A0A3Q0KIH8_SCHMA Loading...

Ethanolaminephosphotransferase 6

AlphaFold DB , UniProt , Accession A0A3Q0KIH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 380 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
1M66.5Low88.7Confident206 Ų20685.4 Ų85.4100%1.01545%0.445SS*.  0134.80-169172.5-169.400106.4
2H83.3Confident89Confident161 Ų16178.6 Ų78.675%0.74541%0.409SS*.  trans-65.3139.1179.1-74-63.5000111.1E364H2-E364 WeakPolarHBondContact CA-OE1 3.23Å; H2-E364 IonicContact CG-OE1 3.67Å; H2-E364 IonicContact ND1-OE1 3.95Å; H2-E364 PolarHBondContact ND1-OE1 3.32Å; H2-E364 VanDerWaalsContact ND1-OE1 3.08Å
3Q88.1Confident89.1Confident54 Ų5482.5 Ų82.525%0.25242%0.421SS..SBendtrans-86.2-31.6176.6-62.2-62.3-32.400111.5Y357 Q360 E364Q3-Y357 HydrophobicContact CG-CD2 4.29Å; Q3-Y357 HydrophobicContact CG-CE2 4.34Å; Q3-Q360 HydrophobicContact CG-CB 3.92Å; Q3-E364 WeakPolarHBondContact CA-OE2 3.46Å; Q3-E364 WeakPolarHBondContact CB-OE2 3.04Å; Q3-E364 PolarHBondContact N-OE1 3.45Å; Q3-E364 PolarHBondContact N-OE2 3.39Å
4L90.9Very high89Confident14 Ų1485 Ų857%0.07344%0.436CS..  trans-97.6133.5179.2-55.4-177.8000111.9M8 I9 V301 V361 E364 I365L4-M8 HydrophobicContact CB-CB 4.46Å; L4-M8 HydrophobicContact CD2-CB 4.41Å; L4-M8 HydrophobicContact CD2-CE 3.6Å; L4-I9 HydrophobicContact CB-CD1 4.5Å; L4-I9 HydrophobicContact CB-CG1 4.15Å; L4-I9 HydrophobicContact CD1-CG1 4.39Å; L4-V301 HydrophobicContact CD2-CG1 4.15Å; L4-V361 HydrophobicContact CD2-CG2 4.31Å; L4-E364 HydrophobicContact CD1-CB 3.84Å; L4-E364 HydrophobicContact CG-CB 4.11Å; L4-E364 WeakPolarHBondContact CG-OE2 3.49Å; L4-E364 PolarHBondContact N-OE2 3.06Å; L4-I365 HydrophobicContact CD1-CG1 3.73Å
5T92.8Very high89.1Confident76 Ų7681.5 Ų81.547%0.46642%0.416SS..  trans-90.3165.416862.30000111Q7 M8 I9T5-Q7 PolarHBondContact O-N 2.8Å; T5-M8 HydrophobicContact CG2-SD 4.26Å; T5-M8 WeakPolarHBondContact O-CA 3.3Å; T5-M8 WeakPolarHBondContact O-CB 3.34Å; T5-M8 PolarHBondContact O-N 3.48Å; T5-M8 VanDerWaalsContact OG1-CG 3.28Å; T5-M8 WeakPolarHBondContact OG1-CG 3.41Å; T5-M8 PolarHBondContact OG1-N 3.39Å; T5-I9 WeakPolarHBondContact O-CG1 3.26Å; T5-I9 PolarHBondContact O-N 3.49Å
6D91.2Very high89Confident140 Ų14087.8 Ų87.875%0.74944%0.439SS*.Hα-helixtrans-57.4-36.3176.3-64.4-32.3000112.8I9 S10D6-I9 PolarHBondContact O-N 3.15Å; D6-S10 PolarHBondContact O-N 3.32Å
7Q92Very high89Confident134 Ų13488.9 Ų88.963%0.62644%0.438SS*.Hα-helixtrans-63.1-43.4174.4-174.21806.600111.4T5 I9 S10 G11 V307T5-Q7 PolarHBondContact O-N 2.8Å; Q7-I9 VanDerWaalsContact C-N 3.34Å; Q7-S10 PolarHBondContact O-N 2.75Å; Q7-G11 PolarHBondContact O-N 3.01Å; Q7-V307 HydrophobicContact CG-CG1 4.09Å
8M93.9Very high89.1Confident27 Ų2786.7 Ų86.713%0.13343%0.433CS..Hα-helixtrans-64.8-40.2178-70.2168.477.400111.8L4 T5 G11 L12 V301 C305 V307L4-M8 HydrophobicContact CB-CB 4.46Å; L4-M8 HydrophobicContact CD2-CB 4.41Å; L4-M8 HydrophobicContact CD2-CE 3.6Å; T5-M8 HydrophobicContact CG2-SD 4.26Å; T5-M8 WeakPolarHBondContact O-CA 3.3Å; T5-M8 WeakPolarHBondContact O-CB 3.34Å; T5-M8 PolarHBondContact O-N 3.48Å; T5-M8 VanDerWaalsContact OG1-CG 3.28Å; T5-M8 WeakPolarHBondContact OG1-CG 3.41Å; T5-M8 PolarHBondContact OG1-N 3.39Å; M8-G11 PolarHBondContact O-N 3.48Å; M8-L12 VanDerWaalsContact O-CB 3.28Å; M8-L12 WeakPolarHBondContact O-CB 3.29Å; M8-L12 PolarHBondContact O-N 2.86Å; M8-V301 HydrophobicContact CE-CG1 3.5Å; M8-V301 VanDerWaalsContact CE-CG1 3.5Å; M8-C305 HydrophobicContact CB-CB 3.83Å; M8-C305 HydrophobicContact CG-CB 4.01Å; M8-C305 PolarHBondContact O-SG 3.22Å; M8-V307 HydrophobicContact CG-CG1 3.86Å; M8-V307 HydrophobicContact CG-CG2 4.01Å
9I93Very high89.3Confident48 Ų4884.9 Ų84.925%0.24643%0.429CS..Hα-helixtrans-61-44.9175-74.1165.6000111L4 T5 D6 Q7 L12 K13 C368L4-I9 HydrophobicContact CB-CD1 4.5Å; L4-I9 HydrophobicContact CB-CG1 4.15Å; L4-I9 HydrophobicContact CD1-CG1 4.39Å; T5-I9 WeakPolarHBondContact O-CG1 3.26Å; T5-I9 PolarHBondContact O-N 3.49Å; D6-I9 PolarHBondContact O-N 3.15Å; Q7-I9 VanDerWaalsContact C-N 3.34Å; I9-L12 PolarHBondContact O-N 3.33Å; I9-K13 WeakPolarHBondContact O-CG 3.44Å; I9-K13 PolarHBondContact O-N 2.75Å; I9-K13 VanDerWaalsContact O-N 3.16Å; I9-C368 VanDerWaalsContact CG2-SG 3.53Å
10S92Very high89.5Confident69 Ų6983.6 Ų83.648%0.48343%0.425SS..Hα-helixtrans-62.2-44.3177.6-1760000112.1D6 Q7 K13 N14D6-S10 PolarHBondContact O-N 3.32Å; Q7-S10 PolarHBondContact O-N 2.75Å; S10-K13 PolarHBondContact O-N 2.98Å; S10-N14 PolarHBondContact O-ND2 3.39Å
11G91.5Very high89.7Confident10 Ų1081.2 Ų81.210%0.10341%0.413CS..Hα-helixtrans-64.5-42.4176.400000112.7Q7 M8 K13 N14 Y15 C305Q7-G11 PolarHBondContact O-N 3.01Å; M8-G11 PolarHBondContact O-N 3.48Å; G11-K13 VanDerWaalsContact C-N 3.32Å; G11-K13 PolarHBondContact O-N 3.48Å; G11-N14 PolarHBondContact O-N 3.48Å; G11-N14 VanDerWaalsContact O-N 3.08Å; G11-Y15 PolarHBondContact O-N 2.98Å; G11-C305 WeakPolarHBondContact CA-O 3.35Å
12L92.8Very high90.9Very high4 Ų475.4 Ų75.42%0.02139%0.386CS..Hα-helixtrans-58.8-40.4178.8-17772.8000112.6M8 I9 N14 Y15 A112 L304 I365 C368 L369M8-L12 VanDerWaalsContact O-CB 3.28Å; M8-L12 WeakPolarHBondContact O-CB 3.29Å; M8-L12 PolarHBondContact O-N 2.86Å; I9-L12 PolarHBondContact O-N 3.33Å; L12-N14 PolarHBondContact O-N 3.34Å; L12-Y15 WeakPolarHBondContact O-CB 3.27Å; L12-Y15 PolarHBondContact O-N 3.49Å; L12-A112 HydrophobicContact CD1-CB 3.53Å; L12-L304 HydrophobicContact CD1-CB 4.25Å; L12-I365 HydrophobicContact CD1-CG2 4.45Å; L12-I365 HydrophobicContact CD2-CB 4.32Å; L12-I365 HydrophobicContact CD2-CG1 4.02Å; L12-I365 HydrophobicContact CD2-CG2 4Å; L12-C368 HydrophobicContact CD2-CB 4.41Å; L12-L369 HydrophobicContact CD2-CD1 4.4Å; L12-L369 HydrophobicContact CD2-CD2 4.26Å; L12-L369 HydrophobicContact CD2-CG 4.16Å; L12-L369 HydrophobicContact CG-CD1 4.5Å; L12-L369 HydrophobicContact CG-CD2 4.25Å
13K89.8Confident91.4Very high130 Ų13067.9 Ų67.957%0.56535%0.352SS*.Hα-helixtrans-65.2-25.4177.8-73.1178.6179.9-179.20113.4I9 S10 G11I9-K13 WeakPolarHBondContact O-CG 3.44Å; I9-K13 PolarHBondContact O-N 2.75Å; I9-K13 VanDerWaalsContact O-N 3.16Å; S10-K13 PolarHBondContact O-N 2.98Å; G11-K13 VanDerWaalsContact C-N 3.32Å; G11-K13 PolarHBondContact O-N 3.48Å
14N88.2Confident91.7Very high117 Ų11768.6 Ų68.663%0.62636%0.361SS*.THydrogen-bonded Turntrans-96.6-2.3-179.6-67.5-55.7000113.2S10 G11 L12S10-N14 PolarHBondContact O-ND2 3.39Å; G11-N14 PolarHBondContact O-N 3.48Å; G11-N14 VanDerWaalsContact O-N 3.08Å; L12-N14 PolarHBondContact O-N 3.34Å
15Y90.2Very high92Very high33 Ų3370.9 Ų70.913%0.12937%0.371CS..  trans-65.2137-175.2-178.6-99.4000112.2G11 L12 A112 E115 K164 L304 H306G11-Y15 PolarHBondContact O-N 2.98Å; L12-Y15 WeakPolarHBondContact O-CB 3.27Å; L12-Y15 PolarHBondContact O-N 3.49Å; Y15-A112 HydrophobicContact CD1-CB 3.7Å; Y15-A112 HydrophobicContact CE1-CB 4.33Å; Y15-A112 HydrophobicContact CG-CB 4.28Å; Y15-E115 WeakPolarHBondContact CE1-OE2 3.5Å; Y15-E115 PolarHBondContact OH-OE1 2.93Å; Y15-E115 PolarHBondContact OH-OE2 3.35Å; Y15-K164 WeakPolarHBondContact OH-CE 3.37Å; Y15-K164 PolarHBondContact OH-NZ 2.84Å; Y15-L304 HydrophobicContact CD1-CD2 3.97Å; Y15-L304 HydrophobicContact CD2-CD2 4.08Å; Y15-L304 WeakPolarHBondContact CD2-O 3.4Å; Y15-L304 HydrophobicContact CE1-CD2 3.48Å; Y15-L304 VanDerWaalsContact CE1-CD2 3.48Å; Y15-L304 HydrophobicContact CE2-CD2 3.63Å; Y15-L304 HydrophobicContact CG-CD2 4.23Å; Y15-H306 AromaticContact CD2-NE2 3.59Å
16K88.4Confident92.1Very high182 Ų18267.3 Ų67.379%0.79135%0.348SS*.  trans-129126.2171.9-68.3-175.8-179.7179.40109.4
17Y89.2Confident92.3Very high107 Ų10763.2 Ų63.242%0.4233%0.329SS..  trans-63.5137.2176.5-178.3-115.1000111.4C19 E115Y17-C19 HydrophobicContact CE1-CB 3.88Å; Y17-C19 WeakPolarHBondContact CE1-SG 3.27Å; Y17-C19 HydrophobicContact CE2-CB 4.28Å; Y17-C19 WeakPolarHBondContact OH-CB 3.37Å; Y17-C19 PolarHBondContact OH-SG 3.09Å; Y17-E115 HydrophobicContact CD2-CG 4.3Å; Y17-E115 VanDerWaalsContact CD2-OE1 3.27Å; Y17-E115 WeakPolarHBondContact CD2-OE1 3.46Å; Y17-E115 WeakPolarHBondContact CD2-OE2 3.3Å; Y17-E115 VanDerWaalsContact CE2-CD 3.49Å; Y17-E115 HydrophobicContact CE2-CG 4.17Å; Y17-E115 VanDerWaalsContact CE2-OE1 3.23Å; Y17-E115 WeakPolarHBondContact CE2-OE1 3.48Å
18S90.8Very high92.6Very high49 Ų4965.5 Ų65.534%0.34333%0.333SS..  trans-144.7119.8174.7-176.20000109.2T169 L170S18-T169 PolarHBondContact OG-OG1 2.88Å; S18-L170 PolarHBondContact O-N 3.46Å
19C93Very high92.7Very high53 Ų5367.8 Ų67.836%0.35835%0.348SS..EExtended strand (participates in β ladder)trans-137.4153.4174.673.40000111.3Y17 L170Y17-C19 HydrophobicContact CE1-CB 3.88Å; Y17-C19 WeakPolarHBondContact CE1-SG 3.27Å; Y17-C19 HydrophobicContact CE2-CB 4.28Å; Y17-C19 WeakPolarHBondContact OH-CB 3.37Å; Y17-C19 PolarHBondContact OH-SG 3.09Å; C19-L170 CarbonylContact C-O 3.49Å; C19-L170 WeakPolarHBondContact CA-O 3.44Å; C19-L170 HydrophobicContact CB-CB 4.1Å
20V93.2Very high93Very high58 Ų5865.9 Ų65.935%0.35234%0.338SS..EExtended strand (participates in β ladder)trans-128.2120.7173173.70000107.7T169 L170 F171 L172V20-T169 HydrophobicContact CB-CG2 4.35Å; V20-T169 HydrophobicContact CG2-CG2 3.72Å; V20-L170 PolarHBondContact N-O 3.4Å; V20-F171 HydrophobicContact CB-CD1 3.84Å; V20-F171 HydrophobicContact CB-CE1 4Å; V20-F171 HydrophobicContact CG1-CD1 4.11Å; V20-F171 HydrophobicContact CG1-CE1 4.25Å; V20-F171 HydrophobicContact CG2-CD1 4.48Å; V20-F171 HydrophobicContact CG2-CE1 4.16Å; V20-L172 PolarHBondContact O-N 2.88Å
21D92.8Very high93.2Very high34 Ų3464.5 Ų64.518%0.18232%0.324CS..  trans-123.8113.9169.6-179.98.1000108.4S23 S26 H31 L172D21-S23 WeakPolarHBondContact OD1-CB 3.32Å; D21-S23 PolarHBondContact OD1-N 3.12Å; D21-S23 VanDerWaalsContact OD1-N 3.08Å; D21-S26 WeakPolarHBondContact OD2-CB 3.3Å; D21-H31 IonicContact OD2-CD2 3.63Å; D21-H31 IonicContact OD2-CE1 3.73Å; D21-H31 IonicContact OD2-NE2 2.74Å; D21-H31 PolarHBondContact OD2-NE2 3.05Å; D21-L172 HydrophobicContact CB-CB 4.3Å; D21-L172 HydrophobicContact CB-CD1 4.05Å; D21-L172 HydrophobicContact CB-CG 4.47Å
22N91.9Very high93.5Very high84 Ų8467.2 Ų67.245%0.44934%0.34SS..  trans-122.317179.664-19.9000112.1P24 W174N22-P24 WeakPolarHBondContact O-CD 3.47Å; N22-W174 VanDerWaalsContact CG-NE1 3.31Å; N22-W174 PolarHBondContact OD1-NE1 3.39Å
23S93.6Very high93.8Very high3 Ų370 Ų702%0.02135%0.352CS..  trans-63126.8171.2176.10000109.6D21 F25 S26 T27 W174D21-S23 WeakPolarHBondContact OD1-CB 3.32Å; D21-S23 PolarHBondContact OD1-N 3.12Å; D21-S23 VanDerWaalsContact OD1-N 3.08Å; S23-F25 VanDerWaalsContact C-N 3.27Å; S23-F25 PolarHBondContact O-N 3.4Å; S23-S26 WeakPolarHBondContact CB-OG 3.38Å; S23-S26 PolarHBondContact O-N 3.44Å; S23-S26 PolarHBondContact OG-N 2.83Å; S23-S26 PolarHBondContact OG-OG 2.8Å; S23-T27 VanDerWaalsContact O-CB 3.25Å; S23-T27 WeakPolarHBondContact O-CB 3.26Å; S23-T27 PolarHBondContact O-N 2.92Å; S23-T27 PolarHBondContact O-OG1 3.36Å; S23-W174 PolarHBondContact OG-O 3.46Å
24P95.5Very high94.2Very high69 Ų6964.2 Ų64.245%0.44833%0.326SS..Hα-helixtrans-58.7-40.3176.1-26.335.1000112.4N22 Y28N22-P24 WeakPolarHBondContact O-CD 3.47Å; P24-Y28 HydrophobicContact CB-CD2 4.25Å; P24-Y28 HydrophobicContact CB-CE2 4.48Å; P24-Y28 WeakPolarHBondContact O-CB 3.46Å; P24-Y28 WeakPolarHBondContact O-CD2 3.2Å; P24-Y28 PolarHBondContact O-N 3.2Å
25F95.9Very high94.6Very high62 Ų6262.3 Ų62.327%0.27232%0.317SS..Hα-helixtrans-63.9-47.4178.7-179.6-108.2000111.3S23 V29 M30 D177 T178 I181S23-F25 VanDerWaalsContact C-N 3.27Å; S23-F25 PolarHBondContact O-N 3.4Å; F25-V29 HydrophobicContact CD2-CB 4.14Å; F25-V29 HydrophobicContact CD2-CG2 4.07Å; F25-V29 HydrophobicContact CE2-CB 4.07Å; F25-V29 HydrophobicContact CE2-CG1 4.05Å; F25-V29 HydrophobicContact CE2-CG2 4.26Å; F25-V29 HydrophobicContact CZ-CG1 4.5Å; F25-V29 WeakPolarHBondContact O-CA 3.34Å; F25-V29 VanDerWaalsContact O-CB 3.28Å; F25-V29 WeakPolarHBondContact O-CB 3.27Å; F25-V29 PolarHBondContact O-N 3.28Å; F25-M30 HydrophobicContact CD1-CG 3.77Å; F25-M30 HydrophobicContact CD1-SD 4.46Å; F25-M30 HydrophobicContact CE1-CG 3.38Å; F25-M30 HydrophobicContact CE1-SD 3.52Å; F25-M30 VanDerWaalsContact CE1-SD 3.52Å; F25-M30 HydrophobicContact CE2-SD 4.5Å; F25-M30 HydrophobicContact CZ-CG 3.93Å; F25-M30 HydrophobicContact CZ-SD 3.54Å; F25-M30 VanDerWaalsContact CZ-SD 3.54Å; F25-M30 PolarHBondContact O-N 3.04Å; F25-D177 HydrophobicContact CD1-CB 4.06Å; F25-D177 HydrophobicContact CE1-CB 4.22Å; F25-T178 WeakPolarHBondContact CD1-OG1 2.78Å; F25-I181 HydrophobicContact CE1-CG1 4.03Å; F25-I181 HydrophobicContact CZ-CB 4.45Å; F25-I181 HydrophobicContact CZ-CG1 4.11Å; F25-I181 HydrophobicContact CZ-CG2 4.48Å
26S95.5Very high95Very high0 Ų067.2 Ų67.20%034%0.335CS..Iπ-helixtrans-63.8-47.6179-46.60000111.3D21 S23 M30 H31 D177D21-S26 WeakPolarHBondContact OD2-CB 3.3Å; S23-S26 WeakPolarHBondContact CB-OG 3.38Å; S23-S26 PolarHBondContact O-N 3.44Å; S23-S26 PolarHBondContact OG-N 2.83Å; S23-S26 PolarHBondContact OG-OG 2.8Å; S26-M30 PolarHBondContact O-N 3.38Å; S26-H31 VanDerWaalsContact C-CD2 3.49Å; S26-H31 WeakPolarHBondContact O-CB 3.33Å; S26-H31 PolarHBondContact O-CD2 3.09Å; S26-H31 PolarHBondContact O-N 3.28Å; S26-D177 WeakPolarHBondContact CB-OD2 3.46Å; S26-D177 PolarHBondContact OG-OD2 3.2Å
27T96.1Very high95.5Very high54 Ų5460.3 Ų60.333%0.33131%0.307SS..Iπ-helixtrans-63.1-46.6-177.1-57.70000112.7S23 P32S23-T27 VanDerWaalsContact O-CB 3.25Å; S23-T27 WeakPolarHBondContact O-CB 3.26Å; S23-T27 PolarHBondContact O-N 2.92Å; S23-T27 PolarHBondContact O-OG1 3.36Å; T27-P32 WeakPolarHBondContact O-CD 3.5Å
28Y96.7Very high95.9Very high183 Ų18355.4 Ų55.472%0.71829%0.288SS*.Iπ-helixtrans-98.9-17-169.9-62-65.7000114.4P24P24-Y28 HydrophobicContact CB-CD2 4.25Å; P24-Y28 HydrophobicContact CB-CE2 4.48Å; P24-Y28 WeakPolarHBondContact O-CB 3.46Å; P24-Y28 WeakPolarHBondContact O-CD2 3.2Å; P24-Y28 PolarHBondContact O-N 3.2Å
29V97.6Very high96.2Very high75 Ų7560 Ų6046%0.45530%0.302SS..Iπ-helixtrans-118.2-59.3-178.4-174.10000111.2F25 P32 F33F25-V29 HydrophobicContact CD2-CB 4.14Å; F25-V29 HydrophobicContact CD2-CG2 4.07Å; F25-V29 HydrophobicContact CE2-CB 4.07Å; F25-V29 HydrophobicContact CE2-CG1 4.05Å; F25-V29 HydrophobicContact CE2-CG2 4.26Å; F25-V29 HydrophobicContact CZ-CG1 4.5Å; F25-V29 WeakPolarHBondContact O-CA 3.34Å; F25-V29 VanDerWaalsContact O-CB 3.28Å; F25-V29 WeakPolarHBondContact O-CB 3.27Å; F25-V29 PolarHBondContact O-N 3.28Å; V29-P32 WeakPolarHBondContact O-CD 3.48Å; V29-F33 WeakPolarHBondContact O-CB 3.35Å; V29-F33 PolarHBondContact O-N 3.42Å; V29-F33 VanDerWaalsContact O-N 3.16Å
30M97.6Very high96.4Very high8 Ų864 Ų644%0.03931%0.314CS..Iπ-helixtrans-73.2-47.6-169.5-57.9-54.5-63.800113F25 S26 F33 W34 D177 I181F25-M30 HydrophobicContact CD1-CG 3.77Å; F25-M30 HydrophobicContact CD1-SD 4.46Å; F25-M30 HydrophobicContact CE1-CG 3.38Å; F25-M30 HydrophobicContact CE1-SD 3.52Å; F25-M30 VanDerWaalsContact CE1-SD 3.52Å; F25-M30 HydrophobicContact CE2-SD 4.5Å; F25-M30 HydrophobicContact CZ-CG 3.93Å; F25-M30 HydrophobicContact CZ-SD 3.54Å; F25-M30 VanDerWaalsContact CZ-SD 3.54Å; F25-M30 PolarHBondContact O-N 3.04Å; S26-M30 PolarHBondContact O-N 3.38Å; M30-F33 HydrophobicContact CE-CD1 4.4Å; M30-F33 WeakPolarHBondContact O-CB 3.41Å; M30-F33 PolarHBondContact O-N 2.77Å; M30-F33 VanDerWaalsContact O-N 3.13Å; M30-W34 HydrophobicContact CB-CD2 4.07Å; M30-W34 HydrophobicContact CB-CE3 3.91Å; M30-W34 HydrophobicContact CB-CH2 3.64Å; M30-W34 HydrophobicContact CB-CZ2 3.78Å; M30-W34 HydrophobicContact CB-CZ3 3.69Å; M30-W34 HydrophobicContact CE-CH2 4.29Å; M30-W34 HydrophobicContact CE-CZ2 3.39Å; M30-W34 HydrophobicContact CG-CH2 4.31Å; M30-W34 HydrophobicContact CG-CZ2 4.29Å; M30-W34 WeakPolarHBondContact O-CB 3.38Å; M30-W34 VanDerWaalsContact O-CD2 3.3Å; M30-W34 VanDerWaalsContact O-CG 3.27Å; M30-W34 PolarHBondContact O-N 3.26Å; M30-D177 HydrophobicContact CG-CB 4.27Å; M30-I181 HydrophobicContact CE-CD1 3.88Å; M30-I181 HydrophobicContact CE-CG1 4.13Å; M30-I181 HydrophobicContact SD-CD1 4.41Å; M30-I181 HydrophobicContact SD-CG1 4.22Å
31H97Very high96.6Very high40 Ų4062.8 Ų62.819%0.18530%0.303CS..Hα-helixtrans-59.2-45.9178.1-77.3-55.5000112.4D21 S26 W34 N35 K102D21-H31 IonicContact OD2-CD2 3.63Å; D21-H31 IonicContact OD2-CE1 3.73Å; D21-H31 IonicContact OD2-NE2 2.74Å; D21-H31 PolarHBondContact OD2-NE2 3.05Å; S26-H31 VanDerWaalsContact C-CD2 3.49Å; S26-H31 WeakPolarHBondContact O-CB 3.33Å; S26-H31 PolarHBondContact O-CD2 3.09Å; S26-H31 PolarHBondContact O-N 3.28Å; H31-W34 AromaticContact CE1-CZ3 3.98Å; H31-W34 AromaticContact ND1-CE3 3.87Å; H31-N35 WeakPolarHBondContact O-CB 3.21Å; H31-N35 PolarHBondContact O-N 3.08Å; H31-N35 PolarHBondContact O-ND2 3.18Å; H31-K102 PolarHBondContact CE1-NZ 3.22Å; H31-K102 WeakPolarHBondContact ND1-CE 3.46Å; H31-K102 PolarHBondContact ND1-NZ 2.89Å
32P98Very high96.9Very high67 Ų6763.6 Ų63.644%0.43531%0.31SS..Hα-helixtrans-56.9-45.8171.4-29.137.2000113.5T27 V29 N35 W36T27-P32 WeakPolarHBondContact O-CD 3.5Å; V29-P32 WeakPolarHBondContact O-CD 3.48Å; P32-N35 PolarHBondContact O-N 3.31Å; P32-W36 WeakPolarHBondContact O-CB 3.41Å; P32-W36 PolarHBondContact O-N 3.42Å
33F98.2Very high97Very high63 Ų6364.4 Ų64.428%0.27632%0.317SS..Hα-helixtrans-61.1-50.4178169.6-114.5000112.2V29 M30 W36 L37 F91 T95V29-F33 WeakPolarHBondContact O-CB 3.35Å; V29-F33 PolarHBondContact O-N 3.42Å; V29-F33 VanDerWaalsContact O-N 3.16Å; M30-F33 HydrophobicContact CE-CD1 4.4Å; M30-F33 WeakPolarHBondContact O-CB 3.41Å; M30-F33 PolarHBondContact O-N 2.77Å; M30-F33 VanDerWaalsContact O-N 3.13Å; F33-W36 HydrophobicContact CD2-CE3 4.02Å; F33-W36 HydrophobicContact CD2-CZ3 4.24Å; F33-W36 HydrophobicContact CE2-CE3 4.12Å; F33-W36 AromaticContact CE2-CZ3 3.91Å; F33-W36 HydrophobicContact CE2-CZ3 3.91Å; F33-W36 WeakPolarHBondContact O-CB 3.25Å; F33-W36 PolarHBondContact O-N 3.27Å; F33-L37 HydrophobicContact CZ-CD2 4.19Å; F33-L37 WeakPolarHBondContact O-CB 3.46Å; F33-L37 PolarHBondContact O-N 3.41Å; F33-F91 HydrophobicContact CZ-CZ 4.41Å; F33-T95 HydrophobicContact CE1-CG2 3.84Å; F33-T95 HydrophobicContact CZ-CG2 4.2Å
34W98.4Very high97.1Very high7 Ų772.5 Ų72.53%0.02735%0.348CS..Hα-helixtrans-66.4-38.5179.1-62.1-35.5000112.7M30 H31 W36 L37 A38 H94 T99 K102M30-W34 HydrophobicContact CB-CD2 4.07Å; M30-W34 HydrophobicContact CB-CE3 3.91Å; M30-W34 HydrophobicContact CB-CH2 3.64Å; M30-W34 HydrophobicContact CB-CZ2 3.78Å; M30-W34 HydrophobicContact CB-CZ3 3.69Å; M30-W34 HydrophobicContact CE-CH2 4.29Å; M30-W34 HydrophobicContact CE-CZ2 3.39Å; M30-W34 HydrophobicContact CG-CH2 4.31Å; M30-W34 HydrophobicContact CG-CZ2 4.29Å; M30-W34 WeakPolarHBondContact O-CB 3.38Å; M30-W34 VanDerWaalsContact O-CD2 3.3Å; M30-W34 VanDerWaalsContact O-CG 3.27Å; M30-W34 PolarHBondContact O-N 3.26Å; H31-W34 AromaticContact CE1-CZ3 3.98Å; H31-W34 AromaticContact ND1-CE3 3.87Å; W34-W36 VanDerWaalsContact C-N 3.29Å; W34-W36 PolarHBondContact O-N 2.94Å; W34-L37 PolarHBondContact O-N 3.07Å; W34-A38 VanDerWaalsContact O-CB 3.24Å; W34-A38 WeakPolarHBondContact O-CB 3.33Å; W34-A38 PolarHBondContact O-N 2.88Å; W34-H94 AromaticContact CZ2-CE1 3.74Å; W34-H94 AromaticContact CZ2-NE2 3.63Å; W34-T99 HydrophobicContact CB-CG2 3.7Å; W34-T99 HydrophobicContact CG-CG2 3.97Å; W34-K102 HydrophobicContact CB-CG 4.31Å
35N98Very high97.2Very high78 Ų7870.5 Ų70.542%0.41733%0.333SS..Hα-helixtrans-62.9-36.7173.4-80.3-45.2000111.9H31 P32 K39 K102H31-N35 WeakPolarHBondContact O-CB 3.21Å; H31-N35 PolarHBondContact O-N 3.08Å; H31-N35 PolarHBondContact O-ND2 3.18Å; P32-N35 PolarHBondContact O-N 3.31Å; N35-K39 WeakPolarHBondContact O-CG 3.47Å; N35-K102 WeakPolarHBondContact OD1-CD 3.39Å
36W98.3Very high97.3Very high135 Ų13567.7 Ų67.751%0.51132%0.321SS..Hα-helixtrans-67.9-49.6173.7167.481000110.9P32 F33 W34 A38 K39 F40P32-W36 WeakPolarHBondContact O-CB 3.41Å; P32-W36 PolarHBondContact O-N 3.42Å; F33-W36 HydrophobicContact CD2-CE3 4.02Å; F33-W36 HydrophobicContact CD2-CZ3 4.24Å; F33-W36 HydrophobicContact CE2-CE3 4.12Å; F33-W36 AromaticContact CE2-CZ3 3.91Å; F33-W36 HydrophobicContact CE2-CZ3 3.91Å; F33-W36 WeakPolarHBondContact O-CB 3.25Å; F33-W36 PolarHBondContact O-N 3.27Å; W34-W36 VanDerWaalsContact C-N 3.29Å; W34-W36 PolarHBondContact O-N 2.94Å; W36-A38 PolarHBondContact O-N 2.89Å; W36-K39 WeakPolarHBondContact O-CB 3.28Å; W36-K39 PolarHBondContact O-N 3.49Å; W36-F40 HydrophobicContact CD2-CE2 4.12Å; W36-F40 AromaticContact CE2-CE2 3.58Å; W36-F40 HydrophobicContact CG-CE2 4.48Å; W36-F40 HydrophobicContact CH2-CE2 4.48Å; W36-F40 AromaticContact CZ2-CE2 3.79Å; W36-F40 HydrophobicContact CZ2-CE2 3.79Å; W36-F40 HydrophobicContact CZ2-CZ 4.26Å; W36-F40 AromaticContact NE1-CE2 3.64Å
37L98.2Very high97.4Very high38 Ų3868.2 Ų68.220%0.19933%0.325CS..Hα-helixtrans-64.6-43-176.2-175.360000112.7F33 W34 K39 F40 Y41 T95 T99F33-L37 HydrophobicContact CZ-CD2 4.19Å; F33-L37 WeakPolarHBondContact O-CB 3.46Å; F33-L37 PolarHBondContact O-N 3.41Å; W34-L37 PolarHBondContact O-N 3.07Å; L37-K39 PolarHBondContact O-N 3.09Å; L37-F40 PolarHBondContact O-N 3.41Å; L37-Y41 HydrophobicContact CG-CE1 4.36Å; L37-T95 HydrophobicContact CD2-CG2 3.3Å; L37-T99 HydrophobicContact CB-CG2 4.38Å; L37-T99 HydrophobicContact CD2-CG2 4.21Å
38A97.5Very high97.5Very high4 Ų466.2 Ų66.23%0.03331%0.312CS..G310 helixtrans-61.6-17.3-17900000113.6W34 W36 F40 Y41 K102 R106W34-A38 VanDerWaalsContact O-CB 3.24Å; W34-A38 WeakPolarHBondContact O-CB 3.33Å; W34-A38 PolarHBondContact O-N 2.88Å; W36-A38 PolarHBondContact O-N 2.89Å; A38-F40 VanDerWaalsContact C-N 3.25Å; A38-F40 PolarHBondContact O-N 2.98Å; A38-Y41 HydrophobicContact CB-CD2 4.45Å; A38-Y41 PolarHBondContact O-N 2.82Å; A38-K102 HydrophobicContact CB-CB 3.79Å; A38-R106 PolarHBondContact O-NE 3.4Å; A38-R106 VanDerWaalsContact O-NE 3.16Å; A38-R106 PolarHBondContact O-NH2 3.2Å
39K97.3Very high97.6Very high146 Ų14660 Ų6064%0.63529%0.291SS*.G310 helixtrans-66.3-28.2173.2-66.4171.6-175.6-179.80112.5N35 W36 L37N35-K39 WeakPolarHBondContact O-CG 3.47Å; W36-K39 WeakPolarHBondContact O-CB 3.28Å; W36-K39 PolarHBondContact O-N 3.49Å; L37-K39 PolarHBondContact O-N 3.09Å
40F97.8Very high97.7Very high137 Ų13756.7 Ų56.760%0.60127%0.271SS*.G310 helixtrans-84.7-11.1-179.5-61.8-79.5000113.1W36 L37 A38W36-F40 HydrophobicContact CD2-CE2 4.12Å; W36-F40 AromaticContact CE2-CE2 3.58Å; W36-F40 HydrophobicContact CG-CE2 4.48Å; W36-F40 HydrophobicContact CH2-CE2 4.48Å; W36-F40 AromaticContact CZ2-CE2 3.79Å; W36-F40 HydrophobicContact CZ2-CE2 3.79Å; W36-F40 HydrophobicContact CZ2-CZ 4.26Å; W36-F40 AromaticContact NE1-CE2 3.64Å; L37-F40 PolarHBondContact O-N 3.41Å; A38-F40 VanDerWaalsContact C-N 3.25Å; A38-F40 PolarHBondContact O-N 2.98Å
41Y97.8Very high97.7Very high32 Ų3256.6 Ų56.613%0.12527%0.271CS..SBendtrans-66.3137.1176-68.4-8.9000110.3L37 A38 L45 I50 L96 T99 Q103 R106L37-Y41 HydrophobicContact CG-CE1 4.36Å; A38-Y41 HydrophobicContact CB-CD2 4.45Å; A38-Y41 PolarHBondContact O-N 2.82Å; Y41-L45 HydrophobicContact CD1-CD2 4.49Å; Y41-L45 HydrophobicContact CD2-CD2 4.35Å; Y41-L45 HydrophobicContact CG-CD2 4.11Å; Y41-I50 HydrophobicContact CD2-CD1 3.58Å; Y41-I50 HydrophobicContact CE2-CD1 3.63Å; Y41-I50 HydrophobicContact CE2-CG1 4.43Å; Y41-L96 WeakPolarHBondContact OH-CD2 3.3Å; Y41-T99 HydrophobicContact CE2-CG2 4.39Å; Y41-T99 WeakPolarHBondContact CE2-OG1 3.29Å; Y41-T99 PolarHBondContact OH-OG1 3.16Å; Y41-Q103 HydrophobicContact CD2-CB 4.27Å; Y41-Q103 HydrophobicContact CD2-CG 4.47Å; Y41-R106 PolarHBondContact O-NH2 3.36Å
42P97.2Very high97.8Very high51 Ų5158.1 Ų58.133%0.33128%0.277SS..  trans-66.4147.9174.425.9-29.4000109.9W44 L45 Q103P42-W44 HydrophobicContact CB-CD2 4.35Å; P42-W44 HydrophobicContact CB-CG 4.28Å; P42-W44 HydrophobicContact CB-CZ2 4.32Å; P42-W44 VanDerWaalsContact CB-NE1 3.33Å; P42-W44 HydrophobicContact CG-CD2 4.22Å; P42-W44 HydrophobicContact CG-CH2 4.4Å; P42-W44 HydrophobicContact CG-CZ2 3.67Å; P42-W44 PolarHBondContact O-N 3.24Å; P42-L45 HydrophobicContact CG-CB 3.97Å; P42-L45 WeakPolarHBondContact O-CB 3.28Å; P42-L45 PolarHBondContact O-N 3.12Å; P42-L45 VanDerWaalsContact O-N 3.11Å; P42-Q103 PolarHBondContact O-NE2 2.94Å; P42-Q103 VanDerWaalsContact O-NE2 3.11Å
43V95.3Very high97.8Very high100 Ų10057.8 Ų57.861%0.60627%0.274SS*.THydrogen-bonded Turntrans-68.7-12.9-175.8-65.20000113.9I376V43-I376 WeakPolarHBondContact O-CD1 3.44Å
44W95.9Very high97.8Very high173 Ų17355 Ų5566%0.65526%0.263SS*.THydrogen-bonded Turntrans-85.4-15.5174.761-105.8000113.1P42 A46P42-W44 HydrophobicContact CB-CD2 4.35Å; P42-W44 HydrophobicContact CB-CG 4.28Å; P42-W44 HydrophobicContact CB-CZ2 4.32Å; P42-W44 VanDerWaalsContact CB-NE1 3.33Å; P42-W44 HydrophobicContact CG-CD2 4.22Å; P42-W44 HydrophobicContact CG-CH2 4.4Å; P42-W44 HydrophobicContact CG-CZ2 3.67Å; P42-W44 PolarHBondContact O-N 3.24Å; W44-A46 PolarHBondContact O-N 3.07Å; W44-A46 VanDerWaalsContact O-N 3.17Å
45L97.5Very high97.9Very high27 Ų2755.7 Ų55.714%0.14127%0.266CS..  trans-71.9110.4-176.5179.860.3000110Y41 P42 L49 I50 Q103Y41-L45 HydrophobicContact CD1-CD2 4.49Å; Y41-L45 HydrophobicContact CD2-CD2 4.35Å; Y41-L45 HydrophobicContact CG-CD2 4.11Å; P42-L45 HydrophobicContact CG-CB 3.97Å; P42-L45 WeakPolarHBondContact O-CB 3.28Å; P42-L45 PolarHBondContact O-N 3.12Å; P42-L45 VanDerWaalsContact O-N 3.11Å; L45-L49 HydrophobicContact CD1-CB 4.35Å; L45-L49 HydrophobicContact CD1-CD2 3.87Å; L45-L49 HydrophobicContact CD1-CG 4.19Å; L45-I50 HydrophobicContact CD1-CG1 4.18Å; L45-I50 HydrophobicContact CD2-CD1 3.82Å; L45-I50 HydrophobicContact CD2-CG1 3.67Å; L45-I50 HydrophobicContact CG-CD1 3.92Å; L45-I50 HydrophobicContact CG-CG1 3.72Å; L45-Q103 PolarHBondContact O-NE2 3.45Å
46A97.7Very high97.9Very high3 Ų355.6 Ų55.63%0.02527%0.265CS..  trans-69.1139179.100000111.4W44 N48 L49 I50 F374 I376W44-A46 PolarHBondContact O-N 3.07Å; W44-A46 VanDerWaalsContact O-N 3.17Å; A46-N48 PolarHBondContact O-N 3.33Å; A46-L49 HydrophobicContact CB-CB 4.35Å; A46-L49 WeakPolarHBondContact O-CB 3.48Å; A46-L49 PolarHBondContact O-N 3.2Å; A46-L49 VanDerWaalsContact O-N 3.08Å; A46-I50 PolarHBondContact O-N 2.87Å; A46-F374 VanDerWaalsContact CB-C 3.42Å; A46-I376 HydrophobicContact CB-CG1 4.41Å
47P98Very high97.9Very high12 Ų1251 Ų518%0.07825%0.25CS..Hα-helixtrans-52.7-48.8176.5-2835.5000113.4L49 I50 T51 Q103 A104 S109P47-L49 PolarHBondContact O-N 3.41Å; P47-L49 VanDerWaalsContact O-N 3.1Å; P47-I50 WeakPolarHBondContact O-CA 3.5Å; P47-I50 VanDerWaalsContact O-CB 3.22Å; P47-I50 WeakPolarHBondContact O-CB 3.37Å; P47-I50 PolarHBondContact O-N 3.41Å; P47-T51 PolarHBondContact O-N 2.82Å; P47-T51 PolarHBondContact O-OG1 3.12Å; P47-T51 VanDerWaalsContact O-OG1 3.12Å; P47-Q103 HydrophobicContact CG-CG 4.2Å; P47-A104 HydrophobicContact CB-CB 3.96Å; P47-A104 VanDerWaalsContact CG-CA 3.47Å; P47-A104 HydrophobicContact CG-CB 3.53Å; P47-S109 WeakPolarHBondContact CG-OG 3.36Å
48N98.2Very high97.9Very high11 Ų1149.4 Ų49.46%0.05924%0.243CC..Hα-helixtrans-64-23.4-178.5-53.8-8.2000112.9A46 F52 G114 F117 V373 F374A46-N48 PolarHBondContact O-N 3.33Å; N48-F52 WeakPolarHBondContact O-CB 3.41Å; N48-F52 PolarHBondContact O-N 3.26Å; N48-G114 VanDerWaalsContact OD1-CA 3.25Å; N48-G114 WeakPolarHBondContact OD1-CA 3.36Å; N48-F117 HydrophobicContact CB-CD1 4.08Å; N48-F117 HydrophobicContact CB-CD2 4.42Å; N48-F117 HydrophobicContact CB-CE1 4.37Å; N48-F117 HydrophobicContact CB-CG 4.11Å; N48-F117 WeakPolarHBondContact O-CE1 3.44Å; N48-V373 HydrophobicContact CB-CG1 4.49Å; N48-V373 WeakPolarHBondContact CB-O 3.43Å; N48-V373 PolarHBondContact ND2-O 3.36Å; N48-F374 HydrophobicContact CB-CD1 4.28Å; N48-F374 HydrophobicContact CB-CE1 4.33Å
49L98.4Very high98Very high52 Ų5250.8 Ų50.827%0.27225%0.251SS..Hα-helixtrans-73.4-34.9173.8-177.958.4000111.2L45 A46 P47 T53 F374L45-L49 HydrophobicContact CD1-CB 4.35Å; L45-L49 HydrophobicContact CD1-CD2 3.87Å; L45-L49 HydrophobicContact CD1-CG 4.19Å; A46-L49 HydrophobicContact CB-CB 4.35Å; A46-L49 WeakPolarHBondContact O-CB 3.48Å; A46-L49 PolarHBondContact O-N 3.2Å; A46-L49 VanDerWaalsContact O-N 3.08Å; P47-L49 PolarHBondContact O-N 3.41Å; P47-L49 VanDerWaalsContact O-N 3.1Å; L49-T53 WeakPolarHBondContact O-CB 3.43Å; L49-T53 PolarHBondContact O-N 2.66Å; L49-T53 PolarHBondContact O-OG1 3.08Å; L49-F374 HydrophobicContact CB-CD1 4.12Å; L49-F374 HydrophobicContact CD1-CD1 4.35Å
50I98.6Very high98.1Very high6 Ų647.3 Ų47.33%0.03124%0.241CC..Hα-helixtrans-61.8-53.6171.5-63.4167.3000109Y41 L45 A46 P47 F52 T53 G54 L96 D100 Q103Y41-I50 HydrophobicContact CD2-CD1 3.58Å; Y41-I50 HydrophobicContact CE2-CD1 3.63Å; Y41-I50 HydrophobicContact CE2-CG1 4.43Å; L45-I50 HydrophobicContact CD1-CG1 4.18Å; L45-I50 HydrophobicContact CD2-CD1 3.82Å; L45-I50 HydrophobicContact CD2-CG1 3.67Å; L45-I50 HydrophobicContact CG-CD1 3.92Å; L45-I50 HydrophobicContact CG-CG1 3.72Å; A46-I50 PolarHBondContact O-N 2.87Å; P47-I50 WeakPolarHBondContact O-CA 3.5Å; P47-I50 VanDerWaalsContact O-CB 3.22Å; P47-I50 WeakPolarHBondContact O-CB 3.37Å; P47-I50 PolarHBondContact O-N 3.41Å; I50-F52 PolarHBondContact O-N 2.76Å; I50-T53 WeakPolarHBondContact O-CB 3.25Å; I50-T53 PolarHBondContact O-N 3.26Å; I50-G54 PolarHBondContact O-N 3.47Å; I50-L96 HydrophobicContact CG2-CB 3.71Å; I50-L96 HydrophobicContact CG2-CD2 4.01Å; I50-L96 HydrophobicContact CG2-CG 4.35Å; I50-L96 VanDerWaalsContact CG2-O 3.23Å; I50-L96 WeakPolarHBondContact CG2-O 3.5Å; I50-D100 HydrophobicContact CB-CB 4.17Å; I50-D100 HydrophobicContact CG2-CB 3.99Å; I50-Q103 HydrophobicContact CD1-CB 3.78Å; I50-Q103 HydrophobicContact CD1-CG 3.68Å
51T98.5Very high98.1Very high7 Ų740.8 Ų40.84%0.04321%0.213CC..Hα-helixtrans-54.8-50.6177.2-430000111.6P47 T53 G54 F55 D100 F117 D118 C121P47-T51 PolarHBondContact O-N 2.82Å; P47-T51 PolarHBondContact O-OG1 3.12Å; P47-T51 VanDerWaalsContact O-OG1 3.12Å; T51-T53 VanDerWaalsContact C-N 3.31Å; T51-T53 PolarHBondContact O-N 3.45Å; T51-G54 PolarHBondContact O-N 3.35Å; T51-F55 WeakPolarHBondContact O-CB 3.33Å; T51-F55 PolarHBondContact O-N 3.21Å; T51-D100 PolarHBondContact OG1-OD2 3.42Å; T51-F117 HydrophobicContact CG2-CD1 3.81Å; T51-F117 HydrophobicContact CG2-CE1 4.3Å; T51-D118 HydrophobicContact CG2-CB 4.14Å; T51-C121 HydrophobicContact CG2-CB 4.44Å
52F98.6Very high98.1Very high71 Ų7139.7 Ų39.731%0.31121%0.209SC..Hα-helixtrans-63.1-38.6-178.9-171.3-120.1000112.1N48 I50 F55 L56 F117 F374N48-F52 WeakPolarHBondContact O-CB 3.41Å; N48-F52 PolarHBondContact O-N 3.26Å; I50-F52 PolarHBondContact O-N 2.76Å; F52-F55 HydrophobicContact CD2-CD1 4.27Å; F52-F55 HydrophobicContact CE2-CD1 4.27Å; F52-F55 PolarHBondContact O-N 3.32Å; F52-L56 HydrophobicContact CD1-CD1 4.04Å; F52-L56 HydrophobicContact CD1-CG 4.49Å; F52-L56 HydrophobicContact CE1-CD1 3.64Å; F52-L56 HydrophobicContact CE1-CG 4.2Å; F52-L56 HydrophobicContact CE2-CD2 4.38Å; F52-L56 HydrophobicContact CE2-CG 4.41Å; F52-L56 HydrophobicContact CZ-CD1 4.01Å; F52-L56 HydrophobicContact CZ-CD2 4.12Å; F52-L56 HydrophobicContact CZ-CG 4.15Å; F52-L56 WeakPolarHBondContact O-CG 3.38Å; F52-L56 PolarHBondContact O-N 2.84Å; F52-F117 HydrophobicContact CB-CE1 3.72Å; F52-F117 HydrophobicContact CB-CZ 3.91Å; F52-F117 HydrophobicContact CD2-CE1 4.21Å; F52-F117 AromaticContact CD2-CZ 3.89Å; F52-F117 HydrophobicContact CD2-CZ 3.89Å; F52-F117 HydrophobicContact CG-CE1 4.4Å; F52-F117 HydrophobicContact CG-CZ 4.18Å; F52-F374 HydrophobicContact CB-CE1 3.94Å; F52-F374 HydrophobicContact CB-CZ 4.46Å; F52-F374 HydrophobicContact CD1-CE1 4.42Å; F52-F374 HydrophobicContact CD1-CZ 4.29Å; F52-F374 HydrophobicContact CG-CE1 4.21Å; F52-F374 HydrophobicContact CG-CZ 4.24Å
53T98.7Very high98.2Very high61 Ų6141.8 Ų41.837%0.37422%0.216SC..Hα-helixtrans-62.5-49.3174.8-58.30000110.1L49 I50 T51 F55 L56 L57 L96L49-T53 WeakPolarHBondContact O-CB 3.43Å; L49-T53 PolarHBondContact O-N 2.66Å; L49-T53 PolarHBondContact O-OG1 3.08Å; I50-T53 WeakPolarHBondContact O-CB 3.25Å; I50-T53 PolarHBondContact O-N 3.26Å; T51-T53 VanDerWaalsContact C-N 3.31Å; T51-T53 PolarHBondContact O-N 3.45Å; T53-F55 VanDerWaalsContact C-N 3.35Å; T53-F55 PolarHBondContact O-N 3.48Å; T53-L56 PolarHBondContact O-N 3.16Å; T53-L57 WeakPolarHBondContact O-CG 3.17Å; T53-L57 PolarHBondContact O-N 3.01Å; T53-L57 VanDerWaalsContact O-N 3.09Å; T53-L96 HydrophobicContact CG2-CD1 3.9Å
54G98.7Very high98.3Very high5 Ų538.8 Ų38.85%0.05220%0.197CC..Hα-helixtrans-55.8-47.9175.600000112.3I50 T51 L56 L57 T58 A93I50-G54 PolarHBondContact O-N 3.47Å; T51-G54 PolarHBondContact O-N 3.35Å; G54-L56 PolarHBondContact O-N 3.41Å; G54-L57 WeakPolarHBondContact O-CB 3.47Å; G54-L57 PolarHBondContact O-N 3.21Å; G54-L57 VanDerWaalsContact O-N 3.1Å; G54-T58 PolarHBondContact O-N 3.07Å; G54-T58 VanDerWaalsContact O-N 3.15Å; G54-A93 WeakPolarHBondContact O-CB 3.44Å
55F98.6Very high98.4Very high20 Ų2030.5 Ų30.59%0.08817%0.165CC..Hα-helixtrans-54-48.2174.2172.8-99.5000112.4T51 F52 T53 L57 T58 V59 C121 W124 V125 F128T51-F55 WeakPolarHBondContact O-CB 3.33Å; T51-F55 PolarHBondContact O-N 3.21Å; F52-F55 HydrophobicContact CD2-CD1 4.27Å; F52-F55 HydrophobicContact CE2-CD1 4.27Å; F52-F55 PolarHBondContact O-N 3.32Å; T53-F55 VanDerWaalsContact C-N 3.35Å; T53-F55 PolarHBondContact O-N 3.48Å; F55-L57 VanDerWaalsContact C-N 3.3Å; F55-L57 PolarHBondContact O-N 3.16Å; F55-T58 WeakPolarHBondContact O-CA 3.31Å; F55-T58 WeakPolarHBondContact O-CB 3.38Å; F55-T58 PolarHBondContact O-N 2.92Å; F55-T58 PolarHBondContact O-OG1 3.38Å; F55-V59 HydrophobicContact CD1-CG2 4.33Å; F55-V59 HydrophobicContact CE1-CG2 3.73Å; F55-V59 HydrophobicContact CE2-CG2 4.22Å; F55-V59 HydrophobicContact CZ-CG2 3.64Å; F55-V59 PolarHBondContact O-N 3.4Å; F55-V59 VanDerWaalsContact O-N 3.08Å; F55-C121 HydrophobicContact CB-CB 4.02Å; F55-C121 HydrophobicContact CD2-CB 3.67Å; F55-C121 HydrophobicContact CG-CB 4.03Å; F55-W124 HydrophobicContact CE1-CE3 4.42Å; F55-W124 HydrophobicContact CE1-CZ3 4.49Å; F55-W124 HydrophobicContact CE2-CB 3.9Å; F55-W124 HydrophobicContact CE2-CD2 4.43Å; F55-W124 AromaticContact CE2-CE3 3.65Å; F55-W124 HydrophobicContact CE2-CE3 3.65Å; F55-W124 HydrophobicContact CE2-CZ3 4.48Å; F55-W124 HydrophobicContact CZ-CD2 4.37Å; F55-W124 AromaticContact CZ-CE3 3.31Å; F55-W124 HydrophobicContact CZ-CE3 3.31Å; F55-W124 AromaticContact CZ-CZ3 3.71Å; F55-W124 HydrophobicContact CZ-CZ3 3.71Å; F55-V125 HydrophobicContact CD2-CG2 4.35Å; F55-F128 AromaticContact CE2-CE2 3.68Å; F55-F128 HydrophobicContact CE2-CE2 3.68Å; F55-F128 AromaticContact CZ-CE2 3.95Å; F55-F128 HydrophobicContact CZ-CE2 3.95Å
56L98.7Very high98.4Very high77 Ų7730.5 Ų30.540%0.40317%0.167SC..Hα-helixtrans-63.7-32.3178.2-70179000113.2F52 T53 G54 T58 V59 T60F52-L56 HydrophobicContact CD1-CD1 4.04Å; F52-L56 HydrophobicContact CD1-CG 4.49Å; F52-L56 HydrophobicContact CE1-CD1 3.64Å; F52-L56 HydrophobicContact CE1-CG 4.2Å; F52-L56 HydrophobicContact CE2-CD2 4.38Å; F52-L56 HydrophobicContact CE2-CG 4.41Å; F52-L56 HydrophobicContact CZ-CD1 4.01Å; F52-L56 HydrophobicContact CZ-CD2 4.12Å; F52-L56 HydrophobicContact CZ-CG 4.15Å; F52-L56 WeakPolarHBondContact O-CG 3.38Å; F52-L56 PolarHBondContact O-N 2.84Å; T53-L56 PolarHBondContact O-N 3.16Å; G54-L56 PolarHBondContact O-N 3.41Å; L56-T58 VanDerWaalsContact C-N 3.28Å; L56-T58 PolarHBondContact O-N 2.93Å; L56-V59 PolarHBondContact O-N 3.05Å; L56-T60 WeakPolarHBondContact O-CB 3.49Å; L56-T60 PolarHBondContact O-N 3.32Å; L56-T60 PolarHBondContact O-OG1 2.65Å
57L98.8Very high98.3Very high37 Ų3735.2 Ų35.219%0.19420%0.199CC..Hα-helixtrans-64.1-36.6172.3-58.5-178.9000111.1T53 G54 F55 T60 H61 L89 I92 A93 L96T53-L57 WeakPolarHBondContact O-CG 3.17Å; T53-L57 PolarHBondContact O-N 3.01Å; T53-L57 VanDerWaalsContact O-N 3.09Å; G54-L57 WeakPolarHBondContact O-CB 3.47Å; G54-L57 PolarHBondContact O-N 3.21Å; G54-L57 VanDerWaalsContact O-N 3.1Å; F55-L57 VanDerWaalsContact C-N 3.3Å; F55-L57 PolarHBondContact O-N 3.16Å; L57-T60 WeakPolarHBondContact O-CB 3.36Å; L57-T60 PolarHBondContact O-N 2.96Å; L57-H61 PolarHBondContact O-CD2 3.36Å; L57-H61 PolarHBondContact O-N 3.4Å; L57-H61 VanDerWaalsContact O-N 3.09Å; L57-L89 HydrophobicContact CB-CD2 4.06Å; L57-L89 HydrophobicContact CD2-CD2 3.7Å; L57-L89 HydrophobicContact CG-CD2 4.29Å; L57-I92 HydrophobicContact CD1-CB 3.92Å; L57-I92 HydrophobicContact CD1-CG2 3.43Å; L57-I92 VanDerWaalsContact CD1-CG2 3.43Å; L57-A93 HydrophobicContact CB-CB 4.23Å; L57-L96 HydrophobicContact CD1-CD1 4.2Å
58T98.7Very high98.3Very high6 Ų638.5 Ų38.54%0.03721%0.21CC..Hα-helixtrans-67.3-42.6176.572.20000113G54 F55 L56 T60 H61 Y62 A93 V125 F128G54-T58 PolarHBondContact O-N 3.07Å; G54-T58 VanDerWaalsContact O-N 3.15Å; F55-T58 WeakPolarHBondContact O-CA 3.31Å; F55-T58 WeakPolarHBondContact O-CB 3.38Å; F55-T58 PolarHBondContact O-N 2.92Å; F55-T58 PolarHBondContact O-OG1 3.38Å; L56-T58 VanDerWaalsContact C-N 3.28Å; L56-T58 PolarHBondContact O-N 2.93Å; T58-T60 VanDerWaalsContact C-N 3.27Å; T58-T60 PolarHBondContact O-N 3.33Å; T58-H61 VanDerWaalsContact CA-CD2 3.41Å; T58-H61 WeakPolarHBondContact CA-CD2 3.2Å; T58-H61 VanDerWaalsContact CA-NE2 3.32Å; T58-H61 WeakPolarHBondContact CA-NE2 3.47Å; T58-H61 PolarHBondContact O-CD2 2.98Å; T58-H61 PolarHBondContact O-CE1 2.94Å; T58-H61 PolarHBondContact O-ND1 3.39Å; T58-H61 PolarHBondContact O-NE2 2.79Å; T58-Y62 WeakPolarHBondContact O-CB 3.34Å; T58-Y62 PolarHBondContact O-N 2.73Å; T58-A93 HydrophobicContact CG2-CB 3.54Å; T58-V125 HydrophobicContact CG2-CG1 4.01Å; T58-V125 HydrophobicContact CG2-CG2 3.92Å; T58-F128 WeakPolarHBondContact OG1-CD2 3.23Å
59V98.6Very high98.2Very high33 Ų3338 Ų3820%0.221%0.208CC..Hα-helixtrans-58.2-43.9172.1175.60000110F55 L56 Y62 L63 F128F55-V59 HydrophobicContact CD1-CG2 4.33Å; F55-V59 HydrophobicContact CE1-CG2 3.73Å; F55-V59 HydrophobicContact CE2-CG2 4.22Å; F55-V59 HydrophobicContact CZ-CG2 3.64Å; F55-V59 PolarHBondContact O-N 3.4Å; F55-V59 VanDerWaalsContact O-N 3.08Å; L56-V59 PolarHBondContact O-N 3.05Å; V59-Y62 PolarHBondContact O-N 3.08Å; V59-L63 HydrophobicContact CG1-CD1 3.77Å; V59-L63 HydrophobicContact CG1-CG 4.14Å; V59-L63 WeakPolarHBondContact O-CB 3.41Å; V59-L63 WeakPolarHBondContact O-CG 3.49Å; V59-L63 PolarHBondContact O-N 3.5Å; V59-F128 HydrophobicContact CG2-CD2 4.12Å; V59-F128 HydrophobicContact CG2-CE2 3.47Å; V59-F128 VanDerWaalsContact CG2-CE2 3.47Å; V59-F128 HydrophobicContact CG2-CZ 3.92Å
60T98.7Very high98Very high72 Ų7239.1 Ų39.144%0.44222%0.218SC..Hα-helixtrans-62.1-49.5-176.7-60.10000111.9L56 L57 T58 Y62 L63 L64 L89L56-T60 WeakPolarHBondContact O-CB 3.49Å; L56-T60 PolarHBondContact O-N 3.32Å; L56-T60 PolarHBondContact O-OG1 2.65Å; L57-T60 WeakPolarHBondContact O-CB 3.36Å; L57-T60 PolarHBondContact O-N 2.96Å; T58-T60 VanDerWaalsContact C-N 3.27Å; T58-T60 PolarHBondContact O-N 3.33Å; T60-Y62 VanDerWaalsContact C-N 3.29Å; T60-Y62 PolarHBondContact O-N 2.96Å; T60-L63 PolarHBondContact O-N 3.49Å; T60-L64 VanDerWaalsContact O-CB 3.31Å; T60-L64 WeakPolarHBondContact O-CB 3.21Å; T60-L64 PolarHBondContact O-N 2.84Å; T60-L89 HydrophobicContact CG2-CD1 3.94Å
61H98.3Very high97.7Very high1 Ų142.2 Ų42.21%0.00524%0.237CC..Hα-helixtrans-66.9-33.9179.971.665.6000112.2L57 T58 L65 T86 L89 S132L57-H61 PolarHBondContact O-CD2 3.36Å; L57-H61 PolarHBondContact O-N 3.4Å; L57-H61 VanDerWaalsContact O-N 3.09Å; T58-H61 VanDerWaalsContact CA-CD2 3.41Å; T58-H61 WeakPolarHBondContact CA-CD2 3.2Å; T58-H61 VanDerWaalsContact CA-NE2 3.32Å; T58-H61 WeakPolarHBondContact CA-NE2 3.47Å; T58-H61 PolarHBondContact O-CD2 2.98Å; T58-H61 PolarHBondContact O-CE1 2.94Å; T58-H61 PolarHBondContact O-ND1 3.39Å; T58-H61 PolarHBondContact O-NE2 2.79Å; H61-L65 WeakPolarHBondContact O-CG 3.49Å; H61-L65 PolarHBondContact O-N 3.18Å; H61-L65 VanDerWaalsContact O-N 3.16Å; H61-T86 HydrophobicContact CB-CG2 3.9Å; H61-L89 HydrophobicContact CB-CB 4.06Å; H61-L89 HydrophobicContact CB-CD1 3.73Å; H61-S132 PolarHBondContact CE1-OG 3.24Å; H61-S132 PolarHBondContact ND1-OG 3.27Å
62Y98.5Very high97.6Very high9 Ų942 Ų424%0.03524%0.236CC..Hα-helixtrans-65.7-49.1176.8174.4-99.1000111.2T58 V59 T60 L64 L65 C66 F128 F286T58-Y62 WeakPolarHBondContact O-CB 3.34Å; T58-Y62 PolarHBondContact O-N 2.73Å; V59-Y62 PolarHBondContact O-N 3.08Å; T60-Y62 VanDerWaalsContact C-N 3.29Å; T60-Y62 PolarHBondContact O-N 2.96Å; Y62-L64 VanDerWaalsContact C-N 3.34Å; Y62-L64 PolarHBondContact O-N 2.81Å; Y62-L65 PolarHBondContact O-N 3.33Å; Y62-C66 VanDerWaalsContact CE1-SG 3.56Å; Y62-C66 VanDerWaalsContact CZ-SG 3.54Å; Y62-C66 PolarHBondContact O-N 3.02Å; Y62-C66 PolarHBondContact O-SG 2.55Å; Y62-F128 AromaticContact CD1-CD1 3.73Å; Y62-F128 HydrophobicContact CD1-CD1 3.73Å; Y62-F128 HydrophobicContact CD1-CE1 4.17Å; Y62-F128 HydrophobicContact CD2-CB 4.39Å; Y62-F128 HydrophobicContact CD2-CD1 4.15Å; Y62-F128 HydrophobicContact CE1-CD1 4.24Å; Y62-F128 HydrophobicContact CE1-CE1 4.49Å; Y62-F128 HydrophobicContact CG-CB 4.21Å; Y62-F128 AromaticContact CG-CD1 3.69Å; Y62-F128 HydrophobicContact CG-CD1 3.69Å; Y62-F128 HydrophobicContact CG-CG 4.27Å; Y62-F286 AromaticContact CE1-CD2 3.86Å; Y62-F286 HydrophobicContact CE1-CD2 3.86Å; Y62-F286 HydrophobicContact CE1-CE2 4.07Å
63L98.3Very high97.4Very high94 Ų9442.3 Ų42.349%0.49224%0.237SC..Hα-helixtrans-63.3-40.5178.4-68.8-179000112V59 T60 L65 C66 C67V59-L63 HydrophobicContact CG1-CD1 3.77Å; V59-L63 HydrophobicContact CG1-CG 4.14Å; V59-L63 WeakPolarHBondContact O-CB 3.41Å; V59-L63 WeakPolarHBondContact O-CG 3.49Å; V59-L63 PolarHBondContact O-N 3.5Å; T60-L63 PolarHBondContact O-N 3.49Å; L63-L65 VanDerWaalsContact C-N 3.31Å; L63-L65 PolarHBondContact O-N 3.19Å; L63-C66 WeakPolarHBondContact O-CB 3.01Å; L63-C66 PolarHBondContact O-N 3.03Å; L63-C66 VanDerWaalsContact O-N 3.14Å; L63-C67 PolarHBondContact O-N 3Å; L63-C67 PolarHBondContact O-SG 2.82Å; L63-C67 VanDerWaalsContact O-SG 3.32Å
64L98Very high97Very high37 Ų3740.9 Ų40.919%0.19423%0.23CC..Hα-helixtrans-57-45.2175.8-174.563.3000111.5T60 Y62 C67 Y68 W81 V82 V85T60-L64 VanDerWaalsContact O-CB 3.31Å; T60-L64 WeakPolarHBondContact O-CB 3.21Å; T60-L64 PolarHBondContact O-N 2.84Å; Y62-L64 VanDerWaalsContact C-N 3.34Å; Y62-L64 PolarHBondContact O-N 2.81Å; L64-C67 PolarHBondContact O-N 3.31Å; L64-Y68 HydrophobicContact CD1-CD2 4.2Å; L64-Y68 HydrophobicContact CD1-CE2 3.74Å; L64-Y68 HydrophobicContact CG-CE2 4.46Å; L64-Y68 VanDerWaalsContact O-CD2 3.31Å; L64-Y68 WeakPolarHBondContact O-CD2 3.49Å; L64-Y68 PolarHBondContact O-N 3.34Å; L64-W81 HydrophobicContact CD1-CH2 3.96Å; L64-W81 HydrophobicContact CD1-CZ3 4.49Å; L64-W81 HydrophobicContact CD2-CH2 4.3Å; L64-W81 HydrophobicContact CD2-CZ3 4.01Å; L64-V82 HydrophobicContact CD2-CB 4.39Å; L64-V82 HydrophobicContact CD2-CG1 3.76Å; L64-V82 HydrophobicContact CD2-CG2 4.27Å; L64-V82 HydrophobicContact CG-CG1 3.83Å; L64-V82 HydrophobicContact CG-CG2 4.3Å; L64-V85 HydrophobicContact CD2-CB 4.47Å; L64-V85 HydrophobicContact CD2-CG1 4.01Å
65L98.2Very high96.6Very high0 Ų041.4 Ų41.40%023%0.232CC..Hα-helixtrans-70.2-33176.5-72.8170.7000113H61 Y62 L63 C67 Y68 N69 V78 V82 W83 T86 F187H61-L65 WeakPolarHBondContact O-CG 3.49Å; H61-L65 PolarHBondContact O-N 3.18Å; H61-L65 VanDerWaalsContact O-N 3.16Å; Y62-L65 PolarHBondContact O-N 3.33Å; L63-L65 VanDerWaalsContact C-N 3.31Å; L63-L65 PolarHBondContact O-N 3.19Å; L65-C67 VanDerWaalsContact C-N 3.31Å; L65-C67 PolarHBondContact O-N 3.24Å; L65-Y68 PolarHBondContact O-N 3.1Å; L65-N69 WeakPolarHBondContact O-CA 3.18Å; L65-N69 PolarHBondContact O-N 2.51Å; L65-V78 HydrophobicContact CD2-CG1 4.16Å; L65-V82 HydrophobicContact CD2-CG1 3.77Å; L65-V82 HydrophobicContact CG-CG1 4.39Å; L65-W83 HydrophobicContact CD2-CE3 4.08Å; L65-W83 HydrophobicContact CD2-CH2 4.03Å; L65-W83 HydrophobicContact CD2-CZ3 3.5Å; L65-W83 VanDerWaalsContact CD2-CZ3 3.5Å; L65-T86 HydrophobicContact CD1-CG2 4.16Å; L65-F187 HydrophobicContact CD1-CE1 4.49Å
66C96.9Very high96.2Very high26 Ų2646.6 Ų46.618%0.17627%0.265CS..Hα-helixtrans-61.6-39.2172.3-71.60000112Y62 L63 P70 R282Y62-C66 VanDerWaalsContact CE1-SG 3.56Å; Y62-C66 VanDerWaalsContact CZ-SG 3.54Å; Y62-C66 PolarHBondContact O-N 3.02Å; Y62-C66 PolarHBondContact O-SG 2.55Å; L63-C66 WeakPolarHBondContact O-CB 3.01Å; L63-C66 PolarHBondContact O-N 3.03Å; L63-C66 VanDerWaalsContact O-N 3.14Å; C66-P70 WeakPolarHBondContact O-CA 3.27Å; C66-R282 PolarHBondContact SG-NH1 3.15Å; C66-R282 VanDerWaalsContact SG-NH1 3.36Å
67C96.9Very high95.9Very high103 Ų10347.7 Ų47.770%0.69627%0.271SS*.Hα-helixtrans-64.8-42.3178.8-67.50000112.8L63 L64 L65L63-C67 PolarHBondContact O-N 3Å; L63-C67 PolarHBondContact O-SG 2.82Å; L63-C67 VanDerWaalsContact O-SG 3.32Å; L64-C67 PolarHBondContact O-N 3.31Å; L65-C67 VanDerWaalsContact C-N 3.31Å; L65-C67 PolarHBondContact O-N 3.24Å
68Y97.2Very high95.8Very high81 Ų8146.4 Ų46.432%0.31827%0.265SS..Hα-helixtrans-90.4-26.8-176.6-70.5-70.2000114.3L64 L65 N77 P79 W81 V82L64-Y68 HydrophobicContact CD1-CD2 4.2Å; L64-Y68 HydrophobicContact CD1-CE2 3.74Å; L64-Y68 HydrophobicContact CG-CE2 4.46Å; L64-Y68 VanDerWaalsContact O-CD2 3.31Å; L64-Y68 WeakPolarHBondContact O-CD2 3.49Å; L64-Y68 PolarHBondContact O-N 3.34Å; L65-Y68 PolarHBondContact O-N 3.1Å; Y68-N77 WeakPolarHBondContact O-CB 3.43Å; Y68-P79 HydrophobicContact CD1-CG 3.91Å; Y68-P79 HydrophobicContact CE1-CG 3.62Å; Y68-P79 HydrophobicContact CE2-CG 4.47Å; Y68-P79 HydrophobicContact CG-CG 4.46Å; Y68-W81 HydrophobicContact CE2-CZ2 4.22Å; Y68-V82 HydrophobicContact CD2-CG2 3.78Å; Y68-V82 HydrophobicContact CE2-CG2 3.68Å
69N96.4Very high95.8Very high0 Ų048 Ų480%028%0.275CS..  trans-133.363.4-177.8-173.12.9000111.6L65 T71 F72 F73 S74 V78 S135 R282L65-N69 WeakPolarHBondContact O-CA 3.18Å; L65-N69 PolarHBondContact O-N 2.51Å; N69-T71 PolarHBondContact O-N 3.28Å; N69-T71 VanDerWaalsContact O-N 3.09Å; N69-F72 PolarHBondContact ND2-O 3.41Å; N69-F72 PolarHBondContact O-N 2.74Å; N69-F72 VanDerWaalsContact OD1-CA 3.25Å; N69-F72 WeakPolarHBondContact OD1-CA 3.43Å; N69-F72 PolarHBondContact OD1-N 2.66Å; N69-F72 VanDerWaalsContact OD1-N 3.13Å; N69-F73 PolarHBondContact OD1-N 3.04Å; N69-S74 WeakPolarHBondContact OD1-CA 3.26Å; N69-S74 WeakPolarHBondContact OD1-CB 3.49Å; N69-S74 PolarHBondContact OD1-N 3.38Å; N69-V78 HydrophobicContact CB-CG2 3.68Å; N69-S135 PolarHBondContact ND2-O 2.87Å; N69-R282 PolarHBondContact O-NE 3.01Å; N69-R282 PolarHBondContact O-NH2 3.34Å
70P94.2Very high95.7Very high76 Ų7650.2 Ų50.249%0.49429%0.289SS..THydrogen-bonded Turntrans-62.1-23.1-172.424.7-35.3000114.4C66 R282C66-P70 WeakPolarHBondContact O-CA 3.27Å; P70-R282 WeakPolarHBondContact O-CD 3.33Å; P70-R282 WeakPolarHBondContact O-CG 3.34Å; P70-R282 PolarHBondContact O-NE 3.48Å; P70-R282 VanDerWaalsContact O-NE 3.08Å
71T93Very high95.6Very high71 Ų7152.7 Ų52.744%0.43629%0.29SS..THydrogen-bonded Turntrans-102.32.3-177.157.90000114.2N69 F73 S74N69-T71 PolarHBondContact O-N 3.28Å; N69-T71 VanDerWaalsContact O-N 3.09Å; T71-F73 WeakPolarHBondContact O-CD2 3.3Å; T71-F73 VanDerWaalsContact O-CE2 3.28Å; T71-F73 WeakPolarHBondContact O-CE2 3.33Å; T71-F73 PolarHBondContact O-N 3.35Å; T71-F73 VanDerWaalsContact O-N 3.07Å; T71-S74 PolarHBondContact OG1-OG 3.3Å
72F95.7Very high95.6Very high1 Ų152.6 Ų52.60%0.00429%0.29CS..SBendtrans68.1-22.4-168.1-59.2-70.1000115.9N69 G131 F134 M146 T281 R282 L285N69-F72 PolarHBondContact ND2-O 3.41Å; N69-F72 PolarHBondContact O-N 2.74Å; N69-F72 VanDerWaalsContact OD1-CA 3.25Å; N69-F72 WeakPolarHBondContact OD1-CA 3.43Å; N69-F72 PolarHBondContact OD1-N 2.66Å; N69-F72 VanDerWaalsContact OD1-N 3.13Å; F72-G131 VanDerWaalsContact CE1-O 3.31Å; F72-G131 WeakPolarHBondContact CE1-O 3.45Å; F72-F134 HydrophobicContact CD1-CB 3.58Å; F72-F134 HydrophobicContact CE1-CB 3.64Å; F72-F134 HydrophobicContact CG-CB 4.21Å; F72-F134 HydrophobicContact CZ-CB 4.3Å; F72-F134 HydrophobicContact CZ-CD2 4.47Å; F72-M146 HydrophobicContact CB-CE 3.86Å; F72-M146 HydrophobicContact CB-SD 4.17Å; F72-M146 HydrophobicContact CD2-SD 3.83Å; F72-M146 HydrophobicContact CE2-SD 4.38Å; F72-M146 HydrophobicContact CG-CE 4.37Å; F72-M146 HydrophobicContact CG-SD 4.08Å; F72-T281 HydrophobicContact CD2-CG2 3.95Å; F72-T281 HydrophobicContact CE2-CG2 3.74Å; F72-R282 HydrophobicContact CD2-CG 3.88Å; F72-R282 HydrophobicContact CE1-CG 3.99Å; F72-R282 HydrophobicContact CE2-CB 4.17Å; F72-R282 HydrophobicContact CE2-CG 3.26Å; F72-R282 HydrophobicContact CG-CG 4.48Å; F72-R282 HydrophobicContact CZ-CB 4.38Å; F72-R282 HydrophobicContact CZ-CG 3.35Å; F72-L285 HydrophobicContact CE2-CD1 4.15Å; F72-L285 HydrophobicContact CZ-CD1 4.29Å
73F93.5Very high95.6Very high78 Ų7852.3 Ų52.334%0.34229%0.289SS..  trans-92.9-0.6-174.3-56.7-70.1000115N69 T71 G138 N139 V143 M146N69-F73 PolarHBondContact OD1-N 3.04Å; T71-F73 WeakPolarHBondContact O-CD2 3.3Å; T71-F73 VanDerWaalsContact O-CE2 3.28Å; T71-F73 WeakPolarHBondContact O-CE2 3.33Å; T71-F73 PolarHBondContact O-N 3.35Å; T71-F73 VanDerWaalsContact O-N 3.07Å; F73-G138 VanDerWaalsContact CE1-O 3.3Å; F73-G138 WeakPolarHBondContact CE1-O 3.47Å; F73-N139 PolarHBondContact O-OD1 3.44Å; F73-V143 HydrophobicContact CE2-CG2 3.78Å; F73-V143 HydrophobicContact CZ-CG2 3.56Å; F73-M146 HydrophobicContact CE1-CE 3.81Å; F73-M146 HydrophobicContact CZ-CE 3.83Å
74S90.4Very high95.7Very high31 Ų3150 Ų5022%0.21728%0.277CS..  trans-105.747.7-174.3-59.90000112.6N69 T71 V76 N77N69-S74 WeakPolarHBondContact OD1-CA 3.26Å; N69-S74 WeakPolarHBondContact OD1-CB 3.49Å; N69-S74 PolarHBondContact OD1-N 3.38Å; T71-S74 PolarHBondContact OG1-OG 3.3Å; S74-V76 PolarHBondContact O-N 3.31Å; S74-V76 VanDerWaalsContact O-N 3.15Å; S74-N77 WeakPolarHBondContact O-CB 3.34Å; S74-N77 PolarHBondContact O-N 3.45Å
75T91.3Very high95.7Very high17 Ų1750.7 Ų50.710%0.10428%0.283CS..G310 helixtrans-56.4-29.1177.231.20000113.3N77 V78 W83 S135 L136 N139T75-N77 PolarHBondContact O-N 2.9Å; T75-V78 PolarHBondContact O-N 2.97Å; T75-W83 HydrophobicContact CG2-CH2 4.25Å; T75-W83 HydrophobicContact CG2-CZ2 4.3Å; T75-S135 WeakPolarHBondContact CG2-O 3.42Å; T75-L136 WeakPolarHBondContact CG2-O 3.46Å; T75-N139 PolarHBondContact OG1-ND2 2.97Å
76V90.2Very high95.7Very high129 Ų12950.7 Ų50.778%0.78228%0.283SS*.G310 helixtrans-65-23.9175.4-63.10000113.6S74 V78S74-V76 PolarHBondContact O-N 3.31Å; S74-V76 VanDerWaalsContact O-N 3.15Å; V76-V78 VanDerWaalsContact C-N 3.34Å
77N93.1Very high95.8Very high100 Ų10049.9 Ų49.954%0.53528%0.277SS..G310 helixtrans-86.2-7.2179-66.6-10.3000112.7Y68 S74 T75 P79Y68-N77 WeakPolarHBondContact O-CB 3.43Å; S74-N77 WeakPolarHBondContact O-CB 3.34Å; S74-N77 PolarHBondContact O-N 3.45Å; T75-N77 PolarHBondContact O-N 2.9Å; N77-P79 VanDerWaalsContact O-CD 3.3Å; N77-P79 WeakPolarHBondContact O-CD 3.38Å
78V96.8Very high95.9Very high9 Ų950.5 Ų50.56%0.05527%0.268CS..SBendtrans-86114.5-179.5-175.40000109.4L65 N69 T75 V76 V82 W83L65-V78 HydrophobicContact CD2-CG1 4.16Å; N69-V78 HydrophobicContact CB-CG2 3.68Å; T75-V78 PolarHBondContact O-N 2.97Å; V76-V78 VanDerWaalsContact C-N 3.34Å; V78-V82 HydrophobicContact CG1-CB 3.69Å; V78-V82 HydrophobicContact CG1-CG1 3.72Å; V78-V82 HydrophobicContact CG1-CG2 4.31Å; V78-W83 HydrophobicContact CB-CH2 4.05Å; V78-W83 HydrophobicContact CB-CZ2 3.44Å; V78-W83 VanDerWaalsContact CB-CZ2 3.44Å; V78-W83 HydrophobicContact CG1-CD2 4.06Å; V78-W83 HydrophobicContact CG1-CE3 4.39Å; V78-W83 HydrophobicContact CG1-CH2 3.87Å; V78-W83 HydrophobicContact CG1-CZ2 3.45Å; V78-W83 VanDerWaalsContact CG1-CZ2 3.45Å; V78-W83 HydrophobicContact CG1-CZ3 4.31Å; V78-W83 HydrophobicContact CG2-CH2 3.96Å; V78-W83 HydrophobicContact CG2-CZ2 3.79Å
79P97.3Very high96Very high39 Ų3947.7 Ų47.725%0.25326%0.259SS..  trans-58.6141.7175.8-23.534.3000111.3Y68 N77 W81 V82Y68-P79 HydrophobicContact CD1-CG 3.91Å; Y68-P79 HydrophobicContact CE1-CG 3.62Å; Y68-P79 HydrophobicContact CE2-CG 4.47Å; Y68-P79 HydrophobicContact CG-CG 4.46Å; N77-P79 VanDerWaalsContact O-CD 3.3Å; N77-P79 WeakPolarHBondContact O-CD 3.38Å; P79-W81 HydrophobicContact CB-CG 4.41Å; P79-W81 VanDerWaalsContact CB-NE1 3.34Å; P79-W81 PolarHBondContact O-N 3.19Å; P79-W81 VanDerWaalsContact O-N 3.1Å; P79-V82 HydrophobicContact CB-CG2 4.24Å; P79-V82 HydrophobicContact CG-CG2 4.33Å; P79-V82 VanDerWaalsContact O-CB 3.3Å; P79-V82 WeakPolarHBondContact O-CB 3.39Å; P79-V82 PolarHBondContact O-N 2.87Å
80T96.6Very high96.1Very high81 Ų8147.9 Ų47.950%0.49726%0.26SS..Hα-helixtrans-56.6-35.5-172.9-50.20000113.4V82 W83 Y191T80-V82 PolarHBondContact O-N 3.23Å; T80-W83 PolarHBondContact O-N 3.04Å; T80-Y191 HydrophobicContact CG2-CD2 3.75Å; T80-Y191 HydrophobicContact CG2-CE2 4.2Å; T80-Y191 WeakPolarHBondContact CG2-O 3.42Å; T80-Y191 WeakPolarHBondContact O-CD2 3.46Å
81W97.9Very high96.3Very high123 Ų12348.1 Ų48.147%0.46625%0.253SS..Hα-helixtrans-63.3-26178.569.5-99.9000113.4L64 Y68 P79 W83 L84 V85L64-W81 HydrophobicContact CD1-CH2 3.96Å; L64-W81 HydrophobicContact CD1-CZ3 4.49Å; L64-W81 HydrophobicContact CD2-CH2 4.3Å; L64-W81 HydrophobicContact CD2-CZ3 4.01Å; Y68-W81 HydrophobicContact CE2-CZ2 4.22Å; P79-W81 HydrophobicContact CB-CG 4.41Å; P79-W81 VanDerWaalsContact CB-NE1 3.34Å; P79-W81 PolarHBondContact O-N 3.19Å; P79-W81 VanDerWaalsContact O-N 3.1Å; W81-W83 VanDerWaalsContact C-N 3.28Å; W81-W83 PolarHBondContact O-N 3.48Å; W81-L84 WeakPolarHBondContact O-CB 3.5Å; W81-L84 PolarHBondContact O-N 3.13Å; W81-V85 HydrophobicContact CE3-CB 4.3Å; W81-V85 HydrophobicContact CE3-CG2 3.66Å; W81-V85 HydrophobicContact CZ3-CB 4.35Å; W81-V85 HydrophobicContact CZ3-CG2 3.93Å; W81-V85 PolarHBondContact O-N 3.04Å
82V98.4Very high96.5Very high0 Ų048.2 Ų48.20%025%0.25CS..Hα-helixtrans-62.6-39.3177.9172.30000110.1L64 L65 Y68 V78 P79 T80 L84 V85 T86L64-V82 HydrophobicContact CD2-CB 4.39Å; L64-V82 HydrophobicContact CD2-CG1 3.76Å; L64-V82 HydrophobicContact CD2-CG2 4.27Å; L64-V82 HydrophobicContact CG-CG1 3.83Å; L64-V82 HydrophobicContact CG-CG2 4.3Å; L65-V82 HydrophobicContact CD2-CG1 3.77Å; L65-V82 HydrophobicContact CG-CG1 4.39Å; Y68-V82 HydrophobicContact CD2-CG2 3.78Å; Y68-V82 HydrophobicContact CE2-CG2 3.68Å; V78-V82 HydrophobicContact CG1-CB 3.69Å; V78-V82 HydrophobicContact CG1-CG1 3.72Å; V78-V82 HydrophobicContact CG1-CG2 4.31Å; P79-V82 HydrophobicContact CB-CG2 4.24Å; P79-V82 HydrophobicContact CG-CG2 4.33Å; P79-V82 VanDerWaalsContact O-CB 3.3Å; P79-V82 WeakPolarHBondContact O-CB 3.39Å; P79-V82 PolarHBondContact O-N 2.87Å; T80-V82 PolarHBondContact O-N 3.23Å; V82-L84 VanDerWaalsContact C-N 3.32Å; V82-L84 PolarHBondContact O-N 3.36Å; V82-V85 PolarHBondContact O-N 3.3Å; V82-T86 WeakPolarHBondContact O-CB 3.47Å; V82-T86 PolarHBondContact O-N 3.39Å; V82-T86 PolarHBondContact O-OG1 3.36Å
83W98.3Very high96.7Very high3 Ų348.5 Ų48.51%0.01125%0.253CS..Hα-helixtrans-62.7-39.6176-53.6123.8000112.3L65 T75 V78 T80 W81 S87 L136 F187 A190 P195L65-W83 HydrophobicContact CD2-CE3 4.08Å; L65-W83 HydrophobicContact CD2-CH2 4.03Å; L65-W83 HydrophobicContact CD2-CZ3 3.5Å; L65-W83 VanDerWaalsContact CD2-CZ3 3.5Å; T75-W83 HydrophobicContact CG2-CH2 4.25Å; T75-W83 HydrophobicContact CG2-CZ2 4.3Å; V78-W83 HydrophobicContact CB-CH2 4.05Å; V78-W83 HydrophobicContact CB-CZ2 3.44Å; V78-W83 VanDerWaalsContact CB-CZ2 3.44Å; V78-W83 HydrophobicContact CG1-CD2 4.06Å; V78-W83 HydrophobicContact CG1-CE3 4.39Å; V78-W83 HydrophobicContact CG1-CH2 3.87Å; V78-W83 HydrophobicContact CG1-CZ2 3.45Å; V78-W83 VanDerWaalsContact CG1-CZ2 3.45Å; V78-W83 HydrophobicContact CG1-CZ3 4.31Å; V78-W83 HydrophobicContact CG2-CH2 3.96Å; V78-W83 HydrophobicContact CG2-CZ2 3.79Å; T80-W83 PolarHBondContact O-N 3.04Å; W81-W83 VanDerWaalsContact C-N 3.28Å; W81-W83 PolarHBondContact O-N 3.48Å; W83-S87 WeakPolarHBondContact O-CB 3.26Å; W83-S87 PolarHBondContact O-N 2.85Å; W83-L136 HydrophobicContact CD2-CD1 4.36Å; W83-L136 HydrophobicContact CE3-CD1 4.09Å; W83-L136 HydrophobicContact CH2-CB 4.3Å; W83-L136 HydrophobicContact CH2-CD1 3.89Å; W83-L136 HydrophobicContact CZ2-CD1 4.17Å; W83-L136 HydrophobicContact CZ3-CB 4.05Å; W83-L136 HydrophobicContact CZ3-CD1 3.85Å; W83-F187 AromaticContact CE3-CD1 3.78Å; W83-F187 HydrophobicContact CE3-CD1 3.78Å; W83-F187 AromaticContact CE3-CE1 3.95Å; W83-F187 HydrophobicContact CE3-CE1 3.95Å; W83-F187 HydrophobicContact CZ3-CD1 4.26Å; W83-F187 AromaticContact CZ3-CE1 3.96Å; W83-F187 HydrophobicContact CZ3-CE1 3.96Å; W83-A190 HydrophobicContact CB-CB 4.17Å; W83-A190 HydrophobicContact CD2-CB 4.37Å; W83-A190 HydrophobicContact CG-CB 4.12Å; W83-P195 HydrophobicContact CD2-CG 4.41Å; W83-P195 HydrophobicContact CZ2-CG 3.64Å
84L98.6Very high96.9Very high44 Ų4445.1 Ų45.123%0.2324%0.238CC..Hα-helixtrans-64.3-47.9175.6-174.463.5000111W81 V82 S87 F88 L188 Y191W81-L84 WeakPolarHBondContact O-CB 3.5Å; W81-L84 PolarHBondContact O-N 3.13Å; V82-L84 VanDerWaalsContact C-N 3.32Å; V82-L84 PolarHBondContact O-N 3.36Å; L84-S87 WeakPolarHBondContact O-CB 3.2Å; L84-S87 PolarHBondContact O-N 3.3Å; L84-F88 HydrophobicContact CD1-CD2 4.03Å; L84-F88 HydrophobicContact CD1-CE2 3.58Å; L84-F88 HydrophobicContact CD2-CE2 4.46Å; L84-F88 HydrophobicContact CG-CD2 4Å; L84-F88 HydrophobicContact CG-CE2 3.83Å; L84-F88 VanDerWaalsContact O-CD2 3.29Å; L84-F88 WeakPolarHBondContact O-CD2 3.36Å; L84-F88 PolarHBondContact O-N 2.96Å; L84-F88 VanDerWaalsContact O-N 3.08Å; L84-L188 HydrophobicContact CD1-CD1 3.76Å; L84-Y191 HydrophobicContact CB-CD1 4.38Å; L84-Y191 HydrophobicContact CB-CD2 3.63Å; L84-Y191 HydrophobicContact CB-CE2 4.07Å; L84-Y191 HydrophobicContact CB-CG 3.81Å; L84-Y191 HydrophobicContact CD1-CD1 3.83Å; L84-Y191 HydrophobicContact CD1-CE1 4.07Å; L84-Y191 HydrophobicContact CD1-CG 4.09Å; L84-Y191 HydrophobicContact CD2-CD2 4.39Å; L84-Y191 HydrophobicContact CD2-CE1 4.24Å; L84-Y191 HydrophobicContact CD2-CE2 4Å; L84-Y191 HydrophobicContact CG-CD2 4.41Å; L84-Y191 HydrophobicContact CG-CG 4.41Å
85V98.7Very high97.3Very high53 Ų5344 Ų4432%0.32123%0.23SC..Hα-helixtrans-61.6-45.8178.3169.90000110.8L64 W81 V82 S87 F88 L89L64-V85 HydrophobicContact CD2-CB 4.47Å; L64-V85 HydrophobicContact CD2-CG1 4.01Å; W81-V85 HydrophobicContact CE3-CB 4.3Å; W81-V85 HydrophobicContact CE3-CG2 3.66Å; W81-V85 HydrophobicContact CZ3-CB 4.35Å; W81-V85 HydrophobicContact CZ3-CG2 3.93Å; W81-V85 PolarHBondContact O-N 3.04Å; V82-V85 PolarHBondContact O-N 3.3Å; V85-S87 VanDerWaalsContact C-N 3.32Å; V85-S87 PolarHBondContact O-N 2.96Å; V85-F88 PolarHBondContact O-N 2.98Å; V85-L89 HydrophobicContact CG1-CD1 3.62Å; V85-L89 HydrophobicContact CG1-CG 4.06Å; V85-L89 WeakPolarHBondContact O-CB 3.48Å; V85-L89 VanDerWaalsContact O-CG 3.24Å; V85-L89 WeakPolarHBondContact O-CG 3.17Å; V85-L89 PolarHBondContact O-N 2.87Å
86T98.7Very high97.7Very high0 Ų044.4 Ų44.40%023%0.232CC..Hα-helixtrans-59.3-42.2176-60.30000111.7H61 L65 V82 F88 L89 V90 F187H61-T86 HydrophobicContact CB-CG2 3.9Å; L65-T86 HydrophobicContact CD1-CG2 4.16Å; V82-T86 WeakPolarHBondContact O-CB 3.47Å; V82-T86 PolarHBondContact O-N 3.39Å; V82-T86 PolarHBondContact O-OG1 3.36Å; T86-F88 PolarHBondContact O-N 3.36Å; T86-L89 PolarHBondContact O-N 2.93Å; T86-V90 HydrophobicContact CG2-CG2 4.18Å; T86-V90 WeakPolarHBondContact O-CB 3.4Å; T86-V90 VanDerWaalsContact O-CG2 3.26Å; T86-V90 WeakPolarHBondContact O-CG2 3.38Å; T86-V90 PolarHBondContact O-N 3.31Å; T86-F187 HydrophobicContact CG2-CD1 3.92Å; T86-F187 HydrophobicContact CG2-CD2 3.68Å; T86-F187 HydrophobicContact CG2-CE1 3.91Å; T86-F187 HydrophobicContact CG2-CE2 3.66Å; T86-F187 HydrophobicContact CG2-CG 3.82Å; T86-F187 HydrophobicContact CG2-CZ 3.8Å
87S98.7Very high98Very high9 Ų939.6 Ų39.66%0.06320%0.201CC..Hα-helixtrans-57.2-50.5175.6179.40000112.3W83 L84 V85 V90 F91 A184 L188W83-S87 WeakPolarHBondContact O-CB 3.26Å; W83-S87 PolarHBondContact O-N 2.85Å; L84-S87 WeakPolarHBondContact O-CB 3.2Å; L84-S87 PolarHBondContact O-N 3.3Å; V85-S87 VanDerWaalsContact C-N 3.32Å; V85-S87 PolarHBondContact O-N 2.96Å; S87-V90 PolarHBondContact O-N 2.72Å; S87-F91 WeakPolarHBondContact O-CB 3.46Å; S87-F91 PolarHBondContact O-N 3.45Å; S87-A184 WeakPolarHBondContact CB-O 3.49Å; S87-A184 PolarHBondContact OG-O 3.02Å; S87-L188 WeakPolarHBondContact OG-CB 3.34Å
88F98.7Very high98.2Very high115 Ų11535.3 Ų35.350%0.50418%0.181SC..Hα-helixtrans-64.2-43177.8-81.4-69.9000112.5L84 V85 T86 F91 I92L84-F88 HydrophobicContact CD1-CD2 4.03Å; L84-F88 HydrophobicContact CD1-CE2 3.58Å; L84-F88 HydrophobicContact CD2-CE2 4.46Å; L84-F88 HydrophobicContact CG-CD2 4Å; L84-F88 HydrophobicContact CG-CE2 3.83Å; L84-F88 VanDerWaalsContact O-CD2 3.29Å; L84-F88 WeakPolarHBondContact O-CD2 3.36Å; L84-F88 PolarHBondContact O-N 2.96Å; L84-F88 VanDerWaalsContact O-N 3.08Å; V85-F88 PolarHBondContact O-N 2.98Å; T86-F88 PolarHBondContact O-N 3.36Å; F88-F91 PolarHBondContact O-N 3.22Å; F88-I92 WeakPolarHBondContact O-CB 3.09Å; F88-I92 WeakPolarHBondContact O-CG1 3.42Å; F88-I92 PolarHBondContact O-N 2.78Å
89L98.8Very high98.3Very high23 Ų2334.9 Ų34.912%0.1218%0.179CC..Hα-helixtrans-62.6-43.9179.3-69.9176000111.6L57 T60 H61 V85 T86 A93L57-L89 HydrophobicContact CB-CD2 4.06Å; L57-L89 HydrophobicContact CD2-CD2 3.7Å; L57-L89 HydrophobicContact CG-CD2 4.29Å; T60-L89 HydrophobicContact CG2-CD1 3.94Å; H61-L89 HydrophobicContact CB-CB 4.06Å; H61-L89 HydrophobicContact CB-CD1 3.73Å; V85-L89 HydrophobicContact CG1-CD1 3.62Å; V85-L89 HydrophobicContact CG1-CG 4.06Å; V85-L89 WeakPolarHBondContact O-CB 3.48Å; V85-L89 VanDerWaalsContact O-CG 3.24Å; V85-L89 WeakPolarHBondContact O-CG 3.17Å; V85-L89 PolarHBondContact O-N 2.87Å; T86-L89 PolarHBondContact O-N 2.93Å; L89-A93 WeakPolarHBondContact O-CB 3.34Å; L89-A93 PolarHBondContact O-N 3.31Å
90V98.6Very high98.3Very high3 Ų333.5 Ų33.52%0.01817%0.169CC..Hα-helixtrans-62.6-48175.41720000110.7T86 S87 I92 A93 H94 L129 V183 A184 F187T86-V90 HydrophobicContact CG2-CG2 4.18Å; T86-V90 WeakPolarHBondContact O-CB 3.4Å; T86-V90 VanDerWaalsContact O-CG2 3.26Å; T86-V90 WeakPolarHBondContact O-CG2 3.38Å; T86-V90 PolarHBondContact O-N 3.31Å; S87-V90 PolarHBondContact O-N 2.72Å; V90-I92 PolarHBondContact O-N 3.12Å; V90-A93 PolarHBondContact O-N 2.88Å; V90-H94 WeakPolarHBondContact O-CB 3.19Å; V90-H94 PolarHBondContact O-N 3.07Å; V90-L129 HydrophobicContact CG1-CD1 3.99Å; V90-L129 HydrophobicContact CG2-CD1 4.05Å; V90-V183 HydrophobicContact CG1-CG1 4.22Å; V90-A184 HydrophobicContact CB-CB 4.38Å; V90-A184 HydrophobicContact CG1-CB 4.05Å; V90-F187 HydrophobicContact CG2-CD2 4.47Å; V90-F187 HydrophobicContact CG2-CE2 4.46Å
91F98.6Very high98.3Very high82 Ų8230.6 Ų30.636%0.3616%0.155SC..Hα-helixtrans-61.9-45.2-179.5177.3-101000112.5F33 S87 F88 T95 I181 A184F33-F91 HydrophobicContact CZ-CZ 4.41Å; S87-F91 WeakPolarHBondContact O-CB 3.46Å; S87-F91 PolarHBondContact O-N 3.45Å; F88-F91 PolarHBondContact O-N 3.22Å; F91-T95 WeakPolarHBondContact O-CB 3.35Å; F91-T95 PolarHBondContact O-N 3.17Å; F91-T95 PolarHBondContact O-OG1 2.74Å; F91-I181 HydrophobicContact CD2-CD1 3.94Å; F91-I181 HydrophobicContact CE2-CD1 3.93Å; F91-A184 HydrophobicContact CB-CB 3.97Å
92I98.7Very high98.3Very high72 Ų7226.3 Ų26.337%0.36914%0.14SC..Hα-helixtrans-67.1-45.8178.6-64.7166.7000109.6L57 F88 V90 H94 T95 L96L57-I92 HydrophobicContact CD1-CB 3.92Å; L57-I92 HydrophobicContact CD1-CG2 3.43Å; L57-I92 VanDerWaalsContact CD1-CG2 3.43Å; F88-I92 WeakPolarHBondContact O-CB 3.09Å; F88-I92 WeakPolarHBondContact O-CG1 3.42Å; F88-I92 PolarHBondContact O-N 2.78Å; V90-I92 PolarHBondContact O-N 3.12Å; I92-H94 PolarHBondContact O-N 2.82Å; I92-T95 WeakPolarHBondContact O-CB 3.17Å; I92-T95 PolarHBondContact O-N 3.16Å; I92-L96 HydrophobicContact CG2-CD1 4.1Å; I92-L96 HydrophobicContact CG2-CG 4.13Å; I92-L96 WeakPolarHBondContact O-CG 3.13Å; I92-L96 PolarHBondContact O-N 3.47Å
93A98.7Very high98.3Very high8 Ų826.3 Ų26.37%0.06614%0.14CC..Hα-helixtrans-55.3-49.9177.700000111.8G54 L57 T58 L89 V90 T95 L96 D97G54-A93 WeakPolarHBondContact O-CB 3.44Å; L57-A93 HydrophobicContact CB-CB 4.23Å; T58-A93 HydrophobicContact CG2-CB 3.54Å; L89-A93 WeakPolarHBondContact O-CB 3.34Å; L89-A93 PolarHBondContact O-N 3.31Å; V90-A93 PolarHBondContact O-N 2.88Å; A93-T95 VanDerWaalsContact C-N 3.29Å; A93-T95 PolarHBondContact O-N 2.5Å; A93-L96 PolarHBondContact O-N 3.25Å; A93-D97 WeakPolarHBondContact O-CB 3.23Å; A93-D97 PolarHBondContact O-N 2.88Å
94H98.2Very high98.2Very high6 Ų626.6 Ų26.63%0.02814%0.143CC..Hα-helixtrans-63.3-33.3176.5177.853.4000113.1W34 V90 I92 G98 D177 Q180W34-H94 AromaticContact CZ2-CE1 3.74Å; W34-H94 AromaticContact CZ2-NE2 3.63Å; V90-H94 WeakPolarHBondContact O-CB 3.19Å; V90-H94 PolarHBondContact O-N 3.07Å; I92-H94 PolarHBondContact O-N 2.82Å; H94-G98 PolarHBondContact O-N 3.3Å; H94-D177 IonicContact CE1-OD1 3.28Å; H94-D177 PolarHBondContact CE1-OD1 3.4Å; H94-D177 VanDerWaalsContact CE1-OD1 3.26Å; H94-D177 IonicContact NE2-OD1 2.78Å; H94-Q180 HydrophobicContact CB-CB 4.22Å
95T98.6Very high98Very high7 Ų730.3 Ų30.34%0.04315%0.154CC..Hα-helixtrans-70-39.5175.4-61.60000112.1F33 L37 F91 I92 A93 T99F33-T95 HydrophobicContact CE1-CG2 3.84Å; F33-T95 HydrophobicContact CZ-CG2 4.2Å; L37-T95 HydrophobicContact CD2-CG2 3.3Å; F91-T95 WeakPolarHBondContact O-CB 3.35Å; F91-T95 PolarHBondContact O-N 3.17Å; F91-T95 PolarHBondContact O-OG1 2.74Å; I92-T95 WeakPolarHBondContact O-CB 3.17Å; I92-T95 PolarHBondContact O-N 3.16Å; A93-T95 VanDerWaalsContact C-N 3.29Å; A93-T95 PolarHBondContact O-N 2.5Å; T95-T99 WeakPolarHBondContact O-CB 3.4Å; T95-T99 VanDerWaalsContact O-CG2 3.27Å; T95-T99 WeakPolarHBondContact O-CG2 3.2Å; T95-T99 PolarHBondContact O-N 3.46Å; T95-T99 PolarHBondContact O-OG1 3.39Å
96L98.6Very high97.9Very high27 Ų2732.4 Ų32.414%0.14116%0.156CC..Hα-helixtrans-65.6-43.3176.3-65.8-176.4000110.7Y41 I50 T53 L57 I92 A93 T99 D100Y41-L96 WeakPolarHBondContact OH-CD2 3.3Å; I50-L96 HydrophobicContact CG2-CB 3.71Å; I50-L96 HydrophobicContact CG2-CD2 4.01Å; I50-L96 HydrophobicContact CG2-CG 4.35Å; I50-L96 VanDerWaalsContact CG2-O 3.23Å; I50-L96 WeakPolarHBondContact CG2-O 3.5Å; T53-L96 HydrophobicContact CG2-CD1 3.9Å; L57-L96 HydrophobicContact CD1-CD1 4.2Å; I92-L96 HydrophobicContact CG2-CD1 4.1Å; I92-L96 HydrophobicContact CG2-CG 4.13Å; I92-L96 WeakPolarHBondContact O-CG 3.13Å; I92-L96 PolarHBondContact O-N 3.47Å; A93-L96 PolarHBondContact O-N 3.25Å; L96-T99 WeakPolarHBondContact CA-OG1 3.48Å; L96-T99 PolarHBondContact O-N 2.81Å; L96-T99 PolarHBondContact O-OG1 3.02Å; L96-D100 PolarHBondContact O-N 3.19Å; L96-D100 VanDerWaalsContact O-N 3.07Å
97D97.9Very high97.7Very high27 Ų2733.7 Ų33.714%0.14416%0.164CC..Hα-helixtrans-54.2-57171.8179.869.6000111.8A93 T99 D100A93-D97 WeakPolarHBondContact O-CB 3.23Å; A93-D97 PolarHBondContact O-N 2.88Å; D97-T99 PolarHBondContact O-N 2.99Å; D97-D100 PolarHBondContact O-N 3.14Å
98G97.5Very high97.5Very high11 Ų1144.5 Ų44.511%0.11320%0.204CC..Hα-helixtrans-64.8-13.3-179.700000115.9H94 K102H94-G98 PolarHBondContact O-N 3.3Å; G98-K102 WeakPolarHBondContact O-CG 3.45Å
99T98.4Very high97.3Very high0 Ų040.6 Ų40.60%019%0.191CC..Hα-helixtrans-104.3-16.1-17954.30000114.5W34 L37 Y41 T95 L96 D97 G101 K102 Q103W34-T99 HydrophobicContact CB-CG2 3.7Å; W34-T99 HydrophobicContact CG-CG2 3.97Å; L37-T99 HydrophobicContact CB-CG2 4.38Å; L37-T99 HydrophobicContact CD2-CG2 4.21Å; Y41-T99 HydrophobicContact CE2-CG2 4.39Å; Y41-T99 WeakPolarHBondContact CE2-OG1 3.29Å; Y41-T99 PolarHBondContact OH-OG1 3.16Å; T95-T99 WeakPolarHBondContact O-CB 3.4Å; T95-T99 VanDerWaalsContact O-CG2 3.27Å; T95-T99 WeakPolarHBondContact O-CG2 3.2Å; T95-T99 PolarHBondContact O-N 3.46Å; T95-T99 PolarHBondContact O-OG1 3.39Å; L96-T99 WeakPolarHBondContact CA-OG1 3.48Å; L96-T99 PolarHBondContact O-N 2.81Å; L96-T99 PolarHBondContact O-OG1 3.02Å; D97-T99 PolarHBondContact O-N 2.99Å; T99-G101 PolarHBondContact O-N 3.44Å; T99-K102 WeakPolarHBondContact O-CB 3.45Å; T99-K102 PolarHBondContact O-N 3.27Å; T99-K102 VanDerWaalsContact O-N 3.16Å; T99-Q103 PolarHBondContact O-N 3.26Å
100D98Very high97.1Very high10 Ų1043 Ų435%0.05321%0.209CC..Hα-helixtrans-63.8-43.8-175.766.211.5000112.4I50 T51 L96 D97 K102 Q103 A104I50-D100 HydrophobicContact CB-CB 4.17Å; I50-D100 HydrophobicContact CG2-CB 3.99Å; T51-D100 PolarHBondContact OG1-OD2 3.42Å; L96-D100 PolarHBondContact O-N 3.19Å; L96-D100 VanDerWaalsContact O-N 3.07Å; D97-D100 PolarHBondContact O-N 3.14Å; D100-K102 VanDerWaalsContact C-N 3.29Å; D100-K102 PolarHBondContact O-N 3.44Å; D100-Q103 CarbonylContact O-C 3.58Å; D100-Q103 WeakPolarHBondContact O-CB 3.14Å; D100-Q103 PolarHBondContact O-N 3.32Å; D100-A104 WeakPolarHBondContact O-CB 3.28Å; D100-A104 PolarHBondContact O-N 3.35Å
101G96.3Very high96.9Very high20 Ų2044.8 Ų44.821%0.20622%0.222CC..Hα-helixtrans-72.3-27.1177.400000111.3T99 A104 R105T99-G101 PolarHBondContact O-N 3.44Å; G101-A104 PolarHBondContact O-N 3.18Å; G101-R105 WeakPolarHBondContact O-CG 3.35Å; G101-R105 PolarHBondContact O-N 2.93Å; G101-R105 PolarHBondContact O-NE 3.3Å; G101-R105 PolarHBondContact O-NH2 3.39Å
102K97.4Very high96.7Very high32 Ų3241.2 Ų41.214%0.13921%0.207CC..Hα-helixtrans-66.7-44.7172.3-48.5-76.1161-170.20109.1H31 W34 N35 A38 G98 T99 D100 R105 R106H31-K102 PolarHBondContact CE1-NZ 3.22Å; H31-K102 WeakPolarHBondContact ND1-CE 3.46Å; H31-K102 PolarHBondContact ND1-NZ 2.89Å; W34-K102 HydrophobicContact CB-CG 4.31Å; N35-K102 WeakPolarHBondContact OD1-CD 3.39Å; A38-K102 HydrophobicContact CB-CB 3.79Å; G98-K102 WeakPolarHBondContact O-CG 3.45Å; T99-K102 WeakPolarHBondContact O-CB 3.45Å; T99-K102 PolarHBondContact O-N 3.27Å; T99-K102 VanDerWaalsContact O-N 3.16Å; D100-K102 VanDerWaalsContact C-N 3.29Å; D100-K102 PolarHBondContact O-N 3.44Å; K102-R105 VanDerWaalsContact CE-NH2 3.31Å; K102-R105 PolarHBondContact O-N 3.48Å; K102-R106 WeakPolarHBondContact O-CB 3.39Å; K102-R106 PolarHBondContact O-N 2.77Å
103Q97.6Very high96.6Very high0 Ų037.8 Ų37.80%019%0.19CC..Hα-helixtrans-62.5-42.6173.3-179.668.2-9.900112.1Y41 P42 L45 P47 I50 T99 D100 R105 R106 T107Y41-Q103 HydrophobicContact CD2-CB 4.27Å; Y41-Q103 HydrophobicContact CD2-CG 4.47Å; P42-Q103 PolarHBondContact O-NE2 2.94Å; P42-Q103 VanDerWaalsContact O-NE2 3.11Å; L45-Q103 PolarHBondContact O-NE2 3.45Å; P47-Q103 HydrophobicContact CG-CG 4.2Å; I50-Q103 HydrophobicContact CD1-CB 3.78Å; I50-Q103 HydrophobicContact CD1-CG 3.68Å; T99-Q103 PolarHBondContact O-N 3.26Å; D100-Q103 CarbonylContact O-C 3.58Å; D100-Q103 WeakPolarHBondContact O-CB 3.14Å; D100-Q103 PolarHBondContact O-N 3.32Å; Q103-R105 VanDerWaalsContact C-N 3.34Å; Q103-R105 PolarHBondContact O-N 3.07Å; Q103-R106 PolarHBondContact O-N 2.82Å; Q103-R106 VanDerWaalsContact OE1-CZ 3.25Å; Q103-R106 VanDerWaalsContact OE1-NE 3.07Å; Q103-T107 PolarHBondContact O-N 3.3Å; Q103-T107 PolarHBondContact O-OG1 2.86Å
104A96.7Very high96.5Very high10 Ų1038.2 Ų38.28%0.08320%0.195CC..Hα-helixtrans-61.9-41.1179.200000112P47 D100 G101 R108 S109 S110P47-A104 HydrophobicContact CB-CB 3.96Å; P47-A104 VanDerWaalsContact CG-CA 3.47Å; P47-A104 HydrophobicContact CG-CB 3.53Å; D100-A104 WeakPolarHBondContact O-CB 3.28Å; D100-A104 PolarHBondContact O-N 3.35Å; G101-A104 PolarHBondContact O-N 3.18Å; A104-R108 CarbonylContact O-C 3.57Å; A104-R108 WeakPolarHBondContact O-CA 3.25Å; A104-R108 PolarHBondContact O-N 3.22Å; A104-R108 VanDerWaalsContact O-N 3.14Å; A104-S109 PolarHBondContact O-N 3.43Å; A104-S110 PolarHBondContact O-N 3.4Å; A104-S110 PolarHBondContact O-OG 2.95Å
105R95.6Very high96.4Very high122 Ų12238.5 Ų38.546%0.4620%0.196SC..Hα-helixtrans-68.7-44.5174.4-74179.4-71-91.1-4.3111.9G101 K102 Q103 T107 R108 S110G101-R105 WeakPolarHBondContact O-CG 3.35Å; G101-R105 PolarHBondContact O-N 2.93Å; G101-R105 PolarHBondContact O-NE 3.3Å; G101-R105 PolarHBondContact O-NH2 3.39Å; K102-R105 VanDerWaalsContact CE-NH2 3.31Å; K102-R105 PolarHBondContact O-N 3.48Å; Q103-R105 VanDerWaalsContact C-N 3.34Å; Q103-R105 PolarHBondContact O-N 3.07Å; R105-T107 VanDerWaalsContact C-N 3.33Å; R105-T107 PolarHBondContact O-N 2.69Å; R105-R108 PolarHBondContact O-N 3.04Å; R105-S110 PolarHBondContact N-OG 2.99Å
106R95.5Very high96.4Very high96 Ų9638.6 Ų38.636%0.36220%0.196SC..Hα-helixtrans-62.4-39.1-178.5-171.5176.269.297.9-4.4112.8A38 Y41 K102 Q103A38-R106 PolarHBondContact O-NE 3.4Å; A38-R106 VanDerWaalsContact O-NE 3.16Å; A38-R106 PolarHBondContact O-NH2 3.2Å; Y41-R106 PolarHBondContact O-NH2 3.36Å; K102-R106 WeakPolarHBondContact O-CB 3.39Å; K102-R106 PolarHBondContact O-N 2.77Å; Q103-R106 PolarHBondContact O-N 2.82Å; Q103-R106 VanDerWaalsContact OE1-CZ 3.25Å; Q103-R106 VanDerWaalsContact OE1-NE 3.07Å
107T95.5Very high96.4Very high28 Ų2838.3 Ų38.317%0.17219%0.194CC..THydrogen-bonded Turntrans-93.55179.159.60000113.3Q103 R105 S109 I376Q103-T107 PolarHBondContact O-N 3.3Å; Q103-T107 PolarHBondContact O-OG1 2.86Å; R105-T107 VanDerWaalsContact C-N 3.33Å; R105-T107 PolarHBondContact O-N 2.69Å; T107-S109 PolarHBondContact O-N 3.45Å; T107-S109 PolarHBondContact OG1-OG 3.39Å; T107-I376 HydrophobicContact CG2-CD1 3.76Å
108R94.3Very high96.4Very high236 Ų23638.1 Ų38.189%0.89119%0.193SC*.THydrogen-bonded Turntrans53.535.8-177.3-55.3-179.7-178.6176.4-0.1113.4A104 R105A104-R108 CarbonylContact O-C 3.57Å; A104-R108 WeakPolarHBondContact O-CA 3.25Å; A104-R108 PolarHBondContact O-N 3.22Å; A104-R108 VanDerWaalsContact O-N 3.14Å; R105-R108 PolarHBondContact O-N 3.04Å
109S94.3Very high96.4Very high33 Ų3338.2 Ų38.223%0.23119%0.19CC..  trans-110.316.4-178.759.90000113.2P47 A104 T107 S111P47-S109 WeakPolarHBondContact CG-OG 3.36Å; A104-S109 PolarHBondContact O-N 3.43Å; T107-S109 PolarHBondContact O-N 3.45Å; T107-S109 PolarHBondContact OG1-OG 3.39Å; S109-S111 PolarHBondContact O-N 3.36Å
110S93.8Very high96.4Very high74 Ų7438.8 Ų38.852%0.51720%0.196SC..  trans-60.5129.6175.5-58.20000110.6A104 R105A104-S110 PolarHBondContact O-N 3.4Å; A104-S110 PolarHBondContact O-OG 2.95Å; R105-S110 PolarHBondContact N-OG 2.99Å
111S94.4Very high96.4Very high40 Ų4039.1 Ų39.128%0.2820%0.199SC..  trans-153.1159.8-176.663.40000111.3S109 L113 G114 E115S109-S111 PolarHBondContact O-N 3.36Å; S111-L113 PolarHBondContact O-N 3.27Å; S111-G114 PolarHBondContact O-N 3.24Å; S111-G114 PolarHBondContact OG-N 3.3Å; S111-E115 PolarHBondContact O-N 3.44Å
112A94.9Very high96.4Very high7 Ų739 Ų396%0.05819%0.194CC..Hα-helixtrans-59.9-29.6171.300000112.4L12 Y15 L116 L304 L369L12-A112 HydrophobicContact CD1-CB 3.53Å; Y15-A112 HydrophobicContact CD1-CB 3.7Å; Y15-A112 HydrophobicContact CE1-CB 4.33Å; Y15-A112 HydrophobicContact CG-CB 4.28Å; A112-L116 PolarHBondContact O-N 2.86Å; A112-L304 HydrophobicContact CB-CD1 4.5Å; A112-L304 HydrophobicContact CB-CD2 4.23Å; A112-L304 WeakPolarHBondContact O-CD1 3.47Å; A112-L369 HydrophobicContact CB-CD1 4.49Å
113L96.6Very high96.5Very high0 Ų037.6 Ų37.60%019%0.188CC..Hα-helixtrans-62.8-46.8174.218058.8000111.5S111 E115 L116 F117 V362 I365 L369 I371 V373S111-L113 PolarHBondContact O-N 3.27Å; L113-E115 VanDerWaalsContact C-N 3.27Å; L113-E115 PolarHBondContact O-N 3.37Å; L113-L116 PolarHBondContact O-N 3.14Å; L113-F117 VanDerWaalsContact O-CB 3.3Å; L113-F117 WeakPolarHBondContact O-CB 3.29Å; L113-F117 PolarHBondContact O-N 3.17Å; L113-V362 HydrophobicContact CD1-CB 4.28Å; L113-V362 HydrophobicContact CD1-CG1 4.11Å; L113-V362 HydrophobicContact CD1-CG2 4.18Å; L113-I365 HydrophobicContact CB-CG2 3.62Å; L113-I365 HydrophobicContact CD1-CB 4.06Å; L113-I365 HydrophobicContact CD1-CG2 3.78Å; L113-I365 HydrophobicContact CG-CG2 4.19Å; L113-L369 HydrophobicContact CB-CD1 4.49Å; L113-I371 HydrophobicContact CB-CD1 3.64Å; L113-I371 HydrophobicContact CD2-CD1 3.54Å; L113-I371 HydrophobicContact CD2-CG1 3.96Å; L113-I371 HydrophobicContact CG-CD1 4.22Å; L113-V373 HydrophobicContact CD2-CG2 4.34Å
114G96.9Very high96.5Very high17 Ų1738.5 Ų38.518%0.17519%0.192CC..Hα-helixtrans-60.4-41-178.700000111.8N48 S111 F117 D118N48-G114 VanDerWaalsContact OD1-CA 3.25Å; N48-G114 WeakPolarHBondContact OD1-CA 3.36Å; S111-G114 PolarHBondContact O-N 3.24Å; S111-G114 PolarHBondContact OG-N 3.3Å; G114-F117 PolarHBondContact O-N 2.77Å; G114-D118 WeakPolarHBondContact O-CB 3.37Å; G114-D118 PolarHBondContact O-N 3.46Å
115E96.7Very high96.6Very high12 Ų1238.6 Ų38.66%0.05619%0.191CC..Hα-helixtrans-66.8-41.3175.6-177.4176.6-171.700113.7Y15 Y17 S111 L113 F117 H119 K164 L304Y15-E115 WeakPolarHBondContact CE1-OE2 3.5Å; Y15-E115 PolarHBondContact OH-OE1 2.93Å; Y15-E115 PolarHBondContact OH-OE2 3.35Å; Y17-E115 HydrophobicContact CD2-CG 4.3Å; Y17-E115 VanDerWaalsContact CD2-OE1 3.27Å; Y17-E115 WeakPolarHBondContact CD2-OE1 3.46Å; Y17-E115 WeakPolarHBondContact CD2-OE2 3.3Å; Y17-E115 VanDerWaalsContact CE2-CD 3.49Å; Y17-E115 HydrophobicContact CE2-CG 4.17Å; Y17-E115 VanDerWaalsContact CE2-OE1 3.23Å; Y17-E115 WeakPolarHBondContact CE2-OE1 3.48Å; S111-E115 PolarHBondContact O-N 3.44Å; L113-E115 VanDerWaalsContact C-N 3.27Å; L113-E115 PolarHBondContact O-N 3.37Å; E115-F117 PolarHBondContact O-N 3.01Å; E115-H119 PolarHBondContact O-N 3.29Å; E115-K164 WeakPolarHBondContact OE1-CE 3.35Å; E115-K164 IonicContact OE1-NZ 2.51Å; E115-K164 PolarHBondContact OE1-NZ 3.34Å; E115-K164 IonicContact OE2-NZ 3.92Å; E115-L304 HydrophobicContact CG-CD2 4.49Å; E115-L304 WeakPolarHBondContact OE2-CD2 3.33Å
116L97.5Very high96.6Very high8 Ų834 Ų344%0.04218%0.177CC..Hα-helixtrans-60.8-40.1172.8177.961.7000111.2A112 L113 G120 I300 V301 L304 V361 I365A112-L116 PolarHBondContact O-N 2.86Å; L113-L116 PolarHBondContact O-N 3.14Å; L116-G120 WeakPolarHBondContact O-CA 3.4Å; L116-G120 PolarHBondContact O-N 3.06Å; L116-I300 HydrophobicContact CD1-CB 4.01Å; L116-I300 HydrophobicContact CD1-CG2 3.6Å; L116-V301 HydrophobicContact CD1-CG2 3.7Å; L116-V301 HydrophobicContact CD2-CG2 3.83Å; L116-V301 HydrophobicContact CG-CG2 4.45Å; L116-L304 HydrophobicContact CB-CD1 3.66Å; L116-L304 HydrophobicContact CD1-CD1 4.46Å; L116-L304 HydrophobicContact CG-CD1 4.48Å; L116-V361 HydrophobicContact CD2-CG1 3.97Å; L116-V361 HydrophobicContact CD2-CG2 4.16Å; L116-I365 HydrophobicContact CD2-CD1 3.4Å
117F97.9Very high96.7Very high22 Ų2229.5 Ų29.510%0.09616%0.16CC..Hα-helixtrans-68.7-47.8-174.9-160.4-77.4000111.1N48 T51 F52 L113 G114 E115 C121 V362 V373 F374N48-F117 HydrophobicContact CB-CD1 4.08Å; N48-F117 HydrophobicContact CB-CD2 4.42Å; N48-F117 HydrophobicContact CB-CE1 4.37Å; N48-F117 HydrophobicContact CB-CG 4.11Å; N48-F117 WeakPolarHBondContact O-CE1 3.44Å; T51-F117 HydrophobicContact CG2-CD1 3.81Å; T51-F117 HydrophobicContact CG2-CE1 4.3Å; F52-F117 HydrophobicContact CB-CE1 3.72Å; F52-F117 HydrophobicContact CB-CZ 3.91Å; F52-F117 HydrophobicContact CD2-CE1 4.21Å; F52-F117 AromaticContact CD2-CZ 3.89Å; F52-F117 HydrophobicContact CD2-CZ 3.89Å; F52-F117 HydrophobicContact CG-CE1 4.4Å; F52-F117 HydrophobicContact CG-CZ 4.18Å; L113-F117 VanDerWaalsContact O-CB 3.3Å; L113-F117 WeakPolarHBondContact O-CB 3.29Å; L113-F117 PolarHBondContact O-N 3.17Å; G114-F117 PolarHBondContact O-N 2.77Å; E115-F117 PolarHBondContact O-N 3.01Å; F117-C121 WeakPolarHBondContact O-CB 3.46Å; F117-C121 PolarHBondContact O-N 3.32Å; F117-C121 VanDerWaalsContact O-N 3.08Å; F117-C121 PolarHBondContact O-SG 3.25Å; F117-C121 VanDerWaalsContact O-SG 3.4Å; F117-V362 HydrophobicContact CD2-CG1 4.43Å; F117-V362 HydrophobicContact CD2-CG2 3.94Å; F117-V362 HydrophobicContact CE2-CG1 4.49Å; F117-V362 HydrophobicContact CE2-CG2 4.33Å; F117-V373 HydrophobicContact CD2-CG1 4.41Å; F117-V373 HydrophobicContact CE2-CG1 4.12Å; F117-F374 HydrophobicContact CE1-CE1 4.42Å; F117-F374 HydrophobicContact CE2-CE1 4.12Å; F117-F374 HydrophobicContact CE2-CZ 4.12Å; F117-F374 AromaticContact CZ-CE1 3.71Å; F117-F374 HydrophobicContact CZ-CE1 3.71Å; F117-F374 AromaticContact CZ-CZ 3.86Å; F117-F374 HydrophobicContact CZ-CZ 3.86Å
118D98Very high96.9Very high22 Ų2228.4 Ų28.412%0.11815%0.153CC..Hα-helixtrans-53.3-69.5170166.7-7.6000110.5T51 G114 G120 C121 D122T51-D118 HydrophobicContact CG2-CB 4.14Å; G114-D118 WeakPolarHBondContact O-CB 3.37Å; G114-D118 PolarHBondContact O-N 3.46Å; D118-G120 PolarHBondContact O-N 3.04Å; D118-G120 VanDerWaalsContact O-N 3.13Å; D118-C121 WeakPolarHBondContact O-CA 3.36Å; D118-C121 WeakPolarHBondContact O-CB 3.26Å; D118-C121 PolarHBondContact O-N 2.9Å; D118-D122 PolarHBondContact O-N 3.02Å
119H97.7Very high97Very high13 Ų1318.2 Ų18.26%0.0612%0.116CC..Hα-helixtrans-69.4-23.8-169.3-60.9-19.5000113.3E115 S123 F157 H161 L170 I300E115-H119 PolarHBondContact O-N 3.29Å; H119-S123 PolarHBondContact O-N 3.39Å; H119-S123 VanDerWaalsContact O-N 3.08Å; H119-F157 WeakPolarHBondContact O-CZ 3.4Å; H119-H161 AromaticContact CD2-NE2 3.74Å; H119-H161 AromaticContact CG-NE2 3.81Å; H119-L170 WeakPolarHBondContact NE2-CD2 3.36Å; H119-I300 HydrophobicContact CB-CD1 3.75Å
120G98Very high97.1Very high12 Ų1216.7 Ų16.712%0.12411%0.106CC..Hα-helixtrans-74.7-30.9172.300000113.6L116 D118 S123 C297L116-G120 WeakPolarHBondContact O-CA 3.4Å; L116-G120 PolarHBondContact O-N 3.06Å; D118-G120 PolarHBondContact O-N 3.04Å; D118-G120 VanDerWaalsContact O-N 3.13Å; G120-S123 PolarHBondContact O-OG 3.05Å; G120-C297 VanDerWaalsContact CA-SG 3.57Å
121C98.5Very high97.3Very high17 Ų1713.3 Ų13.312%0.1158%0.082CC..Hα-helixtrans-70.3-44.3168.1-82.20000110.3T51 F55 F117 D118 S123 W124 V125T51-C121 HydrophobicContact CG2-CB 4.44Å; F55-C121 HydrophobicContact CB-CB 4.02Å; F55-C121 HydrophobicContact CD2-CB 3.67Å; F55-C121 HydrophobicContact CG-CB 4.03Å; F117-C121 WeakPolarHBondContact O-CB 3.46Å; F117-C121 PolarHBondContact O-N 3.32Å; F117-C121 VanDerWaalsContact O-N 3.08Å; F117-C121 PolarHBondContact O-SG 3.25Å; F117-C121 VanDerWaalsContact O-SG 3.4Å; D118-C121 WeakPolarHBondContact O-CA 3.36Å; D118-C121 WeakPolarHBondContact O-CB 3.26Å; D118-C121 PolarHBondContact O-N 2.9Å; C121-S123 VanDerWaalsContact C-N 3.31Å; C121-S123 PolarHBondContact O-N 3.06Å; C121-W124 WeakPolarHBondContact O-CA 3.33Å; C121-W124 WeakPolarHBondContact O-CB 3.24Å; C121-W124 PolarHBondContact O-N 3.32Å; C121-V125 WeakPolarHBondContact O-CG2 3.39Å; C121-V125 PolarHBondContact O-N 2.83Å
122D97.8Very high97.4Very high19 Ų1911.4 Ų11.410%0.1027%0.069CC..Hα-helixtrans-62-33.2-178.3-10515000114.1D118 W124 V125 C126 F157D118-D122 PolarHBondContact O-N 3.02Å; D122-W124 PolarHBondContact O-N 2.82Å; D122-V125 PolarHBondContact O-N 2.98Å; D122-V125 VanDerWaalsContact O-N 3.08Å; D122-C126 PolarHBondContact O-N 3.07Å; D122-C126 PolarHBondContact O-SG 2.86Å; D122-C126 VanDerWaalsContact O-SG 3.35Å; D122-F157 HydrophobicContact CB-CE2 3.77Å; D122-F157 HydrophobicContact CB-CZ 3.79Å
123S97.9Very high97.5Very high1 Ų112.6 Ų12.61%0.0077%0.074CC..Hα-helixtrans-61.2-29.7172.959.20000112.6H119 G120 C121 S293H119-S123 PolarHBondContact O-N 3.39Å; H119-S123 VanDerWaalsContact O-N 3.08Å; G120-S123 PolarHBondContact O-OG 3.05Å; C121-S123 VanDerWaalsContact C-N 3.31Å; C121-S123 PolarHBondContact O-N 3.06Å; S123-S293 PolarHBondContact OG-OG 3.45Å
124W97.8Very high97.5Very high20 Ų2012.8 Ų12.88%0.0767%0.074CC..Hα-helixtrans-83.6-33.2170.4-102.4-9.3000113F55 C121 D122 C126 L127 F128 T290 T351 H354 L355F55-W124 HydrophobicContact CE1-CE3 4.42Å; F55-W124 HydrophobicContact CE1-CZ3 4.49Å; F55-W124 HydrophobicContact CE2-CB 3.9Å; F55-W124 HydrophobicContact CE2-CD2 4.43Å; F55-W124 AromaticContact CE2-CE3 3.65Å; F55-W124 HydrophobicContact CE2-CE3 3.65Å; F55-W124 HydrophobicContact CE2-CZ3 4.48Å; F55-W124 HydrophobicContact CZ-CD2 4.37Å; F55-W124 AromaticContact CZ-CE3 3.31Å; F55-W124 HydrophobicContact CZ-CE3 3.31Å; F55-W124 AromaticContact CZ-CZ3 3.71Å; F55-W124 HydrophobicContact CZ-CZ3 3.71Å; C121-W124 WeakPolarHBondContact O-CA 3.33Å; C121-W124 WeakPolarHBondContact O-CB 3.24Å; C121-W124 PolarHBondContact O-N 3.32Å; D122-W124 PolarHBondContact O-N 2.82Å; W124-C126 PolarHBondContact O-N 3.5Å; W124-L127 WeakPolarHBondContact O-CA 3.42Å; W124-L127 WeakPolarHBondContact O-CB 3.36Å; W124-L127 PolarHBondContact O-N 3.26Å; W124-F128 HydrophobicContact CB-CE2 4.03Å; W124-F128 HydrophobicContact CB-CZ 4.32Å; W124-F128 HydrophobicContact CD2-CZ 4.47Å; W124-F128 HydrophobicContact CG-CZ 4.39Å; W124-F128 PolarHBondContact O-N 3.46Å; W124-T290 HydrophobicContact CZ2-CG2 3.98Å; W124-T290 PolarHBondContact NE1-OG1 3.08Å; W124-T351 HydrophobicContact CZ2-CG2 4.37Å; W124-H354 AromaticContact CD2-CD2 3.94Å; W124-H354 AromaticContact CD2-NE2 3.87Å; W124-H354 AromaticContact CE2-CD2 3.39Å; W124-H354 AromaticContact CE2-NE2 3.73Å; W124-H354 AromaticContact CH2-CD2 3.69Å; W124-H354 AromaticContact CZ2-CD2 3.29Å; W124-H354 WeakPolarHBondContact CZ2-CD2 3.45Å; W124-H354 AromaticContact NE1-CD2 3.89Å; W124-L355 HydrophobicContact CH2-CD2 3.52Å; W124-L355 HydrophobicContact CH2-CG 3.83Å; W124-L355 HydrophobicContact CZ3-CD2 3.66Å; W124-L355 HydrophobicContact CZ3-CG 4.46Å
125V98.3Very high97.5Very high12 Ų1212 Ų127%0.0737%0.066CC..Hα-helixtrans-57-33.8173.7177.10000111.3F55 T58 C121 D122 L127 F128 L129F55-V125 HydrophobicContact CD2-CG2 4.35Å; T58-V125 HydrophobicContact CG2-CG1 4.01Å; T58-V125 HydrophobicContact CG2-CG2 3.92Å; C121-V125 WeakPolarHBondContact O-CG2 3.39Å; C121-V125 PolarHBondContact O-N 2.83Å; D122-V125 PolarHBondContact O-N 2.98Å; D122-V125 VanDerWaalsContact O-N 3.08Å; V125-L127 PolarHBondContact O-N 3.42Å; V125-F128 PolarHBondContact O-N 2.98Å; V125-F128 VanDerWaalsContact O-N 3.08Å; V125-L129 WeakPolarHBondContact O-CB 3.29Å; V125-L129 PolarHBondContact O-N 3.43Å
126C97Very high97.5Very high24 Ų2411.4 Ų11.416%0.1626%0.063CC..Hα-helixtrans-52.7-35.6171.4-68.50000113.3D122 W124 A130 Q150 F154D122-C126 PolarHBondContact O-N 3.07Å; D122-C126 PolarHBondContact O-SG 2.86Å; D122-C126 VanDerWaalsContact O-SG 3.35Å; W124-C126 PolarHBondContact O-N 3.5Å; C126-A130 WeakPolarHBondContact O-CB 3.49Å; C126-A130 PolarHBondContact O-N 2.88Å; C126-Q150 PolarHBondContact O-NE2 3.23Å; C126-F154 HydrophobicContact CB-CD1 3.84Å; C126-F154 HydrophobicContact CB-CE1 3.67Å
127L97.6Very high97.4Very high2 Ų211 Ų111%0.016%0.062CC..Hα-helixtrans-72.3-50.2173.9177.657.9000111.4W124 V125 A130 G131 F154 F286W124-L127 WeakPolarHBondContact O-CA 3.42Å; W124-L127 WeakPolarHBondContact O-CB 3.36Å; W124-L127 PolarHBondContact O-N 3.26Å; V125-L127 PolarHBondContact O-N 3.42Å; L127-A130 PolarHBondContact O-N 3.37Å; L127-G131 PolarHBondContact O-N 2.94Å; L127-F154 HydrophobicContact CB-CE1 4.33Å; L127-F154 HydrophobicContact CB-CZ 3.84Å; L127-F154 HydrophobicContact CD1-CZ 4.31Å; L127-F286 HydrophobicContact CD2-CB 4.31Å; L127-F286 HydrophobicContact CD2-CD2 3.6Å; L127-F286 HydrophobicContact CD2-CE2 4.06Å; L127-F286 HydrophobicContact CD2-CG 3.97Å; L127-F286 HydrophobicContact CG-CD2 4.46Å
128F98.4Very high97.1Very high6 Ų610 Ų103%0.0266%0.057CC..Hα-helixtrans-67.8-40.4-171.7-58.9-32.6000112.3F55 T58 V59 Y62 W124 V125 S132 F286F55-F128 AromaticContact CE2-CE2 3.68Å; F55-F128 HydrophobicContact CE2-CE2 3.68Å; F55-F128 AromaticContact CZ-CE2 3.95Å; F55-F128 HydrophobicContact CZ-CE2 3.95Å; T58-F128 WeakPolarHBondContact OG1-CD2 3.23Å; V59-F128 HydrophobicContact CG2-CD2 4.12Å; V59-F128 HydrophobicContact CG2-CE2 3.47Å; V59-F128 VanDerWaalsContact CG2-CE2 3.47Å; V59-F128 HydrophobicContact CG2-CZ 3.92Å; Y62-F128 AromaticContact CD1-CD1 3.73Å; Y62-F128 HydrophobicContact CD1-CD1 3.73Å; Y62-F128 HydrophobicContact CD1-CE1 4.17Å; Y62-F128 HydrophobicContact CD2-CB 4.39Å; Y62-F128 HydrophobicContact CD2-CD1 4.15Å; Y62-F128 HydrophobicContact CE1-CD1 4.24Å; Y62-F128 HydrophobicContact CE1-CE1 4.49Å; Y62-F128 HydrophobicContact CG-CB 4.21Å; Y62-F128 AromaticContact CG-CD1 3.69Å; Y62-F128 HydrophobicContact CG-CD1 3.69Å; Y62-F128 HydrophobicContact CG-CG 4.27Å; W124-F128 HydrophobicContact CB-CE2 4.03Å; W124-F128 HydrophobicContact CB-CZ 4.32Å; W124-F128 HydrophobicContact CD2-CZ 4.47Å; W124-F128 HydrophobicContact CG-CZ 4.39Å; W124-F128 PolarHBondContact O-N 3.46Å; V125-F128 PolarHBondContact O-N 2.98Å; V125-F128 VanDerWaalsContact O-N 3.08Å; F128-S132 WeakPolarHBondContact O-CB 3.49Å; F128-S132 PolarHBondContact O-N 2.75Å; F128-S132 PolarHBondContact O-OG 3.39Å; F128-F286 AromaticContact CE1-CE2 3.91Å; F128-F286 HydrophobicContact CE1-CE2 3.91Å
129L96.9Very high96.6Very high21 Ų2113.2 Ų13.211%0.117%0.074CC..Hα-helixtrans-68.6-44.7177.7-164.269.5000111.2V90 V125 S132 M133 V183V90-L129 HydrophobicContact CG1-CD1 3.99Å; V90-L129 HydrophobicContact CG2-CD1 4.05Å; V125-L129 WeakPolarHBondContact O-CB 3.29Å; V125-L129 PolarHBondContact O-N 3.43Å; L129-S132 PolarHBondContact O-N 2.92Å; L129-M133 PolarHBondContact O-N 3.33Å; L129-V183 HydrophobicContact CD1-CB 4.32Å; L129-V183 HydrophobicContact CD1-CG1 3.59Å; L129-V183 HydrophobicContact CD2-CG2 4.45Å; L129-V183 HydrophobicContact CG-CG1 4.23Å
130A96.8Very high96.3Very high2 Ų214.8 Ų14.82%0.0178%0.083CC..Hα-helixtrans-59.3-51.2175.900000111.6C126 L127 S132 M133 F134 L153C126-A130 WeakPolarHBondContact O-CB 3.49Å; C126-A130 PolarHBondContact O-N 2.88Å; L127-A130 PolarHBondContact O-N 3.37Å; A130-S132 PolarHBondContact O-N 2.94Å; A130-M133 PolarHBondContact O-N 2.8Å; A130-M133 VanDerWaalsContact O-N 3.13Å; A130-F134 HydrophobicContact CB-CE2 4.1Å; A130-F134 VanDerWaalsContact O-CD2 3.28Å; A130-F134 WeakPolarHBondContact O-CD2 3.17Å; A130-F134 VanDerWaalsContact O-CG 3.28Å; A130-F134 WeakPolarHBondContact O-CG 3.43Å; A130-F134 PolarHBondContact O-N 3.45Å; A130-L153 HydrophobicContact CB-CD1 3.49Å; A130-L153 VanDerWaalsContact CB-CD1 3.49Å
131G97.5Very high96Very high2 Ų214.9 Ų14.92%0.0218%0.08CC..Hα-helixtrans-59.6-36.4176.400000112.4F72 L127 F134 S135F72-G131 VanDerWaalsContact CE1-O 3.31Å; F72-G131 WeakPolarHBondContact CE1-O 3.45Å; L127-G131 PolarHBondContact O-N 2.94Å; G131-F134 PolarHBondContact O-N 2.99Å; G131-S135 PolarHBondContact O-N 2.86Å; G131-S135 PolarHBondContact O-OG 3.08Å
132S97.6Very high95.7Very high0 Ų017.1 Ų17.10%09%0.093CC..Hα-helixtrans-66.3-43.8175.5-58.40000111.5H61 F128 L129 A130 S135 L136H61-S132 PolarHBondContact CE1-OG 3.24Å; H61-S132 PolarHBondContact ND1-OG 3.27Å; F128-S132 WeakPolarHBondContact O-CB 3.49Å; F128-S132 PolarHBondContact O-N 2.75Å; F128-S132 PolarHBondContact O-OG 3.39Å; L129-S132 PolarHBondContact O-N 2.92Å; A130-S132 PolarHBondContact O-N 2.94Å; S132-S135 VanDerWaalsContact O-CB 3.27Å; S132-S135 WeakPolarHBondContact O-CB 3.4Å; S132-S135 PolarHBondContact O-N 2.93Å; S132-S135 VanDerWaalsContact O-N 3.13Å; S132-L136 PolarHBondContact O-N 2.88Å
133M96.4Very high95.7Very high32 Ų3216.3 Ų16.316%0.1589%0.088CC..Hα-helixtrans-63.2-41.9175.2-75.7-62.2-70.200112.6L129 A130 S135 L136 L137 V183 V186 F187 F212L129-M133 PolarHBondContact O-N 3.33Å; A130-M133 PolarHBondContact O-N 2.8Å; A130-M133 VanDerWaalsContact O-N 3.13Å; M133-S135 PolarHBondContact O-N 2.83Å; M133-L136 PolarHBondContact O-N 3.39Å; M133-L136 VanDerWaalsContact O-N 3.14Å; M133-L137 HydrophobicContact CE-CD1 3.76Å; M133-L137 PolarHBondContact O-N 3.44Å; M133-V183 HydrophobicContact CG-CG1 4.12Å; M133-V183 HydrophobicContact CG-CG2 4.14Å; M133-V183 HydrophobicContact SD-CB 4.34Å; M133-V183 HydrophobicContact SD-CG1 3.74Å; M133-V183 HydrophobicContact SD-CG2 3.93Å; M133-V186 HydrophobicContact CE-CG1 4.3Å; M133-V186 HydrophobicContact SD-CG1 4.3Å; M133-F187 HydrophobicContact SD-CE2 4.22Å; M133-F187 HydrophobicContact SD-CZ 4.25Å; M133-F212 HydrophobicContact CE-CD2 4.46Å
134F97Very high95.6Very high4 Ų421.8 Ų21.82%0.01811%0.109CC..Hα-helixtrans-64.1-30173.3-60.9-33.5000112.2F72 A130 G131 L136 G138 Y141 M146 Q150 L285F72-F134 HydrophobicContact CD1-CB 3.58Å; F72-F134 HydrophobicContact CE1-CB 3.64Å; F72-F134 HydrophobicContact CG-CB 4.21Å; F72-F134 HydrophobicContact CZ-CB 4.3Å; F72-F134 HydrophobicContact CZ-CD2 4.47Å; A130-F134 HydrophobicContact CB-CE2 4.1Å; A130-F134 VanDerWaalsContact O-CD2 3.28Å; A130-F134 WeakPolarHBondContact O-CD2 3.17Å; A130-F134 VanDerWaalsContact O-CG 3.28Å; A130-F134 WeakPolarHBondContact O-CG 3.43Å; A130-F134 PolarHBondContact O-N 3.45Å; G131-F134 PolarHBondContact O-N 2.99Å; F134-L136 PolarHBondContact O-N 2.99Å; F134-G138 WeakPolarHBondContact O-CA 3.28Å; F134-G138 PolarHBondContact O-N 3.16Å; F134-Y141 HydrophobicContact CE1-CD1 4.4Å; F134-Y141 HydrophobicContact CE1-CE1 4.31Å; F134-M146 HydrophobicContact CB-CE 4.47Å; F134-M146 HydrophobicContact CB-CG 4.48Å; F134-M146 HydrophobicContact CB-SD 4.27Å; F134-M146 HydrophobicContact CD1-CB 4.35Å; F134-M146 HydrophobicContact CD1-CG 4.02Å; F134-M146 HydrophobicContact CD2-CB 4.08Å; F134-M146 HydrophobicContact CD2-CG 4.33Å; F134-M146 HydrophobicContact CE1-CB 4.3Å; F134-M146 HydrophobicContact CE1-CG 4.34Å; F134-M146 HydrophobicContact CE2-CB 4.02Å; F134-M146 HydrophobicContact CG-CB 4.26Å; F134-M146 HydrophobicContact CG-CG 4.03Å; F134-M146 HydrophobicContact CG-SD 4.4Å; F134-M146 HydrophobicContact CZ-CB 4.14Å; F134-M146 WeakPolarHBondContact CZ-O 3.24Å; F134-Q150 HydrophobicContact CE2-CB 4.25Å; F134-L285 HydrophobicContact CD2-CD1 4.29Å; F134-L285 HydrophobicContact CE2-CD1 4.28Å
135S96.8Very high95.5Very high0 Ų023.2 Ų23.20%012%0.116CC..Hα-helixtrans-67.7-27.4175.5-52.20000112.6N69 T75 G131 S132 M133 R282N69-S135 PolarHBondContact ND2-O 2.87Å; T75-S135 WeakPolarHBondContact CG2-O 3.42Å; G131-S135 PolarHBondContact O-N 2.86Å; G131-S135 PolarHBondContact O-OG 3.08Å; S132-S135 VanDerWaalsContact O-CB 3.27Å; S132-S135 WeakPolarHBondContact O-CB 3.4Å; S132-S135 PolarHBondContact O-N 2.93Å; S132-S135 VanDerWaalsContact O-N 3.13Å; M133-S135 PolarHBondContact O-N 2.83Å; S135-R282 PolarHBondContact OG-NH1 3.06Å; S135-R282 PolarHBondContact OG-NH2 3.21Å
136L96.5Very high95.4Very high0 Ų022.6 Ų22.60%011%0.113CC..Hα-helixtrans-88-40.3177.218065.2000112.1T75 W83 S132 M133 F134 V186 F187 A190 P195 F198T75-L136 WeakPolarHBondContact CG2-O 3.46Å; W83-L136 HydrophobicContact CD2-CD1 4.36Å; W83-L136 HydrophobicContact CE3-CD1 4.09Å; W83-L136 HydrophobicContact CH2-CB 4.3Å; W83-L136 HydrophobicContact CH2-CD1 3.89Å; W83-L136 HydrophobicContact CZ2-CD1 4.17Å; W83-L136 HydrophobicContact CZ3-CB 4.05Å; W83-L136 HydrophobicContact CZ3-CD1 3.85Å; S132-L136 PolarHBondContact O-N 2.88Å; M133-L136 PolarHBondContact O-N 3.39Å; M133-L136 VanDerWaalsContact O-N 3.14Å; F134-L136 PolarHBondContact O-N 2.99Å; L136-V186 HydrophobicContact CD2-CG1 3.34Å; L136-F187 HydrophobicContact CB-CE1 4Å; L136-F187 HydrophobicContact CD2-CD1 4.1Å; L136-F187 HydrophobicContact CD2-CE1 4.05Å; L136-A190 HydrophobicContact CD1-CB 3.61Å; L136-A190 HydrophobicContact CD2-CB 4.24Å; L136-P195 HydrophobicContact CD1-CB 3.64Å; L136-P195 HydrophobicContact CD1-CG 3.77Å; L136-F198 HydrophobicContact CD1-CE2 4.45Å; L136-F198 HydrophobicContact CD2-CD2 4.25Å; L136-F198 HydrophobicContact CD2-CE2 3.96Å; L136-F198 HydrophobicContact CG-CD2 4.42Å
137L94.7Very high95.5Very high1 Ų121.5 Ų21.51%0.00511%0.105CC..Hα-helixtrans-1078.4-169.7-56.7179.7000113.7M133 N139 I140 Y141 F198 A209 F212M133-L137 HydrophobicContact CE-CD1 3.76Å; M133-L137 PolarHBondContact O-N 3.44Å; L137-N139 PolarHBondContact O-N 3.13Å; L137-I140 PolarHBondContact O-N 3.2Å; L137-Y141 HydrophobicContact CB-CD2 4.09Å; L137-Y141 HydrophobicContact CB-CE2 3.79Å; L137-Y141 HydrophobicContact CD1-CE2 4.32Å; L137-Y141 WeakPolarHBondContact O-CD2 3.41Å; L137-F198 HydrophobicContact CD2-CB 3.75Å; L137-F198 HydrophobicContact CD2-CD2 4.3Å; L137-F198 HydrophobicContact CD2-CG 4.02Å; L137-A209 HydrophobicContact CD2-CB 3.99Å; L137-F212 HydrophobicContact CD1-CD2 3.88Å
138G91.3Very high95.4Very high0 Ų024.4 Ų24.40%012%0.119CC..G310 helixtrans-53.2-35.7-167.500000114.6F73 F134 I140 Y141 M146F73-G138 VanDerWaalsContact CE1-O 3.3Å; F73-G138 WeakPolarHBondContact CE1-O 3.47Å; F134-G138 WeakPolarHBondContact O-CA 3.28Å; F134-G138 PolarHBondContact O-N 3.16Å; G138-I140 PolarHBondContact O-N 3.49Å; G138-Y141 PolarHBondContact O-N 2.82Å; G138-Y141 VanDerWaalsContact O-N 3.11Å; G138-M146 VanDerWaalsContact CA-CE 3.47Å
139N88.8Confident95.4Very high90 Ų9024.1 Ų24.148%0.48112%0.118SC..G310 helixtrans-66.3-7.7179.8-62.5-23.6000115.2F73 T75 L137 M199F73-N139 PolarHBondContact O-OD1 3.44Å; T75-N139 PolarHBondContact OG1-ND2 2.97Å; L137-N139 PolarHBondContact O-N 3.13Å; N139-M199 HydrophobicContact CB-CE 4.28Å
140I90Very high95.4Very high46 Ų4623.2 Ų23.224%0.23611%0.114CC..G310 helixtrans-107.6-14.5177.2-58.2-66.1000112.3L137 G138 M199 A209 K213L137-I140 PolarHBondContact O-N 3.2Å; G138-I140 PolarHBondContact O-N 3.49Å; I140-M199 HydrophobicContact CD1-CE 4.35Å; I140-M199 HydrophobicContact CD1-SD 3.53Å; I140-M199 VanDerWaalsContact CD1-SD 3.53Å; I140-M199 HydrophobicContact CG1-CE 3.56Å; I140-M199 HydrophobicContact CG1-SD 3.14Å; I140-M199 WeakPolarHBondContact CG1-SD 3.5Å; I140-A209 HydrophobicContact CB-CB 4.18Å; I140-A209 HydrophobicContact CG1-CB 3.77Å; I140-A209 HydrophobicContact CG2-CB 4.1Å; I140-K213 PolarHBondContact O-NZ 2.97Å
141Y91.7Very high95.5Very high14 Ų1423.4 Ų23.46%0.05511%0.114CC..SBendtrans-101131.4176.2-70.3-95.1000108.9F134 L137 G138 E145 M146 K213F134-Y141 HydrophobicContact CE1-CD1 4.4Å; F134-Y141 HydrophobicContact CE1-CE1 4.31Å; L137-Y141 HydrophobicContact CB-CD2 4.09Å; L137-Y141 HydrophobicContact CB-CE2 3.79Å; L137-Y141 HydrophobicContact CD1-CE2 4.32Å; L137-Y141 WeakPolarHBondContact O-CD2 3.41Å; G138-Y141 PolarHBondContact O-N 2.82Å; G138-Y141 VanDerWaalsContact O-N 3.11Å; Y141-E145 WeakPolarHBondContact CA-OE2 3.47Å; Y141-E145 HydrophobicContact CD1-CB 3.91Å; Y141-M146 HydrophobicContact CG-CG 4.35Å; Y141-K213 HydrophobicContact CD1-CD 3.83Å; Y141-K213 HydrophobicContact CD1-CG 4.35Å; Y141-K213 HydrophobicContact CE1-CB 3.99Å; Y141-K213 HydrophobicContact CE1-CD 3.64Å; Y141-K213 HydrophobicContact CE1-CG 3.66Å; Y141-K213 WeakPolarHBondContact OH-CA 3.21Å
142T94.1Very high95.4Very high64 Ų6423.6 Ų23.639%0.39312%0.115SC..  trans-68.8156.4157.676.30000108.6R144 E145 M146T142-R144 PolarHBondContact O-N 2.89Å; T142-E145 PolarHBondContact N-OE2 3.44Å; T142-E145 WeakPolarHBondContact O-CA 3.46Å; T142-E145 WeakPolarHBondContact O-CB 3.43Å; T142-E145 PolarHBondContact O-N 3.03Å; T142-E145 WeakPolarHBondContact OG1-CG 3.36Å; T142-E145 PolarHBondContact OG1-N 3.38Å; T142-M146 PolarHBondContact O-N 2.79Å
143V96Very high95.4Very high1 Ų126.4 Ų26.41%0.00613%0.129CC..Hα-helixtrans-55.3-39.3176.1175.50000111.8F73 E145 M146 F147 L277 E278 T281F73-V143 HydrophobicContact CE2-CG2 3.78Å; F73-V143 HydrophobicContact CZ-CG2 3.56Å; V143-E145 VanDerWaalsContact C-N 3.33Å; V143-E145 PolarHBondContact O-N 3.16Å; V143-M146 WeakPolarHBondContact O-CB 3.48Å; V143-M146 PolarHBondContact O-N 3.1Å; V143-F147 PolarHBondContact O-N 3.38Å; V143-L277 HydrophobicContact CG1-CD1 3.7Å; V143-L277 HydrophobicContact CG1-CD2 4.12Å; V143-L277 HydrophobicContact CG1-CG 3.48Å; V143-L277 VanDerWaalsContact CG1-CG 3.48Å; V143-L277 VanDerWaalsContact CG1-O 3.28Å; V143-L277 WeakPolarHBondContact CG1-O 3.48Å; V143-E278 WeakPolarHBondContact CB-OE2 3.33Å; V143-E278 WeakPolarHBondContact CG2-OE2 3.32Å; V143-T281 HydrophobicContact CG1-CG2 3.59Å; V143-T281 WeakPolarHBondContact CG1-OG1 3.43Å
144R96.1Very high95.4Very high116 Ų11625.2 Ų25.244%0.43812%0.123SC..Hα-helixtrans-60.2-38172.8-68.6-171.8-67-81.22.6113.7T142 F147 M148 L277 E278T142-R144 PolarHBondContact O-N 2.89Å; R144-F147 WeakPolarHBondContact O-CB 3.49Å; R144-F147 PolarHBondContact O-N 2.68Å; R144-M148 VanDerWaalsContact O-CG 3.31Å; R144-M148 WeakPolarHBondContact O-CG 3.12Å; R144-M148 PolarHBondContact O-N 3.32Å; R144-L277 HydrophobicContact CG-CD2 4.36Å; R144-E278 IonicContact NH1-OE1 3.26Å
145E95.8Very high95.4Very high50 Ų5026.8 Ų26.823%0.23413%0.131CC..Hα-helixtrans-70.3-34.5176-68.1175.4132.100111.3Y141 T142 V143 M148 G149 K213Y141-E145 WeakPolarHBondContact CA-OE2 3.47Å; Y141-E145 HydrophobicContact CD1-CB 3.91Å; T142-E145 PolarHBondContact N-OE2 3.44Å; T142-E145 WeakPolarHBondContact O-CA 3.46Å; T142-E145 WeakPolarHBondContact O-CB 3.43Å; T142-E145 PolarHBondContact O-N 3.03Å; T142-E145 WeakPolarHBondContact OG1-CG 3.36Å; T142-E145 PolarHBondContact OG1-N 3.38Å; V143-E145 VanDerWaalsContact C-N 3.33Å; V143-E145 PolarHBondContact O-N 3.16Å; E145-M148 PolarHBondContact O-N 3.39Å; E145-G149 PolarHBondContact O-N 3.08Å; E145-K213 VanDerWaalsContact CD-NZ 3.26Å; E145-K213 IonicContact OE1-NZ 3.76Å; E145-K213 PolarHBondContact OE1-NZ 3.37Å; E145-K213 IonicContact OE2-NZ 3.08Å; E145-K213 PolarHBondContact OE2-NZ 3.07Å
146M97Very high95.4Very high0 Ų027.8 Ų27.80%014%0.138CC..Hα-helixtrans-62.5-44.6171.5-60.1177.9-179.900111F72 F73 F134 G138 Y141 T142 V143 G149 Q150 T281 L285F72-M146 HydrophobicContact CB-CE 3.86Å; F72-M146 HydrophobicContact CB-SD 4.17Å; F72-M146 HydrophobicContact CD2-SD 3.83Å; F72-M146 HydrophobicContact CE2-SD 4.38Å; F72-M146 HydrophobicContact CG-CE 4.37Å; F72-M146 HydrophobicContact CG-SD 4.08Å; F73-M146 HydrophobicContact CE1-CE 3.81Å; F73-M146 HydrophobicContact CZ-CE 3.83Å; F134-M146 HydrophobicContact CB-CE 4.47Å; F134-M146 HydrophobicContact CB-CG 4.48Å; F134-M146 HydrophobicContact CB-SD 4.27Å; F134-M146 HydrophobicContact CD1-CB 4.35Å; F134-M146 HydrophobicContact CD1-CG 4.02Å; F134-M146 HydrophobicContact CD2-CB 4.08Å; F134-M146 HydrophobicContact CD2-CG 4.33Å; F134-M146 HydrophobicContact CE1-CB 4.3Å; F134-M146 HydrophobicContact CE1-CG 4.34Å; F134-M146 HydrophobicContact CE2-CB 4.02Å; F134-M146 HydrophobicContact CG-CB 4.26Å; F134-M146 HydrophobicContact CG-CG 4.03Å; F134-M146 HydrophobicContact CG-SD 4.4Å; F134-M146 HydrophobicContact CZ-CB 4.14Å; F134-M146 WeakPolarHBondContact CZ-O 3.24Å; G138-M146 VanDerWaalsContact CA-CE 3.47Å; Y141-M146 HydrophobicContact CG-CG 4.35Å; T142-M146 PolarHBondContact O-N 2.79Å; V143-M146 WeakPolarHBondContact O-CB 3.48Å; V143-M146 PolarHBondContact O-N 3.1Å; M146-G149 PolarHBondContact O-N 3.31Å; M146-Q150 WeakPolarHBondContact O-CB 3.32Å; M146-Q150 PolarHBondContact O-N 3.28Å; M146-T281 HydrophobicContact SD-CG2 4.32Å; M146-L285 HydrophobicContact CB-CD1 4.25Å
147F97.8Very high95.4Very high1 Ų128.9 Ų28.90%0.00414%0.142CC..Hα-helixtrans-58.9-48.5175.1173.4-105.1000112.2V143 R144 W151 Y266 A269 L277 F284 L285V143-F147 PolarHBondContact O-N 3.38Å; R144-F147 WeakPolarHBondContact O-CB 3.49Å; R144-F147 PolarHBondContact O-N 2.68Å; F147-W151 AromaticContact CD2-CD1 3.92Å; F147-W151 AromaticContact CD2-NE1 3.98Å; F147-W151 AromaticContact CE1-CD1 3.93Å; F147-W151 AromaticContact CE2-CD1 3.47Å; F147-W151 VanDerWaalsContact CE2-CD1 3.47Å; F147-W151 AromaticContact CE2-NE1 3.15Å; F147-W151 AromaticContact CZ-CD1 3.48Å; F147-W151 VanDerWaalsContact CZ-CD1 3.48Å; F147-W151 AromaticContact CZ-NE1 3.26Å; F147-W151 VanDerWaalsContact CZ-NE1 3.26Å; F147-W151 PolarHBondContact O-N 3.24Å; F147-Y266 AromaticContact CE1-CD1 3.98Å; F147-Y266 HydrophobicContact CE1-CD1 3.98Å; F147-Y266 AromaticContact CE1-CD2 3.92Å; F147-Y266 HydrophobicContact CE1-CD2 3.92Å; F147-Y266 AromaticContact CE1-CE1 3.88Å; F147-Y266 HydrophobicContact CE1-CE1 3.88Å; F147-Y266 AromaticContact CE1-CE2 3.82Å; F147-Y266 HydrophobicContact CE1-CE2 3.82Å; F147-Y266 AromaticContact CE1-CG 3.99Å; F147-Y266 HydrophobicContact CE1-CG 3.99Å; F147-Y266 AromaticContact CE1-CZ 3.8Å; F147-Y266 HydrophobicContact CZ-CD2 4.11Å; F147-Y266 HydrophobicContact CZ-CE2 4.29Å; F147-Y266 HydrophobicContact CZ-CG 4.35Å; F147-A269 HydrophobicContact CD1-CB 4.49Å; F147-A269 HydrophobicContact CE1-CB 4.2Å; F147-A269 HydrophobicContact CE2-CB 4.48Å; F147-A269 HydrophobicContact CZ-CB 4.19Å; F147-L277 HydrophobicContact CB-CD1 4.2Å; F147-L277 HydrophobicContact CB-CD2 4.02Å; F147-L277 HydrophobicContact CG-CD2 4.25Å; F147-F284 HydrophobicContact CD2-CD1 4.36Å; F147-F284 AromaticContact CD2-CE1 3.89Å; F147-F284 HydrophobicContact CD2-CE1 3.89Å; F147-F284 AromaticContact CE2-CE1 3.7Å; F147-F284 HydrophobicContact CE2-CE1 3.7Å; F147-L285 HydrophobicContact CB-CD2 4.11Å; F147-L285 HydrophobicContact CD2-CD2 3.95Å
148M97.3Very high95.5Very high62 Ų6229.1 Ų29.131%0.30514%0.144SC..Hα-helixtrans-64-44.5176.3-68.4176.1-175.700112R144 E145 Q150 W151 V152 F217 Y270R144-M148 VanDerWaalsContact O-CG 3.31Å; R144-M148 WeakPolarHBondContact O-CG 3.12Å; R144-M148 PolarHBondContact O-N 3.32Å; E145-M148 PolarHBondContact O-N 3.39Å; M148-Q150 VanDerWaalsContact C-N 3.35Å; M148-Q150 PolarHBondContact O-N 3.11Å; M148-W151 PolarHBondContact O-N 3.26Å; M148-V152 WeakPolarHBondContact O-CG2 2.94Å; M148-V152 PolarHBondContact O-N 2.88Å; M148-F217 HydrophobicContact CB-CE1 3.97Å; M148-F217 HydrophobicContact CB-CZ 4.05Å; M148-Y270 VanDerWaalsContact CE-OH 3.29Å; M148-Y270 WeakPolarHBondContact CE-OH 3.44Å
149G97.1Very high95.7Very high0 Ų030.1 Ų30.10%015%0.149CC..Hα-helixtrans-63-39.3179.700000112.7E145 M146 W151 V152 L153E145-G149 PolarHBondContact O-N 3.08Å; M146-G149 PolarHBondContact O-N 3.31Å; G149-W151 VanDerWaalsContact C-N 3.34Å; G149-W151 PolarHBondContact O-N 3.07Å; G149-V152 WeakPolarHBondContact O-CB 3.33Å; G149-V152 PolarHBondContact O-N 3.18Å; G149-L153 WeakPolarHBondContact O-CG 3.12Å; G149-L153 PolarHBondContact O-N 3.47Å; G149-L153 VanDerWaalsContact O-N 3.13Å
150Q97.8Very high96.1Very high3 Ų326.4 Ų26.41%0.01413%0.13CC..Hα-helixtrans-61.3-43.8173.6-177.366.170.600111.5C126 F134 M146 M148 L153 F154 L285C126-Q150 PolarHBondContact O-NE2 3.23Å; F134-Q150 HydrophobicContact CE2-CB 4.25Å; M146-Q150 WeakPolarHBondContact O-CB 3.32Å; M146-Q150 PolarHBondContact O-N 3.28Å; M148-Q150 VanDerWaalsContact C-N 3.35Å; M148-Q150 PolarHBondContact O-N 3.11Å; Q150-L153 PolarHBondContact O-N 2.73Å; Q150-F154 VanDerWaalsContact CD-CE2 3.44Å; Q150-F154 HydrophobicContact CG-CD2 3.81Å; Q150-F154 HydrophobicContact CG-CE2 3.35Å; Q150-F154 HydrophobicContact CG-CZ 4.23Å; Q150-F154 VanDerWaalsContact O-CD2 3.28Å; Q150-F154 WeakPolarHBondContact O-CD2 3.45Å; Q150-F154 PolarHBondContact O-N 2.92Å; Q150-L285 HydrophobicContact CB-CD2 4.3Å; Q150-L285 HydrophobicContact CG-CD2 4.5Å
151W97.7Very high96.4Very high6 Ų624.4 Ų24.42%0.02312%0.119CC..Hα-helixtrans-66.5-38.4177.1-87.3116.6000113F147 M148 G149 L153 F154 I155 V258 L261 L262 C288F147-W151 AromaticContact CD2-CD1 3.92Å; F147-W151 AromaticContact CD2-NE1 3.98Å; F147-W151 AromaticContact CE1-CD1 3.93Å; F147-W151 AromaticContact CE2-CD1 3.47Å; F147-W151 VanDerWaalsContact CE2-CD1 3.47Å; F147-W151 AromaticContact CE2-NE1 3.15Å; F147-W151 AromaticContact CZ-CD1 3.48Å; F147-W151 VanDerWaalsContact CZ-CD1 3.48Å; F147-W151 AromaticContact CZ-NE1 3.26Å; F147-W151 VanDerWaalsContact CZ-NE1 3.26Å; F147-W151 PolarHBondContact O-N 3.24Å; M148-W151 PolarHBondContact O-N 3.26Å; G149-W151 VanDerWaalsContact C-N 3.34Å; G149-W151 PolarHBondContact O-N 3.07Å; W151-L153 VanDerWaalsContact C-N 3.28Å; W151-L153 PolarHBondContact O-N 3.11Å; W151-F154 HydrophobicContact CE3-CB 4.31Å; W151-F154 PolarHBondContact O-N 2.96Å; W151-I155 HydrophobicContact CE3-CD1 4.44Å; W151-I155 HydrophobicContact CE3-CG1 4.28Å; W151-I155 WeakPolarHBondContact O-CB 3.27Å; W151-I155 WeakPolarHBondContact O-CG1 3.33Å; W151-I155 PolarHBondContact O-N 3.02Å; W151-V258 HydrophobicContact CZ3-CG2 4.01Å; W151-L261 HydrophobicContact CH2-CB 4.21Å; W151-L261 HydrophobicContact CH2-CD2 3.73Å; W151-L261 HydrophobicContact CH2-CG 3.67Å; W151-L261 HydrophobicContact CZ2-CD2 4.45Å; W151-L261 HydrophobicContact CZ2-CG 4.09Å; W151-L262 HydrophobicContact CB-CD1 4.16Å; W151-L262 HydrophobicContact CD2-CD1 3.27Å; W151-L262 HydrophobicContact CE3-CD1 3.61Å; W151-L262 HydrophobicContact CG-CD1 3.54Å; W151-L262 HydrophobicContact CH2-CB 4.17Å; W151-L262 HydrophobicContact CH2-CD1 4.24Å; W151-L262 HydrophobicContact CZ2-CB 4.37Å; W151-L262 HydrophobicContact CZ2-CD1 4.01Å; W151-L262 HydrophobicContact CZ3-CB 4.36Å; W151-L262 HydrophobicContact CZ3-CD1 4.07Å; W151-C288 HydrophobicContact CZ2-CB 4.5Å
152V97Very high96.6Very high6 Ų625.3 Ų25.34%0.03612%0.123CC..Hα-helixtrans-55.1-45.8171.9161.70000110.9M148 G149 T156 L216 F217 F220M148-V152 WeakPolarHBondContact O-CG2 2.94Å; M148-V152 PolarHBondContact O-N 2.88Å; G149-V152 WeakPolarHBondContact O-CB 3.33Å; G149-V152 PolarHBondContact O-N 3.18Å; V152-T156 WeakPolarHBondContact O-CB 3.48Å; V152-T156 PolarHBondContact O-N 2.72Å; V152-T156 PolarHBondContact O-OG1 3.32Å; V152-L216 HydrophobicContact CG1-CD1 3.83Å; V152-L216 HydrophobicContact CG1-CG 4.11Å; V152-F217 HydrophobicContact CG2-CD1 3.87Å; V152-F217 HydrophobicContact CG2-CE1 3.83Å; V152-F220 HydrophobicContact CB-CD1 4.5Å; V152-F220 HydrophobicContact CB-CG 4.31Å; V152-F220 HydrophobicContact CG1-CB 3.53Å; V152-F220 HydrophobicContact CG1-CD1 4.19Å; V152-F220 HydrophobicContact CG1-CD2 3.84Å; V152-F220 HydrophobicContact CG1-CG 3.59Å; V152-F220 HydrophobicContact CG2-CD1 3.81Å; V152-F220 HydrophobicContact CG2-CE1 4.15Å; V152-F220 HydrophobicContact CG2-CG 4.09Å
153L96.6Very high96.6Very high58 Ų5822.4 Ų22.430%0.30411%0.105SC..Hα-helixtrans-65.6-47178.8-67.5170.9000112.1A130 G149 Q150 W151 I155 T156 F157 L216A130-L153 HydrophobicContact CB-CD1 3.49Å; A130-L153 VanDerWaalsContact CB-CD1 3.49Å; G149-L153 WeakPolarHBondContact O-CG 3.12Å; G149-L153 PolarHBondContact O-N 3.47Å; G149-L153 VanDerWaalsContact O-N 3.13Å; Q150-L153 PolarHBondContact O-N 2.73Å; W151-L153 VanDerWaalsContact C-N 3.28Å; W151-L153 PolarHBondContact O-N 3.11Å; L153-I155 PolarHBondContact O-N 2.96Å; L153-T156 PolarHBondContact O-N 2.97Å; L153-F157 PolarHBondContact O-N 3.25Å; L153-L216 HydrophobicContact CD2-CD1 3.69Å; L153-L216 HydrophobicContact CG-CD1 4.1Å
154F97.3Very high96.5Very high8 Ų822.6 Ų22.64%0.03511%0.105CC..Hα-helixtrans-63.4-42.1177.7-73.6-50.2000113C126 L127 Q150 W151 T156 F157 L158 A292C126-F154 HydrophobicContact CB-CD1 3.84Å; C126-F154 HydrophobicContact CB-CE1 3.67Å; L127-F154 HydrophobicContact CB-CE1 4.33Å; L127-F154 HydrophobicContact CB-CZ 3.84Å; L127-F154 HydrophobicContact CD1-CZ 4.31Å; Q150-F154 VanDerWaalsContact CD-CE2 3.44Å; Q150-F154 HydrophobicContact CG-CD2 3.81Å; Q150-F154 HydrophobicContact CG-CE2 3.35Å; Q150-F154 HydrophobicContact CG-CZ 4.23Å; Q150-F154 VanDerWaalsContact O-CD2 3.28Å; Q150-F154 WeakPolarHBondContact O-CD2 3.45Å; Q150-F154 PolarHBondContact O-N 2.92Å; W151-F154 HydrophobicContact CE3-CB 4.31Å; W151-F154 PolarHBondContact O-N 2.96Å; F154-T156 VanDerWaalsContact C-N 3.33Å; F154-F157 PolarHBondContact O-N 2.68Å; F154-L158 VanDerWaalsContact O-CB 3.29Å; F154-L158 WeakPolarHBondContact O-CB 3.41Å; F154-L158 PolarHBondContact O-N 3.35Å; F154-A292 HydrophobicContact CB-CB 4.46Å; F154-A292 HydrophobicContact CD1-CB 4.26Å; F154-A292 HydrophobicContact CD2-CB 4.2Å; F154-A292 HydrophobicContact CG-CB 4.08Å
155I96.9Very high96.4Very high36 Ų3617.3 Ų17.319%0.1859%0.085CC..Hα-helixtrans-66.6-39.8178-65.4166.3000109.7W151 L153 F157 L158 L159 F220 L262W151-I155 HydrophobicContact CE3-CD1 4.44Å; W151-I155 HydrophobicContact CE3-CG1 4.28Å; W151-I155 WeakPolarHBondContact O-CB 3.27Å; W151-I155 WeakPolarHBondContact O-CG1 3.33Å; W151-I155 PolarHBondContact O-N 3.02Å; L153-I155 PolarHBondContact O-N 2.96Å; I155-F157 VanDerWaalsContact C-N 3.34Å; I155-F157 PolarHBondContact O-N 2.6Å; I155-L158 PolarHBondContact O-N 3.38Å; I155-L159 HydrophobicContact CG2-CD1 3.77Å; I155-L159 HydrophobicContact CG2-CG 3.88Å; I155-L159 VanDerWaalsContact O-CB 3.26Å; I155-L159 WeakPolarHBondContact O-CB 3.5Å; I155-L159 WeakPolarHBondContact O-CG 3.34Å; I155-L159 PolarHBondContact O-N 3.03Å; I155-F220 HydrophobicContact CB-CE2 4.02Å; I155-F220 HydrophobicContact CB-CZ 4.06Å; I155-F220 HydrophobicContact CD1-CZ 4.49Å; I155-F220 HydrophobicContact CG2-CE2 3.76Å; I155-F220 HydrophobicContact CG2-CZ 3.71Å; I155-L262 HydrophobicContact CD1-CD2 4.25Å
156T96Very high96.2Very high22 Ų2214.9 Ų14.914%0.1357%0.074CC..Hα-helixtrans-58.4-46.8175.2-58.30000111.6V152 L153 F154 L159 S160 F220V152-T156 WeakPolarHBondContact O-CB 3.48Å; V152-T156 PolarHBondContact O-N 2.72Å; V152-T156 PolarHBondContact O-OG1 3.32Å; L153-T156 PolarHBondContact O-N 2.97Å; F154-T156 VanDerWaalsContact C-N 3.33Å; T156-L159 PolarHBondContact O-N 3.32Å; T156-S160 PolarHBondContact O-N 2.83Å; T156-S160 PolarHBondContact O-OG 2.81Å; T156-F220 VanDerWaalsContact OG1-CD2 3.28Å; T156-F220 WeakPolarHBondContact OG1-CD2 3.22Å
157F96.6Very high95.9Very high23 Ų2315 Ų1510%0.1018%0.075CC..Hα-helixtrans-64.8-46.1177.8-172.8-92.5000112.2H119 D122 L153 F154 I155 L159 S160 H161 T296H119-F157 WeakPolarHBondContact O-CZ 3.4Å; D122-F157 HydrophobicContact CB-CE2 3.77Å; D122-F157 HydrophobicContact CB-CZ 3.79Å; L153-F157 PolarHBondContact O-N 3.25Å; F154-F157 PolarHBondContact O-N 2.68Å; I155-F157 VanDerWaalsContact C-N 3.34Å; I155-F157 PolarHBondContact O-N 2.6Å; F157-L159 VanDerWaalsContact C-N 3.35Å; F157-L159 PolarHBondContact O-N 2.9Å; F157-S160 PolarHBondContact O-N 3.33Å; F157-H161 AromaticContact CE1-CE1 3.5Å; F157-H161 VanDerWaalsContact CE1-CE1 3.5Å; F157-H161 WeakPolarHBondContact CE1-CE1 3.21Å; F157-H161 AromaticContact CE1-ND1 3.66Å; F157-H161 AromaticContact CZ-CE1 3.46Å; F157-H161 VanDerWaalsContact CZ-CE1 3.46Å; F157-H161 WeakPolarHBondContact CZ-CE1 3.37Å; F157-H161 PolarHBondContact O-ND1 2.93Å; F157-H161 VanDerWaalsContact O-ND1 3.14Å; F157-T296 HydrophobicContact CD1-CG2 3.84Å; F157-T296 HydrophobicContact CE1-CG2 3.62Å
158L96.8Very high95.5Very high6 Ų616.1 Ų16.13%0.0319%0.086CC..Hα-helixtrans-63.3-39.8177.7-173.587.7000111.6F154 I155 S160 H161 W162 V258 T296 L299F154-L158 VanDerWaalsContact O-CB 3.29Å; F154-L158 WeakPolarHBondContact O-CB 3.41Å; F154-L158 PolarHBondContact O-N 3.35Å; I155-L158 PolarHBondContact O-N 3.38Å; L158-S160 VanDerWaalsContact C-N 3.27Å; L158-S160 PolarHBondContact O-N 2.96Å; L158-H161 CarbonylContact O-C 3.5Å; L158-H161 WeakPolarHBondContact O-CA 3.44Å; L158-H161 WeakPolarHBondContact O-CB 3.47Å; L158-H161 PolarHBondContact O-N 2.94Å; L158-W162 WeakPolarHBondContact O-CB 3.35Å; L158-W162 PolarHBondContact O-N 3.38Å; L158-V258 HydrophobicContact CD2-CB 3.78Å; L158-V258 HydrophobicContact CD2-CG1 3.46Å; L158-V258 VanDerWaalsContact CD2-CG1 3.46Å; L158-V258 HydrophobicContact CD2-CG2 3.88Å; L158-T296 HydrophobicContact CD1-CG2 4.2Å; L158-T296 WeakPolarHBondContact CD1-OG1 3.33Å; L158-L299 HydrophobicContact CD1-CD2 3.97Å; L158-L299 HydrophobicContact CG-CD2 4.48Å
159L95.8Very high95.3Very high20 Ų2014.2 Ų14.211%0.1058%0.078CC..Hα-helixtrans-62.5-34.8-178.8-79177.3000112I155 T156 F157 H161 W162 E163 I225I155-L159 HydrophobicContact CG2-CD1 3.77Å; I155-L159 HydrophobicContact CG2-CG 3.88Å; I155-L159 VanDerWaalsContact O-CB 3.26Å; I155-L159 WeakPolarHBondContact O-CB 3.5Å; I155-L159 WeakPolarHBondContact O-CG 3.34Å; I155-L159 PolarHBondContact O-N 3.03Å; T156-L159 PolarHBondContact O-N 3.32Å; F157-L159 VanDerWaalsContact C-N 3.35Å; F157-L159 PolarHBondContact O-N 2.9Å; L159-H161 VanDerWaalsContact C-N 3.27Å; L159-H161 PolarHBondContact O-N 3.1Å; L159-W162 HydrophobicContact CD2-CD2 4.22Å; L159-W162 HydrophobicContact CD2-CE3 3.55Å; L159-W162 HydrophobicContact CD2-CZ3 4.06Å; L159-W162 PolarHBondContact O-N 3.12Å; L159-E163 WeakPolarHBondContact O-CB 3.35Å; L159-E163 PolarHBondContact O-N 3.13Å; L159-I225 HydrophobicContact CD1-CG1 4.07Å
160S96Very high95.2Very high12 Ų1214.3 Ų14.38%0.0848%0.079CC..Hα-helixtrans-62.9-36.9174.1-52.60000111.4T156 F157 L158 K164T156-S160 PolarHBondContact O-N 2.83Å; T156-S160 PolarHBondContact O-OG 2.81Å; F157-S160 PolarHBondContact O-N 3.33Å; L158-S160 VanDerWaalsContact C-N 3.27Å; L158-S160 PolarHBondContact O-N 2.96Å; S160-K164 WeakPolarHBondContact O-CB 3.46Å; S160-K164 PolarHBondContact O-N 3.13Å; S160-K164 VanDerWaalsContact O-N 3.1Å
161H96.5Very high95.1Very high4 Ų415.5 Ų15.52%0.0198%0.084CC..Hα-helixtrans-76.3-40.3174.1-72.588.5000112H119 F157 L158 L159 E163 K164 Y165 L299 I300 Q303H119-H161 AromaticContact CD2-NE2 3.74Å; H119-H161 AromaticContact CG-NE2 3.81Å; F157-H161 AromaticContact CE1-CE1 3.5Å; F157-H161 VanDerWaalsContact CE1-CE1 3.5Å; F157-H161 WeakPolarHBondContact CE1-CE1 3.21Å; F157-H161 AromaticContact CE1-ND1 3.66Å; F157-H161 AromaticContact CZ-CE1 3.46Å; F157-H161 VanDerWaalsContact CZ-CE1 3.46Å; F157-H161 WeakPolarHBondContact CZ-CE1 3.37Å; F157-H161 PolarHBondContact O-ND1 2.93Å; F157-H161 VanDerWaalsContact O-ND1 3.14Å; L158-H161 CarbonylContact O-C 3.5Å; L158-H161 WeakPolarHBondContact O-CA 3.44Å; L158-H161 WeakPolarHBondContact O-CB 3.47Å; L158-H161 PolarHBondContact O-N 2.94Å; L159-H161 VanDerWaalsContact C-N 3.27Å; L159-H161 PolarHBondContact O-N 3.1Å; H161-E163 VanDerWaalsContact C-N 3.3Å; H161-E163 PolarHBondContact O-N 3.29Å; H161-K164 CarbonylContact O-C 3.56Å; H161-K164 WeakPolarHBondContact O-CB 3.09Å; H161-K164 PolarHBondContact O-N 3.35Å; H161-Y165 WeakPolarHBondContact O-CB 3.2Å; H161-Y165 PolarHBondContact O-N 3.46Å; H161-L299 HydrophobicContact CB-CD2 4.09Å; H161-I300 WeakPolarHBondContact CD2-CG1 3.33Å; H161-Q303 VanDerWaalsContact C-NE2 3.31Å; H161-Q303 PolarHBondContact O-NE2 3.18Å
162W95.7Very high94.8Very high34 Ų3417.5 Ų17.513%0.12910%0.095CC..Hα-helixtrans-58.3-44.9174.1175.963.7000111.5L158 L159 Y165 I166 T228 I232 V251 L255L158-W162 WeakPolarHBondContact O-CB 3.35Å; L158-W162 PolarHBondContact O-N 3.38Å; L159-W162 HydrophobicContact CD2-CD2 4.22Å; L159-W162 HydrophobicContact CD2-CE3 3.55Å; L159-W162 HydrophobicContact CD2-CZ3 4.06Å; L159-W162 PolarHBondContact O-N 3.12Å; W162-Y165 WeakPolarHBondContact O-CA 3.37Å; W162-Y165 WeakPolarHBondContact O-CB 3.24Å; W162-Y165 PolarHBondContact O-N 3.39Å; W162-Y165 VanDerWaalsContact O-N 3.12Å; W162-I166 HydrophobicContact CD2-CD1 3.93Å; W162-I166 HydrophobicContact CE3-CD1 4.37Å; W162-I166 HydrophobicContact CG-CD1 4.44Å; W162-I166 HydrophobicContact CH2-CD1 4.21Å; W162-I166 HydrophobicContact CZ2-CD1 3.74Å; W162-I166 HydrophobicContact CZ3-CD1 4.5Å; W162-I166 WeakPolarHBondContact O-CG1 3.39Å; W162-I166 PolarHBondContact O-N 3.48Å; W162-I166 VanDerWaalsContact O-N 3.07Å; W162-T228 HydrophobicContact CE3-CG2 4.09Å; W162-T228 HydrophobicContact CZ3-CG2 4.05Å; W162-I232 HydrophobicContact CE3-CD1 4.01Å; W162-I232 HydrophobicContact CH2-CD1 3.96Å; W162-I232 HydrophobicContact CZ3-CD1 3.54Å; W162-V251 HydrophobicContact CH2-CG1 4.49Å; W162-V251 HydrophobicContact CZ2-CG1 3.48Å; W162-V251 VanDerWaalsContact CZ2-CG1 3.48Å; W162-V251 PolarHBondContact NE1-O 2.88Å; W162-L255 HydrophobicContact CD2-CD2 4.19Å; W162-L255 HydrophobicContact CG-CD2 3.97Å; W162-L255 HydrophobicContact CZ2-CD1 3.97Å
163E94.1Very high94.6Very high3 Ų318.5 Ų18.51%0.01410%0.102CC..Hα-helixtrans-57.2-48.5172.5178.6175.9-155.900111.9L159 H161 Y165 I166 T167 F171 T228 N231 I232L159-E163 WeakPolarHBondContact O-CB 3.35Å; L159-E163 PolarHBondContact O-N 3.13Å; H161-E163 VanDerWaalsContact C-N 3.3Å; H161-E163 PolarHBondContact O-N 3.29Å; E163-Y165 VanDerWaalsContact C-N 3.3Å; E163-Y165 PolarHBondContact O-N 2.9Å; E163-I166 PolarHBondContact O-N 3.03Å; E163-I166 VanDerWaalsContact O-N 3.12Å; E163-T167 HydrophobicContact CG-CG2 4.4Å; E163-T167 WeakPolarHBondContact O-CB 3.32Å; E163-T167 WeakPolarHBondContact O-CG2 3.35Å; E163-T167 PolarHBondContact O-N 3.08Å; E163-T167 PolarHBondContact O-OG1 2.72Å; E163-F171 HydrophobicContact CG-CD2 3.89Å; E163-F171 VanDerWaalsContact OE1-CD2 3.3Å; E163-F171 WeakPolarHBondContact OE1-CD2 3.44Å; E163-T228 HydrophobicContact CB-CG2 3.99Å; E163-T228 HydrophobicContact CG-CG2 4.36Å; E163-N231 WeakPolarHBondContact OE1-CB 3.16Å; E163-N231 VanDerWaalsContact OE1-CG 3.23Å; E163-N231 PolarHBondContact OE1-ND2 3.47Å; E163-I232 HydrophobicContact CG-CG1 4.07Å
164K94.3Very high94.2Very high4 Ų422.3 Ų22.32%0.01711%0.112CC..Hα-helixtrans-61.1-37.6173.6-176.2-169177.4-162.60112.3Y15 E115 S160 H161 I166 G168 T169 L170 R244Y15-K164 WeakPolarHBondContact OH-CE 3.37Å; Y15-K164 PolarHBondContact OH-NZ 2.84Å; E115-K164 WeakPolarHBondContact OE1-CE 3.35Å; E115-K164 IonicContact OE1-NZ 2.51Å; E115-K164 PolarHBondContact OE1-NZ 3.34Å; E115-K164 IonicContact OE2-NZ 3.92Å; S160-K164 WeakPolarHBondContact O-CB 3.46Å; S160-K164 PolarHBondContact O-N 3.13Å; S160-K164 VanDerWaalsContact O-N 3.1Å; H161-K164 CarbonylContact O-C 3.56Å; H161-K164 WeakPolarHBondContact O-CB 3.09Å; H161-K164 PolarHBondContact O-N 3.35Å; K164-I166 PolarHBondContact O-N 3.35Å; K164-G168 VanDerWaalsContact O-CA 3.27Å; K164-G168 WeakPolarHBondContact O-CA 3.36Å; K164-G168 PolarHBondContact O-N 3.08Å; K164-T169 WeakPolarHBondContact CA-O 3.44Å; K164-L170 HydrophobicContact CB-CD1 4.26Å; K164-L170 HydrophobicContact CD-CB 3.96Å; K164-L170 HydrophobicContact CD-CD1 4.16Å; K164-L170 HydrophobicContact CG-CB 4.31Å; K164-R244 PolarHBondContact O-NH2 3.48Å
165Y93.6Very high93.8Very high5 Ų524.6 Ų24.62%0.0213%0.127CC..Hα-helixtrans-61.8-32.5176-179.8-99.4000111.8H161 W162 E163 R244 L246 G250 P254 L299 Q303 P308 A309H161-Y165 WeakPolarHBondContact O-CB 3.2Å; H161-Y165 PolarHBondContact O-N 3.46Å; W162-Y165 WeakPolarHBondContact O-CA 3.37Å; W162-Y165 WeakPolarHBondContact O-CB 3.24Å; W162-Y165 PolarHBondContact O-N 3.39Å; W162-Y165 VanDerWaalsContact O-N 3.12Å; E163-Y165 VanDerWaalsContact C-N 3.3Å; E163-Y165 PolarHBondContact O-N 2.9Å; Y165-R244 VanDerWaalsContact CA-NH2 3.27Å; Y165-R244 VanDerWaalsContact O-CZ 3.27Å; Y165-R244 PolarHBondContact O-NE 2.84Å; Y165-R244 PolarHBondContact O-NH2 3.39Å; Y165-L246 HydrophobicContact CD1-CD1 4.08Å; Y165-L246 HydrophobicContact CE1-CD1 3.65Å; Y165-L246 HydrophobicContact CE1-CD2 4.29Å; Y165-G250 WeakPolarHBondContact CE1-O 3.42Å; Y165-P254 HydrophobicContact CD1-CG 3.98Å; Y165-P254 HydrophobicContact CE1-CG 4.26Å; Y165-L299 HydrophobicContact CD2-CD1 4.04Å; Y165-L299 HydrophobicContact CG-CD1 4.07Å; Y165-Q303 HydrophobicContact CD2-CG 3.75Å; Y165-Q303 HydrophobicContact CG-CG 4.33Å; Y165-P308 WeakPolarHBondContact OH-CA 3.42Å; Y165-A309 HydrophobicContact CE1-CB 4.42Å; Y165-A309 HydrophobicContact CE2-CB 4.05Å; Y165-A309 PolarHBondContact OH-N 3.2Å; Y165-A309 VanDerWaalsContact OH-N 3.16Å
166I91.9Very high93.6Very high0 Ų024.9 Ų24.90%013%0.127CC..Hα-helixtrans-81.5-55.8176-59.3163.5000110.2W162 E163 K164 I232 H243 V251W162-I166 HydrophobicContact CD2-CD1 3.93Å; W162-I166 HydrophobicContact CE3-CD1 4.37Å; W162-I166 HydrophobicContact CG-CD1 4.44Å; W162-I166 HydrophobicContact CH2-CD1 4.21Å; W162-I166 HydrophobicContact CZ2-CD1 3.74Å; W162-I166 HydrophobicContact CZ3-CD1 4.5Å; W162-I166 WeakPolarHBondContact O-CG1 3.39Å; W162-I166 PolarHBondContact O-N 3.48Å; W162-I166 VanDerWaalsContact O-N 3.07Å; E163-I166 PolarHBondContact O-N 3.03Å; E163-I166 VanDerWaalsContact O-N 3.12Å; K164-I166 PolarHBondContact O-N 3.35Å; I166-I232 HydrophobicContact CD1-CD1 3.74Å; I166-I232 HydrophobicContact CD1-CG1 4.32Å; I166-I232 HydrophobicContact CG2-CG2 4.08Å; I166-H243 CarbonylContact O-C 3.47Å; I166-H243 VanDerWaalsContact O-CB 3.27Å; I166-H243 WeakPolarHBondContact O-CB 3.49Å; I166-H243 PolarHBondContact O-CD2 3.05Å; I166-V251 HydrophobicContact CD1-CB 4.38Å; I166-V251 HydrophobicContact CD1-CG1 3.66Å; I166-V251 HydrophobicContact CD1-CG2 4.01Å; I166-V251 HydrophobicContact CG1-CB 4.49Å; I166-V251 HydrophobicContact CG1-CG1 4.28Å; I166-V251 HydrophobicContact CG1-CG2 3.75Å; I166-V251 HydrophobicContact CG2-CG2 4.3Å
167T91.3Very high93.5Very high2 Ų224.1 Ų24.11%0.01212%0.122CC..Hα-helixtrans-85.3-17.9-166.963.50000114.8E163 T169 F171 I232 T235 H243E163-T167 HydrophobicContact CG-CG2 4.4Å; E163-T167 WeakPolarHBondContact O-CB 3.32Å; E163-T167 WeakPolarHBondContact O-CG2 3.35Å; E163-T167 PolarHBondContact O-N 3.08Å; E163-T167 PolarHBondContact O-OG1 2.72Å; T167-T169 PolarHBondContact O-N 3.25Å; T167-T169 PolarHBondContact OG1-N 3.08Å; T167-T169 PolarHBondContact OG1-O 3.33Å; T167-T169 VanDerWaalsContact OG1-O 3.09Å; T167-F171 HydrophobicContact CG2-CE2 4.38Å; T167-I232 HydrophobicContact CG2-CG1 4.16Å; T167-T235 HydrophobicContact CG2-CG2 4.22Å; T167-H243 PolarHBondContact O-CD2 2.89Å; T167-H243 PolarHBondContact O-NE2 3.34Å; T167-H243 VanDerWaalsContact O-NE2 3.12Å
168G90.4Very high93.4Very high24 Ų2425.3 Ų25.325%0.24713%0.131CC..SBendtrans75.23.4-171.800000114.5K164K164-G168 VanDerWaalsContact O-CA 3.27Å; K164-G168 WeakPolarHBondContact O-CA 3.36Å; K164-G168 PolarHBondContact O-N 3.08Å
169T92.8Very high93.3Very high22 Ų2227.4 Ų27.414%0.13515%0.146CC..SBendtrans-128.8132.2-178.4-57.50000110.2S18 V20 K164 T167 F171S18-T169 PolarHBondContact OG-OG1 2.88Å; V20-T169 HydrophobicContact CB-CG2 4.35Å; V20-T169 HydrophobicContact CG2-CG2 3.72Å; K164-T169 WeakPolarHBondContact CA-O 3.44Å; T167-T169 PolarHBondContact O-N 3.25Å; T167-T169 PolarHBondContact OG1-N 3.08Å; T167-T169 PolarHBondContact OG1-O 3.33Å; T167-T169 VanDerWaalsContact OG1-O 3.09Å; T169-F171 HydrophobicContact CG2-CD2 4.49Å; T169-F171 HydrophobicContact CG2-CE1 4.5Å; T169-F171 HydrophobicContact CG2-CE2 4.1Å; T169-F171 HydrophobicContact CG2-CZ 4.1Å; T169-F171 WeakPolarHBondContact O-CD2 3.49Å; T169-F171 PolarHBondContact O-N 2.57Å
170L94.7Very high93.3Very high3 Ų327.5 Ų27.52%0.01615%0.146CC..EExtended strand (participates in β ladder)trans-81.2115.6173.1-173.365000109.7S18 C19 V20 H119 K164 L172S18-L170 PolarHBondContact O-N 3.46Å; C19-L170 CarbonylContact C-O 3.49Å; C19-L170 WeakPolarHBondContact CA-O 3.44Å; C19-L170 HydrophobicContact CB-CB 4.1Å; V20-L170 PolarHBondContact N-O 3.4Å; H119-L170 WeakPolarHBondContact NE2-CD2 3.36Å; K164-L170 HydrophobicContact CB-CD1 4.26Å; K164-L170 HydrophobicContact CD-CB 3.96Å; K164-L170 HydrophobicContact CD-CD1 4.16Å; K164-L170 HydrophobicContact CG-CB 4.31Å; L170-L172 HydrophobicContact CD2-CD2 3.88Å; L170-L172 HydrophobicContact CG-CD2 4.1Å
171F94.3Very high93.4Very high28 Ų2828 Ų2812%0.12315%0.148CC..EExtended strand (participates in β ladder)trans-94.4117171.4-65.2-89.3000108.8V20 E163 T167 T169 N231V20-F171 HydrophobicContact CB-CD1 3.84Å; V20-F171 HydrophobicContact CB-CE1 4Å; V20-F171 HydrophobicContact CG1-CD1 4.11Å; V20-F171 HydrophobicContact CG1-CE1 4.25Å; V20-F171 HydrophobicContact CG2-CD1 4.48Å; V20-F171 HydrophobicContact CG2-CE1 4.16Å; E163-F171 HydrophobicContact CG-CD2 3.89Å; E163-F171 VanDerWaalsContact OE1-CD2 3.3Å; E163-F171 WeakPolarHBondContact OE1-CD2 3.44Å; T167-F171 HydrophobicContact CG2-CE2 4.38Å; T169-F171 HydrophobicContact CG2-CD2 4.49Å; T169-F171 HydrophobicContact CG2-CE1 4.5Å; T169-F171 HydrophobicContact CG2-CE2 4.1Å; T169-F171 HydrophobicContact CG2-CZ 4.1Å; T169-F171 WeakPolarHBondContact O-CD2 3.49Å; T169-F171 PolarHBondContact O-N 2.57Å; F171-N231 HydrophobicContact CD2-CB 4.33Å; F171-N231 HydrophobicContact CE2-CB 4.35Å; F171-N231 HydrophobicContact CG-CB 4.47Å
172L93.3Very high93.3Very high47 Ų4732.2 Ų32.225%0.24617%0.169CC..PPolyproline II helixtrans-78.6128.5177-65.5-173.8000110.1V20 D21 L170V20-L172 PolarHBondContact O-N 2.88Å; D21-L172 HydrophobicContact CB-CB 4.3Å; D21-L172 HydrophobicContact CB-CD1 4.05Å; D21-L172 HydrophobicContact CB-CG 4.47Å; L170-L172 HydrophobicContact CD2-CD2 3.88Å; L170-L172 HydrophobicContact CG-CD2 4.1Å
173P91.5Very high93.4Very high27 Ų2731.4 Ų31.418%0.17517%0.167CC..PPolyproline II helixtrans-62.9137.5176.9-2131.8000111.8T175 F176P173-T175 PolarHBondContact O-N 3.32Å; P173-T175 VanDerWaalsContact O-N 3.07Å; P173-F176 HydrophobicContact CB-CB 4.49Å; P173-F176 VanDerWaalsContact O-CB 3.29Å; P173-F176 WeakPolarHBondContact O-CB 3.49Å; P173-F176 PolarHBondContact O-N 3.42Å
174W89.2Confident93.6Very high139 Ų13931.5 Ų31.553%0.52717%0.168SC..THydrogen-bonded Turntrans-55.7-32.7-179.5-74.310.4000114.2N22 S23 F176N22-W174 VanDerWaalsContact CG-NE1 3.31Å; N22-W174 PolarHBondContact OD1-NE1 3.39Å; S23-W174 PolarHBondContact OG-O 3.46Å; W174-F176 VanDerWaalsContact C-N 3.33Å
175T89.2Confident93.8Very high56 Ų5635.3 Ų35.334%0.34419%0.189SC..Hα-helixtrans-81.5-10.8-177.251.90000113.2P173 S179 H224P173-T175 PolarHBondContact O-N 3.32Å; P173-T175 VanDerWaalsContact O-N 3.07Å; T175-S179 WeakPolarHBondContact O-CB 3.35Å; T175-S179 PolarHBondContact O-N 3.44Å; T175-S179 PolarHBondContact O-OG 2.97Å; T175-S179 VanDerWaalsContact O-OG 3.11Å; T175-H224 PolarHBondContact OG1-CE1 2.84Å; T175-H224 PolarHBondContact OG1-NE2 3.36Å
176F91.8Very high93.9Very high42 Ų4235.7 Ų35.718%0.18419%0.191CC..Hα-helixtrans-57.8-67.1-172.1-179.8-104000111.9P173 W174 T178 S179 Q180P173-F176 HydrophobicContact CB-CB 4.49Å; P173-F176 VanDerWaalsContact O-CB 3.29Å; P173-F176 WeakPolarHBondContact O-CB 3.49Å; P173-F176 PolarHBondContact O-N 3.42Å; W174-F176 VanDerWaalsContact C-N 3.33Å; F176-T178 VanDerWaalsContact C-N 3.31Å; F176-T178 PolarHBondContact O-N 3.03Å; F176-S179 PolarHBondContact O-N 3.45Å; F176-S179 VanDerWaalsContact O-N 3.1Å; F176-S179 PolarHBondContact O-OG 2.9Å; F176-Q180 WeakPolarHBondContact O-CG 3.28Å; F176-Q180 PolarHBondContact O-N 2.9Å; F176-Q180 VanDerWaalsContact O-N 3.14Å
177D94.8Very high94.2Very high5 Ų535.7 Ų35.73%0.02719%0.191CC..Hα-helixtrans-62.8-39-178.5-63.1-31.2000112.4F25 S26 M30 H94 S179 Q180 I181F25-D177 HydrophobicContact CD1-CB 4.06Å; F25-D177 HydrophobicContact CE1-CB 4.22Å; S26-D177 WeakPolarHBondContact CB-OD2 3.46Å; S26-D177 PolarHBondContact OG-OD2 3.2Å; M30-D177 HydrophobicContact CG-CB 4.27Å; H94-D177 IonicContact CE1-OD1 3.28Å; H94-D177 PolarHBondContact CE1-OD1 3.4Å; H94-D177 VanDerWaalsContact CE1-OD1 3.26Å; H94-D177 IonicContact NE2-OD1 2.78Å; D177-S179 VanDerWaalsContact C-N 3.29Å; D177-S179 PolarHBondContact O-N 3.14Å; D177-Q180 PolarHBondContact O-N 3.17Å; D177-I181 WeakPolarHBondContact O-CG1 3.43Å; D177-I181 PolarHBondContact O-N 3.43Å; D177-I181 VanDerWaalsContact O-N 3.08Å
178T94.5Very high94.6Very high48 Ų4838.6 Ų38.629%0.29421%0.207SC..Hα-helixtrans-59.8-43.5177.2-56.70000110.3F25 F176 M182F25-T178 WeakPolarHBondContact CD1-OG1 2.78Å; F176-T178 VanDerWaalsContact C-N 3.31Å; F176-T178 PolarHBondContact O-N 3.03Å; T178-M182 HydrophobicContact CG2-CG 4.27Å; T178-M182 WeakPolarHBondContact O-CB 3.5Å; T178-M182 WeakPolarHBondContact O-CG 3.37Å; T178-M182 PolarHBondContact O-N 3.48Å
179S93.6Very high94.9Very high51 Ų5141 Ų4136%0.35721%0.213SC..Hα-helixtrans-65.9-40.9-179.771.80000112.1T175 F176 D177 M182 V183T175-S179 WeakPolarHBondContact O-CB 3.35Å; T175-S179 PolarHBondContact O-N 3.44Å; T175-S179 PolarHBondContact O-OG 2.97Å; T175-S179 VanDerWaalsContact O-OG 3.11Å; F176-S179 PolarHBondContact O-N 3.45Å; F176-S179 VanDerWaalsContact O-N 3.1Å; F176-S179 PolarHBondContact O-OG 2.9Å; D177-S179 VanDerWaalsContact C-N 3.29Å; D177-S179 PolarHBondContact O-N 3.14Å; S179-M182 PolarHBondContact O-N 3.35Å; S179-V183 VanDerWaalsContact O-CG2 3.28Å; S179-V183 WeakPolarHBondContact O-CG2 3.27Å; S179-V183 PolarHBondContact O-N 3.26Å
180Q95.7Very high95.1Very high22 Ų2240 Ų4010%0.10321%0.207CC..Hα-helixtrans-63.2-46.9178.6-65.4-69.8-8.300111.6H94 F176 D177 V183 A184H94-Q180 HydrophobicContact CB-CB 4.22Å; F176-Q180 WeakPolarHBondContact O-CG 3.28Å; F176-Q180 PolarHBondContact O-N 2.9Å; F176-Q180 VanDerWaalsContact O-N 3.14Å; D177-Q180 PolarHBondContact O-N 3.17Å; Q180-V183 PolarHBondContact O-N 3.43Å; Q180-A184 PolarHBondContact O-N 3.26Å; Q180-A184 VanDerWaalsContact O-N 3.11Å
181I97.3Very high95.2Very high22 Ų2244.3 Ų44.311%0.11322%0.224CC..Hα-helixtrans-63.5-42.6175.2-64.3-63.4000111.1F25 M30 F91 D177 V183 A184 L185F25-I181 HydrophobicContact CE1-CG1 4.03Å; F25-I181 HydrophobicContact CZ-CB 4.45Å; F25-I181 HydrophobicContact CZ-CG1 4.11Å; F25-I181 HydrophobicContact CZ-CG2 4.48Å; M30-I181 HydrophobicContact CE-CD1 3.88Å; M30-I181 HydrophobicContact CE-CG1 4.13Å; M30-I181 HydrophobicContact SD-CD1 4.41Å; M30-I181 HydrophobicContact SD-CG1 4.22Å; F91-I181 HydrophobicContact CD2-CD1 3.94Å; F91-I181 HydrophobicContact CE2-CD1 3.93Å; D177-I181 WeakPolarHBondContact O-CG1 3.43Å; D177-I181 PolarHBondContact O-N 3.43Å; D177-I181 VanDerWaalsContact O-N 3.08Å; I181-V183 VanDerWaalsContact C-N 3.33Å; I181-V183 PolarHBondContact O-N 3.18Å; I181-A184 PolarHBondContact O-N 3.48Å; I181-L185 HydrophobicContact CG2-CD1 4.11Å; I181-L185 HydrophobicContact CG2-CG 4.44Å; I181-L185 WeakPolarHBondContact O-CG 3.23Å; I181-L185 PolarHBondContact O-N 2.81Å
182M95.9Very high95.4Very high93 Ų9352.1 Ų52.146%0.45825%0.253SS..Hα-helixtrans-62.3-39.6177-73-61.1132.700112.2T178 S179 L185 V186T178-M182 HydrophobicContact CG2-CG 4.27Å; T178-M182 WeakPolarHBondContact O-CB 3.5Å; T178-M182 WeakPolarHBondContact O-CG 3.37Å; T178-M182 PolarHBondContact O-N 3.48Å; S179-M182 PolarHBondContact O-N 3.35Å; M182-L185 HydrophobicContact CE-CD1 3.96Å; M182-L185 PolarHBondContact O-N 3.39Å; M182-L185 HydrophobicContact SD-CD1 4.27Å; M182-V186 WeakPolarHBondContact O-CB 3.43Å; M182-V186 VanDerWaalsContact O-CG2 3.23Å; M182-V186 WeakPolarHBondContact O-CG2 3.41Å; M182-V186 PolarHBondContact O-N 2.94Å
183V96.8Very high95.5Very high17 Ų1757.1 Ų57.110%0.10327%0.268CS..Hα-helixtrans-62.2-44.7175.7172.20000111V90 L129 M133 S179 Q180 I181 L185 V186 F187V90-V183 HydrophobicContact CG1-CG1 4.22Å; L129-V183 HydrophobicContact CD1-CB 4.32Å; L129-V183 HydrophobicContact CD1-CG1 3.59Å; L129-V183 HydrophobicContact CD2-CG2 4.45Å; L129-V183 HydrophobicContact CG-CG1 4.23Å; M133-V183 HydrophobicContact CG-CG1 4.12Å; M133-V183 HydrophobicContact CG-CG2 4.14Å; M133-V183 HydrophobicContact SD-CB 4.34Å; M133-V183 HydrophobicContact SD-CG1 3.74Å; M133-V183 HydrophobicContact SD-CG2 3.93Å; S179-V183 VanDerWaalsContact O-CG2 3.28Å; S179-V183 WeakPolarHBondContact O-CG2 3.27Å; S179-V183 PolarHBondContact O-N 3.26Å; Q180-V183 PolarHBondContact O-N 3.43Å; I181-V183 VanDerWaalsContact C-N 3.33Å; I181-V183 PolarHBondContact O-N 3.18Å; V183-L185 VanDerWaalsContact C-N 3.32Å; V183-L185 PolarHBondContact O-N 2.88Å; V183-V186 PolarHBondContact O-N 3.45Å; V183-F187 HydrophobicContact CG1-CD2 3.8Å; V183-F187 HydrophobicContact CG1-CE2 3.45Å; V183-F187 VanDerWaalsContact CG1-CE2 3.45Å; V183-F187 WeakPolarHBondContact O-CD2 3.45Å; V183-F187 PolarHBondContact O-N 3.46Å; V183-F187 VanDerWaalsContact O-N 3.11Å
184A98.4Very high95.6Very high4 Ų458.3 Ų58.33%0.03328%0.277CS..Hα-helixtrans-58.4-44.3174.700000111.9S87 V90 F91 Q180 I181 F187 L188S87-A184 WeakPolarHBondContact CB-O 3.49Å; S87-A184 PolarHBondContact OG-O 3.02Å; V90-A184 HydrophobicContact CB-CB 4.38Å; V90-A184 HydrophobicContact CG1-CB 4.05Å; F91-A184 HydrophobicContact CB-CB 3.97Å; Q180-A184 PolarHBondContact O-N 3.26Å; Q180-A184 VanDerWaalsContact O-N 3.11Å; I181-A184 PolarHBondContact O-N 3.48Å; A184-F187 PolarHBondContact O-N 3.41Å; A184-L188 PolarHBondContact O-N 3.37Å
185L97.9Very high95.9Very high85 Ų8552.4 Ų52.445%0.44526%0.256SS..Hα-helixtrans-66.9-35.5178-68.3175.3000112.9I181 M182 V183 L188 L189I181-L185 HydrophobicContact CG2-CD1 4.11Å; I181-L185 HydrophobicContact CG2-CG 4.44Å; I181-L185 WeakPolarHBondContact O-CG 3.23Å; I181-L185 PolarHBondContact O-N 2.81Å; M182-L185 HydrophobicContact CE-CD1 3.96Å; M182-L185 PolarHBondContact O-N 3.39Å; M182-L185 HydrophobicContact SD-CD1 4.27Å; V183-L185 VanDerWaalsContact C-N 3.32Å; V183-L185 PolarHBondContact O-N 2.88Å; L185-L188 HydrophobicContact CD2-CD2 4.49Å; L185-L188 WeakPolarHBondContact O-CB 3.28Å; L185-L188 PolarHBondContact O-N 2.92Å; L185-L189 WeakPolarHBondContact O-CB 3.46Å; L185-L189 PolarHBondContact O-N 2.95Å
186V97.1Very high96.1Very high12 Ų1253.7 Ų53.77%0.07326%0.264CS..Hα-helixtrans-61.9-44.1175.5160.80000110.6M133 L136 M182 V183 L189 A190 F198 F212M133-V186 HydrophobicContact CE-CG1 4.3Å; M133-V186 HydrophobicContact SD-CG1 4.3Å; L136-V186 HydrophobicContact CD2-CG1 3.34Å; M182-V186 WeakPolarHBondContact O-CB 3.43Å; M182-V186 VanDerWaalsContact O-CG2 3.23Å; M182-V186 WeakPolarHBondContact O-CG2 3.41Å; M182-V186 PolarHBondContact O-N 2.94Å; V183-V186 PolarHBondContact O-N 3.45Å; V186-L189 PolarHBondContact O-N 3.15Å; V186-A190 WeakPolarHBondContact O-CB 3.35Å; V186-A190 PolarHBondContact O-N 3.5Å; V186-F198 HydrophobicContact CB-CE1 4.45Å; V186-F198 HydrophobicContact CB-CZ 4.31Å; V186-F198 HydrophobicContact CG1-CE1 3.95Å; V186-F198 HydrophobicContact CG1-CE2 4.28Å; V186-F198 HydrophobicContact CG1-CZ 3.72Å; V186-F198 HydrophobicContact CG2-CE1 4.22Å; V186-F198 VanDerWaalsContact O-CZ 3.26Å; V186-F198 WeakPolarHBondContact O-CZ 3.23Å; V186-F212 HydrophobicContact CG1-CE2 4.29Å; V186-F212 HydrophobicContact CG2-CE2 3.54Å; V186-F212 HydrophobicContact CG2-CZ 3.44Å; V186-F212 VanDerWaalsContact CG2-CZ 3.44Å
187F98.3Very high96.2Very high0 Ų053.5 Ų53.50%027%0.265CS..Hα-helixtrans-66.6-37174.4-73.9-62.4000112.9L65 W83 T86 V90 M133 L136 V183 A184 L189 A190 Y191L65-F187 HydrophobicContact CD1-CE1 4.49Å; W83-F187 AromaticContact CE3-CD1 3.78Å; W83-F187 HydrophobicContact CE3-CD1 3.78Å; W83-F187 AromaticContact CE3-CE1 3.95Å; W83-F187 HydrophobicContact CE3-CE1 3.95Å; W83-F187 HydrophobicContact CZ3-CD1 4.26Å; W83-F187 AromaticContact CZ3-CE1 3.96Å; W83-F187 HydrophobicContact CZ3-CE1 3.96Å; T86-F187 HydrophobicContact CG2-CD1 3.92Å; T86-F187 HydrophobicContact CG2-CD2 3.68Å; T86-F187 HydrophobicContact CG2-CE1 3.91Å; T86-F187 HydrophobicContact CG2-CE2 3.66Å; T86-F187 HydrophobicContact CG2-CG 3.82Å; T86-F187 HydrophobicContact CG2-CZ 3.8Å; V90-F187 HydrophobicContact CG2-CD2 4.47Å; V90-F187 HydrophobicContact CG2-CE2 4.46Å; M133-F187 HydrophobicContact SD-CE2 4.22Å; M133-F187 HydrophobicContact SD-CZ 4.25Å; L136-F187 HydrophobicContact CB-CE1 4Å; L136-F187 HydrophobicContact CD2-CD1 4.1Å; L136-F187 HydrophobicContact CD2-CE1 4.05Å; V183-F187 HydrophobicContact CG1-CD2 3.8Å; V183-F187 HydrophobicContact CG1-CE2 3.45Å; V183-F187 VanDerWaalsContact CG1-CE2 3.45Å; V183-F187 WeakPolarHBondContact O-CD2 3.45Å; V183-F187 PolarHBondContact O-N 3.46Å; V183-F187 VanDerWaalsContact O-N 3.11Å; A184-F187 PolarHBondContact O-N 3.41Å; F187-L189 VanDerWaalsContact C-N 3.32Å; F187-L189 PolarHBondContact O-N 2.93Å; F187-A190 WeakPolarHBondContact O-CB 3.14Å; F187-A190 PolarHBondContact O-N 2.75Å; F187-Y191 PolarHBondContact O-N 2.91Å
188L98.4Very high96.1Very high64 Ų6453.4 Ų53.434%0.33526%0.264SS..Hα-helixtrans-63-40.9174.4-174.860.8000111.5L84 S87 A184 L185 Y191 W192L84-L188 HydrophobicContact CD1-CD1 3.76Å; S87-L188 WeakPolarHBondContact OG-CB 3.34Å; A184-L188 PolarHBondContact O-N 3.37Å; L185-L188 HydrophobicContact CD2-CD2 4.49Å; L185-L188 WeakPolarHBondContact O-CB 3.28Å; L185-L188 PolarHBondContact O-N 2.92Å; L188-Y191 WeakPolarHBondContact O-CB 3.36Å; L188-Y191 PolarHBondContact O-N 3.24Å; L188-W192 PolarHBondContact O-N 3.08Å
189L97.2Very high96Very high75 Ų7553.8 Ų53.839%0.39326%0.264SS..Hα-helixtrans-69.2-36.8176.4-17763.5000111.6L185 V186 F187 Y191 W192 R193 I197 F198L185-L189 WeakPolarHBondContact O-CB 3.46Å; L185-L189 PolarHBondContact O-N 2.95Å; V186-L189 PolarHBondContact O-N 3.15Å; F187-L189 VanDerWaalsContact C-N 3.32Å; F187-L189 PolarHBondContact O-N 2.93Å; L189-Y191 VanDerWaalsContact C-N 3.29Å; L189-Y191 PolarHBondContact O-N 3.47Å; L189-W192 PolarHBondContact O-N 2.65Å; L189-R193 HydrophobicContact CD1-CB 4.14Å; L189-R193 HydrophobicContact CD1-CG 3.63Å; L189-R193 WeakPolarHBondContact O-CB 3.38Å; L189-R193 PolarHBondContact O-N 2.83Å; L189-I197 HydrophobicContact CG-CG2 4.32Å; L189-F198 HydrophobicContact CB-CZ 4.03Å; L189-F198 HydrophobicContact CD2-CE1 3.91Å; L189-F198 HydrophobicContact CD2-CZ 3.92Å; L189-F198 HydrophobicContact CG-CZ 4.06Å
190A97.3Very high96Very high0 Ų057.2 Ų57.20%027%0.272CS..Hα-helixtrans-59.3-40.6172.300000111.7W83 L136 V186 F187 S194 P195 F198W83-A190 HydrophobicContact CB-CB 4.17Å; W83-A190 HydrophobicContact CD2-CB 4.37Å; W83-A190 HydrophobicContact CG-CB 4.12Å; L136-A190 HydrophobicContact CD1-CB 3.61Å; L136-A190 HydrophobicContact CD2-CB 4.24Å; V186-A190 WeakPolarHBondContact O-CB 3.35Å; V186-A190 PolarHBondContact O-N 3.5Å; F187-A190 WeakPolarHBondContact O-CB 3.14Å; F187-A190 PolarHBondContact O-N 2.75Å; A190-S194 CarbonylContact O-C 3.32Å; A190-S194 VanDerWaalsContact O-C 3.32Å; A190-S194 WeakPolarHBondContact O-CA 3.27Å; A190-S194 PolarHBondContact O-N 3.4Å; A190-P195 HydrophobicContact CB-CG 4.39Å; A190-F198 HydrophobicContact CB-CE2 3.86Å
191Y97.7Very high95.8Very high94 Ų9460.9 Ų60.937%0.36930%0.298SS..Hα-helixtrans-62-52.6172.8165.3-103.2000111.8T80 L84 F187 L188 L189T80-Y191 HydrophobicContact CG2-CD2 3.75Å; T80-Y191 HydrophobicContact CG2-CE2 4.2Å; T80-Y191 WeakPolarHBondContact CG2-O 3.42Å; T80-Y191 WeakPolarHBondContact O-CD2 3.46Å; L84-Y191 HydrophobicContact CB-CD1 4.38Å; L84-Y191 HydrophobicContact CB-CD2 3.63Å; L84-Y191 HydrophobicContact CB-CE2 4.07Å; L84-Y191 HydrophobicContact CB-CG 3.81Å; L84-Y191 HydrophobicContact CD1-CD1 3.83Å; L84-Y191 HydrophobicContact CD1-CE1 4.07Å; L84-Y191 HydrophobicContact CD1-CG 4.09Å; L84-Y191 HydrophobicContact CD2-CD2 4.39Å; L84-Y191 HydrophobicContact CD2-CE1 4.24Å; L84-Y191 HydrophobicContact CD2-CE2 4Å; L84-Y191 HydrophobicContact CG-CD2 4.41Å; L84-Y191 HydrophobicContact CG-CG 4.41Å; F187-Y191 PolarHBondContact O-N 2.91Å; L188-Y191 WeakPolarHBondContact O-CB 3.36Å; L188-Y191 PolarHBondContact O-N 3.24Å; L189-Y191 VanDerWaalsContact C-N 3.29Å; L189-Y191 PolarHBondContact O-N 3.47Å
192W97.4Very high95.5Very high192 Ų19265.5 Ų65.573%0.72732%0.322SS*.Hα-helixtrans-68-42.3-174.6-167.1-52.5000112.4L188 L189L188-W192 PolarHBondContact O-N 3.08Å; L189-W192 PolarHBondContact O-N 2.65Å
193R95.6Very high95.3Very high152 Ų15265.7 Ų65.757%0.57432%0.324SS*.Hα-helixtrans-115.95.9-165.7-64.8-62.6-162.41054.4114.9L189 I197L189-R193 HydrophobicContact CD1-CB 4.14Å; L189-R193 HydrophobicContact CD1-CG 3.63Å; L189-R193 WeakPolarHBondContact O-CB 3.38Å; L189-R193 PolarHBondContact O-N 2.83Å; R193-I197 HydrophobicContact CB-CB 4.03Å; R193-I197 HydrophobicContact CB-CG1 4.1Å; R193-I197 HydrophobicContact CB-CG2 4.13Å
194S94.1Very high95.1Very high51 Ų5173.9 Ų73.936%0.35736%0.359SS..  trans69.1145.7-167.9171.70000113.3A190 T196 I197A190-S194 CarbonylContact O-C 3.32Å; A190-S194 VanDerWaalsContact O-C 3.32Å; A190-S194 WeakPolarHBondContact O-CA 3.27Å; A190-S194 PolarHBondContact O-N 3.4Å; S194-T196 PolarHBondContact O-N 2.9Å; S194-T196 PolarHBondContact OG-N 2.98Å; S194-T196 PolarHBondContact OG-OG1 3.06Å; S194-I197 WeakPolarHBondContact O-CB 3.48Å; S194-I197 WeakPolarHBondContact O-CG2 3.37Å; S194-I197 PolarHBondContact O-N 3.28Å; S194-I197 VanDerWaalsContact O-N 3.09Å
195P94.9Very high94.8Very high15 Ų1576.5 Ų76.510%0.09739%0.386CS..G310 helixtrans-49.7-28.1171-31.737.4000115.3W83 L136 A190 I197 F198W83-P195 HydrophobicContact CD2-CG 4.41Å; W83-P195 HydrophobicContact CZ2-CG 3.64Å; L136-P195 HydrophobicContact CD1-CB 3.64Å; L136-P195 HydrophobicContact CD1-CG 3.77Å; A190-P195 HydrophobicContact CB-CG 4.39Å; P195-I197 PolarHBondContact O-N 2.87Å; P195-I197 VanDerWaalsContact O-N 3.12Å; P195-F198 WeakPolarHBondContact O-CD2 3.47Å; P195-F198 PolarHBondContact O-N 3.47Å
196T92.7Very high94.6Very high83 Ų8378.3 Ų78.351%0.50939%0.387SS..G310 helixtrans-62.3-20-179.858.70000113.4S194 F198 M199S194-T196 PolarHBondContact O-N 2.9Å; S194-T196 PolarHBondContact OG-N 2.98Å; S194-T196 PolarHBondContact OG-OG1 3.06Å; T196-F198 PolarHBondContact O-N 2.91Å; T196-M199 PolarHBondContact O-N 2.97Å; T196-M199 VanDerWaalsContact O-N 3.12Å
197I93.9Very high94.4Very high39 Ų3978.2 Ų78.220%0.239%0.387CS..G310 helixtrans-58.2-34.8176.6-166.356.5000112.5L189 R193 S194 P195 M199 K200L189-I197 HydrophobicContact CG-CG2 4.32Å; R193-I197 HydrophobicContact CB-CB 4.03Å; R193-I197 HydrophobicContact CB-CG1 4.1Å; R193-I197 HydrophobicContact CB-CG2 4.13Å; S194-I197 WeakPolarHBondContact O-CB 3.48Å; S194-I197 WeakPolarHBondContact O-CG2 3.37Å; S194-I197 PolarHBondContact O-N 3.28Å; S194-I197 VanDerWaalsContact O-N 3.09Å; P195-I197 PolarHBondContact O-N 2.87Å; P195-I197 VanDerWaalsContact O-N 3.12Å; I197-M199 PolarHBondContact O-N 3.36Å; I197-K200 HydrophobicContact CD1-CD 4.15Å; I197-K200 PolarHBondContact O-N 2.98Å
198F94.5Very high94.2Very high2 Ų279.5 Ų79.51%0.00940%0.395CS..G310 helixtrans-72.8-15.9-178.3-61.1-72.8000113.3L136 L137 V186 L189 A190 P195 T196 S207 T208 A209 F212L136-F198 HydrophobicContact CD1-CE2 4.45Å; L136-F198 HydrophobicContact CD2-CD2 4.25Å; L136-F198 HydrophobicContact CD2-CE2 3.96Å; L136-F198 HydrophobicContact CG-CD2 4.42Å; L137-F198 HydrophobicContact CD2-CB 3.75Å; L137-F198 HydrophobicContact CD2-CD2 4.3Å; L137-F198 HydrophobicContact CD2-CG 4.02Å; V186-F198 HydrophobicContact CB-CE1 4.45Å; V186-F198 HydrophobicContact CB-CZ 4.31Å; V186-F198 HydrophobicContact CG1-CE1 3.95Å; V186-F198 HydrophobicContact CG1-CE2 4.28Å; V186-F198 HydrophobicContact CG1-CZ 3.72Å; V186-F198 HydrophobicContact CG2-CE1 4.22Å; V186-F198 VanDerWaalsContact O-CZ 3.26Å; V186-F198 WeakPolarHBondContact O-CZ 3.23Å; L189-F198 HydrophobicContact CB-CZ 4.03Å; L189-F198 HydrophobicContact CD2-CE1 3.91Å; L189-F198 HydrophobicContact CD2-CZ 3.92Å; L189-F198 HydrophobicContact CG-CZ 4.06Å; A190-F198 HydrophobicContact CB-CE2 3.86Å; P195-F198 WeakPolarHBondContact O-CD2 3.47Å; P195-F198 PolarHBondContact O-N 3.47Å; T196-F198 PolarHBondContact O-N 2.91Å; F198-S207 WeakPolarHBondContact O-CB 3.39Å; F198-T208 HydrophobicContact CD1-CG2 3.87Å; F198-T208 HydrophobicContact CE1-CG2 4.42Å; F198-T208 PolarHBondContact O-N 2.96Å; F198-A209 HydrophobicContact CB-CB 4.27Å; F198-A209 WeakPolarHBondContact O-CB 3.49Å; F198-A209 PolarHBondContact O-N 3.47Å; F198-F212 HydrophobicContact CD1-CE2 4.08Å; F198-F212 HydrophobicContact CE1-CE2 4.21Å
199M92Very high93.9Very high57 Ų5776.4 Ų76.428%0.28138%0.379SS..G310 helixtrans-90.9-13.8178.9-47.5-42.8-171.900112N139 I140 T196 I197 S207 A209N139-M199 HydrophobicContact CB-CE 4.28Å; I140-M199 HydrophobicContact CD1-CE 4.35Å; I140-M199 HydrophobicContact CD1-SD 3.53Å; I140-M199 VanDerWaalsContact CD1-SD 3.53Å; I140-M199 HydrophobicContact CG1-CE 3.56Å; I140-M199 HydrophobicContact CG1-SD 3.14Å; I140-M199 WeakPolarHBondContact CG1-SD 3.5Å; T196-M199 PolarHBondContact O-N 2.97Å; T196-M199 VanDerWaalsContact O-N 3.12Å; I197-M199 PolarHBondContact O-N 3.36Å; M199-S207 WeakPolarHBondContact O-CB 3.45Å; M199-A209 HydrophobicContact SD-CB 3.9Å
200K92.3Very high93.7Very high122 Ų12274.6 Ų74.653%0.5337%0.373SS..SBendtrans-74.3142.2177.8-64.6-171.4-179.9-178.90110.3I197 L202 S207I197-K200 HydrophobicContact CD1-CD 4.15Å; I197-K200 PolarHBondContact O-N 2.98Å; K200-L202 PolarHBondContact O-N 3.49Å; K200-S207 VanDerWaalsContact O-CA 3.29Å; K200-S207 WeakPolarHBondContact O-CA 3.35Å; K200-S207 WeakPolarHBondContact O-CB 3.41Å
201P92.3Very high93.5Very high100 Ų10076.7 Ų76.765%0.64938%0.383SS*.EExtended strand (participates in β ladder)trans-55.6133.4171.5-24.434000111.3
202L91Very high93.3Very high118 Ų11875.1 Ų75.162%0.61838%0.379SS*.EExtended strand (participates in β ladder)trans-115.9-54.9179.6179.566.5000111.4K200 W206 T208 I211K200-L202 PolarHBondContact O-N 3.49Å; L202-W206 PolarHBondContact N-O 3.29Å; L202-T208 HydrophobicContact CD2-CG2 4.48Å; L202-I211 HydrophobicContact CD2-CD1 4.29Å
203L91.3Very high93.1Very high97 Ų9767.9 Ų67.951%0.50835%0.352SS..EExtended strand (participates in β ladder)trans-136.7126.7-172.7-172.970.8000110.2G205 W206 I211L203-G205 PolarHBondContact O-N 3.46Å; L203-G205 VanDerWaalsContact O-N 3.08Å; L203-W206 PolarHBondContact N-O 2.88Å; L203-W206 WeakPolarHBondContact O-CB 3.24Å; L203-W206 PolarHBondContact O-N 3.35Å; L203-I211 HydrophobicContact CB-CD1 4.28Å
204F92.6Very high93.1Very high189 Ų18965.4 Ų65.483%0.82935%0.346SS*.THydrogen-bonded Turntrans49.234.9-178-53.8-62.9000114W206F204-W206 PolarHBondContact O-N 3.35Å
205G92.3Very high93.1Very high59 Ų5966.4 Ų66.461%0.60835%0.35SS*.THydrogen-bonded Turntrans80.2-8.4-177.100000115.1L203L203-G205 PolarHBondContact O-N 3.46Å; L203-G205 VanDerWaalsContact O-N 3.08Å
206W93Very high93Very high123 Ų12367.3 Ų67.347%0.46635%0.353SS..EExtended strand (participates in β ladder)trans-79.3135.5177.5-72.834.8000110.8L202 L203 F204 I211 F214L202-W206 PolarHBondContact N-O 3.29Å; L203-W206 PolarHBondContact N-O 2.88Å; L203-W206 WeakPolarHBondContact O-CB 3.24Å; L203-W206 PolarHBondContact O-N 3.35Å; F204-W206 PolarHBondContact O-N 3.35Å; W206-I211 HydrophobicContact CB-CD1 4.37Å; W206-I211 HydrophobicContact CB-CG1 4.06Å; W206-I211 HydrophobicContact CE3-CG1 4.16Å; W206-F214 HydrophobicContact CH2-CB 4.39Å; W206-F214 AromaticContact CH2-CD2 3.94Å; W206-F214 HydrophobicContact CH2-CD2 3.94Å; W206-F214 HydrophobicContact CH2-CE2 4.48Å; W206-F214 HydrophobicContact CH2-CG 4.15Å; W206-F214 HydrophobicContact CZ3-CB 3.64Å; W206-F214 HydrophobicContact CZ3-CD1 4.29Å; W206-F214 AromaticContact CZ3-CD2 3.99Å; W206-F214 HydrophobicContact CZ3-CD2 3.99Å; W206-F214 AromaticContact CZ3-CG 3.71Å; W206-F214 HydrophobicContact CZ3-CG 3.71Å
207S94.3Very high93.1Very high10 Ų1065.3 Ų65.37%0.0734%0.338CS..EExtended strand (participates in β ladder)trans-74.5156.717273.70000111.1F198 M199 K200 A209 S210 I211F198-S207 WeakPolarHBondContact O-CB 3.39Å; M199-S207 WeakPolarHBondContact O-CB 3.45Å; K200-S207 VanDerWaalsContact O-CA 3.29Å; K200-S207 WeakPolarHBondContact O-CA 3.35Å; K200-S207 WeakPolarHBondContact O-CB 3.41Å; S207-A209 PolarHBondContact O-N 2.89Å; S207-S210 PolarHBondContact O-N 3.3Å; S207-S210 VanDerWaalsContact O-N 3.1Å; S207-S210 PolarHBondContact OG-N 3.14Å; S207-S210 VanDerWaalsContact OG-N 3.13Å; S207-S210 PolarHBondContact OG-OG 3.11Å; S207-S210 VanDerWaalsContact OG-OG 3.07Å; S207-I211 WeakPolarHBondContact O-CG1 3.49Å; S207-I211 PolarHBondContact O-N 3.49Å
208T93.1Very high93.2Very high27 Ų2767.8 Ų67.817%0.16635%0.347CS..Hα-helixtrans-56.7-38.5175-47.30000111.5F198 L202 I211 F212F198-T208 HydrophobicContact CD1-CG2 3.87Å; F198-T208 HydrophobicContact CE1-CG2 4.42Å; F198-T208 PolarHBondContact O-N 2.96Å; L202-T208 HydrophobicContact CD2-CG2 4.48Å; T208-I211 PolarHBondContact O-N 3.29Å; T208-F212 HydrophobicContact CG2-CD2 4.32Å; T208-F212 HydrophobicContact CG2-CE1 4.09Å; T208-F212 HydrophobicContact CG2-CE2 3.75Å; T208-F212 HydrophobicContact CG2-CZ 3.62Å; T208-F212 WeakPolarHBondContact O-CG 3.35Å; T208-F212 PolarHBondContact O-N 2.91Å
209A92.2Very high93.2Very high0 Ų068.6 Ų68.60%035%0.353CS..Hα-helixtrans-62.6-42.5176.100000112.4L137 I140 F198 M199 S207 I211 F212 K213L137-A209 HydrophobicContact CD2-CB 3.99Å; I140-A209 HydrophobicContact CB-CB 4.18Å; I140-A209 HydrophobicContact CG1-CB 3.77Å; I140-A209 HydrophobicContact CG2-CB 4.1Å; F198-A209 HydrophobicContact CB-CB 4.27Å; F198-A209 WeakPolarHBondContact O-CB 3.49Å; F198-A209 PolarHBondContact O-N 3.47Å; M199-A209 HydrophobicContact SD-CB 3.9Å; S207-A209 PolarHBondContact O-N 2.89Å; A209-I211 VanDerWaalsContact C-N 3.33Å; A209-F212 PolarHBondContact O-N 3.32Å; A209-K213 PolarHBondContact O-N 2.79Å
210S93.5Very high93.3Very high37 Ų3766.4 Ų66.426%0.25934%0.342SS..Hα-helixtrans-64.5-37.7174.9-64.50000112S207 K213 F214S207-S210 PolarHBondContact O-N 3.3Å; S207-S210 VanDerWaalsContact O-N 3.1Å; S207-S210 PolarHBondContact OG-N 3.14Å; S207-S210 VanDerWaalsContact OG-N 3.13Å; S207-S210 PolarHBondContact OG-OG 3.11Å; S207-S210 VanDerWaalsContact OG-OG 3.07Å; S210-K213 PolarHBondContact O-N 2.87Å; S210-F214 WeakPolarHBondContact O-CB 3.45Å; S210-F214 PolarHBondContact O-N 2.82Å
211I93.8Very high93.5Very high44 Ų4466.8 Ų66.823%0.22634%0.341CS..Hα-helixtrans-65.2-41.9175-65.8166.3000110.8L202 L203 W206 S207 T208 A209 F214 T215L202-I211 HydrophobicContact CD2-CD1 4.29Å; L203-I211 HydrophobicContact CB-CD1 4.28Å; W206-I211 HydrophobicContact CB-CD1 4.37Å; W206-I211 HydrophobicContact CB-CG1 4.06Å; W206-I211 HydrophobicContact CE3-CG1 4.16Å; S207-I211 WeakPolarHBondContact O-CG1 3.49Å; S207-I211 PolarHBondContact O-N 3.49Å; T208-I211 PolarHBondContact O-N 3.29Å; A209-I211 VanDerWaalsContact C-N 3.33Å; I211-F214 PolarHBondContact O-N 3.01Å; I211-T215 VanDerWaalsContact O-CB 3.27Å; I211-T215 WeakPolarHBondContact O-CB 3.46Å; I211-T215 PolarHBondContact O-N 3.11Å; I211-T215 PolarHBondContact O-OG1 3.49Å
212F92.9Very high93.6Very high61 Ų6168.6 Ų68.627%0.26834%0.339SS..Hα-helixtrans-62.7-45.9174.6-68.2-25.1000111.9M133 L137 V186 F198 T208 A209 F214 T215 L216M133-F212 HydrophobicContact CE-CD2 4.46Å; L137-F212 HydrophobicContact CD1-CD2 3.88Å; V186-F212 HydrophobicContact CG1-CE2 4.29Å; V186-F212 HydrophobicContact CG2-CE2 3.54Å; V186-F212 HydrophobicContact CG2-CZ 3.44Å; V186-F212 VanDerWaalsContact CG2-CZ 3.44Å; F198-F212 HydrophobicContact CD1-CE2 4.08Å; F198-F212 HydrophobicContact CE1-CE2 4.21Å; T208-F212 HydrophobicContact CG2-CD2 4.32Å; T208-F212 HydrophobicContact CG2-CE1 4.09Å; T208-F212 HydrophobicContact CG2-CE2 3.75Å; T208-F212 HydrophobicContact CG2-CZ 3.62Å; T208-F212 WeakPolarHBondContact O-CG 3.35Å; T208-F212 PolarHBondContact O-N 2.91Å; A209-F212 PolarHBondContact O-N 3.32Å; F212-F214 PolarHBondContact O-N 2.93Å; F212-T215 PolarHBondContact O-N 3.18Å; F212-L216 WeakPolarHBondContact O-CB 3.44Å; F212-L216 PolarHBondContact O-N 3.45Å
213K93.8Very high93.7Very high40 Ų4065.5 Ų65.517%0.17433%0.325CS..Hα-helixtrans-57.4-50.7175.8-177.416569173.60111.1I140 Y141 E145 A209 S210 L216 F217I140-K213 PolarHBondContact O-NZ 2.97Å; Y141-K213 HydrophobicContact CD1-CD 3.83Å; Y141-K213 HydrophobicContact CD1-CG 4.35Å; Y141-K213 HydrophobicContact CE1-CB 3.99Å; Y141-K213 HydrophobicContact CE1-CD 3.64Å; Y141-K213 HydrophobicContact CE1-CG 3.66Å; Y141-K213 WeakPolarHBondContact OH-CA 3.21Å; E145-K213 VanDerWaalsContact CD-NZ 3.26Å; E145-K213 IonicContact OE1-NZ 3.76Å; E145-K213 PolarHBondContact OE1-NZ 3.37Å; E145-K213 IonicContact OE2-NZ 3.08Å; E145-K213 PolarHBondContact OE2-NZ 3.07Å; A209-K213 PolarHBondContact O-N 2.79Å; S210-K213 PolarHBondContact O-N 2.87Å; K213-L216 PolarHBondContact O-N 3.42Å; K213-F217 HydrophobicContact CG-CD2 4.12Å; K213-F217 HydrophobicContact CG-CE2 3.96Å; K213-F217 VanDerWaalsContact O-CD2 3.24Å; K213-F217 WeakPolarHBondContact O-CD2 3.34Å; K213-F217 PolarHBondContact O-N 3.32Å
214F94.5Very high93.8Very high100 Ų10061.9 Ų61.944%0.43931%0.306SS..Hα-helixtrans-60.2-47.7177.7175.1-95.4000111.9W206 S210 I211 F212 L216 F217 F218W206-F214 HydrophobicContact CH2-CB 4.39Å; W206-F214 AromaticContact CH2-CD2 3.94Å; W206-F214 HydrophobicContact CH2-CD2 3.94Å; W206-F214 HydrophobicContact CH2-CE2 4.48Å; W206-F214 HydrophobicContact CH2-CG 4.15Å; W206-F214 HydrophobicContact CZ3-CB 3.64Å; W206-F214 HydrophobicContact CZ3-CD1 4.29Å; W206-F214 AromaticContact CZ3-CD2 3.99Å; W206-F214 HydrophobicContact CZ3-CD2 3.99Å; W206-F214 AromaticContact CZ3-CG 3.71Å; W206-F214 HydrophobicContact CZ3-CG 3.71Å; S210-F214 WeakPolarHBondContact O-CB 3.45Å; S210-F214 PolarHBondContact O-N 2.82Å; I211-F214 PolarHBondContact O-N 3.01Å; F212-F214 PolarHBondContact O-N 2.93Å; F214-L216 VanDerWaalsContact C-N 3.3Å; F214-L216 PolarHBondContact O-N 2.96Å; F214-F217 PolarHBondContact O-N 2.85Å; F214-F218 HydrophobicContact CD1-CB 4.26Å; F214-F218 HydrophobicContact CE1-CB 3.93Å; F214-F218 HydrophobicContact CE1-CD2 4.11Å; F214-F218 AromaticContact CE1-CG 3.96Å; F214-F218 HydrophobicContact CE1-CG 3.96Å; F214-F218 HydrophobicContact CE2-CB 4.43Å; F214-F218 HydrophobicContact CE2-CD2 4.31Å; F214-F218 HydrophobicContact CZ-CB 4.02Å; F214-F218 AromaticContact CZ-CD2 3.62Å; F214-F218 HydrophobicContact CZ-CD2 3.62Å; F214-F218 HydrophobicContact CZ-CE2 4.34Å; F214-F218 AromaticContact CZ-CG 3.93Å; F214-F218 HydrophobicContact CZ-CG 3.93Å; F214-F218 WeakPolarHBondContact O-CB 3.28Å; F214-F218 PolarHBondContact O-N 3.22Å
215T93.6Very high93.9Very high72 Ų7255.5 Ų55.544%0.44228%0.28SS..Hα-helixtrans-58.7-41.4-179.8-58.70000111.6I211 F212 S219I211-T215 VanDerWaalsContact O-CB 3.27Å; I211-T215 WeakPolarHBondContact O-CB 3.46Å; I211-T215 PolarHBondContact O-N 3.11Å; I211-T215 PolarHBondContact O-OG1 3.49Å; F212-T215 PolarHBondContact O-N 3.18Å; T215-S219 WeakPolarHBondContact O-CB 3.2Å; T215-S219 PolarHBondContact O-N 3.43Å; T215-S219 PolarHBondContact O-OG 2.9Å
216L93.9Very high94Very high33 Ų3355.6 Ų55.617%0.17327%0.27CS..Hα-helixtrans-58.9-52.1177.9175.564.1000112.2V152 L153 F212 K213 F214 S219 F220V152-L216 HydrophobicContact CG1-CD1 3.83Å; V152-L216 HydrophobicContact CG1-CG 4.11Å; L153-L216 HydrophobicContact CD2-CD1 3.69Å; L153-L216 HydrophobicContact CG-CD1 4.1Å; F212-L216 WeakPolarHBondContact O-CB 3.44Å; F212-L216 PolarHBondContact O-N 3.45Å; K213-L216 PolarHBondContact O-N 3.42Å; F214-L216 VanDerWaalsContact C-N 3.3Å; F214-L216 PolarHBondContact O-N 2.96Å; L216-S219 PolarHBondContact O-OG 3.33Å; L216-F220 WeakPolarHBondContact O-CB 3.41Å; L216-F220 PolarHBondContact O-N 3.08Å
217F95.3Very high94.1Very high42 Ų4253.1 Ų53.118%0.18427%0.265CS..Hα-helixtrans-72.4-41.6-179.1-70.9-71.5000111.7M148 V152 K213 F214 F220 Y221M148-F217 HydrophobicContact CB-CE1 3.97Å; M148-F217 HydrophobicContact CB-CZ 4.05Å; V152-F217 HydrophobicContact CG2-CD1 3.87Å; V152-F217 HydrophobicContact CG2-CE1 3.83Å; K213-F217 HydrophobicContact CG-CD2 4.12Å; K213-F217 HydrophobicContact CG-CE2 3.96Å; K213-F217 VanDerWaalsContact O-CD2 3.24Å; K213-F217 WeakPolarHBondContact O-CD2 3.34Å; K213-F217 PolarHBondContact O-N 3.32Å; F214-F217 PolarHBondContact O-N 2.85Å; F217-F220 PolarHBondContact O-N 3.38Å; F217-Y221 HydrophobicContact CD1-CE2 4.39Å; F217-Y221 WeakPolarHBondContact O-CD2 3.33Å; F217-Y221 PolarHBondContact O-N 3.17Å
218F95.7Very high94.1Very high90 Ų9053.2 Ų53.240%0.39527%0.265SS..Hα-helixtrans-63-48.2180-177.5-89.9000111.5F214 F220 Y221 F222F214-F218 HydrophobicContact CD1-CB 4.26Å; F214-F218 HydrophobicContact CE1-CB 3.93Å; F214-F218 HydrophobicContact CE1-CD2 4.11Å; F214-F218 AromaticContact CE1-CG 3.96Å; F214-F218 HydrophobicContact CE1-CG 3.96Å; F214-F218 HydrophobicContact CE2-CB 4.43Å; F214-F218 HydrophobicContact CE2-CD2 4.31Å; F214-F218 HydrophobicContact CZ-CB 4.02Å; F214-F218 AromaticContact CZ-CD2 3.62Å; F214-F218 HydrophobicContact CZ-CD2 3.62Å; F214-F218 HydrophobicContact CZ-CE2 4.34Å; F214-F218 AromaticContact CZ-CG 3.93Å; F214-F218 HydrophobicContact CZ-CG 3.93Å; F214-F218 WeakPolarHBondContact O-CB 3.28Å; F214-F218 PolarHBondContact O-N 3.22Å; F218-F220 VanDerWaalsContact C-N 3.27Å; F218-F220 PolarHBondContact O-N 2.98Å; F218-Y221 PolarHBondContact O-N 2.97Å; F218-F222 AromaticContact CD2-CD2 3.46Å; F218-F222 HydrophobicContact CD2-CD2 3.46Å; F218-F222 VanDerWaalsContact CD2-CD2 3.46Å; F218-F222 AromaticContact CD2-CE2 3.93Å; F218-F222 HydrophobicContact CD2-CE2 3.93Å; F218-F222 HydrophobicContact CD2-CG 4.27Å; F218-F222 HydrophobicContact CE1-CB 4.22Å; F218-F222 HydrophobicContact CE2-CB 4.27Å; F218-F222 AromaticContact CE2-CD2 3.6Å; F218-F222 HydrophobicContact CE2-CD2 3.6Å; F218-F222 HydrophobicContact CE2-CE2 4.13Å; F218-F222 AromaticContact CE2-CG 3.99Å; F218-F222 HydrophobicContact CE2-CG 3.99Å; F218-F222 HydrophobicContact CG-CD2 4.02Å; F218-F222 HydrophobicContact CZ-CB 4.07Å; F218-F222 HydrophobicContact CZ-CD2 4.26Å; F218-F222 HydrophobicContact CZ-CG 4.26Å; F218-F222 WeakPolarHBondContact O-CB 3.46Å; F218-F222 WeakPolarHBondContact O-CD2 3.17Å; F218-F222 PolarHBondContact O-N 3.21Å
219S94Very high94Very high20 Ų2055.8 Ų55.814%0.1428%0.276CS..Hα-helixtrans-62.2-37.817970.50000111.2T215 L216 V223 H224T215-S219 WeakPolarHBondContact O-CB 3.2Å; T215-S219 PolarHBondContact O-N 3.43Å; T215-S219 PolarHBondContact O-OG 2.9Å; L216-S219 PolarHBondContact O-OG 3.33Å; S219-V223 CarbonylContact O-C 3.51Å; S219-V223 WeakPolarHBondContact O-CA 3.29Å; S219-V223 VanDerWaalsContact O-CB 3.23Å; S219-V223 WeakPolarHBondContact O-CB 3.47Å; S219-V223 PolarHBondContact O-N 2.86Å; S219-H224 PolarHBondContact O-CD2 2.94Å; S219-H224 PolarHBondContact O-N 3.08Å
220F94.9Very high94.1Very high11 Ų1162 Ų625%0.04830%0.3CS..Iπ-helixtrans-59.7-55.5178.1177.8-112.9000112.6V152 I155 T156 L216 F217 F218 I225V152-F220 HydrophobicContact CB-CD1 4.5Å; V152-F220 HydrophobicContact CB-CG 4.31Å; V152-F220 HydrophobicContact CG1-CB 3.53Å; V152-F220 HydrophobicContact CG1-CD1 4.19Å; V152-F220 HydrophobicContact CG1-CD2 3.84Å; V152-F220 HydrophobicContact CG1-CG 3.59Å; V152-F220 HydrophobicContact CG2-CD1 3.81Å; V152-F220 HydrophobicContact CG2-CE1 4.15Å; V152-F220 HydrophobicContact CG2-CG 4.09Å; I155-F220 HydrophobicContact CB-CE2 4.02Å; I155-F220 HydrophobicContact CB-CZ 4.06Å; I155-F220 HydrophobicContact CD1-CZ 4.49Å; I155-F220 HydrophobicContact CG2-CE2 3.76Å; I155-F220 HydrophobicContact CG2-CZ 3.71Å; T156-F220 VanDerWaalsContact OG1-CD2 3.28Å; T156-F220 WeakPolarHBondContact OG1-CD2 3.22Å; L216-F220 WeakPolarHBondContact O-CB 3.41Å; L216-F220 PolarHBondContact O-N 3.08Å; F217-F220 PolarHBondContact O-N 3.38Å; F218-F220 VanDerWaalsContact C-N 3.27Å; F218-F220 PolarHBondContact O-N 2.98Å; F220-I225 HydrophobicContact CD1-CD1 4.42Å; F220-I225 HydrophobicContact CE1-CD1 3.96Å; F220-I225 HydrophobicContact CE2-CD1 4.34Å; F220-I225 HydrophobicContact CE2-CG1 4.44Å; F220-I225 HydrophobicContact CZ-CD1 3.92Å; F220-I225 HydrophobicContact CZ-CG1 4.49Å; F220-I225 PolarHBondContact O-N 2.88Å
221Y95Very high94Very high129 Ų12960.9 Ų60.951%0.50629%0.291SS..Iπ-helixtrans-75.4-37.6-174.9-68.3-66.8000113.4F217 F218 I225 P226F217-Y221 HydrophobicContact CD1-CE2 4.39Å; F217-Y221 WeakPolarHBondContact O-CD2 3.33Å; F217-Y221 PolarHBondContact O-N 3.17Å; F218-Y221 PolarHBondContact O-N 2.97Å; Y221-I225 HydrophobicContact CD1-CD1 4.35Å; Y221-P226 WeakPolarHBondContact O-CD 3.48Å
222F95.3Very high93.8Very high138 Ų13859.7 Ų59.761%0.60529%0.285SS*.Iπ-helixtrans-105.5-11.6-169.4-61.8-77.9000114.3F218F218-F222 AromaticContact CD2-CD2 3.46Å; F218-F222 HydrophobicContact CD2-CD2 3.46Å; F218-F222 VanDerWaalsContact CD2-CD2 3.46Å; F218-F222 AromaticContact CD2-CE2 3.93Å; F218-F222 HydrophobicContact CD2-CE2 3.93Å; F218-F222 HydrophobicContact CD2-CG 4.27Å; F218-F222 HydrophobicContact CE1-CB 4.22Å; F218-F222 HydrophobicContact CE2-CB 4.27Å; F218-F222 AromaticContact CE2-CD2 3.6Å; F218-F222 HydrophobicContact CE2-CD2 3.6Å; F218-F222 HydrophobicContact CE2-CE2 4.13Å; F218-F222 AromaticContact CE2-CG 3.99Å; F218-F222 HydrophobicContact CE2-CG 3.99Å; F218-F222 HydrophobicContact CG-CD2 4.02Å; F218-F222 HydrophobicContact CZ-CB 4.07Å; F218-F222 HydrophobicContact CZ-CD2 4.26Å; F218-F222 HydrophobicContact CZ-CG 4.26Å; F218-F222 WeakPolarHBondContact O-CB 3.46Å; F218-F222 WeakPolarHBondContact O-CD2 3.17Å; F218-F222 PolarHBondContact O-N 3.21Å
223V93.1Very high93.5Very high53 Ų5362.4 Ų62.432%0.32130%0.301SS..Iπ-helixtrans-121.1-60.8-179.3-176.30000110.9S219 I227S219-V223 CarbonylContact O-C 3.51Å; S219-V223 WeakPolarHBondContact O-CA 3.29Å; S219-V223 VanDerWaalsContact O-CB 3.23Å; S219-V223 WeakPolarHBondContact O-CB 3.47Å; S219-V223 PolarHBondContact O-N 2.86Å; V223-I227 HydrophobicContact CG1-CD1 3.58Å; V223-I227 VanDerWaalsContact O-CB 3.31Å; V223-I227 WeakPolarHBondContact O-CB 3.29Å; V223-I227 WeakPolarHBondContact O-CD1 3.1Å; V223-I227 WeakPolarHBondContact O-CG1 3.39Å; V223-I227 PolarHBondContact O-N 2.97Å
224H93Very high93.2Very high22 Ų2268.4 Ų68.410%0.10232%0.323CS..Iπ-helixtrans-62.9-56.3-174.5-73.4-75.4000112.6T175 S219 I227 T228T175-H224 PolarHBondContact OG1-CE1 2.84Å; T175-H224 PolarHBondContact OG1-NE2 3.36Å; S219-H224 PolarHBondContact O-CD2 2.94Å; S219-H224 PolarHBondContact O-N 3.08Å; H224-I227 PolarHBondContact O-N 2.8Å; H224-T228 PolarHBondContact O-N 3.49Å; H224-T228 PolarHBondContact O-OG1 3.18Å
225I94.9Very high92.8Very high55 Ų5565.5 Ų65.528%0.28231%0.313SS..Hα-helixtrans-57.6-51.3-179.3-71.1170.6000111.7L159 F220 Y221 I227 T228 I229L159-I225 HydrophobicContact CD1-CG1 4.07Å; F220-I225 HydrophobicContact CD1-CD1 4.42Å; F220-I225 HydrophobicContact CE1-CD1 3.96Å; F220-I225 HydrophobicContact CE2-CD1 4.34Å; F220-I225 HydrophobicContact CE2-CG1 4.44Å; F220-I225 HydrophobicContact CZ-CD1 3.92Å; F220-I225 HydrophobicContact CZ-CG1 4.49Å; F220-I225 PolarHBondContact O-N 2.88Å; Y221-I225 HydrophobicContact CD1-CD1 4.35Å; I225-I227 PolarHBondContact O-N 3.37Å; I225-T228 PolarHBondContact O-N 3.26Å; I225-I229 HydrophobicContact CG2-CD1 3.84Å; I225-I229 WeakPolarHBondContact O-CG1 3.31Å; I225-I229 PolarHBondContact O-N 2.89Å
226P95.2Very high92Very high61 Ų6162.9 Ų62.940%0.39630%0.298SS..Hα-helixtrans-60.4-40.5178.5-28.137.6000114.2Y221 I229 W230Y221-P226 WeakPolarHBondContact O-CD 3.48Å; P226-I229 PolarHBondContact O-N 3.2Å; P226-W230 WeakPolarHBondContact O-CB 3.28Å; P226-W230 PolarHBondContact O-N 2.98Å
227I93.9Very high90.2Very high71 Ų7166.7 Ų66.736%0.36432%0.324SS..Hα-helixtrans-66.3-44.7179.4-70.8172.5000110.9V223 H224 I225 I229 W230 N231V223-I227 HydrophobicContact CG1-CD1 3.58Å; V223-I227 VanDerWaalsContact O-CB 3.31Å; V223-I227 WeakPolarHBondContact O-CB 3.29Å; V223-I227 WeakPolarHBondContact O-CD1 3.1Å; V223-I227 WeakPolarHBondContact O-CG1 3.39Å; V223-I227 PolarHBondContact O-N 2.97Å; H224-I227 PolarHBondContact O-N 2.8Å; I225-I227 PolarHBondContact O-N 3.37Å; I227-I229 VanDerWaalsContact C-N 3.33Å; I227-I229 PolarHBondContact O-N 3.45Å; I227-W230 PolarHBondContact O-N 2.88Å; I227-N231 WeakPolarHBondContact O-CB 3.41Å; I227-N231 PolarHBondContact O-N 2.86Å
228T93.8Very high88.7Confident11 Ų1171.2 Ų71.27%0.06735%0.351CS..Hα-helixtrans-58.1-45.4175.6-67.70000111.2W162 E163 H224 I225 W230 I232W162-T228 HydrophobicContact CE3-CG2 4.09Å; W162-T228 HydrophobicContact CZ3-CG2 4.05Å; E163-T228 HydrophobicContact CB-CG2 3.99Å; E163-T228 HydrophobicContact CG-CG2 4.36Å; H224-T228 PolarHBondContact O-N 3.49Å; H224-T228 PolarHBondContact O-OG1 3.18Å; I225-T228 PolarHBondContact O-N 3.26Å; T228-W230 PolarHBondContact O-N 2.95Å; T228-I232 HydrophobicContact CG2-CD1 3.95Å; T228-I232 WeakPolarHBondContact O-CD1 3.28Å; T228-I232 VanDerWaalsContact O-CG1 3.26Å; T228-I232 WeakPolarHBondContact O-CG1 3.45Å; T228-I232 PolarHBondContact O-N 3.34Å; T228-I232 VanDerWaalsContact O-N 3.09Å
229I92.7Very high86.7Confident81 Ų8176.3 Ų76.342%0.41537%0.372SS..Hα-helixtrans-62.7-44.6176.3-67.7169.3000110.9I225 P226 I227 I232 I233I225-I229 HydrophobicContact CG2-CD1 3.84Å; I225-I229 WeakPolarHBondContact O-CG1 3.31Å; I225-I229 PolarHBondContact O-N 2.89Å; P226-I229 PolarHBondContact O-N 3.2Å; I227-I229 VanDerWaalsContact C-N 3.33Å; I227-I229 PolarHBondContact O-N 3.45Å; I229-I232 PolarHBondContact O-N 3.25Å; I229-I233 HydrophobicContact CG2-CD1 3.66Å; I229-I233 HydrophobicContact CG2-CG1 4.37Å; I229-I233 VanDerWaalsContact O-CG1 3.3Å; I229-I233 WeakPolarHBondContact O-CG1 3.39Å; I229-I233 PolarHBondContact O-N 3Å
230W92.3Very high84.8Confident131 Ų13182.2 Ų82.250%0.49640%0.398SS..Hα-helixtrans-61-46.2179.8174.281.6000112.5P226 I227 T228 I233 R234P226-W230 WeakPolarHBondContact O-CB 3.28Å; P226-W230 PolarHBondContact O-N 2.98Å; I227-W230 PolarHBondContact O-N 2.88Å; T228-W230 PolarHBondContact O-N 2.95Å; W230-I233 PolarHBondContact O-N 3.38Å; W230-R234 VanDerWaalsContact O-CB 3.26Å; W230-R234 WeakPolarHBondContact O-CB 3.37Å; W230-R234 PolarHBondContact O-N 3.2Å
231N91.7Very high82.4Confident14 Ų1484.9 Ų84.98%0.07542%0.416CS..Hα-helixtrans-61.8-42.4176.7-79-21.4000112.1E163 F171 I227 R234 T235E163-N231 WeakPolarHBondContact OE1-CB 3.16Å; E163-N231 VanDerWaalsContact OE1-CG 3.23Å; E163-N231 PolarHBondContact OE1-ND2 3.47Å; F171-N231 HydrophobicContact CD2-CB 4.33Å; F171-N231 HydrophobicContact CE2-CB 4.35Å; F171-N231 HydrophobicContact CG-CB 4.47Å; I227-N231 WeakPolarHBondContact O-CB 3.41Å; I227-N231 PolarHBondContact O-N 2.86Å; N231-R234 PolarHBondContact O-N 3.48Å; N231-T235 VanDerWaalsContact O-CB 3.29Å; N231-T235 WeakPolarHBondContact O-CB 3.34Å; N231-T235 PolarHBondContact O-N 3.39Å; N231-T235 PolarHBondContact O-OG1 3.46Å
232I89.8Confident80.5Confident19 Ų1981.7 Ų81.710%0.09740%0.403CS..Hα-helixtrans-59.2-50.8175-69.8164.9000110.1W162 E163 I166 T167 T228 I229 R234 T235 C236W162-I232 HydrophobicContact CE3-CD1 4.01Å; W162-I232 HydrophobicContact CH2-CD1 3.96Å; W162-I232 HydrophobicContact CZ3-CD1 3.54Å; E163-I232 HydrophobicContact CG-CG1 4.07Å; I166-I232 HydrophobicContact CD1-CD1 3.74Å; I166-I232 HydrophobicContact CD1-CG1 4.32Å; I166-I232 HydrophobicContact CG2-CG2 4.08Å; T167-I232 HydrophobicContact CG2-CG1 4.16Å; T228-I232 HydrophobicContact CG2-CD1 3.95Å; T228-I232 WeakPolarHBondContact O-CD1 3.28Å; T228-I232 VanDerWaalsContact O-CG1 3.26Å; T228-I232 WeakPolarHBondContact O-CG1 3.45Å; T228-I232 PolarHBondContact O-N 3.34Å; T228-I232 VanDerWaalsContact O-N 3.09Å; I229-I232 PolarHBondContact O-N 3.25Å; I232-R234 PolarHBondContact O-N 3.45Å; I232-T235 PolarHBondContact O-N 2.93Å; I232-C236 PolarHBondContact O-N 3.06Å; I232-C236 PolarHBondContact O-SG 3.36Å
233I87.9Confident78.6Confident117 Ų11778.8 Ų78.860%0.639%0.391SS*.Hα-helixtrans-61.2-47.2-179.6-68168.9000110.7I229 W230 T235 C236I229-I233 HydrophobicContact CG2-CD1 3.66Å; I229-I233 HydrophobicContact CG2-CG1 4.37Å; I229-I233 VanDerWaalsContact O-CG1 3.3Å; I229-I233 WeakPolarHBondContact O-CG1 3.39Å; I229-I233 PolarHBondContact O-N 3Å; W230-I233 PolarHBondContact O-N 3.38Å; I233-T235 VanDerWaalsContact C-N 3.31Å; I233-T235 PolarHBondContact O-N 2.92Å; I233-C236 PolarHBondContact O-N 3.23Å
234R87.1Confident77.5Confident167 Ų16780.8 Ų80.863%0.6339%0.393SS*.Hα-helixtrans-64-35.3-177.9-176.6179.8172.3-154.2-2.4112.6W230 N231 I232 C236W230-R234 VanDerWaalsContact O-CB 3.26Å; W230-R234 WeakPolarHBondContact O-CB 3.37Å; W230-R234 PolarHBondContact O-N 3.2Å; N231-R234 PolarHBondContact O-N 3.48Å; I232-R234 PolarHBondContact O-N 3.45Å; R234-C236 VanDerWaalsContact C-N 3.28Å; R234-C236 PolarHBondContact O-N 3.36Å
235T85.5Confident76.5Confident38 Ų3883.2 Ų83.223%0.23342%0.424CS..Hα-helixtrans-82.9-3.3-178.8-48.50000112.9T167 N231 I232 I233 P237T167-T235 HydrophobicContact CG2-CG2 4.22Å; N231-T235 VanDerWaalsContact O-CB 3.29Å; N231-T235 WeakPolarHBondContact O-CB 3.34Å; N231-T235 PolarHBondContact O-N 3.39Å; N231-T235 PolarHBondContact O-OG1 3.46Å; I232-T235 PolarHBondContact O-N 2.93Å; I233-T235 VanDerWaalsContact C-N 3.31Å; I233-T235 PolarHBondContact O-N 2.92Å; T235-P237 WeakPolarHBondContact O-CD 3.17Å
236C76.6Confident75.9Confident18 Ų1882.7 Ų82.712%0.12242%0.422CS..  trans-114.772176.1-58.70000112.2I232 I233 R234 N238 H243I232-C236 PolarHBondContact O-N 3.06Å; I232-C236 PolarHBondContact O-SG 3.36Å; I233-C236 PolarHBondContact O-N 3.23Å; R234-C236 VanDerWaalsContact C-N 3.28Å; R234-C236 PolarHBondContact O-N 3.36Å; C236-N238 VanDerWaalsContact C-N 3.28Å; C236-N238 PolarHBondContact O-N 3.19Å; C236-H243 VanDerWaalsContact SG-CB 3.56Å; C236-H243 PolarHBondContact SG-N 2.89Å
237P57.3Low75.4Confident112 Ų11281.1 Ų81.173%0.72742%0.417SS*.THydrogen-bonded Turntrans-71.2-7.8-164.1-18.632.8000116.8T235T235-P237 WeakPolarHBondContact O-CD 3.17Å
238N62.1Low75Confident138 Ų13882.7 Ų82.774%0.73843%0.425SS*.THydrogen-bonded Turntrans-112.618.3-171.3-74.9-16.3000115.3C236 Q240C236-N238 VanDerWaalsContact C-N 3.28Å; C236-N238 PolarHBondContact O-N 3.19Å; N238-Q240 PolarHBondContact O-N 3.31Å
239K53.9Low74.8Confident196 Ų19689.2 Ų89.285%0.85245%0.449SS*.SBendtrans53.56.6-175.3-59.9-176.6179.5179.80115.2P241K239-P241 WeakPolarHBondContact O-CD 3.47Å; K239-P241 WeakPolarHBondContact O-CG 3.29Å; K239-P241 VanDerWaalsContact O-N 3.1Å
240Q54.9Low74.7Confident144 Ų14485.7 Ų85.767%0.67343%0.432SS*.  trans-63.9103.8154.3-66.1-64.8-17.900103.3N238 W242N238-Q240 PolarHBondContact O-N 3.31Å; Q240-W242 PolarHBondContact O-N 3.34Å
241P43.6Very low74.6Confident67 Ų6779.9 Ų79.944%0.43541%0.411SS..SBendtrans-71.46.6-158.3-1.912.2000113.5K239K239-P241 WeakPolarHBondContact O-CD 3.47Å; K239-P241 WeakPolarHBondContact O-CG 3.29Å; K239-P241 VanDerWaalsContact O-N 3.1Å
242W56.7Low74.7Confident62 Ų6282.3 Ų82.324%0.23542%0.423CS..SBendtrans-146.697.5-164.8-32.298.2000107.8Q240 R244 G245 L246 G247 L248 V251Q240-W242 PolarHBondContact O-N 3.34Å; W242-R244 PolarHBondContact O-N 3.11Å; W242-G245 PolarHBondContact O-N 3.13Å; W242-L246 HydrophobicContact CB-CB 4.06Å; W242-G247 VanDerWaalsContact CD2-C 3.41Å; W242-G247 VanDerWaalsContact CD2-O 3.31Å; W242-G247 VanDerWaalsContact NE1-C 3.27Å; W242-L248 HydrophobicContact CH2-CB 4.05Å; W242-L248 HydrophobicContact CH2-CD1 3.27Å; W242-L248 HydrophobicContact CH2-CG 4.25Å; W242-L248 HydrophobicContact CZ2-CB 3.45Å; W242-L248 VanDerWaalsContact CZ2-CB 3.45Å; W242-L248 HydrophobicContact CZ2-CD1 3.55Å; W242-L248 HydrophobicContact CZ2-CG 4.09Å; W242-L248 HydrophobicContact CZ3-CD1 4.25Å; W242-L248 VanDerWaalsContact NE1-N 3.14Å; W242-V251 HydrophobicContact CB-CG2 4.25Å; W242-V251 HydrophobicContact CD2-CB 4.44Å; W242-V251 HydrophobicContact CD2-CG2 3.83Å; W242-V251 HydrophobicContact CE3-CB 3.55Å; W242-V251 HydrophobicContact CE3-CG1 4Å; W242-V251 HydrophobicContact CE3-CG2 3.05Å; W242-V251 HydrophobicContact CG-CG2 4.35Å; W242-V251 HydrophobicContact CZ3-CB 3.6Å; W242-V251 HydrophobicContact CZ3-CG1 3.65Å; W242-V251 HydrophobicContact CZ3-CG2 3.65Å
243H54.4Low74.9Confident77 Ų7784 Ų8436%0.35643%0.429SS..G310 helixtrans-50142.9167.6-171.696.2000109I166 T167 C236 G245I166-H243 CarbonylContact O-C 3.47Å; I166-H243 VanDerWaalsContact O-CB 3.27Å; I166-H243 WeakPolarHBondContact O-CB 3.49Å; I166-H243 PolarHBondContact O-CD2 3.05Å; T167-H243 PolarHBondContact O-CD2 2.89Å; T167-H243 PolarHBondContact O-NE2 3.34Å; T167-H243 VanDerWaalsContact O-NE2 3.12Å; C236-H243 VanDerWaalsContact SG-CB 3.56Å; C236-H243 PolarHBondContact SG-N 2.89Å; H243-G245 VanDerWaalsContact C-N 3.34Å; H243-G245 PolarHBondContact O-N 2.91Å
244R70.5Confident75.3Confident95 Ų9578.6 Ų78.636%0.35840%0.401SS..G310 helixtrans6810.1-167.6-46.9-163.5-95.6-161.5-13117.9K164 Y165 W242 L246K164-R244 PolarHBondContact O-NH2 3.48Å; Y165-R244 VanDerWaalsContact CA-NH2 3.27Å; Y165-R244 VanDerWaalsContact O-CZ 3.27Å; Y165-R244 PolarHBondContact O-NE 2.84Å; Y165-R244 PolarHBondContact O-NH2 3.39Å; W242-R244 PolarHBondContact O-N 3.11Å; R244-L246 HydrophobicContact CB-CG 4.35Å; R244-L246 PolarHBondContact O-N 2.9Å
245G72.5Confident75.7Confident73 Ų7373.3 Ų73.375%0.75339%0.385SS*.G310 helixtrans73.526.3172.600000114.4W242 H243 G247W242-G245 PolarHBondContact O-N 3.13Å; H243-G245 VanDerWaalsContact C-N 3.34Å; H243-G245 PolarHBondContact O-N 2.91Å; G245-G247 PolarHBondContact O-N 3.44Å
246L80.8Confident76.3Confident45 Ų4574.7 Ų74.724%0.23639%0.39CS..  trans-73.1-22.6-172.9-71.2173000115Y165 W242 R244 G250Y165-L246 HydrophobicContact CD1-CD1 4.08Å; Y165-L246 HydrophobicContact CE1-CD1 3.65Å; Y165-L246 HydrophobicContact CE1-CD2 4.29Å; W242-L246 HydrophobicContact CB-CB 4.06Å; R244-L246 HydrophobicContact CB-CG 4.35Å; R244-L246 PolarHBondContact O-N 2.9Å; L246-G250 WeakPolarHBondContact O-CA 3.42Å; L246-G250 PolarHBondContact O-N 3.35Å; L246-G250 VanDerWaalsContact O-N 3.09Å
247G84.9Confident77.3Confident28 Ų2874.2 Ų74.229%0.28939%0.387SS..Hα-helixtrans68.6173.1-169.500000112.9W242 G245 W249 G250 V251W242-G247 VanDerWaalsContact CD2-C 3.41Å; W242-G247 VanDerWaalsContact CD2-O 3.31Å; W242-G247 VanDerWaalsContact NE1-C 3.27Å; G245-G247 PolarHBondContact O-N 3.44Å; G247-W249 PolarHBondContact O-N 2.98Å; G247-G250 PolarHBondContact O-N 3.4Å; G247-V251 PolarHBondContact O-N 3.42Å
248L86.4Confident79.3Confident104 Ų10469.6 Ų69.655%0.54536%0.357SS..Hα-helixtrans-57.9-39.417617662.4000110.9W242 V251 I252W242-L248 HydrophobicContact CH2-CB 4.05Å; W242-L248 HydrophobicContact CH2-CD1 3.27Å; W242-L248 HydrophobicContact CH2-CG 4.25Å; W242-L248 HydrophobicContact CZ2-CB 3.45Å; W242-L248 VanDerWaalsContact CZ2-CB 3.45Å; W242-L248 HydrophobicContact CZ2-CD1 3.55Å; W242-L248 HydrophobicContact CZ2-CG 4.09Å; W242-L248 HydrophobicContact CZ3-CD1 4.25Å; W242-L248 VanDerWaalsContact NE1-N 3.14Å; L248-V251 PolarHBondContact O-N 3.39Å; L248-I252 HydrophobicContact CD1-CD1 3.84Å; L248-I252 HydrophobicContact CD1-CG1 4.29Å; L248-I252 HydrophobicContact CG-CD1 3.87Å; L248-I252 WeakPolarHBondContact O-CG1 3.35Å; L248-I252 PolarHBondContact O-N 2.84Å; L248-I252 VanDerWaalsContact O-N 3.08Å
249W89.5Confident81Confident148 Ų14864.7 Ų64.756%0.56134%0.339SS*.Hα-helixtrans-61.8-48.2179.1-179.1-121.2000112.6G247 V251 I252 R253 M311G247-W249 PolarHBondContact O-N 2.98Å; W249-V251 PolarHBondContact O-N 3.46Å; W249-I252 PolarHBondContact O-N 3.33Å; W249-R253 VanDerWaalsContact O-CB 3.27Å; W249-R253 WeakPolarHBondContact O-CB 3.41Å; W249-R253 PolarHBondContact O-N 3.09Å; W249-M311 HydrophobicContact CH2-SD 4.09Å; W249-M311 HydrophobicContact CZ2-CE 4.34Å; W249-M311 HydrophobicContact CZ2-SD 3.43Å; W249-M311 WeakPolarHBondContact CZ2-SD 3.34Å
250G89.5Confident83.1Confident6 Ų658.1 Ų58.16%0.06231%0.312CS..Hα-helixtrans-62.1-27.9-18000000112.5Y165 L246 G247 P254Y165-G250 WeakPolarHBondContact CE1-O 3.42Å; L246-G250 WeakPolarHBondContact O-CA 3.42Å; L246-G250 PolarHBondContact O-N 3.35Å; L246-G250 VanDerWaalsContact O-N 3.09Å; G247-G250 PolarHBondContact O-N 3.4Å; G250-P254 WeakPolarHBondContact O-CD 3.39Å
251V90.6Very high85.2Confident9 Ų951.2 Ų51.26%0.05528%0.28CS..Hα-helixtrans-78.1-37.3176169.20000113.9W162 I166 W242 G247 L248 W249 P254W162-V251 HydrophobicContact CH2-CG1 4.49Å; W162-V251 HydrophobicContact CZ2-CG1 3.48Å; W162-V251 VanDerWaalsContact CZ2-CG1 3.48Å; W162-V251 PolarHBondContact NE1-O 2.88Å; I166-V251 HydrophobicContact CD1-CB 4.38Å; I166-V251 HydrophobicContact CD1-CG1 3.66Å; I166-V251 HydrophobicContact CD1-CG2 4.01Å; I166-V251 HydrophobicContact CG1-CB 4.49Å; I166-V251 HydrophobicContact CG1-CG1 4.28Å; I166-V251 HydrophobicContact CG1-CG2 3.75Å; I166-V251 HydrophobicContact CG2-CG2 4.3Å; W242-V251 HydrophobicContact CB-CG2 4.25Å; W242-V251 HydrophobicContact CD2-CB 4.44Å; W242-V251 HydrophobicContact CD2-CG2 3.83Å; W242-V251 HydrophobicContact CE3-CB 3.55Å; W242-V251 HydrophobicContact CE3-CG1 4Å; W242-V251 HydrophobicContact CE3-CG2 3.05Å; W242-V251 HydrophobicContact CG-CG2 4.35Å; W242-V251 HydrophobicContact CZ3-CB 3.6Å; W242-V251 HydrophobicContact CZ3-CG1 3.65Å; W242-V251 HydrophobicContact CZ3-CG2 3.65Å; G247-V251 PolarHBondContact O-N 3.42Å; L248-V251 PolarHBondContact O-N 3.39Å; W249-V251 PolarHBondContact O-N 3.46Å; V251-P254 WeakPolarHBondContact O-CD 3.3Å; V251-P254 WeakPolarHBondContact O-CG 3.34Å
252I93.2Very high87.8Confident65 Ų6550.2 Ų50.233%0.33327%0.271SS..Hα-helixtrans-73.3-33.8175.6-66.5171.7000111.2L248 W249 L255 I256L248-I252 HydrophobicContact CD1-CD1 3.84Å; L248-I252 HydrophobicContact CD1-CG1 4.29Å; L248-I252 HydrophobicContact CG-CD1 3.87Å; L248-I252 WeakPolarHBondContact O-CG1 3.35Å; L248-I252 PolarHBondContact O-N 2.84Å; L248-I252 VanDerWaalsContact O-N 3.08Å; W249-I252 PolarHBondContact O-N 3.33Å; I252-L255 WeakPolarHBondContact O-CA 3.35Å; I252-L255 VanDerWaalsContact O-CB 3.3Å; I252-L255 WeakPolarHBondContact O-CB 3.34Å; I252-L255 PolarHBondContact O-N 2.78Å; I252-I256 HydrophobicContact CG2-CD1 3.9Å; I252-I256 HydrophobicContact CG2-CG1 4.44Å; I252-I256 PolarHBondContact O-N 3.19Å
253R94.5Very high89.8Confident55 Ų5553.6 Ų53.621%0.20829%0.287CS..THydrogen-bonded Turntrans-42.8-53.6-176.2-175.1174176106.15.6115.4W249 L255 I256 A309 M311W249-R253 VanDerWaalsContact O-CB 3.27Å; W249-R253 WeakPolarHBondContact O-CB 3.41Å; W249-R253 PolarHBondContact O-N 3.09Å; R253-L255 PolarHBondContact O-N 2.87Å; R253-I256 PolarHBondContact O-N 3.25Å; R253-A309 VanDerWaalsContact CZ-O 3.32Å; R253-A309 PolarHBondContact NE-O 2.66Å; R253-A309 PolarHBondContact NH2-O 3.08Å; R253-M311 HydrophobicContact CG-CG 3.47Å; R253-M311 VanDerWaalsContact CG-CG 3.47Å; R253-M311 HydrophobicContact CG-SD 3.89Å
254P95.9Very high91.9Very high4 Ų450.2 Ų50.23%0.02627%0.273CS..THydrogen-bonded Turntrans-65.8-19.4177.626.8-38.4000114.7Y165 G250 V251 L299 A309Y165-P254 HydrophobicContact CD1-CG 3.98Å; Y165-P254 HydrophobicContact CE1-CG 4.26Å; G250-P254 WeakPolarHBondContact O-CD 3.39Å; V251-P254 WeakPolarHBondContact O-CD 3.3Å; V251-P254 WeakPolarHBondContact O-CG 3.34Å; P254-L299 HydrophobicContact CB-CD1 3.67Å; P254-L299 HydrophobicContact CB-CD2 4.23Å; P254-A309 HydrophobicContact CB-CB 3.8Å; P254-A309 HydrophobicContact CG-CB 4.48Å
255L96.6Very high93.2Very high55 Ų5545.7 Ų45.729%0.28826%0.256SS..Hα-helixtrans-82-17.4179.9-56.7179000112.9W162 I252 R253 V258 G259W162-L255 HydrophobicContact CD2-CD2 4.19Å; W162-L255 HydrophobicContact CG-CD2 3.97Å; W162-L255 HydrophobicContact CZ2-CD1 3.97Å; I252-L255 WeakPolarHBondContact O-CA 3.35Å; I252-L255 VanDerWaalsContact O-CB 3.3Å; I252-L255 WeakPolarHBondContact O-CB 3.34Å; I252-L255 PolarHBondContact O-N 2.78Å; R253-L255 PolarHBondContact O-N 2.87Å; L255-V258 WeakPolarHBondContact O-CG1 3.41Å; L255-G259 PolarHBondContact O-N 3.21Å
256I97.8Very high94.4Very high68 Ų6846 Ų4635%0.34924%0.235SC..Hα-helixtrans-60-55-178.5-60.2-59.3000113.2I252 R253 V258 G259 L260I252-I256 HydrophobicContact CG2-CD1 3.9Å; I252-I256 HydrophobicContact CG2-CG1 4.44Å; I252-I256 PolarHBondContact O-N 3.19Å; R253-I256 PolarHBondContact O-N 3.25Å; I256-V258 PolarHBondContact O-N 2.95Å; I256-G259 PolarHBondContact O-N 2.89Å; I256-L260 PolarHBondContact O-N 3.44Å
257P98.2Very high95.2Very high7 Ų745.1 Ų45.15%0.04523%0.23CC..Hα-helixtrans-65.1-38.9-177.524.2-34.8000112.8L261 V295 N313P257-L261 WeakPolarHBondContact O-CB 3.42Å; P257-L261 PolarHBondContact O-N 2.78Å; P257-V295 HydrophobicContact CB-CG1 3.99Å; P257-V295 HydrophobicContact CB-CG2 4.16Å; P257-V295 HydrophobicContact CG-CG1 3.79Å; P257-N313 HydrophobicContact CB-CB 4.2Å
258V97.9Very high95.7Very high16 Ų1643.8 Ų43.810%0.09722%0.216CC..Hα-helixtrans-69.5-37.3175.7660000111.6W151 L158 L255 I256 L261 L262 V295W151-V258 HydrophobicContact CZ3-CG2 4.01Å; L158-V258 HydrophobicContact CD2-CB 3.78Å; L158-V258 HydrophobicContact CD2-CG1 3.46Å; L158-V258 VanDerWaalsContact CD2-CG1 3.46Å; L158-V258 HydrophobicContact CD2-CG2 3.88Å; L255-V258 WeakPolarHBondContact O-CG1 3.41Å; I256-V258 PolarHBondContact O-N 2.95Å; V258-L261 PolarHBondContact O-N 3.42Å; V258-L262 VanDerWaalsContact O-CB 3.24Å; V258-L262 WeakPolarHBondContact O-CB 3.36Å; V258-L262 PolarHBondContact O-N 3.49Å; V258-V295 HydrophobicContact CB-CG1 4.39Å
259G98.1Very high96.2Very high35 Ų3539.2 Ų39.236%0.36119%0.193SC..Hα-helixtrans-65-42.7178.500000111.6L255 I256 F263L255-G259 PolarHBondContact O-N 3.21Å; I256-G259 PolarHBondContact O-N 2.89Å; G259-F263 VanDerWaalsContact O-CB 3.29Å; G259-F263 WeakPolarHBondContact O-CB 3.48Å; G259-F263 PolarHBondContact O-N 3.43Å
260L98.4Very high96.5Very high57 Ų5737.2 Ų37.230%0.29819%0.186SC..Hα-helixtrans-63.1-46.7172.9178.859.1000111.4I256 L262 F263 S264 V316 Y317I256-L260 PolarHBondContact O-N 3.44Å; L260-L262 PolarHBondContact O-N 3.01Å; L260-F263 PolarHBondContact O-N 3.26Å; L260-S264 WeakPolarHBondContact O-CB 3.26Å; L260-S264 PolarHBondContact O-N 2.93Å; L260-S264 PolarHBondContact O-OG 3.34Å; L260-V316 HydrophobicContact CB-CG1 4.04Å; L260-V316 HydrophobicContact CD2-CG1 3.77Å; L260-V316 HydrophobicContact CG-CG1 3.76Å; L260-Y317 HydrophobicContact CD2-CD1 3.81Å; L260-Y317 HydrophobicContact CD2-CE1 3.66Å
261L98.7Very high96.7Very high0 Ų043.9 Ų43.90%021%0.211CC..Hα-helixtrans-59.1-48.4177.1-177.561.3000111.6W151 P257 V258 F263 S264 S265 I291 A292 V316 Y319W151-L261 HydrophobicContact CH2-CB 4.21Å; W151-L261 HydrophobicContact CH2-CD2 3.73Å; W151-L261 HydrophobicContact CH2-CG 3.67Å; W151-L261 HydrophobicContact CZ2-CD2 4.45Å; W151-L261 HydrophobicContact CZ2-CG 4.09Å; P257-L261 WeakPolarHBondContact O-CB 3.42Å; P257-L261 PolarHBondContact O-N 2.78Å; V258-L261 PolarHBondContact O-N 3.42Å; L261-F263 PolarHBondContact O-N 3.41Å; L261-S264 PolarHBondContact O-N 3.48Å; L261-S265 WeakPolarHBondContact O-CB 3.48Å; L261-S265 PolarHBondContact O-N 3Å; L261-S265 PolarHBondContact O-OG 3.09Å; L261-I291 HydrophobicContact CD1-CB 4.06Å; L261-I291 HydrophobicContact CD1-CD1 4.19Å; L261-I291 HydrophobicContact CD1-CG2 3.74Å; L261-I291 HydrophobicContact CD2-CB 3.91Å; L261-I291 HydrophobicContact CD2-CG2 3.72Å; L261-I291 HydrophobicContact CG-CG2 4.34Å; L261-A292 HydrophobicContact CD2-CB 4.03Å; L261-V316 HydrophobicContact CB-CG1 4.12Å; L261-V316 HydrophobicContact CB-CG2 4.05Å; L261-V316 HydrophobicContact CD1-CG2 4.41Å; L261-V316 HydrophobicContact CD2-CG2 4.45Å; L261-Y319 HydrophobicContact CD1-CD1 3.83Å; L261-Y319 HydrophobicContact CD1-CE1 4.13Å; L261-Y319 HydrophobicContact CD1-CG 4.21Å
262L98.4Very high96.8Very high45 Ų4544.1 Ų44.124%0.23621%0.213CC..Hα-helixtrans-56.5-52.6177.5-177.367.8000110.3W151 I155 V258 L260 S264 S265 Y266W151-L262 HydrophobicContact CB-CD1 4.16Å; W151-L262 HydrophobicContact CD2-CD1 3.27Å; W151-L262 HydrophobicContact CE3-CD1 3.61Å; W151-L262 HydrophobicContact CG-CD1 3.54Å; W151-L262 HydrophobicContact CH2-CB 4.17Å; W151-L262 HydrophobicContact CH2-CD1 4.24Å; W151-L262 HydrophobicContact CZ2-CB 4.37Å; W151-L262 HydrophobicContact CZ2-CD1 4.01Å; W151-L262 HydrophobicContact CZ3-CB 4.36Å; W151-L262 HydrophobicContact CZ3-CD1 4.07Å; I155-L262 HydrophobicContact CD1-CD2 4.25Å; V258-L262 VanDerWaalsContact O-CB 3.24Å; V258-L262 WeakPolarHBondContact O-CB 3.36Å; V258-L262 PolarHBondContact O-N 3.49Å; L260-L262 PolarHBondContact O-N 3.01Å; L262-S264 PolarHBondContact O-N 2.9Å; L262-S265 PolarHBondContact O-N 2.94Å; L262-Y266 HydrophobicContact CD1-CD2 3.93Å; L262-Y266 HydrophobicContact CD1-CE2 3.6Å; L262-Y266 HydrophobicContact CG-CD2 4.04Å; L262-Y266 HydrophobicContact CG-CE2 4.02Å; L262-Y266 VanDerWaalsContact O-CD2 3.32Å; L262-Y266 WeakPolarHBondContact O-CD2 3.4Å; L262-Y266 PolarHBondContact O-N 3.1Å
263F98.4Very high96.6Very high133 Ų13343.3 Ų43.358%0.58321%0.211SC*.Hα-helixtrans-59.2-47.5-179.8-178.7-106.9000112.1G259 L260 L261 S265 Y266 I267G259-F263 VanDerWaalsContact O-CB 3.29Å; G259-F263 WeakPolarHBondContact O-CB 3.48Å; G259-F263 PolarHBondContact O-N 3.43Å; L260-F263 PolarHBondContact O-N 3.26Å; L261-F263 PolarHBondContact O-N 3.41Å; F263-S265 VanDerWaalsContact C-N 3.35Å; F263-S265 PolarHBondContact O-N 3.32Å; F263-Y266 PolarHBondContact O-N 2.99Å; F263-I267 HydrophobicContact CD1-CD1 3.8Å; F263-I267 HydrophobicContact CE1-CD1 3.31Å; F263-I267 HydrophobicContact CE1-CG1 4.29Å; F263-I267 HydrophobicContact CE2-CD1 4.46Å; F263-I267 HydrophobicContact CZ-CD1 3.69Å; F263-I267 HydrophobicContact CZ-CG1 4.34Å; F263-I267 WeakPolarHBondContact O-CG1 3.34Å; F263-I267 PolarHBondContact O-N 3.26Å
264S98.4Very high96.4Very high7 Ų741.2 Ų41.25%0.04921%0.205CC..Hα-helixtrans-62.6-40.2175.3-66.60000112.1L260 L261 L262 Y266 I267 W268 S320 T323L260-S264 WeakPolarHBondContact O-CB 3.26Å; L260-S264 PolarHBondContact O-N 2.93Å; L260-S264 PolarHBondContact O-OG 3.34Å; L261-S264 PolarHBondContact O-N 3.48Å; L262-S264 PolarHBondContact O-N 2.9Å; S264-Y266 VanDerWaalsContact C-N 3.33Å; S264-Y266 PolarHBondContact O-N 3.28Å; S264-I267 WeakPolarHBondContact O-CB 3.17Å; S264-I267 PolarHBondContact O-N 3.24Å; S264-I267 VanDerWaalsContact O-N 3.15Å; S264-W268 PolarHBondContact O-N 2.83Å; S264-S320 WeakPolarHBondContact OG-CB 3.29Å; S264-S320 PolarHBondContact OG-OG 2.79Å; S264-S320 VanDerWaalsContact OG-OG 3.08Å; S264-T323 WeakPolarHBondContact O-CG2 3.36Å
265S98.4Very high96.2Very high0 Ų045 Ų450%023%0.225CC..Hα-helixtrans-65-36.5176.6-66.20000112.5L261 L262 F263 A269 C288 Y319L261-S265 WeakPolarHBondContact O-CB 3.48Å; L261-S265 PolarHBondContact O-N 3Å; L261-S265 PolarHBondContact O-OG 3.09Å; L262-S265 PolarHBondContact O-N 2.94Å; F263-S265 VanDerWaalsContact C-N 3.35Å; F263-S265 PolarHBondContact O-N 3.32Å; S265-A269 WeakPolarHBondContact O-CB 3.38Å; S265-A269 PolarHBondContact O-N 2.86Å; S265-C288 PolarHBondContact OG-SG 3.08Å; S265-C288 VanDerWaalsContact OG-SG 3.36Å; S265-Y319 WeakPolarHBondContact CA-OH 3.38Å; S265-Y319 WeakPolarHBondContact OG-CE1 3.23Å; S265-Y319 PolarHBondContact OG-OH 3.32Å; S265-Y319 VanDerWaalsContact OG-OH 3.06Å
266Y98.1Very high96Very high80 Ų8042.4 Ų42.431%0.31421%0.212SC..Hα-helixtrans-65.4-42.3170.7-90.3-88.6000111.5F147 L262 F263 S264 W268 A269 Y270F147-Y266 AromaticContact CE1-CD1 3.98Å; F147-Y266 HydrophobicContact CE1-CD1 3.98Å; F147-Y266 AromaticContact CE1-CD2 3.92Å; F147-Y266 HydrophobicContact CE1-CD2 3.92Å; F147-Y266 AromaticContact CE1-CE1 3.88Å; F147-Y266 HydrophobicContact CE1-CE1 3.88Å; F147-Y266 AromaticContact CE1-CE2 3.82Å; F147-Y266 HydrophobicContact CE1-CE2 3.82Å; F147-Y266 AromaticContact CE1-CG 3.99Å; F147-Y266 HydrophobicContact CE1-CG 3.99Å; F147-Y266 AromaticContact CE1-CZ 3.8Å; F147-Y266 HydrophobicContact CZ-CD2 4.11Å; F147-Y266 HydrophobicContact CZ-CE2 4.29Å; F147-Y266 HydrophobicContact CZ-CG 4.35Å; L262-Y266 HydrophobicContact CD1-CD2 3.93Å; L262-Y266 HydrophobicContact CD1-CE2 3.6Å; L262-Y266 HydrophobicContact CG-CD2 4.04Å; L262-Y266 HydrophobicContact CG-CE2 4.02Å; L262-Y266 VanDerWaalsContact O-CD2 3.32Å; L262-Y266 WeakPolarHBondContact O-CD2 3.4Å; L262-Y266 PolarHBondContact O-N 3.1Å; F263-Y266 PolarHBondContact O-N 2.99Å; S264-Y266 VanDerWaalsContact C-N 3.33Å; S264-Y266 PolarHBondContact O-N 3.28Å; Y266-W268 PolarHBondContact O-N 2.92Å; Y266-A269 PolarHBondContact O-N 2.99Å; Y266-Y270 AromaticContact CD1-CD2 3.95Å; Y266-Y270 HydrophobicContact CD1-CD2 3.95Å; Y266-Y270 AromaticContact CD1-CE2 3.5Å; Y266-Y270 HydrophobicContact CD1-CE2 3.5Å; Y266-Y270 AromaticContact CE1-CE2 3.87Å; Y266-Y270 HydrophobicContact CE1-CE2 3.87Å; Y266-Y270 VanDerWaalsContact O-CD2 3.28Å; Y266-Y270 WeakPolarHBondContact O-CD2 3.26Å; Y266-Y270 PolarHBondContact O-N 3.11Å; Y266-Y270 VanDerWaalsContact O-N 3.09Å
267I97.3Very high95.9Very high26 Ų2639.2 Ų39.213%0.13320%0.196CC..Hα-helixtrans-57.2-52.3174.8-72.1172.9000110.1F263 S264 A269 Y270 Y271 T323 C327 F328F263-I267 HydrophobicContact CD1-CD1 3.8Å; F263-I267 HydrophobicContact CE1-CD1 3.31Å; F263-I267 HydrophobicContact CE1-CG1 4.29Å; F263-I267 HydrophobicContact CE2-CD1 4.46Å; F263-I267 HydrophobicContact CZ-CD1 3.69Å; F263-I267 HydrophobicContact CZ-CG1 4.34Å; F263-I267 WeakPolarHBondContact O-CG1 3.34Å; F263-I267 PolarHBondContact O-N 3.26Å; S264-I267 WeakPolarHBondContact O-CB 3.17Å; S264-I267 PolarHBondContact O-N 3.24Å; S264-I267 VanDerWaalsContact O-N 3.15Å; I267-A269 VanDerWaalsContact C-N 3.34Å; I267-A269 PolarHBondContact O-N 3.26Å; I267-Y270 PolarHBondContact O-N 3.43Å; I267-Y271 HydrophobicContact CG2-CD2 4.32Å; I267-Y271 WeakPolarHBondContact O-CB 3.2Å; I267-Y271 WeakPolarHBondContact O-CD2 3.41Å; I267-Y271 PolarHBondContact O-N 3.48Å; I267-T323 HydrophobicContact CB-CG2 3.94Å; I267-T323 HydrophobicContact CG2-CG2 3.58Å; I267-C327 HydrophobicContact CG2-CB 4.2Å; I267-F328 HydrophobicContact CD1-CE2 4.49Å; I267-F328 HydrophobicContact CG2-CE2 3.57Å; I267-F328 HydrophobicContact CG2-CZ 3.79Å
268W96.4Very high95.6Very high0 Ų042.4 Ų42.40%021%0.21CC..Hα-helixtrans-64.6-40.8-177.2-157.3-6.6000111.5S264 Y266 Y270 S272 L276 F284 Y319 I322 T323 I326 E339 L343 I346S264-W268 PolarHBondContact O-N 2.83Å; Y266-W268 PolarHBondContact O-N 2.92Å; W268-Y270 VanDerWaalsContact C-N 3.33Å; W268-Y270 PolarHBondContact O-N 2.86Å; W268-S272 WeakPolarHBondContact O-CB 3.46Å; W268-S272 PolarHBondContact O-N 3.4Å; W268-L276 HydrophobicContact CD2-CD2 4.29Å; W268-L276 HydrophobicContact CH2-CD2 4.37Å; W268-L276 HydrophobicContact CZ2-CD2 3.38Å; W268-L276 VanDerWaalsContact NE1-CD2 3.25Å; W268-F284 HydrophobicContact CB-CE2 3.95Å; W268-F284 HydrophobicContact CB-CZ 4Å; W268-F284 AromaticContact CD2-CE2 3.82Å; W268-F284 HydrophobicContact CD2-CE2 3.82Å; W268-F284 HydrophobicContact CE3-CE2 4.17Å; W268-F284 AromaticContact CG-CE2 3.75Å; W268-F284 HydrophobicContact CG-CE2 3.75Å; W268-F284 HydrophobicContact CG-CZ 4.31Å; W268-Y319 HydrophobicContact CE3-CD2 4.19Å; W268-Y319 HydrophobicContact CE3-CE1 4.18Å; W268-Y319 AromaticContact CE3-CE2 3.46Å; W268-Y319 HydrophobicContact CE3-CE2 3.46Å; W268-Y319 VanDerWaalsContact CE3-CE2 3.46Å; W268-Y319 AromaticContact CE3-CZ 3.45Å; W268-Y319 VanDerWaalsContact CE3-CZ 3.45Å; W268-Y319 AromaticContact CZ3-CD2 3.85Å; W268-Y319 HydrophobicContact CZ3-CD2 3.85Å; W268-Y319 AromaticContact CZ3-CE2 3.4Å; W268-Y319 HydrophobicContact CZ3-CE2 3.4Å; W268-Y319 VanDerWaalsContact CZ3-CE2 3.4Å; W268-Y319 AromaticContact CZ3-CZ 3.93Å; W268-I322 HydrophobicContact CH2-CG2 4.18Å; W268-I322 HydrophobicContact CZ3-CG2 4.44Å; W268-T323 HydrophobicContact CB-CG2 3.66Å; W268-T323 VanDerWaalsContact CE3-OG1 3.31Å; W268-T323 HydrophobicContact CG-CG2 4.23Å; W268-I326 HydrophobicContact CZ2-CD1 3.89Å; W268-E339 PolarHBondContact NE1-OE1 3.26Å; W268-L343 HydrophobicContact CH2-CB 4.37Å; W268-L343 HydrophobicContact CH2-CD1 3.85Å; W268-L343 HydrophobicContact CZ2-CB 4.36Å; W268-L343 HydrophobicContact CZ2-CD1 4.3Å; W268-L343 HydrophobicContact CZ3-CD1 4.33Å; W268-I346 HydrophobicContact CH2-CG2 4.15Å; W268-I346 HydrophobicContact CZ3-CG2 4.47Å
269A96.2Very high95.4Very high7 Ų745.4 Ų45.46%0.05823%0.228CC..Hα-helixtrans-60.9-37.1178.500000113.9F147 S265 Y266 I267 L277 F284F147-A269 HydrophobicContact CD1-CB 4.49Å; F147-A269 HydrophobicContact CE1-CB 4.2Å; F147-A269 HydrophobicContact CE2-CB 4.48Å; F147-A269 HydrophobicContact CZ-CB 4.19Å; S265-A269 WeakPolarHBondContact O-CB 3.38Å; S265-A269 PolarHBondContact O-N 2.86Å; Y266-A269 PolarHBondContact O-N 2.99Å; I267-A269 VanDerWaalsContact C-N 3.34Å; I267-A269 PolarHBondContact O-N 3.26Å; A269-L277 HydrophobicContact CB-CB 4.48Å; A269-L277 HydrophobicContact CB-CD2 3.79Å; A269-F284 HydrophobicContact CB-CE1 4.34Å; A269-F284 HydrophobicContact CB-CZ 4.18Å
270Y94.6Very high95.2Very high107 Ų10745.2 Ų45.242%0.4222%0.219SC..Hα-helixtrans-103.9-26.5-172.3-74.5-90.1000114.6M148 Y266 I267 W268M148-Y270 VanDerWaalsContact CE-OH 3.29Å; M148-Y270 WeakPolarHBondContact CE-OH 3.44Å; Y266-Y270 AromaticContact CD1-CD2 3.95Å; Y266-Y270 HydrophobicContact CD1-CD2 3.95Å; Y266-Y270 AromaticContact CD1-CE2 3.5Å; Y266-Y270 HydrophobicContact CD1-CE2 3.5Å; Y266-Y270 AromaticContact CE1-CE2 3.87Å; Y266-Y270 HydrophobicContact CE1-CE2 3.87Å; Y266-Y270 VanDerWaalsContact O-CD2 3.28Å; Y266-Y270 WeakPolarHBondContact O-CD2 3.26Å; Y266-Y270 PolarHBondContact O-N 3.11Å; Y266-Y270 VanDerWaalsContact O-N 3.09Å; I267-Y270 PolarHBondContact O-N 3.43Å; W268-Y270 VanDerWaalsContact C-N 3.33Å; W268-Y270 PolarHBondContact O-N 2.86Å
271Y93.5Very high95.1Very high146 Ų14642.8 Ų42.857%0.57321%0.207SC*.Hα-helixtrans-107.95.8-178.6-62.7-84000113.3I267 P273 F328I267-Y271 HydrophobicContact CG2-CD2 4.32Å; I267-Y271 WeakPolarHBondContact O-CB 3.2Å; I267-Y271 WeakPolarHBondContact O-CD2 3.41Å; I267-Y271 PolarHBondContact O-N 3.48Å; Y271-P273 WeakPolarHBondContact O-CD 3.39Å; Y271-F328 HydrophobicContact CD1-CE1 4.44Å; Y271-F328 HydrophobicContact CG-CE1 4.41Å; Y271-F328 HydrophobicContact CG-CZ 4.36Å
272S93.2Very high95Very high14 Ų1443.6 Ų43.610%0.09821%0.21CC..  trans-55.1121.9172.3168.70000111.4W268 S274 N275 L276 E339W268-S272 WeakPolarHBondContact O-CB 3.46Å; W268-S272 PolarHBondContact O-N 3.4Å; S272-S274 PolarHBondContact O-N 3.36Å; S272-S274 PolarHBondContact OG-N 2.99Å; S272-N275 PolarHBondContact O-N 3.18Å; S272-N275 PolarHBondContact OG-N 3.4Å; S272-N275 VanDerWaalsContact OG-N 3.17Å; S272-L276 VanDerWaalsContact OG-CB 3.25Å; S272-L276 WeakPolarHBondContact OG-CB 3.47Å; S272-L276 PolarHBondContact OG-N 3.07Å; S272-E339 VanDerWaalsContact CB-OE1 3.25Å; S272-E339 WeakPolarHBondContact CB-OE1 3.17Å; S272-E339 PolarHBondContact OG-OE1 3.13Å; S272-E339 PolarHBondContact OG-OE2 3.4Å
273P90.6Very high94.9Very high47 Ų4743 Ų4331%0.30521%0.207SC..THydrogen-bonded Turntrans-60.3-30.6176.3-2534.6000114Y271 E339Y271-P273 WeakPolarHBondContact O-CD 3.39Å; P273-E339 WeakPolarHBondContact CD-OE2 3.33Å
274S90.2Very high94.9Very high11 Ų1136.6 Ų36.68%0.07718%0.18CC..THydrogen-bonded Turntrans-98.54.7-179.471.40000114.8S272 L276 E339S272-S274 PolarHBondContact O-N 3.36Å; S272-S274 PolarHBondContact OG-N 2.99Å; S274-L276 VanDerWaalsContact C-N 3.3Å; S274-L276 PolarHBondContact O-N 3.06Å; S274-E339 WeakPolarHBondContact CB-OE2 3.45Å; S274-E339 PolarHBondContact N-OE2 2.89Å; S274-E339 PolarHBondContact OG-OE2 2.92Å
275N91.3Very high94.9Very high84 Ų8436.5 Ų36.545%0.44918%0.178SC..  trans53.549.4-172.3-164.512.6000111.7S272 L277 E278 T279S272-N275 PolarHBondContact O-N 3.18Å; S272-N275 PolarHBondContact OG-N 3.4Å; S272-N275 VanDerWaalsContact OG-N 3.17Å; N275-L277 PolarHBondContact O-N 2.77Å; N275-E278 VanDerWaalsContact ND2-CG 3.29Å; N275-E278 WeakPolarHBondContact ND2-CG 3.28Å; N275-E278 PolarHBondContact O-N 3.48Å; N275-E278 VanDerWaalsContact OD1-CG 3.28Å; N275-E278 WeakPolarHBondContact OD1-CG 3.28Å; N275-T279 PolarHBondContact O-N 3.13Å; N275-T279 PolarHBondContact O-OG1 2.71Å
276L91.7Very high94.9Very high0 Ų038.4 Ų38.40%019%0.187CC..Hα-helixtrans-55.7-35.6-171-175.270.6000113.2W268 S272 S274 E278 T279 N280 F284 E339 C340 L343W268-L276 HydrophobicContact CD2-CD2 4.29Å; W268-L276 HydrophobicContact CH2-CD2 4.37Å; W268-L276 HydrophobicContact CZ2-CD2 3.38Å; W268-L276 VanDerWaalsContact NE1-CD2 3.25Å; S272-L276 VanDerWaalsContact OG-CB 3.25Å; S272-L276 WeakPolarHBondContact OG-CB 3.47Å; S272-L276 PolarHBondContact OG-N 3.07Å; S274-L276 VanDerWaalsContact C-N 3.3Å; S274-L276 PolarHBondContact O-N 3.06Å; L276-E278 VanDerWaalsContact C-N 3.32Å; L276-E278 PolarHBondContact O-N 2.86Å; L276-T279 WeakPolarHBondContact CA-OG1 3.44Å; L276-T279 PolarHBondContact O-N 2.93Å; L276-T279 PolarHBondContact O-OG1 3.01Å; L276-N280 HydrophobicContact CD1-CB 4.11Å; L276-N280 WeakPolarHBondContact O-CA 3.5Å; L276-N280 PolarHBondContact O-N 3.29Å; L276-F284 HydrophobicContact CD2-CD2 3.88Å; L276-F284 HydrophobicContact CD2-CE2 4.24Å; L276-F284 HydrophobicContact CG-CD2 4.27Å; L276-E339 HydrophobicContact CB-CG 4.46Å; L276-E339 HydrophobicContact CD1-CG 4.24Å; L276-E339 HydrophobicContact CD2-CG 4.05Å; L276-E339 HydrophobicContact CG-CG 4.5Å; L276-C340 HydrophobicContact CD1-CB 4.49Å; L276-L343 HydrophobicContact CD1-CB 4.25Å; L276-L343 HydrophobicContact CD1-CD2 3.84Å; L276-L343 HydrophobicContact CD2-CB 3.99Å; L276-L343 HydrophobicContact CD2-CD1 4.23Å; L276-L343 HydrophobicContact CD2-CD2 3.84Å; L276-L343 HydrophobicContact CD2-CG 4.21Å; L276-L343 HydrophobicContact CG-CD2 3.86Å
277L95.1Very high94.9Very high2 Ų234.6 Ų34.61%0.0117%0.172CC..Hα-helixtrans-61.3-41178.1173.961.8000111.2V143 R144 F147 A269 N275 T281 F284V143-L277 HydrophobicContact CG1-CD1 3.7Å; V143-L277 HydrophobicContact CG1-CD2 4.12Å; V143-L277 HydrophobicContact CG1-CG 3.48Å; V143-L277 VanDerWaalsContact CG1-CG 3.48Å; V143-L277 VanDerWaalsContact CG1-O 3.28Å; V143-L277 WeakPolarHBondContact CG1-O 3.48Å; R144-L277 HydrophobicContact CG-CD2 4.36Å; F147-L277 HydrophobicContact CB-CD1 4.2Å; F147-L277 HydrophobicContact CB-CD2 4.02Å; F147-L277 HydrophobicContact CG-CD2 4.25Å; A269-L277 HydrophobicContact CB-CB 4.48Å; A269-L277 HydrophobicContact CB-CD2 3.79Å; N275-L277 PolarHBondContact O-N 2.77Å; L277-T281 HydrophobicContact CD1-CG2 4.34Å; L277-T281 WeakPolarHBondContact O-CA 3.49Å; L277-T281 WeakPolarHBondContact O-CB 3.41Å; L277-T281 PolarHBondContact O-N 3.48Å; L277-T281 PolarHBondContact O-OG1 3.35Å; L277-F284 HydrophobicContact CD1-CB 4.49Å; L277-F284 HydrophobicContact CD1-CD1 3.69Å; L277-F284 HydrophobicContact CD1-CE1 4.19Å; L277-F284 HydrophobicContact CD1-CG 4.21Å
278E93.3Very high95Very high74 Ų7433.5 Ų33.535%0.34617%0.166SC..Hα-helixtrans-75-36178.4-65.5-73.3172.100112.3V143 R144 N275 L276V143-E278 WeakPolarHBondContact CB-OE2 3.33Å; V143-E278 WeakPolarHBondContact CG2-OE2 3.32Å; R144-E278 IonicContact NH1-OE1 3.26Å; N275-E278 VanDerWaalsContact ND2-CG 3.29Å; N275-E278 WeakPolarHBondContact ND2-CG 3.28Å; N275-E278 PolarHBondContact O-N 3.48Å; N275-E278 VanDerWaalsContact OD1-CG 3.28Å; N275-E278 WeakPolarHBondContact OD1-CG 3.28Å; L276-E278 VanDerWaalsContact C-N 3.32Å; L276-E278 PolarHBondContact O-N 2.86Å
279T92.4Very high95.1Very high78 Ų7833.5 Ų33.548%0.47917%0.166SC..Hα-helixtrans-82.8-29.9-176.556.70000113.6N275 L276N275-T279 PolarHBondContact O-N 3.13Å; N275-T279 PolarHBondContact O-OG1 2.71Å; L276-T279 WeakPolarHBondContact CA-OG1 3.44Å; L276-T279 PolarHBondContact O-N 2.93Å; L276-T279 PolarHBondContact O-OG1 3.01Å
280N94.7Very high95.2Very high31 Ų3133.1 Ų33.117%0.16616%0.164CC..SBendtrans-134.339.4-172.1-70.2-90.5000112L276 R282 T283 F284 C340 L343 H344L276-N280 HydrophobicContact CD1-CB 4.11Å; L276-N280 WeakPolarHBondContact O-CA 3.5Å; L276-N280 PolarHBondContact O-N 3.29Å; N280-R282 VanDerWaalsContact C-N 3.34Å; N280-R282 PolarHBondContact O-N 3.08Å; N280-T283 PolarHBondContact O-N 3.22Å; N280-T283 VanDerWaalsContact O-N 3.16Å; N280-F284 WeakPolarHBondContact O-CB 3.42Å; N280-F284 PolarHBondContact O-N 3.09Å; N280-C340 PolarHBondContact OD1-SG 2.97Å; N280-C340 VanDerWaalsContact OD1-SG 3.39Å; N280-L343 HydrophobicContact CB-CD2 3.77Å; N280-H344 PolarHBondContact OD1-CE1 3.46Å
281T96.2Very high95.4Very high7 Ų728.1 Ų28.14%0.04314%0.144CC..Hα-helixtrans-49-50.2-171.6-47.20000113.2F72 V143 M146 L277 T283 F284 L285F72-T281 HydrophobicContact CD2-CG2 3.95Å; F72-T281 HydrophobicContact CE2-CG2 3.74Å; V143-T281 HydrophobicContact CG1-CG2 3.59Å; V143-T281 WeakPolarHBondContact CG1-OG1 3.43Å; M146-T281 HydrophobicContact SD-CG2 4.32Å; L277-T281 HydrophobicContact CD1-CG2 4.34Å; L277-T281 WeakPolarHBondContact O-CA 3.49Å; L277-T281 WeakPolarHBondContact O-CB 3.41Å; L277-T281 PolarHBondContact O-N 3.48Å; L277-T281 PolarHBondContact O-OG1 3.35Å; T281-T283 PolarHBondContact O-N 2.69Å; T281-F284 PolarHBondContact O-N 3.37Å; T281-L285 HydrophobicContact CG2-CD1 3.89Å; T281-L285 HydrophobicContact CG2-CG 4.18Å; T281-L285 VanDerWaalsContact O-CG 3.26Å; T281-L285 WeakPolarHBondContact O-CG 3.42Å; T281-L285 PolarHBondContact O-N 3.18Å
282R96.6Very high95.6Very high17 Ų1721.3 Ų21.36%0.06412%0.118CC..Hα-helixtrans-57.8-52.8-179.1-81.1-167.8-173.5-86.3-4.8112.4C66 N69 P70 F72 S135 N280 F284 L285 F286C66-R282 PolarHBondContact SG-NH1 3.15Å; C66-R282 VanDerWaalsContact SG-NH1 3.36Å; N69-R282 PolarHBondContact O-NE 3.01Å; N69-R282 PolarHBondContact O-NH2 3.34Å; P70-R282 WeakPolarHBondContact O-CD 3.33Å; P70-R282 WeakPolarHBondContact O-CG 3.34Å; P70-R282 PolarHBondContact O-NE 3.48Å; P70-R282 VanDerWaalsContact O-NE 3.08Å; F72-R282 HydrophobicContact CD2-CG 3.88Å; F72-R282 HydrophobicContact CE1-CG 3.99Å; F72-R282 HydrophobicContact CE2-CB 4.17Å; F72-R282 HydrophobicContact CE2-CG 3.26Å; F72-R282 HydrophobicContact CG-CG 4.48Å; F72-R282 HydrophobicContact CZ-CB 4.38Å; F72-R282 HydrophobicContact CZ-CG 3.35Å; S135-R282 PolarHBondContact OG-NH1 3.06Å; S135-R282 PolarHBondContact OG-NH2 3.21Å; N280-R282 VanDerWaalsContact C-N 3.34Å; N280-R282 PolarHBondContact O-N 3.08Å; R282-F284 VanDerWaalsContact C-N 3.28Å; R282-F284 PolarHBondContact O-N 3.43Å; R282-L285 PolarHBondContact O-N 2.64Å; R282-F286 VanDerWaalsContact O-CB 3.22Å; R282-F286 WeakPolarHBondContact O-CB 3.42Å; R282-F286 PolarHBondContact O-N 2.96Å
283T97.3Very high95.9Very high31 Ų3120.7 Ų20.719%0.1911%0.113CC..Hα-helixtrans-62.3-40.6-178.8-51.10000110.5N280 T281 F286 C287 L343 T347N280-T283 PolarHBondContact O-N 3.22Å; N280-T283 VanDerWaalsContact O-N 3.16Å; T281-T283 PolarHBondContact O-N 2.69Å; T283-F286 PolarHBondContact O-N 3.43Å; T283-C287 WeakPolarHBondContact O-CB 3.28Å; T283-C287 PolarHBondContact O-N 3.1Å; T283-L343 HydrophobicContact CG2-CD2 3.84Å; T283-L343 HydrophobicContact CG2-CG 3.85Å; T283-T347 HydrophobicContact CG2-CG2 4.18Å
284F97.9Very high96.3Very high0 Ų018.5 Ų18.50%010%0.099CC..Hα-helixtrans-62.4-49.4177.9-169.7-86.2000112.1F147 W268 A269 L276 L277 N280 T281 R282 F286 C287 C288 L343F147-F284 HydrophobicContact CD2-CD1 4.36Å; F147-F284 AromaticContact CD2-CE1 3.89Å; F147-F284 HydrophobicContact CD2-CE1 3.89Å; F147-F284 AromaticContact CE2-CE1 3.7Å; F147-F284 HydrophobicContact CE2-CE1 3.7Å; W268-F284 HydrophobicContact CB-CE2 3.95Å; W268-F284 HydrophobicContact CB-CZ 4Å; W268-F284 AromaticContact CD2-CE2 3.82Å; W268-F284 HydrophobicContact CD2-CE2 3.82Å; W268-F284 HydrophobicContact CE3-CE2 4.17Å; W268-F284 AromaticContact CG-CE2 3.75Å; W268-F284 HydrophobicContact CG-CE2 3.75Å; W268-F284 HydrophobicContact CG-CZ 4.31Å; A269-F284 HydrophobicContact CB-CE1 4.34Å; A269-F284 HydrophobicContact CB-CZ 4.18Å; L276-F284 HydrophobicContact CD2-CD2 3.88Å; L276-F284 HydrophobicContact CD2-CE2 4.24Å; L276-F284 HydrophobicContact CG-CD2 4.27Å; L277-F284 HydrophobicContact CD1-CB 4.49Å; L277-F284 HydrophobicContact CD1-CD1 3.69Å; L277-F284 HydrophobicContact CD1-CE1 4.19Å; L277-F284 HydrophobicContact CD1-CG 4.21Å; N280-F284 WeakPolarHBondContact O-CB 3.42Å; N280-F284 PolarHBondContact O-N 3.09Å; T281-F284 PolarHBondContact O-N 3.37Å; R282-F284 VanDerWaalsContact C-N 3.28Å; R282-F284 PolarHBondContact O-N 3.43Å; F284-F286 PolarHBondContact O-N 3.44Å; F284-C287 PolarHBondContact O-N 3.38Å; F284-C288 PolarHBondContact O-N 2.84Å; F284-C288 VanDerWaalsContact O-N 3.11Å; F284-C288 PolarHBondContact O-SG 3.19Å; F284-L343 HydrophobicContact CB-CD2 4.18Å; F284-L343 HydrophobicContact CD2-CD1 4.23Å
285L98Very high96.6Very high4 Ų418.3 Ų18.32%0.02110%0.097CC..Hα-helixtrans-64.3-39.9177-63.7-177.4000111.8F72 F134 M146 F147 Q150 T281 R282 C288 G289F72-L285 HydrophobicContact CE2-CD1 4.15Å; F72-L285 HydrophobicContact CZ-CD1 4.29Å; F134-L285 HydrophobicContact CD2-CD1 4.29Å; F134-L285 HydrophobicContact CE2-CD1 4.28Å; M146-L285 HydrophobicContact CB-CD1 4.25Å; F147-L285 HydrophobicContact CB-CD2 4.11Å; F147-L285 HydrophobicContact CD2-CD2 3.95Å; Q150-L285 HydrophobicContact CB-CD2 4.3Å; Q150-L285 HydrophobicContact CG-CD2 4.5Å; T281-L285 HydrophobicContact CG2-CD1 3.89Å; T281-L285 HydrophobicContact CG2-CG 4.18Å; T281-L285 VanDerWaalsContact O-CG 3.26Å; T281-L285 WeakPolarHBondContact O-CG 3.42Å; T281-L285 PolarHBondContact O-N 3.18Å; R282-L285 PolarHBondContact O-N 2.64Å; L285-C288 PolarHBondContact O-N 3.17Å; L285-G289 PolarHBondContact O-N 3.19Å
286F98.5Very high97Very high41 Ų4114.5 Ų14.518%0.188%0.077CC..Hα-helixtrans-63.4-42.7177.8-173.9-79.2000112.1Y62 L127 F128 R282 T283 F284 G289 T290 T347 T351Y62-F286 AromaticContact CE1-CD2 3.86Å; Y62-F286 HydrophobicContact CE1-CD2 3.86Å; Y62-F286 HydrophobicContact CE1-CE2 4.07Å; L127-F286 HydrophobicContact CD2-CB 4.31Å; L127-F286 HydrophobicContact CD2-CD2 3.6Å; L127-F286 HydrophobicContact CD2-CE2 4.06Å; L127-F286 HydrophobicContact CD2-CG 3.97Å; L127-F286 HydrophobicContact CG-CD2 4.46Å; F128-F286 AromaticContact CE1-CE2 3.91Å; F128-F286 HydrophobicContact CE1-CE2 3.91Å; R282-F286 VanDerWaalsContact O-CB 3.22Å; R282-F286 WeakPolarHBondContact O-CB 3.42Å; R282-F286 PolarHBondContact O-N 2.96Å; T283-F286 PolarHBondContact O-N 3.43Å; F284-F286 PolarHBondContact O-N 3.44Å; F286-G289 PolarHBondContact O-N 2.91Å; F286-T290 WeakPolarHBondContact O-CB 3.43Å; F286-T290 PolarHBondContact O-N 3.42Å; F286-T290 PolarHBondContact O-OG1 3.31Å; F286-T347 HydrophobicContact CD1-CG2 3.62Å; F286-T347 HydrophobicContact CE1-CG2 4.15Å; F286-T351 HydrophobicContact CE1-CG2 4.33Å; F286-T351 WeakPolarHBondContact CE1-OG1 3.36Å; F286-T351 HydrophobicContact CZ-CG2 4.5Å
287C98.6Very high97.3Very high0 Ų015 Ų150%08%0.08CC..Hα-helixtrans-59.1-55.2174.9-171.60000111T283 F284 G289 T290 I291 L343 T347T283-C287 WeakPolarHBondContact O-CB 3.28Å; T283-C287 PolarHBondContact O-N 3.1Å; F284-C287 PolarHBondContact O-N 3.38Å; C287-G289 VanDerWaalsContact C-N 3.29Å; C287-G289 PolarHBondContact O-N 3.25Å; C287-T290 PolarHBondContact O-N 3.48Å; C287-I291 WeakPolarHBondContact O-CG1 3.46Å; C287-I291 PolarHBondContact O-N 2.86Å; C287-I291 VanDerWaalsContact O-N 3.13Å; C287-L343 HydrophobicContact CB-CD1 4.21Å; C287-T347 HydrophobicContact CB-CG2 4.32Å; C287-T347 VanDerWaalsContact CB-OG1 3.32Å; C287-T347 WeakPolarHBondContact CB-OG1 3.26Å
288C98.2Very high97.4Very high2 Ų217.2 Ų17.21%0.0149%0.089CC..Hα-helixtrans-57.9-44.6179.7-61.20000111.2W151 S265 F284 L285 T290 I291 A292 Y319W151-C288 HydrophobicContact CZ2-CB 4.5Å; S265-C288 PolarHBondContact OG-SG 3.08Å; S265-C288 VanDerWaalsContact OG-SG 3.36Å; F284-C288 PolarHBondContact O-N 2.84Å; F284-C288 VanDerWaalsContact O-N 3.11Å; F284-C288 PolarHBondContact O-SG 3.19Å; L285-C288 PolarHBondContact O-N 3.17Å; C288-T290 PolarHBondContact O-N 2.92Å; C288-I291 PolarHBondContact O-N 3.01Å; C288-A292 WeakPolarHBondContact O-CB 3.36Å; C288-A292 PolarHBondContact O-N 3.38Å; C288-Y319 PolarHBondContact SG-OH 2.9Å
289G98.3Very high97.6Very high0 Ų014 Ų140%07%0.074CC..Hα-helixtrans-67-34.8-179.300000114.4L285 F286 C287 A292 S293L285-G289 PolarHBondContact O-N 3.19Å; F286-G289 PolarHBondContact O-N 2.91Å; C287-G289 VanDerWaalsContact C-N 3.29Å; C287-G289 PolarHBondContact O-N 3.25Å; G289-A292 PolarHBondContact O-N 2.97Å; G289-S293 WeakPolarHBondContact O-CB 3.32Å; G289-S293 PolarHBondContact O-N 2.88Å
290T98.8Very high97.9Very high0 Ų010.3 Ų10.30%05%0.051CC..Hα-helixtrans-67.4-41.3174.8-62.80000111.8W124 F286 C287 C288 S293 N294 V350 H354W124-T290 HydrophobicContact CZ2-CG2 3.98Å; W124-T290 PolarHBondContact NE1-OG1 3.08Å; F286-T290 WeakPolarHBondContact O-CB 3.43Å; F286-T290 PolarHBondContact O-N 3.42Å; F286-T290 PolarHBondContact O-OG1 3.31Å; C287-T290 PolarHBondContact O-N 3.48Å; C288-T290 PolarHBondContact O-N 2.92Å; T290-S293 PolarHBondContact O-N 3.18Å; T290-N294 PolarHBondContact O-N 2.64Å; T290-V350 HydrophobicContact CG2-CG2 4.14Å; T290-H354 HydrophobicContact CG2-CB 4.05Å
291I98.7Very high98Very high1 Ų19 Ų91%0.0055%0.045CC..Hα-helixtrans-69-40.1176.4-55.4166.2000110.3L261 C287 C288 S293 N294 V295 E315 V316 Y319 V350L261-I291 HydrophobicContact CD1-CB 4.06Å; L261-I291 HydrophobicContact CD1-CD1 4.19Å; L261-I291 HydrophobicContact CD1-CG2 3.74Å; L261-I291 HydrophobicContact CD2-CB 3.91Å; L261-I291 HydrophobicContact CD2-CG2 3.72Å; L261-I291 HydrophobicContact CG-CG2 4.34Å; C287-I291 WeakPolarHBondContact O-CG1 3.46Å; C287-I291 PolarHBondContact O-N 2.86Å; C287-I291 VanDerWaalsContact O-N 3.13Å; C288-I291 PolarHBondContact O-N 3.01Å; I291-S293 VanDerWaalsContact C-N 3.33Å; I291-S293 PolarHBondContact O-N 3.41Å; I291-N294 WeakPolarHBondContact O-CB 3.22Å; I291-N294 PolarHBondContact O-N 3.07Å; I291-V295 WeakPolarHBondContact O-CG2 3.19Å; I291-V295 PolarHBondContact O-N 3.5Å; I291-E315 HydrophobicContact CG1-CB 4.38Å; I291-E315 HydrophobicContact CG2-CB 3.97Å; I291-V316 HydrophobicContact CG2-CB 4.48Å; I291-V316 HydrophobicContact CG2-CG2 3.59Å; I291-Y319 HydrophobicContact CD1-CD2 3.44Å; I291-Y319 VanDerWaalsContact CD1-CD2 3.44Å; I291-Y319 HydrophobicContact CD1-CE2 4.26Å; I291-Y319 HydrophobicContact CD1-CG 3.72Å; I291-V350 HydrophobicContact CD1-CG1 4.22Å; I291-V350 HydrophobicContact CG1-CB 4.12Å; I291-V350 HydrophobicContact CG1-CG1 4.07Å; I291-V350 HydrophobicContact CG1-CG2 4.07Å
292A98.6Very high97.9Very high4 Ų48.9 Ų8.93%0.0334%0.044CC..Hα-helixtrans-61.8-40.7175.100000112.1F154 L261 C288 G289 V295 T296F154-A292 HydrophobicContact CB-CB 4.46Å; F154-A292 HydrophobicContact CD1-CB 4.26Å; F154-A292 HydrophobicContact CD2-CB 4.2Å; F154-A292 HydrophobicContact CG-CB 4.08Å; L261-A292 HydrophobicContact CD2-CB 4.03Å; C288-A292 WeakPolarHBondContact O-CB 3.36Å; C288-A292 PolarHBondContact O-N 3.38Å; G289-A292 PolarHBondContact O-N 2.97Å; A292-V295 PolarHBondContact O-N 3.45Å; A292-T296 PolarHBondContact O-N 3.26Å; A292-T296 PolarHBondContact O-OG1 3.17Å
293S98.5Very high97.8Very high0 Ų08.1 Ų8.10%04%0.041CC..Hα-helixtrans-60-46.4171.8-175.60000111.1S123 G289 T290 I291 V295 T296 C297 H354S123-S293 PolarHBondContact OG-OG 3.45Å; G289-S293 WeakPolarHBondContact O-CB 3.32Å; G289-S293 PolarHBondContact O-N 2.88Å; T290-S293 PolarHBondContact O-N 3.18Å; I291-S293 VanDerWaalsContact C-N 3.33Å; I291-S293 PolarHBondContact O-N 3.41Å; S293-V295 PolarHBondContact O-N 2.93Å; S293-T296 CarbonylContact O-C 3.6Å; S293-T296 WeakPolarHBondContact O-CB 3.33Å; S293-T296 PolarHBondContact O-N 3.05Å; S293-T296 VanDerWaalsContact O-N 3.07Å; S293-C297 PolarHBondContact O-N 3.42Å; S293-C297 PolarHBondContact O-SG 2.61Å; S293-H354 PolarHBondContact OG-NE2 2.9Å
294N98.5Very high97.7Very high1 Ų16.7 Ų6.71%0.0053%0.032CC..Hα-helixtrans-57.4-46.8175.9-173.4-72.7000112.8T290 I291 T296 C297 R298 N313 E315 H354T290-N294 PolarHBondContact O-N 2.64Å; I291-N294 WeakPolarHBondContact O-CB 3.22Å; I291-N294 PolarHBondContact O-N 3.07Å; N294-T296 VanDerWaalsContact C-N 3.27Å; N294-T296 PolarHBondContact O-N 2.91Å; N294-C297 PolarHBondContact O-N 2.99Å; N294-R298 WeakPolarHBondContact O-CG 3.25Å; N294-R298 PolarHBondContact O-N 3.18Å; N294-R298 VanDerWaalsContact O-N 3.08Å; N294-R298 PolarHBondContact OD1-NE 2.91Å; N294-N313 PolarHBondContact OD1-ND2 2.98Å; N294-E315 PolarHBondContact ND2-OE1 3.32Å; N294-E315 PolarHBondContact OD1-OE1 3.45Å; N294-E315 PolarHBondContact OD1-OE2 3.49Å; N294-H354 WeakPolarHBondContact CA-ND1 3.1Å; N294-H354 WeakPolarHBondContact CB-ND1 3.29Å; N294-H354 PolarHBondContact ND2-ND1 3.17Å
295V98.5Very high97.5Very high7 Ų76.7 Ų6.74%0.0423%0.033CC..Hα-helixtrans-57.9-43.1174.9172.50000110.7P257 V258 I291 A292 S293 R298 L299 N313 V316P257-V295 HydrophobicContact CB-CG1 3.99Å; P257-V295 HydrophobicContact CB-CG2 4.16Å; P257-V295 HydrophobicContact CG-CG1 3.79Å; V258-V295 HydrophobicContact CB-CG1 4.39Å; I291-V295 WeakPolarHBondContact O-CG2 3.19Å; I291-V295 PolarHBondContact O-N 3.5Å; A292-V295 PolarHBondContact O-N 3.45Å; S293-V295 PolarHBondContact O-N 2.93Å; V295-R298 PolarHBondContact O-N 2.78Å; V295-L299 PolarHBondContact O-N 2.85Å; V295-N313 HydrophobicContact CG2-CB 4.38Å; V295-V316 HydrophobicContact CG2-CG2 3.59Å
296T98.3Very high97.2Very high4 Ų411.1 Ų11.13%0.0255%0.053CC..Hα-helixtrans-67.1-47-179.8-53.60000112.2F157 L158 A292 S293 N294 R298 L299 I300F157-T296 HydrophobicContact CD1-CG2 3.84Å; F157-T296 HydrophobicContact CE1-CG2 3.62Å; L158-T296 HydrophobicContact CD1-CG2 4.2Å; L158-T296 WeakPolarHBondContact CD1-OG1 3.33Å; A292-T296 PolarHBondContact O-N 3.26Å; A292-T296 PolarHBondContact O-OG1 3.17Å; S293-T296 CarbonylContact O-C 3.6Å; S293-T296 WeakPolarHBondContact O-CB 3.33Å; S293-T296 PolarHBondContact O-N 3.05Å; S293-T296 VanDerWaalsContact O-N 3.07Å; N294-T296 VanDerWaalsContact C-N 3.27Å; N294-T296 PolarHBondContact O-N 2.91Å; T296-R298 VanDerWaalsContact C-N 3.28Å; T296-R298 PolarHBondContact O-N 2.62Å; T296-L299 WeakPolarHBondContact O-CA 3.25Å; T296-L299 WeakPolarHBondContact O-CB 3.28Å; T296-L299 PolarHBondContact O-N 3.26Å; T296-I300 HydrophobicContact CG2-CD1 4.04Å; T296-I300 HydrophobicContact CG2-CG1 4.48Å; T296-I300 WeakPolarHBondContact O-CG1 3.38Å; T296-I300 PolarHBondContact O-N 2.93Å
297C98.3Very high96.9Very high10 Ų1010 Ų107%0.0685%0.049CC..Hα-helixtrans-57.7-42.2176.3-65.90000111.8G120 S293 N294 L299 I300 V301 Y357G120-C297 VanDerWaalsContact CA-SG 3.57Å; S293-C297 PolarHBondContact O-N 3.42Å; S293-C297 PolarHBondContact O-SG 2.61Å; N294-C297 PolarHBondContact O-N 2.99Å; C297-L299 VanDerWaalsContact C-N 3.33Å; C297-L299 PolarHBondContact O-N 3.45Å; C297-I300 PolarHBondContact O-N 3.28Å; C297-V301 WeakPolarHBondContact O-CG2 3.33Å; C297-V301 PolarHBondContact O-N 2.81Å; C297-Y357 HydrophobicContact CB-CE1 3.96Å
298R97.9Very high96.7Very high50 Ų5013.4 Ų13.419%0.1897%0.071CC..Hα-helixtrans-65.2-35.8176.5-72.1-177.5-172.8-812.2112.6N294 V295 T296 A302 P310 E315 Y357N294-R298 WeakPolarHBondContact O-CG 3.25Å; N294-R298 PolarHBondContact O-N 3.18Å; N294-R298 VanDerWaalsContact O-N 3.08Å; N294-R298 PolarHBondContact OD1-NE 2.91Å; V295-R298 PolarHBondContact O-N 2.78Å; T296-R298 VanDerWaalsContact C-N 3.28Å; T296-R298 PolarHBondContact O-N 2.62Å; R298-A302 PolarHBondContact O-N 3.47Å; R298-A302 VanDerWaalsContact O-N 3.13Å; R298-P310 HydrophobicContact CB-CG 3.75Å; R298-E315 IonicContact NH2-OE1 3.01Å; R298-E315 PolarHBondContact NH2-OE1 3.04Å; R298-E315 IonicContact NH2-OE2 3.19Å; R298-Y357 HydrophobicContact CG-CE1 4.1Å; R298-Y357 HydrophobicContact CG-CE2 4.31Å; R298-Y357 WeakPolarHBondContact CG-OH 3.07Å
299L97.7Very high96.5Very high6 Ų613.3 Ų13.33%0.0317%0.071CC..Hα-helixtrans-65.1-44.4171.8174.958.5000111.3L158 H161 Y165 P254 V295 T296 C297 V301 A302 Q303 A309L158-L299 HydrophobicContact CD1-CD2 3.97Å; L158-L299 HydrophobicContact CG-CD2 4.48Å; H161-L299 HydrophobicContact CB-CD2 4.09Å; Y165-L299 HydrophobicContact CD2-CD1 4.04Å; Y165-L299 HydrophobicContact CG-CD1 4.07Å; P254-L299 HydrophobicContact CB-CD1 3.67Å; P254-L299 HydrophobicContact CB-CD2 4.23Å; V295-L299 PolarHBondContact O-N 2.85Å; T296-L299 WeakPolarHBondContact O-CA 3.25Å; T296-L299 WeakPolarHBondContact O-CB 3.28Å; T296-L299 PolarHBondContact O-N 3.26Å; C297-L299 VanDerWaalsContact C-N 3.33Å; C297-L299 PolarHBondContact O-N 3.45Å; L299-V301 PolarHBondContact O-N 2.89Å; L299-A302 WeakPolarHBondContact O-CB 3.34Å; L299-A302 PolarHBondContact O-N 2.92Å; L299-Q303 VanDerWaalsContact O-CG 3.3Å; L299-Q303 WeakPolarHBondContact O-CG 3.4Å; L299-Q303 PolarHBondContact O-N 3.35Å; L299-A309 HydrophobicContact CD1-CB 3.85Å
300I97.5Very high96.3Very high0 Ų015.6 Ų15.60%09%0.086CC..Hα-helixtrans-58.3-49176.5-65.4161.6000110.2L116 H119 H161 T296 C297 A302 Q303 L304L116-I300 HydrophobicContact CD1-CB 4.01Å; L116-I300 HydrophobicContact CD1-CG2 3.6Å; H119-I300 HydrophobicContact CB-CD1 3.75Å; H161-I300 WeakPolarHBondContact CD2-CG1 3.33Å; T296-I300 HydrophobicContact CG2-CD1 4.04Å; T296-I300 HydrophobicContact CG2-CG1 4.48Å; T296-I300 WeakPolarHBondContact O-CG1 3.38Å; T296-I300 PolarHBondContact O-N 2.93Å; C297-I300 PolarHBondContact O-N 3.28Å; I300-A302 VanDerWaalsContact C-N 3.29Å; I300-A302 PolarHBondContact O-N 2.85Å; I300-Q303 WeakPolarHBondContact O-CB 3.48Å; I300-Q303 PolarHBondContact O-N 3.32Å; I300-L304 HydrophobicContact CG2-CD1 3.96Å; I300-L304 HydrophobicContact CG2-CG 4.22Å; I300-L304 WeakPolarHBondContact O-CG 3.48Å; I300-L304 PolarHBondContact O-N 3.22Å
301V97Very high96.2Very high5 Ų517.4 Ų17.43%0.0310%0.095CC..Hα-helixtrans-56.5-43.9176.9172.70000111.3L4 M8 L116 C297 L299 Q303 L304 C305 V361L4-V301 HydrophobicContact CD2-CG1 4.15Å; M8-V301 HydrophobicContact CE-CG1 3.5Å; M8-V301 VanDerWaalsContact CE-CG1 3.5Å; L116-V301 HydrophobicContact CD1-CG2 3.7Å; L116-V301 HydrophobicContact CD2-CG2 3.83Å; L116-V301 HydrophobicContact CG-CG2 4.45Å; C297-V301 WeakPolarHBondContact O-CG2 3.33Å; C297-V301 PolarHBondContact O-N 2.81Å; L299-V301 PolarHBondContact O-N 2.89Å; V301-Q303 VanDerWaalsContact C-N 3.29Å; V301-Q303 PolarHBondContact O-N 3.27Å; V301-L304 PolarHBondContact O-N 3.3Å; V301-C305 VanDerWaalsContact O-CB 3.25Å; V301-C305 WeakPolarHBondContact O-CB 3.47Å; V301-C305 PolarHBondContact O-N 2.87Å; V301-C305 PolarHBondContact O-SG 3.47Å; V301-C305 VanDerWaalsContact O-SG 3.39Å; V301-V361 HydrophobicContact CG2-CG2 3.88Å
302A95.2Very high96Very high3 Ų323.4 Ų23.43%0.02512%0.122CC..Hα-helixtrans-62-36.5177.500000113R298 L299 I300 H306 V307R298-A302 PolarHBondContact O-N 3.47Å; R298-A302 VanDerWaalsContact O-N 3.13Å; L299-A302 WeakPolarHBondContact O-CB 3.34Å; L299-A302 PolarHBondContact O-N 2.92Å; I300-A302 VanDerWaalsContact C-N 3.29Å; I300-A302 PolarHBondContact O-N 2.85Å; A302-H306 PolarHBondContact O-N 3.25Å; A302-H306 VanDerWaalsContact O-N 3.07Å; A302-V307 HydrophobicContact CB-CG2 4.02Å; A302-V307 PolarHBondContact O-N 3Å
303Q94.4Very high96Very high2 Ų223.5 Ų23.51%0.00912%0.122CC..Hα-helixtrans-66.3-46.9175.3-64159.41.300112.1H161 Y165 L299 I300 V301 C305 H306H161-Q303 VanDerWaalsContact C-NE2 3.31Å; H161-Q303 PolarHBondContact O-NE2 3.18Å; Y165-Q303 HydrophobicContact CD2-CG 3.75Å; Y165-Q303 HydrophobicContact CG-CG 4.33Å; L299-Q303 VanDerWaalsContact O-CG 3.3Å; L299-Q303 WeakPolarHBondContact O-CG 3.4Å; L299-Q303 PolarHBondContact O-N 3.35Å; I300-Q303 WeakPolarHBondContact O-CB 3.48Å; I300-Q303 PolarHBondContact O-N 3.32Å; V301-Q303 VanDerWaalsContact C-N 3.29Å; V301-Q303 PolarHBondContact O-N 3.27Å; Q303-C305 VanDerWaalsContact C-N 3.28Å; Q303-C305 PolarHBondContact O-N 2.95Å; Q303-H306 PolarHBondContact O-N 3.28Å
304L94.6Very high95.9Very high0 Ų028.7 Ų28.70%015%0.145CC..Hα-helixtrans-63.1-38.5179.5-64.2177.2000111.3L12 Y15 A112 E115 L116 I300 V301 H306L12-L304 HydrophobicContact CD1-CB 4.25Å; Y15-L304 HydrophobicContact CD1-CD2 3.97Å; Y15-L304 HydrophobicContact CD2-CD2 4.08Å; Y15-L304 WeakPolarHBondContact CD2-O 3.4Å; Y15-L304 HydrophobicContact CE1-CD2 3.48Å; Y15-L304 VanDerWaalsContact CE1-CD2 3.48Å; Y15-L304 HydrophobicContact CE2-CD2 3.63Å; Y15-L304 HydrophobicContact CG-CD2 4.23Å; A112-L304 HydrophobicContact CB-CD1 4.5Å; A112-L304 HydrophobicContact CB-CD2 4.23Å; A112-L304 WeakPolarHBondContact O-CD1 3.47Å; E115-L304 HydrophobicContact CG-CD2 4.49Å; E115-L304 WeakPolarHBondContact OE2-CD2 3.33Å; L116-L304 HydrophobicContact CB-CD1 3.66Å; L116-L304 HydrophobicContact CD1-CD1 4.46Å; L116-L304 HydrophobicContact CG-CD1 4.48Å; I300-L304 HydrophobicContact CG2-CD1 3.96Å; I300-L304 HydrophobicContact CG2-CG 4.22Å; I300-L304 WeakPolarHBondContact O-CG 3.48Å; I300-L304 PolarHBondContact O-N 3.22Å; V301-L304 PolarHBondContact O-N 3.3Å; L304-H306 VanDerWaalsContact C-N 3.34Å; L304-H306 PolarHBondContact O-CD2 3.06Å
305C94.1Very high95.9Very high1 Ų128.7 Ų28.71%0.00715%0.145CC..THydrogen-bonded Turntrans-86.3-0.2-179.7-69.40000113.9M8 G11 V301 Q303 V307M8-C305 HydrophobicContact CB-CB 3.83Å; M8-C305 HydrophobicContact CG-CB 4.01Å; M8-C305 PolarHBondContact O-SG 3.22Å; G11-C305 WeakPolarHBondContact CA-O 3.35Å; V301-C305 VanDerWaalsContact O-CB 3.25Å; V301-C305 WeakPolarHBondContact O-CB 3.47Å; V301-C305 PolarHBondContact O-N 2.87Å; V301-C305 PolarHBondContact O-SG 3.47Å; V301-C305 VanDerWaalsContact O-SG 3.39Å; Q303-C305 VanDerWaalsContact C-N 3.28Å; Q303-C305 PolarHBondContact O-N 2.95Å; C305-V307 HydrophobicContact CB-CG1 4.38Å; C305-V307 HydrophobicContact CB-CG2 3.98Å; C305-V307 PolarHBondContact O-N 3.27Å
306H90.7Very high95.9Very high96 Ų9628.4 Ų28.444%0.44414%0.143SC..THydrogen-bonded Turntrans5237.8-176.7-62.6-91.8000114Y15 A302 Q303 L304Y15-H306 AromaticContact CD2-NE2 3.59Å; A302-H306 PolarHBondContact O-N 3.25Å; A302-H306 VanDerWaalsContact O-N 3.07Å; Q303-H306 PolarHBondContact O-N 3.28Å; L304-H306 VanDerWaalsContact C-N 3.34Å; L304-H306 PolarHBondContact O-CD2 3.06Å
307V92.8Very high95.9Very high17 Ų1732.4 Ų32.410%0.10316%0.158CC..  trans-112.6160.6178.6-65.50000111.6Q7 M8 A302 C305 A309Q7-V307 HydrophobicContact CG-CG1 4.09Å; M8-V307 HydrophobicContact CG-CG1 3.86Å; M8-V307 HydrophobicContact CG-CG2 4.01Å; A302-V307 HydrophobicContact CB-CG2 4.02Å; A302-V307 PolarHBondContact O-N 3Å; C305-V307 HydrophobicContact CB-CG1 4.38Å; C305-V307 HydrophobicContact CB-CG2 3.98Å; C305-V307 PolarHBondContact O-N 3.27Å; V307-A309 PolarHBondContact O-N 3.36Å
308P93.4Very high95.9Very high72 Ų7234.6 Ų34.647%0.46817%0.169SC..PPolyproline II helixtrans-56.9134.3173.2-25.935.9000112.2Y165Y165-P308 WeakPolarHBondContact OH-CA 3.42Å
309A95.1Very high95.9Very high0 Ų032.2 Ų32.20%016%0.16CC..PPolyproline II helixtrans-56.6142.9-18000000112Y165 R253 P254 L299 V307 M311Y165-A309 HydrophobicContact CE1-CB 4.42Å; Y165-A309 HydrophobicContact CE2-CB 4.05Å; Y165-A309 PolarHBondContact OH-N 3.2Å; Y165-A309 VanDerWaalsContact OH-N 3.16Å; R253-A309 VanDerWaalsContact CZ-O 3.32Å; R253-A309 PolarHBondContact NE-O 2.66Å; R253-A309 PolarHBondContact NH2-O 3.08Å; P254-A309 HydrophobicContact CB-CB 3.8Å; P254-A309 HydrophobicContact CG-CB 4.48Å; L299-A309 HydrophobicContact CD1-CB 3.85Å; V307-A309 PolarHBondContact O-N 3.36Å; A309-M311 PolarHBondContact O-N 3.5Å
310P94.5Very high96Very high48 Ų4832.7 Ų32.731%0.31216%0.164SC..PPolyproline II helixtrans-69.1130.8178.523.6-28000111R298R298-P310 HydrophobicContact CB-CG 3.75Å
311M95.1Very high96Very high39 Ų3937.9 Ų37.919%0.19219%0.19CC..  trans-89.7-27.7173.6-62.3-176-55.300112.2W249 R253 A309W249-M311 HydrophobicContact CH2-SD 4.09Å; W249-M311 HydrophobicContact CZ2-CE 4.34Å; W249-M311 HydrophobicContact CZ2-SD 3.43Å; W249-M311 WeakPolarHBondContact CZ2-SD 3.34Å; R253-M311 HydrophobicContact CG-CG 3.47Å; R253-M311 VanDerWaalsContact CG-CG 3.47Å; R253-M311 HydrophobicContact CG-SD 3.89Å; A309-M311 PolarHBondContact O-N 3.5Å
312H95.7Very high95.9Very high127 Ų12739.3 Ų39.359%0.58820%0.198SC*.  trans-96.2126.9-178-56.2-69.5000108.5Y317H312-Y317 HydrophobicContact CB-CE2 3.86Å; H312-Y317 AromaticContact ND1-CE2 3.73Å; H312-Y317 AromaticContact ND1-CZ 3.64Å; H312-Y317 PolarHBondContact ND1-OH 3.14Å
313N97.8Very high96Very high5 Ų539.2 Ų39.23%0.02720%0.197CC..  trans-132.6120.2174.2-178.7-65.9000107.7P257 N294 V295 E315 V316 Y317P257-N313 HydrophobicContact CB-CB 4.2Å; N294-N313 PolarHBondContact OD1-ND2 2.98Å; V295-N313 HydrophobicContact CG2-CB 4.38Å; N313-E315 VanDerWaalsContact C-N 3.3Å; N313-E315 PolarHBondContact O-N 3.27Å; N313-E315 WeakPolarHBondContact OD1-CA 3.4Å; N313-E315 WeakPolarHBondContact OD1-CB 3.35Å; N313-E315 PolarHBondContact OD1-N 3.39Å; N313-E315 PolarHBondContact OD1-OE2 3.36Å; N313-V316 HydrophobicContact CB-CB 3.99Å; N313-V316 HydrophobicContact CB-CG2 3.81Å; N313-V316 PolarHBondContact O-N 3.48Å; N313-V316 WeakPolarHBondContact OD1-CG2 3.45Å; N313-V316 PolarHBondContact OD1-N 2.96Å; N313-Y317 WeakPolarHBondContact O-CD2 3.26Å; N313-Y317 PolarHBondContact O-N 3.26Å
314K97Very high96Very high109 Ų10944.6 Ų44.647%0.47422%0.22SC..Hα-helixtrans-62.9-41.2-173.7170.7-167.6163.6-149.40110.6Y317 L318 D353K314-Y317 PolarHBondContact O-N 2.93Å; K314-L318 WeakPolarHBondContact O-CB 3.48Å; K314-L318 PolarHBondContact O-N 3.29Å; K314-D353 VanDerWaalsContact NZ-CG 3.33Å; K314-D353 IonicContact NZ-OD1 3.68Å; K314-D353 PolarHBondContact NZ-OD1 3.44Å; K314-D353 IonicContact NZ-OD2 2.77Å; K314-D353 PolarHBondContact NZ-OD2 2.96Å
315E98.1Very high96Very high1 Ų146.8 Ų46.81%0.00523%0.234CC..Hα-helixtrans-68.2-41.3-177.6-57.485.4153.400110.4I291 N294 R298 N313 Y319 V350I291-E315 HydrophobicContact CG1-CB 4.38Å; I291-E315 HydrophobicContact CG2-CB 3.97Å; N294-E315 PolarHBondContact ND2-OE1 3.32Å; N294-E315 PolarHBondContact OD1-OE1 3.45Å; N294-E315 PolarHBondContact OD1-OE2 3.49Å; R298-E315 IonicContact NH2-OE1 3.01Å; R298-E315 PolarHBondContact NH2-OE1 3.04Å; R298-E315 IonicContact NH2-OE2 3.19Å; N313-E315 VanDerWaalsContact C-N 3.3Å; N313-E315 PolarHBondContact O-N 3.27Å; N313-E315 WeakPolarHBondContact OD1-CA 3.4Å; N313-E315 WeakPolarHBondContact OD1-CB 3.35Å; N313-E315 PolarHBondContact OD1-N 3.39Å; N313-E315 PolarHBondContact OD1-OE2 3.36Å; E315-Y319 VanDerWaalsContact O-CB 3.27Å; E315-Y319 WeakPolarHBondContact O-CB 3.39Å; E315-Y319 PolarHBondContact O-N 2.87Å; E315-V350 HydrophobicContact CB-CG1 4.37Å
316V98.6Very high95.9Very high1 Ų147 Ų471%0.00624%0.235CC..Hα-helixtrans-63.1-45.7171.8176.50000111.1L260 L261 I291 V295 N313 Y319 S320L260-V316 HydrophobicContact CB-CG1 4.04Å; L260-V316 HydrophobicContact CD2-CG1 3.77Å; L260-V316 HydrophobicContact CG-CG1 3.76Å; L261-V316 HydrophobicContact CB-CG1 4.12Å; L261-V316 HydrophobicContact CB-CG2 4.05Å; L261-V316 HydrophobicContact CD1-CG2 4.41Å; L261-V316 HydrophobicContact CD2-CG2 4.45Å; I291-V316 HydrophobicContact CG2-CB 4.48Å; I291-V316 HydrophobicContact CG2-CG2 3.59Å; V295-V316 HydrophobicContact CG2-CG2 3.59Å; N313-V316 HydrophobicContact CB-CB 3.99Å; N313-V316 HydrophobicContact CB-CG2 3.81Å; N313-V316 PolarHBondContact O-N 3.48Å; N313-V316 WeakPolarHBondContact OD1-CG2 3.45Å; N313-V316 PolarHBondContact OD1-N 2.96Å; V316-Y319 PolarHBondContact O-N 3.11Å; V316-S320 VanDerWaalsContact O-CB 3.28Å; V316-S320 WeakPolarHBondContact O-CB 3.39Å; V316-S320 PolarHBondContact O-N 3.03Å; V316-S320 PolarHBondContact O-OG 2.85Å
317Y98.5Very high96Very high88 Ų8843.4 Ų43.435%0.34522%0.22SC..Hα-helixtrans-64.1-44.9178.7-67.7-26.6000112.7L260 H312 N313 K314 Y319 S320 I321L260-Y317 HydrophobicContact CD2-CD1 3.81Å; L260-Y317 HydrophobicContact CD2-CE1 3.66Å; H312-Y317 HydrophobicContact CB-CE2 3.86Å; H312-Y317 AromaticContact ND1-CE2 3.73Å; H312-Y317 AromaticContact ND1-CZ 3.64Å; H312-Y317 PolarHBondContact ND1-OH 3.14Å; N313-Y317 WeakPolarHBondContact O-CD2 3.26Å; N313-Y317 PolarHBondContact O-N 3.26Å; K314-Y317 PolarHBondContact O-N 2.93Å; Y317-Y319 VanDerWaalsContact C-N 3.34Å; Y317-Y319 PolarHBondContact O-N 3.38Å; Y317-S320 PolarHBondContact O-N 3.36Å; Y317-I321 WeakPolarHBondContact O-CB 3.48Å; Y317-I321 WeakPolarHBondContact O-CD1 3.41Å; Y317-I321 VanDerWaalsContact O-CG1 3.23Å; Y317-I321 WeakPolarHBondContact O-CG1 3.14Å; Y317-I321 PolarHBondContact O-N 3.38Å
318L98.2Very high96Very high56 Ų5647.5 Ų47.529%0.29324%0.237SC..Hα-helixtrans-57.6-49175.4179.161000111.1K314 S320 I321 I322 I346 F349K314-L318 WeakPolarHBondContact O-CB 3.48Å; K314-L318 PolarHBondContact O-N 3.29Å; L318-S320 PolarHBondContact O-N 2.96Å; L318-I321 PolarHBondContact O-N 2.64Å; L318-I322 HydrophobicContact CD1-CD1 3.72Å; L318-I322 HydrophobicContact CD1-CG1 4.36Å; L318-I322 HydrophobicContact CG-CD1 3.93Å; L318-I322 WeakPolarHBondContact O-CB 3.24Å; L318-I322 WeakPolarHBondContact O-CG1 3.1Å; L318-I322 PolarHBondContact O-N 2.86Å; L318-I346 HydrophobicContact CG-CD1 4.45Å; L318-F349 HydrophobicContact CD2-CD1 3.47Å; L318-F349 VanDerWaalsContact CD2-CD1 3.47Å; L318-F349 HydrophobicContact CD2-CE1 3.33Å; L318-F349 HydrophobicContact CD2-CZ 4.29Å
319Y98.6Very high95.7Very high0 Ų048.9 Ų48.90%024%0.239CC..Hα-helixtrans-61.1-43.5177.3-179-85.7000112.7L261 S265 W268 C288 I291 E315 V316 Y317 I322 T323 I346L261-Y319 HydrophobicContact CD1-CD1 3.83Å; L261-Y319 HydrophobicContact CD1-CE1 4.13Å; L261-Y319 HydrophobicContact CD1-CG 4.21Å; S265-Y319 WeakPolarHBondContact CA-OH 3.38Å; S265-Y319 WeakPolarHBondContact OG-CE1 3.23Å; S265-Y319 PolarHBondContact OG-OH 3.32Å; S265-Y319 VanDerWaalsContact OG-OH 3.06Å; W268-Y319 HydrophobicContact CE3-CD2 4.19Å; W268-Y319 HydrophobicContact CE3-CE1 4.18Å; W268-Y319 AromaticContact CE3-CE2 3.46Å; W268-Y319 HydrophobicContact CE3-CE2 3.46Å; W268-Y319 VanDerWaalsContact CE3-CE2 3.46Å; W268-Y319 AromaticContact CE3-CZ 3.45Å; W268-Y319 VanDerWaalsContact CE3-CZ 3.45Å; W268-Y319 AromaticContact CZ3-CD2 3.85Å; W268-Y319 HydrophobicContact CZ3-CD2 3.85Å; W268-Y319 AromaticContact CZ3-CE2 3.4Å; W268-Y319 HydrophobicContact CZ3-CE2 3.4Å; W268-Y319 VanDerWaalsContact CZ3-CE2 3.4Å; W268-Y319 AromaticContact CZ3-CZ 3.93Å; C288-Y319 PolarHBondContact SG-OH 2.9Å; I291-Y319 HydrophobicContact CD1-CD2 3.44Å; I291-Y319 VanDerWaalsContact CD1-CD2 3.44Å; I291-Y319 HydrophobicContact CD1-CE2 4.26Å; I291-Y319 HydrophobicContact CD1-CG 3.72Å; E315-Y319 VanDerWaalsContact O-CB 3.27Å; E315-Y319 WeakPolarHBondContact O-CB 3.39Å; E315-Y319 PolarHBondContact O-N 2.87Å; V316-Y319 PolarHBondContact O-N 3.11Å; Y317-Y319 VanDerWaalsContact C-N 3.34Å; Y317-Y319 PolarHBondContact O-N 3.38Å; Y319-I322 PolarHBondContact O-N 3.41Å; Y319-T323 VanDerWaalsContact O-CB 3.3Å; Y319-T323 WeakPolarHBondContact O-CB 3.27Å; Y319-T323 PolarHBondContact O-N 3.44Å; Y319-T323 PolarHBondContact O-OG1 3.39Å; Y319-I346 HydrophobicContact CD2-CD1 3.91Å; Y319-I346 HydrophobicContact CG-CD1 4.38Å
320S98.4Very high95.1Very high16 Ų1652.9 Ų52.911%0.11226%0.26CS..Hα-helixtrans-66-42.8-179.2-55.20000111.9S264 V316 Y317 L318 T323 F324S264-S320 WeakPolarHBondContact OG-CB 3.29Å; S264-S320 PolarHBondContact OG-OG 2.79Å; S264-S320 VanDerWaalsContact OG-OG 3.08Å; V316-S320 VanDerWaalsContact O-CB 3.28Å; V316-S320 WeakPolarHBondContact O-CB 3.39Å; V316-S320 PolarHBondContact O-N 3.03Å; V316-S320 PolarHBondContact O-OG 2.85Å; Y317-S320 PolarHBondContact O-N 3.36Å; L318-S320 PolarHBondContact O-N 2.96Å; S320-T323 PolarHBondContact O-N 3.13Å; S320-F324 WeakPolarHBondContact O-CB 3.45Å; S320-F324 PolarHBondContact O-N 2.74Å
321I97.9Very high93.7Very high109 Ų10956.5 Ų56.556%0.55928%0.283SS*.Hα-helixtrans-65.2-47.7177.4-68.6165.4000110.1Y317 L318 T323 F324 V325Y317-I321 WeakPolarHBondContact O-CB 3.48Å; Y317-I321 WeakPolarHBondContact O-CD1 3.41Å; Y317-I321 VanDerWaalsContact O-CG1 3.23Å; Y317-I321 WeakPolarHBondContact O-CG1 3.14Å; Y317-I321 PolarHBondContact O-N 3.38Å; L318-I321 PolarHBondContact O-N 2.64Å; I321-T323 VanDerWaalsContact C-N 3.32Å; I321-T323 PolarHBondContact O-N 3.42Å; I321-F324 PolarHBondContact O-N 3.28Å; I321-V325 HydrophobicContact CG2-CG2 4.3Å; I321-V325 WeakPolarHBondContact O-CB 3.45Å; I321-V325 VanDerWaalsContact O-CG2 3.26Å; I321-V325 WeakPolarHBondContact O-CG2 3.48Å; I321-V325 PolarHBondContact O-N 2.74Å
322I96.2Very high92.2Very high36 Ų3656 Ų5619%0.18528%0.282CS..Hα-helixtrans-58.7-46.6177.4-75.4169.3000110.6W268 L318 Y319 F324 V325 I326 V342 I346W268-I322 HydrophobicContact CH2-CG2 4.18Å; W268-I322 HydrophobicContact CZ3-CG2 4.44Å; L318-I322 HydrophobicContact CD1-CD1 3.72Å; L318-I322 HydrophobicContact CD1-CG1 4.36Å; L318-I322 HydrophobicContact CG-CD1 3.93Å; L318-I322 WeakPolarHBondContact O-CB 3.24Å; L318-I322 WeakPolarHBondContact O-CG1 3.1Å; L318-I322 PolarHBondContact O-N 2.86Å; Y319-I322 PolarHBondContact O-N 3.41Å; I322-F324 PolarHBondContact O-N 2.93Å; I322-V325 PolarHBondContact O-N 3.32Å; I322-I326 HydrophobicContact CG2-CD1 3.61Å; I322-I326 HydrophobicContact CG2-CG1 4.38Å; I322-I326 WeakPolarHBondContact O-CB 3.42Å; I322-I326 WeakPolarHBondContact O-CG1 3.39Å; I322-I326 PolarHBondContact O-N 3.18Å; I322-V342 HydrophobicContact CG2-CG1 3.66Å; I322-I346 HydrophobicContact CD1-CB 4.33Å; I322-I346 HydrophobicContact CD1-CD1 3.63Å; I322-I346 HydrophobicContact CD1-CG1 4.09Å
323T96.2Very high90.6Very high1 Ų156.7 Ų56.71%0.00629%0.289CS..Hα-helixtrans-55.5-50.7176.3-63.90000111.4S264 I267 W268 Y319 S320 I321 V325 I326 C327S264-T323 WeakPolarHBondContact O-CG2 3.36Å; I267-T323 HydrophobicContact CB-CG2 3.94Å; I267-T323 HydrophobicContact CG2-CG2 3.58Å; W268-T323 HydrophobicContact CB-CG2 3.66Å; W268-T323 VanDerWaalsContact CE3-OG1 3.31Å; W268-T323 HydrophobicContact CG-CG2 4.23Å; Y319-T323 VanDerWaalsContact O-CB 3.3Å; Y319-T323 WeakPolarHBondContact O-CB 3.27Å; Y319-T323 PolarHBondContact O-N 3.44Å; Y319-T323 PolarHBondContact O-OG1 3.39Å; S320-T323 PolarHBondContact O-N 3.13Å; I321-T323 VanDerWaalsContact C-N 3.32Å; I321-T323 PolarHBondContact O-N 3.42Å; T323-V325 PolarHBondContact O-N 3.38Å; T323-I326 PolarHBondContact O-N 3.16Å; T323-C327 WeakPolarHBondContact O-CB 3.41Å; T323-C327 PolarHBondContact O-N 3.09Å; T323-C327 PolarHBondContact O-SG 3.26Å
324F95.5Very high89Confident114 Ų11465 Ų6550%0.533%0.325SS..Hα-helixtrans-62.8-43.9-178.3-175.8-99.9000111.9S320 I321 I322 F328 I329S320-F324 WeakPolarHBondContact O-CB 3.45Å; S320-F324 PolarHBondContact O-N 2.74Å; I321-F324 PolarHBondContact O-N 3.28Å; I322-F324 PolarHBondContact O-N 2.93Å; F324-F328 AromaticContact CD2-CD2 3.49Å; F324-F328 HydrophobicContact CD2-CD2 3.49Å; F324-F328 VanDerWaalsContact CD2-CD2 3.49Å; F324-F328 HydrophobicContact CD2-CE2 4.07Å; F324-F328 HydrophobicContact CD2-CG 4.49Å; F324-F328 HydrophobicContact CE2-CB 4.46Å; F324-F328 AromaticContact CE2-CD2 3.76Å; F324-F328 HydrophobicContact CE2-CD2 3.76Å; F324-F328 HydrophobicContact CE2-CE2 4.43Å; F324-F328 HydrophobicContact CE2-CG 4.42Å; F324-F328 HydrophobicContact CG-CD2 4.21Å; F324-F328 WeakPolarHBondContact O-CB 3.47Å; F324-F328 PolarHBondContact O-N 2.91Å; F324-I329 HydrophobicContact CD1-CD1 3.83Å; F324-I329 HydrophobicContact CD1-CG1 4.33Å; F324-I329 HydrophobicContact CE1-CD1 3.72Å; F324-I329 HydrophobicContact CE1-CG1 4.1Å
325V93.8Very high87.7Confident47 Ų4763.9 Ų63.929%0.28533%0.325SS..Iπ-helixtrans-62.7-46.6178.61710000111.1I321 I322 T323 I329 L330I321-V325 HydrophobicContact CG2-CG2 4.3Å; I321-V325 WeakPolarHBondContact O-CB 3.45Å; I321-V325 VanDerWaalsContact O-CG2 3.26Å; I321-V325 WeakPolarHBondContact O-CG2 3.48Å; I321-V325 PolarHBondContact O-N 2.74Å; I322-V325 PolarHBondContact O-N 3.32Å; T323-V325 PolarHBondContact O-N 3.38Å; V325-I329 HydrophobicContact CG2-CD1 4.09Å; V325-I329 PolarHBondContact O-N 2.94Å; V325-I329 VanDerWaalsContact O-N 3.09Å; V325-L330 HydrophobicContact CG1-CD1 3.72Å; V325-L330 HydrophobicContact CG1-CG 3.74Å; V325-L330 PolarHBondContact O-N 3.36Å
326I91.9Very high86.5Confident5 Ų567.2 Ų67.23%0.02635%0.345CS..Iπ-helixtrans-65.1-45.7179.9-73.4174.5000111.6W268 I322 T323 I332 E339 V342W268-I326 HydrophobicContact CZ2-CD1 3.89Å; I322-I326 HydrophobicContact CG2-CD1 3.61Å; I322-I326 HydrophobicContact CG2-CG1 4.38Å; I322-I326 WeakPolarHBondContact O-CB 3.42Å; I322-I326 WeakPolarHBondContact O-CG1 3.39Å; I322-I326 PolarHBondContact O-N 3.18Å; T323-I326 PolarHBondContact O-N 3.16Å; I326-I332 HydrophobicContact CB-CD1 4.4Å; I326-I332 HydrophobicContact CG1-CD1 4.23Å; I326-I332 HydrophobicContact CG2-CD1 4.05Å; I326-E339 HydrophobicContact CD1-CG 4.4Å; I326-E339 HydrophobicContact CG2-CG 3.93Å; I326-V342 HydrophobicContact CD1-CB 4.18Å; I326-V342 HydrophobicContact CD1-CG1 3.78Å
327C92.3Very high85.9Confident20 Ų2069.6 Ų69.614%0.13536%0.362CS..Iπ-helixtrans-80.9-27.6-171.5-61.50000113.2I267 T323I267-C327 HydrophobicContact CG2-CB 4.2Å; T323-C327 WeakPolarHBondContact O-CB 3.41Å; T323-C327 PolarHBondContact O-N 3.09Å; T323-C327 PolarHBondContact O-SG 3.26Å
328F92.5Very high85.4Confident103 Ų10368.7 Ų68.745%0.45237%0.365SS..Iπ-helixtrans-130.2-18.6-168.3-54.9-62.9000116.1I267 Y271 F324I267-F328 HydrophobicContact CD1-CE2 4.49Å; I267-F328 HydrophobicContact CG2-CE2 3.57Å; I267-F328 HydrophobicContact CG2-CZ 3.79Å; Y271-F328 HydrophobicContact CD1-CE1 4.44Å; Y271-F328 HydrophobicContact CG-CE1 4.41Å; Y271-F328 HydrophobicContact CG-CZ 4.36Å; F324-F328 AromaticContact CD2-CD2 3.49Å; F324-F328 HydrophobicContact CD2-CD2 3.49Å; F324-F328 VanDerWaalsContact CD2-CD2 3.49Å; F324-F328 HydrophobicContact CD2-CE2 4.07Å; F324-F328 HydrophobicContact CD2-CG 4.49Å; F324-F328 HydrophobicContact CE2-CB 4.46Å; F324-F328 AromaticContact CE2-CD2 3.76Å; F324-F328 HydrophobicContact CE2-CD2 3.76Å; F324-F328 HydrophobicContact CE2-CE2 4.43Å; F324-F328 HydrophobicContact CE2-CG 4.42Å; F324-F328 HydrophobicContact CG-CD2 4.21Å; F324-F328 WeakPolarHBondContact O-CB 3.47Å; F324-F328 PolarHBondContact O-N 2.91Å
329I88.1Confident85Confident101 Ų10166 Ų6652%0.51835%0.351SS..Iπ-helixtrans-107.2-50.4-175.9-61.6177.6000111.5F324 V325 P331F324-I329 HydrophobicContact CD1-CD1 3.83Å; F324-I329 HydrophobicContact CD1-CG1 4.33Å; F324-I329 HydrophobicContact CE1-CD1 3.72Å; F324-I329 HydrophobicContact CE1-CG1 4.1Å; V325-I329 HydrophobicContact CG2-CD1 4.09Å; V325-I329 PolarHBondContact O-N 2.94Å; V325-I329 VanDerWaalsContact O-N 3.09Å; I329-P331 WeakPolarHBondContact O-CD 3.3Å
330L82Confident84.8Confident85 Ų8567.4 Ų67.445%0.44536%0.36SS..  trans-76.4125.7-176.1-70174.7000109.8V325 I332V325-L330 HydrophobicContact CG1-CD1 3.72Å; V325-L330 HydrophobicContact CG1-CG 3.74Å; V325-L330 PolarHBondContact O-N 3.36Å; L330-I332 HydrophobicContact CB-CD1 4.12Å; L330-I332 HydrophobicContact CB-CG1 3.54Å; L330-I332 HydrophobicContact CD1-CD1 4.11Å; L330-I332 HydrophobicContact CD1-CG1 4.26Å; L330-I332 PolarHBondContact O-N 3.46Å
331P66Low84.6Confident123 Ų12371.3 Ų71.380%0.79938%0.379SS*.  trans-73.970162.532.7-32.2000107.4I329 N333I329-P331 WeakPolarHBondContact O-CD 3.3Å; P331-N333 PolarHBondContact O-N 2.65Å
332I64Low84.4Confident30 Ų3068.1 Ų68.115%0.15437%0.365CS..  trans-68.897.8168.1-50.9-175.7000103.8I326 L330 K334I326-I332 HydrophobicContact CB-CD1 4.4Å; I326-I332 HydrophobicContact CG1-CD1 4.23Å; I326-I332 HydrophobicContact CG2-CD1 4.05Å; L330-I332 HydrophobicContact CB-CD1 4.12Å; L330-I332 HydrophobicContact CB-CG1 3.54Å; L330-I332 HydrophobicContact CD1-CD1 4.11Å; L330-I332 HydrophobicContact CD1-CG1 4.26Å; L330-I332 PolarHBondContact O-N 3.46Å; I332-K334 PolarHBondContact O-N 3.19Å
333N61.3Low84.4Confident141 Ų14166.4 Ų66.475%0.75436%0.356SS*.  trans-42.3144.7158.2-89.9-24.5000106.8P331 D335P331-N333 PolarHBondContact O-N 2.65Å; N333-D335 WeakPolarHBondContact O-CA 3.31Å; N333-D335 PolarHBondContact O-N 3.37Å
334K63Low84.5Confident178 Ų17870 Ų7077%0.77437%0.372SS*.SBendtrans-53.58.3-174.4-64.8-177.1176.9-179.20116.5I332 T336I332-K334 PolarHBondContact O-N 3.19Å; K334-T336 WeakPolarHBondContact O-CG2 3.34Å; K334-T336 PolarHBondContact O-N 3.42Å
335D69.8Low84.6Confident87 Ų8770.1 Ų70.147%0.46538%0.378SS..  trans-51.698.3161.5-168.6-9.4000110.9N333 S337N333-D335 WeakPolarHBondContact O-CA 3.31Å; N333-D335 PolarHBondContact O-N 3.37Å; D335-S337 PolarHBondContact O-N 3.2Å; D335-S337 VanDerWaalsContact O-N 3.17Å; D335-S337 VanDerWaalsContact OD1-CB 3.23Å; D335-S337 WeakPolarHBondContact OD1-CB 3.5Å; D335-S337 PolarHBondContact OD1-N 3.39Å; D335-S337 PolarHBondContact OD1-OG 3.01Å; D335-S337 PolarHBondContact OD2-OG 3.44Å
336T73.9Confident84.8Confident71 Ų7168.2 Ų68.244%0.43637%0.366SS..Hα-helixtrans-63.8-16.1179.955.20000112.8K334 C340K334-T336 WeakPolarHBondContact O-CG2 3.34Å; K334-T336 PolarHBondContact O-N 3.42Å; T336-C340 WeakPolarHBondContact O-CB 3.06Å; T336-C340 PolarHBondContact O-N 3.24Å
337S85Confident85.1Confident51 Ų5168.5 Ų68.536%0.35737%0.368SS..Hα-helixtrans-68.6-43.7-172.9680000112.7D335 C340 I341D335-S337 PolarHBondContact O-N 3.2Å; D335-S337 VanDerWaalsContact O-N 3.17Å; D335-S337 VanDerWaalsContact OD1-CB 3.23Å; D335-S337 WeakPolarHBondContact OD1-CB 3.5Å; D335-S337 PolarHBondContact OD1-N 3.39Å; D335-S337 PolarHBondContact OD1-OG 3.01Å; D335-S337 PolarHBondContact OD2-OG 3.44Å; S337-C340 PolarHBondContact O-N 3.16Å; S337-I341 WeakPolarHBondContact O-CB 3.38Å; S337-I341 WeakPolarHBondContact O-CD1 3.34Å; S337-I341 WeakPolarHBondContact O-CG1 3.28Å; S337-I341 PolarHBondContact O-N 2.77Å
338V88.6Confident85.4Confident69 Ų6970.8 Ų70.842%0.41838%0.384SS..Hα-helixtrans-65.9-49.5-176.3178.70000111.1C340 I341 V342V338-C340 VanDerWaalsContact C-N 3.29Å; V338-C340 PolarHBondContact O-N 2.86Å; V338-I341 PolarHBondContact O-N 3.25Å; V338-V342 WeakPolarHBondContact O-CG2 3.16Å; V338-V342 PolarHBondContact O-N 3.45Å
339E91.2Very high85.7Confident0 Ų070 Ų700%038%0.381CS..Hα-helixtrans-62.3-39.1179.4-171.7177-179.600111.5W268 S272 P273 S274 L276 I326 V342 L343W268-E339 PolarHBondContact NE1-OE1 3.26Å; S272-E339 VanDerWaalsContact CB-OE1 3.25Å; S272-E339 WeakPolarHBondContact CB-OE1 3.17Å; S272-E339 PolarHBondContact OG-OE1 3.13Å; S272-E339 PolarHBondContact OG-OE2 3.4Å; P273-E339 WeakPolarHBondContact CD-OE2 3.33Å; S274-E339 WeakPolarHBondContact CB-OE2 3.45Å; S274-E339 PolarHBondContact N-OE2 2.89Å; S274-E339 PolarHBondContact OG-OE2 2.92Å; L276-E339 HydrophobicContact CB-CG 4.46Å; L276-E339 HydrophobicContact CD1-CG 4.24Å; L276-E339 HydrophobicContact CD2-CG 4.05Å; L276-E339 HydrophobicContact CG-CG 4.5Å; I326-E339 HydrophobicContact CD1-CG 4.4Å; I326-E339 HydrophobicContact CG2-CG 3.93Å; E339-V342 PolarHBondContact O-N 3.03Å; E339-L343 PolarHBondContact O-N 2.91Å
340C92.8Very high86.2Confident28 Ų2865.2 Ų65.219%0.18936%0.356CS..Hα-helixtrans-62-46.2173.4-179.30000112.1L276 N280 T336 S337 V338 V342 L343 H344L276-C340 HydrophobicContact CD1-CB 4.49Å; N280-C340 PolarHBondContact OD1-SG 2.97Å; N280-C340 VanDerWaalsContact OD1-SG 3.39Å; T336-C340 WeakPolarHBondContact O-CB 3.06Å; T336-C340 PolarHBondContact O-N 3.24Å; S337-C340 PolarHBondContact O-N 3.16Å; V338-C340 VanDerWaalsContact C-N 3.29Å; V338-C340 PolarHBondContact O-N 2.86Å; C340-V342 VanDerWaalsContact C-N 3.33Å; C340-V342 PolarHBondContact O-N 3.35Å; C340-L343 WeakPolarHBondContact O-CB 3.03Å; C340-L343 PolarHBondContact O-N 3.47Å; C340-H344 PolarHBondContact O-N 3.45Å; C340-H344 PolarHBondContact O-ND1 3.25Å; C340-H344 PolarHBondContact SG-CE1 3.01Å; C340-H344 PolarHBondContact SG-ND1 2.51Å
341I94Very high87Confident98 Ų9862.4 Ų62.450%0.50334%0.342SS..Hα-helixtrans-60.1-45176.4-70.3162.2000110.2S337 V338 L343 H344 L345S337-I341 WeakPolarHBondContact O-CB 3.38Å; S337-I341 WeakPolarHBondContact O-CD1 3.34Å; S337-I341 WeakPolarHBondContact O-CG1 3.28Å; S337-I341 PolarHBondContact O-N 2.77Å; V338-I341 PolarHBondContact O-N 3.25Å; I341-L343 VanDerWaalsContact C-N 3.33Å; I341-L343 PolarHBondContact O-N 3.31Å; I341-H344 PolarHBondContact O-N 2.76Å; I341-L345 HydrophobicContact CG2-CD1 3.82Å; I341-L345 HydrophobicContact CG2-CG 4.21Å; I341-L345 WeakPolarHBondContact O-CB 3.28Å; I341-L345 VanDerWaalsContact O-CG 3.31Å; I341-L345 WeakPolarHBondContact O-CG 3.49Å; I341-L345 PolarHBondContact O-N 3.19Å
342V95Very high88.6Confident43 Ų4362.2 Ų62.226%0.26133%0.334SS..Hα-helixtrans-60.8-43.2177.8176.50000111.1I322 I326 V338 E339 C340 H344 L345 I346I322-V342 HydrophobicContact CG2-CG1 3.66Å; I326-V342 HydrophobicContact CD1-CB 4.18Å; I326-V342 HydrophobicContact CD1-CG1 3.78Å; V338-V342 WeakPolarHBondContact O-CG2 3.16Å; V338-V342 PolarHBondContact O-N 3.45Å; E339-V342 PolarHBondContact O-N 3.03Å; C340-V342 VanDerWaalsContact C-N 3.33Å; C340-V342 PolarHBondContact O-N 3.35Å; V342-H344 PolarHBondContact O-N 3.2Å; V342-L345 PolarHBondContact O-N 3.4Å; V342-I346 WeakPolarHBondContact O-CG2 3.43Å; V342-I346 PolarHBondContact O-N 3.42Å
343L96.6Very high90.2Very high0 Ų062.2 Ų62.20%034%0.335CS..Hα-helixtrans-57.9-46.1175179.765.4000111.8W268 L276 N280 T283 F284 C287 E339 C340 I341 I346 T347W268-L343 HydrophobicContact CH2-CB 4.37Å; W268-L343 HydrophobicContact CH2-CD1 3.85Å; W268-L343 HydrophobicContact CZ2-CB 4.36Å; W268-L343 HydrophobicContact CZ2-CD1 4.3Å; W268-L343 HydrophobicContact CZ3-CD1 4.33Å; L276-L343 HydrophobicContact CD1-CB 4.25Å; L276-L343 HydrophobicContact CD1-CD2 3.84Å; L276-L343 HydrophobicContact CD2-CB 3.99Å; L276-L343 HydrophobicContact CD2-CD1 4.23Å; L276-L343 HydrophobicContact CD2-CD2 3.84Å; L276-L343 HydrophobicContact CD2-CG 4.21Å; L276-L343 HydrophobicContact CG-CD2 3.86Å; N280-L343 HydrophobicContact CB-CD2 3.77Å; T283-L343 HydrophobicContact CG2-CD2 3.84Å; T283-L343 HydrophobicContact CG2-CG 3.85Å; F284-L343 HydrophobicContact CB-CD2 4.18Å; F284-L343 HydrophobicContact CD2-CD1 4.23Å; C287-L343 HydrophobicContact CB-CD1 4.21Å; E339-L343 PolarHBondContact O-N 2.91Å; C340-L343 WeakPolarHBondContact O-CB 3.03Å; C340-L343 PolarHBondContact O-N 3.47Å; I341-L343 VanDerWaalsContact C-N 3.33Å; I341-L343 PolarHBondContact O-N 3.31Å; L343-I346 HydrophobicContact CD1-CG2 4.49Å; L343-I346 VanDerWaalsContact O-CG2 3.28Å; L343-I346 WeakPolarHBondContact O-CG2 3.48Å; L343-T347 WeakPolarHBondContact O-CB 3.36Å; L343-T347 PolarHBondContact O-N 2.87Å; L343-T347 PolarHBondContact O-OG1 3.47Å
344H97.3Very high91.9Very high76 Ų7656.1 Ų56.135%0.35230%0.301SS..Hα-helixtrans-66.8-39.2179.6-72.290.6000112.1N280 C340 I341 V342 S348N280-H344 PolarHBondContact OD1-CE1 3.46Å; C340-H344 PolarHBondContact O-N 3.45Å; C340-H344 PolarHBondContact O-ND1 3.25Å; C340-H344 PolarHBondContact SG-CE1 3.01Å; C340-H344 PolarHBondContact SG-ND1 2.51Å; I341-H344 PolarHBondContact O-N 2.76Å; V342-H344 PolarHBondContact O-N 3.2Å; H344-S348 WeakPolarHBondContact O-CB 3.41Å; H344-S348 PolarHBondContact O-N 2.84Å; H344-S348 PolarHBondContact O-OG 3.44Å
345L98Very high93.6Very high117 Ų11752 Ų5261%0.61329%0.287SS*.Hα-helixtrans-64.5-50176.6-71.7175000111.8I341 V342 T347 S348 F349I341-L345 HydrophobicContact CG2-CD1 3.82Å; I341-L345 HydrophobicContact CG2-CG 4.21Å; I341-L345 WeakPolarHBondContact O-CB 3.28Å; I341-L345 VanDerWaalsContact O-CG 3.31Å; I341-L345 WeakPolarHBondContact O-CG 3.49Å; I341-L345 PolarHBondContact O-N 3.19Å; V342-L345 PolarHBondContact O-N 3.4Å; L345-T347 VanDerWaalsContact C-N 3.33Å; L345-T347 PolarHBondContact O-N 2.58Å; L345-S348 PolarHBondContact O-N 3.39Å; L345-F349 WeakPolarHBondContact O-CB 3.29Å; L345-F349 PolarHBondContact O-N 2.96Å
346I98.2Very high95Very high6 Ų652.3 Ų52.33%0.03129%0.286CS..Hα-helixtrans-64.5-40.8178.2-166.4-177.7000110.7W268 L318 Y319 I322 V342 L343 S348 F349 V350W268-I346 HydrophobicContact CH2-CG2 4.15Å; W268-I346 HydrophobicContact CZ3-CG2 4.47Å; L318-I346 HydrophobicContact CG-CD1 4.45Å; Y319-I346 HydrophobicContact CD2-CD1 3.91Å; Y319-I346 HydrophobicContact CG-CD1 4.38Å; I322-I346 HydrophobicContact CD1-CB 4.33Å; I322-I346 HydrophobicContact CD1-CD1 3.63Å; I322-I346 HydrophobicContact CD1-CG1 4.09Å; V342-I346 WeakPolarHBondContact O-CG2 3.43Å; V342-I346 PolarHBondContact O-N 3.42Å; L343-I346 HydrophobicContact CD1-CG2 4.49Å; L343-I346 VanDerWaalsContact O-CG2 3.28Å; L343-I346 WeakPolarHBondContact O-CG2 3.48Å; I346-S348 PolarHBondContact O-N 3.37Å; I346-F349 PolarHBondContact O-N 2.94Å; I346-V350 HydrophobicContact CG1-CG1 4.04Å; I346-V350 WeakPolarHBondContact O-CG1 3.39Å; I346-V350 WeakPolarHBondContact O-CG2 3.31Å; I346-V350 PolarHBondContact O-N 3.2Å
347T98.6Very high96.1Very high11 Ų1149.5 Ų49.57%0.06727%0.267CS..Hα-helixtrans-59.2-47.5176.9-59.20000111.1T283 F286 C287 L343 L345 F349 V350 T351T283-T347 HydrophobicContact CG2-CG2 4.18Å; F286-T347 HydrophobicContact CD1-CG2 3.62Å; F286-T347 HydrophobicContact CE1-CG2 4.15Å; C287-T347 HydrophobicContact CB-CG2 4.32Å; C287-T347 VanDerWaalsContact CB-OG1 3.32Å; C287-T347 WeakPolarHBondContact CB-OG1 3.26Å; L343-T347 WeakPolarHBondContact O-CB 3.36Å; L343-T347 PolarHBondContact O-N 2.87Å; L343-T347 PolarHBondContact O-OG1 3.47Å; L345-T347 VanDerWaalsContact C-N 3.33Å; L345-T347 PolarHBondContact O-N 2.58Å; T347-F349 PolarHBondContact O-N 2.89Å; T347-V350 WeakPolarHBondContact O-CG2 3.49Å; T347-T351 WeakPolarHBondContact O-CB 3.48Å; T347-T351 PolarHBondContact O-N 3.29Å; T347-T351 PolarHBondContact O-OG1 3.09Å
348S98.6Very high96.7Very high69 Ų6948.3 Ų48.348%0.48326%0.263SS..Hα-helixtrans-61.6-45.9177.4-57.10000111.1H344 L345 I346 T351 L352H344-S348 WeakPolarHBondContact O-CB 3.41Å; H344-S348 PolarHBondContact O-N 2.84Å; H344-S348 PolarHBondContact O-OG 3.44Å; L345-S348 PolarHBondContact O-N 3.39Å; I346-S348 PolarHBondContact O-N 3.37Å; S348-T351 PolarHBondContact O-N 3.33Å; S348-L352 WeakPolarHBondContact O-CG 3.17Å; S348-L352 PolarHBondContact O-N 3.12Å
349F98.6Very high97.1Very high86 Ų8652.7 Ų52.738%0.37727%0.273SS..Hα-helixtrans-60.9-53.1178.7176.9-94.4000112.5L318 L345 I346 T347 T351 L352 D353L318-F349 HydrophobicContact CD2-CD1 3.47Å; L318-F349 VanDerWaalsContact CD2-CD1 3.47Å; L318-F349 HydrophobicContact CD2-CE1 3.33Å; L318-F349 HydrophobicContact CD2-CZ 4.29Å; L345-F349 WeakPolarHBondContact O-CB 3.29Å; L345-F349 PolarHBondContact O-N 2.96Å; I346-F349 PolarHBondContact O-N 2.94Å; T347-F349 PolarHBondContact O-N 2.89Å; F349-T351 PolarHBondContact O-N 3.12Å; F349-L352 PolarHBondContact O-N 3.03Å; F349-D353 WeakPolarHBondContact O-CB 3.4Å; F349-D353 PolarHBondContact O-N 3Å
350V98.5Very high97.4Very high1 Ų154.4 Ų54.41%0.00628%0.281CS..Hα-helixtrans-66.3-29.7-177.5-59.70000112T290 I291 E315 I346 T347 H354T290-V350 HydrophobicContact CG2-CG2 4.14Å; I291-V350 HydrophobicContact CD1-CG1 4.22Å; I291-V350 HydrophobicContact CG1-CB 4.12Å; I291-V350 HydrophobicContact CG1-CG1 4.07Å; I291-V350 HydrophobicContact CG1-CG2 4.07Å; E315-V350 HydrophobicContact CB-CG1 4.37Å; I346-V350 HydrophobicContact CG1-CG1 4.04Å; I346-V350 WeakPolarHBondContact O-CG1 3.39Å; I346-V350 WeakPolarHBondContact O-CG2 3.31Å; I346-V350 PolarHBondContact O-N 3.2Å; T347-V350 WeakPolarHBondContact O-CG2 3.49Å; V350-H354 WeakPolarHBondContact O-CB 3.11Å; V350-H354 PolarHBondContact O-N 3.03Å
351T98.6Very high97.5Very high25 Ų2553.3 Ų53.315%0.15327%0.274CS..Hα-helixtrans-67.2-49174.6-54.70000111.1W124 F286 T347 S348 F349 H354 L355W124-T351 HydrophobicContact CZ2-CG2 4.37Å; F286-T351 HydrophobicContact CE1-CG2 4.33Å; F286-T351 WeakPolarHBondContact CE1-OG1 3.36Å; F286-T351 HydrophobicContact CZ-CG2 4.5Å; T347-T351 WeakPolarHBondContact O-CB 3.48Å; T347-T351 PolarHBondContact O-N 3.29Å; T347-T351 PolarHBondContact O-OG1 3.09Å; S348-T351 PolarHBondContact O-N 3.33Å; F349-T351 PolarHBondContact O-N 3.12Å; T351-H354 PolarHBondContact O-N 3.29Å; T351-L355 HydrophobicContact CG2-CD1 4.34Å; T351-L355 WeakPolarHBondContact O-CG 3.42Å; T351-L355 PolarHBondContact O-N 3.42Å
352L98.5Very high97.7Very high120 Ų12049.5 Ų49.563%0.62826%0.255SS*.Hα-helixtrans-64.2-42177.4-68.5173.2000111.8S348 F349 L355 H356S348-L352 WeakPolarHBondContact O-CG 3.17Å; S348-L352 PolarHBondContact O-N 3.12Å; F349-L352 PolarHBondContact O-N 3.03Å; L352-L355 PolarHBondContact O-N 3.41Å; L352-H356 VanDerWaalsContact O-CB 3.29Å; L352-H356 WeakPolarHBondContact O-CB 3.46Å; L352-H356 PolarHBondContact O-N 3.03Å
353D98.1Very high97.8Very high30 Ų3050 Ų5016%0.1626%0.256CS..Hα-helixtrans-66-39178.2-155.444.8000111.1K314 F349 H356 Y357K314-D353 VanDerWaalsContact NZ-CG 3.33Å; K314-D353 IonicContact NZ-OD1 3.68Å; K314-D353 PolarHBondContact NZ-OD1 3.44Å; K314-D353 IonicContact NZ-OD2 2.77Å; K314-D353 PolarHBondContact NZ-OD2 2.96Å; F349-D353 WeakPolarHBondContact O-CB 3.4Å; F349-D353 PolarHBondContact O-N 3Å; D353-H356 PolarHBondContact O-N 2.82Å; D353-Y357 WeakPolarHBondContact O-CB 3.07Å; D353-Y357 PolarHBondContact O-N 3.35Å
354H98.1Very high97.8Very high12 Ų1251.5 Ų51.56%0.05626%0.263CS..Hα-helixtrans-66.7-43.6175.3-17769.7000112.6W124 T290 S293 N294 V350 T351 H356 Y357 G358W124-H354 AromaticContact CD2-CD2 3.94Å; W124-H354 AromaticContact CD2-NE2 3.87Å; W124-H354 AromaticContact CE2-CD2 3.39Å; W124-H354 AromaticContact CE2-NE2 3.73Å; W124-H354 AromaticContact CH2-CD2 3.69Å; W124-H354 AromaticContact CZ2-CD2 3.29Å; W124-H354 WeakPolarHBondContact CZ2-CD2 3.45Å; W124-H354 AromaticContact NE1-CD2 3.89Å; T290-H354 HydrophobicContact CG2-CB 4.05Å; S293-H354 PolarHBondContact OG-NE2 2.9Å; N294-H354 WeakPolarHBondContact CA-ND1 3.1Å; N294-H354 WeakPolarHBondContact CB-ND1 3.29Å; N294-H354 PolarHBondContact ND2-ND1 3.17Å; V350-H354 WeakPolarHBondContact O-CB 3.11Å; V350-H354 PolarHBondContact O-N 3.03Å; T351-H354 PolarHBondContact O-N 3.29Å; H354-H356 VanDerWaalsContact C-N 3.32Å; H354-H356 PolarHBondContact O-N 3.31Å; H354-Y357 PolarHBondContact O-N 2.88Å; H354-G358 PolarHBondContact O-N 3Å
355L98.1Very high97.7Very high91 Ų9147.9 Ų47.948%0.47625%0.247SC..Hα-helixtrans-60.7-43173.3-73.1171.3000111.5W124 T351 L352 G358 Y359W124-L355 HydrophobicContact CH2-CD2 3.52Å; W124-L355 HydrophobicContact CH2-CG 3.83Å; W124-L355 HydrophobicContact CZ3-CD2 3.66Å; W124-L355 HydrophobicContact CZ3-CG 4.46Å; T351-L355 HydrophobicContact CG2-CD1 4.34Å; T351-L355 WeakPolarHBondContact O-CG 3.42Å; T351-L355 PolarHBondContact O-N 3.42Å; L352-L355 PolarHBondContact O-N 3.41Å; L355-G358 PolarHBondContact O-N 3.38Å; L355-Y359 WeakPolarHBondContact O-CB 3.31Å; L355-Y359 PolarHBondContact O-N 3.36Å
356H97.9Very high97.6Very high94 Ų9442.9 Ų42.944%0.43522%0.221SC..Hα-helixtrans-63.6-43.7177.2-17565.2000112L352 D353 H354 Y359 Q360L352-H356 VanDerWaalsContact O-CB 3.29Å; L352-H356 WeakPolarHBondContact O-CB 3.46Å; L352-H356 PolarHBondContact O-N 3.03Å; D353-H356 PolarHBondContact O-N 2.82Å; H354-H356 VanDerWaalsContact C-N 3.32Å; H354-H356 PolarHBondContact O-N 3.31Å; H356-Y359 PolarHBondContact O-N 3.41Å; H356-Q360 PolarHBondContact CE1-NE2 3.07Å; H356-Q360 PolarHBondContact NE2-NE2 3.13Å; H356-Q360 WeakPolarHBondContact O-CG 3.31Å; H356-Q360 PolarHBondContact O-N 2.85Å
357Y97.6Very high97.4Very high13 Ų1346.6 Ų46.65%0.05125%0.248CC..Hα-helixtrans-58.7-48.8173.7170.6-104.1000111.5Q3 C297 R298 D353 H354 Y359 Q360 V361Q3-Y357 HydrophobicContact CG-CD2 4.29Å; Q3-Y357 HydrophobicContact CG-CE2 4.34Å; C297-Y357 HydrophobicContact CB-CE1 3.96Å; R298-Y357 HydrophobicContact CG-CE1 4.1Å; R298-Y357 HydrophobicContact CG-CE2 4.31Å; R298-Y357 WeakPolarHBondContact CG-OH 3.07Å; D353-Y357 WeakPolarHBondContact O-CB 3.07Å; D353-Y357 PolarHBondContact O-N 3.35Å; H354-Y357 PolarHBondContact O-N 2.88Å; Y357-Y359 PolarHBondContact O-N 2.97Å; Y357-Q360 PolarHBondContact O-N 3.3Å; Y357-V361 HydrophobicContact CE1-CG1 4.35Å; Y357-V361 HydrophobicContact CE2-CB 4.46Å; Y357-V361 WeakPolarHBondContact O-CG1 3.47Å; Y357-V361 PolarHBondContact O-N 3.22Å
358G97.1Very high97.2Very high26 Ų2647 Ų4727%0.26825%0.251SS..Hα-helixtrans-56.3-48.8176.500000112.1H354 L355 Q360 V362H354-G358 PolarHBondContact O-N 3Å; L355-G358 PolarHBondContact O-N 3.38Å; G358-Q360 PolarHBondContact O-N 3.27Å; G358-V362 VanDerWaalsContact O-CB 3.24Å; G358-V362 WeakPolarHBondContact O-CB 3.43Å; G358-V362 WeakPolarHBondContact O-CG2 3.45Å; G358-V362 PolarHBondContact O-N 3.08Å
359Y97.2Very high96.9Very high160 Ų16045.9 Ų45.963%0.62724%0.239SC*.Hα-helixtrans-58.5-46.3175.9174.6-96.1000112.5L355 H356 Y357 N363L355-Y359 WeakPolarHBondContact O-CB 3.31Å; L355-Y359 PolarHBondContact O-N 3.36Å; H356-Y359 PolarHBondContact O-N 3.41Å; Y357-Y359 PolarHBondContact O-N 2.97Å; Y359-N363 WeakPolarHBondContact CD2-ND2 3.4Å; Y359-N363 VanDerWaalsContact CE1-ND2 3.28Å; Y359-N363 WeakPolarHBondContact CE1-ND2 2.93Å; Y359-N363 WeakPolarHBondContact CE2-ND2 3.13Å; Y359-N363 WeakPolarHBondContact O-CB 3.35Å; Y359-N363 VanDerWaalsContact O-CG 3.3Å; Y359-N363 PolarHBondContact O-N 2.85Å; Y359-N363 VanDerWaalsContact O-N 3.14Å; Y359-N363 PolarHBondContact O-ND2 3.43Å
360Q97Very high96.6Very high37 Ų3750.8 Ų50.817%0.17326%0.256CS..Hα-helixtrans-64.7-51.7-179.6-77.3-177-22.300112Q3 H356 Y357 G358 V362 N363 E364Q3-Q360 HydrophobicContact CG-CB 3.92Å; H356-Q360 PolarHBondContact CE1-NE2 3.07Å; H356-Q360 PolarHBondContact NE2-NE2 3.13Å; H356-Q360 WeakPolarHBondContact O-CG 3.31Å; H356-Q360 PolarHBondContact O-N 2.85Å; Y357-Q360 PolarHBondContact O-N 3.3Å; G358-Q360 PolarHBondContact O-N 3.27Å; Q360-V362 VanDerWaalsContact C-N 3.35Å; Q360-V362 PolarHBondContact O-N 3.09Å; Q360-N363 PolarHBondContact O-N 3.49Å; Q360-E364 WeakPolarHBondContact O-CG 3.5Å; Q360-E364 PolarHBondContact O-N 3.49Å
361V96.9Very high96.4Very high4 Ų452.9 Ų52.92%0.02427%0.267CS..Hα-helixtrans-66.3-38.8-175.275.10000111.6L4 L116 V301 Y357 E364 I365L4-V361 HydrophobicContact CD2-CG2 4.31Å; L116-V361 HydrophobicContact CD2-CG1 3.97Å; L116-V361 HydrophobicContact CD2-CG2 4.16Å; V301-V361 HydrophobicContact CG2-CG2 3.88Å; Y357-V361 HydrophobicContact CE1-CG1 4.35Å; Y357-V361 HydrophobicContact CE2-CB 4.46Å; Y357-V361 WeakPolarHBondContact O-CG1 3.47Å; Y357-V361 PolarHBondContact O-N 3.22Å; V361-E364 PolarHBondContact O-N 2.65Å; V361-I365 HydrophobicContact CG2-CD1 3.99Å; V361-I365 HydrophobicContact CG2-CG1 4.4Å; V361-I365 WeakPolarHBondContact O-CB 3.25Å; V361-I365 VanDerWaalsContact O-CG1 3.26Å; V361-I365 WeakPolarHBondContact O-CG1 3.21Å; V361-I365 PolarHBondContact O-N 3Å
362V97.6Very high96.2Very high18 Ų1858.2 Ų58.211%0.10929%0.288CS..Hα-helixtrans-60.8-47.6175.1163.40000110.5L113 F117 G358 Q360 S366 V373L113-V362 HydrophobicContact CD1-CB 4.28Å; L113-V362 HydrophobicContact CD1-CG1 4.11Å; L113-V362 HydrophobicContact CD1-CG2 4.18Å; F117-V362 HydrophobicContact CD2-CG1 4.43Å; F117-V362 HydrophobicContact CD2-CG2 3.94Å; F117-V362 HydrophobicContact CE2-CG1 4.49Å; F117-V362 HydrophobicContact CE2-CG2 4.33Å; G358-V362 VanDerWaalsContact O-CB 3.24Å; G358-V362 WeakPolarHBondContact O-CB 3.43Å; G358-V362 WeakPolarHBondContact O-CG2 3.45Å; G358-V362 PolarHBondContact O-N 3.08Å; Q360-V362 VanDerWaalsContact C-N 3.35Å; Q360-V362 PolarHBondContact O-N 3.09Å; V362-S366 WeakPolarHBondContact O-CB 3.5Å; V362-S366 PolarHBondContact O-N 2.9Å; V362-V373 HydrophobicContact CG1-CB 4.39Å; V362-V373 HydrophobicContact CG1-CG1 3.77Å; V362-V373 HydrophobicContact CG1-CG2 3.64Å
363N96.7Very high96.1Very high53 Ų5353.4 Ų53.428%0.28326%0.264SS..Hα-helixtrans-67-38.1-179.9-75.6-39.9000113.2Y359 Q360 S366 S367Y359-N363 WeakPolarHBondContact CD2-ND2 3.4Å; Y359-N363 VanDerWaalsContact CE1-ND2 3.28Å; Y359-N363 WeakPolarHBondContact CE1-ND2 2.93Å; Y359-N363 WeakPolarHBondContact CE2-ND2 3.13Å; Y359-N363 WeakPolarHBondContact O-CB 3.35Å; Y359-N363 VanDerWaalsContact O-CG 3.3Å; Y359-N363 PolarHBondContact O-N 2.85Å; Y359-N363 VanDerWaalsContact O-N 3.14Å; Y359-N363 PolarHBondContact O-ND2 3.43Å; Q360-N363 PolarHBondContact O-N 3.49Å; N363-S366 PolarHBondContact O-N 3.17Å; N363-S367 WeakPolarHBondContact O-CB 3.45Å; N363-S367 PolarHBondContact O-N 3.03Å; N363-S367 PolarHBondContact O-OG 3.29Å
364E96.4Very high96.1Very high32 Ų3256.5 Ų56.515%0.1528%0.276CS..Hα-helixtrans-66.7-45.7177.2-74.4-177.1-173.200111.9H2 Q3 L4 Q360 V361 S367 C368H2-E364 WeakPolarHBondContact CA-OE1 3.23Å; H2-E364 IonicContact CG-OE1 3.67Å; H2-E364 IonicContact ND1-OE1 3.95Å; H2-E364 PolarHBondContact ND1-OE1 3.32Å; H2-E364 VanDerWaalsContact ND1-OE1 3.08Å; Q3-E364 WeakPolarHBondContact CA-OE2 3.46Å; Q3-E364 WeakPolarHBondContact CB-OE2 3.04Å; Q3-E364 PolarHBondContact N-OE1 3.45Å; Q3-E364 PolarHBondContact N-OE2 3.39Å; L4-E364 HydrophobicContact CD1-CB 3.84Å; L4-E364 HydrophobicContact CG-CB 4.11Å; L4-E364 WeakPolarHBondContact CG-OE2 3.49Å; L4-E364 PolarHBondContact N-OE2 3.06Å; Q360-E364 WeakPolarHBondContact O-CG 3.5Å; Q360-E364 PolarHBondContact O-N 3.49Å; V361-E364 PolarHBondContact O-N 2.65Å; E364-S367 PolarHBondContact O-N 3Å; E364-C368 VanDerWaalsContact O-CB 3.26Å; E364-C368 WeakPolarHBondContact O-CB 3.46Å; E364-C368 PolarHBondContact O-N 3.14Å
365I96.2Very high96Very high1 Ų158.5 Ų58.51%0.00529%0.291CS..Hα-helixtrans-63-45.1175-68.6178000110.2L4 L12 L113 L116 V361 S367 C368 L369L4-I365 HydrophobicContact CD1-CG1 3.73Å; L12-I365 HydrophobicContact CD1-CG2 4.45Å; L12-I365 HydrophobicContact CD2-CB 4.32Å; L12-I365 HydrophobicContact CD2-CG1 4.02Å; L12-I365 HydrophobicContact CD2-CG2 4Å; L113-I365 HydrophobicContact CB-CG2 3.62Å; L113-I365 HydrophobicContact CD1-CB 4.06Å; L113-I365 HydrophobicContact CD1-CG2 3.78Å; L113-I365 HydrophobicContact CG-CG2 4.19Å; L116-I365 HydrophobicContact CD2-CD1 3.4Å; V361-I365 HydrophobicContact CG2-CD1 3.99Å; V361-I365 HydrophobicContact CG2-CG1 4.4Å; V361-I365 WeakPolarHBondContact O-CB 3.25Å; V361-I365 VanDerWaalsContact O-CG1 3.26Å; V361-I365 WeakPolarHBondContact O-CG1 3.21Å; V361-I365 PolarHBondContact O-N 3Å; I365-S367 VanDerWaalsContact C-N 3.3Å; I365-S367 PolarHBondContact O-N 3.36Å; I365-C368 PolarHBondContact O-N 3.46Å; I365-L369 HydrophobicContact CG2-CD1 3.73Å; I365-L369 HydrophobicContact CG2-CG 4.31Å; I365-L369 WeakPolarHBondContact O-CB 3.3Å; I365-L369 WeakPolarHBondContact O-CG 3.43Å; I365-L369 PolarHBondContact O-N 2.62Å
366S95.7Very high95.7Very high12 Ų1255 Ų558%0.08427%0.273CS..Hα-helixtrans-56.8-44.7177.7-167.60000111.3V362 N363 Y370 I371 V373V362-S366 WeakPolarHBondContact O-CB 3.5Å; V362-S366 PolarHBondContact O-N 2.9Å; N363-S366 PolarHBondContact O-N 3.17Å; S366-Y370 PolarHBondContact O-N 3.1Å; S366-I371 PolarHBondContact O-N 3.27Å; S366-I371 PolarHBondContact OG-O 2.93Å; S366-V373 WeakPolarHBondContact OG-CG2 3.41Å
367S94.3Very high95.1Very high83 Ų8353 Ų5358%0.5827%0.268SS*.Hα-helixtrans-68.5-42.9177.8-57.40000112N363 E364 I365 L369 Y370N363-S367 WeakPolarHBondContact O-CB 3.45Å; N363-S367 PolarHBondContact O-N 3.03Å; N363-S367 PolarHBondContact O-OG 3.29Å; E364-S367 PolarHBondContact O-N 3Å; I365-S367 VanDerWaalsContact C-N 3.3Å; I365-S367 PolarHBondContact O-N 3.36Å; S367-L369 VanDerWaalsContact C-N 3.33Å; S367-L369 PolarHBondContact O-N 3.16Å; S367-Y370 PolarHBondContact O-N 3.23Å
368C92.9Very high94.1Very high20 Ų2059.8 Ų59.814%0.13530%0.299CS..Hα-helixtrans-64.4-36.3178.7176.90000113I9 L12 E364 I365I9-C368 VanDerWaalsContact CG2-SG 3.53Å; L12-C368 HydrophobicContact CD2-CB 4.41Å; E364-C368 VanDerWaalsContact O-CB 3.26Å; E364-C368 WeakPolarHBondContact O-CB 3.46Å; E364-C368 PolarHBondContact O-N 3.14Å; I365-C368 PolarHBondContact O-N 3.46Å
369L92.4Very high92.5Very high45 Ų4567.4 Ų67.424%0.23633%0.328CS..THydrogen-bonded Turntrans-92.3-1.6-179.4-63.4-179.1000112.9L12 A112 L113 I365 S367 I371L12-L369 HydrophobicContact CD2-CD1 4.4Å; L12-L369 HydrophobicContact CD2-CD2 4.26Å; L12-L369 HydrophobicContact CD2-CG 4.16Å; L12-L369 HydrophobicContact CG-CD1 4.5Å; L12-L369 HydrophobicContact CG-CD2 4.25Å; A112-L369 HydrophobicContact CB-CD1 4.49Å; L113-L369 HydrophobicContact CB-CD1 4.49Å; I365-L369 HydrophobicContact CG2-CD1 3.73Å; I365-L369 HydrophobicContact CG2-CG 4.31Å; I365-L369 WeakPolarHBondContact O-CB 3.3Å; I365-L369 WeakPolarHBondContact O-CG 3.43Å; I365-L369 PolarHBondContact O-N 2.62Å; S367-L369 VanDerWaalsContact C-N 3.33Å; S367-L369 PolarHBondContact O-N 3.16Å; L369-I371 HydrophobicContact CB-CD1 3.98Å; L369-I371 HydrophobicContact CB-CG1 4Å; L369-I371 HydrophobicContact CB-CG2 4.43Å; L369-I371 HydrophobicContact CD1-CD1 4.06Å; L369-I371 PolarHBondContact O-N 3.4Å
370Y93.1Very high90Very high190 Ų19072.6 Ų72.675%0.74536%0.358SS*.THydrogen-bonded Turntrans52.939.3-175.9-55.3-81.6000113.5S366 S367S366-Y370 PolarHBondContact O-N 3.1Å; S367-Y370 PolarHBondContact O-N 3.23Å
371I93.9Very high89.7Confident45 Ų4574.4 Ų74.423%0.23137%0.367CS..  trans-113.1152.7177.359.3-176000109.9L113 S366 L369L113-I371 HydrophobicContact CB-CD1 3.64Å; L113-I371 HydrophobicContact CD2-CD1 3.54Å; L113-I371 HydrophobicContact CD2-CG1 3.96Å; L113-I371 HydrophobicContact CG-CD1 4.22Å; S366-I371 PolarHBondContact O-N 3.27Å; S366-I371 PolarHBondContact OG-O 2.93Å; L369-I371 HydrophobicContact CB-CD1 3.98Å; L369-I371 HydrophobicContact CB-CG1 4Å; L369-I371 HydrophobicContact CB-CG2 4.43Å; L369-I371 HydrophobicContact CD1-CD1 4.06Å; L369-I371 PolarHBondContact O-N 3.4Å
372K95.3Very high89.3Confident136 Ų13678.1 Ų78.159%0.59139%0.385SS*.  trans-88.6139.6167.1-63.5176.9-177.7177.30109.4S375 T377K372-S375 WeakPolarHBondContact CB-O 3.3Å; K372-T377 PolarHBondContact N-OG1 3.24Å
373V96.5Very high88.8Confident19 Ų1981.4 Ų81.412%0.11540%0.401CS..SBendtrans-65.5-51.1-177.5-173.70000111.8N48 L113 F117 V362 S366N48-V373 HydrophobicContact CB-CG1 4.49Å; N48-V373 WeakPolarHBondContact CB-O 3.43Å; N48-V373 PolarHBondContact ND2-O 3.36Å; L113-V373 HydrophobicContact CD2-CG2 4.34Å; F117-V373 HydrophobicContact CD2-CG1 4.41Å; F117-V373 HydrophobicContact CE2-CG1 4.12Å; V362-V373 HydrophobicContact CG1-CB 4.39Å; V362-V373 HydrophobicContact CG1-CG1 3.77Å; V362-V373 HydrophobicContact CG1-CG2 3.64Å; S366-V373 WeakPolarHBondContact OG-CG2 3.41Å
374F97.1Very high88.4Confident95 Ų9583.1 Ų83.142%0.41741%0.408SS..SBendtrans-111.620.4-172.8-59.8-54.4000114A46 N48 L49 F52 F117A46-F374 VanDerWaalsContact CB-C 3.42Å; N48-F374 HydrophobicContact CB-CD1 4.28Å; N48-F374 HydrophobicContact CB-CE1 4.33Å; L49-F374 HydrophobicContact CB-CD1 4.12Å; L49-F374 HydrophobicContact CD1-CD1 4.35Å; F52-F374 HydrophobicContact CB-CE1 3.94Å; F52-F374 HydrophobicContact CB-CZ 4.46Å; F52-F374 HydrophobicContact CD1-CE1 4.42Å; F52-F374 HydrophobicContact CD1-CZ 4.29Å; F52-F374 HydrophobicContact CG-CE1 4.21Å; F52-F374 HydrophobicContact CG-CZ 4.24Å; F117-F374 HydrophobicContact CE1-CE1 4.42Å; F117-F374 HydrophobicContact CE2-CE1 4.12Å; F117-F374 HydrophobicContact CE2-CZ 4.12Å; F117-F374 AromaticContact CZ-CE1 3.71Å; F117-F374 HydrophobicContact CZ-CE1 3.71Å; F117-F374 AromaticContact CZ-CZ 3.86Å; F117-F374 HydrophobicContact CZ-CZ 3.86Å
375S95.7Very high87.9Confident55 Ų5586.3 Ų86.339%0.38542%0.424SS..SBendtrans-146145.8177.6-176.20000109.8K372 T377K372-S375 WeakPolarHBondContact CB-O 3.3Å; S375-T377 PolarHBondContact O-N 2.95Å
376I92.8Very high87.3Confident17 Ų1792 Ų929%0.08745%0.452CS..  trans-73126.5178.5-72.4165.2000109.4V43 A46 T107V43-I376 WeakPolarHBondContact O-CD1 3.44Å; A46-I376 HydrophobicContact CB-CG1 4.41Å; T107-I376 HydrophobicContact CG2-CD1 3.76Å
377T85.8Confident86.7Confident53 Ų5397.7 Ų97.733%0.32548%0.478SS..  trans-90.2112.2174.1-520000107.7K372 S375 Q379K372-T377 PolarHBondContact N-OG1 3.24Å; S375-T377 PolarHBondContact O-N 2.95Å; T377-Q379 PolarHBondContact O-N 3.15Å
378H76Confident86.1Confident154 Ų15498.8 Ų98.871%0.71347%0.47SS*.  trans-75.7117.8171.6-63.1-73.1000107.9Q380H378-Q380 PolarHBondContact O-N 3.49Å
379Q63.1Low85.6Confident187 Ų187105.4 Ų105.487%0.87450%0.498SS*.  trans-63.2124.6163.9-69.5-176.5-20.200107T377T377-Q379 PolarHBondContact O-N 3.15Å
380Q45.1Very low84.9Confident269 Ų269110.9 Ų110.9100%1.25752%0.522SS*.  trans-680172.7-76.6-174.2-24.600110.9H378H378-Q380 PolarHBondContact O-N 3.49Å

Retrieved 380 of 380 residues in 597 ms (Link to these results)

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