y307 HydrophobicContact CG-CE1 3.97Å
87P97.5Very high95.7Very high56 Ų5645 Ų4536%0.36422%0.218SC..Hα-helixtrans-56.9-36.1173.6-27.637.1000113.8F45 M84 F85 I90 S91F45-P87 HydrophobicContact CD2-CG 4.13Å; F45-P87 HydrophobicContact CE2-CG 3.86Å; F45-P87 HydrophobicContact CZ-CG 4.1Å; M84-P87 WeakPolarHBondContact O-CD 2.89Å; F85-P87 VanDerWaalsContact C-CD 3.42Å; F85-P87 VanDerWaalsContact C-N 3.34Å; P87-I90 PolarHBondContact O-N 3.03Å; P87-S91 WeakPolarHBondContact O-CB 3.23Å; P87-S91 PolarHBondContact O-N 2.81Å
88F97.1Very high95.8Very high55 Ų5542.3 Ų42.324%0.24120%0.204CC..Hα-helixtrans-69.9-40.9176.2-58.3-91.8000111.1F85 L86 S91 F92 W98 F100 I104F85-F88 HydrophobicContact CB-CD2 4.38Å; F85-F88 AromaticContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CE2 4.18Å; F85-F88 WeakPolarHBondContact O-CB 3.13Å; F85-F88 PolarHBondContact O-N 3.33Å; L86-F88 PolarHBondContact O-N 3.38Å; F88-S91 PolarHBondContact O-N 3.22Å; F88-F92 WeakPolarHBondContact O-CB 3.37Å; F88-F92 PolarHBondContact O-N 2.8Å; F88-W98 HydrophobicContact CB-CH2 4.16Å; F88-W98 HydrophobicContact CB-CZ3 4.35Å; F88-F100 HydrophobicContact CB-CD2 4.37Å; F88-F100 HydrophobicContact CB-CE2 4.05Å; F88-F100 AromaticContact CD1-CD1 3.77Å; F88-F100 HydrophobicContact CD1-CD1 3.77Å; F88-F100 AromaticContact CD1-CD2 3.74Å; F88-F100 HydrophobicContact CD1-CD2 3.74Å; F88-F100 AromaticContact CD1-CE1 3.76Å; F88-F100 HydrophobicContact CD1-CE1 3.76Å; F88-F100 AromaticContact CD1-CE2 3.72Å; F88-F100 HydrophobicContact CD1-CE2 3.72Å; F88-F100 AromaticContact CD1-CG 3.75Å; F88-F100 HydrophobicContact CD1-CG 3.75Å; F88-F100 AromaticContact CD1-CZ 3.72Å; F88-F100 HydrophobicContact CD1-CZ 3.72Å; F88-F100 AromaticContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CE1 4.03Å; F88-F100 HydrophobicContact CE1-CG 4.25Å; F88-F100 HydrophobicContact CE1-CZ 4.42Å; F88-F100 HydrophobicContact CG-CE2 4.35Å; F88-F100 HydrophobicContact CG-CZ 4.5Å; F88-I104 HydrophobicContact CD1-CG2 3.68Å; F88-I104 HydrophobicContact CE1-CG2 3.66Å; F88-I104 HydrophobicContact CG-CG2 4.35Å; F88-I104 HydrophobicContact CZ-CG2 4.32Å
89V95.9Very high95.8Very high8 Ų847.1 Ų47.15%0.04823%0.228CC..Hα-helixtrans-61.1-45.9173.7179.70000110.7Y41 F85 L86 S91 F92 R93 F108Y41-V89 HydrophobicContact CD2-CG1 4.03Å; Y41-V89 HydrophobicContact CE1-CG1 4.29Å; Y41-V89 HydrophobicContact CE2-CG1 3.77Å; Y41-V89 HydrophobicContact CG-CG1 4.43Å; F85-V89 PolarHBondContact O-N 3.48Å; L86-V89 WeakPolarHBondContact O-CB 3.13Å; L86-V89 PolarHBondContact O-N 2.72Å; L86-V89 VanDerWaalsContact O-N 3.13Å; V89-S91 PolarHBondContact O-N 2.92Å; V89-F92 PolarHBondContact O-N 3.13Å; V89-R93 HydrophobicContact CG1-CG 4.32Å; V89-R93 VanDerWaalsContact O-CG 3.26Å; V89-R93 WeakPolarHBondContact O-CG 3.26Å; V89-R93 PolarHBondContact O-N 2.87Å; V89-F108 HydrophobicContact CG2-CD2 4.45Å; V89-F108 HydrophobicContact CG2-CE2 3.54Å; V89-F108 HydrophobicContact CG2-CZ 3.77Å
90I97.2Very high95.8Very high30 Ų3050.2 Ų50.215%0.15424%0.242CC..Hα-helixtrans-58.5-50.3177.1-69.2162.6000110.5A38 Y41 A42 L86 P87 F92 R93 I94A38-I90 HydrophobicContact CB-CG2 4.31Å; Y41-I90 HydrophobicContact CG-CG1 4.49Å; A42-I90 HydrophobicContact CB-CD1 4.04Å; L86-I90 VanDerWaalsContact O-CG1 3.27Å; L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 2.99Å; P87-I90 PolarHBondContact O-N 3.03Å; I90-F92 VanDerWaalsContact C-N 3.32Å; I90-F92 PolarHBondContact O-N 3.26Å; I90-R93 PolarHBondContact O-N 3.42Å; I90-I94 HydrophobicContact CG2-CD1 3.81Å; I90-I94 WeakPolarHBondContact O-CG1 3.34Å; I90-I94 PolarHBondContact O-N 3.36Å
91S97.3Very high95.9Very high28 Ų2851 Ų5120%0.19625%0.252CS..Hα-helixtrans-56.5-47.1176.8-179.90000111.4P87 F88 V89 R93 I94 K95P87-S91 WeakPolarHBondContact O-CB 3.23Å; P87-S91 PolarHBondContact O-N 2.81Å; F88-S91 PolarHBondContact O-N 3.22Å; V89-S91 PolarHBondContact O-N 2.92Å; S91-R93 PolarHBondContact O-N 2.94Å; S91-I94 PolarHBondContact O-N 2.91Å; S91-K95 WeakPolarHBondContact O-CB 3.21Å; S91-K95 WeakPolarHBondContact O-CG 3.45Å; S91-K95 PolarHBondContact O-N 3.12Å
92F95.1Very high95.9Very high32 Ų3251.5 Ų51.514%0.1426%0.256CS..Hα-helixtrans-60.9-40.8177.4177.6-123.6000112.7F88 V89 I90 R96 W98 V182F88-F92 WeakPolarHBondContact O-CB 3.37Å; F88-F92 PolarHBondContact O-N 2.8Å; V89-F92 PolarHBondContact O-N 3.13Å; I90-F92 VanDerWaalsContact C-N 3.32Å; I90-F92 PolarHBondContact O-N 3.26Å; F92-R96 WeakPolarHBondContact O-CA 3.32Å; F92-R96 PolarHBondContact O-N 2.75Å; F92-W98 HydrophobicContact CB-CE3 4.17Å; F92-W98 HydrophobicContact CD2-CB 4.09Å; F92-W98 HydrophobicContact CD2-CE3 4.31Å; F92-W98 HydrophobicContact CE2-CB 4.18Å; F92-W98 HydrophobicContact CG-CE3 4.21Å; F92-V182 HydrophobicContact CE2-CG1 4.36Å; F92-V182 HydrophobicContact CZ-CB 4.21Å; F92-V182 HydrophobicContact CZ-CG1 4.08Å
93R93.1Very high96Very high60 Ų6054.8 Ų54.823%0.22628%0.283CS..Hα-helixtrans-65.5-38.1177.7-68.5-65179-119.73.1112.7Y41 V89 I90 S91 N300Y41-R93 HydrophobicContact CE2-CG 4.25Å; V89-R93 HydrophobicContact CG1-CG 4.32Å; V89-R93 VanDerWaalsContact O-CG 3.26Å; V89-R93 WeakPolarHBondContact O-CG 3.26Å; V89-R93 PolarHBondContact O-N 2.87Å; I90-R93 PolarHBondContact O-N 3.42Å; S91-R93 PolarHBondContact O-N 2.94Å; R93-N300 PolarHBondContact NH2-OD1 2.98Å
94I94.1Very high96.1Very high104 Ų10457.1 Ų57.153%0.53330%0.296SS..Hα-helixtrans-76.1-48.8179-64.7169.6000110.9A38 I90 S91A38-I94 HydrophobicContact CB-CD1 4.34Å; A38-I94 HydrophobicContact CB-CG1 4.08Å; I90-I94 HydrophobicContact CG2-CD1 3.81Å; I90-I94 WeakPolarHBondContact O-CG1 3.34Å; I90-I94 PolarHBondContact O-N 3.36Å; S91-I94 PolarHBondContact O-N 2.91Å
95K93.8Very high96.2Very high129 Ų12952.8 Ų52.856%0.56127%0.274SS*.Hα-helixtrans-77.2-20.1-175.5-66.2-66.2-173.1178.90113.5S91 T97S91-K95 WeakPolarHBondContact O-CB 3.21Å; S91-K95 WeakPolarHBondContact O-CG 3.45Å; S91-K95 PolarHBondContact O-N 3.12Å; K95-T97 HydrophobicContact CB-CG2 4.39Å; K95-T97 PolarHBondContact O-N 3.01Å; K95-T97 VanDerWaalsContact O-N 3.12Å
96R92.2Very high96.3Very high154 Ų15455.3 Ų55.358%0.58129%0.285SS*.SBendtrans63.94.7-175.6-50.8178.2-70.6-170.6-9.3114.6R34 F92 T180R34-R96 VanDerWaalsContact NH1-CD 3.26Å; F92-R96 WeakPolarHBondContact O-CA 3.32Å; F92-R96 PolarHBondContact O-N 2.75Å; R96-T180 VanDerWaalsContact O-CG2 3.25Å; R96-T180 WeakPolarHBondContact O-CG2 3.43Å
97T95.7Very high96.3Very high30 Ų3059.4 Ų59.418%0.18431%0.307CS..SBendtrans-141.2143179.9-170.20000109.5K95 I99 V181K95-T97 HydrophobicContact CB-CG2 4.39Å; K95-T97 PolarHBondContact O-N 3.01Å; K95-T97 VanDerWaalsContact O-N 3.12Å; T97-I99 HydrophobicContact CG2-CG2 3.84Å; T97-I99 PolarHBondContact O-N 2.96Å; T97-V181 CarbonylContact C-O 3.57Å; T97-V181 WeakPolarHBondContact CA-O 3.1Å; T97-V181 PolarHBondContact OG1-N 2.57Å; T97-V181 PolarHBondContact OG1-O 3.25Å
98W97.1Very high96.3Very high12 Ų1257.7 Ų57.75%0.04529%0.294CS..  trans-83.9110-179.7-179.3-93.1000110.1F88 F92 F100 G101 I104 C105 F108 V181 C183F88-W98 HydrophobicContact CB-CH2 4.16Å; F88-W98 HydrophobicContact CB-CZ3 4.35Å; F92-W98 HydrophobicContact CB-CE3 4.17Å; F92-W98 HydrophobicContact CD2-CB 4.09Å; F92-W98 HydrophobicContact CD2-CE3 4.31Å; F92-W98 HydrophobicContact CE2-CB 4.18Å; F92-W98 HydrophobicContact CG-CE3 4.21Å; W98-F100 HydrophobicContact CD2-CD2 4.23Å; W98-F100 HydrophobicContact CE3-CD2 4.25Å; W98-F100 HydrophobicContact CH2-CD2 4.05Å; W98-F100 HydrophobicContact CZ2-CB 3.8Å; W98-F100 AromaticContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CG 4.36Å; W98-F100 HydrophobicContact CZ3-CD2 4.17Å; W98-G101 PolarHBondContact NE1-O 2.9Å; W98-I104 HydrophobicContact CH2-CG2 4.17Å; W98-I104 HydrophobicContact CZ2-CB 4.06Å; W98-I104 HydrophobicContact CZ2-CG2 3.79Å; W98-C105 HydrophobicContact CZ2-CB 3.94Å; W98-F108 HydrophobicContact CH2-CB 4.33Å; W98-V181 HydrophobicContact CB-CG1 4.49Å; W98-V181 PolarHBondContact N-O 3.47Å; W98-C183 HydrophobicContact CB-CB 4.27Å; W98-C183 HydrophobicContact CD2-CB 3.47Å; W98-C183 VanDerWaalsContact CD2-CB 3.47Å; W98-C183 HydrophobicContact CE3-CB 3.68Å; W98-C183 HydrophobicContact CG-CB 3.73Å; W98-C183 HydrophobicContact CZ2-CB 4.43Å; W98-C183 HydrophobicContact CZ3-CB 4.23Å
99I96.6Very high96.4Very high100 Ų10056.4 Ų56.451%0.51329%0.288SS..  trans-101.80-172.763.8172.3000114.5T97T97-I99 HydrophobicContact CG2-CG2 3.84Å; T97-I99 PolarHBondContact O-N 2.96Å
100F97.3Very high96.5Very high66 Ų6658.4 Ų58.429%0.28930%0.298SS..SBendtrans-97.64.6-170.7-54.8-76.3000114F88 W98 I104F88-F100 HydrophobicContact CB-CD2 4.37Å; F88-F100 HydrophobicContact CB-CE2 4.05Å; F88-F100 AromaticContact CD1-CD1 3.77Å; F88-F100 HydrophobicContact CD1-CD1 3.77Å; F88-F100 AromaticContact CD1-CD2 3.74Å; F88-F100 HydrophobicContact CD1-CD2 3.74Å; F88-F100 AromaticContact CD1-CE1 3.76Å; F88-F100 HydrophobicContact CD1-CE1 3.76Å; F88-F100 AromaticContact CD1-CE2 3.72Å; F88-F100 HydrophobicContact CD1-CE2 3.72Å; F88-F100 AromaticContact CD1-CG 3.75Å; F88-F100 HydrophobicContact CD1-CG 3.75Å; F88-F100 AromaticContact CD1-CZ 3.72Å; F88-F100 HydrophobicContact CD1-CZ 3.72Å; F88-F100 AromaticContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CE1 4.03Å; F88-F100 HydrophobicContact CE1-CG 4.25Å; F88-F100 HydrophobicContact CE1-CZ 4.42Å; F88-F100 HydrophobicContact CG-CE2 4.35Å; F88-F100 HydrophobicContact CG-CZ 4.5Å; W98-F100 HydrophobicContact CD2-CD2 4.23Å; W98-F100 HydrophobicContact CE3-CD2 4.25Å; W98-F100 HydrophobicContact CH2-CD2 4.05Å; W98-F100 HydrophobicContact CZ2-CB 3.8Å; W98-F100 AromaticContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CG 4.36Å; W98-F100 HydrophobicContact CZ3-CD2 4.17Å; F100-I104 HydrophobicContact CB-CB 3.73Å; F100-I104 HydrophobicContact CB-CG1 4.05Å; F100-I104 HydrophobicContact CB-CG2 3.83Å; F100-I104 HydrophobicContact CG-CG2 4.42Å; F100-I104 WeakPolarHBondContact O-CG1 3.43Å
101G96.7Very high96.4Very high32 Ų3257.9 Ų57.933%0.3330%0.297SS..Hα-helixtrans69.8179.4-179.500000114.7W98 C105W98-G101 PolarHBondContact NE1-O 2.9Å; G101-C105 PolarHBondContact O-N 3.35Å
102T97.1Very high96.4Very high61 Ų6158 Ų5837%0.37429%0.294SS..Hα-helixtrans-67.6-37.3-172.5-47.80000113.3C105 K106 I173T102-C105 WeakPolarHBondContact O-CB 3.39Å; T102-C105 PolarHBondContact O-N 3.28Å; T102-K106 HydrophobicContact CG2-CD 4.47Å; T102-K106 HydrophobicContact CG2-CG 4.48Å; T102-K106 PolarHBondContact O-N 3.26Å; T102-I173 VanDerWaalsContact OG1-CD1 3.26Å; T102-I173 WeakPolarHBondContact OG1-CD1 3.45Å; T102-I173 WeakPolarHBondContact OG1-CG1 3.31Å
103A97.7Very high96.4Very high71 Ų7156.6 Ų56.659%0.58729%0.289SS*.Hα-helixtrans-61.8-48.7-177.200000111.9C105 K106 L107A103-C105 VanDerWaalsContact C-N 3.31Å; A103-C105 PolarHBondContact O-N 3.03Å; A103-K106 PolarHBondContact O-N 3.01Å; A103-L107 WeakPolarHBondContact O-CB 3.4Å; A103-L107 WeakPolarHBondContact O-CG 3.34Å; A103-L107 PolarHBondContact O-N 3.38Å
104I97.6Very high96.7Very high50 Ų5054.3 Ų54.326%0.25628%0.281SS..Hα-helixtrans-68.4-33.8177-55.9-57.6000110.9F88 W98 F100 L107 F108F88-I104 HydrophobicContact CD1-CG2 3.68Å; F88-I104 HydrophobicContact CE1-CG2 3.66Å; F88-I104 HydrophobicContact CG-CG2 4.35Å; F88-I104 HydrophobicContact CZ-CG2 4.32Å; W98-I104 HydrophobicContact CH2-CG2 4.17Å; W98-I104 HydrophobicContact CZ2-CB 4.06Å; W98-I104 HydrophobicContact CZ2-CG2 3.79Å; F100-I104 HydrophobicContact CB-CB 3.73Å; F100-I104 HydrophobicContact CB-CG1 4.05Å; F100-I104 HydrophobicContact CB-CG2 3.83Å; F100-I104 HydrophobicContact CG-CG2 4.42Å; F100-I104 WeakPolarHBondContact O-CG1 3.43Å; I104-L107 HydrophobicContact CD1-CD1 4.24Å; I104-L107 PolarHBondContact O-N 3.39Å; I104-F108 VanDerWaalsContact O-CB 3.28Å; I104-F108 WeakPolarHBondContact O-CB 3.28Å; I104-F108 PolarHBondContact O-N 2.86Å
105C98.2Very high96.8Very high0 Ų049.7 Ų49.70%026%0.258CS..Hα-helixtrans-60.8-47.6176175.50000111.7W98 G101 T102 A103 F108 F109 E172 I173 C183W98-C105 HydrophobicContact CZ2-CB 3.94Å; G101-C105 PolarHBondContact O-N 3.35Å; T102-C105 WeakPolarHBondContact O-CB 3.39Å; T102-C105 PolarHBondContact O-N 3.28Å; A103-C105 VanDerWaalsContact C-N 3.31Å; A103-C105 PolarHBondContact O-N 3.03Å; C105-F108 WeakPolarHBondContact O-CB 3.28Å; C105-F108 PolarHBondContact O-N 3.13Å; C105-F109 PolarHBondContact O-N 3.27Å; C105-F109 VanDerWaalsContact O-N 3.15Å; C105-E172 PolarHBondContact SG-O 3.32Å; C105-E172 VanDerWaalsContact SG-O 3.41Å; C105-I173 HydrophobicContact CB-CG2 3.82Å; C105-C183 WeakPolarHBondContact CA-SG 3.43Å; C105-C183 HydrophobicContact CB-CB 3.82Å; C105-C183 WeakPolarHBondContact CB-SG 3.47Å; C105-C183 WeakPolarHBondContact SG-CA 3.41Å; C105-C183 WeakPolarHBondContact SG-CB 3.41Å; C105-C183 CovalentContact SG-SG 2.03Å; C105-C183 PolarHBondContact SG-SG 3.25Å
106K98.1Very high96.9Very high84 Ų8444.1 Ų44.137%0.36523%0.234SC..Hα-helixtrans-63.3-47.3175-72.9-170.6171.5-165.30111.5T102 A103 F108 F109 I110 S171T102-K106 HydrophobicContact CG2-CD 4.47Å; T102-K106 HydrophobicContact CG2-CG 4.48Å; T102-K106 PolarHBondContact O-N 3.26Å; A103-K106 PolarHBondContact O-N 3.01Å; K106-F108 VanDerWaalsContact C-N 3.26Å; K106-F108 PolarHBondContact O-N 3.48Å; K106-F109 PolarHBondContact O-N 3.22Å; K106-I110 HydrophobicContact CB-CD1 4.28Å; K106-I110 WeakPolarHBondContact O-CB 2.98Å; K106-I110 WeakPolarHBondContact O-CD1 3.41Å; K106-I110 WeakPolarHBondContact O-CG1 3.42Å; K106-I110 PolarHBondContact O-N 2.85Å; K106-S171 WeakPolarHBondContact CE-O 3.26Å; K106-S171 WeakPolarHBondContact CG-O 3.25Å
107L97.8Very high97.2Very high86 Ų8637.1 Ų37.145%0.4521%0.207SC..Hα-helixtrans-59.2-37.9178.1-76.1172.5000112.6F85 A103 I104 S111F85-L107 HydrophobicContact CE1-CB 4.2Å; F85-L107 HydrophobicContact CZ-CB 4.33Å; A103-L107 WeakPolarHBondContact O-CB 3.4Å; A103-L107 WeakPolarHBondContact O-CG 3.34Å; A103-L107 PolarHBondContact O-N 3.38Å; I104-L107 HydrophobicContact CD1-CD1 4.24Å; I104-L107 PolarHBondContact O-N 3.39Å; L107-S111 WeakPolarHBondContact O-CB 3.42Å; L107-S111 PolarHBondContact O-N 3Å; L107-S111 PolarHBondContact O-OG 3.24Å
108F97.6Very high97.3Very high20 Ų2035.7 Ų35.79%0.08820%0.199CC..Hα-helixtrans-59.3-56.9174.3166.8-112.3000110.9F85 V89 W98 I104 C105 K106 I110 S111 E112F85-F108 HydrophobicContact CB-CD2 3.66Å; F85-F108 HydrophobicContact CB-CE2 4.18Å; F85-F108 HydrophobicContact CD1-CB 4.06Å; F85-F108 HydrophobicContact CD1-CD2 4.23Å; F85-F108 HydrophobicContact CE1-CB 4.49Å; F85-F108 HydrophobicContact CG-CD2 4.12Å; V89-F108 HydrophobicContact CG2-CD2 4.45Å; V89-F108 HydrophobicContact CG2-CE2 3.54Å; V89-F108 HydrophobicContact CG2-CZ 3.77Å; W98-F108 HydrophobicContact CH2-CB 4.33Å; I104-F108 VanDerWaalsContact O-CB 3.28Å; I104-F108 WeakPolarHBondContact O-CB 3.28Å; I104-F108 PolarHBondContact O-N 2.86Å; C105-F108 WeakPolarHBondContact O-CB 3.28Å; C105-F108 PolarHBondContact O-N 3.13Å; K106-F108 VanDerWaalsContact C-N 3.26Å; K106-F108 PolarHBondContact O-N 3.48Å; F108-I110 PolarHBondContact O-N 2.93Å; F108-S111 PolarHBondContact O-N 2.97Å; F108-E112 WeakPolarHBondContact CE1-OE2 3.29Å; F108-E112 HydrophobicContact CE2-CB 4.41Å; F108-E112 WeakPolarHBondContact CZ-OE2 3.48Å; F108-E112 WeakPolarHBondContact O-CB 3.46Å; F108-E112 PolarHBondContact O-N 2.03Å
109F98.1Very high97.2Very high27 Ų2735.3 Ų35.312%0.11820%0.198CC..Hα-helixtrans-67.6-37.3-178-84.2-62.1000113.6C105 K106 S113 I167 C183 I185C105-F109 PolarHBondContact O-N 3.27Å; C105-F109 VanDerWaalsContact O-N 3.15Å; K106-F109 PolarHBondContact O-N 3.22Å; F109-S113 VanDerWaalsContact O-CB 3.25Å; F109-S113 WeakPolarHBondContact O-CB 3.46Å; F109-S113 PolarHBondContact O-N 2.96Å; F109-S113 PolarHBondContact O-OG 3.39Å; F109-I167 HydrophobicContact CB-CG2 3.75Å; F109-I167 HydrophobicContact CD1-CG2 4.46Å; F109-I167 HydrophobicContact CG-CG2 4.41Å; F109-C183 HydrophobicContact CE2-CB 4.48Å; F109-C183 WeakPolarHBondContact CE2-SG 3.45Å; F109-I185 HydrophobicContact CD1-CD1 3.98Å; F109-I185 HydrophobicContact CD1-CG1 3.89Å; F109-I185 HydrophobicContact CE1-CD1 3.87Å; F109-I185 HydrophobicContact CE1-CG1 3.74Å; F109-I185 HydrophobicContact CE2-CG1 4.33Å; F109-I185 HydrophobicContact CG-CG1 4.29Å; F109-I185 HydrophobicContact CZ-CG1 3.97Å
110I97.4Very high97.1Very high51 Ų5130.6 Ų30.626%0.26217%0.174SC..Hα-helixtrans-58.4-58172.8-68.5162.8000108.7K106 F108 E112 S113 T114 Y168K106-I110 HydrophobicContact CB-CD1 4.28Å; K106-I110 WeakPolarHBondContact O-CB 2.98Å; K106-I110 WeakPolarHBondContact O-CD1 3.41Å; K106-I110 WeakPolarHBondContact O-CG1 3.42Å; K106-I110 PolarHBondContact O-N 2.85Å; F108-I110 PolarHBondContact O-N 2.93Å; I110-E112 PolarHBondContact O-N 3.48Å; I110-S113 PolarHBondContact O-N 3.15Å; I110-S113 PolarHBondContact O-OG 3.13Å; I110-S113 VanDerWaalsContact O-OG 3.11Å; I110-T114 PolarHBondContact O-N 3.02Å; I110-T114 PolarHBondContact O-OG1 3.21Å; I110-Y168 HydrophobicContact CB-CD1 3.99Å; I110-Y168 HydrophobicContact CB-CE1 4.03Å; I110-Y168 HydrophobicContact CG1-CD1 3.43Å; I110-Y168 VanDerWaalsContact CG1-CD1 3.43Å; I110-Y168 HydrophobicContact CG1-CE1 3.98Å; I110-Y168 HydrophobicContact CG1-CG 3.76Å; I110-Y168 HydrophobicContact CG2-CD1 4.18Å; I110-Y168 HydrophobicContact CG2-CE1 3.86Å
111S96.4Very high97.1Very high19 Ų1930.5 Ų30.513%0.13317%0.172CC..Hα-helixtrans-63.4-46.3-175.8-57.30000111.6F85 L107 F108 T115F85-S111 VanDerWaalsContact CE2-OG 3.25Å; F85-S111 WeakPolarHBondContact CE2-OG 3.24Å; F85-S111 WeakPolarHBondContact CZ-OG 3.42Å; L107-S111 WeakPolarHBondContact O-CB 3.42Å; L107-S111 PolarHBondContact O-N 3Å; L107-S111 PolarHBondContact O-OG 3.24Å; F108-S111 PolarHBondContact O-N 2.97Å; S111-T115 VanDerWaalsContact O-CB 3.26Å; S111-T115 WeakPolarHBondContact O-CB 3.3Å; S111-T115 VanDerWaalsContact O-CG2 3.26Å; S111-T115 WeakPolarHBondContact O-CG2 3.33Å; S111-T115 PolarHBondContact O-N 3.27Å; S111-T115 PolarHBondContact O-OG1 3.03Å
112E96Very high97.1Very high29 Ų2929 Ų2914%0.13616%0.156CC..Hα-helixtrans-55.8-54.3176.9169.6168.9-145.600110.8F82 F108 I110 K116 Y307F82-E112 HydrophobicContact CD2-CG 4.39Å; F82-E112 HydrophobicContact CE2-CB 4.44Å; F82-E112 HydrophobicContact CE2-CG 3.85Å; F108-E112 WeakPolarHBondContact CE1-OE2 3.29Å; F108-E112 HydrophobicContact CE2-CB 4.41Å; F108-E112 WeakPolarHBondContact CZ-OE2 3.48Å; F108-E112 WeakPolarHBondContact O-CB 3.46Å; F108-E112 PolarHBondContact O-N 2.03Å; I110-E112 PolarHBondContact O-N 3.48Å; E112-K116 WeakPolarHBondContact O-CB 3.14Å; E112-K116 PolarHBondContact O-N 2.92Å; E112-Y307 PolarHBondContact OE1-OH 3.03Å
113S96.3Very high96.9Very high4 Ų426.1 Ų26.13%0.02814%0.138CC..Hα-helixtrans-65-48.1-176.4600000112.1F109 I110 Y117F109-S113 VanDerWaalsContact O-CB 3.25Å; F109-S113 WeakPolarHBondContact O-CB 3.46Å; F109-S113 PolarHBondContact O-N 2.96Å; F109-S113 PolarHBondContact O-OG 3.39Å; I110-S113 PolarHBondContact O-N 3.15Å; I110-S113 PolarHBondContact O-OG 3.13Å; I110-S113 VanDerWaalsContact O-OG 3.11Å; S113-Y117 WeakPolarHBondContact O-CD2 3.07Å; S113-Y117 PolarHBondContact O-N 2.93Å
114T97.9Very high96.8Very high11 Ų1123.1 Ų23.17%0.06711%0.113CC..Hα-helixtrans-63.5-50.3-179.1-40.30000111.8I110 A118 W157 I160 S161 Y168I110-T114 PolarHBondContact O-N 3.02Å; I110-T114 PolarHBondContact O-OG1 3.21Å; T114-A118 VanDerWaalsContact O-CB 3.22Å; T114-A118 WeakPolarHBondContact O-CB 3.38Å; T114-A118 PolarHBondContact O-N 3.26Å; T114-W157 HydrophobicContact CG2-CE3 4.02Å; T114-W157 HydrophobicContact CG2-CZ3 3.99Å; T114-I160 HydrophobicContact CG2-CG2 4.2Å; T114-I160 WeakPolarHBondContact O-CG2 3.41Å; T114-S161 WeakPolarHBondContact CG2-OG 3.35Å; T114-Y168 PolarHBondContact OG1-OH 2.96Å
115T97.8Very high96.6Very high7 Ų722.2 Ų22.24%0.04311%0.109CC..Hα-helixtrans-79.1-35.3-167.263.10000112.2A78 V81 F82 S111 Y117 A118 S119 W157A78-T115 WeakPolarHBondContact O-CB 3.46Å; V81-T115 HydrophobicContact CB-CG2 3.78Å; V81-T115 HydrophobicContact CG1-CG2 3.68Å; F82-T115 WeakPolarHBondContact CA-OG1 3.03Å; F82-T115 WeakPolarHBondContact CB-OG1 3.03Å; F82-T115 PolarHBondContact N-OG1 3.35Å; S111-T115 VanDerWaalsContact O-CB 3.26Å; S111-T115 WeakPolarHBondContact O-CB 3.3Å; S111-T115 VanDerWaalsContact O-CG2 3.26Å; S111-T115 WeakPolarHBondContact O-CG2 3.33Å; S111-T115 PolarHBondContact O-N 3.27Å; S111-T115 PolarHBondContact O-OG1 3.03Å; T115-Y117 VanDerWaalsContact C-N 3.33Å; T115-Y117 PolarHBondContact O-N 2.94Å; T115-A118 PolarHBondContact O-N 2.99Å; T115-S119 PolarHBondContact O-N 3.31Å; T115-W157 HydrophobicContact CG2-CH2 4.15Å; T115-W157 HydrophobicContact CG2-CZ3 4.11Å
116K96.1Very high96.3Very high13 Ų1322.6 Ų22.66%0.05711%0.11CC..Hα-helixtrans-59.1-43.9173.7-170.5-170.260.8-176.30111.1F82 E112 S119 W273 Y276 P306F82-K116 HydrophobicContact CD1-CB 4.35Å; F82-K116 HydrophobicContact CD1-CG 4.42Å; F82-K116 HydrophobicContact CD2-CB 4.26Å; F82-K116 HydrophobicContact CE1-CB 4.17Å; F82-K116 HydrophobicContact CE1-CD 4.42Å; F82-K116 HydrophobicContact CE1-CG 3.8Å; F82-K116 HydrophobicContact CE2-CB 4.08Å; F82-K116 HydrophobicContact CE2-CD 4.28Å; F82-K116 HydrophobicContact CE2-CG 4.19Å; F82-K116 HydrophobicContact CG-CB 4.42Å; F82-K116 HydrophobicContact CZ-CB 4.04Å; F82-K116 HydrophobicContact CZ-CD 3.83Å; F82-K116 HydrophobicContact CZ-CG 3.67Å; E112-K116 WeakPolarHBondContact O-CB 3.14Å; E112-K116 PolarHBondContact O-N 2.92Å; K116-S119 WeakPolarHBondContact O-CB 3.47Å; K116-W273 HydrophobicContact CD-CH2 3.81Å; K116-W273 HydrophobicContact CD-CZ2 4.41Å; K116-W273 HydrophobicContact CD-CZ3 4.38Å; K116-W273 HydrophobicContact CG-CH2 3.49Å; K116-W273 VanDerWaalsContact CG-CH2 3.49Å; K116-W273 HydrophobicContact CG-CZ2 3.75Å; K116-Y276 PolarHBondContact NZ-OH 2.71Å; K116-P306 HydrophobicContact CD-CB 3.78Å; K116-P306 HydrophobicContact CD-CG 4.28Å; K116-P306 HydrophobicContact CG-CB 4.02Å
117Y96.9Very high96Very high7 Ų719 Ų193%0.02710%0.096CC..Hα-helixtrans-80.1-30.2177.3-62.6-54.8000113.4S113 T115 S119 V120 Y121 M164 C217 W273 Y276 W277S113-Y117 WeakPolarHBondContact O-CD2 3.07Å; S113-Y117 PolarHBondContact O-N 2.93Å; T115-Y117 VanDerWaalsContact C-N 3.33Å; T115-Y117 PolarHBondContact O-N 2.94Å; Y117-S119 VanDerWaalsContact C-N 3.28Å; Y117-S119 PolarHBondContact O-N 3.44Å; Y117-V120 WeakPolarHBondContact O-CB 3.12Å; Y117-V120 PolarHBondContact O-N 3.19Å; Y117-Y121 PolarHBondContact O-N 2.94Å; Y117-Y121 VanDerWaalsContact O-N 3.11Å; Y117-M164 HydrophobicContact CD2-CE 3.61Å; Y117-M164 HydrophobicContact CD2-CG 4.17Å; Y117-M164 HydrophobicContact CD2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CD2-SD 3.35Å; Y117-M164 HydrophobicContact CE2-CE 3.81Å; Y117-M164 HydrophobicContact CE2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CE2-SD 3.33Å; Y117-M164 HydrophobicContact CG-CE 4.48Å; Y117-C217 HydrophobicContact CD1-CB 3.44Å; Y117-C217 VanDerWaalsContact CD1-CB 3.44Å; Y117-C217 HydrophobicContact CE1-CB 3.87Å; Y117-C217 HydrophobicContact CG-CB 3.86Å; Y117-W273 AromaticContact CD1-CH2 3.63Å; Y117-W273 HydrophobicContact CD1-CH2 3.63Å; Y117-W273 AromaticContact CD1-CZ3 3.97Å; Y117-W273 HydrophobicContact CD1-CZ3 3.97Å; Y117-W273 AromaticContact CE1-CH2 3.64Å; Y117-W273 HydrophobicContact CE1-CH2 3.64Å; Y117-W273 AromaticContact CE1-CZ3 3.53Å; Y117-W273 HydrophobicContact CE1-CZ3 3.53Å; Y117-Y276 PolarHBondContact OH-OH 3.38Å; Y117-W277 HydrophobicContact CE1-CH2 4.36Å; Y117-W277 AromaticContact CE1-CZ2 3.65Å; Y117-W277 HydrophobicContact CE1-CZ2 3.65Å; Y117-W277 AromaticContact CZ-CZ2 4Å
118A97.7Very high95.7Very high0 Ų017.6 Ų17.60%09%0.088CC..Hα-helixtrans-59.8-39.3170.700000111.9A78 T114 T115 V120 Y121 F122 W157 I160A78-A118 HydrophobicContact CB-CB 4.02Å; T114-A118 VanDerWaalsContact O-CB 3.22Å; T114-A118 WeakPolarHBondContact O-CB 3.38Å; T114-A118 PolarHBondContact O-N 3.26Å; T115-A118 PolarHBondContact O-N 2.99Å; A118-V120 VanDerWaalsContact C-N 3.34Å; A118-V120 PolarHBondContact O-N 3.37Å; A118-Y121 WeakPolarHBondContact O-CB 3.32Å; A118-Y121 PolarHBondContact O-N 2.89Å; A118-F122 HydrophobicContact CB-CD2 4.39Å; A118-F122 HydrophobicContact CB-CE2 4.11Å; A118-F122 WeakPolarHBondContact O-CD2 3.34Å; A118-F122 PolarHBondContact O-N 3.39Å; A118-W157 HydrophobicContact CB-CE3 4.07Å; A118-W157 HydrophobicContact CB-CH2 3.82Å; A118-W157 HydrophobicContact CB-CZ2 4.26Å; A118-W157 HydrophobicContact CB-CZ3 3.71Å; A118-I160 VanDerWaalsContact CA-CD1 3.48Å; A118-I160 HydrophobicContact CB-CD1 4.1Å
119S96.1Very high95.3Very high4 Ų417 Ų173%0.0289%0.086CC..Hα-helixtrans-54.1-49.1173.4-175.30000111.7L75 D79 T115 K116 Y117 Y121 F122 I123L75-S119 WeakPolarHBondContact CD1-O 3.34Å; L75-S119 VanDerWaalsContact CD1-OG 3.26Å; L75-S119 WeakPolarHBondContact CD1-OG 3.42Å; D79-S119 WeakPolarHBondContact OD1-CB 3.27Å; D79-S119 PolarHBondContact OD1-OG 3.46Å; T115-S119 PolarHBondContact O-N 3.31Å; K116-S119 WeakPolarHBondContact O-CB 3.47Å; Y117-S119 VanDerWaalsContact C-N 3.28Å; Y117-S119 PolarHBondContact O-N 3.44Å; S119-Y121 VanDerWaalsContact C-N 3.33Å; S119-Y121 PolarHBondContact O-N 2.9Å; S119-F122 PolarHBondContact O-N 3.32Å; S119-I123 VanDerWaalsContact O-CG1 3.31Å; S119-I123 WeakPolarHBondContact O-CG1 3.5Å; S119-I123 PolarHBondContact O-N 2.84Å
120V95.4Very high94.8Very high1 Ų117.8 Ų17.81%0.0069%0.088CC..Hα-helixtrans-59.6-43.2177.8-1790000112.2Y117 A118 I123 S124 C217 P221 M225 Y269 W273Y117-V120 WeakPolarHBondContact O-CB 3.12Å; Y117-V120 PolarHBondContact O-N 3.19Å; A118-V120 VanDerWaalsContact C-N 3.34Å; A118-V120 PolarHBondContact O-N 3.37Å; V120-I123 PolarHBondContact O-N 2.88Å; V120-S124 PolarHBondContact O-N 3.48Å; V120-S124 PolarHBondContact O-OG 2.64Å; V120-C217 WeakPolarHBondContact CG1-O 3.2Å; V120-P221 HydrophobicContact CG1-CB 3.54Å; V120-P221 HydrophobicContact CG1-CG 3.96Å; V120-M225 HydrophobicContact CG1-CE 4.42Å; V120-Y269 HydrophobicContact CB-CE2 4.16Å; V120-Y269 HydrophobicContact CG1-CD2 4.49Å; V120-Y269 HydrophobicContact CG1-CE2 3.49Å; V120-Y269 VanDerWaalsContact CG1-CE2 3.49Å; V120-Y269 WeakPolarHBondContact CG1-OH 3.31Å; V120-Y269 HydrophobicContact CG2-CD2 4.45Å; V120-Y269 HydrophobicContact CG2-CE2 3.73Å; V120-W273 HydrophobicContact CG2-CD2 4.27Å; V120-W273 VanDerWaalsContact CG2-CE2 3.48Å; V120-W273 HydrophobicContact CG2-CH2 3.78Å; V120-W273 HydrophobicContact CG2-CZ2 3.19Å
121Y96.3Very high94.3Very high64 Ų6416.1 Ų16.125%0.2518%0.081SC..Hα-helixtrans-61-47177.2175.3-100.4000111.8Y117 A118 S119 I123 S124 L125 A152 G156 I160Y117-Y121 PolarHBondContact O-N 2.94Å; Y117-Y121 VanDerWaalsContact O-N 3.11Å; A118-Y121 WeakPolarHBondContact O-CB 3.32Å; A118-Y121 PolarHBondContact O-N 2.89Å; S119-Y121 VanDerWaalsContact C-N 3.33Å; S119-Y121 PolarHBondContact O-N 2.9Å; Y121-I123 PolarHBondContact O-N 3.38Å; Y121-S124 WeakPolarHBondContact O-CB 3.13Å; Y121-S124 PolarHBondContact O-N 3.01Å; Y121-L125 HydrophobicContact CD1-CD1 4.06Å; Y121-L125 HydrophobicContact CD1-CG 4.49Å; Y121-L125 HydrophobicContact CE1-CD1 3.34Å; Y121-L125 HydrophobicContact CE1-CG 4.03Å; Y121-L125 HydrophobicContact CE2-CG 4.48Å; Y121-L125 PolarHBondContact O-N 3.24Å; Y121-A152 PolarHBondContact OH-O 2.98Å; Y121-G156 VanDerWaalsContact CE1-CA 3.49Å; Y121-I160 HydrophobicContact CG-CD1 4.07Å
122F95.9Very high93.9Very high0 Ų018.4 Ų18.40%09%0.091CC..Hα-helixtrans-69.2-33.8179.4-69.5-60000113.1L71 N74 L75 A118 S119 S124 L125 L126 A153 W157L71-F122 HydrophobicContact CD2-CD1 4.25Å; N74-F122 HydrophobicContact CB-CD1 3.72Å; N74-F122 HydrophobicContact CB-CD2 3.86Å; N74-F122 HydrophobicContact CB-CE1 3.44Å; N74-F122 VanDerWaalsContact CB-CE1 3.44Å; N74-F122 HydrophobicContact CB-CE2 3.61Å; N74-F122 HydrophobicContact CB-CG 3.96Å; N74-F122 HydrophobicContact CB-CZ 3.42Å; N74-F122 VanDerWaalsContact CB-CZ 3.42Å; L75-F122 HydrophobicContact CB-CB 3.85Å; L75-F122 HydrophobicContact CD1-CB 4.2Å; A118-F122 HydrophobicContact CB-CD2 4.39Å; A118-F122 HydrophobicContact CB-CE2 4.11Å; A118-F122 WeakPolarHBondContact O-CD2 3.34Å; A118-F122 PolarHBondContact O-N 3.39Å; S119-F122 PolarHBondContact O-N 3.32Å; F122-S124 VanDerWaalsContact C-N 3.29Å; F122-S124 PolarHBondContact O-N 3.42Å; F122-L125 HydrophobicContact CD1-CD1 4.18Å; F122-L125 HydrophobicContact CE1-CD1 4.4Å; F122-L125 PolarHBondContact O-N 3.19Å; F122-L126 WeakPolarHBondContact O-CB 3.04Å; F122-L126 WeakPolarHBondContact O-CD1 3.47Å; F122-L126 WeakPolarHBondContact O-CG 3.42Å; F122-L126 PolarHBondContact O-N 3.28Å; F122-A153 HydrophobicContact CE1-CB 3.76Å; F122-A153 HydrophobicContact CZ-CB 4.1Å; F122-W157 AromaticContact CE2-CE2 3.77Å; F122-W157 AromaticContact CE2-CZ2 3.97Å; F122-W157 HydrophobicContact CE2-CZ2 3.97Å; F122-W157 AromaticContact CE2-NE1 3.64Å; F122-W157 AromaticContact CZ-CD1 3.86Å; F122-W157 AromaticContact CZ-NE1 3.49Å
123I94Very high93.2Very high1 Ų118.9 Ų18.91%0.00510%0.097CC..Hα-helixtrans-61.9-39.8171.2-67168.6000110.7L75 S119 V120 Y121 L126 S127 M225 I265L75-I123 HydrophobicContact CD1-CD1 4.34Å; L75-I123 HydrophobicContact CD1-CG1 3.84Å; L75-I123 HydrophobicContact CD2-CG1 3.99Å; S119-I123 VanDerWaalsContact O-CG1 3.31Å; S119-I123 WeakPolarHBondContact O-CG1 3.5Å; S119-I123 PolarHBondContact O-N 2.84Å; V120-I123 PolarHBondContact O-N 2.88Å; Y121-I123 PolarHBondContact O-N 3.38Å; I123-L126 PolarHBondContact O-N 2.77Å; I123-S127 PolarHBondContact O-N 2.84Å; I123-S127 PolarHBondContact O-OG 3.5Å; I123-M225 HydrophobicContact CB-SD 4.46Å; I123-M225 HydrophobicContact CG2-SD 3.57Å; I123-M225 VanDerWaalsContact CG2-SD 3.57Å; I123-I265 HydrophobicContact CG2-CG2 3.64Å
124S94.3Very high92.4Very high7 Ų719 Ų195%0.04910%0.098CC..Hα-helixtrans-65-45.9176.8-57.60000111.5V120 Y121 F122 L126 S127 I128 P221V120-S124 PolarHBondContact O-N 3.48Å; V120-S124 PolarHBondContact O-OG 2.64Å; Y121-S124 WeakPolarHBondContact O-CB 3.13Å; Y121-S124 PolarHBondContact O-N 3.01Å; F122-S124 VanDerWaalsContact C-N 3.29Å; F122-S124 PolarHBondContact O-N 3.42Å; S124-L126 VanDerWaalsContact C-N 3.33Å; S124-L126 PolarHBondContact O-N 3.08Å; S124-S127 WeakPolarHBondContact O-CB 3.23Å; S124-S127 PolarHBondContact O-N 3.46Å; S124-S127 VanDerWaalsContact O-N 3.17Å; S124-I128 WeakPolarHBondContact O-CG1 3.24Å; S124-I128 PolarHBondContact O-N 3.49Å; S124-P221 WeakPolarHBondContact OG-CB 3.37Å
125L94.9Very high91.6Very high32 Ų3224.9 Ų24.917%0.16812%0.119CC..Hα-helixtrans-61.8-39.4174.2-71.1-175000112.6L71 Y121 F122 S127 I128 D129 A152L71-L125 HydrophobicContact CD1-CB 3.93Å; L71-L125 HydrophobicContact CD2-CB 3.91Å; L71-L125 HydrophobicContact CD2-CD1 3.67Å; L71-L125 HydrophobicContact CD2-CG 4.47Å; Y121-L125 HydrophobicContact CD1-CD1 4.06Å; Y121-L125 HydrophobicContact CD1-CG 4.49Å; Y121-L125 HydrophobicContact CE1-CD1 3.34Å; Y121-L125 HydrophobicContact CE1-CG 4.03Å; Y121-L125 HydrophobicContact CE2-CG 4.48Å; Y121-L125 PolarHBondContact O-N 3.24Å; F122-L125 HydrophobicContact CD1-CD1 4.18Å; F122-L125 HydrophobicContact CE1-CD1 4.4Å; F122-L125 PolarHBondContact O-N 3.19Å; L125-S127 VanDerWaalsContact C-N 3.31Å; L125-S127 PolarHBondContact O-N 3.47Å; L125-I128 HydrophobicContact CD2-CD1 4.4Å; L125-I128 PolarHBondContact O-N 3.06Å; L125-D129 WeakPolarHBondContact O-CB 3.37Å; L125-D129 PolarHBondContact O-N 3.44Å; L125-A152 HydrophobicContact CD1-CB 4.18Å
126L91.8Very high90.6Very high7 Ų730 Ų304%0.03714%0.141CC..Hα-helixtrans-63.1-39.9175-75.8162.9000111.1L71 I72 L75 F122 I123 S124 D129 R130 Y317L71-L126 HydrophobicContact CB-CD1 4.5Å; L71-L126 HydrophobicContact CB-CD2 3.54Å; L71-L126 HydrophobicContact CB-CG 3.82Å; L71-L126 HydrophobicContact CD1-CD2 4.11Å; L71-L126 HydrophobicContact CD1-CG 4.31Å; I72-L126 HydrophobicContact CG1-CD1 4.33Å; I72-L126 HydrophobicContact CG1-CD2 3.89Å; L75-L126 HydrophobicContact CB-CD1 4.37Å; L75-L126 HydrophobicContact CD2-CD1 3.56Å; F122-L126 WeakPolarHBondContact O-CB 3.04Å; F122-L126 WeakPolarHBondContact O-CD1 3.47Å; F122-L126 WeakPolarHBondContact O-CG 3.42Å; F122-L126 PolarHBondContact O-N 3.28Å; I123-L126 PolarHBondContact O-N 2.77Å; S124-L126 VanDerWaalsContact C-N 3.33Å; S124-L126 PolarHBondContact O-N 3.08Å; L126-D129 PolarHBondContact O-N 3.01Å; L126-R130 WeakPolarHBondContact O-CG 3.34Å; L126-R130 PolarHBondContact O-N 3.31Å; L126-Y317 VanDerWaalsContact CD1-OH 3.24Å; L126-Y317 WeakPolarHBondContact CD1-OH 3.42Å
127S90.5Very high89Confident8 Ų835 Ų356%0.05616%0.164CC..Hα-helixtrans-62.6-43.3175.9-60.70000111.5I123 S124 L125 R130 C131I123-S127 PolarHBondContact O-N 2.84Å; I123-S127 PolarHBondContact O-OG 3.5Å; S124-S127 WeakPolarHBondContact O-CB 3.23Å; S124-S127 PolarHBondContact O-N 3.46Å; S124-S127 VanDerWaalsContact O-N 3.17Å; L125-S127 VanDerWaalsContact C-N 3.31Å; L125-S127 PolarHBondContact O-N 3.47Å; S127-R130 PolarHBondContact O-N 3.37Å; S127-C131 PolarHBondContact O-N 2.82Å; S127-C131 VanDerWaalsContact O-N 3.1Å; S127-C131 PolarHBondContact O-SG 3.48Å
128I91.7Very high87.2Confident58 Ų5842 Ų4230%0.29720%0.202SC..Hα-helixtrans-61.9-48.9174.1-66165.2000110.8S124 L125 R130 C131 L132 I224 C228S124-I128 WeakPolarHBondContact O-CG1 3.24Å; S124-I128 PolarHBondContact O-N 3.49Å; L125-I128 HydrophobicContact CD2-CD1 4.4Å; L125-I128 PolarHBondContact O-N 3.06Å; I128-R130 PolarHBondContact O-N 2.67Å; I128-C131 WeakPolarHBondContact O-CB 3.39Å; I128-C131 PolarHBondContact O-N 3.09Å; I128-L132 HydrophobicContact CG2-CD1 3.83Å; I128-L132 HydrophobicContact CG2-CG 4.21Å; I128-L132 WeakPolarHBondContact O-CG 3.48Å; I128-L132 PolarHBondContact O-N 2.94Å; I128-I224 HydrophobicContact CD1-CG2 3.81Å; I128-I224 HydrophobicContact CG1-CG2 3.97Å; I128-C228 VanDerWaalsContact CG1-SG 3.53Å
129D89.7Confident85.3Confident6 Ų644.3 Ų44.33%0.03221%0.211CC..Hα-helixtrans-54.1-41.3177.7175.864.3000111.5V67 T68 L71 L125 L126 S133V67-D129 WeakPolarHBondContact CG1-OD1 3.14Å; T68-D129 PolarHBondContact OG1-OD2 3.18Å; L71-D129 HydrophobicContact CD1-CB 4.09Å; L125-D129 WeakPolarHBondContact O-CB 3.37Å; L125-D129 PolarHBondContact O-N 3.44Å; L126-D129 PolarHBondContact O-N 3.01Å; D129-S133 VanDerWaalsContact O-CB 3.23Å; D129-S133 WeakPolarHBondContact O-CB 3.4Å; D129-S133 PolarHBondContact O-N 3.06Å; D129-S133 PolarHBondContact O-OG 3.11Å
130R87.3Confident83.5Confident45 Ų4554.1 Ų54.117%0.1725%0.248CC..Hα-helixtrans-65.9-42.7175.1-65-44.3173.3-149.7-15.7113.3T68 L126 S127 I128 L132 S133 V134 L232 L258 V262T68-R130 PolarHBondContact OG1-NH1 3.19Å; T68-R130 PolarHBondContact OG1-NH2 3.34Å; L126-R130 WeakPolarHBondContact O-CG 3.34Å; L126-R130 PolarHBondContact O-N 3.31Å; S127-R130 PolarHBondContact O-N 3.37Å; I128-R130 PolarHBondContact O-N 2.67Å; R130-L132 VanDerWaalsContact C-N 3.35Å; R130-S133 PolarHBondContact O-N 3.32Å; R130-V134 VanDerWaalsContact O-CG2 3.26Å; R130-V134 WeakPolarHBondContact O-CG2 2.95Å; R130-V134 PolarHBondContact O-N 3.38Å; R130-L232 HydrophobicContact CB-CD1 4.01Å; R130-L258 HydrophobicContact CG-CD1 4.03Å; R130-V262 HydrophobicContact CB-CG2 4.38Å; R130-V262 HydrophobicContact CG-CG2 4.12Å
131C87Confident82.1Confident15 Ų1557 Ų5710%0.10127%0.266CS..Hα-helixtrans-62.2-45.6178.2-64.10000111.5S127 I128 V134 R135 C228S127-C131 PolarHBondContact O-N 2.82Å; S127-C131 VanDerWaalsContact O-N 3.1Å; S127-C131 PolarHBondContact O-SG 3.48Å; I128-C131 WeakPolarHBondContact O-CB 3.39Å; I128-C131 PolarHBondContact O-N 3.09Å; C131-V134 PolarHBondContact O-N 2.83Å; C131-R135 VanDerWaalsContact O-CB 3.26Å; C131-R135 WeakPolarHBondContact O-CB 3.46Å; C131-R135 PolarHBondContact O-N 3.43Å; C131-C228 WeakPolarHBondContact SG-CA 3.13Å; C131-C228 WeakPolarHBondContact SG-CB 3.02Å; C131-C228 PolarHBondContact SG-O 3.38Å
132L87.7Confident81.3Confident68 Ų6856.4 Ų56.436%0.35627%0.27SS..Hα-helixtrans-65.4-43.5178.2-64.5177.3000111.7I128 R130 V134 R135 F136 Y139I128-L132 HydrophobicContact CG2-CD1 3.83Å; I128-L132 HydrophobicContact CG2-CG 4.21Å; I128-L132 WeakPolarHBondContact O-CG 3.48Å; I128-L132 PolarHBondContact O-N 2.94Å; R130-L132 VanDerWaalsContact C-N 3.35Å; L132-V134 VanDerWaalsContact C-N 3.33Å; L132-V134 PolarHBondContact O-N 2.97Å; L132-R135 PolarHBondContact O-N 2.93Å; L132-F136 HydrophobicContact CD2-CD2 4.31Å; L132-F136 HydrophobicContact CD2-CE2 3.92Å; L132-F136 WeakPolarHBondContact O-CD2 3.42Å; L132-F136 PolarHBondContact O-N 3.15Å; L132-Y139 HydrophobicContact CB-CE2 4.1Å
133S82.9Confident80.8Confident38 Ų3865.7 Ų65.727%0.26631%0.305SS..Hα-helixtrans-63.2-36.3178.9-650000113D129 R130D129-S133 VanDerWaalsContact O-CB 3.23Å; D129-S133 WeakPolarHBondContact O-CB 3.4Å; D129-S133 PolarHBondContact O-N 3.06Å; D129-S133 PolarHBondContact O-OG 3.11Å; R130-S133 PolarHBondContact O-N 3.32Å
134V79.2Confident80.5Confident7 Ų770 Ų704%0.04233%0.334CS..Hα-helixtrans-77.9-36.3178174.80000111.3R130 C131 L132 Q235 V236 Y255 L258R130-V134 VanDerWaalsContact O-CG2 3.26Å; R130-V134 WeakPolarHBondContact O-CG2 2.95Å; R130-V134 PolarHBondContact O-N 3.38Å; C131-V134 PolarHBondContact O-N 2.83Å; L132-V134 VanDerWaalsContact C-N 3.33Å; L132-V134 PolarHBondContact O-N 2.97Å; V134-Q235 HydrophobicContact CG1-CB 4.34Å; V134-Q235 HydrophobicContact CG1-CG 3.72Å; V134-V236 HydrophobicContact CG1-CG2 4.27Å; V134-Y255 HydrophobicContact CB-CE1 4.29Å; V134-Y255 HydrophobicContact CG1-CD1 4.11Å; V134-Y255 HydrophobicContact CG1-CE1 3.79Å; V134-Y255 HydrophobicContact CG2-CD1 4.16Å; V134-Y255 HydrophobicContact CG2-CE1 3.98Å; V134-L258 HydrophobicContact CG2-CD2 3.52Å
135R80.1Confident80.3Confident135 Ų13572.3 Ų72.351%0.50934%0.344SS..Hα-helixtrans-73.4-42.4-178.8-177.160.4-176.8150.69.7112.4C131 L132C131-R135 VanDerWaalsContact O-CB 3.26Å; C131-R135 WeakPolarHBondContact O-CB 3.46Å; C131-R135 PolarHBondContact O-N 3.43Å; L132-R135 PolarHBondContact O-N 2.93Å
136F77.7Confident80.1Confident114 Ų11475 Ų7550%0.535%0.352SS..  trans-10592.5-179.1-59.2-71.2000109.6L132 N138 Y139L132-F136 HydrophobicContact CD2-CD2 4.31Å; L132-F136 HydrophobicContact CD2-CE2 3.92Å; L132-F136 WeakPolarHBondContact O-CD2 3.42Å; L132-F136 PolarHBondContact O-N 3.15Å; F136-N138 PolarHBondContact O-N 3.28Å; F136-Y139 HydrophobicContact CB-CD2 4.31Å; F136-Y139 WeakPolarHBondContact O-CB 3.49Å; F136-Y139 PolarHBondContact O-N 3Å
137Q62.5Low80.1Confident118 Ų11880.2 Ų80.255%0.55138%0.377SS*.THydrogen-bonded Turntrans-65-26.2-176.7-159163.2-28.900113.2Y139Q137-Y139 VanDerWaalsContact C-N 3.27Å; Q137-Y139 PolarHBondContact O-N 3.39Å
138N59Low80.3Confident153 Ų15385.3 Ų85.382%0.81840%0.403SS*.THydrogen-bonded Turntrans-91.832.4170.8-66.5-16.7000112.2F136 R140F136-N138 PolarHBondContact O-N 3.28Å; N138-R140 PolarHBondContact O-N 3.23Å
139Y57.5Low80.4Confident49 Ų4982.9 Ų82.919%0.19239%0.392CS..  trans-67.467.3170.5-163.7-92000109.6L132 F136 Q137 V141 K145L132-Y139 HydrophobicContact CB-CE2 4.1Å; F136-Y139 HydrophobicContact CB-CD2 4.31Å; F136-Y139 WeakPolarHBondContact O-CB 3.49Å; F136-Y139 PolarHBondContact O-N 3Å; Q137-Y139 VanDerWaalsContact C-N 3.27Å; Q137-Y139 PolarHBondContact O-N 3.39Å; Y139-V141 PolarHBondContact O-N 3.04Å; Y139-V141 VanDerWaalsContact O-N 3.17Å; Y139-K145 HydrophobicContact CD1-CD 4.43Å; Y139-K145 HydrophobicContact CE1-CD 3.84Å; Y139-K145 HydrophobicContact CE2-CD 3.99Å; Y139-K145 VanDerWaalsContact CE2-NZ 3.35Å
140R59Low80.7Confident210 Ų21085.8 Ų85.879%0.79241%0.41SS*.  trans-58124.3164.9-78.8-173.9-176.6-179.22.1106.4N138 S142 K145N138-R140 PolarHBondContact O-N 3.23Å; R140-S142 PolarHBondContact O-N 3.19Å; R140-K145 PolarHBondContact O-NZ 2.56Å
141V66.1Low81.2Confident63 Ų6387 Ų8738%0.38242%0.422SS..  trans-67.699.2172.5175.90000106.4Y139 R146Y139-V141 PolarHBondContact O-N 3.04Å; Y139-V141 VanDerWaalsContact O-N 3.17Å; V141-R146 HydrophobicContact CG1-CG 3.64Å
142S79.4Confident81.7Confident50 Ų5087.3 Ų87.335%0.3543%0.425SS..  trans-81159.8172.467.30000110R140 C144 K145 R146R140-S142 PolarHBondContact O-N 3.19Å; S142-C144 PolarHBondContact O-N 3.28Å; S142-K145 PolarHBondContact O-N 3.17Å; S142-K145 WeakPolarHBondContact OG-CG 3.33Å; S142-K145 PolarHBondContact OG-N 3.43Å; S142-R146 PolarHBondContact O-N 2.96Å
143R85Confident82.2Confident196 Ų19684.2 Ų84.274%0.7441%0.41SS*.Hα-helixtrans-54.8-39.5170.5-177177.2177.2118.40.9111.5K145 R146 M147R143-K145 PolarHBondContact O-N 3.46Å; R143-R146 PolarHBondContact O-N 3.37Å; R143-M147 PolarHBondContact O-N 3.31Å
144C88.4Confident82.9Confident91 Ų9187.6 Ų87.662%0.61542%0.424SS*.Hα-helixtrans-57.6-47.8177.3178.20000112.4S142 R146 M147 L148S142-C144 PolarHBondContact O-N 3.28Å; C144-R146 VanDerWaalsContact C-N 3.33Å; C144-R146 PolarHBondContact O-N 2.91Å; C144-M147 WeakPolarHBondContact O-CB 3.39Å; C144-M147 PolarHBondContact O-N 2.75Å; C144-L148 PolarHBondContact O-N 2.92Å
145K88.5Confident83.8Confident56 Ų5690.7 Ų90.724%0.24344%0.443CS..Hα-helixtrans-63.1-37179-70.3170.2176.8179.90113.3V67 Y139 R140 S142 R143 L148 A149V67-K145 HydrophobicContact CG2-CB 4.04Å; Y139-K145 HydrophobicContact CD1-CD 4.43Å; Y139-K145 HydrophobicContact CE1-CD 3.84Å; Y139-K145 HydrophobicContact CE2-CD 3.99Å; Y139-K145 VanDerWaalsContact CE2-NZ 3.35Å; R140-K145 PolarHBondContact O-NZ 2.56Å; S142-K145 PolarHBondContact O-N 3.17Å; S142-K145 WeakPolarHBondContact OG-CG 3.33Å; S142-K145 PolarHBondContact OG-N 3.43Å; R143-K145 PolarHBondContact O-N 3.46Å; K145-L148 PolarHBondContact O-N 2.79Å; K145-A149 PolarHBondContact O-N 2.99Å
146R90.5Very high84.7Confident88 Ų8884.4 Ų84.433%0.33242%0.42SS..Hα-helixtrans-67.1-43174.9-67.9-174.6-62.6168.6-0.7111.5T65 I70 V141 S142 R143 C144 L148 A149 V150T65-R146 WeakPolarHBondContact O-CD 3.29Å; I70-R146 HydrophobicContact CD1-CB 4.06Å; I70-R146 HydrophobicContact CD1-CG 4.28Å; V141-R146 HydrophobicContact CG1-CG 3.64Å; S142-R146 PolarHBondContact O-N 2.96Å; R143-R146 PolarHBondContact O-N 3.37Å; C144-R146 VanDerWaalsContact C-N 3.33Å; C144-R146 PolarHBondContact O-N 2.91Å; R146-L148 VanDerWaalsContact C-N 3.32Å; R146-L148 PolarHBondContact O-N 3.5Å; R146-A149 WeakPolarHBondContact O-CB 3.5Å; R146-A149 PolarHBondContact O-N 2.84Å; R146-V150 WeakPolarHBondContact O-CG2 3.35Å; R146-V150 PolarHBondContact O-N 3.26Å
147M93.2Very high85.6Confident116 Ų11681.4 Ų81.457%0.57141%0.406SS*.Hα-helixtrans-60-44.7174.4-173.2-159.3-71.300110.6R143 C144 A149 V150 V151R143-M147 PolarHBondContact O-N 3.31Å; C144-M147 WeakPolarHBondContact O-CB 3.39Å; C144-M147 PolarHBondContact O-N 2.75Å; M147-A149 VanDerWaalsContact C-N 3.29Å; M147-A149 PolarHBondContact O-N 3.08Å; M147-V150 PolarHBondContact O-N 3.22Å; M147-V150 VanDerWaalsContact O-N 3.12Å; M147-V151 HydrophobicContact CG-CG2 4.38Å; M147-V151 WeakPolarHBondContact O-CG2 3.46Å; M147-V151 PolarHBondContact O-N 3.43Å
148L94.3Very high87.3Confident116 Ų11679.8 Ų79.861%0.60740%0.404SS*.Hα-helixtrans-58.5-40.7175.9-17962.2000112.1C144 K145 R146 V151 A152C144-L148 PolarHBondContact O-N 2.92Å; K145-L148 PolarHBondContact O-N 2.79Å; R146-L148 VanDerWaalsContact C-N 3.32Å; R146-L148 PolarHBondContact O-N 3.5Å; L148-V151 PolarHBondContact O-N 3.45Å; L148-A152 VanDerWaalsContact O-CB 3.24Å; L148-A152 WeakPolarHBondContact O-CB 3.12Å; L148-A152 PolarHBondContact O-N 3.06Å
149A94.2Very high89.2Confident7 Ų776 Ų766%0.05839%0.386CS..Hα-helixtrans-65.2-38.517600000112.8V67 I70 K145 R146 M147 A153V67-A149 HydrophobicContact CB-CB 4.45Å; V67-A149 HydrophobicContact CG1-CB 3.87Å; V67-A149 HydrophobicContact CG2-CB 4.38Å; I70-A149 HydrophobicContact CD1-CB 4.36Å; I70-A149 HydrophobicContact CG2-CB 4.25Å; K145-A149 PolarHBondContact O-N 2.99Å; R146-A149 WeakPolarHBondContact O-CB 3.5Å; R146-A149 PolarHBondContact O-N 2.84Å; M147-A149 VanDerWaalsContact C-N 3.29Å; M147-A149 PolarHBondContact O-N 3.08Å; A149-A153 WeakPolarHBondContact O-CB 3.42Å; A149-A153 PolarHBondContact O-N 2.95Å
150V96.1Very high91.1Very high67 Ų6774.2 Ų74.241%0.40638%0.38SS..Hα-helixtrans-66.6-46.1174.8173.10000110.6I70 R146 M147 A153 L154I70-V150 HydrophobicContact CD1-CG2 4.21Å; I70-V150 HydrophobicContact CG2-CG2 4.13Å; R146-V150 WeakPolarHBondContact O-CG2 3.35Å; R146-V150 PolarHBondContact O-N 3.26Å; M147-V150 PolarHBondContact O-N 3.22Å; M147-V150 VanDerWaalsContact O-N 3.12Å; V150-A153 WeakPolarHBondContact O-CB 3.25Å; V150-A153 PolarHBondContact O-N 3.11Å; V150-L154 HydrophobicContact CG1-CD1 4.21Å; V150-L154 WeakPolarHBondContact O-CG 3.47Å; V150-L154 PolarHBondContact O-N 3.08Å
151V97.5Very high93Very high69 Ų6966.1 Ų66.142%0.41836%0.355SS..Hα-helixtrans-61.5-46.1176.9172.30000110.5M147 L148 A153 L154 V155M147-V151 HydrophobicContact CG-CG2 4.38Å; M147-V151 WeakPolarHBondContact O-CG2 3.46Å; M147-V151 PolarHBondContact O-N 3.43Å; L148-V151 PolarHBondContact O-N 3.45Å; V151-A153 VanDerWaalsContact C-N 3.29Å; V151-A153 PolarHBondContact O-N 2.69Å; V151-L154 PolarHBondContact O-N 3.33Å; V151-V155 HydrophobicContact CG1-CG2 4.22Å; V151-V155 WeakPolarHBondContact O-CB 3.49Å; V151-V155 VanDerWaalsContact O-CG2 3.29Å; V151-V155 WeakPolarHBondContact O-CG2 3.37Å; V151-V155 PolarHBondContact O-N 3.45Å
152A97.5Very high94.5Very high22 Ų2267 Ų6718%0.18236%0.364CS..Hα-helixtrans-59.5-39.9175.700000111.8Y121 L125 L148 G156Y121-A152 PolarHBondContact OH-O 2.98Å; L125-A152 HydrophobicContact CD1-CB 4.18Å; L148-A152 VanDerWaalsContact O-CB 3.24Å; L148-A152 WeakPolarHBondContact O-CB 3.12Å; L148-A152 PolarHBondContact O-N 3.06Å; A152-G156 PolarHBondContact O-N 3.39Å
153A97.8Very high95.4Very high4 Ų466.6 Ų66.63%0.03336%0.358CS..Hα-helixtrans-63.9-47.317500000112.3F122 A149 V150 V151 V155 G156 W157F122-A153 HydrophobicContact CE1-CB 3.76Å; F122-A153 HydrophobicContact CZ-CB 4.1Å; A149-A153 WeakPolarHBondContact O-CB 3.42Å; A149-A153 PolarHBondContact O-N 2.95Å; V150-A153 WeakPolarHBondContact O-CB 3.25Å; V150-A153 PolarHBondContact O-N 3.11Å; V151-A153 VanDerWaalsContact C-N 3.29Å; V151-A153 PolarHBondContact O-N 2.69Å; A153-V155 PolarHBondContact O-N 2.98Å; A153-G156 PolarHBondContact O-N 2.84Å; A153-W157 PolarHBondContact O-N 3.32Å
154L98Very high96Very high109 Ų10957.3 Ų57.357%0.57132%0.323SS*.Hα-helixtrans-60.5-46.4177.5-68.7172.9000111.5V150 V151 G156 W157 T158V150-L154 HydrophobicContact CG1-CD1 4.21Å; V150-L154 WeakPolarHBondContact O-CG 3.47Å; V150-L154 PolarHBondContact O-N 3.08Å; V151-L154 PolarHBondContact O-N 3.33Å; L154-G156 VanDerWaalsContact C-N 3.35Å; L154-G156 PolarHBondContact O-N 2.91Å; L154-W157 PolarHBondContact O-N 2.97Å; L154-T158 WeakPolarHBondContact O-CG2 3.43Å; L154-T158 PolarHBondContact O-N 3.32Å; L154-T158 PolarHBondContact O-OG1 3.37Å
155V97.9Very high96.5Very high72 Ų7255.8 Ų55.844%0.43631%0.311SS..Hα-helixtrans-62.6-41.8176.5171.60000111.3V151 A153 T158 V159V151-V155 HydrophobicContact CG1-CG2 4.22Å; V151-V155 WeakPolarHBondContact O-CB 3.49Å; V151-V155 VanDerWaalsContact O-CG2 3.29Å; V151-V155 WeakPolarHBondContact O-CG2 3.37Å; V151-V155 PolarHBondContact O-N 3.45Å; A153-V155 PolarHBondContact O-N 2.98Å; V155-T158 WeakPolarHBondContact CA-OG1 3.4Å; V155-T158 PolarHBondContact O-N 3.02Å; V155-T158 PolarHBondContact O-OG1 3.47Å; V155-V159 HydrophobicContact CG1-CG2 3.99Å; V155-V159 VanDerWaalsContact O-CB 3.27Å; V155-V159 WeakPolarHBondContact O-CB 3.44Å; V155-V159 WeakPolarHBondContact O-CG2 3.33Å; V155-V159 PolarHBondContact O-N 3.27Å
156G97.7Very high96.9Very high2 Ų254.6 Ų54.62%0.02131%0.309CS..Hα-helixtrans-59.8-48.9176.400000112.1Y121 A152 A153 L154 T158 I160Y121-G156 VanDerWaalsContact CE1-CA 3.49Å; A152-G156 PolarHBondContact O-N 3.39Å; A153-G156 PolarHBondContact O-N 2.84Å; L154-G156 VanDerWaalsContact C-N 3.35Å; L154-G156 PolarHBondContact O-N 2.91Å; G156-T158 PolarHBondContact O-N 2.86Å; G156-I160 WeakPolarHBondContact O-CB 3.16Å; G156-I160 WeakPolarHBondContact O-CD1 3.33Å; G156-I160 WeakPolarHBondContact O-CG1 3.5Å; G156-I160 PolarHBondContact O-N 2.92Å
157W98.3Very high97.3Very high52 Ų5250.9 Ų50.920%0.19730%0.295CS..Hα-helixtrans-60.5-44.9177-79.6114.1000112.3N74 A78 T114 T115 A118 F122 A153 L154 S161N74-W157 PolarHBondContact OD1-NE1 3.36Å; A78-W157 HydrophobicContact CB-CH2 3.74Å; A78-W157 HydrophobicContact CB-CZ2 4.02Å; T114-W157 HydrophobicContact CG2-CE3 4.02Å; T114-W157 HydrophobicContact CG2-CZ3 3.99Å; T115-W157 HydrophobicContact CG2-CH2 4.15Å; T115-W157 HydrophobicContact CG2-CZ3 4.11Å; A118-W157 HydrophobicContact CB-CE3 4.07Å; A118-W157 HydrophobicContact CB-CH2 3.82Å; A118-W157 HydrophobicContact CB-CZ2 4.26Å; A118-W157 HydrophobicContact CB-CZ3 3.71Å; F122-W157 AromaticContact CE2-CE2 3.77Å; F122-W157 AromaticContact CE2-CZ2 3.97Å; F122-W157 HydrophobicContact CE2-CZ2 3.97Å; F122-W157 AromaticContact CE2-NE1 3.64Å; F122-W157 AromaticContact CZ-CD1 3.86Å; F122-W157 AromaticContact CZ-NE1 3.49Å; A153-W157 PolarHBondContact O-N 3.32Å; L154-W157 PolarHBondContact O-N 2.97Å; W157-S161 VanDerWaalsContact O-CB 3.23Å; W157-S161 WeakPolarHBondContact O-CB 3.37Å; W157-S161 PolarHBondContact O-N 3.02Å; W157-S161 PolarHBondContact O-OG 3.35Å
158T98.2Very high97.5Very high84 Ų8447.6 Ų47.652%0.51528%0.277SS..Hα-helixtrans-68.1-47.7-179.955.50000111.7L154 V155 G156 I160 S161 S162L154-T158 WeakPolarHBondContact O-CG2 3.43Å; L154-T158 PolarHBondContact O-N 3.32Å; L154-T158 PolarHBondContact O-OG1 3.37Å; V155-T158 WeakPolarHBondContact CA-OG1 3.4Å; V155-T158 PolarHBondContact O-N 3.02Å; V155-T158 PolarHBondContact O-OG1 3.47Å; G156-T158 PolarHBondContact O-N 2.86Å; T158-I160 PolarHBondContact O-N 2.99Å; T158-S161 PolarHBondContact O-N 3.35Å; T158-S162 WeakPolarHBondContact O-CB 3.49Å; T158-S162 PolarHBondContact O-N 3.41Å; T158-S162 PolarHBondContact O-OG 3.44Å
159V98Very high97.6Very high74 Ų7447.2 Ų47.245%0.44827%0.274SS..Hα-helixtrans-60.7-46.8179.7169.40000111.1V155 S161 S162 L163V155-V159 HydrophobicContact CG1-CG2 3.99Å; V155-V159 VanDerWaalsContact O-CB 3.27Å; V155-V159 WeakPolarHBondContact O-CB 3.44Å; V155-V159 WeakPolarHBondContact O-CG2 3.33Å; V155-V159 PolarHBondContact O-N 3.27Å; V159-S161 VanDerWaalsContact C-N 3.34Å; V159-S161 PolarHBondContact O-N 3.26Å; V159-S162 PolarHBondContact O-N 3.32Å; V159-L163 HydrophobicContact CG1-CD1 4.07Å; V159-L163 HydrophobicContact CG1-CG 4.43Å; V159-L163 VanDerWaalsContact O-CG 3.32Å; V159-L163 WeakPolarHBondContact O-CG 3.33Å; V159-L163 PolarHBondContact O-N 2.69Å
160I98.4Very high97.8Very high11 Ų1150.2 Ų50.26%0.05629%0.285CS..Hα-helixtrans-65.6-41.4179.2-66.2168.7000110.6T114 A118 Y121 G156 T158 S162 L163 M164T114-I160 HydrophobicContact CG2-CG2 4.2Å; T114-I160 WeakPolarHBondContact O-CG2 3.41Å; A118-I160 VanDerWaalsContact CA-CD1 3.48Å; A118-I160 HydrophobicContact CB-CD1 4.1Å; Y121-I160 HydrophobicContact CG-CD1 4.07Å; G156-I160 WeakPolarHBondContact O-CB 3.16Å; G156-I160 WeakPolarHBondContact O-CD1 3.33Å; G156-I160 WeakPolarHBondContact O-CG1 3.5Å; G156-I160 PolarHBondContact O-N 2.92Å; T158-I160 PolarHBondContact O-N 2.99Å; I160-S162 VanDerWaalsContact C-N 3.29Å; I160-S162 PolarHBondContact O-N 3.38Å; I160-L163 PolarHBondContact O-N 3.35Å; I160-M164 HydrophobicContact CG2-CG 4.36Å; I160-M164 VanDerWaalsContact O-CG 3.29Å; I160-M164 WeakPolarHBondContact O-CG 3.41Å; I160-M164 PolarHBondContact O-N 2.81Å
161S98.1Very high97.9Very high40 Ų4047 Ų4728%0.2827%0.265SS..Hα-helixtrans-60.8-40.4176.4-60.20000111.9T114 W157 T158 V159 M164 V165 Y168T114-S161 WeakPolarHBondContact CG2-OG 3.35Å; W157-S161 VanDerWaalsContact O-CB 3.23Å; W157-S161 WeakPolarHBondContact O-CB 3.37Å; W157-S161 PolarHBondContact O-N 3.02Å; W157-S161 PolarHBondContact O-OG 3.35Å; T158-S161 PolarHBondContact O-N 3.35Å; V159-S161 VanDerWaalsContact C-N 3.34Å; V159-S161 PolarHBondContact O-N 3.26Å; S161-M164 PolarHBondContact O-N 3.32Å; S161-V165 PolarHBondContact O-N 2.87Å; S161-Y168 WeakPolarHBondContact CA-OH 3.46Å; S161-Y168 WeakPolarHBondContact O-CE2 3.13Å; S161-Y168 PolarHBondContact O-OH 2.91Å
162S97.9Very high97.9Very high82 Ų8247 Ų4757%0.57326%0.261SS*.Hα-helixtrans-65.7-42.2175.7-62.20000112.4T158 V159 I160 M164 V165T158-S162 WeakPolarHBondContact O-CB 3.49Å; T158-S162 PolarHBondContact O-N 3.41Å; T158-S162 PolarHBondContact O-OG 3.44Å; V159-S162 PolarHBondContact O-N 3.32Å; I160-S162 VanDerWaalsContact C-N 3.29Å; I160-S162 PolarHBondContact O-N 3.38Å; S162-M164 PolarHBondContact O-N 3.29Å; S162-V165 WeakPolarHBondContact O-CB 3.16Å; S162-V165 VanDerWaalsContact O-CG2 3.3Å; S162-V165 WeakPolarHBondContact O-CG2 3.26Å; S162-V165 PolarHBondContact O-N 3.42Å
163L97.8Very high97.9Very high41 Ų4148.8 Ų48.822%0.21527%0.266CS..Hα-helixtrans-64-29.8176.6-70.5173.7000112.2V159 I160 Y212 L216V159-L163 HydrophobicContact CG1-CD1 4.07Å; V159-L163 HydrophobicContact CG1-CG 4.43Å; V159-L163 VanDerWaalsContact O-CG 3.32Å; V159-L163 WeakPolarHBondContact O-CG 3.33Å; V159-L163 PolarHBondContact O-N 2.69Å; I160-L163 PolarHBondContact O-N 3.35Å; L163-Y212 HydrophobicContact CB-CE2 4.44Å; L163-Y212 HydrophobicContact CD2-CD2 4.35Å; L163-Y212 HydrophobicContact CD2-CE2 4.22Å; L163-Y212 PolarHBondContact O-OH 3.41Å; L163-L216 HydrophobicContact CD1-CB 4.35Å; L163-L216 HydrophobicContact CD1-CD1 4.02Å; L163-L216 HydrophobicContact CD2-CD1 3.69Å
164M98Very high97.8Very high0 Ų054.9 Ų54.90%029%0.289CS..THydrogen-bonded Turntrans-89.80.5-177.8-62.9-56.2119.100114.2Y117 I160 S161 S162 P166 I167 Y168 F209Y117-M164 HydrophobicContact CD2-CE 3.61Å; Y117-M164 HydrophobicContact CD2-CG 4.17Å; Y117-M164 HydrophobicContact CD2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CD2-SD 3.35Å; Y117-M164 HydrophobicContact CE2-CE 3.81Å; Y117-M164 HydrophobicContact CE2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CE2-SD 3.33Å; Y117-M164 HydrophobicContact CG-CE 4.48Å; I160-M164 HydrophobicContact CG2-CG 4.36Å; I160-M164 VanDerWaalsContact O-CG 3.29Å; I160-M164 WeakPolarHBondContact O-CG 3.41Å; I160-M164 PolarHBondContact O-N 2.81Å; S161-M164 PolarHBondContact O-N 3.32Å; S162-M164 PolarHBondContact O-N 3.29Å; M164-P166 VanDerWaalsContact C-CD 3.43Å; M164-P166 VanDerWaalsContact C-N 3.32Å; M164-I167 WeakPolarHBondContact O-CB 3.26Å; M164-I167 PolarHBondContact O-N 2.88Å; M164-I167 HydrophobicContact SD-CD1 4.33Å; M164-Y168 HydrophobicContact CB-CE1 3.63Å; M164-Y168 VanDerWaalsContact O-CD1 3.26Å; M164-Y168 WeakPolarHBondContact O-CD1 3.38Å; M164-Y168 WeakPolarHBondContact O-CE1 3.13Å; M164-Y168 PolarHBondContact O-N 3.47Å; M164-F209 HydrophobicContact CE-CZ 4.42Å; M164-F209 HydrophobicContact SD-CE2 4.24Å; M164-F209 HydrophobicContact SD-CZ 3.89Å
165V98.1Very high97.7Very high60 Ų6056.2 Ų56.236%0.36429%0.292SS..Hα-helixtrans-49.8-41.6179.9168.40000114.1S161 S162 I167 Y168 I169S161-V165 PolarHBondContact O-N 2.87Å; S162-V165 WeakPolarHBondContact O-CB 3.16Å; S162-V165 VanDerWaalsContact O-CG2 3.3Å; S162-V165 WeakPolarHBondContact O-CG2 3.26Å; S162-V165 PolarHBondContact O-N 3.42Å; V165-I167 VanDerWaalsContact C-N 3.26Å; V165-I167 PolarHBondContact O-N 3.28Å; V165-Y168 HydrophobicContact CG2-CD2 4.23Å; V165-Y168 HydrophobicContact CG2-CE2 4.3Å; V165-Y168 WeakPolarHBondContact O-CA 3.32Å; V165-Y168 VanDerWaalsContact O-CB 3.31Å; V165-Y168 WeakPolarHBondContact O-CB 3.14Å; V165-Y168 PolarHBondContact O-N 3.24Å; V165-I169 HydrophobicContact CG1-CD1 3.75Å; V165-I169 HydrophobicContact CG1-CG1 4.22Å; V165-I169 PolarHBondContact O-N 3.37Å; V165-I169 VanDerWaalsContact O-N 3.08Å
166P97.7Very high97.5Very high30 Ų3057.4 Ų57.420%0.19530%0.299CS..Hα-helixtrans-57.5-37.7177.7-28.738.6000113.4M164 Y168 I169 Y170 W187 F209M164-P166 VanDerWaalsContact C-CD 3.43Å; M164-P166 VanDerWaalsContact C-N 3.32Å; P166-Y168 VanDerWaalsContact C-N 3.25Å; P166-Y168 PolarHBondContact O-N 2.94Å; P166-I169 PolarHBondContact O-N 2.82Å; P166-Y170 HydrophobicContact CB-CD2 4.17Å; P166-Y170 HydrophobicContact CB-CE2 4.2Å; P166-Y170 WeakPolarHBondContact O-CB 2.9Å; P166-Y170 WeakPolarHBondContact O-CD2 2.98Å; P166-Y170 PolarHBondContact O-N 3.21Å; P166-W187 HydrophobicContact CB-CH2 4.4Å; P166-W187 HydrophobicContact CB-CZ3 4.01Å; P166-F209 HydrophobicContact CB-CD2 3.93Å; P166-F209 HydrophobicContact CB-CE2 4.42Å; P166-F209 HydrophobicContact CG-CD2 4.12Å
167I97.8Very high97.2Very high10 Ų1060.2 Ų60.25%0.05132%0.316CS..Hα-helixtrans-63.3-35.6174.2-69.9-177.5000110.7F109 M164 V165 I169 S171 I185 W187 F209F109-I167 HydrophobicContact CB-CG2 3.75Å; F109-I167 HydrophobicContact CD1-CG2 4.46Å; F109-I167 HydrophobicContact CG-CG2 4.41Å; M164-I167 WeakPolarHBondContact O-CB 3.26Å; M164-I167 PolarHBondContact O-N 2.88Å; M164-I167 HydrophobicContact SD-CD1 4.33Å; V165-I167 VanDerWaalsContact C-N 3.26Å; V165-I167 PolarHBondContact O-N 3.28Å; I167-I169 VanDerWaalsContact C-N 3.34Å; I167-S171 WeakPolarHBondContact O-CB 3.4Å; I167-S171 PolarHBondContact O-N 2.99Å; I167-S171 PolarHBondContact O-OG 3.23Å; I167-I185 HydrophobicContact CD1-CD1 4.18Å; I167-I185 HydrophobicContact CG1-CD1 4.08Å; I167-I185 HydrophobicContact CG2-CD1 4.28Å; I167-W187 HydrophobicContact CG1-CH2 4.25Å; I167-F209 HydrophobicContact CD1-CE1 3.78Å; I167-F209 HydrophobicContact CD1-CE2 4.1Å; I167-F209 HydrophobicContact CD1-CZ 3.3Å; I167-F209 HydrophobicContact CG1-CE1 4.09Å; I167-F209 HydrophobicContact CG1-CE2 3.9Å; I167-F209 HydrophobicContact CG1-CZ 3.56Å
168Y97.8Very high97Very high48 Ų4863.1 Ų63.119%0.18834%0.341CS..Hα-helixtrans-69.9-36-178.4-50.4-11.9000111.6I110 T114 S161 M164 V165 P166I110-Y168 HydrophobicContact CB-CD1 3.99Å; I110-Y168 HydrophobicContact CB-CE1 4.03Å; I110-Y168 HydrophobicContact CG1-CD1 3.43Å; I110-Y168 VanDerWaalsContact CG1-CD1 3.43Å; I110-Y168 HydrophobicContact CG1-CE1 3.98Å; I110-Y168 HydrophobicContact CG1-CG 3.76Å; I110-Y168 HydrophobicContact CG2-CD1 4.18Å; I110-Y168 HydrophobicContact CG2-CE1 3.86Å; T114-Y168 PolarHBondContact OG1-OH 2.96Å; S161-Y168 WeakPolarHBondContact CA-OH 3.46Å; S161-Y168 WeakPolarHBondContact O-CE2 3.13Å; S161-Y168 PolarHBondContact O-OH 2.91Å; M164-Y168 HydrophobicContact CB-CE1 3.63Å; M164-Y168 VanDerWaalsContact O-CD1 3.26Å; M164-Y168 WeakPolarHBondContact O-CD1 3.38Å; M164-Y168 WeakPolarHBondContact O-CE1 3.13Å; M164-Y168 PolarHBondContact O-N 3.47Å; V165-Y168 HydrophobicContact CG2-CD2 4.23Å; V165-Y168 HydrophobicContact CG2-CE2 4.3Å; V165-Y168 WeakPolarHBondContact O-CA 3.32Å; V165-Y168 VanDerWaalsContact O-CB 3.31Å; V165-Y168 WeakPolarHBondContact O-CB 3.14Å; V165-Y168 PolarHBondContact O-N 3.24Å; P166-Y168 VanDerWaalsContact C-N 3.25Å; P166-Y168 PolarHBondContact O-N 2.94Å
169I97.6Very high96.7Very high107 Ų10766 Ų6655%0.54935%0.354SS..Hα-helixtrans-73.3-49178.3-64172.4000110V165 P166 I167V165-I169 HydrophobicContact CG1-CD1 3.75Å; V165-I169 HydrophobicContact CG1-CG1 4.22Å; V165-I169 PolarHBondContact O-N 3.37Å; V165-I169 VanDerWaalsContact O-N 3.08Å; P166-I169 PolarHBondContact O-N 2.82Å; I167-I169 VanDerWaalsContact C-N 3.34Å
170Y97.4Very high96.6Very high71 Ų7164.4 Ų64.428%0.27834%0.344SS..Hα-helixtrans-91.7-3-170.5-58.7-54.5000114.7P166 E172 A186 W187 P188 T205P166-Y170 HydrophobicContact CB-CD2 4.17Å; P166-Y170 HydrophobicContact CB-CE2 4.2Å; P166-Y170 WeakPolarHBondContact O-CB 2.9Å; P166-Y170 WeakPolarHBondContact O-CD2 2.98Å; P166-Y170 PolarHBondContact O-N 3.21Å; Y170-E172 PolarHBondContact O-N 3.01Å; Y170-A186 PolarHBondContact O-N 2.8Å; Y170-W187 AromaticContact CD2-CE3 3.67Å; Y170-W187 HydrophobicContact CD2-CE3 3.67Å; Y170-W187 AromaticContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CE2-CE3 4.27Å; Y170-W187 HydrophobicContact CE2-CZ3 4.26Å; Y170-W187 HydrophobicContact CG-CE3 4.34Å; Y170-P188 HydrophobicContact CE1-CG 4.02Å; Y170-P188 HydrophobicContact CE2-CG 4.46Å; Y170-T205 HydrophobicContact CD2-CG2 4.4Å; Y170-T205 HydrophobicContact CE2-CG2 3.65Å
171S98Very high96.5Very high0 Ų065.7 Ų65.70%035%0.353CS..EExtended strand (participates in β ladder)trans-75.1123.8172.848.20000111.3K106 I167K106-S171 WeakPolarHBondContact CE-O 3.26Å; K106-S171 WeakPolarHBondContact CG-O 3.25Å; I167-S171 WeakPolarHBondContact O-CB 3.4Å; I167-S171 PolarHBondContact O-N 2.99Å; I167-S171 PolarHBondContact O-OG 3.23Å
172E97.2Very high96.4Very high69 Ų6965.3 Ų65.332%0.32235%0.348SS..EExtended strand (participates in β ladder)trans-154.1171.7-17866.3176.3176.600112.5C105 Y170 R174 T184 A186C105-E172 PolarHBondContact SG-O 3.32Å; C105-E172 VanDerWaalsContact SG-O 3.41Å; Y170-E172 PolarHBondContact O-N 3.01Å; E172-R174 HydrophobicContact CG-CG 4.23Å; E172-R174 IonicContact OE1-CZ 3.14Å; E172-R174 IonicContact OE1-NE 2.74Å; E172-R174 PolarHBondContact OE1-NE 2.88Å; E172-R174 IonicContact OE1-NH2 2.72Å; E172-R174 PolarHBondContact OE1-NH2 3.36Å; E172-T184 PolarHBondContact N-O 2.82Å; E172-T184 PolarHBondContact O-N 2.78Å; E172-A186 HydrophobicContact CG-CB 3.69Å; E172-A186 WeakPolarHBondContact OE1-CB 3.29Å
173I97.9Very high96.4Very high59 Ų5962 Ų6230%0.30333%0.325SS..EExtended strand (participates in β ladder)trans-92.4139.3168.861.4171.7000109.5T102 C105 V181 V182T102-I173 VanDerWaalsContact OG1-CD1 3.26Å; T102-I173 WeakPolarHBondContact OG1-CD1 3.45Å; T102-I173 WeakPolarHBondContact OG1-CG1 3.31Å; C105-I173 HydrophobicContact CB-CG2 3.82Å; I173-V181 HydrophobicContact CB-CG1 3.85Å; I173-V181 HydrophobicContact CD1-CG1 4.39Å; I173-V181 HydrophobicContact CG2-CG1 4.42Å; I173-V182 CarbonylContact C-O 3.52Å; I173-V182 VanDerWaalsContact CA-O 3.24Å; I173-V182 WeakPolarHBondContact CA-O 3.47Å
174R96.4Very high96.3Very high132 Ų13262.5 Ų62.550%0.49833%0.33SS..EExtended strand (participates in β ladder)trans-127.9137.5173-69.3-163.7169.6-137.7-7.1110.6E172 V181 V182 T184 A186E172-R174 HydrophobicContact CG-CG 4.23Å; E172-R174 IonicContact OE1-CZ 3.14Å; E172-R174 IonicContact OE1-NE 2.74Å; E172-R174 PolarHBondContact OE1-NE 2.88Å; E172-R174 IonicContact OE1-NH2 2.72Å; E172-R174 PolarHBondContact OE1-NH2 3.36Å; R174-V181 CarbonylContact O-C 3.51Å; R174-V181 WeakPolarHBondContact O-CA 3.46Å; R174-V182 HydrophobicContact CB-CG2 4.26Å; R174-V182 PolarHBondContact N-O 3.38Å; R174-V182 PolarHBondContact O-N 3.1Å; R174-T184 HydrophobicContact CB-CG2 4.36Å; R174-T184 HydrophobicContact CG-CG2 4.07Å; R174-A186 VanDerWaalsContact NE-CB 3.35Å
175E95.8Very high96.2Very high137 Ų13764.4 Ų64.464%0.6434%0.34SS*.EExtended strand (participates in β ladder)trans-82.6117.4171.4-166.5176.5150.300108.9T177 P178E175-T177 VanDerWaalsContact CG-O 3.27Å; E175-T177 WeakPolarHBondContact CG-O 3.33Å; E175-P178 WeakPolarHBondContact OE1-CA 3.33Å
176V92.6Very high96.1Very high96 Ų9662.2 Ų62.258%0.58233%0.328SS*.EExtended strand (participates in β ladder)trans-94.6-34.5178.9-1780000110.4T180 V182V176-T180 PolarHBondContact N-O 3.2Å; V176-V182 HydrophobicContact CG2-CB 4.31Å; V176-V182 HydrophobicContact CG2-CG1 3.74Å; V176-V182 HydrophobicContact CG2-CG2 3.62Å
177T93.4Very high96Very high61 Ų6162.2 Ų62.237%0.37432%0.324SS..EExtended strand (participates in β ladder)trans-144.7163.417368.60000107.7E175 N179 T180E175-T177 VanDerWaalsContact CG-O 3.27Å; E175-T177 WeakPolarHBondContact CG-O 3.33Å; T177-N179 PolarHBondContact O-N 3.3Å; T177-T180 PolarHBondContact N-O 2.83Å; T177-T180 PolarHBondContact O-N 2.93Å; T177-T180 WeakPolarHBondContact OG1-CB 3.41Å; T177-T180 PolarHBondContact OG1-N 3.41Å; T177-T180 VanDerWaalsContact OG1-N 3.12Å; T177-T180 PolarHBondContact OG1-OG1 3.45Å
178P92.3Very high95.8Very high113 Ų11363.7 Ų63.773%0.73433%0.334SS*.THydrogen-bonded Turntrans-50.2-26.8178.3-30.136.7000115.4E175E175-P178 WeakPolarHBondContact OE1-CA 3.33Å
179N93.3Very high95.5Very high145 Ų14564 Ų6478%0.77535%0.347SS*.THydrogen-bonded Turntrans-111.51.5-178.8-64.2-37.6000113.9T177T177-N179 PolarHBondContact O-N 3.3Å
180T95Very high95.1Very high41 Ų4162.2 Ų62.225%0.25234%0.338SS..EExtended strand (participates in β ladder)trans-130.2107.6-173.7-50.90000110.9R96 V176 T177 V182R96-T180 VanDerWaalsContact O-CG2 3.25Å; R96-T180 WeakPolarHBondContact O-CG2 3.43Å; V176-T180 PolarHBondContact N-O 3.2Å; T177-T180 PolarHBondContact N-O 2.83Å; T177-T180 PolarHBondContact O-N 2.93Å; T177-T180 WeakPolarHBondContact OG1-CB 3.41Å; T177-T180 PolarHBondContact OG1-N 3.41Å; T177-T180 VanDerWaalsContact OG1-N 3.12Å; T177-T180 PolarHBondContact OG1-OG1 3.45Å; T180-V182 HydrophobicContact CG2-CG1 4.35Å
181V97Very high94.7Very high38 Ų3863.4 Ų63.423%0.2336%0.357CS..EExtended strand (participates in β ladder)trans-102.6138.8171.2179.30000108.3T97 W98 I173 R174T97-V181 CarbonylContact C-O 3.57Å; T97-V181 WeakPolarHBondContact CA-O 3.1Å; T97-V181 PolarHBondContact OG1-N 2.57Å; T97-V181 PolarHBondContact OG1-O 3.25Å; W98-V181 HydrophobicContact CB-CG1 4.49Å; W98-V181 PolarHBondContact N-O 3.47Å; I173-V181 HydrophobicContact CB-CG1 3.85Å; I173-V181 HydrophobicContact CD1-CG1 4.39Å; I173-V181 HydrophobicContact CG2-CG1 4.42Å; R174-V181 CarbonylContact O-C 3.51Å; R174-V181 WeakPolarHBondContact O-CA 3.46Å
182V96.5Very high94.2Very high31 Ų3168 Ų6819%0.18838%0.377CS..EExtended strand (participates in β ladder)trans-120.2144.1175.4-58.40000110F92 I173 R174 V176 T180 T184F92-V182 HydrophobicContact CE2-CG1 4.36Å; F92-V182 HydrophobicContact CZ-CB 4.21Å; F92-V182 HydrophobicContact CZ-CG1 4.08Å; I173-V182 CarbonylContact C-O 3.52Å; I173-V182 VanDerWaalsContact CA-O 3.24Å; I173-V182 WeakPolarHBondContact CA-O 3.47Å; R174-V182 HydrophobicContact CB-CG2 4.26Å; R174-V182 PolarHBondContact N-O 3.38Å; R174-V182 PolarHBondContact O-N 3.1Å; V176-V182 HydrophobicContact CG2-CB 4.31Å; V176-V182 HydrophobicContact CG2-CG1 3.74Å; V176-V182 HydrophobicContact CG2-CG2 3.62Å; T180-V182 HydrophobicContact CG2-CG1 4.35Å; V182-T184 HydrophobicContact CG2-CG2 4.27Å
183C97.3Very high93.7Very high14 Ų1470.9 Ų70.910%0.09539%0.39CS..EExtended strand (participates in β ladder)trans-91.7116.3166.2174.80000107.7W98 C105 F109W98-C183 HydrophobicContact CB-CB 4.27Å; W98-C183 HydrophobicContact CD2-CB 3.47Å; W98-C183 VanDerWaalsContact CD2-CB 3.47Å; W98-C183 HydrophobicContact CE3-CB 3.68Å; W98-C183 HydrophobicContact CG-CB 3.73Å; W98-C183 HydrophobicContact CZ2-CB 4.43Å; W98-C183 HydrophobicContact CZ3-CB 4.23Å; C105-C183 WeakPolarHBondContact CA-SG 3.43Å; C105-C183 HydrophobicContact CB-CB 3.82Å; C105-C183 WeakPolarHBondContact CB-SG 3.47Å; C105-C183 WeakPolarHBondContact SG-CA 3.41Å; C105-C183 WeakPolarHBondContact SG-CB 3.41Å; C105-C183 CovalentContact SG-SG 2.03Å; C105-C183 PolarHBondContact SG-SG 3.25Å; F109-C183 HydrophobicContact CE2-CB 4.48Å; F109-C183 WeakPolarHBondContact CE2-SG 3.45Å
184T95.7Very high93.1Very high51 Ų5169 Ų6931%0.31338%0.381SS..EExtended strand (participates in β ladder)trans-140.8168.1-173.4-167.50000111.6E172 R174 V182E172-T184 PolarHBondContact N-O 2.82Å; E172-T184 PolarHBondContact O-N 2.78Å; R174-T184 HydrophobicContact CB-CG2 4.36Å; R174-T184 HydrophobicContact CG-CG2 4.07Å; V182-T184 HydrophobicContact CG2-CG2 4.27Å
185I96.1Very high92.8Very high39 Ų3971 Ų7120%0.240%0.396CS..EExtended strand (participates in β ladder)trans-92.4121.2164.6-54.9164.4000106.9F109 I167 W187F109-I185 HydrophobicContact CD1-CD1 3.98Å; F109-I185 HydrophobicContact CD1-CG1 3.89Å; F109-I185 HydrophobicContact CE1-CD1 3.87Å; F109-I185 HydrophobicContact CE1-CG1 3.74Å; F109-I185 HydrophobicContact CE2-CG1 4.33Å; F109-I185 HydrophobicContact CG-CG1 4.29Å; F109-I185 HydrophobicContact CZ-CG1 3.97Å; I167-I185 HydrophobicContact CD1-CD1 4.18Å; I167-I185 HydrophobicContact CG1-CD1 4.08Å; I167-I185 HydrophobicContact CG2-CD1 4.28Å; I185-W187 HydrophobicContact CD1-CZ2 4.49Å; I185-W187 HydrophobicContact CG2-CD2 3.79Å; I185-W187 VanDerWaalsContact CG2-CE2 3.44Å; I185-W187 HydrophobicContact CG2-CE3 4.26Å; I185-W187 HydrophobicContact CG2-CG 4.3Å; I185-W187 HydrophobicContact CG2-CH2 4.09Å; I185-W187 HydrophobicContact CG2-CZ2 3.62Å; I185-W187 HydrophobicContact CG2-CZ3 4.4Å
186A95.3Very high92.6Very high14 Ų1471.5 Ų71.512%0.11640%0.396CS..  trans-103.182-178.300000110.4Y170 E172 R174Y170-A186 PolarHBondContact O-N 2.8Å; E172-A186 HydrophobicContact CG-CB 3.69Å; E172-A186 WeakPolarHBondContact OE1-CB 3.29Å; R174-A186 VanDerWaalsContact NE-CB 3.35Å
187W94.7Very high92.4Very high31 Ų3169.2 Ų69.212%0.11739%0.392CS..PPolyproline II helixtrans-62138.2177.8-59.9115.6000111.1P166 I167 Y170 I185 Y203 T205 E206 F209P166-W187 HydrophobicContact CB-CH2 4.4Å; P166-W187 HydrophobicContact CB-CZ3 4.01Å; I167-W187 HydrophobicContact CG1-CH2 4.25Å; Y170-W187 AromaticContact CD2-CE3 3.67Å; Y170-W187 HydrophobicContact CD2-CE3 3.67Å; Y170-W187 AromaticContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CE2-CE3 4.27Å; Y170-W187 HydrophobicContact CE2-CZ3 4.26Å; Y170-W187 HydrophobicContact CG-CE3 4.34Å; I185-W187 HydrophobicContact CD1-CZ2 4.49Å; I185-W187 HydrophobicContact CG2-CD2 3.79Å; I185-W187 VanDerWaalsContact CG2-CE2 3.44Å; I185-W187 HydrophobicContact CG2-CE3 4.26Å; I185-W187 HydrophobicContact CG2-CG 4.3Å; I185-W187 HydrophobicContact CG2-CH2 4.09Å; I185-W187 HydrophobicContact CG2-CZ2 3.62Å; I185-W187 HydrophobicContact CG2-CZ3 4.4Å; W187-Y203 HydrophobicContact CB-CD1 4.15Å; W187-T205 HydrophobicContact CE3-CG2 3.86Å; W187-T205 HydrophobicContact CZ3-CG2 4.02Å; W187-E206 HydrophobicContact CB-CB 4.07Å; W187-E206 HydrophobicContact CD2-CB 3.83Å; W187-E206 HydrophobicContact CD2-CG 4.21Å; W187-E206 HydrophobicContact CE3-CB 4.48Å; W187-E206 HydrophobicContact CG-CB 3.62Å; W187-E206 HydrophobicContact CG-CG 4.03Å; W187-E206 PolarHBondContact NE1-OE1 3.35Å; W187-F209 HydrophobicContact CH2-CB 3.7Å; W187-F209 AromaticContact CH2-CD1 3.48Å; W187-F209 HydrophobicContact CH2-CD1 3.48Å; W187-F209 VanDerWaalsContact CH2-CD1 3.48Å; W187-F209 AromaticContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CE1 4.09Å; W187-F209 HydrophobicContact CH2-CE2 4.34Å; W187-F209 AromaticContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CZ2-CB 4.34Å; W187-F209 AromaticContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CE1 4.19Å; W187-F209 AromaticContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ3-CB 4.04Å; W187-F209 HydrophobicContact CZ3-CD2 4.38Å; W187-F209 HydrophobicContact CZ3-CG 4.07Å
188P94.2Very high92.2Very high41 Ų4172.1 Ų72.127%0.26640%0.402SS..PPolyproline II helixtrans-63.6138.517627.8-34.3000110.1Y170 T205Y170-P188 HydrophobicContact CE1-CG 4.02Å; Y170-P188 HydrophobicContact CE2-CG 4.46Å; P188-T205 HydrophobicContact CG-CG2 4.16Å; P188-T205 WeakPolarHBondContact CG-OG1 3.33Å
189A91.1Very high91.9Very high55 Ų5570.9 Ų70.946%0.45539%0.392SS..PPolyproline II helixtrans-100.9121.4176.900000109.7Y203A189-Y203 HydrophobicContact CB-CD1 4.12Å; A189-Y203 HydrophobicContact CB-CE1 3.65Å
190D89.5Confident91.5Very high69 Ų6970 Ų7037%0.36938%0.378SS..EExtended strand (participates in β ladder)trans-92.2125.3172.2-56.4-49.9000108.7T201 S202 T204D190-T201 CarbonylContact O-C 3.52Å; D190-T201 WeakPolarHBondContact O-CA 3.47Å; D190-S202 PolarHBondContact N-O 3.42Å; D190-S202 PolarHBondContact O-N 3.25Å; D190-T204 WeakPolarHBondContact OD2-CB 3.26Å; D190-T204 WeakPolarHBondContact OD2-CG2 3.23Å; D190-T204 PolarHBondContact OD2-OG1 3.02Å
191S88.5Confident91Very high95 Ų9572.4 Ų72.466%0.66439%0.392SS*.EExtended strand (participates in β ladder)trans-94.1134.9175.157.30000110.7R200S191-R200 CarbonylContact C-O 3.57Å; S191-R200 WeakPolarHBondContact CA-O 3.17Å
192F87.6Confident90.5Very high97 Ų9772 Ų7243%0.42539%0.392SS..EExtended strand (participates in β ladder)trans-140.2149.217671-84.7000110.1T199 R200F192-T199 CarbonylContact O-C 3.59Å; F192-T199 WeakPolarHBondContact O-CA 3.28Å; F192-R200 HydrophobicContact CD1-CB 4.18Å; F192-R200 WeakPolarHBondContact CD1-O 3.46Å; F192-R200 HydrophobicContact CD2-CB 4.45Å; F192-R200 HydrophobicContact CE1-CB 3.6Å; F192-R200 HydrophobicContact CE2-CB 3.93Å; F192-R200 HydrophobicContact CE2-CG 4.47Å; F192-R200 HydrophobicContact CZ-CB 3.48Å; F192-R200 VanDerWaalsContact CZ-CB 3.48Å; F192-R200 HydrophobicContact CZ-CG 4.29Å; F192-R200 PolarHBondContact N-O 3.32Å; F192-R200 PolarHBondContact O-N 2.94Å
193H87.9Confident90.2Very high130 Ų13075.2 Ų75.260%0.60240%0.401SS*.EExtended strand (participates in β ladder)trans-87.5130.1172.9-71.1-86.6000109.9G197 Q198 T199H193-G197 PolarHBondContact ND1-O 2.96Å; H193-Q198 WeakPolarHBondContact CA-O 3.34Å; H193-T199 PolarHBondContact CE1-OG1 2.58Å; H193-T199 PolarHBondContact ND1-OG1 2.86Å
194D85.7Confident89.9Confident20 Ų2076.9 Ų76.911%0.10741%0.411CS..  trans-75.5176172.8766.9000112F196 G197 Q198 R200D194-F196 PolarHBondContact O-N 2.93Å; D194-F196 VanDerWaalsContact OD1-CA 3.32Å; D194-F196 WeakPolarHBondContact OD1-CA 3.19Å; D194-F196 WeakPolarHBondContact OD1-CB 3.32Å; D194-F196 PolarHBondContact OD1-N 3.49Å; D194-G197 PolarHBondContact O-N 3.3Å; D194-G197 PolarHBondContact OD1-N 3.49Å; D194-Q198 PolarHBondContact N-O 2.87Å; D194-Q198 WeakPolarHBondContact OD1-CB 3.5Å; D194-Q198 PolarHBondContact OD1-N 3.34Å; D194-R200 HydrophobicContact CB-CG 4.27Å; D194-R200 IonicContact OD2-CZ 3.12Å; D194-R200 IonicContact OD2-NE 2.8Å; D194-R200 PolarHBondContact OD2-NE 2.88Å; D194-R200 IonicContact OD2-NH2 2.74Å; D194-R200 PolarHBondContact OD2-NH2 2.71Å
195Q89.7Confident89.9Confident174 Ų17476.2 Ų76.281%0.81341%0.407SS*.THydrogen-bonded Turntrans-59.4-14.1178.568.2-170.5-0.100114.6
196F90.7Very high89.8Confident146 Ų14676.7 Ų76.764%0.6441%0.408SS*.THydrogen-bonded Turntrans-101.49.6176.2-56.3-72.3000112.2D194 Q198D194-F196 PolarHBondContact O-N 2.93Å; D194-F196 VanDerWaalsContact OD1-CA 3.32Å; D194-F196 WeakPolarHBondContact OD1-CA 3.19Å; D194-F196 WeakPolarHBondContact OD1-CB 3.32Å; D194-F196 PolarHBondContact OD1-N 3.49Å; F196-Q198 PolarHBondContact O-N 3.35Å
197G88.5Confident89.8Confident49 Ų4978.4 Ų78.451%0.50541%0.414SS..SBendtrans76.13.3-177.500000114.5H193 D194H193-G197 PolarHBondContact ND1-O 2.96Å; D194-G197 PolarHBondContact O-N 3.3Å; D194-G197 PolarHBondContact OD1-N 3.49Å
198Q88.8Confident89.8Confident121 Ų12184.9 Ų84.957%0.56544%0.439SS*.  trans-79.5130.3-179.1-65.1179.664.900110.6H193 D194 F196 R200H193-Q198 WeakPolarHBondContact CA-O 3.34Å; D194-Q198 PolarHBondContact N-O 2.87Å; D194-Q198 WeakPolarHBondContact OD1-CB 3.5Å; D194-Q198 PolarHBondContact OD1-N 3.34Å; F196-Q198 PolarHBondContact O-N 3.35Å; Q198-R200 PolarHBondContact O-N 3.41Å
199T86Confident90Very high87 Ų8783.6 Ų83.653%0.53443%0.43SS..EExtended strand (participates in β ladder)trans-69.1116.3173.7-48.40000109.7F192 H193F192-T199 CarbonylContact O-C 3.59Å; F192-T199 WeakPolarHBondContact O-CA 3.28Å; H193-T199 PolarHBondContact CE1-OG1 2.58Å; H193-T199 PolarHBondContact ND1-OG1 2.86Å
200R85Confident90.3Very high128 Ų12881.4 Ų81.448%0.48341%0.41SS..EExtended strand (participates in β ladder)trans-108149170.9-63.6-169.1-174.5-168.62109.7S191 F192 D194 Q198S191-R200 CarbonylContact C-O 3.57Å; S191-R200 WeakPolarHBondContact CA-O 3.17Å; F192-R200 HydrophobicContact CD1-CB 4.18Å; F192-R200 WeakPolarHBondContact CD1-O 3.46Å; F192-R200 HydrophobicContact CD2-CB 4.45Å; F192-R200 HydrophobicContact CE1-CB 3.6Å; F192-R200 HydrophobicContact CE2-CB 3.93Å; F192-R200 HydrophobicContact CE2-CG 4.47Å; F192-R200 HydrophobicContact CZ-CB 3.48Å; F192-R200 VanDerWaalsContact CZ-CB 3.48Å; F192-R200 HydrophobicContact CZ-CG 4.29Å; F192-R200 PolarHBondContact N-O 3.32Å; F192-R200 PolarHBondContact O-N 2.94Å; D194-R200 HydrophobicContact CB-CG 4.27Å; D194-R200 IonicContact OD2-CZ 3.12Å; D194-R200 IonicContact OD2-NE 2.8Å; D194-R200 PolarHBondContact OD2-NE 2.88Å; D194-R200 IonicContact OD2-NH2 2.74Å; D194-R200 PolarHBondContact OD2-NH2 2.71Å; Q198-R200 PolarHBondContact O-N 3.41Å
201T85Confident90.6Very high90 Ų9082.2 Ų82.255%0.55241%0.414SS*.EExtended strand (participates in β ladder)trans-105.3131174.850.90000109.7D190D190-T201 CarbonylContact O-C 3.52Å; D190-T201 WeakPolarHBondContact O-CA 3.47Å
202S86.4Confident91.1Very high31 Ų3180.9 Ų80.922%0.21740%0.395CS..EExtended strand (participates in β ladder)trans-117.6135.6173.1-175.20000109.9D190 T204D190-S202 PolarHBondContact N-O 3.42Å; D190-S202 PolarHBondContact O-N 3.25Å; S202-T204 VanDerWaalsContact C-N 3.34Å; S202-T204 PolarHBondContact O-N 3.39Å; S202-T204 WeakPolarHBondContact OG-CG2 3.41Å
203Y90.4Very high91.6Very high98 Ų9876.3 Ų76.338%0.38438%0.375SS..  trans-96.657.8175-63.9-83.6000109.8W187 A189 T205 E206 H207W187-Y203 HydrophobicContact CB-CD1 4.15Å; A189-Y203 HydrophobicContact CB-CD1 4.12Å; A189-Y203 HydrophobicContact CB-CE1 3.65Å; Y203-T205 PolarHBondContact O-N 3.49Å; Y203-T205 VanDerWaalsContact O-N 3.12Å; Y203-E206 WeakPolarHBondContact O-CB 3.4Å; Y203-E206 PolarHBondContact O-N 2.98Å; Y203-H207 VanDerWaalsContact C-ND1 3.32Å; Y203-H207 PolarHBondContact O-N 2.92Å; Y203-H207 PolarHBondContact O-ND1 3.13Å
204T91.7Very high92Very high48 Ų4872.1 Ų72.129%0.29436%0.355SS..Hα-helixtrans-54-40.1-168.665.50000112.5D190 S202 E206 H207 Y208D190-T204 WeakPolarHBondContact OD2-CB 3.26Å; D190-T204 WeakPolarHBondContact OD2-CG2 3.23Å; D190-T204 PolarHBondContact OD2-OG1 3.02Å; S202-T204 VanDerWaalsContact C-N 3.34Å; S202-T204 PolarHBondContact O-N 3.39Å; S202-T204 WeakPolarHBondContact OG-CG2 3.41Å; T204-E206 VanDerWaalsContact C-N 3.31Å; T204-E206 PolarHBondContact O-N 3.44Å; T204-H207 WeakPolarHBondContact O-CB 3.49Å; T204-H207 PolarHBondContact O-N 2.92Å; T204-H207 VanDerWaalsContact O-N 3.13Å; T204-Y208 WeakPolarHBondContact O-CD2 3.29Å; T204-Y208 PolarHBondContact O-N 3.46Å
205T94.2Very high92.6Very high37 Ų3773.5 Ų73.523%0.22736%0.364CS..Hα-helixtrans-58.9-40.3177.6-62.20000112.4Y170 W187 P188 Y203 F209Y170-T205 HydrophobicContact CD2-CG2 4.4Å; Y170-T205 HydrophobicContact CE2-CG2 3.65Å; W187-T205 HydrophobicContact CE3-CG2 3.86Å; W187-T205 HydrophobicContact CZ3-CG2 4.02Å; P188-T205 HydrophobicContact CG-CG2 4.16Å; P188-T205 WeakPolarHBondContact CG-OG1 3.33Å; Y203-T205 PolarHBondContact O-N 3.49Å; Y203-T205 VanDerWaalsContact O-N 3.12Å; T205-F209 WeakPolarHBondContact O-CB 3.3Å; T205-F209 PolarHBondContact O-N 3.38Å
206E95Very high93Very high50 Ų5069 Ų6923%0.23435%0.345CS..Hα-helixtrans-64.9-41.5175.7-177.3170.9-15900111.8W187 Y203 T204 F209 T210 V284W187-E206 HydrophobicContact CB-CB 4.07Å; W187-E206 HydrophobicContact CD2-CB 3.83Å; W187-E206 HydrophobicContact CD2-CG 4.21Å; W187-E206 HydrophobicContact CE3-CB 4.48Å; W187-E206 HydrophobicContact CG-CB 3.62Å; W187-E206 HydrophobicContact CG-CG 4.03Å; W187-E206 PolarHBondContact NE1-OE1 3.35Å; Y203-E206 WeakPolarHBondContact O-CB 3.4Å; Y203-E206 PolarHBondContact O-N 2.98Å; T204-E206 VanDerWaalsContact C-N 3.31Å; T204-E206 PolarHBondContact O-N 3.44Å; E206-F209 PolarHBondContact O-N 3.28Å; E206-T210 VanDerWaalsContact O-CB 3.26Å; E206-T210 WeakPolarHBondContact O-CB 3.45Å; E206-T210 PolarHBondContact O-N 3.47Å; E206-T210 PolarHBondContact O-OG1 2.94Å; E206-V284 HydrophobicContact CG-CG1 4.36Å; E206-V284 HydrophobicContact CG-CG2 3.99Å
207H94.8Very high93.2Very high50 Ų5062.4 Ų62.423%0.23132%0.317CS..Hα-helixtrans-62.1-49.7178.1-61.986.3000111.2Y203 T204 T210 L211 V284 F285Y203-H207 VanDerWaalsContact C-ND1 3.32Å; Y203-H207 PolarHBondContact O-N 2.92Å; Y203-H207 PolarHBondContact O-ND1 3.13Å; T204-H207 WeakPolarHBondContact O-CB 3.49Å; T204-H207 PolarHBondContact O-N 2.92Å; T204-H207 VanDerWaalsContact O-N 3.13Å; H207-T210 PolarHBondContact O-N 3.18Å; H207-L211 VanDerWaalsContact O-CB 3.32Å; H207-L211 WeakPolarHBondContact O-CB 3.41Å; H207-L211 PolarHBondContact O-N 3.04Å; H207-V284 HydrophobicContact CB-CG1 4.24Å; H207-V284 PolarHBondContact NE2-O 2.85Å; H207-F285 HydrophobicContact CB-CE1 4.15Å; H207-F285 HydrophobicContact CB-CZ 4.24Å; H207-F285 AromaticContact CD2-CD1 3.74Å; H207-F285 AromaticContact CD2-CE1 3.7Å
208Y96.1Very high93.6Very high166 Ų16660.8 Ų60.865%0.65130%0.296SS*.Hα-helixtrans-61.6-47.5176.9-73.1-65.8000111.1T204 T210 L211 Y212T204-Y208 WeakPolarHBondContact O-CD2 3.29Å; T204-Y208 PolarHBondContact O-N 3.46Å; Y208-T210 VanDerWaalsContact C-N 3.35Å; Y208-T210 PolarHBondContact O-N 3.43Å; Y208-L211 PolarHBondContact O-N 3.5Å; Y208-Y212 WeakPolarHBondContact O-CD1 3.07Å; Y208-Y212 PolarHBondContact O-N 2.9Å
209F97.4Very high93.9Very high15 Ų1558.2 Ų58.27%0.06629%0.286CS..Hα-helixtrans-53.6-51.5177.1179-92.7000112.3M164 P166 I167 W187 T205 E206 Y212 S213M164-F209 HydrophobicContact CE-CZ 4.42Å; M164-F209 HydrophobicContact SD-CE2 4.24Å; M164-F209 HydrophobicContact SD-CZ 3.89Å; P166-F209 HydrophobicContact CB-CD2 3.93Å; P166-F209 HydrophobicContact CB-CE2 4.42Å; P166-F209 HydrophobicContact CG-CD2 4.12Å; I167-F209 HydrophobicContact CD1-CE1 3.78Å; I167-F209 HydrophobicContact CD1-CE2 4.1Å; I167-F209 HydrophobicContact CD1-CZ 3.3Å; I167-F209 HydrophobicContact CG1-CE1 4.09Å; I167-F209 HydrophobicContact CG1-CE2 3.9Å; I167-F209 HydrophobicContact CG1-CZ 3.56Å; W187-F209 HydrophobicContact CH2-CB 3.7Å; W187-F209 AromaticContact CH2-CD1 3.48Å; W187-F209 HydrophobicContact CH2-CD1 3.48Å; W187-F209 VanDerWaalsContact CH2-CD1 3.48Å; W187-F209 AromaticContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CE1 4.09Å; W187-F209 HydrophobicContact CH2-CE2 4.34Å; W187-F209 AromaticContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CZ2-CB 4.34Å; W187-F209 AromaticContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CE1 4.19Å; W187-F209 AromaticContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ3-CB 4.04Å; W187-F209 HydrophobicContact CZ3-CD2 4.38Å; W187-F209 HydrophobicContact CZ3-CG 4.07Å; T205-F209 WeakPolarHBondContact O-CB 3.3Å; T205-F209 PolarHBondContact O-N 3.38Å; E206-F209 PolarHBondContact O-N 3.28Å; F209-Y212 HydrophobicContact CB-CE1 4.29Å; F209-Y212 HydrophobicContact CD2-CE1 4.2Å; F209-Y212 HydrophobicContact CD2-CE2 4.36Å; F209-Y212 AromaticContact CD2-CZ 3.62Å; F209-Y212 WeakPolarHBondContact CD2-OH 3.28Å; F209-Y212 HydrophobicContact CE2-CE2 4.44Å; F209-Y212 WeakPolarHBondContact CE2-OH 2.99Å; F209-S213 WeakPolarHBondContact CZ-OG 3.27Å; F209-S213 WeakPolarHBondContact O-CB 3.27Å; F209-S213 PolarHBondContact O-N 3.21Å; F209-S213 PolarHBondContact O-OG 3.11Å
210T96.9Very high94.4Very high9 Ų957.5 Ų57.56%0.05528%0.278CS..Hα-helixtrans-64.1-44-177.8-59.80000110.9E206 H207 Y208 F214 W277 N280 L281 V284E206-T210 VanDerWaalsContact O-CB 3.26Å; E206-T210 WeakPolarHBondContact O-CB 3.45Å; E206-T210 PolarHBondContact O-N 3.47Å; E206-T210 PolarHBondContact O-OG1 2.94Å; H207-T210 PolarHBondContact O-N 3.18Å; Y208-T210 VanDerWaalsContact C-N 3.35Å; Y208-T210 PolarHBondContact O-N 3.43Å; T210-F214 VanDerWaalsContact O-CB 3.24Å; T210-F214 WeakPolarHBondContact O-CB 3.17Å; T210-F214 PolarHBondContact O-N 2.94Å; T210-W277 HydrophobicContact CG2-CZ3 4.4Å; T210-N280 HydrophobicContact CG2-CB 4.48Å; T210-L281 HydrophobicContact CG2-CD2 4.17Å; T210-V284 HydrophobicContact CG2-CB 4.42Å; T210-V284 HydrophobicContact CG2-CG2 4.15Å
211L97.5Very high94.9Very high86 Ų8652 Ų5245%0.4526%0.26SS..Hα-helixtrans-66.3-50.4-177.5-174.564.6000112.3H207 Y208 S213 F214 V215 F285H207-L211 VanDerWaalsContact O-CB 3.32Å; H207-L211 WeakPolarHBondContact O-CB 3.41Å; H207-L211 PolarHBondContact O-N 3.04Å; Y208-L211 PolarHBondContact O-N 3.5Å; L211-S213 VanDerWaalsContact C-N 3.33Å; L211-S213 PolarHBondContact O-N 3.22Å; L211-F214 WeakPolarHBondContact O-CB 3.11Å; L211-F214 PolarHBondContact O-N 2.98Å; L211-V215 WeakPolarHBondContact O-CG2 3Å; L211-V215 PolarHBondContact O-N 2.9Å; L211-V215 VanDerWaalsContact O-N 3.08Å; L211-F285 HydrophobicContact CB-CZ 4.37Å
212Y97.6Very high95.4Very high67 Ų6748.1 Ų48.126%0.26324%0.236SC..Hα-helixtrans-69.3-35.2179.876.4-114.1000111.3L163 Y208 F209 F214 V215 L216L163-Y212 HydrophobicContact CB-CE2 4.44Å; L163-Y212 HydrophobicContact CD2-CD2 4.35Å; L163-Y212 HydrophobicContact CD2-CE2 4.22Å; L163-Y212 PolarHBondContact O-OH 3.41Å; Y208-Y212 WeakPolarHBondContact O-CD1 3.07Å; Y208-Y212 PolarHBondContact O-N 2.9Å; F209-Y212 HydrophobicContact CB-CE1 4.29Å; F209-Y212 HydrophobicContact CD2-CE1 4.2Å; F209-Y212 HydrophobicContact CD2-CE2 4.36Å; F209-Y212 AromaticContact CD2-CZ 3.62Å; F209-Y212 WeakPolarHBondContact CD2-OH 3.28Å; F209-Y212 HydrophobicContact CE2-CE2 4.44Å; F209-Y212 WeakPolarHBondContact CE2-OH 2.99Å; Y212-F214 VanDerWaalsContact C-N 3.33Å; Y212-V215 PolarHBondContact O-N 3.27Å; Y212-L216 HydrophobicContact CD2-CD1 4.23Å; Y212-L216 VanDerWaalsContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CB 3.25Å; Y212-L216 VanDerWaalsContact O-CG 3.29Å; Y212-L216 WeakPolarHBondContact O-CG 3.24Å; Y212-L216 PolarHBondContact O-N 3.27Å
213S97.5Very high95.8Very high0 Ų051.5 Ų51.50%025%0.25CS..Hα-helixtrans-67.1-38.3178-61.90000110.6F209 L211 V215 C217F209-S213 WeakPolarHBondContact CZ-OG 3.27Å; F209-S213 WeakPolarHBondContact O-CB 3.27Å; F209-S213 PolarHBondContact O-N 3.21Å; F209-S213 PolarHBondContact O-OG 3.11Å; L211-S213 VanDerWaalsContact C-N 3.33Å; L211-S213 PolarHBondContact O-N 3.22Å; S213-V215 PolarHBondContact O-N 3.37Å; S213-C217 WeakPolarHBondContact O-CA 3.42Å; S213-C217 WeakPolarHBondContact O-CB 3.18Å; S213-C217 PolarHBondContact O-N 3.2Å
214F97.8Very high96Very high42 Ų4249.7 Ų49.718%0.18425%0.246CC..Hα-helixtrans-58.2-48.9172.2168.6-108.9000111.1T210 L211 Y212 F218 L219 W277 L281T210-F214 VanDerWaalsContact O-CB 3.24Å; T210-F214 WeakPolarHBondContact O-CB 3.17Å; T210-F214 PolarHBondContact O-N 2.94Å; L211-F214 WeakPolarHBondContact O-CB 3.11Å; L211-F214 PolarHBondContact O-N 2.98Å; Y212-F214 VanDerWaalsContact C-N 3.33Å; F214-F218 AromaticContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CE1 4.35Å; F214-F218 AromaticContact CE2-CD1 3.4Å; F214-F218 HydrophobicContact CE2-CD1 3.4Å; F214-F218 AromaticContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CZ-CD1 4.31Å; F214-F218 HydrophobicContact CZ-CE1 4.42Å; F214-F218 WeakPolarHBondContact O-CB 3.22Å; F214-F218 PolarHBondContact O-N 3.46Å; F214-L219 HydrophobicContact CE1-CB 4.46Å; F214-L219 HydrophobicContact CE1-CD2 4.21Å; F214-L219 PolarHBondContact O-N 3.39Å; F214-W277 VanDerWaalsContact CA-CZ3 3.49Å; F214-W277 HydrophobicContact CB-CD2 4.2Å; F214-W277 HydrophobicContact CB-CE3 3.59Å; F214-W277 HydrophobicContact CB-CH2 4.24Å; F214-W277 HydrophobicContact CB-CZ3 3.64Å; F214-W277 HydrophobicContact CD2-CB 3.74Å; F214-W277 AromaticContact CD2-CD2 3.77Å; F214-W277 HydrophobicContact CD2-CD2 3.77Å; F214-W277 AromaticContact CD2-CE3 3.81Å; F214-W277 HydrophobicContact CD2-CE3 3.81Å; F214-W277 AromaticContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CE2-CB 3.96Å; F214-W277 HydrophobicContact CE2-CG 4.33Å; F214-W277 HydrophobicContact CG-CD2 4.49Å; F214-W277 HydrophobicContact CG-CE3 4.19Å; F214-L281 HydrophobicContact CB-CD2 4.47Å; F214-L281 HydrophobicContact CD1-CD1 4.28Å; F214-L281 HydrophobicContact CD2-CD1 3.85Å; F214-L281 HydrophobicContact CE1-CD1 4.27Å; F214-L281 HydrophobicContact CE2-CD1 3.81Å; F214-L281 HydrophobicContact CG-CD1 4.07Å; F214-L281 HydrophobicContact CG-CD2 4.42Å; F214-L281 HydrophobicContact CZ-CD1 4.03Å
215V97.9Very high96Very high50 Ų5047.4 Ų47.430%0.30323%0.233SC..Iπ-helixtrans-67.1-53.1-178174.50000111.4L211 Y212 S213 L219 I220L211-V215 WeakPolarHBondContact O-CG2 3Å; L211-V215 PolarHBondContact O-N 2.9Å; L211-V215 VanDerWaalsContact O-N 3.08Å; Y212-V215 PolarHBondContact O-N 3.27Å; S213-V215 PolarHBondContact O-N 3.37Å; V215-L219 PolarHBondContact O-N 2.98Å; V215-I220 HydrophobicContact CG1-CD1 4.11Å; V215-I220 HydrophobicContact CG1-CG1 4.31Å; V215-I220 WeakPolarHBondContact O-CB 2.91Å; V215-I220 WeakPolarHBondContact O-CG1 3.37Å; V215-I220 PolarHBondContact O-N 3.49Å
216L97.2Very high96Very high78 Ų7849.8 Ų49.841%0.40824%0.243SC..Iπ-helixtrans-79.2-37.2-170.8-62.2179.5000113L163 Y212 I220 P221L163-L216 HydrophobicContact CD1-CB 4.35Å; L163-L216 HydrophobicContact CD1-CD1 4.02Å; L163-L216 HydrophobicContact CD2-CD1 3.69Å; Y212-L216 HydrophobicContact CD2-CD1 4.23Å; Y212-L216 VanDerWaalsContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CB 3.25Å; Y212-L216 VanDerWaalsContact O-CG 3.29Å; Y212-L216 WeakPolarHBondContact O-CG 3.24Å; Y212-L216 PolarHBondContact O-N 3.27Å; L216-I220 HydrophobicContact CD2-CD1 3.87Å; L216-P221 VanDerWaalsContact O-CD 3.26Å; L216-P221 WeakPolarHBondContact O-CD 3.5Å
217C95.7Very high95.9Very high8 Ų853.1 Ų53.15%0.05426%0.257CS..Iπ-helixtrans-100-7-174.1-530000113.5Y117 V120 S213Y117-C217 HydrophobicContact CD1-CB 3.44Å; Y117-C217 VanDerWaalsContact CD1-CB 3.44Å; Y117-C217 HydrophobicContact CE1-CB 3.87Å; Y117-C217 HydrophobicContact CG-CB 3.86Å; V120-C217 WeakPolarHBondContact CG1-O 3.2Å; S213-C217 WeakPolarHBondContact O-CA 3.42Å; S213-C217 WeakPolarHBondContact O-CB 3.18Å; S213-C217 PolarHBondContact O-N 3.2Å
218F95.9Very high95.8Very high15 Ų1551.2 Ų51.27%0.06625%0.249CC..Iπ-helixtrans-134.8-55.8175.6168.9-99.6000115F214 S222 Y269 W273 T274 W277F214-F218 AromaticContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CE1 4.35Å; F214-F218 AromaticContact CE2-CD1 3.4Å; F214-F218 HydrophobicContact CE2-CD1 3.4Å; F214-F218 AromaticContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CZ-CD1 4.31Å; F214-F218 HydrophobicContact CZ-CE1 4.42Å; F214-F218 WeakPolarHBondContact O-CB 3.22Å; F214-F218 PolarHBondContact O-N 3.46Å; F218-S222 WeakPolarHBondContact O-CB 3.39Å; F218-S222 PolarHBondContact O-N 3.33Å; F218-S222 PolarHBondContact O-OG 3.38Å; F218-Y269 HydrophobicContact CD2-CE1 4.37Å; F218-Y269 AromaticContact CD2-CZ 3.87Å; F218-Y269 VanDerWaalsContact CD2-OH 3.23Å; F218-Y269 WeakPolarHBondContact CD2-OH 2.88Å; F218-Y269 HydrophobicContact CE2-CE1 4.31Å; F218-Y269 PolarHBondContact O-OH 2.67Å; F218-W273 HydrophobicContact CD2-CB 3.72Å; F218-W273 HydrophobicContact CE2-CB 3.65Å; F218-T274 HydrophobicContact CZ-CG2 4.46Å; F218-T274 WeakPolarHBondContact CZ-OG1 3.33Å; F218-W277 HydrophobicContact CB-CD2 4.3Å; F218-W277 HydrophobicContact CB-CG 4.14Å; F218-W277 HydrophobicContact CB-CZ2 4.26Å; F218-W277 HydrophobicContact CD1-CB 4.28Å; F218-W277 AromaticContact CD1-CD1 3.62Å; F218-W277 AromaticContact CD1-CG 3.95Å; F218-W277 HydrophobicContact CD1-CG 3.95Å; F218-W277 AromaticContact CD2-CD1 3.39Å; F218-W277 HydrophobicContact CD2-CG 4.43Å; F218-W277 AromaticContact CD2-NE1 3.8Å; F218-W277 HydrophobicContact CE1-CB 4.4Å; F218-W277 HydrophobicContact CE1-CG 4.49Å; F218-W277 AromaticContact CG-CD1 3.16Å; F218-W277 AromaticContact CG-CG 3.92Å; F218-W277 HydrophobicContact CG-CG 3.92Å; F218-W277 AromaticContact CG-NE1 3.45Å
219L96.9Very high95.4Very high67 Ų6746.4 Ų46.435%0.35123%0.23SC..Iπ-helixtrans-64-51-172.7-175.361.5000111.7F214 V215 S222 I223F214-L219 HydrophobicContact CE1-CB 4.46Å; F214-L219 HydrophobicContact CE1-CD2 4.21Å; F214-L219 PolarHBondContact O-N 3.39Å; V215-L219 PolarHBondContact O-N 2.98Å; L219-S222 WeakPolarHBondContact O-CB 3.37Å; L219-S222 PolarHBondContact O-N 2.87Å; L219-I223 HydrophobicContact CD1-CD1 4.19Å; L219-I223 HydrophobicContact CG-CD1 4.03Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.26Å; L219-I223 PolarHBondContact O-N 2.92Å
220I96.2Very high95.2Very high73 Ų7351.8 Ų51.837%0.37425%0.251SS..Hα-helixtrans-60.9-52.4177.4-69.5174.4000111.1V215 L216 S222 I223 I224V215-I220 HydrophobicContact CG1-CD1 4.11Å; V215-I220 HydrophobicContact CG1-CG1 4.31Å; V215-I220 WeakPolarHBondContact O-CB 2.91Å; V215-I220 WeakPolarHBondContact O-CG1 3.37Å; V215-I220 PolarHBondContact O-N 3.49Å; L216-I220 HydrophobicContact CD2-CD1 3.87Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 2.92Å; I220-I223 PolarHBondContact O-N 3.5Å; I220-I224 HydrophobicContact CG2-CD1 3.78Å; I220-I224 HydrophobicContact CG2-CG1 4.47Å; I220-I224 WeakPolarHBondContact O-CG1 3.43Å; I220-I224 PolarHBondContact O-N 3.24Å
221P95.2Very high94.8Very high13 Ų1354.3 Ų54.38%0.08426%0.264CS..Hα-helixtrans-52.9-43.1172.9-31.837.4000114.1V120 S124 L216 I224 M225V120-P221 HydrophobicContact CG1-CB 3.54Å; V120-P221 HydrophobicContact CG1-CG 3.96Å; S124-P221 WeakPolarHBondContact OG-CB 3.37Å; L216-P221 VanDerWaalsContact O-CD 3.26Å; L216-P221 WeakPolarHBondContact O-CD 3.5Å; P221-I224 PolarHBondContact O-N 2.86Å; P221-M225 HydrophobicContact CB-CE 4.01Å; P221-M225 WeakPolarHBondContact O-CB 3.17Å; P221-M225 VanDerWaalsContact O-CE 3.28Å; P221-M225 WeakPolarHBondContact O-CE 3.22Å; P221-M225 WeakPolarHBondContact O-CG 3.47Å; P221-M225 PolarHBondContact O-N 3.46Å
222S95.2Very high94.4Very high7 Ų750.3 Ų50.35%0.04924%0.243CC..Hα-helixtrans-61.2-47.6178-63.90000111.7F218 L219 I220 I224 M225 I226 Y269F218-S222 WeakPolarHBondContact O-CB 3.39Å; F218-S222 PolarHBondContact O-N 3.33Å; F218-S222 PolarHBondContact O-OG 3.38Å; L219-S222 WeakPolarHBondContact O-CB 3.37Å; L219-S222 PolarHBondContact O-N 2.87Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 2.92Å; S222-I224 VanDerWaalsContact C-N 3.34Å; S222-I224 PolarHBondContact O-N 2.93Å; S222-M225 PolarHBondContact O-N 3.2Å; S222-I226 WeakPolarHBondContact O-CB 3.44Å; S222-I226 VanDerWaalsContact O-CG1 3.23Å; S222-I226 WeakPolarHBondContact O-CG1 3.36Å; S222-I226 PolarHBondContact O-N 3.4Å; S222-Y269 WeakPolarHBondContact OG-CE1 3.48Å; S222-Y269 PolarHBondContact OG-OH 2.88Å
223I95.7Very high93.9Very high102 Ų10248.1 Ų48.152%0.52324%0.236SC..Hα-helixtrans-60.6-46177.3-68.8166000110.2L219 I220 M225 I226 F227L219-I223 HydrophobicContact CD1-CD1 4.19Å; L219-I223 HydrophobicContact CG-CD1 4.03Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.26Å; L219-I223 PolarHBondContact O-N 2.92Å; I220-I223 PolarHBondContact O-N 3.5Å; I223-M225 PolarHBondContact O-N 2.89Å; I223-I226 PolarHBondContact O-N 3.2Å; I223-F227 WeakPolarHBondContact O-CB 3.44Å; I223-F227 PolarHBondContact O-N 2.98Å
224I93.8Very high93.5Very high60 Ų6054.8 Ų54.831%0.30826%0.262SS..Hα-helixtrans-58.5-47.8177.1-69.7169000110.5I128 I220 P221 S222 F227 C228I128-I224 HydrophobicContact CD1-CG2 3.81Å; I128-I224 HydrophobicContact CG1-CG2 3.97Å; I220-I224 HydrophobicContact CG2-CD1 3.78Å; I220-I224 HydrophobicContact CG2-CG1 4.47Å; I220-I224 WeakPolarHBondContact O-CG1 3.43Å; I220-I224 PolarHBondContact O-N 3.24Å; P221-I224 PolarHBondContact O-N 2.86Å; S222-I224 VanDerWaalsContact C-N 3.34Å; S222-I224 PolarHBondContact O-N 2.93Å; I224-F227 PolarHBondContact O-N 3.41Å; I224-C228 WeakPolarHBondContact O-CB 3.38Å; I224-C228 PolarHBondContact O-N 3.25Å; I224-C228 PolarHBondContact O-SG 3.37Å
225M92Very high92.7Very high1 Ų154.6 Ų54.61%0.00526%0.261CS..Hα-helixtrans-64.6-44.9-179.6-78.7-174.8-82.500112.7V120 I123 P221 S222 I223 C228 Y229 V266 Y269V120-M225 HydrophobicContact CG1-CE 4.42Å; I123-M225 HydrophobicContact CB-SD 4.46Å; I123-M225 HydrophobicContact CG2-SD 3.57Å; I123-M225 VanDerWaalsContact CG2-SD 3.57Å; P221-M225 HydrophobicContact CB-CE 4.01Å; P221-M225 WeakPolarHBondContact O-CB 3.17Å; P221-M225 VanDerWaalsContact O-CE 3.28Å; P221-M225 WeakPolarHBondContact O-CE 3.22Å; P221-M225 WeakPolarHBondContact O-CG 3.47Å; P221-M225 PolarHBondContact O-N 3.46Å; S222-M225 PolarHBondContact O-N 3.2Å; I223-M225 PolarHBondContact O-N 2.89Å; M225-C228 PolarHBondContact O-N 3.48Å; M225-Y229 VanDerWaalsContact O-CB 3.31Å; M225-Y229 WeakPolarHBondContact O-CB 3.48Å; M225-Y229 PolarHBondContact O-N 3.18Å; M225-V266 HydrophobicContact CB-CG1 4.49Å; M225-V266 HydrophobicContact CB-CG2 4.24Å; M225-Y269 HydrophobicContact CE-CD1 3.36Å; M225-Y269 HydrophobicContact CE-CD2 4.16Å; M225-Y269 HydrophobicContact CE-CE1 3.08Å; M225-Y269 HydrophobicContact CE-CE2 3.93Å; M225-Y269 HydrophobicContact CE-CG 3.91Å; M225-Y269 HydrophobicContact SD-CD1 3.99Å; M225-Y269 HydrophobicContact SD-CE1 4.29Å; M225-Y269 HydrophobicContact SD-CG 4.26Å
226I93.8Very high91.9Very high86 Ų8653.6 Ų53.644%0.44126%0.255SS..Hα-helixtrans-63.5-45.7177.8-69166000110.3S222 I223 Y229 Y230 L270S222-I226 WeakPolarHBondContact O-CB 3.44Å; S222-I226 VanDerWaalsContact O-CG1 3.23Å; S222-I226 WeakPolarHBondContact O-CG1 3.36Å; S222-I226 PolarHBondContact O-N 3.4Å; I223-I226 PolarHBondContact O-N 3.2Å; I226-Y229 PolarHBondContact O-N 3.42Å; I226-Y230 PolarHBondContact O-N 3.48Å; I226-L270 HydrophobicContact CD1-CD1 4.21Å; I226-L270 HydrophobicContact CG1-CD1 4.27Å
227F93.4Very high91.3Very high121 Ų12153.6 Ų53.653%0.53126%0.255SS..Hα-helixtrans-64.2-45.7178-179.8-109.9000111.9I223 I224 Y229 Y230 L231I223-F227 WeakPolarHBondContact O-CB 3.44Å; I223-F227 PolarHBondContact O-N 2.98Å; I224-F227 PolarHBondContact O-N 3.41Å; F227-Y229 VanDerWaalsContact C-N 3.32Å; F227-Y229 PolarHBondContact O-N 3.3Å; F227-Y230 WeakPolarHBondContact O-CB 3.36Å; F227-Y230 PolarHBondContact O-N 2.87Å; F227-L231 HydrophobicContact CD1-CD1 4.02Å; F227-L231 HydrophobicContact CD1-CG 4.48Å; F227-L231 HydrophobicContact CE1-CD1 3.47Å; F227-L231 VanDerWaalsContact CE1-CD1 3.47Å; F227-L231 HydrophobicContact CE1-CG 4.14Å; F227-L231 HydrophobicContact CE2-CD1 4.48Å; F227-L231 HydrophobicContact CE2-CD2 4.35Å; F227-L231 HydrophobicContact CE2-CG 4.34Å; F227-L231 HydrophobicContact CZ-CD1 3.74Å; F227-L231 HydrophobicContact CZ-CD2 4.15Å; F227-L231 HydrophobicContact CZ-CG 4.06Å; F227-L231 WeakPolarHBondContact O-CG 3.4Å; F227-L231 PolarHBondContact O-N 3.14Å
228C91.4Very high90.6Very high9 Ų956.3 Ų56.36%0.06127%0.267CS..Hα-helixtrans-54.6-50172.6-78.30000110.7I128 C131 I224 M225 Y230 L231 L232I128-C228 VanDerWaalsContact CG1-SG 3.53Å; C131-C228 WeakPolarHBondContact SG-CA 3.13Å; C131-C228 WeakPolarHBondContact SG-CB 3.02Å; C131-C228 PolarHBondContact SG-O 3.38Å; I224-C228 WeakPolarHBondContact O-CB 3.38Å; I224-C228 PolarHBondContact O-N 3.25Å; I224-C228 PolarHBondContact O-SG 3.37Å; M225-C228 PolarHBondContact O-N 3.48Å; C228-Y230 PolarHBondContact O-N 3.45Å; C228-L231 PolarHBondContact O-N 3.37Å; C228-L232 WeakPolarHBondContact O-CB 3.42Å; C228-L232 PolarHBondContact O-N 2.89Å
229Y89.2Confident89.6Confident65 Ų6556.6 Ų56.626%0.25527%0.271SS..Hα-helixtrans-58.9-45.8178171-112.7000112.6M225 I226 F227 L231 L232 V233 V262 I263M225-Y229 VanDerWaalsContact O-CB 3.31Å; M225-Y229 WeakPolarHBondContact O-CB 3.48Å; M225-Y229 PolarHBondContact O-N 3.18Å; I226-Y229 PolarHBondContact O-N 3.42Å; F227-Y229 VanDerWaalsContact C-N 3.32Å; F227-Y229 PolarHBondContact O-N 3.3Å; Y229-L231 VanDerWaalsContact C-N 3.33Å; Y229-L231 PolarHBondContact O-N 2.87Å; Y229-L232 WeakPolarHBondContact O-CB 3.43Å; Y229-L232 PolarHBondContact O-N 2.84Å; Y229-V233 HydrophobicContact CD2-CG2 3.82Å; Y229-V233 HydrophobicContact CE1-CG2 4.08Å; Y229-V233 HydrophobicContact CE2-CG2 3.13Å; Y229-V233 HydrophobicContact CG-CG2 4.48Å; Y229-V233 WeakPolarHBondContact O-CG2 3.19Å; Y229-V233 PolarHBondContact O-N 3.12Å; Y229-V233 WeakPolarHBondContact OH-CG2 3.23Å; Y229-V262 HydrophobicContact CD2-CG1 4.33Å; Y229-I263 HydrophobicContact CD2-CG1 4Å; Y229-I263 HydrophobicContact CE2-CB 4.4Å; Y229-I263 HydrophobicContact CE2-CD1 3.73Å; Y229-I263 HydrophobicContact CE2-CG1 3.09Å; Y229-I263 VanDerWaalsContact CZ-CG1 3.42Å; Y229-I263 WeakPolarHBondContact OH-CD1 3.5Å; Y229-I263 VanDerWaalsContact OH-CG1 3.32Å; Y229-I263 WeakPolarHBondContact OH-CG1 3.41Å
230Y91.8Very high88.2Confident129 Ų12955.9 Ų55.951%0.50628%0.281SS..Hα-helixtrans-55.5-47.9175.1167.2-106.6000111.8I226 F227 C228 L232 V233 R234I226-Y230 PolarHBondContact O-N 3.48Å; F227-Y230 WeakPolarHBondContact O-CB 3.36Å; F227-Y230 PolarHBondContact O-N 2.87Å; C228-Y230 PolarHBondContact O-N 3.45Å; Y230-L232 PolarHBondContact O-N 3.11Å; Y230-V233 PolarHBondContact O-N 3.42Å; Y230-R234 WeakPolarHBondContact O-CB 3.31Å; Y230-R234 PolarHBondContact O-N 3.3Å
231L90.3Very high86.8Confident62 Ų6261.6 Ų61.633%0.32530%0.297SS..Hα-helixtrans-61.9-42.7176.6-67.4-176.9000112.2F227 C228 Y229 R234 Q235F227-L231 HydrophobicContact CD1-CD1 4.02Å; F227-L231 HydrophobicContact CD1-CG 4.48Å; F227-L231 HydrophobicContact CE1-CD1 3.47Å; F227-L231 VanDerWaalsContact CE1-CD1 3.47Å; F227-L231 HydrophobicContact CE1-CG 4.14Å; F227-L231 HydrophobicContact CE2-CD1 4.48Å; F227-L231 HydrophobicContact CE2-CD2 4.35Å; F227-L231 HydrophobicContact CE2-CG 4.34Å; F227-L231 HydrophobicContact CZ-CD1 3.74Å; F227-L231 HydrophobicContact CZ-CD2 4.15Å; F227-L231 HydrophobicContact CZ-CG 4.06Å; F227-L231 WeakPolarHBondContact O-CG 3.4Å; F227-L231 PolarHBondContact O-N 3.14Å; C228-L231 PolarHBondContact O-N 3.37Å; Y229-L231 VanDerWaalsContact C-N 3.33Å; Y229-L231 PolarHBondContact O-N 2.87Å; L231-R234 PolarHBondContact O-N 2.86Å; L231-Q235 VanDerWaalsContact O-CB 3.24Å; L231-Q235 WeakPolarHBondContact O-CB 3.3Å; L231-Q235 PolarHBondContact O-N 3.4Å
232L87.2Confident85.1Confident1 Ų169.5 Ų69.51%0.00533%0.325CS..Hα-helixtrans-60.3-48.2177.3-176.1150.1000110.9R130 C228 Y229 Y230 Q235 V236 K259 V262R130-L232 HydrophobicContact CB-CD1 4.01Å; C228-L232 WeakPolarHBondContact O-CB 3.42Å; C228-L232 PolarHBondContact O-N 2.89Å; Y229-L232 WeakPolarHBondContact O-CB 3.43Å; Y229-L232 PolarHBondContact O-N 2.84Å; Y230-L232 PolarHBondContact O-N 3.11Å; L232-Q235 PolarHBondContact O-N 2.89Å; L232-V236 HydrophobicContact CD2-CG2 4.27Å; L232-V236 WeakPolarHBondContact O-CB 3.42Å; L232-V236 VanDerWaalsContact O-CG2 3.26Å; L232-V236 WeakPolarHBondContact O-CG2 3.31Å; L232-V236 PolarHBondContact O-N 3.04Å; L232-K259 HydrophobicContact CD2-CB 4.14Å; L232-K259 HydrophobicContact CD2-CG 4.28Å; L232-V262 HydrophobicContact CD1-CB 4.42Å; L232-V262 HydrophobicContact CD1-CG1 4.38Å; L232-V262 HydrophobicContact CD1-CG2 4.04Å
233V87.8Confident83.1Confident22 Ų2272.7 Ų72.713%0.13334%0.342CS..Hα-helixtrans-64.1-48.2179.5172.70000111.4Y229 Y230 Q235 V236 I237 K259Y229-V233 HydrophobicContact CD2-CG2 3.82Å; Y229-V233 HydrophobicContact CE1-CG2 4.08Å; Y229-V233 HydrophobicContact CE2-CG2 3.13Å; Y229-V233 HydrophobicContact CG-CG2 4.48Å; Y229-V233 WeakPolarHBondContact O-CG2 3.19Å; Y229-V233 PolarHBondContact O-N 3.12Å; Y229-V233 WeakPolarHBondContact OH-CG2 3.23Å; Y230-V233 PolarHBondContact O-N 3.42Å; V233-Q235 VanDerWaalsContact C-N 3.29Å; V233-Q235 PolarHBondContact O-N 3.01Å; V233-V236 PolarHBondContact O-N 2.81Å; V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.32Å; V233-I237 WeakPolarHBondContact O-CG1 3.37Å; V233-I237 PolarHBondContact O-N 3.35Å; V233-K259 HydrophobicContact CG2-CD 4.31Å; V233-K259 HydrophobicContact CG2-CG 4.45Å
234R88.2Confident81.2Confident140 Ų14077.9 Ų77.953%0.52836%0.361SS..Hα-helixtrans-56.7-46.6177.7-177.2-179.4168.2-164.4-1.3110.6Y230 L231 V236 I237 M238Y230-R234 WeakPolarHBondContact O-CB 3.31Å; Y230-R234 PolarHBondContact O-N 3.3Å; L231-R234 PolarHBondContact O-N 2.86Å; R234-V236 PolarHBondContact O-N 3.25Å; R234-I237 PolarHBondContact O-N 2.84Å; R234-M238 HydrophobicContact CG-CG 4.33Å; R234-M238 WeakPolarHBondContact O-CB 3.33Å; R234-M238 WeakPolarHBondContact O-CG 3.23Å; R234-M238 PolarHBondContact O-N 3.1Å
235Q83Confident79.4Confident37 Ų3784.5 Ų84.517%0.17339%0.387CS..Hα-helixtrans-64.5-40.2179.2-17963.31700112.1V134 L231 L232 V233 S239V134-Q235 HydrophobicContact CG1-CB 4.34Å; V134-Q235 HydrophobicContact CG1-CG 3.72Å; L231-Q235 VanDerWaalsContact O-CB 3.24Å; L231-Q235 WeakPolarHBondContact O-CB 3.3Å; L231-Q235 PolarHBondContact O-N 3.4Å; L232-Q235 PolarHBondContact O-N 2.89Å; V233-Q235 VanDerWaalsContact C-N 3.29Å; V233-Q235 PolarHBondContact O-N 3.01Å; Q235-S239 PolarHBondContact NE2-OG 3.24Å; Q235-S239 WeakPolarHBondContact O-CB 3.47Å; Q235-S239 PolarHBondContact O-N 3.33Å; Q235-S239 PolarHBondContact O-OG 2.69Å
236V81Confident77.7Confident30 Ų3091 Ų9118%0.18242%0.422CS..Hα-helixtrans-64.8-42.8176.7169.40000111.2V134 L232 V233 R234 S239 G240 Y255V134-V236 HydrophobicContact CG1-CG2 4.27Å; L232-V236 HydrophobicContact CD2-CG2 4.27Å; L232-V236 WeakPolarHBondContact O-CB 3.42Å; L232-V236 VanDerWaalsContact O-CG2 3.26Å; L232-V236 WeakPolarHBondContact O-CG2 3.31Å; L232-V236 PolarHBondContact O-N 3.04Å; V233-V236 PolarHBondContact O-N 2.81Å; R234-V236 PolarHBondContact O-N 3.25Å; V236-S239 PolarHBondContact O-N 2.94Å; V236-G240 PolarHBondContact O-N 2.85Å; V236-Y255 HydrophobicContact CG2-CD1 4.39Å
237I83.5Confident76.2Confident78 Ų7889.8 Ų89.840%0.441%0.412SS..Hα-helixtrans-64.8-49.2177.3-67.1169.7000110.7V233 R234 S239 G240 R241V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.32Å; V233-I237 WeakPolarHBondContact O-CG1 3.37Å; V233-I237 PolarHBondContact O-N 3.35Å; R234-I237 PolarHBondContact O-N 2.84Å; I237-S239 VanDerWaalsContact C-N 3.31Å; I237-S239 PolarHBondContact O-N 2.81Å; I237-G240 PolarHBondContact O-N 3.19Å; I237-G240 VanDerWaalsContact O-N 3.15Å; I237-R241 PolarHBondContact O-N 3.42Å
238M80.6Confident75Confident64 Ų6488.5 Ų88.532%0.31541%0.414SS..Hα-helixtrans-61.6-40.1178.9-69.9-61.5-67.900111.8R234 G240 R241 R242R234-M238 HydrophobicContact CG-CG 4.33Å; R234-M238 WeakPolarHBondContact O-CB 3.33Å; R234-M238 WeakPolarHBondContact O-CG 3.23Å; R234-M238 PolarHBondContact O-N 3.1Å; M238-G240 VanDerWaalsContact C-N 3.31Å; M238-G240 PolarHBondContact O-N 3.31Å; M238-R241 PolarHBondContact O-N 2.83Å; M238-R242 WeakPolarHBondContact O-CG 3.42Å; M238-R242 PolarHBondContact O-N 3.43Å
239S74.5Confident74.2Confident21 Ų2195.5 Ų95.515%0.14744%0.443CS..Hα-helixtrans-67.6-32.4176.8-57.50000112.5Q235 V236 I237Q235-S239 PolarHBondContact NE2-OG 3.24Å; Q235-S239 WeakPolarHBondContact O-CB 3.47Å; Q235-S239 PolarHBondContact O-N 3.33Å; Q235-S239 PolarHBondContact O-OG 2.69Å; V236-S239 PolarHBondContact O-N 2.94Å; I237-S239 VanDerWaalsContact C-N 3.31Å; I237-S239 PolarHBondContact O-N 2.81Å
240G69.3Low73.5Confident53 Ų5396.7 Ų96.755%0.54646%0.46SS..Hα-helixtrans-67.3-35.7172.200000113.3V236 I237 M238V236-G240 PolarHBondContact O-N 2.85Å; I237-G240 PolarHBondContact O-N 3.19Å; I237-G240 VanDerWaalsContact O-N 3.15Å; M238-G240 VanDerWaalsContact C-N 3.31Å; M238-G240 PolarHBondContact O-N 3.31Å
241R65.1Low72.6Confident192 Ų19293.7 Ų93.773%0.72545%0.451SS*.Hα-helixtrans-73.6-39.9177.6-69.8-179.5178.9175.7-1.2113I237 M238 L243I237-R241 PolarHBondContact O-N 3.42Å; M238-R241 PolarHBondContact O-N 2.83Å; R241-L243 PolarHBondContact O-N 2.96Å
242R60.5Low71.8Confident179 Ų17999 Ų9968%0.67547%0.467SS*.Hα-helixtrans-73.1-20-175.3-72-178.7-167.6-171.2-0.1115.3M238M238-R242 WeakPolarHBondContact O-CG 3.42Å; M238-R242 PolarHBondContact O-N 3.43Å
243L53.9Low71.4Confident75 Ų75102.8 Ų102.839%0.39349%0.487SS..THydrogen-bonded Turntrans-134.445.8-163.9-75.4160.6000113.7R241 K245 R247R241-L243 PolarHBondContact O-N 2.96Å; L243-K245 PolarHBondContact O-N 3.42Å; L243-R247 HydrophobicContact CB-CG 4.41Å; L243-R247 HydrophobicContact CD1-CG 4.3Å
244K54.5Low71Confident211 Ų211104.9 Ų104.992%0.91750%0.503SS*.THydrogen-bonded Turntrans-57.5-14.5172.5-109.4-176.4179.3-177.50114.1
245K56.5Low70.6Confident198 Ų19899.8 Ų99.886%0.86148%0.484SS*.THydrogen-bonded Turntrans-108.7-33.3-174-150.3170.8-179.4179.20116.4L243L243-K245 PolarHBondContact O-N 3.42Å
246N56Low70.5Confident137 Ų13799 Ų9973%0.73349%0.486SS*.THydrogen-bonded Turntrans-121.50.6-164.1-72.35.1000117.4
247R63.2Low70.6Confident62 Ų62101.8 Ų101.823%0.23449%0.493CS..SBendtrans-92.1130170.9-78.2-151-163.9-130.212.7111.5L243 Y255L243-R247 HydrophobicContact CB-CG 4.41Å; L243-R247 HydrophobicContact CD1-CG 4.3Å; R247-Y255 VanDerWaalsContact NH1-CE2 3.33Å; R247-Y255 PolarHBondContact NH1-OH 2.83Å
248T67.6Low70.6Confident93 Ų9399.8 Ų99.857%0.57148%0.483SS*.  trans-56.2138.3169.151.50000110.4C250 M251T248-C250 PolarHBondContact O-N 3.49Å; T248-M251 PolarHBondContact O-N 3.32Å
249K73.8Confident70.8Confident157 Ų15799.5 Ų99.568%0.68348%0.48SS*.Hα-helixtrans-42.5-32.9171.4-178177.8177179.30112.5N253K249-N253 VanDerWaalsContact O-CG 3.27Å; K249-N253 PolarHBondContact O-N 3.48Å; K249-N253 VanDerWaalsContact O-N 3.17Å; K249-N253 PolarHBondContact O-OD1 3.2Å
250C74.9Confident71.4Confident89 Ų89105 Ų10560%0.60150%0.497SS*.Hα-helixtrans-55.5-51.7174-173.20000113.8T248 R252 N253 S254T248-C250 PolarHBondContact O-N 3.49Å; C250-R252 PolarHBondContact O-N 3.44Å; C250-N253 PolarHBondContact O-N 2.99Å; C250-S254 PolarHBondContact O-N 2.99Å
251M73.3Confident72.2Confident67 Ų67102.9 Ų102.933%0.3347%0.473SS..Hα-helixtrans-63.1-42.3-178.2-73.6-61.2-71.300112T248 N253 S254 Y255T248-M251 PolarHBondContact O-N 3.32Å; M251-N253 VanDerWaalsContact C-N 3.32Å; M251-N253 PolarHBondContact O-N 3.4Å; M251-S254 WeakPolarHBondContact O-CB 3.4Å; M251-S254 PolarHBondContact O-N 2.91Å; M251-Y255 HydrophobicContact CE-CE2 3.84Å; M251-Y255 WeakPolarHBondContact O-CD2 3.32Å; M251-Y255 PolarHBondContact O-N 3.3Å
252R74.5Confident73.2Confident174 Ų17494.1 Ų94.166%0.65744%0.441SS*.Hα-helixtrans-59.1-44.6176.7-175.5176.168.3176.31.5111.5C250 S254 Y255 G256C250-R252 PolarHBondContact O-N 3.44Å; R252-S254 VanDerWaalsContact C-N 3.33Å; R252-S254 PolarHBondContact O-N 3.02Å; R252-Y255 PolarHBondContact O-N 3.49Å; R252-G256 PolarHBondContact O-N 3.45Å
253N78.8Confident74.5Confident80 Ų8087.8 Ų87.843%0.42842%0.42SS..Hα-helixtrans-64.2-38.3177.8-69.6-7.3000111.9K249 C250 M251 G256 R257K249-N253 VanDerWaalsContact O-CG 3.27Å; K249-N253 PolarHBondContact O-N 3.48Å; K249-N253 VanDerWaalsContact O-N 3.17Å; K249-N253 PolarHBondContact O-OD1 3.2Å; C250-N253 PolarHBondContact O-N 2.99Å; M251-N253 VanDerWaalsContact C-N 3.32Å; M251-N253 PolarHBondContact O-N 3.4Å; N253-G256 PolarHBondContact O-N 3.32Å; N253-R257 WeakPolarHBondContact O-CB 3.33Å; N253-R257 PolarHBondContact O-N 3Å
254S77.7Confident76.2Confident65 Ų6586.1 Ų86.146%0.45542%0.415SS..Hα-helixtrans-62.6-49.3175.9-171.10000112.2C250 M251 R252 G256 R257 L258C250-S254 PolarHBondContact O-N 2.99Å; M251-S254 WeakPolarHBondContact O-CB 3.4Å; M251-S254 PolarHBondContact O-N 2.91Å; R252-S254 VanDerWaalsContact C-N 3.33Å; R252-S254 PolarHBondContact O-N 3.02Å; S254-G256 PolarHBondContact O-N 2.92Å; S254-R257 WeakPolarHBondContact O-CB 3.47Å; S254-R257 PolarHBondContact O-N 3.44Å; S254-L258 PolarHBondContact O-N 3.01Å
255Y80.3Confident77.8Confident33 Ų3376.6 Ų76.613%0.12937%0.374CS..Hα-helixtrans-63.3-40.6176.2-73.2-67.1000112.8V134 V236 R247 M251 R252 R257 L258 K259V134-Y255 HydrophobicContact CB-CE1 4.29Å; V134-Y255 HydrophobicContact CG1-CD1 4.11Å; V134-Y255 HydrophobicContact CG1-CE1 3.79Å; V134-Y255 HydrophobicContact CG2-CD1 4.16Å; V134-Y255 HydrophobicContact CG2-CE1 3.98Å; V236-Y255 HydrophobicContact CG2-CD1 4.39Å; R247-Y255 VanDerWaalsContact NH1-CE2 3.33Å; R247-Y255 PolarHBondContact NH1-OH 2.83Å; M251-Y255 HydrophobicContact CE-CE2 3.84Å; M251-Y255 WeakPolarHBondContact O-CD2 3.32Å; M251-Y255 PolarHBondContact O-N 3.3Å; R252-Y255 PolarHBondContact O-N 3.49Å; Y255-R257 VanDerWaalsContact C-N 3.26Å; Y255-R257 PolarHBondContact O-N 2.86Å; Y255-L258 PolarHBondContact O-N 3.45Å; Y255-K259 WeakPolarHBondContact O-CB 3.33Å; Y255-K259 PolarHBondContact O-N 3.49Å
256G82.1Confident79.4Confident21 Ų2167.5 Ų67.522%0.21634%0.335CS..Hα-helixtrans-61-38176.100000112.1R252 N253 S254 R260R252-G256 PolarHBondContact O-N 3.45Å; N253-G256 PolarHBondContact O-N 3.32Å; S254-G256 PolarHBondContact O-N 2.92Å; G256-R260 WeakPolarHBondContact O-CG 3.42Å; G256-R260 PolarHBondContact O-N 3.35Å; G256-R260 VanDerWaalsContact O-N 3.13Å; G256-R260 PolarHBondContact O-NH1 3.49Å
257R83.2Confident81.2Confident88 Ų8863.9 Ų63.933%0.33232%0.32SS..Hα-helixtrans-68.8-45.1175.8-164.4-176-61.9160-8.7112N253 S254 Y255 K259 R260 M261 F320 S322N253-R257 WeakPolarHBondContact O-CB 3.33Å; N253-R257 PolarHBondContact O-N 3Å; S254-R257 WeakPolarHBondContact O-CB 3.47Å; S254-R257 PolarHBondContact O-N 3.44Å; Y255-R257 VanDerWaalsContact C-N 3.26Å; Y255-R257 PolarHBondContact O-N 2.86Å; R257-K259 VanDerWaalsContact C-N 3.35Å; R257-K259 PolarHBondContact O-N 3.37Å; R257-R260 PolarHBondContact O-N 2.97Å; R257-M261 WeakPolarHBondContact O-CB 3.01Å; R257-M261 PolarHBondContact O-N 3.37Å; R257-F320 WeakPolarHBondContact CD-O 3.16Å; R257-F320 HydrophobicContact CG-CB 4.18Å; R257-F320 HydrophobicContact CG-CD1 4.06Å; R257-F320 VanDerWaalsContact CG-O 3.23Å; R257-F320 WeakPolarHBondContact CG-O 3.4Å; R257-S322 PolarHBondContact NH1-OG 3.49Å
258L82.5Confident82.6Confident36 Ų3662.1 Ų62.119%0.18832%0.316CS..Hα-helixtrans-59.9-44.5174.9176.262.3000111.5R130 V134 S254 Y255 R260 M261 V262R130-L258 HydrophobicContact CG-CD1 4.03Å; V134-L258 HydrophobicContact CG2-CD2 3.52Å; S254-L258 PolarHBondContact O-N 3.01Å; Y255-L258 PolarHBondContact O-N 3.45Å; L258-R260 PolarHBondContact O-N 2.96Å; L258-M261 WeakPolarHBondContact O-CB 3.34Å; L258-M261 PolarHBondContact O-N 2.67Å; L258-V262 HydrophobicContact CD1-CG2 4.02Å; L258-V262 HydrophobicContact CG-CG2 4.5Å; L258-V262 WeakPolarHBondContact O-CG2 3.21Å; L258-V262 PolarHBondContact O-N 2.99Å
259K84.6Confident83.7Confident59 Ų5957.7 Ų57.726%0.25729%0.289SS..Hα-helixtrans-57.1-50176.4177.3179.8170.2178.70110.9L232 V233 Y255 R257 M261 V262 I263L232-K259 HydrophobicContact CD2-CB 4.14Å; L232-K259 HydrophobicContact CD2-CG 4.28Å; V233-K259 HydrophobicContact CG2-CD 4.31Å; V233-K259 HydrophobicContact CG2-CG 4.45Å; Y255-K259 WeakPolarHBondContact O-CB 3.33Å; Y255-K259 PolarHBondContact O-N 3.49Å; R257-K259 VanDerWaalsContact C-N 3.35Å; R257-K259 PolarHBondContact O-N 3.37Å; K259-M261 VanDerWaalsContact C-N 3.33Å; K259-M261 PolarHBondContact O-N 3.03Å; K259-V262 PolarHBondContact O-N 3.41Å; K259-I263 HydrophobicContact CD-CD1 4.49Å; K259-I263 HydrophobicContact CG-CD1 3.81Å; K259-I263 VanDerWaalsContact O-CG1 3.23Å; K259-I263 WeakPolarHBondContact O-CG1 3.23Å; K259-I263 PolarHBondContact O-N 3.14Å
260R87.4Confident84.7Confident136 Ų13652.3 Ų52.351%0.51327%0.268SS..Hα-helixtrans-60.4-42.9178.3-73.6-169.6-61.6-87.84.4112.2G256 R257 L258 I263 S264 F320G256-R260 WeakPolarHBondContact O-CG 3.42Å; G256-R260 PolarHBondContact O-N 3.35Å; G256-R260 VanDerWaalsContact O-N 3.13Å; G256-R260 PolarHBondContact O-NH1 3.49Å; R257-R260 PolarHBondContact O-N 2.97Å; L258-R260 PolarHBondContact O-N 2.96Å; R260-I263 PolarHBondContact O-N 2.95Å; R260-S264 PolarHBondContact O-N 3.04Å; R260-S264 PolarHBondContact O-OG 3.48Å; R260-S264 VanDerWaalsContact O-OG 3.08Å; R260-F320 HydrophobicContact CB-CD1 4.13Å; R260-F320 HydrophobicContact CB-CE1 3.57Å; R260-F320 HydrophobicContact CB-CZ 4.12Å
261M86.3Confident85.7Confident8 Ų854.3 Ų54.34%0.03927%0.272CS..Hα-helixtrans-57.7-50.9176.9-171.3-178.5148.500112.7R257 L258 K259 I263 S264 I265 Y317 F320R257-M261 WeakPolarHBondContact O-CB 3.01Å; R257-M261 PolarHBondContact O-N 3.37Å; L258-M261 WeakPolarHBondContact O-CB 3.34Å; L258-M261 PolarHBondContact O-N 2.67Å; K259-M261 VanDerWaalsContact C-N 3.33Å; K259-M261 PolarHBondContact O-N 3.03Å; M261-I263 VanDerWaalsContact C-N 3.34Å; M261-I263 PolarHBondContact O-N 3.1Å; M261-S264 PolarHBondContact O-N 3.35Å; M261-I265 HydrophobicContact CE-CD1 3.79Å; M261-I265 HydrophobicContact CG-CD1 4.09Å; M261-I265 WeakPolarHBondContact O-CG1 3.26Å; M261-I265 PolarHBondContact O-N 3.17Å; M261-Y317 HydrophobicContact CE-CD1 3.04Å; M261-Y317 HydrophobicContact CE-CE1 3.16Å; M261-Y317 HydrophobicContact CE-CG 4.02Å; M261-F320 HydrophobicContact CB-CB 3.45Å; M261-F320 VanDerWaalsContact CB-CB 3.45Å; M261-F320 HydrophobicContact CB-CD1 4.28Å; M261-F320 HydrophobicContact CB-CD2 3.71Å; M261-F320 HydrophobicContact CB-CG 3.56Å; M261-F320 HydrophobicContact CG-CB 3.54Å; M261-F320 HydrophobicContact CG-CD2 3.78Å; M261-F320 HydrophobicContact CG-CG 3.91Å; M261-F320 HydrophobicContact SD-CB 3.75Å
262V85.8Confident86.7Confident8 Ų851.5 Ų51.55%0.04826%0.258CS..Hα-helixtrans-65.3-40.2-178.2174.80000110.6R130 Y229 L232 L258 K259 S264 I265 V266R130-V262 HydrophobicContact CB-CG2 4.38Å; R130-V262 HydrophobicContact CG-CG2 4.12Å; Y229-V262 HydrophobicContact CD2-CG1 4.33Å; L232-V262 HydrophobicContact CD1-CB 4.42Å; L232-V262 HydrophobicContact CD1-CG1 4.38Å; L232-V262 HydrophobicContact CD1-CG2 4.04Å; L258-V262 HydrophobicContact CD1-CG2 4.02Å; L258-V262 HydrophobicContact CG-CG2 4.5Å; L258-V262 WeakPolarHBondContact O-CG2 3.21Å; L258-V262 PolarHBondContact O-N 2.99Å; K259-V262 PolarHBondContact O-N 3.41Å; V262-S264 PolarHBondContact O-N 3.31Å; V262-I265 PolarHBondContact O-N 2.87Å; V262-V266 HydrophobicContact CG1-CG2 4.29Å; V262-V266 WeakPolarHBondContact O-CG2 3.19Å; V262-V266 PolarHBondContact O-N 2.86Å
263I87.9Confident87.8Confident47 Ų4743.3 Ų43.324%0.24123%0.228CC..Hα-helixtrans-56.5-51.3173.5-69.4166.8000110.4Y229 K259 R260 M261 I265 V266 C267Y229-I263 HydrophobicContact CD2-CG1 4Å; Y229-I263 HydrophobicContact CE2-CB 4.4Å; Y229-I263 HydrophobicContact CE2-CD1 3.73Å; Y229-I263 HydrophobicContact CE2-CG1 3.09Å; Y229-I263 VanDerWaalsContact CZ-CG1 3.42Å; Y229-I263 WeakPolarHBondContact OH-CD1 3.5Å; Y229-I263 VanDerWaalsContact OH-CG1 3.32Å; Y229-I263 WeakPolarHBondContact OH-CG1 3.41Å; K259-I263 HydrophobicContact CD-CD1 4.49Å; K259-I263 HydrophobicContact CG-CD1 3.81Å; K259-I263 VanDerWaalsContact O-CG1 3.23Å; K259-I263 WeakPolarHBondContact O-CG1 3.23Å; K259-I263 PolarHBondContact O-N 3.14Å; R260-I263 PolarHBondContact O-N 2.95Å; M261-I263 VanDerWaalsContact C-N 3.34Å; M261-I263 PolarHBondContact O-N 3.1Å; I263-I265 VanDerWaalsContact C-N 3.3Å; I263-I265 PolarHBondContact O-N 3.01Å; I263-V266 PolarHBondContact O-N 3.06Å; I263-C267 VanDerWaalsContact O-CB 3.32Å; I263-C267 WeakPolarHBondContact O-CB 3.11Å; I263-C267 PolarHBondContact O-N 3.26Å; I263-C267 PolarHBondContact O-SG 3.4Å
264S89.6Confident88.7Confident40 Ų4041.8 Ų41.828%0.2822%0.221SC..Hα-helixtrans-60.8-39.8-178.1-61.80000112.1R260 M261 V262 C268R260-S264 PolarHBondContact O-N 3.04Å; R260-S264 PolarHBondContact O-OG 3.48Å; R260-S264 VanDerWaalsContact O-OG 3.08Å; M261-S264 PolarHBondContact O-N 3.35Å; V262-S264 PolarHBondContact O-N 3.31Å; S264-C268 WeakPolarHBondContact O-CB 3.33Å; S264-C268 PolarHBondContact O-N 3.01Å
265I89.1Confident89.6Confident10 Ų1040.9 Ų40.95%0.05121%0.214CC..Hα-helixtrans-65.4-49.8177.5-67.4168.3000110.7I123 M261 V262 I263 C268 Y269 L316 Y317I123-I265 HydrophobicContact CG2-CG2 3.64Å; M261-I265 HydrophobicContact CE-CD1 3.79Å; M261-I265 HydrophobicContact CG-CD1 4.09Å; M261-I265 WeakPolarHBondContact O-CG1 3.26Å; M261-I265 PolarHBondContact O-N 3.17Å; V262-I265 PolarHBondContact O-N 2.87Å; I263-I265 VanDerWaalsContact C-N 3.3Å; I263-I265 PolarHBondContact O-N 3.01Å; I265-C268 PolarHBondContact O-N 2.89Å; I265-Y269 WeakPolarHBondContact O-CB 2.78Å; I265-Y269 PolarHBondContact O-N 3.49Å; I265-L316 HydrophobicContact CB-CD1 4.3Å; I265-L316 HydrophobicContact CG1-CB 3.98Å; I265-L316 HydrophobicContact CG1-CD1 3.59Å; I265-L316 HydrophobicContact CG1-CG 4.41Å; I265-Y317 HydrophobicContact CD1-CE1 4.14Å
266V89.7Confident90.3Very high8 Ų840.2 Ų40.25%0.04821%0.211CC..Hα-helixtrans-64.2-44.2-179174.80000111.2M225 V262 I263 Y269 L270M225-V266 HydrophobicContact CB-CG1 4.49Å; M225-V266 HydrophobicContact CB-CG2 4.24Å; V262-V266 HydrophobicContact CG1-CG2 4.29Å; V262-V266 WeakPolarHBondContact O-CG2 3.19Å; V262-V266 PolarHBondContact O-N 2.86Å; I263-V266 PolarHBondContact O-N 3.06Å; V266-Y269 PolarHBondContact O-N 3.48Å; V266-L270 HydrophobicContact CG1-CD1 3.99Å; V266-L270 HydrophobicContact CG1-CG 4.4Å; V266-L270 WeakPolarHBondContact O-CG 2.95Å; V266-L270 PolarHBondContact O-N 3.41Å
267C92.2Very high91Very high61 Ų6139.4 Ų39.441%0.41220%0.202SC..Hα-helixtrans-64-45.5177-69.90000111.8I263 Y269 L270 L271I263-C267 VanDerWaalsContact O-CB 3.32Å; I263-C267 WeakPolarHBondContact O-CB 3.11Å; I263-C267 PolarHBondContact O-N 3.26Å; I263-C267 PolarHBondContact O-SG 3.4Å; C267-Y269 VanDerWaalsContact C-N 3.32Å; C267-Y269 PolarHBondContact O-N 3.15Å; C267-L270 PolarHBondContact O-N 3.49Å; C267-L271 VanDerWaalsContact O-CB 3.31Å; C267-L271 WeakPolarHBondContact O-CB 3.36Å; C267-L271 WeakPolarHBondContact O-CG 3.42Å; C267-L271 PolarHBondContact O-N 2.99Å
268C92.8Very high91.6Very high24 Ų2439.6 Ų39.616%0.16221%0.208CC..Hα-helixtrans-60.4-44.3177.9-171.80000111.2S264 I265 C272 T312 L316S264-C268 WeakPolarHBondContact O-CB 3.33Å; S264-C268 PolarHBondContact O-N 3.01Å; I265-C268 PolarHBondContact O-N 2.89Å; C268-C272 WeakPolarHBondContact O-CB 3.02Å; C268-C272 PolarHBondContact O-N 3.35Å; C268-C272 PolarHBondContact O-SG 3.16Å; C268-T312 PolarHBondContact SG-OG1 3.33Å; C268-L316 HydrophobicContact CB-CD1 4.41Å
269Y92.1Very high92.2Very high1 Ų138.3 Ų38.30%0.00420%0.201CC..Hα-helixtrans-57-55.3174.2165.1-96.9000111.4V120 F218 S222 M225 I265 V266 C267 L271 C272 W273V120-Y269 HydrophobicContact CB-CE2 4.16Å; V120-Y269 HydrophobicContact CG1-CD2 4.49Å; V120-Y269 HydrophobicContact CG1-CE2 3.49Å; V120-Y269 VanDerWaalsContact CG1-CE2 3.49Å; V120-Y269 WeakPolarHBondContact CG1-OH 3.31Å; V120-Y269 HydrophobicContact CG2-CD2 4.45Å; V120-Y269 HydrophobicContact CG2-CE2 3.73Å; F218-Y269 HydrophobicContact CD2-CE1 4.37Å; F218-Y269 AromaticContact CD2-CZ 3.87Å; F218-Y269 VanDerWaalsContact CD2-OH 3.23Å; F218-Y269 WeakPolarHBondContact CD2-OH 2.88Å; F218-Y269 HydrophobicContact CE2-CE1 4.31Å; F218-Y269 PolarHBondContact O-OH 2.67Å; S222-Y269 WeakPolarHBondContact OG-CE1 3.48Å; S222-Y269 PolarHBondContact OG-OH 2.88Å; M225-Y269 HydrophobicContact CE-CD1 3.36Å; M225-Y269 HydrophobicContact CE-CD2 4.16Å; M225-Y269 HydrophobicContact CE-CE1 3.08Å; M225-Y269 HydrophobicContact CE-CE2 3.93Å; M225-Y269 HydrophobicContact CE-CG 3.91Å; M225-Y269 HydrophobicContact SD-CD1 3.99Å; M225-Y269 HydrophobicContact SD-CE1 4.29Å; M225-Y269 HydrophobicContact SD-CG 4.26Å; I265-Y269 WeakPolarHBondContact O-CB 2.78Å; I265-Y269 PolarHBondContact O-N 3.49Å; V266-Y269 PolarHBondContact O-N 3.48Å; C267-Y269 VanDerWaalsContact C-N 3.32Å; C267-Y269 PolarHBondContact O-N 3.15Å; Y269-L271 VanDerWaalsContact C-N 3.34Å; Y269-L271 PolarHBondContact O-N 3.38Å; Y269-C272 PolarHBondContact O-N 3.1Å; Y269-W273 HydrophobicContact CD2-CB 4.45Å; Y269-W273 AromaticContact CD2-CD1 3.17Å; Y269-W273 AromaticContact CD2-CG 3.89Å; Y269-W273 HydrophobicContact CD2-CG 3.89Å; Y269-W273 AromaticContact CD2-NE1 3.6Å; Y269-W273 HydrophobicContact CE2-CB 4.07Å; Y269-W273 AromaticContact CE2-CD1 3.31Å; Y269-W273 HydrophobicContact CE2-CD2 4.16Å; Y269-W273 AromaticContact CE2-CG 3.58Å; Y269-W273 HydrophobicContact CE2-CG 3.58Å; Y269-W273 AromaticContact CE2-NE1 3.68Å; Y269-W273 WeakPolarHBondContact O-CB 3.23Å; Y269-W273 VanDerWaalsContact O-CD1 3.3Å; Y269-W273 PolarHBondContact O-N 2.95Å
270L94.5Very high92.6Very high44 Ų4436.7 Ų36.723%0.2320%0.196CC..Hα-helixtrans-61.9-41.3-177-69.2175.2000111.9I226 V266 C267 C272 T274I226-L270 HydrophobicContact CD1-CD1 4.21Å; I226-L270 HydrophobicContact CG1-CD1 4.27Å; V266-L270 HydrophobicContact CG1-CD1 3.99Å; V266-L270 HydrophobicContact CG1-CG 4.4Å; V266-L270 WeakPolarHBondContact O-CG 2.95Å; V266-L270 PolarHBondContact O-N 3.41Å; C267-L270 PolarHBondContact O-N 3.49Å; L270-C272 VanDerWaalsContact C-N 3.32Å; L270-C272 PolarHBondContact O-N 3.34Å; L270-T274 WeakPolarHBondContact O-CB 3.41Å; L270-T274 PolarHBondContact O-N 2.85Å; L270-T274 PolarHBondContact O-OG1 2.9Å
271L95.5Very high93Very high131 Ų13132 Ų3269%0.68618%0.181SC*.Hα-helixtrans-65.9-34.4178.6-71.8171.4000112.6C267 Y269 P275C267-L271 VanDerWaalsContact O-CB 3.31Å; C267-L271 WeakPolarHBondContact O-CB 3.36Å; C267-L271 WeakPolarHBondContact O-CG 3.42Å; C267-L271 PolarHBondContact O-N 2.99Å; Y269-L271 VanDerWaalsContact C-N 3.34Å; Y269-L271 PolarHBondContact O-N 3.38Å; L271-P275 WeakPolarHBondContact O-CD 3.43Å; L271-P275 WeakPolarHBondContact O-CG 3.24Å
272C95.5Very high93.3Very high7 Ų735.6 Ų35.65%0.04720%0.199CC..Hα-helixtrans-80.4-40.9179.2-67.80000112.5C268 Y269 L270 L305C268-C272 WeakPolarHBondContact O-CB 3.02Å; C268-C272 PolarHBondContact O-N 3.35Å; C268-C272 PolarHBondContact O-SG 3.16Å; Y269-C272 PolarHBondContact O-N 3.1Å; L270-C272 VanDerWaalsContact C-N 3.32Å; L270-C272 PolarHBondContact O-N 3.34Å; C272-L305 HydrophobicContact CB-CB 4.12Å; C272-L305 WeakPolarHBondContact CB-O 3.37Å; C272-L305 WeakPolarHBondContact O-CB 3.17Å
273W96.6Very high93.5Very high3 Ų338.1 Ų38.11%0.01121%0.214CC..Hα-helixtrans-89.3-31.1-170.4-78.993.1000114.3K116 Y117 V120 F218 Y269 Y276 W277 P306K116-W273 HydrophobicContact CD-CH2 3.81Å; K116-W273 HydrophobicContact CD-CZ2 4.41Å; K116-W273 HydrophobicContact CD-CZ3 4.38Å; K116-W273 HydrophobicContact CG-CH2 3.49Å; K116-W273 VanDerWaalsContact CG-CH2 3.49Å; K116-W273 HydrophobicContact CG-CZ2 3.75Å; Y117-W273 AromaticContact CD1-CH2 3.63Å; Y117-W273 HydrophobicContact CD1-CH2 3.63Å; Y117-W273 AromaticContact CD1-CZ3 3.97Å; Y117-W273 HydrophobicContact CD1-CZ3 3.97Å; Y117-W273 AromaticContact CE1-CH2 3.64Å; Y117-W273 HydrophobicContact CE1-CH2 3.64Å; Y117-W273 AromaticContact CE1-CZ3 3.53Å; Y117-W273 HydrophobicContact CE1-CZ3 3.53Å; V120-W273 HydrophobicContact CG2-CD2 4.27Å; V120-W273 VanDerWaalsContact CG2-CE2 3.48Å; V120-W273 HydrophobicContact CG2-CH2 3.78Å; V120-W273 HydrophobicContact CG2-CZ2 3.19Å; F218-W273 HydrophobicContact CD2-CB 3.72Å; F218-W273 HydrophobicContact CE2-CB 3.65Å; Y269-W273 HydrophobicContact CD2-CB 4.45Å; Y269-W273 AromaticContact CD2-CD1 3.17Å; Y269-W273 AromaticContact CD2-CG 3.89Å; Y269-W273 HydrophobicContact CD2-CG 3.89Å; Y269-W273 AromaticContact CD2-NE1 3.6Å; Y269-W273 HydrophobicContact CE2-CB 4.07Å; Y269-W273 AromaticContact CE2-CD1 3.31Å; Y269-W273 HydrophobicContact CE2-CD2 4.16Å; Y269-W273 AromaticContact CE2-CG 3.58Å; Y269-W273 HydrophobicContact CE2-CG 3.58Å; Y269-W273 AromaticContact CE2-NE1 3.68Å; Y269-W273 WeakPolarHBondContact O-CB 3.23Å; Y269-W273 VanDerWaalsContact O-CD1 3.3Å; Y269-W273 PolarHBondContact O-N 2.95Å; W273-Y276 AromaticContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CE1 4.37Å; W273-Y276 HydrophobicContact CZ3-CD1 4.09Å; W273-Y276 HydrophobicContact CZ3-CE1 4.08Å; W273-Y276 WeakPolarHBondContact O-CB 3.4Å; W273-Y276 PolarHBondContact O-N 3.42Å; W273-W277 AromaticContact CE3-CD1 3.98Å; W273-W277 AromaticContact CE3-NE1 3.46Å; W273-W277 AromaticContact CZ3-NE1 3.79Å; W273-W277 VanDerWaalsContact O-CD1 3.24Å; W273-W277 PolarHBondContact O-N 2.85Å; W273-P306 HydrophobicContact CZ2-CB 4.26Å
274T96.6Very high93.6Very high47 Ų4736.5 Ų36.529%0.28821%0.206SC..Hα-helixtrans-62.7-48-178.1-54.20000112.1F218 L270 Y276 W277 I278F218-T274 HydrophobicContact CZ-CG2 4.46Å; F218-T274 WeakPolarHBondContact CZ-OG1 3.33Å; L270-T274 WeakPolarHBondContact O-CB 3.41Å; L270-T274 PolarHBondContact O-N 2.85Å; L270-T274 PolarHBondContact O-OG1 2.9Å; T274-Y276 VanDerWaalsContact C-N 3.3Å; T274-Y276 PolarHBondContact O-N 2.94Å; T274-W277 PolarHBondContact O-N 2.83Å; T274-I278 HydrophobicContact CG2-CD1 3.63Å; T274-I278 HydrophobicContact CG2-CG1 4.19Å; T274-I278 WeakPolarHBondContact O-CG1 3.38Å; T274-I278 PolarHBondContact O-N 3.4Å
275P96.8Very high93.7Very high47 Ų4739.8 Ų39.831%0.30522%0.216SC..Hα-helixtrans-63.8-36.5177.9-20.233.4000112.5L271 W277 M279 I302 L305L271-P275 WeakPolarHBondContact O-CD 3.43Å; L271-P275 WeakPolarHBondContact O-CG 3.24Å; P275-W277 PolarHBondContact O-N 3.29Å; P275-M279 VanDerWaalsContact O-CB 3.29Å; P275-M279 WeakPolarHBondContact O-CB 3.37Å; P275-M279 PolarHBondContact O-N 2.88Å; P275-I302 HydrophobicContact CB-CG2 4.48Å; P275-L305 HydrophobicContact CB-CD1 3.76Å; P275-L305 HydrophobicContact CG-CD1 3.83Å
276Y96.3Very high93.6Very high18 Ų1842.8 Ų42.87%0.07123%0.232CC..Hα-helixtrans-56.2-49.6173.6168.8-88.3000111.4K116 Y117 W273 T274 N280 H303 P306K116-Y276 PolarHBondContact NZ-OH 2.71Å; Y117-Y276 PolarHBondContact OH-OH 3.38Å; W273-Y276 AromaticContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CE1 4.37Å; W273-Y276 HydrophobicContact CZ3-CD1 4.09Å; W273-Y276 HydrophobicContact CZ3-CE1 4.08Å; W273-Y276 WeakPolarHBondContact O-CB 3.4Å; W273-Y276 PolarHBondContact O-N 3.42Å; T274-Y276 VanDerWaalsContact C-N 3.3Å; T274-Y276 PolarHBondContact O-N 2.94Å; Y276-N280 WeakPolarHBondContact CE2-ND2 3.22Å; Y276-N280 PolarHBondContact O-N 3.03Å; Y276-N280 VanDerWaalsContact O-N 3.09Å; Y276-N280 PolarHBondContact O-ND2 3.41Å; Y276-H303 AromaticContact CE2-CD2 3.73Å; Y276-H303 AromaticContact CE2-NE2 3.59Å; Y276-P306 HydrophobicContact CD2-CG 3.87Å; Y276-P306 HydrophobicContact CE2-CG 4.4Å; Y276-P306 HydrophobicContact CG-CG 4.09Å
277W97Very high92.9Very high5 Ų547.3 Ų47.32%0.01927%0.27CS..Hα-helixtrans-72.3-42.1-178.9-79.2111.1000113.6Y117 T210 F214 F218 W273 T274 P275 M279 N280 L281Y117-W277 HydrophobicContact CE1-CH2 4.36Å; Y117-W277 AromaticContact CE1-CZ2 3.65Å; Y117-W277 HydrophobicContact CE1-CZ2 3.65Å; Y117-W277 AromaticContact CZ-CZ2 4Å; T210-W277 HydrophobicContact CG2-CZ3 4.4Å; F214-W277 VanDerWaalsContact CA-CZ3 3.49Å; F214-W277 HydrophobicContact CB-CD2 4.2Å; F214-W277 HydrophobicContact CB-CE3 3.59Å; F214-W277 HydrophobicContact CB-CH2 4.24Å; F214-W277 HydrophobicContact CB-CZ3 3.64Å; F214-W277 HydrophobicContact CD2-CB 3.74Å; F214-W277 AromaticContact CD2-CD2 3.77Å; F214-W277 HydrophobicContact CD2-CD2 3.77Å; F214-W277 AromaticContact CD2-CE3 3.81Å; F214-W277 HydrophobicContact CD2-CE3 3.81Å; F214-W277 AromaticContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CE2-CB 3.96Å; F214-W277 HydrophobicContact CE2-CG 4.33Å; F214-W277 HydrophobicContact CG-CD2 4.49Å; F214-W277 HydrophobicContact CG-CE3 4.19Å; F218-W277 HydrophobicContact CB-CD2 4.3Å; F218-W277 HydrophobicContact CB-CG 4.14Å; F218-W277 HydrophobicContact CB-CZ2 4.26Å; F218-W277 HydrophobicContact CD1-CB 4.28Å; F218-W277 AromaticContact CD1-CD1 3.62Å; F218-W277 AromaticContact CD1-CG 3.95Å; F218-W277 HydrophobicContact CD1-CG 3.95Å; F218-W277 AromaticContact CD2-CD1 3.39Å; F218-W277 HydrophobicContact CD2-CG 4.43Å; F218-W277 AromaticContact CD2-NE1 3.8Å; F218-W277 HydrophobicContact CE1-CB 4.4Å; F218-W277 HydrophobicContact CE1-CG 4.49Å; F218-W277 AromaticContact CG-CD1 3.16Å; F218-W277 AromaticContact CG-CG 3.92Å; F218-W277 HydrophobicContact CG-CG 3.92Å; F218-W277 AromaticContact CG-NE1 3.45Å; W273-W277 AromaticContact CE3-CD1 3.98Å; W273-W277 AromaticContact CE3-NE1 3.46Å; W273-W277 AromaticContact CZ3-NE1 3.79Å; W273-W277 VanDerWaalsContact O-CD1 3.24Å; W273-W277 PolarHBondContact O-N 2.85Å; T274-W277 PolarHBondContact O-N 2.83Å; P275-W277 PolarHBondContact O-N 3.29Å; W277-M279 VanDerWaalsContact C-N 3.28Å; W277-M279 PolarHBondContact O-N 3.27Å; W277-N280 PolarHBondContact O-N 2.83Å; W277-L281 WeakPolarHBondContact O-CB 3.48Å; W277-L281 VanDerWaalsContact O-CG 3.23Å; W277-L281 WeakPolarHBondContact O-CG 3.4Å; W277-L281 PolarHBondContact O-N 3.35Å
278I95.6Very high92.3Very high91 Ų9151.2 Ų51.247%0.46729%0.287SS..Hα-helixtrans-56.3-47.6175.7-70172.9000110T274 L281 I282T274-I278 HydrophobicContact CG2-CD1 3.63Å; T274-I278 HydrophobicContact CG2-CG1 4.19Å; T274-I278 WeakPolarHBondContact O-CG1 3.38Å; T274-I278 PolarHBondContact O-N 3.4Å; I278-L281 PolarHBondContact O-N 3.27Å; I278-I282 HydrophobicContact CG2-CD1 3.7Å; I278-I282 HydrophobicContact CG2-CG1 4.45Å; I278-I282 VanDerWaalsContact O-CG1 3.29Å; I278-I282 WeakPolarHBondContact O-CG1 3.43Å; I278-I282 PolarHBondContact O-N 3Å
279M93.6Very high91.7Very high10 Ų1051.9 Ų51.95%0.04929%0.29CS..Hα-helixtrans-64.7-45.3-179.2-171.264.4-174.700112.3P275 W277 L281 I282 V283 L295 F299 I302P275-M279 VanDerWaalsContact O-CB 3.29Å; P275-M279 WeakPolarHBondContact O-CB 3.37Å; P275-M279 PolarHBondContact O-N 2.88Å; W277-M279 VanDerWaalsContact C-N 3.28Å; W277-M279 PolarHBondContact O-N 3.27Å; M279-L281 VanDerWaalsContact C-N 3.34Å; M279-L281 PolarHBondContact O-N 3.36Å; M279-I282 PolarHBondContact O-N 2.99Å; M279-V283 HydrophobicContact CE-CG2 3.78Å; M279-V283 HydrophobicContact CG-CG2 4.47Å; M279-V283 VanDerWaalsContact O-CG2 3.32Å; M279-V283 WeakPolarHBondContact O-CG2 3.5Å; M279-V283 PolarHBondContact O-N 3.42Å; M279-V283 HydrophobicContact SD-CG2 4.43Å; M279-L295 HydrophobicContact CE-CD1 3.58Å; M279-L295 HydrophobicContact CE-CD2 4.48Å; M279-L295 HydrophobicContact CE-CG 3.83Å; M279-F299 HydrophobicContact CE-CB 4.05Å; M279-F299 HydrophobicContact CE-CD2 3.94Å; M279-F299 HydrophobicContact CG-CD2 3.89Å; M279-I302 HydrophobicContact CB-CD1 3.82Å; M279-I302 HydrophobicContact CB-CG2 4.07Å; M279-I302 HydrophobicContact CG-CD1 3.87Å; M279-I302 HydrophobicContact SD-CD1 4.19Å
280N94.4Very high91.2Very high25 Ų2559.5 Ų59.513%0.13433%0.326CS..Hα-helixtrans-62.8-40.1177.5-82.3-82.3000111.8T210 Y276 W277 V283 V284T210-N280 HydrophobicContact CG2-CB 4.48Å; Y276-N280 WeakPolarHBondContact CE2-ND2 3.22Å; Y276-N280 PolarHBondContact O-N 3.03Å; Y276-N280 VanDerWaalsContact O-N 3.09Å; Y276-N280 PolarHBondContact O-ND2 3.41Å; W277-N280 PolarHBondContact O-N 2.83Å; N280-V283 PolarHBondContact O-N 3.33Å; N280-V284 WeakPolarHBondContact O-CB 3.26Å; N280-V284 VanDerWaalsContact O-CG2 3.25Å; N280-V284 WeakPolarHBondContact O-CG2 3.5Å; N280-V284 PolarHBondContact O-N 2.9Å
281L95.6Very high90.6Very high38 Ų3861.8 Ų61.820%0.19934%0.341CS..Hα-helixtrans-64.5-43.3175.5-70.7168.7000111.9T210 F214 W277 I278 M279 F285T210-L281 HydrophobicContact CG2-CD2 4.17Å; F214-L281 HydrophobicContact CB-CD2 4.47Å; F214-L281 HydrophobicContact CD1-CD1 4.28Å; F214-L281 HydrophobicContact CD2-CD1 3.85Å; F214-L281 HydrophobicContact CE1-CD1 4.27Å; F214-L281 HydrophobicContact CE2-CD1 3.81Å; F214-L281 HydrophobicContact CG-CD1 4.07Å; F214-L281 HydrophobicContact CG-CD2 4.42Å; F214-L281 HydrophobicContact CZ-CD1 4.03Å; W277-L281 WeakPolarHBondContact O-CB 3.48Å; W277-L281 VanDerWaalsContact O-CG 3.23Å; W277-L281 WeakPolarHBondContact O-CG 3.4Å; W277-L281 PolarHBondContact O-N 3.35Å; I278-L281 PolarHBondContact O-N 3.27Å; M279-L281 VanDerWaalsContact C-N 3.34Å; M279-L281 PolarHBondContact O-N 3.36Å; L281-F285 HydrophobicContact CD2-CD2 4.21Å; L281-F285 HydrophobicContact CD2-CE2 3.88Å; L281-F285 WeakPolarHBondContact O-CB 3.46Å; L281-F285 WeakPolarHBondContact O-CD2 3.46Å; L281-F285 PolarHBondContact O-N 3.35Å
282I92.8Very high90.2Very high83 Ų8358.8 Ų58.843%0.42633%0.329SS..Hα-helixtrans-62.1-48.4177.4-70.2168000110.7I278 M279 V284 N286 V289I278-I282 HydrophobicContact CG2-CD1 3.7Å; I278-I282 HydrophobicContact CG2-CG1 4.45Å; I278-I282 VanDerWaalsContact O-CG1 3.29Å; I278-I282 WeakPolarHBondContact O-CG1 3.43Å; I278-I282 PolarHBondContact O-N 3Å; M279-I282 PolarHBondContact O-N 2.99Å; I282-V284 PolarHBondContact O-N 3.47Å; I282-N286 WeakPolarHBondContact O-CB 3.44Å; I282-N286 PolarHBondContact O-N 3.08Å; I282-V289 HydrophobicContact CG2-CG2 4.34Å
283V89.4Confident89.7Confident60 Ų6061.4 Ų61.436%0.36435%0.345SS..Hα-helixtrans-64.3-42.5-176.71710000111.5M279 N280 F299M279-V283 HydrophobicContact CE-CG2 3.78Å; M279-V283 HydrophobicContact CG-CG2 4.47Å; M279-V283 VanDerWaalsContact O-CG2 3.32Å; M279-V283 WeakPolarHBondContact O-CG2 3.5Å; M279-V283 PolarHBondContact O-N 3.42Å; M279-V283 HydrophobicContact SD-CG2 4.43Å; N280-V283 PolarHBondContact O-N 3.33Å; V283-F299 HydrophobicContact CG2-CD2 4.28Å; V283-F299 HydrophobicContact CG2-CE2 4.35Å
284V90.7Very high89.3Confident13 Ų1365.5 Ų65.58%0.07937%0.373CS..Hα-helixtrans-71.7-43.4-177.4169.20000111.8E206 H207 T210 N280 I282E206-V284 HydrophobicContact CG-CG1 4.36Å; E206-V284 HydrophobicContact CG-CG2 3.99Å; H207-V284 HydrophobicContact CB-CG1 4.24Å; H207-V284 PolarHBondContact NE2-O 2.85Å; T210-V284 HydrophobicContact CG2-CB 4.42Å; T210-V284 HydrophobicContact CG2-CG2 4.15Å; N280-V284 WeakPolarHBondContact O-CB 3.26Å; N280-V284 VanDerWaalsContact O-CG2 3.25Å; N280-V284 WeakPolarHBondContact O-CG2 3.5Å; N280-V284 PolarHBondContact O-N 2.9Å; I282-V284 PolarHBondContact O-N 3.47Å
285F90.7Very high88.9Confident109 Ų10965 Ų6548%0.47837%0.369SS..Hα-helixtrans-92.8-4.5-173-70.6-79.2000114.9H207 L211 L281H207-F285 HydrophobicContact CB-CE1 4.15Å; H207-F285 HydrophobicContact CB-CZ 4.24Å; H207-F285 AromaticContact CD2-CD1 3.74Å; H207-F285 AromaticContact CD2-CE1 3.7Å; L211-F285 HydrophobicContact CB-CZ 4.37Å; L281-F285 HydrophobicContact CD2-CD2 4.21Å; L281-F285 HydrophobicContact CD2-CE2 3.88Å; L281-F285 WeakPolarHBondContact O-CB 3.46Å; L281-F285 WeakPolarHBondContact O-CD2 3.46Å; L281-F285 PolarHBondContact O-N 3.35Å
286N87.6Confident88.5Confident73 Ų7370.1 Ų70.139%0.3938%0.382SS..  trans-116.789.1177.9-171.8-7.8000111.3I282 N288 V289I282-N286 WeakPolarHBondContact O-CB 3.44Å; I282-N286 PolarHBondContact O-N 3.08Å; N286-N288 PolarHBondContact O-N 3.12Å; N286-N288 VanDerWaalsContact O-N 3.1Å; N286-N288 PolarHBondContact OD1-N 2.93Å; N286-N288 VanDerWaalsContact OD1-N 3.15Å; N286-V289 HydrophobicContact CB-CG2 3.53Å; N286-V289 VanDerWaalsContact ND2-CG2 3.33Å; N286-V289 WeakPolarHBondContact ND2-CG2 3.21Å; N286-V289 WeakPolarHBondContact O-CG2 3.27Å; N286-V289 PolarHBondContact O-N 3.13Å
287A75.4Confident88.2Confident103 Ų10372 Ų7285%0.85139%0.393SS*.THydrogen-bonded Turntrans-60.8-18.417800000114.1
288N78.6Confident87.9Confident143 Ų14376.6 Ų76.677%0.76542%0.416SS*.THydrogen-bonded Turntrans-96.54.3-177.1-62.8-34.4000113.2N286 Q290N286-N288 PolarHBondContact O-N 3.12Å; N286-N288 VanDerWaalsContact O-N 3.1Å; N286-N288 PolarHBondContact OD1-N 2.93Å; N286-N288 VanDerWaalsContact OD1-N 3.15Å; N288-Q290 PolarHBondContact O-N 3.26Å
289V81.1Confident87.7Confident38 Ų3875.4 Ų75.423%0.2341%0.407CS..  trans-64.4112.4177.2176.30000109.3I282 N286 V291 L295I282-V289 HydrophobicContact CG2-CG2 4.34Å; N286-V289 HydrophobicContact CB-CG2 3.53Å; N286-V289 VanDerWaalsContact ND2-CG2 3.33Å; N286-V289 WeakPolarHBondContact ND2-CG2 3.21Å; N286-V289 WeakPolarHBondContact O-CG2 3.27Å; N286-V289 PolarHBondContact O-N 3.13Å; V289-V291 PolarHBondContact O-N 3.42Å; V289-V291 VanDerWaalsContact O-N 3.17Å; V289-L295 HydrophobicContact CG1-CD2 3.25Å
290Q81.3Confident87.7Confident162 Ų16276.9 Ų76.976%0.75742%0.416SS*.  trans-66.2116.8169.6-68.1-171.3-15.200109.3N288 T292N288-Q290 PolarHBondContact O-N 3.26Å; Q290-T292 PolarHBondContact O-N 2.8Å
291V80.8Confident87.6Confident91 Ų9179.1 Ų79.155%0.55243%0.43SS*.  trans-77.177-179.9-171.10000109.8V289 R296V289-V291 PolarHBondContact O-N 3.42Å; V289-V291 VanDerWaalsContact O-N 3.17Å; V291-R296 HydrophobicContact CG1-CG 3.56Å
292T87.7Confident87.6Confident69 Ų6978.3 Ų78.342%0.42343%0.426SS..  trans-69.2158.9174.266.70000111.4Q290 S294 L295 R296Q290-T292 PolarHBondContact O-N 2.8Å; T292-S294 VanDerWaalsContact C-N 3.28Å; T292-S294 PolarHBondContact O-N 3.06Å; T292-L295 PolarHBondContact O-N 2.84Å; T292-L295 VanDerWaalsContact O-N 3.16Å; T292-L295 WeakPolarHBondContact OG1-CB 3.24Å; T292-L295 PolarHBondContact OG1-N 3.43Å; T292-R296 WeakPolarHBondContact O-CG 3.2Å; T292-R296 PolarHBondContact O-N 3.21Å
293T85.2Confident87.7Confident62 Ų6276.2 Ų76.238%0.3841%0.414SS..Hα-helixtrans-54.9-44.2173.9-58.50000111.8L26 L30 L295 R296 I297L26-T293 HydrophobicContact CD1-CG2 4.4Å; L30-T293 HydrophobicContact CD1-CG2 3.72Å; T293-L295 VanDerWaalsContact C-N 3.33Å; T293-L295 PolarHBondContact O-N 3.18Å; T293-R296 WeakPolarHBondContact O-CB 3.18Å; T293-R296 PolarHBondContact O-N 3.49Å; T293-I297 HydrophobicContact CG2-CD1 4.1Å; T293-I297 WeakPolarHBondContact O-CG1 3.36Å; T293-I297 PolarHBondContact O-N 2.96Å
294S87.6Confident88Confident88 Ų8873.8 Ų73.862%0.61540%0.399SS*.Hα-helixtrans-60.4-41.4177.8-52.70000112.1T292 I297 M298T292-S294 VanDerWaalsContact C-N 3.28Å; T292-S294 PolarHBondContact O-N 3.06Å; S294-I297 PolarHBondContact O-N 3.01Å; S294-M298 WeakPolarHBondContact O-CB 3.28Å; S294-M298 PolarHBondContact O-N 2.92Å
295L88.3Confident88.3Confident38 Ų3875.3 Ų75.320%0.19941%0.406CS..Hα-helixtrans-65.8-39.6176.8-16672000111.9M279 V289 T292 T293 M298 F299M279-L295 HydrophobicContact CE-CD1 3.58Å; M279-L295 HydrophobicContact CE-CD2 4.48Å; M279-L295 HydrophobicContact CE-CG 3.83Å; V289-L295 HydrophobicContact CG1-CD2 3.25Å; T292-L295 PolarHBondContact O-N 2.84Å; T292-L295 VanDerWaalsContact O-N 3.16Å; T292-L295 WeakPolarHBondContact OG1-CB 3.24Å; T292-L295 PolarHBondContact OG1-N 3.43Å; T293-L295 VanDerWaalsContact C-N 3.33Å; T293-L295 PolarHBondContact O-N 3.18Å; L295-M298 PolarHBondContact O-N 2.92Å; L295-F299 WeakPolarHBondContact O-CB 3.21Å; L295-F299 PolarHBondContact O-N 2.83Å
296R88Confident88.6Confident154 Ų15470.3 Ų70.358%0.58139%0.385SS*.Hα-helixtrans-61.7-43174.3-67.3178.6178.7-165.4-1.8111.6V291 T292 T293 F299 N300V291-R296 HydrophobicContact CG1-CG 3.56Å; T292-R296 WeakPolarHBondContact O-CG 3.2Å; T292-R296 PolarHBondContact O-N 3.21Å; T293-R296 WeakPolarHBondContact O-CB 3.18Å; T293-R296 PolarHBondContact O-N 3.49Å; R296-F299 PolarHBondContact O-N 3.24Å; R296-N300 PolarHBondContact O-N 3.17Å; R296-N300 VanDerWaalsContact O-N 3.09Å; R296-N300 PolarHBondContact O-ND2 3.42Å
297I89.9Confident89Confident57 Ų5767.1 Ų67.129%0.29237%0.367SS..Hα-helixtrans-63-48.2176.9-66169.5000109.7V33 T293 S294 F299 N300 V301V33-I297 HydrophobicContact CG1-CG1 4.24Å; V33-I297 HydrophobicContact CG1-CG2 4.11Å; V33-I297 HydrophobicContact CG2-CD1 4.26Å; T293-I297 HydrophobicContact CG2-CD1 4.1Å; T293-I297 WeakPolarHBondContact O-CG1 3.36Å; T293-I297 PolarHBondContact O-N 2.96Å; S294-I297 PolarHBondContact O-N 3.01Å; I297-F299 VanDerWaalsContact C-N 3.34Å; I297-F299 PolarHBondContact O-N 3.2Å; I297-N300 PolarHBondContact O-N 2.9Å; I297-V301 HydrophobicContact CG2-CG2 4.44Å; I297-V301 WeakPolarHBondContact O-CG2 3.4Å; I297-V301 PolarHBondContact O-N 3Å
298M92.2Very high89.9Confident101 Ų10164.4 Ų64.450%0.49834%0.34SS..Hα-helixtrans-57.8-45.5177.5-175-174.8-64.300111.9S294 L295 N300 V301 I302S294-M298 WeakPolarHBondContact O-CB 3.28Å; S294-M298 PolarHBondContact O-N 2.92Å; L295-M298 PolarHBondContact O-N 2.92Å; M298-N300 VanDerWaalsContact C-N 3.34Å; M298-N300 PolarHBondContact O-N 3.21Å; M298-V301 PolarHBondContact O-N 2.83Å; M298-I302 HydrophobicContact CG-CD1 3.73Å; M298-I302 HydrophobicContact CG-CG1 4.33Å; M298-I302 WeakPolarHBondContact O-CB 3.33Å; M298-I302 VanDerWaalsContact O-CG1 3.3Å; M298-I302 WeakPolarHBondContact O-CG1 3.4Å; M298-I302 PolarHBondContact O-N 3.19Å; M298-I302 HydrophobicContact SD-CD1 4.32Å
299F91.6Very high90.6Very high67 Ų6757.7 Ų57.729%0.29430%0.304SS..Hα-helixtrans-57.7-46.2176.5-174-90.6000111.6M279 V283 L295 R296 I297 V301 I302 H303M279-F299 HydrophobicContact CE-CB 4.05Å; M279-F299 HydrophobicContact CE-CD2 3.94Å; M279-F299 HydrophobicContact CG-CD2 3.89Å; V283-F299 HydrophobicContact CG2-CD2 4.28Å; V283-F299 HydrophobicContact CG2-CE2 4.35Å; L295-F299 WeakPolarHBondContact O-CB 3.21Å; L295-F299 PolarHBondContact O-N 2.83Å; R296-F299 PolarHBondContact O-N 3.24Å; I297-F299 VanDerWaalsContact C-N 3.34Å; I297-F299 PolarHBondContact O-N 3.2Å; F299-V301 PolarHBondContact O-N 3.5Å; F299-I302 PolarHBondContact O-N 3.23Å; F299-H303 AromaticContact CD1-CE1 3.78Å; F299-H303 AromaticContact CD1-ND1 3.62Å; F299-H303 AromaticContact CD2-CE1 3.7Å; F299-H303 AromaticContact CE1-CE1 3.32Å; F299-H303 WeakPolarHBondContact CE1-CE1 3.3Å; F299-H303 AromaticContact CE1-ND1 3.53Å; F299-H303 AromaticContact CE1-NE2 3.83Å; F299-H303 AromaticContact CE2-CE1 3.25Å; F299-H303 WeakPolarHBondContact CE2-CE1 3.33Å; F299-H303 AromaticContact CG-CE1 3.97Å; F299-H303 AromaticContact CG-ND1 3.9Å; F299-H303 AromaticContact CZ-CE1 3.03Å; F299-H303 WeakPolarHBondContact CZ-CE1 3.32Å; F299-H303 AromaticContact CZ-ND1 3.75Å; F299-H303 AromaticContact CZ-NE2 3.51Å; F299-H303 PolarHBondContact O-N 2.66Å; F299-H303 VanDerWaalsContact O-N 3.07Å; F299-H303 PolarHBondContact O-ND1 2.98Å
300N92Very high91.2Very high41 Ų4156 Ų5622%0.21929%0.294CS..Hα-helixtrans-62.2-41.8176.9-79.7-75.2000112.4L37 R93 R296 I297 M298 H303L37-N300 HydrophobicContact CD1-CB 3.97Å; R93-N300 PolarHBondContact NH2-OD1 2.98Å; R296-N300 PolarHBondContact O-N 3.17Å; R296-N300 VanDerWaalsContact O-N 3.09Å; R296-N300 PolarHBondContact O-ND2 3.42Å; I297-N300 PolarHBondContact O-N 2.9Å; M298-N300 VanDerWaalsContact C-N 3.34Å; M298-N300 PolarHBondContact O-N 3.21Å; N300-H303 PolarHBondContact O-N 3.37Å
301V93.7Very high91.7Very high72 Ų7248.4 Ų48.444%0.43626%0.258SS..Hα-helixtrans-65.2-43.6177.2172.40000111.2L37 I297 M298 F299 H303 I304L37-V301 HydrophobicContact CD2-CG2 4.16Å; I297-V301 HydrophobicContact CG2-CG2 4.44Å; I297-V301 WeakPolarHBondContact O-CG2 3.4Å; I297-V301 PolarHBondContact O-N 3Å; M298-V301 PolarHBondContact O-N 2.83Å; F299-V301 PolarHBondContact O-N 3.5Å; V301-H303 VanDerWaalsContact C-N 3.28Å; V301-H303 PolarHBondContact O-N 2.86Å; V301-I304 VanDerWaalsContact O-CB 3.31Å; V301-I304 WeakPolarHBondContact O-CB 3.4Å; V301-I304 PolarHBondContact O-N 3.49Å; V301-I304 VanDerWaalsContact O-N 3.07Å
302I95.6Very high92.2Very high21 Ų2145.3 Ų45.311%0.10824%0.24CC..Hα-helixtrans-62.6-36.3179.1-73.8173.8000111.4P275 M279 M298 F299 I304 L305P275-I302 HydrophobicContact CB-CG2 4.48Å; M279-I302 HydrophobicContact CB-CD1 3.82Å; M279-I302 HydrophobicContact CB-CG2 4.07Å; M279-I302 HydrophobicContact CG-CD1 3.87Å; M279-I302 HydrophobicContact SD-CD1 4.19Å; M298-I302 HydrophobicContact CG-CD1 3.73Å; M298-I302 HydrophobicContact CG-CG1 4.33Å; M298-I302 WeakPolarHBondContact O-CB 3.33Å; M298-I302 VanDerWaalsContact O-CG1 3.3Å; M298-I302 WeakPolarHBondContact O-CG1 3.4Å; M298-I302 PolarHBondContact O-N 3.19Å; M298-I302 HydrophobicContact SD-CD1 4.32Å; F299-I302 PolarHBondContact O-N 3.23Å; I302-I304 PolarHBondContact O-N 2.94Å; I302-L305 WeakPolarHBondContact O-CB 3.29Å; I302-L305 WeakPolarHBondContact O-CG 3.37Å; I302-L305 PolarHBondContact O-N 3.28Å; I302-L305 VanDerWaalsContact O-N 3.1Å
303H94.5Very high92.2Very high38 Ų3842.2 Ų42.218%0.17622%0.221CC..THydrogen-bonded Turntrans-70.3-10.7177.1-77.269.8000113.9Y276 F299 N300 V301 Y307Y276-H303 AromaticContact CE2-CD2 3.73Å; Y276-H303 AromaticContact CE2-NE2 3.59Å; F299-H303 AromaticContact CD1-CE1 3.78Å; F299-H303 AromaticContact CD1-ND1 3.62Å; F299-H303 AromaticContact CD2-CE1 3.7Å; F299-H303 AromaticContact CE1-CE1 3.32Å; F299-H303 WeakPolarHBondContact CE1-CE1 3.3Å; F299-H303 AromaticContact CE1-ND1 3.53Å; F299-H303 AromaticContact CE1-NE2 3.83Å; F299-H303 AromaticContact CE2-CE1 3.25Å; F299-H303 WeakPolarHBondContact CE2-CE1 3.33Å; F299-H303 AromaticContact CG-CE1 3.97Å; F299-H303 AromaticContact CG-ND1 3.9Å; F299-H303 AromaticContact CZ-CE1 3.03Å; F299-H303 WeakPolarHBondContact CZ-CE1 3.32Å; F299-H303 AromaticContact CZ-ND1 3.75Å; F299-H303 AromaticContact CZ-NE2 3.51Å; F299-H303 PolarHBondContact O-N 2.66Å; F299-H303 VanDerWaalsContact O-N 3.07Å; F299-H303 PolarHBondContact O-ND1 2.98Å; N300-H303 PolarHBondContact O-N 3.37Å; V301-H303 VanDerWaalsContact C-N 3.28Å; V301-H303 PolarHBondContact O-N 2.86Å; H303-Y307 WeakPolarHBondContact O-CD2 3.45Å; H303-Y307 WeakPolarHBondContact O-CE2 3.24Å
304I96.1Very high92.1Very high10 Ų1039.5 Ų39.55%0.05120%0.204CC..THydrogen-bonded Turntrans-76.5-28.7170.5-67.7172.2000111.3L37 I40 Y41 L44 V301 I302 Y307 V308L37-I304 HydrophobicContact CD2-CD1 3.39Å; I40-I304 HydrophobicContact CG2-CD1 4.05Å; I40-I304 HydrophobicContact CG2-CG2 3.87Å; Y41-I304 HydrophobicContact CD1-CG1 4.47Å; Y41-I304 HydrophobicContact CE1-CD1 4.41Å; Y41-I304 HydrophobicContact CE1-CG1 3.67Å; Y41-I304 HydrophobicContact CE2-CD1 4.48Å; Y41-I304 HydrophobicContact CE2-CG1 4.44Å; L44-I304 HydrophobicContact CD1-CG2 3.48Å; L44-I304 VanDerWaalsContact CD1-CG2 3.48Å; V301-I304 VanDerWaalsContact O-CB 3.31Å; V301-I304 WeakPolarHBondContact O-CB 3.4Å; V301-I304 PolarHBondContact O-N 3.49Å; V301-I304 VanDerWaalsContact O-N 3.07Å; I302-I304 PolarHBondContact O-N 2.94Å; I304-Y307 WeakPolarHBondContact O-CA 3.34Å; I304-Y307 VanDerWaalsContact O-CB 3.29Å; I304-Y307 WeakPolarHBondContact O-CB 3.48Å; I304-Y307 PolarHBondContact O-N 3.18Å; I304-V308 HydrophobicContact CG2-CG2 4.11Å; I304-V308 PolarHBondContact O-N 2.77Å
305L96.5Very high91.7Very high44 Ų4439.1 Ų39.123%0.2320%0.195CC..Hα-helixtrans-58.8-40.8-170.3-61.5177.9000114.6C272 P275 I302 Y307 V308 S309C272-L305 HydrophobicContact CB-CB 4.12Å; C272-L305 WeakPolarHBondContact CB-O 3.37Å; C272-L305 WeakPolarHBondContact O-CB 3.17Å; P275-L305 HydrophobicContact CB-CD1 3.76Å; P275-L305 HydrophobicContact CG-CD1 3.83Å; I302-L305 WeakPolarHBondContact O-CB 3.29Å; I302-L305 WeakPolarHBondContact O-CG 3.37Å; I302-L305 PolarHBondContact O-N 3.28Å; I302-L305 VanDerWaalsContact O-N 3.1Å; L305-Y307 PolarHBondContact O-N 3.41Å; L305-V308 WeakPolarHBondContact O-CA 3.45Å; L305-V308 WeakPolarHBondContact O-CB 3.38Å; L305-V308 PolarHBondContact O-N 3.42Å; L305-S309 PolarHBondContact O-N 3.25Å
306P96Very high91.3Very high4 Ų438.4 Ų38.43%0.02619%0.191CC..Hα-helixtrans-58.8-34.1174.2-26.336.6000113.5F82 K116 W273 Y276 S309 C310F82-P306 HydrophobicContact CE1-CB 4.34Å; F82-P306 HydrophobicContact CZ-CB 4.3Å; K116-P306 HydrophobicContact CD-CB 3.78Å; K116-P306 HydrophobicContact CD-CG 4.28Å; K116-P306 HydrophobicContact CG-CB 4.02Å; W273-P306 HydrophobicContact CZ2-CB 4.26Å; Y276-P306 HydrophobicContact CD2-CG 3.87Å; Y276-P306 HydrophobicContact CE2-CG 4.4Å; Y276-P306 HydrophobicContact CG-CG 4.09Å; P306-S309 WeakPolarHBondContact O-CB 3.32Å; P306-S309 PolarHBondContact O-N 2.81Å; P306-C310 PolarHBondContact O-N 3.04Å; P306-C310 VanDerWaalsContact O-N 3.17Å
307Y95.9Very high90.7Very high7 Ų731.8 Ų31.83%0.02717%0.166CC..Hα-helixtrans-67.1-37.3173.2-61.6-85.1000111.5Y41 F82 L86 E112 H303 I304 L305 S309 C310 V311Y41-Y307 HydrophobicContact CE1-CD2 4.23Å; Y41-Y307 HydrophobicContact CE1-CE2 4.22Å; F82-Y307 HydrophobicContact CD1-CD1 4.2Å; F82-Y307 HydrophobicContact CD1-CE1 4.43Å; F82-Y307 HydrophobicContact CD2-CD1 4.3Å; F82-Y307 AromaticContact CD2-CE1 3.72Å; F82-Y307 HydrophobicContact CD2-CE1 3.72Å; F82-Y307 AromaticContact CE1-CD1 3.64Å; F82-Y307 HydrophobicContact CE1-CD1 3.64Å; F82-Y307 AromaticContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CG 4.01Å; F82-Y307 AromaticContact CE2-CD1 3.75Å; F82-Y307 HydrophobicContact CE2-CD1 3.75Å; F82-Y307 AromaticContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE2 4.13Å; F82-Y307 HydrophobicContact CE2-CG 4.49Å; F82-Y307 AromaticContact CE2-CZ 3.33Å; F82-Y307 WeakPolarHBondContact CE2-OH 3.13Å; F82-Y307 HydrophobicContact CG-CD1 4.49Å; F82-Y307 HydrophobicContact CG-CE1 4.33Å; F82-Y307 AromaticContact CZ-CD1 3.38Å; F82-Y307 HydrophobicContact CZ-CD1 3.38Å; F82-Y307 AromaticContact CZ-CD2 3.97Å; F82-Y307 HydrophobicContact CZ-CD2 3.97Å; F82-Y307 AromaticContact CZ-CE1 3.23Å; F82-Y307 HydrophobicContact CZ-CE1 3.23Å; F82-Y307 AromaticContact CZ-CE2 3.82Å; F82-Y307 HydrophobicContact CZ-CE2 3.82Å; F82-Y307 AromaticContact CZ-CG 3.76Å; F82-Y307 HydrophobicContact CZ-CG 3.76Å; F82-Y307 AromaticContact CZ-CZ 3.45Å; F82-Y307 VanDerWaalsContact CZ-CZ 3.45Å; L86-Y307 HydrophobicContact CD1-CD1 4.1Å; L86-Y307 HydrophobicContact CD2-CD1 3.62Å; L86-Y307 HydrophobicContact CD2-CE1 3.35Å; L86-Y307 HydrophobicContact CD2-CE2 4.46Å; L86-Y307 HydrophobicContact CD2-CG 4.26Å; L86-Y307 HydrophobicContact CG-CD1 4.06Å; L86-Y307 HydrophobicContact CG-CE1 3.97Å; E112-Y307 PolarHBondContact OE1-OH 3.03Å; H303-Y307 WeakPolarHBondContact O-CD2 3.45Å; H303-Y307 WeakPolarHBondContact O-CE2 3.24Å; I304-Y307 WeakPolarHBondContact O-CA 3.34Å; I304-Y307 VanDerWaalsContact O-CB 3.29Å; I304-Y307 WeakPolarHBondContact O-CB 3.48Å; I304-Y307 PolarHBondContact O-N 3.18Å; L305-Y307 PolarHBondContact O-N 3.41Å; Y307-S309 VanDerWaalsContact C-N 3.29Å; Y307-S309 PolarHBondContact O-N 3.45Å; Y307-C310 PolarHBondContact O-N 3.45Å; Y307-C310 PolarHBondContact O-SG 3.33Å; Y307-V311 WeakPolarHBondContact O-CG1 3.5Å; Y307-V311 PolarHBondContact O-N 2.98Å
308V95.5Very high89.6Confident46 Ų4630.4 Ų30.428%0.27916%0.163SC..Hα-helixtrans-61-41.2172.4-177.60000110.7L44 I304 L305 C310 V311 T312L44-V308 HydrophobicContact CD1-CG2 4.5Å; L44-V308 HydrophobicContact CD2-CG2 4.05Å; I304-V308 HydrophobicContact CG2-CG2 4.11Å; I304-V308 PolarHBondContact O-N 2.77Å; L305-V308 WeakPolarHBondContact O-CA 3.45Å; L305-V308 WeakPolarHBondContact O-CB 3.38Å; L305-V308 PolarHBondContact O-N 3.42Å; V308-C310 VanDerWaalsContact C-N 3.33Å; V308-C310 PolarHBondContact O-N 2.91Å; V308-V311 WeakPolarHBondContact O-CG2 3.39Å; V308-T312 HydrophobicContact CG1-CG2 4.28Å; V308-T312 WeakPolarHBondContact O-CG2 3.23Å; V308-T312 PolarHBondContact O-N 3.07Å; V308-T312 PolarHBondContact O-OG1 2.95Å
309S94Very high88.3Confident2 Ų230.4 Ų30.41%0.01416%0.164CC..Hα-helixtrans-61.4-37.7177.1-168.50000112.9L305 P306 Y307 T312L305-S309 PolarHBondContact O-N 3.25Å; P306-S309 WeakPolarHBondContact O-CB 3.32Å; P306-S309 PolarHBondContact O-N 2.81Å; Y307-S309 VanDerWaalsContact C-N 3.29Å; Y307-S309 PolarHBondContact O-N 3.45Å; S309-T312 PolarHBondContact O-OG1 3.31Å
310C92.6Very high86.9Confident1 Ų129.2 Ų29.21%0.00716%0.159CC..Hα-helixtrans-77.5-34.7-176.876.60000113N51 D79 F82 P306 Y307 V308N51-C310 PolarHBondContact ND2-O 3.44Å; D79-C310 HydrophobicContact CB-CB 3.97Å; D79-C310 WeakPolarHBondContact OD1-CB 3.44Å; F82-C310 HydrophobicContact CD1-CB 4.04Å; F82-C310 HydrophobicContact CE1-CB 4.47Å; P306-C310 PolarHBondContact O-N 3.04Å; P306-C310 VanDerWaalsContact O-N 3.17Å; Y307-C310 PolarHBondContact O-N 3.45Å; Y307-C310 PolarHBondContact O-SG 3.33Å; V308-C310 VanDerWaalsContact C-N 3.33Å; V308-C310 PolarHBondContact O-N 2.91Å
311V92Very high85.4Confident3 Ų329.6 Ų29.62%0.01816%0.163CC..Hα-helixtrans-79.3-21.5-178.7-55.30000113.2L44 L47 I83 Y307 V308L44-V311 HydrophobicContact CD2-CG1 4.4Å; L44-V311 HydrophobicContact CD2-CG2 3.71Å; L44-V311 WeakPolarHBondContact O-CG1 3.43Å; L47-V311 HydrophobicContact CB-CB 4.08Å; L47-V311 HydrophobicContact CB-CG1 4.47Å; L47-V311 HydrophobicContact CB-CG2 4.35Å; L47-V311 HydrophobicContact CD1-CG2 4.45Å; I83-V311 HydrophobicContact CG2-CG1 4.21Å; Y307-V311 WeakPolarHBondContact O-CG1 3.5Å; Y307-V311 PolarHBondContact O-N 2.98Å; V308-V311 WeakPolarHBondContact O-CG2 3.39Å
312T90.8Very high83.4Confident27 Ų2729.3 Ų29.317%0.16617%0.165CC..Hα-helixtrans-76.6-23.7179.3500000112.6C268 V308 S309 L315 L316C268-T312 PolarHBondContact SG-OG1 3.33Å; V308-T312 HydrophobicContact CG1-CG2 4.28Å; V308-T312 WeakPolarHBondContact O-CG2 3.23Å; V308-T312 PolarHBondContact O-N 3.07Å; V308-T312 PolarHBondContact O-OG1 2.95Å; S309-T312 PolarHBondContact O-OG1 3.31Å; T312-L315 WeakPolarHBondContact O-CB 3.29Å; T312-L315 PolarHBondContact O-N 3.38Å; T312-L315 VanDerWaalsContact O-N 3.15Å; T312-L316 WeakPolarHBondContact O-CG 3.26Å; T312-L316 PolarHBondContact O-N 3.05Å
313N88.2Confident81.5Confident4 Ų434.7 Ų34.72%0.02119%0.189CC..Hα-helixtrans-50-62.2179.6-76-24.3000112.1L75 D79 L315 L316 Y317L75-N313 HydrophobicContact CD2-CB 4.45Å; D79-N313 PolarHBondContact OD2-ND2 3.26Å; N313-L315 VanDerWaalsContact C-N 3.29Å; N313-L315 PolarHBondContact O-N 3.35Å; N313-L316 PolarHBondContact O-N 3.04Å; N313-L316 VanDerWaalsContact O-N 3.1Å; N313-Y317 VanDerWaalsContact C-CD2 3.42Å; N313-Y317 HydrophobicContact CB-CD2 4.38Å; N313-Y317 HydrophobicContact CB-CE2 4.01Å; N313-Y317 WeakPolarHBondContact O-CD2 3.39Å; N313-Y317 PolarHBondContact O-N 3.17Å
314P83.4Confident79.4Confident5 Ų535.2 Ų35.23%0.03219%0.191CC..Hα-helixtrans-49.7-44.9175-33.438.2000114.5S50 N51 I54 L316 Y317 A318S50-P314 WeakPolarHBondContact OG-CB 3.36Å; S50-P314 WeakPolarHBondContact OG-CG 3.39Å; N51-P314 HydrophobicContact CB-CG 4.44Å; N51-P314 VanDerWaalsContact CG-CG 3.46Å; N51-P314 WeakPolarHBondContact OD1-CD 3.24Å; N51-P314 WeakPolarHBondContact OD1-CG 3.48Å; I54-P314 HydrophobicContact CD1-CB 3.5Å; I54-P314 HydrophobicContact CD1-CG 3.67Å; P314-L316 VanDerWaalsContact C-N 3.32Å; P314-L316 PolarHBondContact O-N 3.07Å; P314-Y317 PolarHBondContact O-N 2.93Å; P314-A318 WeakPolarHBondContact O-CB 3.26Å; P314-A318 PolarHBondContact O-N 2.73Å
315L78.4Confident77.4Confident80 Ų8038.9 Ų38.942%0.41921%0.206SC..Hα-helixtrans-61.3-44.7-178.9-62.9174.7000110.1T312 N313 A318 L319T312-L315 WeakPolarHBondContact O-CB 3.29Å; T312-L315 PolarHBondContact O-N 3.38Å; T312-L315 VanDerWaalsContact O-N 3.15Å; N313-L315 VanDerWaalsContact C-N 3.29Å; N313-L315 PolarHBondContact O-N 3.35Å; L315-A318 PolarHBondContact O-N 3.03Å; L315-L319 VanDerWaalsContact O-CB 3.25Å; L315-L319 WeakPolarHBondContact O-CB 3.46Å; L315-L319 WeakPolarHBondContact O-CD1 3.26Å; L315-L319 WeakPolarHBondContact O-CG 3.22Å; L315-L319 PolarHBondContact O-N 3.24Å
316L80.9Confident75.3Confident22 Ų2240.7 Ų40.712%0.11521%0.214CC..Hα-helixtrans-66.4-44.2176.8-64176.1000111.6I265 C268 T312 N313 P314 A318 F320I265-L316 HydrophobicContact CB-CD1 4.3Å; I265-L316 HydrophobicContact CG1-CB 3.98Å; I265-L316 HydrophobicContact CG1-CD1 3.59Å; I265-L316 HydrophobicContact CG1-CG 4.41Å; C268-L316 HydrophobicContact CB-CD1 4.41Å; T312-L316 WeakPolarHBondContact O-CG 3.26Å; T312-L316 PolarHBondContact O-N 3.05Å; N313-L316 PolarHBondContact O-N 3.04Å; N313-L316 VanDerWaalsContact O-N 3.1Å; P314-L316 VanDerWaalsContact C-N 3.32Å; P314-L316 PolarHBondContact O-N 3.07Å; L316-A318 VanDerWaalsContact C-N 3.32Å; L316-A318 PolarHBondContact O-N 3Å; L316-F320 HydrophobicContact CD2-CE2 4.06Å; L316-F320 VanDerWaalsContact O-CD2 3.24Å; L316-F320 WeakPolarHBondContact O-CD2 3.43Å; L316-F320 PolarHBondContact O-N 3.08Å
317Y74.2Confident73.5Confident16 Ų1641.3 Ų41.36%0.06322%0.217CC..Hα-helixtrans-60.4-42.3174.7-69.5-70.2000111.9I72 L75 L126 M261 I265 N313 P314 T321I72-Y317 HydrophobicContact CD1-CD1 4.06Å; I72-Y317 HydrophobicContact CD1-CE1 4.12Å; I72-Y317 HydrophobicContact CG1-CE1 4.3Å; L75-Y317 HydrophobicContact CD2-CE2 3.95Å; L126-Y317 VanDerWaalsContact CD1-OH 3.24Å; L126-Y317 WeakPolarHBondContact CD1-OH 3.42Å; M261-Y317 HydrophobicContact CE-CD1 3.04Å; M261-Y317 HydrophobicContact CE-CE1 3.16Å; M261-Y317 HydrophobicContact CE-CG 4.02Å; I265-Y317 HydrophobicContact CD1-CE1 4.14Å; N313-Y317 VanDerWaalsContact C-CD2 3.42Å; N313-Y317 HydrophobicContact CB-CD2 4.38Å; N313-Y317 HydrophobicContact CB-CE2 4.01Å; N313-Y317 WeakPolarHBondContact O-CD2 3.39Å; N313-Y317 PolarHBondContact O-N 3.17Å; P314-Y317 PolarHBondContact O-N 2.93Å; Y317-T321 WeakPolarHBondContact O-CB 3.24Å; Y317-T321 PolarHBondContact O-N 3.29Å; Y317-T321 PolarHBondContact O-OG1 2.92Å
318A68.5Low71.5Confident27 Ų2744.3 Ų44.322%0.22324%0.236CC..Hα-helixtrans-69.7-44.9-179.800000112.6P314 L315 L316 F320 F324 K325P314-A318 WeakPolarHBondContact O-CB 3.26Å; P314-A318 PolarHBondContact O-N 2.73Å; L315-A318 PolarHBondContact O-N 3.03Å; L316-A318 VanDerWaalsContact C-N 3.32Å; L316-A318 PolarHBondContact O-N 3Å; A318-F320 VanDerWaalsContact C-N 3.28Å; A318-F320 PolarHBondContact O-N 3.47Å; A318-F324 VanDerWaalsContact CA-CD1 3.46Å; A318-F324 HydrophobicContact CB-CD1 3.46Å; A318-F324 VanDerWaalsContact CB-CD1 3.46Å; A318-F324 HydrophobicContact CB-CE1 3.58Å; A318-K325 WeakPolarHBondContact O-CE 3.04Å; A318-K325 WeakPolarHBondContact O-CG 3.27Å
319L64.8Low69.7Low101 Ų10147.9 Ų47.953%0.52925%0.245SC..Hα-helixtrans-64.2-34.3-178.6-73.6171.2000112.2L315 K325L315-L319 VanDerWaalsContact O-CB 3.25Å; L315-L319 WeakPolarHBondContact O-CB 3.46Å; L315-L319 WeakPolarHBondContact O-CD1 3.26Å; L315-L319 WeakPolarHBondContact O-CG 3.22Å; L315-L319 PolarHBondContact O-N 3.24Å; L319-K325 VanDerWaalsContact C-CE 3.48Å; L319-K325 WeakPolarHBondContact O-CE 3.19Å; L319-K325 PolarHBondContact O-NZ 3.12Å
320F60.8Low68Low42 Ų4249.8 Ų49.818%0.18425%0.253CS..Hα-helixtrans-108.4-7.8-173.4-64.2-72.4000115.5R257 R260 M261 L316 A318R257-F320 WeakPolarHBondContact CD-O 3.16Å; R257-F320 HydrophobicContact CG-CB 4.18Å; R257-F320 HydrophobicContact CG-CD1 4.06Å; R257-F320 VanDerWaalsContact CG-O 3.23Å; R257-F320 WeakPolarHBondContact CG-O 3.4Å; R260-F320 HydrophobicContact CB-CD1 4.13Å; R260-F320 HydrophobicContact CB-CE1 3.57Å; R260-F320 HydrophobicContact CB-CZ 4.12Å; M261-F320 HydrophobicContact CB-CB 3.45Å; M261-F320 VanDerWaalsContact CB-CB 3.45Å; M261-F320 HydrophobicContact CB-CD1 4.28Å; M261-F320 HydrophobicContact CB-CD2 3.71Å; M261-F320 HydrophobicContact CB-CG 3.56Å; M261-F320 HydrophobicContact CG-CB 3.54Å; M261-F320 HydrophobicContact CG-CD2 3.78Å; M261-F320 HydrophobicContact CG-CG 3.91Å; M261-F320 HydrophobicContact SD-CB 3.75Å; L316-F320 HydrophobicContact CD2-CE2 4.06Å; L316-F320 VanDerWaalsContact O-CD2 3.24Å; L316-F320 WeakPolarHBondContact O-CD2 3.43Å; L316-F320 PolarHBondContact O-N 3.08Å; A318-F320 VanDerWaalsContact C-N 3.28Å; A318-F320 PolarHBondContact O-N 3.47Å
321T61.7Low66.5Low50 Ų5053 Ų5331%0.30728%0.279SS..  trans-105.2107.2175.4-47.60000110Y317 H323 F324 K325Y317-T321 WeakPolarHBondContact O-CB 3.24Å; Y317-T321 PolarHBondContact O-N 3.29Å; Y317-T321 PolarHBondContact O-OG1 2.92Å; T321-H323 HydrophobicContact CG2-CB 4.07Å; T321-H323 PolarHBondContact O-N 3.17Å; T321-F324 HydrophobicContact CG2-CB 4.23Å; T321-F324 PolarHBondContact O-N 3.22Å; T321-K325 PolarHBondContact O-N 2.85Å
322S51.9Low65Low66 Ų6657.1 Ų57.146%0.46231%0.314SS..Hα-helixtrans-58.6-34.8177.342.70000112.6R257 K325 E326R257-S322 PolarHBondContact NH1-OG 3.49Å; S322-K325 PolarHBondContact O-N 3.42Å; S322-E326 WeakPolarHBondContact O-CB 3.5Å; S322-E326 PolarHBondContact O-N 3.35Å
323H53.9Low63.8Low133 Ų13364.8 Ų64.862%0.61634%0.34SS*.Hα-helixtrans-62.6-41.8174.8-175.4-82.5000111.7T321 E326 V327T321-H323 HydrophobicContact CG2-CB 4.07Å; T321-H323 PolarHBondContact O-N 3.17Å; H323-E326 PolarHBondContact O-N 3.22Å; H323-V327 WeakPolarHBondContact O-CB 3.17Å; H323-V327 VanDerWaalsContact O-CG2 3.24Å; H323-V327 WeakPolarHBondContact O-CG2 3.46Å; H323-V327 PolarHBondContact O-N 3.45Å
324F50.8Low62Low49 Ų4967.9 Ų67.922%0.21537%0.373CS..Hα-helixtrans-67.7-44.1176.9-167-92.1000111.3I54 A318 T321 E326 V327 V328I54-F324 HydrophobicContact CD1-CE2 4.31Å; I54-F324 HydrophobicContact CD1-CZ 3.87Å; I54-F324 HydrophobicContact CG1-CE2 3.94Å; I54-F324 HydrophobicContact CG1-CZ 3.68Å; A318-F324 VanDerWaalsContact CA-CD1 3.46Å; A318-F324 HydrophobicContact CB-CD1 3.46Å; A318-F324 VanDerWaalsContact CB-CD1 3.46Å; A318-F324 HydrophobicContact CB-CE1 3.58Å; T321-F324 HydrophobicContact CG2-CB 4.23Å; T321-F324 PolarHBondContact O-N 3.22Å; F324-E326 PolarHBondContact O-N 2.94Å; F324-V327 PolarHBondContact O-N 2.85Å; F324-V328 HydrophobicContact CD1-CG2 3.62Å; F324-V328 HydrophobicContact CE1-CG2 3.3Å; F324-V328 HydrophobicContact CE2-CG2 4.39Å; F324-V328 HydrophobicContact CG-CG2 4.34Å; F324-V328 HydrophobicContact CZ-CG2 3.73Å; F324-V328 WeakPolarHBondContact O-CB 3.41Å; F324-V328 WeakPolarHBondContact O-CG2 3.35Å; F324-V328 PolarHBondContact O-N 3.04Å
325K53.8Low60.4Low87 Ų8769.7 Ų69.738%0.37839%0.385SS..Hα-helixtrans-55.9-40.4174-65.6-167.8179.7-179.30112.3A318 L319 T321 S322 R329A318-K325 WeakPolarHBondContact O-CE 3.04Å; A318-K325 WeakPolarHBondContact O-CG 3.27Å; L319-K325 VanDerWaalsContact C-CE 3.48Å; L319-K325 WeakPolarHBondContact O-CE 3.19Å; L319-K325 PolarHBondContact O-NZ 3.12Å; T321-K325 PolarHBondContact O-N 2.85Å; S322-K325 PolarHBondContact O-N 3.42Å; K325-R329 VanDerWaalsContact O-CB 3.28Å; K325-R329 WeakPolarHBondContact O-CB 3.12Å; K325-R329 PolarHBondContact O-N 2.91Å
326E54Low59Low83 Ų8370.4 Ų70.439%0.38840%0.397SS..Hα-helixtrans-75.3-39.3-179.7-171.2157.5163.300112.8S322 H323 F324 R329 K330S322-E326 WeakPolarHBondContact O-CB 3.5Å; S322-E326 PolarHBondContact O-N 3.35Å; H323-E326 PolarHBondContact O-N 3.22Å; F324-E326 PolarHBondContact O-N 2.94Å; E326-R329 PolarHBondContact O-N 2.94Å; E326-K330 HydrophobicContact CG-CD 4.11Å; E326-K330 HydrophobicContact CG-CG 4.46Å; E326-K330 WeakPolarHBondContact O-CB 3.49Å; E326-K330 VanDerWaalsContact O-CG 3.3Å; E326-K330 WeakPolarHBondContact O-CG 3.45Å; E326-K330 PolarHBondContact O-N 3.34Å; E326-K330 WeakPolarHBondContact OE1-CE 3.41Å; E326-K330 IonicContact OE1-NZ 2.73Å; E326-K330 PolarHBondContact OE1-NZ 3.03Å
327V57.6Low57.4Low17 Ų1774.4 Ų74.410%0.10342%0.418CS..Hα-helixtrans-62.4-46.3172.8167.50000111.1F57 H323 F324 K330 A331F57-V327 HydrophobicContact CD2-CG1 4.49Å; F57-V327 HydrophobicContact CE1-CG1 4.01Å; F57-V327 HydrophobicContact CE2-CG1 3.57Å; F57-V327 HydrophobicContact CZ-CG1 3.3Å; H323-V327 WeakPolarHBondContact O-CB 3.17Å; H323-V327 VanDerWaalsContact O-CG2 3.24Å; H323-V327 WeakPolarHBondContact O-CG2 3.46Å; H323-V327 PolarHBondContact O-N 3.45Å; F324-V327 PolarHBondContact O-N 2.85Å; V327-K330 PolarHBondContact O-N 3.4Å; V327-A331 VanDerWaalsContact O-CB 3.32Å; V327-A331 WeakPolarHBondContact O-CB 3.43Å; V327-A331 PolarHBondContact O-N 3.28Å
328V54.2Low56.3Low70 Ų7078.9 Ų78.942%0.42445%0.447SS..Hα-helixtrans-63.2-45175.6171.80000110.8F324 K330 A331 A332F324-V328 HydrophobicContact CD1-CG2 3.62Å; F324-V328 HydrophobicContact CE1-CG2 3.3Å; F324-V328 HydrophobicContact CE2-CG2 4.39Å; F324-V328 HydrophobicContact CG-CG2 4.34Å; F324-V328 HydrophobicContact CZ-CG2 3.73Å; F324-V328 WeakPolarHBondContact O-CB 3.41Å; F324-V328 WeakPolarHBondContact O-CG2 3.35Å; F324-V328 PolarHBondContact O-N 3.04Å; V328-K330 VanDerWaalsContact C-N 3.33Å; V328-K330 PolarHBondContact O-N 3.24Å; V328-A331 PolarHBondContact O-N 3.44Å; V328-A332 VanDerWaalsContact O-CB 3.23Å; V328-A332 WeakPolarHBondContact O-CB 3.49Å; V328-A332 PolarHBondContact O-N 3.17Å
329R57.5Low55.1Low120 Ų12083.4 Ų83.445%0.45346%0.463SS..Hα-helixtrans-59.2-41.6174.3-99.3-176-90.6115-6.5112.6K325 E326 R333K325-R329 VanDerWaalsContact O-CB 3.28Å; K325-R329 WeakPolarHBondContact O-CB 3.12Å; K325-R329 PolarHBondContact O-N 2.91Å; E326-R329 PolarHBondContact O-N 2.94Å; R329-R333 WeakPolarHBondContact O-CB 3.5Å; R329-R333 WeakPolarHBondContact O-CG 3.46Å; R329-R333 PolarHBondContact O-N 2.99Å; R329-R333 VanDerWaalsContact O-N 3.1Å
330K57.8Low54.2Low42 Ų4281.5 Ų81.518%0.18345%0.453CS..Hα-helixtrans-72.3-38.3179.8-75.9178-179.3170.50112.1E326 V327 V328 R333 S335E326-K330 HydrophobicContact CG-CD 4.11Å; E326-K330 HydrophobicContact CG-CG 4.46Å; E326-K330 WeakPolarHBondContact O-CB 3.49Å; E326-K330 VanDerWaalsContact O-CG 3.3Å; E326-K330 WeakPolarHBondContact O-CG 3.45Å; E326-K330 PolarHBondContact O-N 3.34Å; E326-K330 WeakPolarHBondContact OE1-CE 3.41Å; E326-K330 IonicContact OE1-NZ 2.73Å; E326-K330 PolarHBondContact OE1-NZ 3.03Å; V327-K330 PolarHBondContact O-N 3.4Å; V328-K330 VanDerWaalsContact C-N 3.33Å; V328-K330 PolarHBondContact O-N 3.24Å; K330-R333 PolarHBondContact O-N 3.18Å; K330-S335 PolarHBondContact O-N 3.49Å; K330-S335 PolarHBondContact O-OG 3.32Å
331A60.8Low53.4Low68 Ų6883.5 Ų83.556%0.56247%0.469SS*.Hα-helixtrans-64.5-44.6173.100000111.5V327 V328 R333 G334V327-A331 VanDerWaalsContact O-CB 3.32Å; V327-A331 WeakPolarHBondContact O-CB 3.43Å; V327-A331 PolarHBondContact O-N 3.28Å; V328-A331 PolarHBondContact O-N 3.44Å; A331-R333 VanDerWaalsContact C-N 3.25Å; A331-R333 PolarHBondContact O-N 3.29Å; A331-G334 PolarHBondContact O-N 3.35Å; A331-G334 VanDerWaalsContact O-N 3.16Å
332A61.4Low52.2Low90 Ų9087.1 Ų87.174%0.74448%0.482SS*.Hα-helixtrans-65.2-26.5176.800000113.3V328 G334V328-A332 VanDerWaalsContact O-CB 3.23Å; V328-A332 WeakPolarHBondContact O-CB 3.49Å; V328-A332 PolarHBondContact O-N 3.17Å; A332-G334 VanDerWaalsContact C-N 3.3Å
333R65.8Low51.6Low189 Ų18988.3 Ų88.371%0.71348%0.483SS*.THydrogen-bonded Turntrans-84.95.3176-74.2176-175.1-175.6-1.1114R329 K330 A331 S335R329-R333 WeakPolarHBondContact O-CB 3.5Å; R329-R333 WeakPolarHBondContact O-CG 3.46Å; R329-R333 PolarHBondContact O-N 2.99Å; R329-R333 VanDerWaalsContact O-N 3.1Å; K330-R333 PolarHBondContact O-N 3.18Å; A331-R333 VanDerWaalsContact C-N 3.25Å; A331-R333 PolarHBondContact O-N 3.29Å; R333-S335 PolarHBondContact O-N 3.26Å
334G50.4Low50.8Low69 Ų6990 Ų9071%0.71149%0.488SS*.THydrogen-bonded Turntrans59.520-17900000114.2A331 A332 S336A331-G334 PolarHBondContact O-N 3.35Å; A331-G334 VanDerWaalsContact O-N 3.16Å; A332-G334 VanDerWaalsContact C-N 3.3Å; G334-S336 PolarHBondContact O-N 3.35Å
335S49.2Very low50.1Low43 Ų4390.5 Ų90.530%0.30150%0.498SS..  trans-68.1124.2-172.1-43.30000110.7K330 R333K330-S335 PolarHBondContact O-N 3.49Å; K330-S335 PolarHBondContact O-OG 3.32Å; R333-S335 PolarHBondContact O-N 3.26Å
336S48.3Very low49.2Very low94 Ų9491.2 Ų91.266%0.65751%0.505SS*.  trans-64.7158-178.2660000113.3G334 V338G334-S336 PolarHBondContact O-N 3.35Å; S336-V338 PolarHBondContact O-N 3.43Å
337L49.2Very low48.1Very low106 Ų10690.4 Ų90.456%0.55552%0.519SS*.THydrogen-bonded Turntrans-55.6-17.3-163.6-149.580.5000116.5Q339 L340L337-Q339 VanDerWaalsContact C-N 3.34Å; L337-Q339 PolarHBondContact O-N 3.06Å; L337-L340 PolarHBondContact O-N 3.29Å
338V50.1Low47Very low111 Ų111100.2 Ų100.267%0.67355%0.554SS**Hα-helixtrans-68-31.6-172.3-1790000112.4S336 T341S336-V338 PolarHBondContact O-N 3.43Å; V338-T341 PolarHBondContact O-OG1 2.7Å
339Q44.1Very low45.9Very low121 Ų121105 Ų10557%0.56557%0.57SS**Hα-helixtrans-79.7-17.7-179.8-73.4-175.3-11.600114.1L337L337-Q339 VanDerWaalsContact C-N 3.34Å; L337-Q339 PolarHBondContact O-N 3.06Å
340L44.6Very low44.6Very low62 Ų62107.8 Ų107.833%0.32559%0.588SS.*Hα-helixtrans-84.5-29.3-178.3-94.6141.2000112.9L337L337-L340 PolarHBondContact O-N 3.29Å
341T44.2Very low43.5Very low84 Ų84113.1 Ų113.152%0.51562%0.616SS.*Hα-helixtrans-76.4-29.1177.347.60000112.7V338 L343 K344V338-T341 PolarHBondContact O-OG1 2.7Å; T341-L343 PolarHBondContact O-N 3.38Å; T341-L343 VanDerWaalsContact O-N 3.08Å; T341-K344 PolarHBondContact O-N 3Å
342H37.7Very low42.2Very low125 Ų125124.8 Ų124.858%0.57965%0.646SS**Hα-helixtrans-60.9-22179.7-143.8-83.4000113.4S345 I346H342-S345 WeakPolarHBondContact O-CB 3.44Å; H342-S345 PolarHBondContact O-N 3.21Å; H342-I346 WeakPolarHBondContact O-CG1 3.47Å; H342-I346 PolarHBondContact O-N 3.08Å
343L38.8Very low41.3Very low91 Ų91126.6 Ų126.648%0.47664%0.641SS.*Hα-helixtrans-83.7-15.1175.4-80.8159.6000114.6T341 S345 I346 G347T341-L343 PolarHBondContact O-N 3.38Å; T341-L343 VanDerWaalsContact O-N 3.08Å; L343-S345 PolarHBondContact O-N 3.29Å; L343-I346 HydrophobicContact CD2-CB 4.26Å; L343-I346 HydrophobicContact CD2-CD1 4.06Å; L343-G347 PolarHBondContact O-N 2.98Å
344K37.4Very low40Very low169 Ų169123.3 Ų123.374%0.73564%0.637SS**Hα-helixtrans-67.1-26165-85-177.3177175.70111.5T341T341-K344 PolarHBondContact O-N 3Å
345S35.2Very low39.4Very low60 Ų60126.3 Ų126.342%0.4263%0.633SS.*Hα-helixtrans-79.7-47.6176.4151.40000111.5H342 L343 G347 R348H342-S345 WeakPolarHBondContact O-CB 3.44Å; H342-S345 PolarHBondContact O-N 3.21Å; L343-S345 PolarHBondContact O-N 3.29Å; S345-G347 VanDerWaalsContact C-N 3.31Å; S345-G347 PolarHBondContact O-N 3.13Å; S345-R348 PolarHBondContact O-N 3.33Å; S345-R348 VanDerWaalsContact O-N 3.13Å
346I34.9Very low38.8Very low101 Ų101131.2 Ų131.252%0.51865%0.653SS.*Hα-helixtrans-66.4-32.2-176.5-62.8164.5000112.2H342 L343 R348H342-I346 WeakPolarHBondContact O-CG1 3.47Å; H342-I346 PolarHBondContact O-N 3.08Å; L343-I346 HydrophobicContact CD2-CB 4.26Å; L343-I346 HydrophobicContact CD2-CD1 4.06Å; I346-R348 VanDerWaalsContact C-N 3.27Å; I346-R348 PolarHBondContact O-N 3.3Å
347G31.9Very low38.2Very low67 Ų67133.5 Ų133.569%0.69165%0.652SS**THydrogen-bonded Turntrans-71.2-13.5176.600000115.5L343 S345L343-G347 PolarHBondContact O-N 2.98Å; S345-G347 VanDerWaalsContact C-N 3.31Å; S345-G347 PolarHBondContact O-N 3.13Å
348R32.7Very low37.5Very low222 Ų222135.3 Ų135.384%0.83866%0.659SS**THydrogen-bonded Turntrans-92.2-13.9178.5-78.3-170.7-171.3-176.83.1114.2S345 I346S345-R348 PolarHBondContact O-N 3.33Å; S345-R348 VanDerWaalsContact O-N 3.13Å; I346-R348 VanDerWaalsContact C-N 3.27Å; I346-R348 PolarHBondContact O-N 3.3Å
349F31.8Very low36.6Very low172 Ų172137.1 Ų137.175%0.75466%0.658SS**SBendtrans-92.60.8-171.1-98.2-81.4000116.4
350H30Very low36Very low178 Ų178138.3 Ų138.382%0.82467%0.665SS**SBendtrans-132.157.3-180-87.3-6.2000113.6
351I35.1Very low35.3Very low153 Ų153144.7 Ų144.779%0.78569%0.693SS**  trans-147.472.7147.9-46.7178.3000108
352R34.4Very low34.5Very low314 Ų314150.2 Ų150.2100%1.18571%0.709SS**  trans-81.90132.3-89.6-175.3176.8-178.3-1106.1

Retrieved 352 of 352 residues in 366 ms (Link to these results)