A0A096NSP4_PAPAN Loading...

Cyclin-D1-binding protein 1

May negatively regulate cell cycle progression. May act at least in part via inhibition of the cyclin-D1/CDK4 complex, thereby preventing phosphorylation of RB1 and blocking E2F-dependent transcription.

AlphaFold DB , UniProt , Accession A0A096NSP4, Species PAPAN (Papio anubis, Olive baboon), Gene CCNDBP1, Length 360 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
1M45.6Very low44.1Very low247 Ų247116.4 Ų116.4100%1.21783%0.829SS**  01190-70.8-153.3-145.400108.5
2A38.4Very low44.9Very low103 Ų103117 Ų11785%0.85183%0.827SS**  trans17686.9150.600000106.9
3S40.3Very low47.2Very low112 Ų112119.1 Ų119.178%0.78383%0.831SS**  trans-78.4113.9166.3-178.20000106.9T5S3-T5 PolarHBondContact O-N 3.36Å
4A42.8Very low49.9Very low102 Ų102115.7 Ų115.784%0.84380%0.799SS**  trans-78.898.8171.700000108.3A6A4-A6 PolarHBondContact O-N 3.37Å
5T44.7Very low52.5Low128 Ų128110.2 Ų110.279%0.78576%0.764SS**  trans-69116168.141.30000109.2S3S3-T5 PolarHBondContact O-N 3.36Å
6A43.1Very low55Low87 Ų87108.6 Ų108.672%0.71975%0.75SS**PPolyproline II helixtrans-60.3144.5167.400000110.3A4 A8A4-A6 PolarHBondContact O-N 3.37Å; A6-A8 PolarHBondContact O-N 3.2Å
7P44.1Very low57.1Low126 Ų126103.5 Ų103.582%0.81872%0.715SS**PPolyproline II helixtrans-68.7126.1177.228.3-30.6000109.1A9P7-A9 PolarHBondContact O-N 3.25Å
8A45.2Very low59.1Low98 Ų9899.8 Ų99.881%0.8169%0.685SS**PPolyproline II helixtrans-56.712617000000108.8A6 A10A6-A8 PolarHBondContact O-N 3.2Å; A8-A10 PolarHBondContact O-N 3.29Å; A8-A10 VanDerWaalsContact O-N 3.1Å
9A43.9Very low60.9Low102 Ų10297.8 Ų97.884%0.84367%0.665SS**PPolyproline II helixtrans-55.1118170.700000108.3P7 A11P7-A9 PolarHBondContact O-N 3.25Å; A9-A11 PolarHBondContact O-N 3.33Å; A9-A11 VanDerWaalsContact O-N 3.1Å
10A45.7Very low62.6Low95 Ų9593.9 Ų93.979%0.78564%0.636SS**PPolyproline II helixtrans-57.2117.8175.700000108.2A8A8-A10 PolarHBondContact O-N 3.29Å; A8-A10 VanDerWaalsContact O-N 3.1Å
11A51.4Low64.1Low80 Ų8089.4 Ų89.466%0.66161%0.606SS**PPolyproline II helixtrans-55136.1169.600000108A9 T13A9-A11 PolarHBondContact O-N 3.33Å; A9-A11 VanDerWaalsContact O-N 3.1Å; A11-T13 PolarHBondContact O-N 3.31Å
12P53.9Low66.4Low124 Ų12482.4 Ų82.481%0.80557%0.566SS**  trans-58.2113.618022-30.5000108.7L14P12-L14 PolarHBondContact O-N 3.21Å; P12-L14 VanDerWaalsContact O-N 3.15Å
13T74.8Confident69.1Low144 Ų14481.2 Ų81.288%0.88354%0.542SS*.  trans-66.1113176.9-4.80000107.5A11A11-T13 PolarHBondContact O-N 3.31Å
14L84.3Confident71.8Confident72 Ų7276.1 Ų76.138%0.37751%0.506SS..PPolyproline II helixtrans-59.3138.7177-72166.8000110.1P12 P82 Q83P12-L14 PolarHBondContact O-N 3.21Å; P12-L14 VanDerWaalsContact O-N 3.15Å; L14-P82 HydrophobicContact CB-CB 3.88Å; L14-Q83 HydrophobicContact CD1-CG 3.72Å
15A89.6Confident74.3Confident33 Ų3371.3 Ų71.327%0.27347%0.466SS..PPolyproline II helixtrans-61.3155.3178.700000111Q19 Q20A15-Q19 HydrophobicContact CB-CB 4.32Å; A15-Q19 HydrophobicContact CB-CG 4.28Å; A15-Q20 HydrophobicContact CB-CG 3.93Å; A15-Q20 PolarHBondContact O-NE2 3.1Å
16P92.6Very high76.8Confident85 Ų8570.4 Ų70.455%0.55245%0.453SS*.PPolyproline II helixtrans-56.5150.9173.5-24.233.9000112.3L18 Q19 Q20P16-L18 PolarHBondContact O-N 3.33Å; P16-Q19 HydrophobicContact CB-CB 4.4Å; P16-Q19 WeakPolarHBondContact O-CA 3.36Å; P16-Q19 WeakPolarHBondContact O-CB 3.35Å; P16-Q19 PolarHBondContact O-N 3.38Å; P16-Q20 PolarHBondContact O-N 2.99Å
17P91.1Very high79.3Confident22 Ų2270.7 Ų70.714%0.14344%0.44CS..Hα-helixtrans-49.9-50.5-175-32.537.7000115Q19 Q20 L21 F74 P80 T85P17-Q19 VanDerWaalsContact C-N 3.27Å; P17-Q19 PolarHBondContact O-N 3.35Å; P17-Q20 WeakPolarHBondContact O-CB 3.18Å; P17-Q20 PolarHBondContact O-N 3.24Å; P17-L21 PolarHBondContact O-N 3.1Å; P17-L21 VanDerWaalsContact O-N 3.17Å; P17-F74 HydrophobicContact CB-CE1 4.13Å; P17-F74 HydrophobicContact CB-CZ 4.49Å; P17-P80 WeakPolarHBondContact CG-O 3.36Å; P17-T85 HydrophobicContact CB-CG2 4.13Å; P17-T85 WeakPolarHBondContact CB-OG1 3.49Å
18L92Very high81.8Confident36 Ų3664.7 Ų64.719%0.18840%0.401CS..Hα-helixtrans-65.6-31.2179.9-56.7-178.3000112.5P16 L21 R22 F74 L79 L136 S137 T139P16-L18 PolarHBondContact O-N 3.33Å; L18-L21 PolarHBondContact O-N 2.82Å; L18-R22 WeakPolarHBondContact O-CG 3.49Å; L18-R22 PolarHBondContact O-N 3.32Å; L18-F74 HydrophobicContact CD2-CD1 4.28Å; L18-F74 HydrophobicContact CD2-CE1 4.38Å; L18-L79 HydrophobicContact CD1-CD1 4.47Å; L18-L79 HydrophobicContact CD2-CD1 4.03Å; L18-L79 HydrophobicContact CG-CD1 4.18Å; L18-L136 WeakPolarHBondContact CD2-O 3.48Å; L18-S137 PolarHBondContact O-OG 2.95Å; L18-T139 HydrophobicContact CD1-CG2 4.48Å
19Q93.6Very high84.3Confident63 Ų6363.4 Ų63.429%0.29438%0.375SS..Hα-helixtrans-72.2-35.7176.8-171.46325.200111.1A15 P16 P17 L21 R22 H23A15-Q19 HydrophobicContact CB-CB 4.32Å; A15-Q19 HydrophobicContact CB-CG 4.28Å; P16-Q19 HydrophobicContact CB-CB 4.4Å; P16-Q19 WeakPolarHBondContact O-CA 3.36Å; P16-Q19 WeakPolarHBondContact O-CB 3.35Å; P16-Q19 PolarHBondContact O-N 3.38Å; P17-Q19 VanDerWaalsContact C-N 3.27Å; P17-Q19 PolarHBondContact O-N 3.35Å; Q19-L21 VanDerWaalsContact C-N 3.34Å; Q19-R22 PolarHBondContact O-N 2.87Å; Q19-R22 VanDerWaalsContact OE1-NH1 3.16Å; Q19-H23 PolarHBondContact NE2-CE1 3.46Å; Q19-H23 VanDerWaalsContact NE2-CE1 3.32Å; Q19-H23 PolarHBondContact NE2-NE2 3.26Å; Q19-H23 PolarHBondContact O-CD2 2.92Å; Q19-H23 PolarHBondContact O-N 3.17Å; Q19-H23 VanDerWaalsContact O-N 3.09Å
20Q94.9Very high86.8Confident19 Ų1964.6 Ų64.69%0.08937%0.366CS..Hα-helixtrans-63.3-39.2173.3-64.8-174.230.500112A15 P16 P17 H23 L24 P82 T85A15-Q20 HydrophobicContact CB-CG 3.93Å; A15-Q20 PolarHBondContact O-NE2 3.1Å; P16-Q20 PolarHBondContact O-N 2.99Å; P17-Q20 WeakPolarHBondContact O-CB 3.18Å; P17-Q20 PolarHBondContact O-N 3.24Å; Q20-H23 PolarHBondContact O-N 2.78Å; Q20-L24 PolarHBondContact O-N 3.08Å; Q20-P82 PolarHBondContact NE2-O 3.17Å; Q20-P82 PolarHBondContact OE1-O 2.75Å; Q20-T85 HydrophobicContact CB-CG2 3.92Å; Q20-T85 HydrophobicContact CG-CG2 4.47Å
21L94.4Very high89.2Confident0 Ų061 Ų610%033%0.334CS..Hα-helixtrans-64.3-40.9175.6-68.6-174000112.4P17 L18 Q19 L24 A25 L70 F74 M133 L136 S137P17-L21 PolarHBondContact O-N 3.1Å; P17-L21 VanDerWaalsContact O-N 3.17Å; L18-L21 PolarHBondContact O-N 2.82Å; Q19-L21 VanDerWaalsContact C-N 3.34Å; L21-L24 PolarHBondContact O-N 3.34Å; L21-A25 PolarHBondContact O-N 3.31Å; L21-L70 HydrophobicContact CD2-CD1 4.47Å; L21-L70 HydrophobicContact CD2-CD2 4.35Å; L21-F74 HydrophobicContact CD1-CD1 3.57Å; L21-F74 HydrophobicContact CD1-CD2 4.39Å; L21-F74 HydrophobicContact CD1-CE1 3.44Å; L21-F74 VanDerWaalsContact CD1-CE1 3.44Å; L21-F74 HydrophobicContact CD1-CE2 4.28Å; L21-F74 HydrophobicContact CD1-CG 4.07Å; L21-F74 HydrophobicContact CD1-CZ 3.82Å; L21-F74 HydrophobicContact CD2-CE2 4.38Å; L21-F74 HydrophobicContact CD2-CZ 4.16Å; L21-F74 HydrophobicContact CG-CE1 4.03Å; L21-F74 HydrophobicContact CG-CZ 4.06Å; L21-M133 HydrophobicContact CD2-SD 3.88Å; L21-L136 HydrophobicContact CD1-CB 3.83Å; L21-S137 WeakPolarHBondContact CB-OG 3.49Å
22R94.4Very high91.2Very high100 Ų10058.2 Ų58.238%0.37731%0.308SS..Hα-helixtrans-60.6-46.3173.9-68.6-179.1-166.1146.42.1112.1L18 Q19 L24 A25 E26 S137L18-R22 WeakPolarHBondContact O-CG 3.49Å; L18-R22 PolarHBondContact O-N 3.32Å; Q19-R22 PolarHBondContact O-N 2.87Å; Q19-R22 VanDerWaalsContact OE1-NH1 3.16Å; R22-L24 VanDerWaalsContact C-N 3.3Å; R22-L24 PolarHBondContact O-N 2.89Å; R22-A25 WeakPolarHBondContact O-CB 3.45Å; R22-A25 PolarHBondContact O-N 3.46Å; R22-A25 VanDerWaalsContact O-N 3.16Å; R22-E26 WeakPolarHBondContact O-CG 3.36Å; R22-E26 PolarHBondContact O-N 2.89Å; R22-S137 PolarHBondContact N-OG 3.39Å; R22-S137 PolarHBondContact NH2-O 3.33Å
23H95.5Very high93.2Very high77 Ų7755.9 Ų55.936%0.35629%0.293SS..Hα-helixtrans-61.6-40.4176.9-70.5-46.6000111.9Q19 Q20 A25 E26 E27Q19-H23 PolarHBondContact NE2-CE1 3.46Å; Q19-H23 VanDerWaalsContact NE2-CE1 3.32Å; Q19-H23 PolarHBondContact NE2-NE2 3.26Å; Q19-H23 PolarHBondContact O-CD2 2.92Å; Q19-H23 PolarHBondContact O-N 3.17Å; Q19-H23 VanDerWaalsContact O-N 3.09Å; Q20-H23 PolarHBondContact O-N 2.78Å; H23-A25 PolarHBondContact O-N 3.05Å; H23-E26 IonicContact ND1-OE2 3Å; H23-E26 PolarHBondContact ND1-OE2 3.27Å; H23-E26 PolarHBondContact O-N 3.45Å; H23-E27 WeakPolarHBondContact O-CG 3.43Å; H23-E27 PolarHBondContact O-N 3.38Å
24L95.9Very high94Very high5 Ų557.2 Ų57.23%0.02628%0.282CS..Hα-helixtrans-62.7-41.9174.2-179.662.7000111.9Q20 L21 R22 E26 E27 L28 C89 V92 H93 M133Q20-L24 PolarHBondContact O-N 3.08Å; L21-L24 PolarHBondContact O-N 3.34Å; R22-L24 VanDerWaalsContact C-N 3.3Å; R22-L24 PolarHBondContact O-N 2.89Å; L24-E26 VanDerWaalsContact C-N 3.33Å; L24-E26 PolarHBondContact O-N 3.38Å; L24-E27 PolarHBondContact O-N 3.41Å; L24-L28 HydrophobicContact CD1-CD1 4.46Å; L24-L28 HydrophobicContact CD1-CD2 4.44Å; L24-L28 HydrophobicContact CD1-CG 4.13Å; L24-L28 HydrophobicContact CG-CD1 4.19Å; L24-L28 HydrophobicContact CG-CG 4.29Å; L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3Å; L24-L28 PolarHBondContact O-N 2.99Å; L24-C89 HydrophobicContact CD2-CB 3.92Å; L24-V92 HydrophobicContact CD2-CB 4.05Å; L24-V92 HydrophobicContact CD2-CG1 3.97Å; L24-H93 HydrophobicContact CD1-CB 4.09Å; L24-M133 HydrophobicContact CD2-CG 4.05Å; L24-M133 HydrophobicContact CD2-SD 3.83Å; L24-M133 HydrophobicContact CG-CG 4.25Å
25A95.9Very high94.5Very high1 Ų153.9 Ų53.91%0.00826%0.264CS..Hα-helixtrans-58.4-45.1176.200000111.9L21 R22 H23 L28 R29 M133 E134L21-A25 PolarHBondContact O-N 3.31Å; R22-A25 WeakPolarHBondContact O-CB 3.45Å; R22-A25 PolarHBondContact O-N 3.46Å; R22-A25 VanDerWaalsContact O-N 3.16Å; H23-A25 PolarHBondContact O-N 3.05Å; A25-L28 PolarHBondContact O-N 3.16Å; A25-R29 WeakPolarHBondContact O-CG 3.39Å; A25-R29 PolarHBondContact O-N 2.92Å; A25-M133 HydrophobicContact CB-CB 3.75Å; A25-E134 HydrophobicContact CB-CG 3.77Å
26E96.6Very high94.6Very high110 Ų11059.5 Ų59.551%0.51428%0.278SS..Hα-helixtrans-60.1-48.4174.7-68.5169.9170.900111.2R22 H23 L24 L28 R29 L30R22-E26 WeakPolarHBondContact O-CG 3.36Å; R22-E26 PolarHBondContact O-N 2.89Å; H23-E26 IonicContact ND1-OE2 3Å; H23-E26 PolarHBondContact ND1-OE2 3.27Å; H23-E26 PolarHBondContact O-N 3.45Å; L24-E26 VanDerWaalsContact C-N 3.33Å; L24-E26 PolarHBondContact O-N 3.38Å; E26-L28 VanDerWaalsContact C-N 3.34Å; E26-L28 PolarHBondContact O-N 3.37Å; E26-R29 PolarHBondContact O-N 3.43Å; E26-L30 WeakPolarHBondContact O-CG 3.24Å; E26-L30 PolarHBondContact O-N 3.41Å; E26-L30 VanDerWaalsContact O-N 3.07Å
27E96.6Very high94.5Very high92 Ų9260.8 Ų60.843%0.4329%0.285SS..Hα-helixtrans-58.8-42.7177.5-75.7-178-175.500112.8H23 L24 L30 H93H23-E27 WeakPolarHBondContact O-CG 3.43Å; H23-E27 PolarHBondContact O-N 3.38Å; L24-E27 PolarHBondContact O-N 3.41Å; E27-L30 WeakPolarHBondContact O-CB 3.33Å; E27-L30 PolarHBondContact O-N 3.34Å; E27-H93 IonicContact OE2-CE1 2.63Å; E27-H93 PolarHBondContact OE2-CE1 2.79Å; E27-H93 IonicContact OE2-ND1 2.95Å; E27-H93 PolarHBondContact OE2-ND1 3.4Å
28L96.8Very high94Very high0 Ų060.3 Ų60.30%028%0.284CS..Hα-helixtrans-64.5-40.8177.9-70179.6000111.2L24 A25 E26 L30 L31 V92 I96 V126 M129 A130 M133L24-L28 HydrophobicContact CD1-CD1 4.46Å; L24-L28 HydrophobicContact CD1-CD2 4.44Å; L24-L28 HydrophobicContact CD1-CG 4.13Å; L24-L28 HydrophobicContact CG-CD1 4.19Å; L24-L28 HydrophobicContact CG-CG 4.29Å; L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3Å; L24-L28 PolarHBondContact O-N 2.99Å; A25-L28 PolarHBondContact O-N 3.16Å; E26-L28 VanDerWaalsContact C-N 3.34Å; E26-L28 PolarHBondContact O-N 3.37Å; L28-L30 VanDerWaalsContact C-N 3.29Å; L28-L30 PolarHBondContact O-N 3.09Å; L28-L31 HydrophobicContact CD2-CD1 4.09Å; L28-L31 VanDerWaalsContact O-CB 3.24Å; L28-L31 WeakPolarHBondContact O-CB 3.43Å; L28-L31 PolarHBondContact O-N 2.99Å; L28-V92 HydrophobicContact CD1-CG1 4.25Å; L28-I96 HydrophobicContact CD2-CB 4.09Å; L28-I96 HydrophobicContact CD2-CG1 3.99Å; L28-I96 HydrophobicContact CD2-CG2 3.94Å; L28-V126 WeakPolarHBondContact O-CG1 3.5Å; L28-M129 HydrophobicContact CD1-CB 4.21Å; L28-M129 HydrophobicContact CD1-CG 3.63Å; L28-A130 HydrophobicContact CB-CB 3.97Å; L28-A130 HydrophobicContact CD1-CB 4.48Å; L28-M133 HydrophobicContact CD1-CG 4.28Å
29R96.4Very high93.5Very high72 Ų7264.1 Ų64.127%0.27230%0.301SS..Hα-helixtrans-64.4-32.7175.5-73.2-162-177.392.6-3.2113.5A25 E26 L31 L32 P33 A130 E134A25-R29 WeakPolarHBondContact O-CG 3.39Å; A25-R29 PolarHBondContact O-N 2.92Å; E26-R29 PolarHBondContact O-N 3.43Å; R29-L31 PolarHBondContact O-N 3.43Å; R29-L31 VanDerWaalsContact O-N 3.16Å; R29-L32 HydrophobicContact CB-CD1 4.36Å; R29-L32 HydrophobicContact CG-CD1 4.21Å; R29-L32 WeakPolarHBondContact O-CB 3.25Å; R29-L32 PolarHBondContact O-N 3.19Å; R29-P33 VanDerWaalsContact O-CD 3.29Å; R29-P33 WeakPolarHBondContact O-CD 3.34Å; R29-A130 HydrophobicContact CG-CB 3.92Å; R29-E134 IonicContact CZ-OE1 2.75Å; R29-E134 IonicContact CZ-OE2 3.17Å; R29-E134 IonicContact NH1-OE1 2.7Å; R29-E134 PolarHBondContact NH1-OE1 3.37Å; R29-E134 IonicContact NH1-OE2 3.85Å; R29-E134 IonicContact NH2-OE1 3.4Å; R29-E134 PolarHBondContact NH2-OE1 3.34Å; R29-E134 VanDerWaalsContact NH2-OE1 3.08Å; R29-E134 IonicContact NH2-OE2 3.87Å; R29-E134 PolarHBondContact NH2-OE2 3.24Å
30L96.3Very high92.9Very high126 Ų12662.1 Ų62.166%0.6629%0.294SS*.THydrogen-bonded Turntrans-63.7-16.6173.5-66.6173.9000112.9E26 E27 L28E26-L30 WeakPolarHBondContact O-CG 3.24Å; E26-L30 PolarHBondContact O-N 3.41Å; E26-L30 VanDerWaalsContact O-N 3.07Å; E27-L30 WeakPolarHBondContact O-CB 3.33Å; E27-L30 PolarHBondContact O-N 3.34Å; L28-L30 VanDerWaalsContact C-N 3.29Å; L28-L30 PolarHBondContact O-N 3.09Å
31L95.4Very high92.4Very high19 Ų1966.5 Ų66.510%0.09932%0.315CS..Hα-helixtrans-78.3-27172.9-53.3177.1000112.5L28 R29 R34 V35 I96 I100 V126L28-L31 HydrophobicContact CD2-CD1 4.09Å; L28-L31 VanDerWaalsContact O-CB 3.24Å; L28-L31 WeakPolarHBondContact O-CB 3.43Å; L28-L31 PolarHBondContact O-N 2.99Å; R29-L31 PolarHBondContact O-N 3.43Å; R29-L31 VanDerWaalsContact O-N 3.16Å; L31-R34 WeakPolarHBondContact O-CB 3.44Å; L31-R34 PolarHBondContact O-N 2.92Å; L31-R34 VanDerWaalsContact O-N 3.1Å; L31-V35 WeakPolarHBondContact O-CG2 3.28Å; L31-V35 PolarHBondContact O-N 2.89Å; L31-I96 HydrophobicContact CD1-CG2 3.89Å; L31-I100 HydrophobicContact CB-CD1 4.26Å; L31-I100 HydrophobicContact CD1-CD1 3.93Å; L31-V126 HydrophobicContact CB-CG1 4.34Å
32L95.2Very high91.4Very high23 Ų2375.8 Ų75.812%0.1236%0.358CS..Hα-helixtrans-58.8-49.4-174.4-60.7169.9000113R29 R34 V35 R36 L123 V126 D127R29-L32 HydrophobicContact CB-CD1 4.36Å; R29-L32 HydrophobicContact CG-CD1 4.21Å; R29-L32 WeakPolarHBondContact O-CB 3.25Å; R29-L32 PolarHBondContact O-N 3.19Å; L32-R34 PolarHBondContact O-N 3.44Å; L32-V35 PolarHBondContact O-N 2.98Å; L32-R36 WeakPolarHBondContact O-CB 3.25Å; L32-R36 PolarHBondContact O-N 2.96Å; L32-L123 HydrophobicContact CB-CD2 4.29Å; L32-L123 HydrophobicContact CD2-CB 4.49Å; L32-L123 HydrophobicContact CD2-CD2 3.87Å; L32-L123 WeakPolarHBondContact O-CD2 3.3Å; L32-V126 HydrophobicContact CD2-CB 3.8Å; L32-V126 HydrophobicContact CD2-CG1 3.59Å; L32-V126 HydrophobicContact CG-CG1 4.16Å; L32-D127 HydrophobicContact CD1-CB 4.34Å; L32-D127 HydrophobicContact CD2-CB 4.16Å
33P94.9Very high90.2Very high75 Ų7574.4 Ų74.449%0.48736%0.361SS..Hα-helixtrans-60.9-36.7176.8-22.334.5000112R29 R36 V37R29-P33 VanDerWaalsContact O-CD 3.29Å; R29-P33 WeakPolarHBondContact O-CD 3.34Å; P33-R36 PolarHBondContact O-N 3.31Å; P33-V37 WeakPolarHBondContact O-CG2 3.45Å; P33-V37 PolarHBondContact O-N 3.47Å
34R92.7Very high88.7Confident171 Ų17178.1 Ų78.165%0.64539%0.39SS*.Hα-helixtrans-67.1-42.9-179-57.5179.472-179.13.1111.6L31 L32 R36 G38 Y104L31-R34 WeakPolarHBondContact O-CB 3.44Å; L31-R34 PolarHBondContact O-N 2.92Å; L31-R34 VanDerWaalsContact O-N 3.1Å; L32-R34 PolarHBondContact O-N 3.44Å; R34-R36 VanDerWaalsContact C-N 3.33Å; R34-G38 VanDerWaalsContact O-CA 3.28Å; R34-G38 WeakPolarHBondContact O-CA 3.4Å; R34-G38 PolarHBondContact O-N 3.15Å; R34-Y104 PolarHBondContact O-OH 3.13Å
35V93.7Very high87.7Confident2 Ų285.8 Ų85.81%0.01243%0.425CS..Hα-helixtrans-66.3-36.7176.2173.80000111.2L31 L32 V37 G38 I100 Y103 Y104 R119 T122 L123L31-V35 WeakPolarHBondContact O-CG2 3.28Å; L31-V35 PolarHBondContact O-N 2.89Å; L32-V35 PolarHBondContact O-N 2.98Å; V35-V37 PolarHBondContact O-N 2.94Å; V35-G38 PolarHBondContact O-N 2.63Å; V35-I100 HydrophobicContact CG2-CD1 3.84Å; V35-I100 HydrophobicContact CG2-CG1 4.02Å; V35-I100 HydrophobicContact CG2-CG2 3.92Å; V35-Y103 HydrophobicContact CG1-CD1 4.3Å; V35-Y103 HydrophobicContact CG1-CE1 3.96Å; V35-Y104 WeakPolarHBondContact CA-OH 3.42Å; V35-R119 HydrophobicContact CG1-CG 4.37Å; V35-T122 HydrophobicContact CG1-CG2 3.88Å; V35-L123 HydrophobicContact CB-CD2 3.75Å; V35-L123 HydrophobicContact CG1-CD2 3.69Å; V35-L123 HydrophobicContact CG1-CG 3.99Å
36R91.8Very high87.1Confident151 Ų15194.9 Ų94.957%0.5747%0.468SS*.Hα-helixtrans-61.9-45.4-179-167.4172.7-68.2158.9-0.9112.5L32 P33 R34 R119L32-R36 WeakPolarHBondContact O-CB 3.25Å; L32-R36 PolarHBondContact O-N 2.96Å; P33-R36 PolarHBondContact O-N 3.31Å; R34-R36 VanDerWaalsContact C-N 3.33Å; R36-R119 PolarHBondContact O-NH1 3.36Å
37V89.8Confident86.8Confident113 Ų11392 Ų9269%0.68545%0.453SS*.Hα-helixtrans-92.5-2.8178.9-56.10000113.7P33 V35 E39P33-V37 WeakPolarHBondContact O-CG2 3.45Å; P33-V37 PolarHBondContact O-N 3.47Å; V35-V37 PolarHBondContact O-N 2.94Å; V37-E39 PolarHBondContact O-N 2.92Å
38G81.8Confident86.7Confident12 Ų1292 Ų9212%0.12446%0.456CS..PPolyproline II helixtrans-68.2129.1-168.800000113.4R34 V35 R115R34-G38 VanDerWaalsContact O-CA 3.28Å; R34-G38 WeakPolarHBondContact O-CA 3.4Å; R34-G38 PolarHBondContact O-N 3.15Å; V35-G38 PolarHBondContact O-N 2.63Å; G38-R115 PolarHBondContact O-NH1 2.95Å; G38-R115 PolarHBondContact O-NH2 3.41Å
39E80.2Confident86.5Confident116 Ų11696.8 Ų96.854%0.54248%0.475SS..PPolyproline II helixtrans-80.4154.4-179.7-77.5-63.3165.300112.4V37 Y104 K108 R115V37-E39 PolarHBondContact O-N 2.92Å; E39-Y104 WeakPolarHBondContact O-CD1 3.3Å; E39-K108 IonicContact OE1-NZ 2.78Å; E39-K108 PolarHBondContact OE1-NZ 2.77Å; E39-K108 WeakPolarHBondContact OE2-CE 3.17Å; E39-K108 IonicContact OE2-NZ 3.91Å; E39-K108 PolarHBondContact OE2-NZ 2.96Å; E39-R115 VanDerWaalsContact C-NH2 3.27Å
40A82.9Confident86.4Confident20 Ų2099.7 Ų99.717%0.16549%0.491CS..PPolyproline II helixtrans-66.1145.3174.800000109.1E42 K108 R115A40-E42 PolarHBondContact O-N 3.27Å; A40-K108 HydrophobicContact CB-CG 4.42Å; A40-R115 VanDerWaalsContact N-NH2 3.11Å
41Q82.8Confident86.3Confident112 Ų11297.4 Ų97.452%0.52348%0.478SS..PPolyproline II helixtrans-65.3126.6172.9-171.8172.7-9.200108.9T43 Y104Q41-T43 HydrophobicContact CB-CG2 4.39Å; Q41-T43 HydrophobicContact CG-CG2 4Å; Q41-T43 PolarHBondContact O-N 3.21Å; Q41-Y104 WeakPolarHBondContact CB-O 3.36Å; Q41-Y104 PolarHBondContact N-O 3.18Å
42E73.1Confident86.4Confident194 Ų19496.9 Ų96.991%0.90748%0.475SS*.  trans-68.9114.5172.7-69.9-177.2177.200108.8A40A40-E42 PolarHBondContact O-N 3.27Å
43T70Confident86.4Confident72 Ų7296.2 Ų96.244%0.44247%0.471SS..  trans-132.1133.8177.164.20000109.8Q41 E45Q41-T43 HydrophobicContact CB-CG2 4.39Å; Q41-T43 HydrophobicContact CG-CG2 4Å; Q41-T43 PolarHBondContact O-N 3.21Å; T43-E45 VanDerWaalsContact C-N 3.3Å
44T63.5Low86.5Confident155 Ų15598.9 Ų98.995%0.95147%0.471SS*.  trans-85-4.5172.949.70000113.2
45E75.1Confident86.7Confident165 Ų16596 Ų9677%0.77146%0.46SS*.SBendtrans-81.2147.2179.5-66.8-174.7173.300111.6T43 F47T43-E45 VanDerWaalsContact C-N 3.3Å; E45-F47 PolarHBondContact O-N 3.38Å
46E83.8Confident86.9Confident193 Ų19396 Ų9690%0.90246%0.46SS*.  trans-65125.5177.3-167.7177.7-177.900110.6N48E46-N48 PolarHBondContact O-N 3.18Å
47F90.8Very high87.1Confident49 Ų4990.4 Ų90.422%0.21544%0.442CS..  trans-68.1114.7-177.3174.2-104.1000111.7E45 R49 F52 L106 P107 Q110E45-F47 PolarHBondContact O-N 3.38Å; F47-R49 HydrophobicContact CD1-CB 4.35Å; F47-R49 HydrophobicContact CE1-CB 3.85Å; F47-R49 HydrophobicContact CE1-CG 4.14Å; F47-R49 PolarHBondContact O-N 3.14Å; F47-F52 HydrophobicContact CE2-CB 3.66Å; F47-F52 HydrophobicContact CE2-CD1 4.48Å; F47-F52 AromaticContact CE2-CD2 3.89Å; F47-F52 HydrophobicContact CE2-CD2 3.89Å; F47-F52 AromaticContact CE2-CG 3.75Å; F47-F52 HydrophobicContact CE2-CG 3.75Å; F47-F52 HydrophobicContact CZ-CB 3.58Å; F47-F52 AromaticContact CZ-CD1 3.94Å; F47-F52 HydrophobicContact CZ-CD1 3.94Å; F47-F52 HydrophobicContact CZ-CD2 4.17Å; F47-F52 AromaticContact CZ-CG 3.62Å; F47-F52 HydrophobicContact CZ-CG 3.62Å; F47-L106 HydrophobicContact CE2-CD1 4.33Å; F47-L106 HydrophobicContact CZ-CD1 3.88Å; F47-P107 HydrophobicContact CB-CG 4.01Å; F47-P107 VanDerWaalsContact CD2-CD 3.48Å; F47-P107 HydrophobicContact CD2-CG 3.69Å; F47-P107 HydrophobicContact CE2-CG 4.29Å; F47-P107 HydrophobicContact CG-CG 3.84Å; F47-Q110 VanDerWaalsContact CD1-CD 3.44Å; F47-Q110 HydrophobicContact CD1-CG 3.76Å; F47-Q110 HydrophobicContact CE1-CG 3.62Å; F47-Q110 HydrophobicContact CG-CG 4.42Å; F47-Q110 HydrophobicContact CZ-CG 4.19Å
48N93.5Very high87.4Confident92 Ų9290.2 Ų90.249%0.49243%0.433SS..  trans-87.698.7174.7-171.3-40.7000111.4E46 E50 M51 F52E46-N48 PolarHBondContact O-N 3.18Å; N48-E50 PolarHBondContact O-N 3.47Å; N48-E50 PolarHBondContact OD1-N 3.33Å; N48-M51 HydrophobicContact CB-CB 3.9Å; N48-M51 PolarHBondContact O-N 2.9Å; N48-M51 WeakPolarHBondContact OD1-CB 3.37Å; N48-M51 PolarHBondContact OD1-N 3.16Å; N48-F52 WeakPolarHBondContact O-CB 3.37Å; N48-F52 PolarHBondContact O-N 3.12Å
49R92.2Very high88.2Confident101 Ų10190.2 Ų90.238%0.38143%0.432SS..Hα-helixtrans-57.4-44.1-177.7-169.2169.584.5132.7-3.5113.6F47 W53 R167 D168F47-R49 HydrophobicContact CD1-CB 4.35Å; F47-R49 HydrophobicContact CE1-CB 3.85Å; F47-R49 HydrophobicContact CE1-CG 4.14Å; F47-R49 PolarHBondContact O-N 3.14Å; R49-W53 PolarHBondContact O-N 3.23Å; R49-R167 PolarHBondContact NH1-O 3Å; R49-D168 IonicContact NH1-OD2 2.98Å; R49-D168 PolarHBondContact NH1-OD2 3.24Å
50E94.6Very high89Confident132 Ų13284.8 Ų84.862%0.61741%0.407SS*.Hα-helixtrans-67.6-43.8-177.5-166.5-166.7140.600111.3N48 W53 R54N48-E50 PolarHBondContact O-N 3.47Å; N48-E50 PolarHBondContact OD1-N 3.33Å; E50-W53 PolarHBondContact O-N 2.95Å; E50-R54 WeakPolarHBondContact O-CB 3.4Å; E50-R54 PolarHBondContact O-N 3.35Å; E50-R54 IonicContact OE1-CZ 3.89Å; E50-R54 IonicContact OE1-NH2 2.77Å; E50-R54 PolarHBondContact OE1-NH2 3.18Å
51M95.4Very high89.7Confident78 Ų7888.4 Ų88.438%0.38443%0.427SS..Hα-helixtrans-65.1-39.2178.5-174.7167.6178.800112.2N48 R54 R55N48-M51 HydrophobicContact CB-CB 3.9Å; N48-M51 PolarHBondContact O-N 2.9Å; N48-M51 WeakPolarHBondContact OD1-CB 3.37Å; N48-M51 PolarHBondContact OD1-N 3.16Å; M51-R54 PolarHBondContact O-N 3.41Å; M51-R55 WeakPolarHBondContact O-CB 3.46Å; M51-R55 WeakPolarHBondContact O-CG 3.41Å; M51-R55 PolarHBondContact O-N 3.36Å
52F96.1Very high90.4Very high8 Ų885.3 Ų85.34%0.03542%0.415CS..Hα-helixtrans-57.3-56.2173.3169.3-95.5000111.3F47 N48 R54 R55 L56 V102 L105 L106 V118F47-F52 HydrophobicContact CE2-CB 3.66Å; F47-F52 HydrophobicContact CE2-CD1 4.48Å; F47-F52 AromaticContact CE2-CD2 3.89Å; F47-F52 HydrophobicContact CE2-CD2 3.89Å; F47-F52 AromaticContact CE2-CG 3.75Å; F47-F52 HydrophobicContact CE2-CG 3.75Å; F47-F52 HydrophobicContact CZ-CB 3.58Å; F47-F52 AromaticContact CZ-CD1 3.94Å; F47-F52 HydrophobicContact CZ-CD1 3.94Å; F47-F52 HydrophobicContact CZ-CD2 4.17Å; F47-F52 AromaticContact CZ-CG 3.62Å; F47-F52 HydrophobicContact CZ-CG 3.62Å; N48-F52 WeakPolarHBondContact O-CB 3.37Å; N48-F52 PolarHBondContact O-N 3.12Å; F52-R54 VanDerWaalsContact C-N 3.27Å; F52-R54 PolarHBondContact O-N 2.92Å; F52-R55 PolarHBondContact O-N 3.47Å; F52-L56 HydrophobicContact CE1-CD2 3.99Å; F52-L56 HydrophobicContact CZ-CD2 3.95Å; F52-L56 WeakPolarHBondContact O-CB 2.86Å; F52-L56 PolarHBondContact O-N 2.92Å; F52-V102 HydrophobicContact CD2-CG1 4.36Å; F52-V102 HydrophobicContact CE2-CG1 4.24Å; F52-V102 WeakPolarHBondContact CE2-O 3.28Å; F52-L105 HydrophobicContact CD2-CB 4.41Å; F52-L106 HydrophobicContact CD1-CD1 4.46Å; F52-L106 HydrophobicContact CE1-CD1 4Å; F52-L106 HydrophobicContact CE2-CB 3.7Å; F52-L106 HydrophobicContact CE2-CD1 4.33Å; F52-L106 HydrophobicContact CZ-CB 3.74Å; F52-L106 HydrophobicContact CZ-CD1 3.94Å; F52-L106 HydrophobicContact CZ-CD2 4.17Å; F52-L106 HydrophobicContact CZ-CG 4.17Å; F52-V118 HydrophobicContact CZ-CG1 4.42Å
53W96.8Very high91.6Very high9 Ų976 Ų763%0.03437%0.372CS..Hα-helixtrans-63.7-34.7-177.9-72.5115.2000112.3R49 E50 L56 N57 L114 V118 I165 P166 R167R49-W53 PolarHBondContact O-N 3.23Å; E50-W53 PolarHBondContact O-N 2.95Å; W53-L56 HydrophobicContact CE3-CD2 3.85Å; W53-L56 HydrophobicContact CZ3-CD2 3.67Å; W53-N57 PolarHBondContact O-N 3.22Å; W53-N57 VanDerWaalsContact O-N 3.11Å; W53-N57 PolarHBondContact O-ND2 3.45Å; W53-L114 HydrophobicContact CH2-CD1 4.2Å; W53-L114 HydrophobicContact CZ2-CD1 4.1Å; W53-L114 HydrophobicContact CZ2-CD2 4.45Å; W53-V118 HydrophobicContact CH2-CG2 3.65Å; W53-V118 HydrophobicContact CZ3-CG2 4.26Å; W53-I165 HydrophobicContact CH2-CG2 4.1Å; W53-I165 HydrophobicContact CZ3-CB 4.49Å; W53-I165 HydrophobicContact CZ3-CG2 4.3Å; W53-P166 VanDerWaalsContact CH2-O 3.23Å; W53-P166 WeakPolarHBondContact CH2-O 3.48Å; W53-P166 WeakPolarHBondContact CZ2-O 3.5Å; W53-R167 HydrophobicContact CD2-CB 4.38Å; W53-R167 HydrophobicContact CD2-CG 3.9Å; W53-R167 HydrophobicContact CE3-CG 4.37Å; W53-R167 HydrophobicContact CG-CG 4.21Å; W53-R167 VanDerWaalsContact CZ2-CA 3.48Å; W53-R167 HydrophobicContact CZ2-CB 4.13Å; W53-R167 HydrophobicContact CZ2-CG 4.22Å; W53-R167 PolarHBondContact NE1-O 2.88Å
54R96.5Very high92.9Very high131 Ų13173.9 Ų73.949%0.49436%0.36SS..Hα-helixtrans-61.7-53.8174.3-169.9-171.4-52.1177.52.4111.3E50 M51 F52 L56 N57 E58E50-R54 WeakPolarHBondContact O-CB 3.4Å; E50-R54 PolarHBondContact O-N 3.35Å; E50-R54 IonicContact OE1-CZ 3.89Å; E50-R54 IonicContact OE1-NH2 2.77Å; E50-R54 PolarHBondContact OE1-NH2 3.18Å; M51-R54 PolarHBondContact O-N 3.41Å; F52-R54 VanDerWaalsContact C-N 3.27Å; F52-R54 PolarHBondContact O-N 2.92Å; R54-L56 VanDerWaalsContact C-N 3.29Å; R54-L56 PolarHBondContact O-N 3.46Å; R54-N57 PolarHBondContact O-N 3.04Å; R54-E58 WeakPolarHBondContact CG-OE1 3.35Å; R54-E58 WeakPolarHBondContact O-CG 3.49Å; R54-E58 PolarHBondContact O-N 2.87Å
55R96.8Very high94.4Very high112 Ų11273.2 Ų73.242%0.42334%0.34SS..Hα-helixtrans-58.9-40.2178.6-75.9177.3170-175.9-6.8112.3M51 F52 E58 A59 V102M51-R55 WeakPolarHBondContact O-CB 3.46Å; M51-R55 WeakPolarHBondContact O-CG 3.41Å; M51-R55 PolarHBondContact O-N 3.36Å; F52-R55 PolarHBondContact O-N 3.47Å; R55-E58 PolarHBondContact O-N 2.94Å; R55-A59 VanDerWaalsContact O-CB 3.3Å; R55-A59 WeakPolarHBondContact O-CB 3.32Å; R55-A59 PolarHBondContact O-N 3.18Å; R55-V102 HydrophobicContact CB-CG1 4.02Å; R55-V102 HydrophobicContact CB-CG2 4.24Å
56L96.7Very high95.5Very high0 Ų066.2 Ų66.20%031%0.308CS..Hα-helixtrans-65.3-42.8-179.4-170.668.9000111.3F52 W53 R54 A59 A60 F99 V102 V118 M162F52-L56 HydrophobicContact CE1-CD2 3.99Å; F52-L56 HydrophobicContact CZ-CD2 3.95Å; F52-L56 WeakPolarHBondContact O-CB 2.86Å; F52-L56 PolarHBondContact O-N 2.92Å; W53-L56 HydrophobicContact CE3-CD2 3.85Å; W53-L56 HydrophobicContact CZ3-CD2 3.67Å; R54-L56 VanDerWaalsContact C-N 3.29Å; R54-L56 PolarHBondContact O-N 3.46Å; L56-A59 PolarHBondContact O-N 3.43Å; L56-A60 PolarHBondContact O-N 3.41Å; L56-F99 HydrophobicContact CD1-CD2 4.46Å; L56-F99 HydrophobicContact CD1-CE2 3.77Å; L56-F99 HydrophobicContact CD1-CZ 3.81Å; L56-F99 HydrophobicContact CG-CE2 4.3Å; L56-F99 HydrophobicContact CG-CZ 4.48Å; L56-V102 HydrophobicContact CB-CG1 3.86Å; L56-V102 HydrophobicContact CD1-CB 4.23Å; L56-V102 HydrophobicContact CD1-CG1 3.85Å; L56-V102 HydrophobicContact CG-CG1 4.47Å; L56-V118 HydrophobicContact CD2-CG1 4.08Å; L56-M162 HydrophobicContact CD1-CE 4.14Å; L56-M162 HydrophobicContact CD2-CE 3.46Å; L56-M162 VanDerWaalsContact CD2-CE 3.46Å; L56-M162 HydrophobicContact CG-CE 3.52Å
57N96.4Very high96.1Very high35 Ų3557 Ų5719%0.18727%0.265CS..Hα-helixtrans-67.4-43175.5-74.2-55.9000112.2W53 R54 A59 A60 V61W53-N57 PolarHBondContact O-N 3.22Å; W53-N57 VanDerWaalsContact O-N 3.11Å; W53-N57 PolarHBondContact O-ND2 3.45Å; R54-N57 PolarHBondContact O-N 3.04Å; N57-A59 VanDerWaalsContact C-N 3.3Å; N57-A59 PolarHBondContact O-N 2.9Å; N57-A60 PolarHBondContact O-N 3.2Å; N57-V61 WeakPolarHBondContact O-CG2 3.47Å; N57-V61 PolarHBondContact O-N 2.91Å
58E96.8Very high96.2Very high109 Ų10957.9 Ų57.951%0.50927%0.274SS..Hα-helixtrans-60.2-40.3175.9-72.6169.4-177.100111.9R54 R55 V61 T62R54-E58 WeakPolarHBondContact CG-OE1 3.35Å; R54-E58 WeakPolarHBondContact O-CG 3.49Å; R54-E58 PolarHBondContact O-N 2.87Å; R55-E58 PolarHBondContact O-N 2.94Å; E58-V61 PolarHBondContact O-N 3.02Å; E58-T62 PolarHBondContact O-N 3.31Å; E58-T62 PolarHBondContact O-OG1 3.35Å
59A97.7Very high96.3Very high11 Ų1155.9 Ų55.99%0.09127%0.265CS..Hα-helixtrans-65.8-41.7175.600000111.7R55 L56 N57 T62 V63 F99 V102R55-A59 VanDerWaalsContact O-CB 3.3Å; R55-A59 WeakPolarHBondContact O-CB 3.32Å; R55-A59 PolarHBondContact O-N 3.18Å; L56-A59 PolarHBondContact O-N 3.43Å; N57-A59 VanDerWaalsContact C-N 3.3Å; N57-A59 PolarHBondContact O-N 2.9Å; A59-T62 WeakPolarHBondContact O-CB 3.11Å; A59-T62 PolarHBondContact O-N 3.18Å; A59-V63 WeakPolarHBondContact O-CG2 3.45Å; A59-V63 PolarHBondContact O-N 2.87Å; A59-F99 HydrophobicContact CB-CB 4.17Å; A59-F99 HydrophobicContact CB-CD2 3.61Å; A59-F99 HydrophobicContact CB-CE2 4.47Å; A59-F99 HydrophobicContact CB-CG 4.36Å; A59-V102 HydrophobicContact CB-CG2 4.44Å
60A97.3Very high96.3Very high3 Ų351.1 Ų51.13%0.02525%0.247CC..Hα-helixtrans-62-43.6175.100000112.2L56 N57 T62 V63 S64 F99 I125 M162L56-A60 PolarHBondContact O-N 3.41Å; N57-A60 PolarHBondContact O-N 3.2Å; A60-T62 VanDerWaalsContact C-N 3.27Å; A60-T62 PolarHBondContact O-N 3.21Å; A60-V63 PolarHBondContact O-N 3.24Å; A60-S64 PolarHBondContact O-N 3.21Å; A60-F99 HydrophobicContact CB-CD2 4.35Å; A60-F99 HydrophobicContact CB-CE2 3.85Å; A60-I125 HydrophobicContact CB-CD1 4.49Å; A60-M162 HydrophobicContact CB-CB 4.25Å; A60-M162 HydrophobicContact CB-CG 3.73Å
61V97.2Very high96.2Very high96 Ų9645.7 Ų45.758%0.58222%0.223SC*.Hα-helixtrans-59.5-42.3175.1170.70000110.6N57 E58 S64 R65N57-V61 WeakPolarHBondContact O-CG2 3.47Å; N57-V61 PolarHBondContact O-N 2.91Å; E58-V61 PolarHBondContact O-N 3.02Å; V61-S64 PolarHBondContact O-N 3.45Å; V61-S64 PolarHBondContact O-OG 3.12Å; V61-R65 WeakPolarHBondContact O-CB 3.26Å; V61-R65 PolarHBondContact O-N 3.04Å
62T97.9Very high95.9Very high46 Ų4645.3 Ų45.328%0.28223%0.225SC..Hα-helixtrans-59.4-49.3175.7-58.20000111.1E58 A59 A60 S64 R65 E66 A95E58-T62 PolarHBondContact O-N 3.31Å; E58-T62 PolarHBondContact O-OG1 3.35Å; A59-T62 WeakPolarHBondContact O-CB 3.11Å; A59-T62 PolarHBondContact O-N 3.18Å; A60-T62 VanDerWaalsContact C-N 3.27Å; A60-T62 PolarHBondContact O-N 3.21Å; T62-S64 VanDerWaalsContact C-N 3.34Å; T62-S64 PolarHBondContact O-N 3.45Å; T62-R65 WeakPolarHBondContact O-CB 3.24Å; T62-R65 PolarHBondContact O-N 3.43Å; T62-R65 VanDerWaalsContact O-N 3.15Å; T62-E66 WeakPolarHBondContact O-CG 3.34Å; T62-E66 PolarHBondContact O-N 2.96Å; T62-A95 HydrophobicContact CG2-CB 4.03Å
63V98Very high95.7Very high0 Ų047 Ų470%024%0.236CC..Hα-helixtrans-57.2-46.6176.9174.80000111.4A59 A60 R65 E66 A67 A95 I96 F99 I125 M129 V155A59-V63 WeakPolarHBondContact O-CG2 3.45Å; A59-V63 PolarHBondContact O-N 2.87Å; A60-V63 PolarHBondContact O-N 3.24Å; V63-R65 VanDerWaalsContact C-N 3.29Å; V63-R65 PolarHBondContact O-N 3.03Å; V63-E66 PolarHBondContact O-N 3.16Å; V63-A67 PolarHBondContact O-N 2.94Å; V63-A95 HydrophobicContact CG2-CB 4.12Å; V63-I96 HydrophobicContact CG1-CD1 3.77Å; V63-I96 HydrophobicContact CG2-CD1 4.04Å; V63-F99 HydrophobicContact CG2-CB 4.09Å; V63-F99 HydrophobicContact CG2-CG 4.47Å; V63-I125 HydrophobicContact CB-CG2 4.43Å; V63-I125 HydrophobicContact CG1-CG2 3.72Å; V63-M129 HydrophobicContact CG1-CE 3.55Å; V63-M129 WeakPolarHBondContact O-CE 3.19Å; V63-V155 HydrophobicContact CG1-CG2 4.18Å
64S97Very high95.3Very high27 Ų2747.4 Ų47.419%0.18924%0.238CC..Hα-helixtrans-62.5-34178.574.70000113.4A60 V61 T62 A67 T68 W156A60-S64 PolarHBondContact O-N 3.21Å; V61-S64 PolarHBondContact O-N 3.45Å; V61-S64 PolarHBondContact O-OG 3.12Å; T62-S64 VanDerWaalsContact C-N 3.34Å; T62-S64 PolarHBondContact O-N 3.45Å; S64-A67 WeakPolarHBondContact O-CB 3.49Å; S64-A67 PolarHBondContact O-N 2.9Å; S64-T68 PolarHBondContact O-N 3.02Å; S64-T68 PolarHBondContact O-OG1 2.71Å; S64-T68 VanDerWaalsContact O-OG1 3.13Å; S64-W156 PolarHBondContact O-NE1 3.42Å
65R97.1Very high94.8Very high141 Ų14144.9 Ų44.953%0.53224%0.24SC..Hα-helixtrans-69.7-41.1176.7-175.5-172.167.2-156.2-3.3111.6V61 T62 V63 A67 T68 T69V61-R65 WeakPolarHBondContact O-CB 3.26Å; V61-R65 PolarHBondContact O-N 3.04Å; T62-R65 WeakPolarHBondContact O-CB 3.24Å; T62-R65 PolarHBondContact O-N 3.43Å; T62-R65 VanDerWaalsContact O-N 3.15Å; V63-R65 VanDerWaalsContact C-N 3.29Å; V63-R65 PolarHBondContact O-N 3.03Å; R65-A67 VanDerWaalsContact C-N 3.33Å; R65-T68 PolarHBondContact O-N 3.06Å; R65-T69 WeakPolarHBondContact O-CB 3.34Å; R65-T69 PolarHBondContact O-N 3.47Å; R65-T69 PolarHBondContact O-OG1 2.98Å
66E97.3Very high94.2Very high18 Ų1845.4 Ų45.48%0.08425%0.248CC..Hα-helixtrans-65.5-39.3175.7-57.4-43.3136.800110.7T62 V63 T68 T69 L70 V92 A95T62-E66 WeakPolarHBondContact O-CG 3.34Å; T62-E66 PolarHBondContact O-N 2.96Å; V63-E66 PolarHBondContact O-N 3.16Å; E66-T68 PolarHBondContact O-N 3.21Å; E66-T69 PolarHBondContact O-N 3.41Å; E66-L70 PolarHBondContact O-N 3.22Å; E66-V92 HydrophobicContact CB-CG2 4Å; E66-A95 HydrophobicContact CG-CB 3.93Å
67A95.6Very high93.5Very high0 Ų052.9 Ų52.90%029%0.287CS..Hα-helixtrans-57.2-49.6171.700000111.9V63 S64 R65 T69 L70 T71 M129 L132 V155 W156V63-A67 PolarHBondContact O-N 2.94Å; S64-A67 WeakPolarHBondContact O-CB 3.49Å; S64-A67 PolarHBondContact O-N 2.9Å; R65-A67 VanDerWaalsContact C-N 3.33Å; A67-T69 VanDerWaalsContact C-N 3.31Å; A67-T69 PolarHBondContact O-N 3.24Å; A67-L70 PolarHBondContact O-N 3.22Å; A67-T71 WeakPolarHBondContact O-CB 3.45Å; A67-T71 PolarHBondContact O-N 3.33Å; A67-T71 PolarHBondContact O-OG1 2.97Å; A67-M129 HydrophobicContact CB-CE 3.84Å; A67-M129 HydrophobicContact CB-SD 4.39Å; A67-L132 HydrophobicContact CB-CD2 3.66Å; A67-V155 HydrophobicContact CB-CG1 3.72Å; A67-V155 HydrophobicContact CB-CG2 4.44Å; A67-W156 HydrophobicContact CB-CH2 4.16Å; A67-W156 HydrophobicContact CB-CZ2 3.64Å
68T94.4Very high93.1Very high66 Ų6657 Ų5741%0.40532%0.316SS..Hα-helixtrans-62.1-39.7178.1-61.10000112.2S64 R65 E66 T72 W156S64-T68 PolarHBondContact O-N 3.02Å; S64-T68 PolarHBondContact O-OG1 2.71Å; S64-T68 VanDerWaalsContact O-OG1 3.13Å; R65-T68 PolarHBondContact O-N 3.06Å; E66-T68 PolarHBondContact O-N 3.21Å; T68-T72 WeakPolarHBondContact O-CB 3.35Å; T68-T72 PolarHBondContact O-N 3.04Å; T68-T72 PolarHBondContact O-OG1 3.22Å; T68-W156 PolarHBondContact OG1-NE1 2.64Å
69T94.5Very high92.7Very high50 Ų5054.8 Ų54.831%0.30731%0.307SS..Hα-helixtrans-62.6-51.3178.2-59.10000110.5R65 E66 A67 T72 V73 F88R65-T69 WeakPolarHBondContact O-CB 3.34Å; R65-T69 PolarHBondContact O-N 3.47Å; R65-T69 PolarHBondContact O-OG1 2.98Å; E66-T69 PolarHBondContact O-N 3.41Å; A67-T69 VanDerWaalsContact C-N 3.31Å; A67-T69 PolarHBondContact O-N 3.24Å; T69-T72 PolarHBondContact O-N 3.11Å; T69-V73 VanDerWaalsContact O-CG2 3.31Å; T69-V73 WeakPolarHBondContact O-CG2 3.43Å; T69-V73 PolarHBondContact O-N 2.96Å; T69-F88 HydrophobicContact CG2-CD1 4.21Å; T69-F88 HydrophobicContact CG2-CE1 3.79Å
70L92.8Very high92.4Very high1 Ų154.9 Ų54.91%0.00531%0.307CS..Hα-helixtrans-61-48.4179-91-175.7000112.4L21 E66 A67 T72 V73 F74 F88 V92 M133 L136L21-L70 HydrophobicContact CD2-CD1 4.47Å; L21-L70 HydrophobicContact CD2-CD2 4.35Å; E66-L70 PolarHBondContact O-N 3.22Å; A67-L70 PolarHBondContact O-N 3.22Å; L70-T72 VanDerWaalsContact C-N 3.29Å; L70-T72 PolarHBondContact O-N 2.99Å; L70-V73 PolarHBondContact O-N 3.39Å; L70-F74 HydrophobicContact CD2-CD2 3.67Å; L70-F74 HydrophobicContact CD2-CE2 3.42Å; L70-F74 VanDerWaalsContact CD2-CE2 3.42Å; L70-F74 WeakPolarHBondContact O-CB 3.25Å; L70-F74 WeakPolarHBondContact O-CD2 3.41Å; L70-F74 PolarHBondContact O-N 3.15Å; L70-F88 HydrophobicContact CD2-CB 3.56Å; L70-F88 HydrophobicContact CD2-CD2 4.49Å; L70-F88 HydrophobicContact CD2-CG 4.04Å; L70-F88 HydrophobicContact CG-CB 4.33Å; L70-V92 HydrophobicContact CD1-CG2 3.43Å; L70-V92 VanDerWaalsContact CD1-CG2 3.43Å; L70-V92 HydrophobicContact CG-CG2 4.24Å; L70-M133 HydrophobicContact CD1-CE 3.24Å; L70-M133 HydrophobicContact CD1-SD 3.43Å; L70-M133 WeakPolarHBondContact CD1-SD 3.47Å; L70-L136 HydrophobicContact CB-CD1 4.12Å
71T91.9Very high92.3Very high19 Ų1956.5 Ų56.512%0.11732%0.318CS..Hα-helixtrans-53.9-47.7175.5-85.40000111.7A67 V73 S75 Y152 W156A67-T71 WeakPolarHBondContact O-CB 3.45Å; A67-T71 PolarHBondContact O-N 3.33Å; A67-T71 PolarHBondContact O-OG1 2.97Å; T71-V73 VanDerWaalsContact C-N 3.35Å; T71-V73 PolarHBondContact O-N 3.06Å; T71-S75 WeakPolarHBondContact O-CB 3.42Å; T71-S75 PolarHBondContact O-N 3.39Å; T71-S75 PolarHBondContact O-OG 2.75Å; T71-Y152 HydrophobicContact CG2-CE1 3.69Å; T71-Y152 WeakPolarHBondContact CG2-OH 3.42Å; T71-Y152 PolarHBondContact OG1-OH 3.45Å; T71-W156 HydrophobicContact CG2-CH2 4.4Å; T71-W156 WeakPolarHBondContact OG1-CH2 3.34Å
72T89.8Confident92.1Very high69 Ų6954.2 Ų54.242%0.42331%0.305SS..Hα-helixtrans-63.8-42.2-177.8-56.70000111.6T68 T69 L70T68-T72 WeakPolarHBondContact O-CB 3.35Å; T68-T72 PolarHBondContact O-N 3.04Å; T68-T72 PolarHBondContact O-OG1 3.22Å; T69-T72 PolarHBondContact O-N 3.11Å; L70-T72 VanDerWaalsContact C-N 3.29Å; L70-T72 PolarHBondContact O-N 2.99Å
73V91.2Very high91.9Very high43 Ų4358.7 Ų58.726%0.26132%0.322SS..Hα-helixtrans-70.4-44.5-178.4171.20000111.7T69 L70 T71 S75 Q76 P80 F88T69-V73 VanDerWaalsContact O-CG2 3.31Å; T69-V73 WeakPolarHBondContact O-CG2 3.43Å; T69-V73 PolarHBondContact O-N 2.96Å; L70-V73 PolarHBondContact O-N 3.39Å; T71-V73 VanDerWaalsContact C-N 3.35Å; T71-V73 PolarHBondContact O-N 3.06Å; V73-S75 VanDerWaalsContact C-N 3.33Å; V73-Q76 PolarHBondContact O-N 3.25Å; V73-P80 HydrophobicContact CG1-CB 4.05Å; V73-P80 HydrophobicContact CG1-CG 3.71Å; V73-F88 HydrophobicContact CG1-CE2 3.86Å; V73-F88 HydrophobicContact CG1-CZ 4.29Å; V73-F88 HydrophobicContact CG2-CE1 4.42Å; V73-F88 HydrophobicContact CG2-CE2 4.27Å; V73-F88 HydrophobicContact CG2-CZ 3.86Å
74F89Confident91.8Very high19 Ų1963.8 Ų63.88%0.08335%0.346CS..Hα-helixtrans-82.6-9.3-177.1-79-96.4000113.8P17 L18 L21 L70 Q76 L79 P80 T85 L136P17-F74 HydrophobicContact CB-CE1 4.13Å; P17-F74 HydrophobicContact CB-CZ 4.49Å; L18-F74 HydrophobicContact CD2-CD1 4.28Å; L18-F74 HydrophobicContact CD2-CE1 4.38Å; L21-F74 HydrophobicContact CD1-CD1 3.57Å; L21-F74 HydrophobicContact CD1-CD2 4.39Å; L21-F74 HydrophobicContact CD1-CE1 3.44Å; L21-F74 VanDerWaalsContact CD1-CE1 3.44Å; L21-F74 HydrophobicContact CD1-CE2 4.28Å; L21-F74 HydrophobicContact CD1-CG 4.07Å; L21-F74 HydrophobicContact CD1-CZ 3.82Å; L21-F74 HydrophobicContact CD2-CE2 4.38Å; L21-F74 HydrophobicContact CD2-CZ 4.16Å; L21-F74 HydrophobicContact CG-CE1 4.03Å; L21-F74 HydrophobicContact CG-CZ 4.06Å; L70-F74 HydrophobicContact CD2-CD2 3.67Å; L70-F74 HydrophobicContact CD2-CE2 3.42Å; L70-F74 VanDerWaalsContact CD2-CE2 3.42Å; L70-F74 WeakPolarHBondContact O-CB 3.25Å; L70-F74 WeakPolarHBondContact O-CD2 3.41Å; L70-F74 PolarHBondContact O-N 3.15Å; F74-Q76 VanDerWaalsContact C-N 3.3Å; F74-L79 HydrophobicContact CD1-CD2 4.03Å; F74-P80 HydrophobicContact CD2-CG 4.36Å; F74-P80 HydrophobicContact CE1-CG 4Å; F74-P80 HydrophobicContact CE2-CG 3.69Å; F74-P80 HydrophobicContact CZ-CG 3.47Å; F74-P80 VanDerWaalsContact CZ-CG 3.47Å; F74-T85 HydrophobicContact CZ-CG2 3.76Å; F74-L136 HydrophobicContact CB-CD1 4.5Å; F74-L136 HydrophobicContact CB-CD2 4.2Å
75S86.4Confident91.6Very high78 Ų7862.5 Ų62.555%0.54534%0.337SS..THydrogen-bonded Turntrans-82.1-5.4171.1-620000113.5T71 V73 Y152T71-S75 WeakPolarHBondContact O-CB 3.42Å; T71-S75 PolarHBondContact O-N 3.39Å; T71-S75 PolarHBondContact O-OG 2.75Å; V73-S75 VanDerWaalsContact C-N 3.33Å; S75-Y152 PolarHBondContact OG-OH 3.05Å
76Q83.7Confident91.6Very high123 Ų12359 Ų5958%0.57533%0.327SS*.SBendtrans-117.9151.2-175.8-62.7-179.827.100111.3V73 F74V73-Q76 PolarHBondContact O-N 3.25Å; F74-Q76 VanDerWaalsContact C-N 3.3Å
77L81.9Confident91.5Very high157 Ų15764.3 Ų64.382%0.82235%0.35SS*.SBendtrans-107.5142.5169.9-69.7177.7000110.3L79L77-L79 HydrophobicContact CD2-CD2 4.47Å; L77-L79 HydrophobicContact CD2-CG 4.08Å
78P87.3Confident91.5Very high122 Ų12266.3 Ų66.379%0.79236%0.358SS*.SBendcis-72.6151.6-0.731.2-35.2000112.8
79L88.9Confident91.6Very high62 Ų6263.9 Ų63.933%0.32534%0.344SS..PPolyproline II helixtrans-60.1152.2171-69.8-179.6000110.6L18 F74 L77L18-L79 HydrophobicContact CD1-CD1 4.47Å; L18-L79 HydrophobicContact CD2-CD1 4.03Å; L18-L79 HydrophobicContact CG-CD1 4.18Å; F74-L79 HydrophobicContact CD1-CD2 4.03Å; L77-L79 HydrophobicContact CD2-CD2 4.47Å; L77-L79 HydrophobicContact CD2-CG 4.08Å
80P91.7Very high91.7Very high13 Ų1366.6 Ų66.68%0.08435%0.353CS..PPolyproline II helixtrans-59.1153.6177.624.8-34.9000111.6P17 V73 F74 E84 F88P17-P80 WeakPolarHBondContact CG-O 3.36Å; V73-P80 HydrophobicContact CG1-CB 4.05Å; V73-P80 HydrophobicContact CG1-CG 3.71Å; F74-P80 HydrophobicContact CD2-CG 4.36Å; F74-P80 HydrophobicContact CE1-CG 4Å; F74-P80 HydrophobicContact CE2-CG 3.69Å; F74-P80 HydrophobicContact CZ-CG 3.47Å; F74-P80 VanDerWaalsContact CZ-CG 3.47Å; P80-E84 HydrophobicContact CB-CB 4.01Å; P80-F88 HydrophobicContact CB-CE2 4.35Å
81S94Very high92Very high37 Ų3770 Ų7026%0.25937%0.369SS..PPolyproline II helixtrans-61.6159.1173.964.90000111.3Q83 E84 T85S81-Q83 PolarHBondContact O-N 3.37Å; S81-Q83 VanDerWaalsContact O-N 3.14Å; S81-E84 WeakPolarHBondContact CB-OE2 3.48Å; S81-E84 PolarHBondContact N-OE2 2.82Å; S81-E84 PolarHBondContact O-N 2.78Å; S81-E84 WeakPolarHBondContact OG-CB 3.4Å; S81-E84 VanDerWaalsContact OG-CD 3.23Å; S81-E84 VanDerWaalsContact OG-CG 3.24Å; S81-E84 WeakPolarHBondContact OG-CG 3.48Å; S81-E84 PolarHBondContact OG-N 3.34Å; S81-E84 PolarHBondContact OG-OE2 3.36Å; S81-T85 WeakPolarHBondContact O-CB 3.38Å; S81-T85 PolarHBondContact O-N 3.28Å; S81-T85 PolarHBondContact O-OG1 2.97Å
82P93.7Very high92.3Very high48 Ų4869.1 Ų69.131%0.31236%0.364SS..Hα-helixtrans-55.3-30.8175-27.935.4000114L14 Q20 Q86L14-P82 HydrophobicContact CB-CB 3.88Å; Q20-P82 PolarHBondContact NE2-O 3.17Å; Q20-P82 PolarHBondContact OE1-O 2.75Å; P82-Q86 WeakPolarHBondContact O-CB 3.47Å; P82-Q86 PolarHBondContact O-N 2.8Å; P82-Q86 VanDerWaalsContact O-N 3.12Å
83Q94.3Very high92.6Very high139 Ų13967.2 Ų67.265%0.6535%0.35SS*.Hα-helixtrans-76.8-42.1179.5-65137.2-11.200111.9L14 S81 T85 Q86 K87L14-Q83 HydrophobicContact CD1-CG 3.72Å; S81-Q83 PolarHBondContact O-N 3.37Å; S81-Q83 VanDerWaalsContact O-N 3.14Å; Q83-T85 VanDerWaalsContact C-N 3.34Å; Q83-Q86 PolarHBondContact O-N 3.33Å; Q83-K87 PolarHBondContact O-N 3.05Å
84E94.6Very high92.9Very high107 Ų10768 Ų6850%0.536%0.361SS..Hα-helixtrans-65.3-41174-71.4162.8146.200110.9P80 S81 Q86 K87 F88P80-E84 HydrophobicContact CB-CB 4.01Å; S81-E84 WeakPolarHBondContact CB-OE2 3.48Å; S81-E84 PolarHBondContact N-OE2 2.82Å; S81-E84 PolarHBondContact O-N 2.78Å; S81-E84 WeakPolarHBondContact OG-CB 3.4Å; S81-E84 VanDerWaalsContact OG-CD 3.23Å; S81-E84 VanDerWaalsContact OG-CG 3.24Å; S81-E84 WeakPolarHBondContact OG-CG 3.48Å; S81-E84 PolarHBondContact OG-N 3.34Å; S81-E84 PolarHBondContact OG-OE2 3.36Å; E84-Q86 VanDerWaalsContact C-N 3.33Å; E84-Q86 PolarHBondContact O-N 2.96Å; E84-K87 WeakPolarHBondContact O-CB 3.16Å; E84-K87 PolarHBondContact O-N 3.35Å; E84-F88 HydrophobicContact CB-CE2 4.35Å; E84-F88 WeakPolarHBondContact O-CD2 3.23Å; E84-F88 PolarHBondContact O-N 3.3Å
85T94.6Very high93.3Very high0 Ų067.4 Ų67.40%036%0.36CS..Hα-helixtrans-58.8-46.2175.8-550000111.3P17 Q20 F74 S81 Q83 K87 F88 C89P17-T85 HydrophobicContact CB-CG2 4.13Å; P17-T85 WeakPolarHBondContact CB-OG1 3.49Å; Q20-T85 HydrophobicContact CB-CG2 3.92Å; Q20-T85 HydrophobicContact CG-CG2 4.47Å; F74-T85 HydrophobicContact CZ-CG2 3.76Å; S81-T85 WeakPolarHBondContact O-CB 3.38Å; S81-T85 PolarHBondContact O-N 3.28Å; S81-T85 PolarHBondContact O-OG1 2.97Å; Q83-T85 VanDerWaalsContact C-N 3.34Å; T85-K87 VanDerWaalsContact C-N 3.26Å; T85-K87 PolarHBondContact O-N 2.94Å; T85-F88 PolarHBondContact O-N 3.1Å; T85-F88 VanDerWaalsContact O-N 3.12Å; T85-C89 PolarHBondContact O-N 3.16Å; T85-C89 PolarHBondContact O-SG 3.07Å; T85-C89 VanDerWaalsContact O-SG 3.35Å
86Q95.8Very high93.9Very high69 Ų6963.7 Ų63.732%0.32233%0.334SS..Hα-helixtrans-57.7-43.3177.9-176.6-172.9-15.500111.1P82 Q83 E84 F88 C89 E90P82-Q86 WeakPolarHBondContact O-CB 3.47Å; P82-Q86 PolarHBondContact O-N 2.8Å; P82-Q86 VanDerWaalsContact O-N 3.12Å; Q83-Q86 PolarHBondContact O-N 3.33Å; E84-Q86 VanDerWaalsContact C-N 3.33Å; E84-Q86 PolarHBondContact O-N 2.96Å; Q86-F88 PolarHBondContact O-N 3.5Å; Q86-C89 WeakPolarHBondContact O-CB 3.44Å; Q86-C89 PolarHBondContact O-N 3.01Å; Q86-E90 PolarHBondContact NE2-OE1 3.25Å; Q86-E90 WeakPolarHBondContact O-CG 3.39Å; Q86-E90 PolarHBondContact O-N 3.41Å
87K96.2Very high94.5Very high129 Ų12963.6 Ų63.656%0.56133%0.331SS*.Hα-helixtrans-62.2-41.4177.8-172.2179.8178.9-177.20112.1Q83 E84 T85 E90 Q91Q83-K87 PolarHBondContact O-N 3.05Å; E84-K87 WeakPolarHBondContact O-CB 3.16Å; E84-K87 PolarHBondContact O-N 3.35Å; T85-K87 VanDerWaalsContact C-N 3.26Å; T85-K87 PolarHBondContact O-N 2.94Å; K87-E90 PolarHBondContact O-N 2.88Å; K87-Q91 VanDerWaalsContact O-CG 3.26Å; K87-Q91 WeakPolarHBondContact O-CG 3.32Å; K87-Q91 PolarHBondContact O-N 2.92Å
88F96Very high95.3Very high41 Ų4158.6 Ų58.618%0.1831%0.313CS..Hα-helixtrans-64.5-41.8174.4-67.3-58.9000111.8T69 L70 V73 P80 E84 T85 Q86 E90 Q91 V92T69-F88 HydrophobicContact CG2-CD1 4.21Å; T69-F88 HydrophobicContact CG2-CE1 3.79Å; L70-F88 HydrophobicContact CD2-CB 3.56Å; L70-F88 HydrophobicContact CD2-CD2 4.49Å; L70-F88 HydrophobicContact CD2-CG 4.04Å; L70-F88 HydrophobicContact CG-CB 4.33Å; V73-F88 HydrophobicContact CG1-CE2 3.86Å; V73-F88 HydrophobicContact CG1-CZ 4.29Å; V73-F88 HydrophobicContact CG2-CE1 4.42Å; V73-F88 HydrophobicContact CG2-CE2 4.27Å; V73-F88 HydrophobicContact CG2-CZ 3.86Å; P80-F88 HydrophobicContact CB-CE2 4.35Å; E84-F88 HydrophobicContact CB-CE2 4.35Å; E84-F88 WeakPolarHBondContact O-CD2 3.23Å; E84-F88 PolarHBondContact O-N 3.3Å; T85-F88 PolarHBondContact O-N 3.1Å; T85-F88 VanDerWaalsContact O-N 3.12Å; Q86-F88 PolarHBondContact O-N 3.5Å; F88-E90 VanDerWaalsContact C-N 3.34Å; F88-E90 PolarHBondContact O-N 3.28Å; F88-Q91 WeakPolarHBondContact O-CB 3.39Å; F88-Q91 PolarHBondContact O-N 3.43Å; F88-V92 PolarHBondContact O-N 3.03Å
89C96.4Very high95.8Very high15 Ų1552.8 Ų52.810%0.10128%0.275CS..Hα-helixtrans-60.4-43.9176.1-67.70000111.9L24 T85 Q86 Q91 V92 H93L24-C89 HydrophobicContact CD2-CB 3.92Å; T85-C89 PolarHBondContact O-N 3.16Å; T85-C89 PolarHBondContact O-SG 3.07Å; T85-C89 VanDerWaalsContact O-SG 3.35Å; Q86-C89 WeakPolarHBondContact O-CB 3.44Å; Q86-C89 PolarHBondContact O-N 3.01Å; C89-Q91 VanDerWaalsContact C-N 3.33Å; C89-Q91 PolarHBondContact O-N 3.33Å; C89-V92 PolarHBondContact O-N 3.38Å; C89-H93 WeakPolarHBondContact O-CB 3.37Å; C89-H93 PolarHBondContact O-N 3.27Å
90E96.6Very high96.2Very high108 Ų10850.6 Ų50.651%0.50526%0.263SS..Hα-helixtrans-61.5-40.2175.9-73.3170.9-172.800112.1Q86 K87 F88 H93 A94Q86-E90 PolarHBondContact NE2-OE1 3.25Å; Q86-E90 WeakPolarHBondContact O-CG 3.39Å; Q86-E90 PolarHBondContact O-N 3.41Å; K87-E90 PolarHBondContact O-N 2.88Å; F88-E90 VanDerWaalsContact C-N 3.34Å; F88-E90 PolarHBondContact O-N 3.28Å; E90-H93 PolarHBondContact O-N 3.42Å; E90-A94 VanDerWaalsContact O-CB 3.24Å; E90-A94 WeakPolarHBondContact O-CB 3.41Å; E90-A94 PolarHBondContact O-N 2.94Å
91Q97.6Very high96.4Very high71 Ų7152.3 Ų52.333%0.33228%0.279SS..Hα-helixtrans-63.9-46.5177-74.2169.9-2400112.2K87 F88 C89 A94 A95K87-Q91 VanDerWaalsContact O-CG 3.26Å; K87-Q91 WeakPolarHBondContact O-CG 3.32Å; K87-Q91 PolarHBondContact O-N 2.92Å; F88-Q91 WeakPolarHBondContact O-CB 3.39Å; F88-Q91 PolarHBondContact O-N 3.43Å; C89-Q91 VanDerWaalsContact C-N 3.33Å; C89-Q91 PolarHBondContact O-N 3.33Å; Q91-A94 PolarHBondContact O-N 3Å; Q91-A95 WeakPolarHBondContact O-CB 3.43Å; Q91-A95 PolarHBondContact O-N 2.89Å
92V97.8Very high96.5Very high1 Ų151.4 Ų51.41%0.00627%0.272CS..Hα-helixtrans-60.8-48.9175.2169.50000110.8L24 L28 E66 L70 F88 C89 A94 A95 I96 M129L24-V92 HydrophobicContact CD2-CB 4.05Å; L24-V92 HydrophobicContact CD2-CG1 3.97Å; L28-V92 HydrophobicContact CD1-CG1 4.25Å; E66-V92 HydrophobicContact CB-CG2 4Å; L70-V92 HydrophobicContact CD1-CG2 3.43Å; L70-V92 VanDerWaalsContact CD1-CG2 3.43Å; L70-V92 HydrophobicContact CG-CG2 4.24Å; F88-V92 PolarHBondContact O-N 3.03Å; C89-V92 PolarHBondContact O-N 3.38Å; V92-A94 VanDerWaalsContact C-N 3.28Å; V92-A94 PolarHBondContact O-N 3.21Å; V92-A95 PolarHBondContact O-N 3.49Å; V92-I96 HydrophobicContact CG1-CG1 4.37Å; V92-I96 WeakPolarHBondContact O-CG1 3.45Å; V92-I96 PolarHBondContact O-N 2.96Å; V92-M129 HydrophobicContact CG1-CE 4.17Å; V92-M129 HydrophobicContact CG1-CG 3.72Å; V92-M129 HydrophobicContact CG1-SD 3.88Å
93H96.8Very high96.6Very high30 Ų3049.1 Ų49.114%0.13926%0.257CS..Hα-helixtrans-60.7-41.3-179.2-162121.2000110.9L24 E27 C89 E90 K97L24-H93 HydrophobicContact CD1-CB 4.09Å; E27-H93 IonicContact OE2-CE1 2.63Å; E27-H93 PolarHBondContact OE2-CE1 2.79Å; E27-H93 IonicContact OE2-ND1 2.95Å; E27-H93 PolarHBondContact OE2-ND1 3.4Å; C89-H93 WeakPolarHBondContact O-CB 3.37Å; C89-H93 PolarHBondContact O-N 3.27Å; E90-H93 PolarHBondContact O-N 3.42Å; H93-K97 VanDerWaalsContact CD2-CE 3.45Å; H93-K97 WeakPolarHBondContact CD2-CE 3.45Å; H93-K97 PolarHBondContact CD2-NZ 3.16Å; H93-K97 VanDerWaalsContact CD2-NZ 3.32Å; H93-K97 WeakPolarHBondContact NE2-CE 3.49Å; H93-K97 PolarHBondContact NE2-NZ 3.45Å; H93-K97 WeakPolarHBondContact O-CB 3.43Å; H93-K97 WeakPolarHBondContact O-CG 3.24Å; H93-K97 PolarHBondContact O-N 3.15Å
94A97.8Very high96.7Very high58 Ų5845 Ų4548%0.47924%0.236SC..Hα-helixtrans-64.3-43.9175.400000112.4E90 Q91 V92 K97 A98E90-A94 VanDerWaalsContact O-CB 3.24Å; E90-A94 WeakPolarHBondContact O-CB 3.41Å; E90-A94 PolarHBondContact O-N 2.94Å; Q91-A94 PolarHBondContact O-N 3Å; V92-A94 VanDerWaalsContact C-N 3.28Å; V92-A94 PolarHBondContact O-N 3.21Å; A94-K97 PolarHBondContact O-N 2.86Å; A94-A98 WeakPolarHBondContact O-CB 3.48Å; A94-A98 PolarHBondContact O-N 3.36Å
95A98.3Very high96.7Very high8 Ų842.5 Ų42.57%0.06623%0.226CC..Hα-helixtrans-61.7-45.5177.500000111.8T62 V63 E66 Q91 V92 A98 F99T62-A95 HydrophobicContact CG2-CB 4.03Å; V63-A95 HydrophobicContact CG2-CB 4.12Å; E66-A95 HydrophobicContact CG-CB 3.93Å; Q91-A95 WeakPolarHBondContact O-CB 3.43Å; Q91-A95 PolarHBondContact O-N 2.89Å; V92-A95 PolarHBondContact O-N 3.49Å; A95-A98 PolarHBondContact O-N 3.39Å; A95-F99 WeakPolarHBondContact O-CB 3.27Å; A95-F99 PolarHBondContact O-N 3.36Å
96I98.2Very high96.7Very high0 Ų042.6 Ų42.60%023%0.226CC..Hα-helixtrans-64.3-45.3177-67.3-66000111.3L28 L31 V63 V92 A98 F99 I100 I125 V126 M129L28-I96 HydrophobicContact CD2-CB 4.09Å; L28-I96 HydrophobicContact CD2-CG1 3.99Å; L28-I96 HydrophobicContact CD2-CG2 3.94Å; L31-I96 HydrophobicContact CD1-CG2 3.89Å; V63-I96 HydrophobicContact CG1-CD1 3.77Å; V63-I96 HydrophobicContact CG2-CD1 4.04Å; V92-I96 HydrophobicContact CG1-CG1 4.37Å; V92-I96 WeakPolarHBondContact O-CG1 3.45Å; V92-I96 PolarHBondContact O-N 2.96Å; I96-A98 VanDerWaalsContact C-N 3.33Å; I96-A98 PolarHBondContact O-N 3.24Å; I96-F99 PolarHBondContact O-N 2.86Å; I96-I100 HydrophobicContact CG2-CD1 3.73Å; I96-I100 HydrophobicContact CG2-CG1 4.37Å; I96-I100 WeakPolarHBondContact O-CG1 3.49Å; I96-I100 PolarHBondContact O-N 2.81Å; I96-I125 HydrophobicContact CD1-CG2 4.23Å; I96-V126 HydrophobicContact CG2-CG2 3.91Å; I96-M129 HydrophobicContact CD1-CB 4.01Å; I96-M129 HydrophobicContact CD1-CG 4.14Å; I96-M129 HydrophobicContact CG1-CG 4.27Å
97K96.8Very high96.6Very high120 Ų12040.3 Ų40.352%0.52222%0.217SC..Hα-helixtrans-60.1-43.1175.9-83.7-176.6169.9148.90112.1H93 A94 F99 I100 A101H93-K97 VanDerWaalsContact CD2-CE 3.45Å; H93-K97 WeakPolarHBondContact CD2-CE 3.45Å; H93-K97 PolarHBondContact CD2-NZ 3.16Å; H93-K97 VanDerWaalsContact CD2-NZ 3.32Å; H93-K97 WeakPolarHBondContact NE2-CE 3.49Å; H93-K97 PolarHBondContact NE2-NZ 3.45Å; H93-K97 WeakPolarHBondContact O-CB 3.43Å; H93-K97 WeakPolarHBondContact O-CG 3.24Å; H93-K97 PolarHBondContact O-N 3.15Å; A94-K97 PolarHBondContact O-N 2.86Å; K97-F99 VanDerWaalsContact C-N 3.34Å; K97-I100 PolarHBondContact O-N 2.98Å; K97-A101 VanDerWaalsContact O-CB 3.31Å; K97-A101 WeakPolarHBondContact O-CB 3.33Å; K97-A101 PolarHBondContact O-N 3.4Å
98A97.7Very high96.4Very high53 Ų5338.9 Ų38.944%0.43821%0.211SC..Hα-helixtrans-62.4-42.8176.900000111.3A94 A95 I96 A101 V102A94-A98 WeakPolarHBondContact O-CB 3.48Å; A94-A98 PolarHBondContact O-N 3.36Å; A95-A98 PolarHBondContact O-N 3.39Å; I96-A98 VanDerWaalsContact C-N 3.33Å; I96-A98 PolarHBondContact O-N 3.24Å; A98-A101 WeakPolarHBondContact O-CB 3.47Å; A98-A101 PolarHBondContact O-N 3.5Å; A98-V102 WeakPolarHBondContact O-CG2 3.2Å; A98-V102 PolarHBondContact O-N 3.46Å; A98-V102 VanDerWaalsContact O-N 3.09Å
99F97.8Very high96.2Very high0 Ų042 Ų420%023%0.229CC..Hα-helixtrans-61.2-49.4176.4-174.5-91.1000112.3L56 A59 A60 V63 A95 I96 K97 A101 V102 Y103 T122 I125 M162L56-F99 HydrophobicContact CD1-CD2 4.46Å; L56-F99 HydrophobicContact CD1-CE2 3.77Å; L56-F99 HydrophobicContact CD1-CZ 3.81Å; L56-F99 HydrophobicContact CG-CE2 4.3Å; L56-F99 HydrophobicContact CG-CZ 4.48Å; A59-F99 HydrophobicContact CB-CB 4.17Å; A59-F99 HydrophobicContact CB-CD2 3.61Å; A59-F99 HydrophobicContact CB-CE2 4.47Å; A59-F99 HydrophobicContact CB-CG 4.36Å; A60-F99 HydrophobicContact CB-CD2 4.35Å; A60-F99 HydrophobicContact CB-CE2 3.85Å; V63-F99 HydrophobicContact CG2-CB 4.09Å; V63-F99 HydrophobicContact CG2-CG 4.47Å; A95-F99 WeakPolarHBondContact O-CB 3.27Å; A95-F99 PolarHBondContact O-N 3.36Å; I96-F99 PolarHBondContact O-N 2.86Å; K97-F99 VanDerWaalsContact C-N 3.34Å; F99-A101 VanDerWaalsContact C-N 3.29Å; F99-A101 PolarHBondContact O-N 2.85Å; F99-V102 PolarHBondContact O-N 3.28Å; F99-V102 VanDerWaalsContact O-N 3.16Å; F99-Y103 PolarHBondContact O-N 2.8Å; F99-Y103 VanDerWaalsContact O-N 3.16Å; F99-T122 HydrophobicContact CD1-CG2 4.01Å; F99-T122 HydrophobicContact CE1-CG2 3.79Å; F99-I125 HydrophobicContact CE1-CD1 3.91Å; F99-I125 HydrophobicContact CE2-CD1 3.94Å; F99-I125 HydrophobicContact CZ-CD1 3.49Å; F99-I125 VanDerWaalsContact CZ-CD1 3.49Å; F99-M162 HydrophobicContact CE2-CE 4.11Å; F99-M162 HydrophobicContact CZ-CE 3.75Å; F99-M162 HydrophobicContact CZ-SD 3.97Å
100I97.3Very high96.1Very high15 Ų1543.6 Ų43.68%0.07724%0.235CC..Hα-helixtrans-60.1-40.5176.1-67.8168.2000111.1L31 V35 I96 K97 V102 Y103 Y104 T122 V126L31-I100 HydrophobicContact CB-CD1 4.26Å; L31-I100 HydrophobicContact CD1-CD1 3.93Å; V35-I100 HydrophobicContact CG2-CD1 3.84Å; V35-I100 HydrophobicContact CG2-CG1 4.02Å; V35-I100 HydrophobicContact CG2-CG2 3.92Å; I96-I100 HydrophobicContact CG2-CD1 3.73Å; I96-I100 HydrophobicContact CG2-CG1 4.37Å; I96-I100 WeakPolarHBondContact O-CG1 3.49Å; I96-I100 PolarHBondContact O-N 2.81Å; K97-I100 PolarHBondContact O-N 2.98Å; I100-V102 VanDerWaalsContact C-N 3.3Å; I100-V102 PolarHBondContact O-N 2.67Å; I100-Y103 WeakPolarHBondContact O-CB 3.46Å; I100-Y103 PolarHBondContact O-N 2.89Å; I100-Y103 VanDerWaalsContact O-N 3.16Å; I100-Y104 HydrophobicContact CG2-CD2 3.81Å; I100-Y104 HydrophobicContact CG2-CE2 3.35Å; I100-Y104 WeakPolarHBondContact O-CD2 3.37Å; I100-Y104 PolarHBondContact O-N 3.42Å; I100-Y104 VanDerWaalsContact O-N 3.08Å; I100-T122 HydrophobicContact CG1-CG2 4.07Å; I100-V126 HydrophobicContact CD1-CG2 3.91Å; I100-V126 HydrophobicContact CG1-CG2 4.11Å
101A96.1Very high96.1Very high49 Ų4938.4 Ų38.441%0.40521%0.211SC..Hα-helixtrans-60.8-40.2177.800000111.6K97 A98 F99 Y104 L105K97-A101 VanDerWaalsContact O-CB 3.31Å; K97-A101 WeakPolarHBondContact O-CB 3.33Å; K97-A101 PolarHBondContact O-N 3.4Å; A98-A101 WeakPolarHBondContact O-CB 3.47Å; A98-A101 PolarHBondContact O-N 3.5Å; F99-A101 VanDerWaalsContact C-N 3.29Å; F99-A101 PolarHBondContact O-N 2.85Å; A101-Y104 PolarHBondContact O-N 3.32Å; A101-L105 PolarHBondContact O-N 2.88Å
102V96.5Very high96Very high18 Ų1839.4 Ų39.411%0.10922%0.218CC..Hα-helixtrans-63.5-42.2174.5-179.50000111.1F52 R55 L56 A59 A98 F99 I100 Y104 L105F52-V102 HydrophobicContact CD2-CG1 4.36Å; F52-V102 HydrophobicContact CE2-CG1 4.24Å; F52-V102 WeakPolarHBondContact CE2-O 3.28Å; R55-V102 HydrophobicContact CB-CG1 4.02Å; R55-V102 HydrophobicContact CB-CG2 4.24Å; L56-V102 HydrophobicContact CB-CG1 3.86Å; L56-V102 HydrophobicContact CD1-CB 4.23Å; L56-V102 HydrophobicContact CD1-CG1 3.85Å; L56-V102 HydrophobicContact CG-CG1 4.47Å; A59-V102 HydrophobicContact CB-CG2 4.44Å; A98-V102 WeakPolarHBondContact O-CG2 3.2Å; A98-V102 PolarHBondContact O-N 3.46Å; A98-V102 VanDerWaalsContact O-N 3.09Å; F99-V102 PolarHBondContact O-N 3.28Å; F99-V102 VanDerWaalsContact O-N 3.16Å; I100-V102 VanDerWaalsContact C-N 3.3Å; I100-V102 PolarHBondContact O-N 2.67Å; V102-Y104 VanDerWaalsContact C-N 3.28Å; V102-Y104 PolarHBondContact O-N 3.03Å; V102-L105 VanDerWaalsContact O-CB 3.3Å; V102-L105 WeakPolarHBondContact O-CB 3.23Å; V102-L105 PolarHBondContact O-N 3.45Å
103Y96.1Very high96Very high0 Ų039.5 Ų39.50%022%0.218CC..Hα-helixtrans-55.6-42.3174.3153.1-110.9000112.3V35 F99 I100 L105 L106 R115 V118 R119 T122V35-Y103 HydrophobicContact CG1-CD1 4.3Å; V35-Y103 HydrophobicContact CG1-CE1 3.96Å; F99-Y103 PolarHBondContact O-N 2.8Å; F99-Y103 VanDerWaalsContact O-N 3.16Å; I100-Y103 WeakPolarHBondContact O-CB 3.46Å; I100-Y103 PolarHBondContact O-N 2.89Å; I100-Y103 VanDerWaalsContact O-N 3.16Å; Y103-L105 PolarHBondContact O-N 3.5Å; Y103-L106 WeakPolarHBondContact O-CB 3.36Å; Y103-L106 PolarHBondContact O-N 3.45Å; Y103-R115 HydrophobicContact CE2-CG 4.29Å; Y103-R115 PolarHBondContact OH-NH1 3.01Å; Y103-R115 PolarHBondContact OH-NH2 3.43Å; Y103-V118 HydrophobicContact CD2-CG1 3.98Å; Y103-R119 HydrophobicContact CE2-CB 3.68Å; Y103-R119 HydrophobicContact CE2-CG 4.29Å; Y103-R119 WeakPolarHBondContact OH-CD 3.37Å; Y103-R119 WeakPolarHBondContact OH-CG 3.38Å; Y103-T122 HydrophobicContact CD1-CG2 4.32Å; Y103-T122 HydrophobicContact CG-CG2 4.36Å
104Y95.8Very high96Very high53 Ų5338.2 Ų38.221%0.20821%0.213CC..Hα-helixtrans-66.3-15.3178.8-72.6-48000114.7R34 V35 E39 Q41 I100 A101 V102 L106R34-Y104 PolarHBondContact O-OH 3.13Å; V35-Y104 WeakPolarHBondContact CA-OH 3.42Å; E39-Y104 WeakPolarHBondContact O-CD1 3.3Å; Q41-Y104 WeakPolarHBondContact CB-O 3.36Å; Q41-Y104 PolarHBondContact N-O 3.18Å; I100-Y104 HydrophobicContact CG2-CD2 3.81Å; I100-Y104 HydrophobicContact CG2-CE2 3.35Å; I100-Y104 WeakPolarHBondContact O-CD2 3.37Å; I100-Y104 PolarHBondContact O-N 3.42Å; I100-Y104 VanDerWaalsContact O-N 3.08Å; A101-Y104 PolarHBondContact O-N 3.32Å; V102-Y104 VanDerWaalsContact C-N 3.28Å; V102-Y104 PolarHBondContact O-N 3.03Å; Y104-L106 PolarHBondContact O-N 2.94Å
105L95.1Very high96Very high55 Ų5536.2 Ų36.229%0.28819%0.193SC..THydrogen-bonded Turntrans-76-8.9171.5-57.1176.7000113.2F52 A101 V102 Y103 P107F52-L105 HydrophobicContact CD2-CB 4.41Å; A101-L105 PolarHBondContact O-N 2.88Å; V102-L105 VanDerWaalsContact O-CB 3.3Å; V102-L105 WeakPolarHBondContact O-CB 3.23Å; V102-L105 PolarHBondContact O-N 3.45Å; Y103-L105 PolarHBondContact O-N 3.5Å; L105-P107 VanDerWaalsContact O-CD 3.25Å; L105-P107 WeakPolarHBondContact O-CD 3.46Å
106L95.1Very high95.8Very high2 Ų238.7 Ų38.71%0.0120%0.202CC..SBendtrans-78.8110.7176-174.262.9000110.1F47 F52 Y103 Y104 Q110 R115 V118F47-L106 HydrophobicContact CE2-CD1 4.33Å; F47-L106 HydrophobicContact CZ-CD1 3.88Å; F52-L106 HydrophobicContact CD1-CD1 4.46Å; F52-L106 HydrophobicContact CE1-CD1 4Å; F52-L106 HydrophobicContact CE2-CB 3.7Å; F52-L106 HydrophobicContact CE2-CD1 4.33Å; F52-L106 HydrophobicContact CZ-CB 3.74Å; F52-L106 HydrophobicContact CZ-CD1 3.94Å; F52-L106 HydrophobicContact CZ-CD2 4.17Å; F52-L106 HydrophobicContact CZ-CG 4.17Å; Y103-L106 WeakPolarHBondContact O-CB 3.36Å; Y103-L106 PolarHBondContact O-N 3.45Å; Y104-L106 PolarHBondContact O-N 2.94Å; L106-Q110 HydrophobicContact CD1-CB 4.03Å; L106-Q110 HydrophobicContact CD1-CG 4.07Å; L106-R115 HydrophobicContact CD2-CB 4.13Å; L106-R115 HydrophobicContact CD2-CG 4.16Å; L106-R115 PolarHBondContact O-NE 3.45Å; L106-V118 HydrophobicContact CD2-CB 3.91Å; L106-V118 HydrophobicContact CD2-CG1 4.21Å; L106-V118 HydrophobicContact CD2-CG2 3.83Å
107P93.6Very high95.8Very high20 Ų2039.9 Ų39.913%0.1321%0.208CC..  trans-75.2155.6-179.114-1.6000111.1F47 L105 D109 Q110F47-P107 HydrophobicContact CB-CG 4.01Å; F47-P107 VanDerWaalsContact CD2-CD 3.48Å; F47-P107 HydrophobicContact CD2-CG 3.69Å; F47-P107 HydrophobicContact CE2-CG 4.29Å; F47-P107 HydrophobicContact CG-CG 3.84Å; L105-P107 VanDerWaalsContact O-CD 3.25Å; L105-P107 WeakPolarHBondContact O-CD 3.46Å; P107-D109 VanDerWaalsContact CB-OD1 3.25Å; P107-D109 WeakPolarHBondContact CB-OD1 3.38Å; P107-D109 VanDerWaalsContact CG-OD1 3.28Å; P107-D109 WeakPolarHBondContact CG-OD1 3.22Å; P107-D109 PolarHBondContact O-N 3.19Å; P107-Q110 HydrophobicContact CG-CG 4.02Å; P107-Q110 PolarHBondContact O-N 3.44Å
108K91.7Very high95.8Very high100 Ų10034.2 Ų34.244%0.43518%0.183SC..G310 helixtrans-65.9-24.3176.9-69-176.6177.7175.50112.5E39 A40 Q110 G111E39-K108 IonicContact OE1-NZ 2.78Å; E39-K108 PolarHBondContact OE1-NZ 2.77Å; E39-K108 WeakPolarHBondContact OE2-CE 3.17Å; E39-K108 IonicContact OE2-NZ 3.91Å; E39-K108 PolarHBondContact OE2-NZ 2.96Å; A40-K108 HydrophobicContact CB-CG 4.42Å; K108-Q110 PolarHBondContact O-N 3.5Å; K108-G111 PolarHBondContact O-N 3.13Å
109D91.6Very high95.8Very high105 Ų10534.9 Ų34.956%0.56118%0.175SC*.G310 helixtrans-66.1-19.2179.572.2-4000113.7P107 G111P107-D109 VanDerWaalsContact CB-OD1 3.25Å; P107-D109 WeakPolarHBondContact CB-OD1 3.38Å; P107-D109 VanDerWaalsContact CG-OD1 3.28Å; P107-D109 WeakPolarHBondContact CG-OD1 3.22Å; P107-D109 PolarHBondContact O-N 3.19Å; D109-G111 PolarHBondContact O-N 3.06Å
110Q94.5Very high95.7Very high49 Ų4936.1 Ų36.123%0.22919%0.187CC..G310 helixtrans-78-6.8173.9-60-55-67.500112.5F47 L106 P107 K108 L114 N169F47-Q110 VanDerWaalsContact CD1-CD 3.44Å; F47-Q110 HydrophobicContact CD1-CG 3.76Å; F47-Q110 HydrophobicContact CE1-CG 3.62Å; F47-Q110 HydrophobicContact CG-CG 4.42Å; F47-Q110 HydrophobicContact CZ-CG 4.19Å; L106-Q110 HydrophobicContact CD1-CB 4.03Å; L106-Q110 HydrophobicContact CD1-CG 4.07Å; P107-Q110 HydrophobicContact CG-CG 4.02Å; P107-Q110 PolarHBondContact O-N 3.44Å; K108-Q110 PolarHBondContact O-N 3.5Å; Q110-L114 HydrophobicContact CB-CD2 4.18Å; Q110-N169 WeakPolarHBondContact O-CB 3.27Å
111G95.4Very high95.7Very high0 Ų035.9 Ų35.90%019%0.187CC..  trans117.1133.8176.600000113.9K108 D109 T113 R115 N169K108-G111 PolarHBondContact O-N 3.13Å; D109-G111 PolarHBondContact O-N 3.06Å; G111-T113 VanDerWaalsContact C-N 3.33Å; G111-R115 WeakPolarHBondContact O-CB 3.41Å; G111-R115 PolarHBondContact O-N 3.48Å; G111-N169 WeakPolarHBondContact CA-OD1 3.45Å
112I95.9Very high95.8Very high92 Ų9233.5 Ų33.547%0.47217%0.168SC..Hα-helixtrans-65.7-41178.2-60172.9000109.3R115 K116 D275I112-R115 PolarHBondContact O-N 2.83Å; I112-K116 HydrophobicContact CG2-CD 4.46Å; I112-K116 HydrophobicContact CG2-CG 4.42Å; I112-K116 WeakPolarHBondContact O-CB 3.44Å; I112-K116 WeakPolarHBondContact O-CG 3.44Å; I112-K116 PolarHBondContact O-N 3.22Å; I112-D275 WeakPolarHBondContact CB-OD2 3.48Å; I112-D275 PolarHBondContact N-OD1 3.41Å; I112-D275 PolarHBondContact N-OD2 3.46Å
113T97.6Very high95.8Very high3 Ų333.8 Ų33.82%0.01817%0.169CC..Hα-helixtrans-63.3-48.3178.4-54.40000111.5G111 R115 K116 L117 N169 A172 M176 D275 V278G111-T113 VanDerWaalsContact C-N 3.33Å; T113-R115 VanDerWaalsContact C-N 3.33Å; T113-R115 PolarHBondContact O-N 3.33Å; T113-K116 WeakPolarHBondContact O-CB 3.44Å; T113-K116 PolarHBondContact O-N 3.14Å; T113-L117 PolarHBondContact O-N 3.26Å; T113-L117 VanDerWaalsContact O-N 3.13Å; T113-N169 WeakPolarHBondContact CB-OD1 3.44Å; T113-A172 HydrophobicContact CG2-CB 3.99Å; T113-M176 HydrophobicContact CG2-CB 4.39Å; T113-D275 VanDerWaalsContact CB-OD1 3.27Å; T113-D275 WeakPolarHBondContact CB-OD1 3.46Å; T113-D275 PolarHBondContact N-OD1 2.82Å; T113-D275 PolarHBondContact OG1-OD1 2.76Å; T113-V278 HydrophobicContact CG2-CB 4.48Å; T113-V278 HydrophobicContact CG2-CG1 3.9Å; T113-V278 HydrophobicContact CG2-CG2 4.27Å
114L97.4Very high95.9Very high3 Ų338.6 Ų38.62%0.01619%0.194CC..Hα-helixtrans-57.4-47.3174.4176.561.7000111.3W53 Q110 K116 L117 V118 P166 N169 A172W53-L114 HydrophobicContact CH2-CD1 4.2Å; W53-L114 HydrophobicContact CZ2-CD1 4.1Å; W53-L114 HydrophobicContact CZ2-CD2 4.45Å; Q110-L114 HydrophobicContact CB-CD2 4.18Å; L114-K116 VanDerWaalsContact C-N 3.35Å; L114-K116 PolarHBondContact O-N 2.94Å; L114-L117 PolarHBondContact O-N 2.74Å; L114-V118 HydrophobicContact CD1-CG2 4.31Å; L114-V118 WeakPolarHBondContact O-CG2 3.42Å; L114-V118 PolarHBondContact O-N 3.28Å; L114-P166 HydrophobicContact CD1-CB 4.48Å; L114-P166 WeakPolarHBondContact CD1-O 3.43Å; L114-N169 WeakPolarHBondContact CB-OD1 3.42Å; L114-N169 PolarHBondContact N-OD1 3.08Å; L114-A172 HydrophobicContact CB-CB 4.02Å; L114-A172 HydrophobicContact CD1-CB 4.29Å
115R96.3Very high96Very high16 Ų1636 Ų366%0.0618%0.184CC..Hα-helixtrans-64.3-38.1179.6-168.6173.6-171.5-82-2112.3G38 E39 A40 Y103 L106 G111 I112 T113 L117 V118 R119G38-R115 PolarHBondContact O-NH1 2.95Å; G38-R115 PolarHBondContact O-NH2 3.41Å; E39-R115 VanDerWaalsContact C-NH2 3.27Å; A40-R115 VanDerWaalsContact N-NH2 3.11Å; Y103-R115 HydrophobicContact CE2-CG 4.29Å; Y103-R115 PolarHBondContact OH-NH1 3.01Å; Y103-R115 PolarHBondContact OH-NH2 3.43Å; L106-R115 HydrophobicContact CD2-CB 4.13Å; L106-R115 HydrophobicContact CD2-CG 4.16Å; L106-R115 PolarHBondContact O-NE 3.45Å; G111-R115 WeakPolarHBondContact O-CB 3.41Å; G111-R115 PolarHBondContact O-N 3.48Å; I112-R115 PolarHBondContact O-N 2.83Å; T113-R115 VanDerWaalsContact C-N 3.33Å; T113-R115 PolarHBondContact O-N 3.33Å; R115-L117 VanDerWaalsContact C-N 3.31Å; R115-L117 PolarHBondContact O-N 3.5Å; R115-V118 PolarHBondContact O-N 3.47Å; R115-R119 WeakPolarHBondContact O-CB 3.45Å; R115-R119 PolarHBondContact O-N 3.35Å
116K95.9Very high96.1Very high60 Ų6033.4 Ų33.426%0.26117%0.171SC..Hα-helixtrans-55.9-45.9172.6-80.6176174.1179.50110.4I112 T113 L114 R119 G120 E282I112-K116 HydrophobicContact CG2-CD 4.46Å; I112-K116 HydrophobicContact CG2-CG 4.42Å; I112-K116 WeakPolarHBondContact O-CB 3.44Å; I112-K116 WeakPolarHBondContact O-CG 3.44Å; I112-K116 PolarHBondContact O-N 3.22Å; T113-K116 WeakPolarHBondContact O-CB 3.44Å; T113-K116 PolarHBondContact O-N 3.14Å; L114-K116 VanDerWaalsContact C-N 3.35Å; L114-K116 PolarHBondContact O-N 2.94Å; K116-R119 PolarHBondContact O-N 3.35Å; K116-G120 PolarHBondContact O-N 3.29Å; K116-E282 IonicContact NZ-OE2 3.38Å; K116-E282 PolarHBondContact NZ-OE2 3.02Å
117L97Very high96.1Very high25 Ų2535.7 Ų35.713%0.13118%0.183CC..Hα-helixtrans-67.2-46.2179.7-67.4176.5000113T113 L114 R115 R119 G120 A121 P166 A172 L175 M176T113-L117 PolarHBondContact O-N 3.26Å; T113-L117 VanDerWaalsContact O-N 3.13Å; L114-L117 PolarHBondContact O-N 2.74Å; R115-L117 VanDerWaalsContact C-N 3.31Å; R115-L117 PolarHBondContact O-N 3.5Å; L117-R119 VanDerWaalsContact C-N 3.3Å; L117-R119 PolarHBondContact O-N 3.13Å; L117-G120 PolarHBondContact O-N 2.91Å; L117-A121 PolarHBondContact O-N 3.35Å; L117-P166 HydrophobicContact CD1-CG 3.94Å; L117-A172 HydrophobicContact CD1-CB 3.67Å; L117-L175 HydrophobicContact CD1-CD2 3.96Å; L117-L175 HydrophobicContact CD2-CD2 4.39Å; L117-M176 HydrophobicContact CD2-CE 3.87Å
118V97.3Very high96.2Very high0 Ų034.8 Ų34.80%018%0.177CC..Hα-helixtrans-64.4-38.8177.8178.70000110.9F52 W53 L56 Y103 L106 L114 R115 A121 T122 I165F52-V118 HydrophobicContact CZ-CG1 4.42Å; W53-V118 HydrophobicContact CH2-CG2 3.65Å; W53-V118 HydrophobicContact CZ3-CG2 4.26Å; L56-V118 HydrophobicContact CD2-CG1 4.08Å; Y103-V118 HydrophobicContact CD2-CG1 3.98Å; L106-V118 HydrophobicContact CD2-CB 3.91Å; L106-V118 HydrophobicContact CD2-CG1 4.21Å; L106-V118 HydrophobicContact CD2-CG2 3.83Å; L114-V118 HydrophobicContact CD1-CG2 4.31Å; L114-V118 WeakPolarHBondContact O-CG2 3.42Å; L114-V118 PolarHBondContact O-N 3.28Å; R115-V118 PolarHBondContact O-N 3.47Å; V118-A121 PolarHBondContact O-N 3.01Å; V118-T122 WeakPolarHBondContact O-CB 3.48Å; V118-T122 PolarHBondContact O-N 3.03Å; V118-T122 PolarHBondContact O-OG1 3.39Å; V118-I165 HydrophobicContact CG2-CG2 4.06Å
119R97.2Very high96.5Very high68 Ų6830 Ų3026%0.25716%0.156SC..Hα-helixtrans-61-44.9172.7-179.2176.560.3-170-7.4111.4V35 R36 Y103 R115 K116 L117 T122 L123V35-R119 HydrophobicContact CG1-CG 4.37Å; R36-R119 PolarHBondContact O-NH1 3.36Å; Y103-R119 HydrophobicContact CE2-CB 3.68Å; Y103-R119 HydrophobicContact CE2-CG 4.29Å; Y103-R119 WeakPolarHBondContact OH-CD 3.37Å; Y103-R119 WeakPolarHBondContact OH-CG 3.38Å; R115-R119 WeakPolarHBondContact O-CB 3.45Å; R115-R119 PolarHBondContact O-N 3.35Å; K116-R119 PolarHBondContact O-N 3.35Å; L117-R119 VanDerWaalsContact C-N 3.3Å; L117-R119 PolarHBondContact O-N 3.13Å; R119-T122 WeakPolarHBondContact O-CB 3.33Å; R119-T122 PolarHBondContact O-N 2.95Å; R119-L123 HydrophobicContact CG-CD1 4.23Å; R119-L123 WeakPolarHBondContact O-CG 3.01Å; R119-L123 PolarHBondContact O-N 3.09Å
120G96.6Very high96.7Very high25 Ų2525 Ų2526%0.25813%0.129SC..Hα-helixtrans-55.7-55.1176.100000111.6K116 L117 T122 L123 D124K116-G120 PolarHBondContact O-N 3.29Å; L117-G120 PolarHBondContact O-N 2.91Å; G120-T122 PolarHBondContact O-N 3.44Å; G120-L123 WeakPolarHBondContact O-CA 3.43Å; G120-L123 WeakPolarHBondContact O-CB 3.36Å; G120-L123 PolarHBondContact O-N 3.49Å; G120-D124 VanDerWaalsContact O-CG 3.28Å; G120-D124 PolarHBondContact O-N 3.4Å
121A97.1Very high96.7Very high10 Ų1025.4 Ų25.48%0.08313%0.131CC..Hα-helixtrans-60.4-31.8177.600000113.4L117 V118 D124 I125 M162 I165L117-A121 PolarHBondContact O-N 3.35Å; V118-A121 PolarHBondContact O-N 3.01Å; A121-D124 PolarHBondContact O-N 2.96Å; A121-I125 WeakPolarHBondContact O-CG1 3.44Å; A121-I125 PolarHBondContact O-N 2.73Å; A121-M162 HydrophobicContact CB-SD 3.86Å; A121-I165 HydrophobicContact CB-CD1 3.27Å; A121-I165 HydrophobicContact CB-CG1 4.39Å
122T97.8Very high96.6Very high0 Ų025.4 Ų25.40%013%0.131CC..Hα-helixtrans-66.4-43.3173.8-57.30000112V35 F99 I100 Y103 V118 R119 G120 D124 I125 V126V35-T122 HydrophobicContact CG1-CG2 3.88Å; F99-T122 HydrophobicContact CD1-CG2 4.01Å; F99-T122 HydrophobicContact CE1-CG2 3.79Å; I100-T122 HydrophobicContact CG1-CG2 4.07Å; Y103-T122 HydrophobicContact CD1-CG2 4.32Å; Y103-T122 HydrophobicContact CG-CG2 4.36Å; V118-T122 WeakPolarHBondContact O-CB 3.48Å; V118-T122 PolarHBondContact O-N 3.03Å; V118-T122 PolarHBondContact O-OG1 3.39Å; R119-T122 WeakPolarHBondContact O-CB 3.33Å; R119-T122 PolarHBondContact O-N 2.95Å; G120-T122 PolarHBondContact O-N 3.44Å; T122-D124 VanDerWaalsContact C-N 3.34Å; T122-I125 PolarHBondContact O-N 3.26Å; T122-V126 VanDerWaalsContact O-CG2 3.23Å; T122-V126 WeakPolarHBondContact O-CG2 3.31Å; T122-V126 PolarHBondContact O-N 3.15Å; T122-V126 VanDerWaalsContact O-N 3.13Å
123L97.5Very high96.4Very high24 Ų2421 Ų2113%0.12611%0.109CC..Hα-helixtrans-62.8-42.9174.4-67.5166.6000110.9L32 V35 R119 G120 I125 V126 D127L32-L123 HydrophobicContact CB-CD2 4.29Å; L32-L123 HydrophobicContact CD2-CB 4.49Å; L32-L123 HydrophobicContact CD2-CD2 3.87Å; L32-L123 WeakPolarHBondContact O-CD2 3.3Å; V35-L123 HydrophobicContact CB-CD2 3.75Å; V35-L123 HydrophobicContact CG1-CD2 3.69Å; V35-L123 HydrophobicContact CG1-CG 3.99Å; R119-L123 HydrophobicContact CG-CD1 4.23Å; R119-L123 WeakPolarHBondContact O-CG 3.01Å; R119-L123 PolarHBondContact O-N 3.09Å; G120-L123 WeakPolarHBondContact O-CA 3.43Å; G120-L123 WeakPolarHBondContact O-CB 3.36Å; G120-L123 PolarHBondContact O-N 3.49Å; L123-I125 VanDerWaalsContact C-N 3.34Å; L123-I125 PolarHBondContact O-N 2.98Å; L123-V126 PolarHBondContact O-N 3.46Å; L123-D127 WeakPolarHBondContact O-CB 3.47Å; L123-D127 PolarHBondContact O-N 3.48Å
124D96.8Very high96.1Very high100 Ų10024.8 Ų24.854%0.53513%0.126SC..Hα-helixtrans-61.4-40.4179.6-61.4-21.6000112.1G120 A121 T122 G128 A158G120-D124 VanDerWaalsContact O-CG 3.28Å; G120-D124 PolarHBondContact O-N 3.4Å; A121-D124 PolarHBondContact O-N 2.96Å; T122-D124 VanDerWaalsContact C-N 3.34Å; D124-G128 PolarHBondContact O-N 2.75Å; D124-A158 HydrophobicContact CB-CB 4.13Å
125I97.5Very high95.8Very high0 Ų025.9 Ų25.90%013%0.133CC..Hα-helixtrans-67.5-43.6176-72.3173.1000111.6A60 V63 I96 F99 A121 T122 L123 M129 A158 M162A60-I125 HydrophobicContact CB-CD1 4.49Å; V63-I125 HydrophobicContact CB-CG2 4.43Å; V63-I125 HydrophobicContact CG1-CG2 3.72Å; I96-I125 HydrophobicContact CD1-CG2 4.23Å; F99-I125 HydrophobicContact CE1-CD1 3.91Å; F99-I125 HydrophobicContact CE2-CD1 3.94Å; F99-I125 HydrophobicContact CZ-CD1 3.49Å; F99-I125 VanDerWaalsContact CZ-CD1 3.49Å; A121-I125 WeakPolarHBondContact O-CG1 3.44Å; A121-I125 PolarHBondContact O-N 2.73Å; T122-I125 PolarHBondContact O-N 3.26Å; L123-I125 VanDerWaalsContact C-N 3.34Å; L123-I125 PolarHBondContact O-N 2.98Å; I125-M129 WeakPolarHBondContact O-CB 3.24Å; I125-M129 PolarHBondContact O-N 3.31Å; I125-A158 HydrophobicContact CG1-CB 3.68Å; I125-M162 HydrophobicContact CD1-CG 3.81Å; I125-M162 HydrophobicContact CD1-SD 3.67Å
126V97.7Very high95.4Very high0 Ų025.9 Ų25.90%013%0.134CC..Hα-helixtrans-64.9-45.2179.5174.70000110.6L28 L31 L32 I96 I100 T122 L123 M129 A130L28-V126 WeakPolarHBondContact O-CG1 3.5Å; L31-V126 HydrophobicContact CB-CG1 4.34Å; L32-V126 HydrophobicContact CD2-CB 3.8Å; L32-V126 HydrophobicContact CD2-CG1 3.59Å; L32-V126 HydrophobicContact CG-CG1 4.16Å; I96-V126 HydrophobicContact CG2-CG2 3.91Å; I100-V126 HydrophobicContact CD1-CG2 3.91Å; I100-V126 HydrophobicContact CG1-CG2 4.11Å; T122-V126 VanDerWaalsContact O-CG2 3.23Å; T122-V126 WeakPolarHBondContact O-CG2 3.31Å; T122-V126 PolarHBondContact O-N 3.15Å; T122-V126 VanDerWaalsContact O-N 3.13Å; L123-V126 PolarHBondContact O-N 3.46Å; V126-M129 PolarHBondContact O-N 3Å; V126-A130 PolarHBondContact O-N 2.85Å
127D96.5Very high95Very high49 Ų4923.1 Ų23.126%0.26212%0.122SC..Hα-helixtrans-68-44.6179.2-169.664.8000111.5L32 L123 M129 A130 Q131L32-D127 HydrophobicContact CD1-CB 4.34Å; L32-D127 HydrophobicContact CD2-CB 4.16Å; L123-D127 WeakPolarHBondContact O-CB 3.47Å; L123-D127 PolarHBondContact O-N 3.48Å; D127-M129 VanDerWaalsContact C-N 3.3Å; D127-M129 PolarHBondContact O-N 3.34Å; D127-A130 WeakPolarHBondContact O-CA 3.11Å; D127-A130 WeakPolarHBondContact O-CB 3.48Å; D127-A130 PolarHBondContact O-N 3.07Å; D127-Q131 WeakPolarHBondContact O-CG 3.41Å; D127-Q131 PolarHBondContact O-N 3.35Å; D127-Q131 PolarHBondContact OD2-NE2 3.29Å
128G95.8Very high94.4Very high1 Ų125.4 Ų25.41%0.0113%0.134CC..Hα-helixtrans-59.4-39.8175.800000112.8D124 Q131 L132 S154D124-G128 PolarHBondContact O-N 2.75Å; G128-Q131 PolarHBondContact O-N 3.4Å; G128-L132 PolarHBondContact O-N 2.89Å; G128-S154 VanDerWaalsContact CA-OG 3.31Å; G128-S154 WeakPolarHBondContact CA-OG 3.29Å; G128-S154 PolarHBondContact O-OG 3.49Å
129M96.9Very high92.8Very high0 Ų028 Ų280%015%0.149CC..Hα-helixtrans-65.3-41173.7-176.462.282.900111.7L28 V63 A67 V92 I96 I125 V126 D127 L132 M133 V155L28-M129 HydrophobicContact CD1-CB 4.21Å; L28-M129 HydrophobicContact CD1-CG 3.63Å; V63-M129 HydrophobicContact CG1-CE 3.55Å; V63-M129 WeakPolarHBondContact O-CE 3.19Å; A67-M129 HydrophobicContact CB-CE 3.84Å; A67-M129 HydrophobicContact CB-SD 4.39Å; V92-M129 HydrophobicContact CG1-CE 4.17Å; V92-M129 HydrophobicContact CG1-CG 3.72Å; V92-M129 HydrophobicContact CG1-SD 3.88Å; I96-M129 HydrophobicContact CD1-CB 4.01Å; I96-M129 HydrophobicContact CD1-CG 4.14Å; I96-M129 HydrophobicContact CG1-CG 4.27Å; I125-M129 WeakPolarHBondContact O-CB 3.24Å; I125-M129 PolarHBondContact O-N 3.31Å; V126-M129 PolarHBondContact O-N 3Å; D127-M129 VanDerWaalsContact C-N 3.3Å; D127-M129 PolarHBondContact O-N 3.34Å; M129-L132 PolarHBondContact O-N 3.46Å; M129-L132 HydrophobicContact SD-CD2 4.38Å; M129-M133 HydrophobicContact CG-CE 4.34Å; M129-M133 WeakPolarHBondContact O-CG 3.29Å; M129-M133 PolarHBondContact O-N 3.04Å; M129-M133 HydrophobicContact SD-CE 3.41Å; M129-M133 WeakPolarHBondContact SD-CE 3.29Å; M129-V155 HydrophobicContact CB-CG2 4.08Å; M129-V155 HydrophobicContact CE-CG2 4.1Å
130A95.6Very high90.9Very high0 Ų030.3 Ų30.30%017%0.174CC..Hα-helixtrans-63.3-41.5176.200000112.1L28 R29 V126 D127 M133 E134L28-A130 HydrophobicContact CB-CB 3.97Å; L28-A130 HydrophobicContact CD1-CB 4.48Å; R29-A130 HydrophobicContact CG-CB 3.92Å; V126-A130 PolarHBondContact O-N 2.85Å; D127-A130 WeakPolarHBondContact O-CA 3.11Å; D127-A130 WeakPolarHBondContact O-CB 3.48Å; D127-A130 PolarHBondContact O-N 3.07Å; A130-M133 PolarHBondContact O-N 3.32Å; A130-E134 PolarHBondContact O-N 3.21Å; A130-E134 VanDerWaalsContact O-N 3.15Å
131Q93.9Very high88.6Confident57 Ų5735.3 Ų35.327%0.26620%0.199SC..Hα-helixtrans-60.6-45.1174-68.8178.925.600111.4D127 G128 M133 E134 V135 S154D127-Q131 WeakPolarHBondContact O-CG 3.41Å; D127-Q131 PolarHBondContact O-N 3.35Å; D127-Q131 PolarHBondContact OD2-NE2 3.29Å; G128-Q131 PolarHBondContact O-N 3.4Å; Q131-M133 VanDerWaalsContact C-N 3.32Å; Q131-M133 PolarHBondContact O-N 3.07Å; Q131-E134 WeakPolarHBondContact O-CB 3.39Å; Q131-E134 PolarHBondContact O-N 3.16Å; Q131-V135 WeakPolarHBondContact O-CG2 3.39Å; Q131-V135 PolarHBondContact O-N 3.4Å; Q131-S154 PolarHBondContact OE1-OG 3.3Å
132L93.8Very high86.4Confident0 Ų040.9 Ų40.90%022%0.224CC..Hα-helixtrans-59-43.7176.5178.463.5000111.7A67 G128 M129 E134 V135 L136 Y152 V155 W156A67-L132 HydrophobicContact CB-CD2 3.66Å; G128-L132 PolarHBondContact O-N 2.89Å; M129-L132 PolarHBondContact O-N 3.46Å; M129-L132 HydrophobicContact SD-CD2 4.38Å; L132-E134 VanDerWaalsContact C-N 3.29Å; L132-E134 PolarHBondContact O-N 2.92Å; L132-V135 PolarHBondContact O-N 3.3Å; L132-L136 HydrophobicContact CD1-CD1 4.07Å; L132-L136 HydrophobicContact CD1-CG 4.04Å; L132-L136 HydrophobicContact CG-CD1 3.99Å; L132-L136 HydrophobicContact CG-CG 4.34Å; L132-L136 WeakPolarHBondContact O-CG 3.4Å; L132-L136 PolarHBondContact O-N 3.47Å; L132-Y152 HydrophobicContact CD1-CD2 3.97Å; L132-Y152 HydrophobicContact CD1-CE2 4.08Å; L132-Y152 HydrophobicContact CD1-CG 4.35Å; L132-V155 HydrophobicContact CD2-CG1 3.93Å; L132-W156 HydrophobicContact CD1-CH2 4.3Å; L132-W156 HydrophobicContact CD1-CZ3 4.25Å; L132-W156 HydrophobicContact CD2-CH2 3.88Å; L132-W156 HydrophobicContact CD2-CZ3 4.19Å
133M92.8Very high84.1Confident0 Ų043.9 Ų43.90%024%0.244CC..Hα-helixtrans-59.6-39.8177.8-68.5-48.210800112.1L21 L24 A25 L28 L70 M129 A130 Q131 S137L21-M133 HydrophobicContact CD2-SD 3.88Å; L24-M133 HydrophobicContact CD2-CG 4.05Å; L24-M133 HydrophobicContact CD2-SD 3.83Å; L24-M133 HydrophobicContact CG-CG 4.25Å; A25-M133 HydrophobicContact CB-CB 3.75Å; L28-M133 HydrophobicContact CD1-CG 4.28Å; L70-M133 HydrophobicContact CD1-CE 3.24Å; L70-M133 HydrophobicContact CD1-SD 3.43Å; L70-M133 WeakPolarHBondContact CD1-SD 3.47Å; M129-M133 HydrophobicContact CG-CE 4.34Å; M129-M133 WeakPolarHBondContact O-CG 3.29Å; M129-M133 PolarHBondContact O-N 3.04Å; M129-M133 HydrophobicContact SD-CE 3.41Å; M129-M133 WeakPolarHBondContact SD-CE 3.29Å; A130-M133 PolarHBondContact O-N 3.32Å; Q131-M133 VanDerWaalsContact C-N 3.32Å; Q131-M133 PolarHBondContact O-N 3.07Å; M133-S137 WeakPolarHBondContact O-CB 3.28Å; M133-S137 PolarHBondContact O-N 3.04Å; M133-S137 VanDerWaalsContact O-N 3.14Å; M133-S137 PolarHBondContact O-OG 2.96Å
134E91.3Very high81.9Confident82 Ų8246.8 Ų46.838%0.38327%0.265SS..Hα-helixtrans-65.5-46.8176.1-72.5-173.8154.600112.5A25 R29 A130 Q131 L132 L136 S137 I138A25-E134 HydrophobicContact CB-CG 3.77Å; R29-E134 IonicContact CZ-OE1 2.75Å; R29-E134 IonicContact CZ-OE2 3.17Å; R29-E134 IonicContact NH1-OE1 2.7Å; R29-E134 PolarHBondContact NH1-OE1 3.37Å; R29-E134 IonicContact NH1-OE2 3.85Å; R29-E134 IonicContact NH2-OE1 3.4Å; R29-E134 PolarHBondContact NH2-OE1 3.34Å; R29-E134 VanDerWaalsContact NH2-OE1 3.08Å; R29-E134 IonicContact NH2-OE2 3.87Å; R29-E134 PolarHBondContact NH2-OE2 3.24Å; A130-E134 PolarHBondContact O-N 3.21Å; A130-E134 VanDerWaalsContact O-N 3.15Å; Q131-E134 WeakPolarHBondContact O-CB 3.39Å; Q131-E134 PolarHBondContact O-N 3.16Å; L132-E134 VanDerWaalsContact C-N 3.29Å; L132-E134 PolarHBondContact O-N 2.92Å; E134-L136 VanDerWaalsContact C-N 3.31Å; E134-L136 PolarHBondContact O-N 3.17Å; E134-S137 WeakPolarHBondContact O-CA 3.41Å; E134-S137 VanDerWaalsContact O-CB 3.27Å; E134-S137 WeakPolarHBondContact O-CB 3.48Å; E134-S137 PolarHBondContact O-N 3.17Å; E134-I138 PolarHBondContact O-N 3.09Å
135V89.9Confident79.8Confident26 Ų2650.9 Ų50.916%0.15828%0.281CS..Hα-helixtrans-60.6-44.2-179.91770000110.5Q131 L132 S137 I138 S151 Y152Q131-V135 WeakPolarHBondContact O-CG2 3.39Å; Q131-V135 PolarHBondContact O-N 3.4Å; L132-V135 PolarHBondContact O-N 3.3Å; V135-S137 PolarHBondContact O-N 3.02Å; V135-I138 PolarHBondContact O-N 3.2Å; V135-S151 VanDerWaalsContact CG2-OG 3.3Å; V135-S151 WeakPolarHBondContact CG2-OG 3.48Å; V135-Y152 HydrophobicContact CG1-CD2 3.85Å; V135-Y152 HydrophobicContact CG1-CE2 4.34Å
136L89.1Confident77.4Confident17 Ų1757.6 Ų57.69%0.08932%0.317CS..Hα-helixtrans-67.5-16.3176-65.5179000113.5L18 L21 L70 F74 L132 E134 Y152L18-L136 WeakPolarHBondContact CD2-O 3.48Å; L21-L136 HydrophobicContact CD1-CB 3.83Å; L70-L136 HydrophobicContact CB-CD1 4.12Å; F74-L136 HydrophobicContact CB-CD1 4.5Å; F74-L136 HydrophobicContact CB-CD2 4.2Å; L132-L136 HydrophobicContact CD1-CD1 4.07Å; L132-L136 HydrophobicContact CD1-CG 4.04Å; L132-L136 HydrophobicContact CG-CD1 3.99Å; L132-L136 HydrophobicContact CG-CG 4.34Å; L132-L136 WeakPolarHBondContact O-CG 3.4Å; L132-L136 PolarHBondContact O-N 3.47Å; E134-L136 VanDerWaalsContact C-N 3.31Å; E134-L136 PolarHBondContact O-N 3.17Å; L136-Y152 HydrophobicContact CD2-CE2 3.84Å
137S87.9Confident75.1Confident1 Ų163.8 Ų63.81%0.00735%0.35CS..THydrogen-bonded Turntrans-86.4-8.5176.8-58.70000113.8L18 L21 R22 M133 E134 V135L18-S137 PolarHBondContact O-OG 2.95Å; L21-S137 WeakPolarHBondContact CB-OG 3.49Å; R22-S137 PolarHBondContact N-OG 3.39Å; R22-S137 PolarHBondContact NH2-O 3.33Å; M133-S137 WeakPolarHBondContact O-CB 3.28Å; M133-S137 PolarHBondContact O-N 3.04Å; M133-S137 VanDerWaalsContact O-N 3.14Å; M133-S137 PolarHBondContact O-OG 2.96Å; E134-S137 WeakPolarHBondContact O-CA 3.41Å; E134-S137 VanDerWaalsContact O-CB 3.27Å; E134-S137 WeakPolarHBondContact O-CB 3.48Å; E134-S137 PolarHBondContact O-N 3.17Å; V135-S137 PolarHBondContact O-N 3.02Å
138I83.8Confident73.2Confident73 Ų7363.8 Ų63.837%0.37435%0.35SS..SBendtrans-88.1131.4178.4-61.7169.6000108.9E134 V135 Q142E134-I138 PolarHBondContact O-N 3.09Å; V135-I138 PolarHBondContact O-N 3.2Å; I138-Q142 HydrophobicContact CG2-CB 3.72Å
139T63.2Low71.4Confident54 Ų5470.2 Ų70.233%0.33138%0.383SS..  trans-68.8142.9176.2-2.60000110.6L18 T141 Q142L18-T139 HydrophobicContact CD1-CG2 4.48Å; T139-T141 PolarHBondContact O-N 3.45Å; T139-Q142 PolarHBondContact O-N 3.26Å
140P57.4Low69.6Low118 Ų11877 Ų7777%0.76642%0.418SS*.G310 helixtrans-56.1-17.7-177.7-26.433.6000115.8Q142P140-Q142 VanDerWaalsContact C-N 3.27Å; P140-Q142 PolarHBondContact O-N 2.85Å
141T48.1Very low68.2Low130 Ų13078 Ų7880%0.79843%0.425SS*.G310 helixtrans-79.4-3.6176.542.90000114.2T139T139-T141 PolarHBondContact O-N 3.45Å
142Q50.9Low67.2Low127 Ų12778.5 Ų78.559%0.59343%0.425SS*.G310 helixtrans-116.63.1-173.9-69-177.9-11.300114.4I138 T139 P140 P144I138-Q142 HydrophobicContact CG2-CB 3.72Å; T139-Q142 PolarHBondContact O-N 3.26Å; P140-Q142 VanDerWaalsContact C-N 3.27Å; P140-Q142 PolarHBondContact O-N 2.85Å; Q142-P144 WeakPolarHBondContact O-CD 3.36Å
143S50.7Low66.8Low62 Ų6282.3 Ų82.343%0.43445%0.445SS..  trans-79.7118.6-17955.20000112D148S143-D148 VanDerWaalsContact CB-OD2 3.3Å; S143-D148 WeakPolarHBondContact CB-OD2 3.4Å
144P49.7Very low66.6Low85 Ų8583.5 Ų83.555%0.55245%0.454SS*.  trans-75.7132.2165.722.7-14.2000110Q142 N146Q142-P144 WeakPolarHBondContact O-CD 3.36Å; P144-N146 PolarHBondContact O-N 2.85Å
145E52.9Low66.8Low187 Ų18779.6 Ų79.687%0.87444%0.436SS*.THydrogen-bonded Turntrans-56.72-156.5-66.2-179.1154.400119.3
146N47.8Very low67Low141 Ų14180.2 Ų80.275%0.75444%0.435SS*.THydrogen-bonded Turntrans-150.5-3.2-176.6-84.5-45.6000117.9P144P144-N146 PolarHBondContact O-N 2.85Å
147N48.3Very low67.3Low130 Ų13082.3 Ų82.370%0.69545%0.449SS*.SBendtrans-90.7-8.9-176.4-111.86.1000114.7
148D56.6Low67.6Low49 Ų4982.9 Ų82.926%0.26245%0.453SS..Hα-helixtrans-92.4-13.4-165.8-64-25.8000114.6S143 S151 Y152S143-D148 VanDerWaalsContact CB-OD2 3.3Å; S143-D148 WeakPolarHBondContact CB-OD2 3.4Å; D148-S151 PolarHBondContact O-OG 3.42Å; D148-S151 VanDerWaalsContact O-OG 3.06Å; D148-Y152 WeakPolarHBondContact O-CB 3.35Å; D148-Y152 PolarHBondContact O-N 3.25Å; D148-Y152 VanDerWaalsContact O-N 3.1Å
149L58.3Low68.2Low135 Ų13580 Ų8071%0.70744%0.439SS*.Hα-helixtrans-73.2-34.9-176.3-76.1163.5000113.1N153L149-N153 PolarHBondContact O-N 3.06Å
150I60.9Low69.6Low143 Ų14383.4 Ų83.473%0.73345%0.452SS*.Hα-helixtrans-71.3-44.6-179.5-62.6175.3000110.2Y152 N153 S154I150-Y152 VanDerWaalsContact C-N 3.33Å; I150-N153 PolarHBondContact O-N 2.85Å; I150-S154 PolarHBondContact O-N 3.34Å
151S64.1Low71.2Confident22 Ų2282.5 Ų82.515%0.15444%0.437CS..Hα-helixtrans-69.3-30.7178.551.30000112.3V135 D148 S154V135-S151 VanDerWaalsContact CG2-OG 3.3Å; V135-S151 WeakPolarHBondContact CG2-OG 3.48Å; D148-S151 PolarHBondContact O-OG 3.42Å; D148-S151 VanDerWaalsContact O-OG 3.06Å; S151-S154 PolarHBondContact O-OG 3.05Å
152Y74.6Confident73.2Confident67 Ų6776.4 Ų76.426%0.26340%0.399SS..Hα-helixtrans-62.7-53.9171.7-145.1-108.3000110.7T71 S75 L132 V135 L136 D148 I150 S154 W156T71-Y152 HydrophobicContact CG2-CE1 3.69Å; T71-Y152 WeakPolarHBondContact CG2-OH 3.42Å; T71-Y152 PolarHBondContact OG1-OH 3.45Å; S75-Y152 PolarHBondContact OG-OH 3.05Å; L132-Y152 HydrophobicContact CD1-CD2 3.97Å; L132-Y152 HydrophobicContact CD1-CE2 4.08Å; L132-Y152 HydrophobicContact CD1-CG 4.35Å; V135-Y152 HydrophobicContact CG1-CD2 3.85Å; V135-Y152 HydrophobicContact CG1-CE2 4.34Å; L136-Y152 HydrophobicContact CD2-CE2 3.84Å; D148-Y152 WeakPolarHBondContact O-CB 3.35Å; D148-Y152 PolarHBondContact O-N 3.25Å; D148-Y152 VanDerWaalsContact O-N 3.1Å; I150-Y152 VanDerWaalsContact C-N 3.33Å; Y152-S154 VanDerWaalsContact C-N 3.35Å; Y152-S154 PolarHBondContact O-N 3.48Å; Y152-W156 HydrophobicContact CD1-CZ3 4.22Å; Y152-W156 VanDerWaalsContact O-CE3 3.31Å; Y152-W156 WeakPolarHBondContact O-CZ3 3.43Å
153N85Confident75Confident79 Ų7973.5 Ų73.542%0.42239%0.392SS..Hα-helixtrans-82.6-9-168.2-16028.1000114.9L149 I150 V155 W156 V157L149-N153 PolarHBondContact O-N 3.06Å; I150-N153 PolarHBondContact O-N 2.85Å; N153-V155 VanDerWaalsContact C-N 3.34Å; N153-V155 PolarHBondContact O-N 3.39Å; N153-W156 PolarHBondContact O-N 3.15Å; N153-W156 VanDerWaalsContact O-N 3.11Å; N153-V157 WeakPolarHBondContact O-CG2 3.49Å; N153-V157 PolarHBondContact O-N 3.14Å
154S89.3Confident77Confident26 Ų2677.4 Ų77.418%0.18240%0.403CS..Hα-helixtrans-53.7-44.8-170.363.20000113.4G128 Q131 I150 S151 Y152 W156 V157 A158G128-S154 VanDerWaalsContact CA-OG 3.31Å; G128-S154 WeakPolarHBondContact CA-OG 3.29Å; G128-S154 PolarHBondContact O-OG 3.49Å; Q131-S154 PolarHBondContact OE1-OG 3.3Å; I150-S154 PolarHBondContact O-N 3.34Å; S151-S154 PolarHBondContact O-OG 3.05Å; Y152-S154 VanDerWaalsContact C-N 3.35Å; Y152-S154 PolarHBondContact O-N 3.48Å; S154-W156 PolarHBondContact O-N 3.33Å; S154-V157 PolarHBondContact O-N 3.11Å; S154-A158 WeakPolarHBondContact O-CB 3.39Å; S154-A158 PolarHBondContact O-N 2.96Å
155V94.3Very high79.1Confident0 Ų074.3 Ų74.30%038%0.382CS..Hα-helixtrans-64.4-38.3180670000113V63 A67 M129 L132 N153 C159V63-V155 HydrophobicContact CG1-CG2 4.18Å; A67-V155 HydrophobicContact CB-CG1 3.72Å; A67-V155 HydrophobicContact CB-CG2 4.44Å; M129-V155 HydrophobicContact CB-CG2 4.08Å; M129-V155 HydrophobicContact CE-CG2 4.1Å; L132-V155 HydrophobicContact CD2-CG1 3.93Å; N153-V155 VanDerWaalsContact C-N 3.34Å; N153-V155 PolarHBondContact O-N 3.39Å; V155-C159 WeakPolarHBondContact O-CB 3.37Å; V155-C159 PolarHBondContact O-N 3.47Å; V155-C159 PolarHBondContact O-SG 3.38Å
156W95.3Very high81.2Confident38 Ų3866.2 Ų66.214%0.14435%0.345CS..Hα-helixtrans-72.7-41.8178.4-70.6-82.6000111.2S64 A67 T68 T71 L132 Y152 N153 S154 A158 C159 Q160S64-W156 PolarHBondContact O-NE1 3.42Å; A67-W156 HydrophobicContact CB-CH2 4.16Å; A67-W156 HydrophobicContact CB-CZ2 3.64Å; T68-W156 PolarHBondContact OG1-NE1 2.64Å; T71-W156 HydrophobicContact CG2-CH2 4.4Å; T71-W156 WeakPolarHBondContact OG1-CH2 3.34Å; L132-W156 HydrophobicContact CD1-CH2 4.3Å; L132-W156 HydrophobicContact CD1-CZ3 4.25Å; L132-W156 HydrophobicContact CD2-CH2 3.88Å; L132-W156 HydrophobicContact CD2-CZ3 4.19Å; Y152-W156 HydrophobicContact CD1-CZ3 4.22Å; Y152-W156 VanDerWaalsContact O-CE3 3.31Å; Y152-W156 WeakPolarHBondContact O-CZ3 3.43Å; N153-W156 PolarHBondContact O-N 3.15Å; N153-W156 VanDerWaalsContact O-N 3.11Å; S154-W156 PolarHBondContact O-N 3.33Å; W156-A158 VanDerWaalsContact C-N 3.31Å; W156-A158 PolarHBondContact O-N 3.18Å; W156-C159 PolarHBondContact O-N 2.84Å; W156-Q160 WeakPolarHBondContact O-CB 3.07Å; W156-Q160 WeakPolarHBondContact O-CG 3.43Å; W156-Q160 PolarHBondContact O-N 3.48Å
157V94.3Very high83.5Confident62 Ų6265.3 Ų65.338%0.37633%0.331SS..Hα-helixtrans-57.8-48173.81750000109.6N153 S154 C159 Q160 Q161N153-V157 WeakPolarHBondContact O-CG2 3.49Å; N153-V157 PolarHBondContact O-N 3.14Å; S154-V157 PolarHBondContact O-N 3.11Å; V157-C159 PolarHBondContact O-N 3.17Å; V157-Q160 WeakPolarHBondContact O-CB 3.5Å; V157-Q160 PolarHBondContact O-N 3.26Å; V157-Q161 WeakPolarHBondContact O-CG 3.44Å; V157-Q161 PolarHBondContact O-N 3.42Å; V157-Q161 VanDerWaalsContact O-N 3.1Å
158A95.1Very high85.8Confident12 Ų1260.2 Ų60.210%0.09930%0.304CS..Hα-helixtrans-60.2-45.2177.700000112.3D124 I125 S154 W156 Q160 Q161D124-A158 HydrophobicContact CB-CB 4.13Å; I125-A158 HydrophobicContact CG1-CB 3.68Å; S154-A158 WeakPolarHBondContact O-CB 3.39Å; S154-A158 PolarHBondContact O-N 2.96Å; W156-A158 VanDerWaalsContact C-N 3.31Å; W156-A158 PolarHBondContact O-N 3.18Å; A158-Q160 VanDerWaalsContact C-N 3.32Å; A158-Q160 PolarHBondContact O-N 3.41Å; A158-Q161 PolarHBondContact O-N 3Å
159C95.3Very high87.7Confident12 Ų1258 Ų588%0.08129%0.292CS..Hα-helixtrans-63.5-36.1175.6-68.40000112.7V155 W156 V157 Q161 M162V155-C159 WeakPolarHBondContact O-CB 3.37Å; V155-C159 PolarHBondContact O-N 3.47Å; V155-C159 PolarHBondContact O-SG 3.38Å; W156-C159 PolarHBondContact O-N 2.84Å; V157-C159 PolarHBondContact O-N 3.17Å; C159-Q161 VanDerWaalsContact C-N 3.3Å; C159-Q161 PolarHBondContact O-N 3.09Å; C159-M162 WeakPolarHBondContact O-CB 3.47Å; C159-M162 WeakPolarHBondContact O-CG 3.47Å; C159-M162 PolarHBondContact O-N 3.19Å
160Q93.3Very high89.6Confident127 Ų12753.5 Ų53.559%0.59327%0.267SS*.Hα-helixtrans-70.2-23.4177.7-76173.11.600113.4W156 V157 A158 M162 P163W156-Q160 WeakPolarHBondContact O-CB 3.07Å; W156-Q160 WeakPolarHBondContact O-CG 3.43Å; W156-Q160 PolarHBondContact O-N 3.48Å; V157-Q160 WeakPolarHBondContact O-CB 3.5Å; V157-Q160 PolarHBondContact O-N 3.26Å; A158-Q160 VanDerWaalsContact C-N 3.32Å; A158-Q160 PolarHBondContact O-N 3.41Å; Q160-M162 VanDerWaalsContact C-N 3.27Å; Q160-M162 PolarHBondContact O-N 2.93Å; Q160-P163 VanDerWaalsContact O-CD 3.28Å; Q160-P163 WeakPolarHBondContact O-CD 3.44Å
161Q90.3Very high91.4Very high98 Ų9848.4 Ų48.446%0.45825%0.246SC..Hα-helixtrans-73.3-19.1174.9-65.4-48.9-49.800112.8V157 A158 C159 Q164 I165V157-Q161 WeakPolarHBondContact O-CG 3.44Å; V157-Q161 PolarHBondContact O-N 3.42Å; V157-Q161 VanDerWaalsContact O-N 3.1Å; A158-Q161 PolarHBondContact O-N 3Å; C159-Q161 VanDerWaalsContact C-N 3.3Å; C159-Q161 PolarHBondContact O-N 3.09Å; Q161-Q164 WeakPolarHBondContact O-CA 3.39Å; Q161-Q164 VanDerWaalsContact O-CB 3.32Å; Q161-Q164 WeakPolarHBondContact O-CB 3.37Å; Q161-Q164 PolarHBondContact O-N 3.01Å; Q161-I165 PolarHBondContact O-N 2.86Å
162M90.4Very high93Very high2 Ų247.3 Ų47.31%0.0124%0.239CC..G310 helixtrans-55.3-43.1-174-66.6-58.3-55.600114.9L56 A60 F99 A121 I125 C159 Q160 Q164 I165L56-M162 HydrophobicContact CD1-CE 4.14Å; L56-M162 HydrophobicContact CD2-CE 3.46Å; L56-M162 VanDerWaalsContact CD2-CE 3.46Å; L56-M162 HydrophobicContact CG-CE 3.52Å; A60-M162 HydrophobicContact CB-CB 4.25Å; A60-M162 HydrophobicContact CB-CG 3.73Å; F99-M162 HydrophobicContact CE2-CE 4.11Å; F99-M162 HydrophobicContact CZ-CE 3.75Å; F99-M162 HydrophobicContact CZ-SD 3.97Å; A121-M162 HydrophobicContact CB-SD 3.86Å; I125-M162 HydrophobicContact CD1-CG 3.81Å; I125-M162 HydrophobicContact CD1-SD 3.67Å; C159-M162 WeakPolarHBondContact O-CB 3.47Å; C159-M162 WeakPolarHBondContact O-CG 3.47Å; C159-M162 PolarHBondContact O-N 3.19Å; Q160-M162 VanDerWaalsContact C-N 3.27Å; Q160-M162 PolarHBondContact O-N 2.93Å; M162-Q164 PolarHBondContact O-N 2.92Å; M162-I165 HydrophobicContact CE-CD1 3.71Å; M162-I165 PolarHBondContact O-N 3Å; M162-I165 HydrophobicContact SD-CD1 3.51Å; M162-I165 VanDerWaalsContact SD-CD1 3.51Å
163P89.9Confident94.2Very high67 Ų6744.2 Ų44.244%0.43523%0.227SC..G310 helixtrans-66.8-21.5175.8-21.936000114.1Q160Q160-P163 VanDerWaalsContact O-CD 3.28Å; Q160-P163 WeakPolarHBondContact O-CD 3.44Å
164Q91.6Very high94.8Very high144 Ų14442.5 Ų42.567%0.67322%0.217SC*.G310 helixtrans-85.2-14.4-178.7-52.1-56.6-29.200112.8Q161 M162Q161-Q164 WeakPolarHBondContact O-CA 3.39Å; Q161-Q164 VanDerWaalsContact O-CB 3.32Å; Q161-Q164 WeakPolarHBondContact O-CB 3.37Å; Q161-Q164 PolarHBondContact O-N 3.01Å; M162-Q164 PolarHBondContact O-N 2.92Å
165I94.6Very high95.3Very high20 Ų2044.3 Ų44.310%0.10323%0.225CC..SBendtrans-63.8133.9178.9-59.9173.7000109.2W53 V118 A121 Q161 M162 R167W53-I165 HydrophobicContact CH2-CG2 4.1Å; W53-I165 HydrophobicContact CZ3-CB 4.49Å; W53-I165 HydrophobicContact CZ3-CG2 4.3Å; V118-I165 HydrophobicContact CG2-CG2 4.06Å; A121-I165 HydrophobicContact CB-CD1 3.27Å; A121-I165 HydrophobicContact CB-CG1 4.39Å; Q161-I165 PolarHBondContact O-N 2.86Å; M162-I165 HydrophobicContact CE-CD1 3.71Å; M162-I165 PolarHBondContact O-N 3Å; M162-I165 HydrophobicContact SD-CD1 3.51Å; M162-I165 VanDerWaalsContact SD-CD1 3.51Å; I165-R167 PolarHBondContact O-N 3.41Å
166P96.5Very high95.4Very high16 Ų1645.3 Ų45.310%0.10423%0.23CC..  trans-51.2139.1174.2-31.138.3000112.7W53 L114 L117 A171 A172 L175W53-P166 VanDerWaalsContact CH2-O 3.23Å; W53-P166 WeakPolarHBondContact CH2-O 3.48Å; W53-P166 WeakPolarHBondContact CZ2-O 3.5Å; L114-P166 HydrophobicContact CD1-CB 4.48Å; L114-P166 WeakPolarHBondContact CD1-O 3.43Å; L117-P166 HydrophobicContact CD1-CG 3.94Å; P166-A171 HydrophobicContact CB-CB 3.76Å; P166-A172 HydrophobicContact CB-CB 4.04Å; P166-A172 HydrophobicContact CG-CB 4.49Å; P166-L175 HydrophobicContact CG-CB 4.15Å; P166-L175 HydrophobicContact CG-CD2 3.73Å
167R95.8Very high95.6Very high122 Ų12243.6 Ų43.646%0.4622%0.223SC..SBendtrans-99.6-2.4-177.5-61.6-169.9-172.7-179.51.8115.1R49 W53 I165R49-R167 PolarHBondContact NH1-O 3Å; W53-R167 HydrophobicContact CD2-CB 4.38Å; W53-R167 HydrophobicContact CD2-CG 3.9Å; W53-R167 HydrophobicContact CE3-CG 4.37Å; W53-R167 HydrophobicContact CG-CG 4.21Å; W53-R167 VanDerWaalsContact CZ2-CA 3.48Å; W53-R167 HydrophobicContact CZ2-CB 4.13Å; W53-R167 HydrophobicContact CZ2-CG 4.22Å; W53-R167 PolarHBondContact NE1-O 2.88Å; I165-R167 PolarHBondContact O-N 3.41Å
168D96.4Very high95.8Very high24 Ų2442.7 Ų42.713%0.12822%0.218CC..SBendtrans-147161.7172.846.282.1000111R49 K170 A171 A172 K268R49-D168 IonicContact NH1-OD2 2.98Å; R49-D168 PolarHBondContact NH1-OD2 3.24Å; D168-K170 VanDerWaalsContact C-N 3.26Å; D168-K170 PolarHBondContact O-N 2.89Å; D168-A171 PolarHBondContact O-N 3.33Å; D168-A171 PolarHBondContact OD1-N 3.42Å; D168-A171 VanDerWaalsContact OD1-N 3.15Å; D168-A172 PolarHBondContact O-N 2.88Å; D168-K268 HydrophobicContact CB-CD 4.18Å; D168-K268 IonicContact OD1-NZ 3.39Å; D168-K268 WeakPolarHBondContact OD2-CE 3.28Å; D168-K268 IonicContact OD2-NZ 2.87Å; D168-K268 PolarHBondContact OD2-NZ 3.47Å
169N97.8Very high95.9Very high3 Ų346.3 Ų46.32%0.01623%0.231CC..Hα-helixtrans-63.8-29.2-175.7-148.241.6000113.5Q110 G111 T113 L114 A172 A173 V271 L274 D275Q110-N169 WeakPolarHBondContact O-CB 3.27Å; G111-N169 WeakPolarHBondContact CA-OD1 3.45Å; T113-N169 WeakPolarHBondContact CB-OD1 3.44Å; L114-N169 WeakPolarHBondContact CB-OD1 3.42Å; L114-N169 PolarHBondContact N-OD1 3.08Å; N169-A172 PolarHBondContact O-N 3.3Å; N169-A173 WeakPolarHBondContact O-CB 3.36Å; N169-A173 PolarHBondContact O-N 3.47Å; N169-V271 PolarHBondContact ND2-O 3.28Å; N169-L274 HydrophobicContact CB-CD1 4.48Å; N169-D275 VanDerWaalsContact ND2-CG 3.33Å; N169-D275 PolarHBondContact ND2-OD1 3.46Å; N169-D275 PolarHBondContact OD1-OD1 3.35Å
170K98.3Very high96Very high39 Ų3946.2 Ų46.217%0.1723%0.23CC..Hα-helixtrans-63.5-50.2175.1-179-177.2179.3169.40110.8D168 A172 A173 L174 V262 A263 G266 K268 L274D168-K170 VanDerWaalsContact C-N 3.26Å; D168-K170 PolarHBondContact O-N 2.89Å; K170-A172 VanDerWaalsContact C-N 3.27Å; K170-A172 PolarHBondContact O-N 3.25Å; K170-A173 PolarHBondContact O-N 3.28Å; K170-L174 HydrophobicContact CG-CD1 4.37Å; K170-L174 WeakPolarHBondContact O-CG 3.31Å; K170-L174 PolarHBondContact O-N 2.88Å; K170-V262 WeakPolarHBondContact CE-O 3.34Å; K170-A263 WeakPolarHBondContact CE-O 3.39Å; K170-A263 PolarHBondContact NZ-O 2.78Å; K170-G266 VanDerWaalsContact CD-O 3.29Å; K170-G266 WeakPolarHBondContact CD-O 3.15Å; K170-G266 VanDerWaalsContact CE-O 3.24Å; K170-G266 WeakPolarHBondContact CE-O 3.42Å; K170-G266 PolarHBondContact NZ-O 3.31Å; K170-K268 HydrophobicContact CB-CG 4.2Å; K170-L274 HydrophobicContact CB-CD1 4.02Å
171A98.2Very high96.2Very high36 Ų3640.5 Ų40.530%0.29820%0.204SC..Hα-helixtrans-63.9-34.9176.700000111.8P166 D168 L174 L175P166-A171 HydrophobicContact CB-CB 3.76Å; D168-A171 PolarHBondContact O-N 3.33Å; D168-A171 PolarHBondContact OD1-N 3.42Å; D168-A171 VanDerWaalsContact OD1-N 3.15Å; A171-L174 PolarHBondContact O-N 2.96Å; A171-L175 PolarHBondContact O-N 3.24Å
172A98.3Very high96.6Very high0 Ų039.3 Ų39.30%020%0.201CC..Hα-helixtrans-63.2-46.6174.200000112.3T113 L114 L117 P166 D168 N169 K170 L174 L175 M176T113-A172 HydrophobicContact CG2-CB 3.99Å; L114-A172 HydrophobicContact CB-CB 4.02Å; L114-A172 HydrophobicContact CD1-CB 4.29Å; L117-A172 HydrophobicContact CD1-CB 3.67Å; P166-A172 HydrophobicContact CB-CB 4.04Å; P166-A172 HydrophobicContact CG-CB 4.49Å; D168-A172 PolarHBondContact O-N 2.88Å; N169-A172 PolarHBondContact O-N 3.3Å; K170-A172 VanDerWaalsContact C-N 3.27Å; K170-A172 PolarHBondContact O-N 3.25Å; A172-L174 PolarHBondContact O-N 3.45Å; A172-L175 PolarHBondContact O-N 3.34Å; A172-M176 PolarHBondContact O-N 2.98Å
173A98.5Very high97Very high1 Ų144.7 Ų44.71%0.00822%0.224CC..Hα-helixtrans-60.8-43.9176.100000112N169 K170 L175 M176 L177 V262 L274 V278N169-A173 WeakPolarHBondContact O-CB 3.36Å; N169-A173 PolarHBondContact O-N 3.47Å; K170-A173 PolarHBondContact O-N 3.28Å; A173-L175 VanDerWaalsContact C-N 3.34Å; A173-L175 PolarHBondContact O-N 3.49Å; A173-M176 PolarHBondContact O-N 3.46Å; A173-L177 WeakPolarHBondContact O-CB 3.44Å; A173-L177 VanDerWaalsContact O-CG 3.27Å; A173-L177 WeakPolarHBondContact O-CG 3.48Å; A173-L177 PolarHBondContact O-N 3.29Å; A173-V262 HydrophobicContact CB-CG1 4.41Å; A173-L274 HydrophobicContact CB-CB 4.49Å; A173-V278 HydrophobicContact CB-CG2 3.44Å; A173-V278 VanDerWaalsContact CB-CG2 3.44Å
174L98.6Very high97.4Very high43 Ų4341.5 Ų41.523%0.22520%0.204CC..Hα-helixtrans-62.4-40.3176.4-73.6172.1000112.8K170 A171 A172 T178 R259 V262 A263K170-L174 HydrophobicContact CG-CD1 4.37Å; K170-L174 WeakPolarHBondContact O-CG 3.31Å; K170-L174 PolarHBondContact O-N 2.88Å; A171-L174 PolarHBondContact O-N 2.96Å; A172-L174 PolarHBondContact O-N 3.45Å; L174-T178 WeakPolarHBondContact O-CB 3.23Å; L174-T178 PolarHBondContact O-N 3.18Å; L174-T178 PolarHBondContact O-OG1 3.45Å; L174-R259 HydrophobicContact CD2-CG 4.05Å; L174-V262 HydrophobicContact CD2-CB 4.1Å; L174-V262 HydrophobicContact CD2-CG1 3.83Å; L174-V262 HydrophobicContact CG-CG1 4.07Å; L174-A263 HydrophobicContact CD1-CB 4.46Å; L174-A263 HydrophobicContact CD2-CB 3.81Å
175L98.3Very high97.7Very high64 Ų6438.2 Ų38.234%0.33519%0.187SC..Hα-helixtrans-62.2-46.6174.8-179.862.2000110.5L117 P166 A171 A172 A173 T178 K179L117-L175 HydrophobicContact CD1-CD2 3.96Å; L117-L175 HydrophobicContact CD2-CD2 4.39Å; P166-L175 HydrophobicContact CG-CB 4.15Å; P166-L175 HydrophobicContact CG-CD2 3.73Å; A171-L175 PolarHBondContact O-N 3.24Å; A172-L175 PolarHBondContact O-N 3.34Å; A173-L175 VanDerWaalsContact C-N 3.34Å; A173-L175 PolarHBondContact O-N 3.49Å; L175-T178 PolarHBondContact O-N 3.4Å; L175-K179 WeakPolarHBondContact O-CG 3.5Å; L175-K179 PolarHBondContact O-N 3.11Å
176M98.2Very high97.8Very high22 Ų2241.1 Ų41.111%0.10820%0.203CC..Hα-helixtrans-65.8-44-178.8-162.359.876.500112.5T113 L117 A172 A173 T178 K179 N180 V278 E282T113-M176 HydrophobicContact CG2-CB 4.39Å; L117-M176 HydrophobicContact CD2-CE 3.87Å; A172-M176 PolarHBondContact O-N 2.98Å; A173-M176 PolarHBondContact O-N 3.46Å; M176-T178 VanDerWaalsContact C-N 3.25Å; M176-T178 PolarHBondContact O-N 3.03Å; M176-K179 WeakPolarHBondContact O-CB 3.27Å; M176-K179 PolarHBondContact O-N 3.41Å; M176-K179 HydrophobicContact SD-CD 4.26Å; M176-N180 PolarHBondContact O-N 2.92Å; M176-V278 HydrophobicContact CB-CG1 3.93Å; M176-V278 HydrophobicContact CG-CG1 3.71Å; M176-E282 WeakPolarHBondContact CE-OE1 3.4Å; M176-E282 HydrophobicContact CG-CG 4.05Å; M176-E282 WeakPolarHBondContact CG-OE1 3.41Å; M176-E282 VanDerWaalsContact SD-OE1 3.42Å
177L98.3Very high97.8Very high1 Ų141 Ų411%0.00520%0.204CC..Hα-helixtrans-61.4-35.8175.2-71168.1000112A173 N180 V181 L255 I258 R259 V262 S281A173-L177 WeakPolarHBondContact O-CB 3.44Å; A173-L177 VanDerWaalsContact O-CG 3.27Å; A173-L177 WeakPolarHBondContact O-CG 3.48Å; A173-L177 PolarHBondContact O-N 3.29Å; L177-N180 PolarHBondContact O-N 3.46Å; L177-V181 VanDerWaalsContact O-CG2 3.3Å; L177-V181 WeakPolarHBondContact O-CG2 3.38Å; L177-V181 PolarHBondContact O-N 3.1Å; L177-L255 HydrophobicContact CD2-CD2 4.42Å; L177-I258 HydrophobicContact CD1-CG2 4.15Å; L177-I258 HydrophobicContact CD2-CG2 3.96Å; L177-R259 HydrophobicContact CB-CB 4.07Å; L177-R259 HydrophobicContact CB-CG 4.03Å; L177-R259 HydrophobicContact CD1-CB 4.45Å; L177-V262 HydrophobicContact CD1-CB 4.12Å; L177-V262 HydrophobicContact CD1-CG1 4.37Å; L177-V262 HydrophobicContact CD1-CG2 3.81Å; L177-S281 WeakPolarHBondContact CD2-OG 3.43Å
178T98.4Very high97.9Very high43 Ų4335.5 Ų35.526%0.26418%0.183SC..Hα-helixtrans-65.7-46.2175-57.90000111L174 L175 M176 N180 V181 D182 R259L174-T178 WeakPolarHBondContact O-CB 3.23Å; L174-T178 PolarHBondContact O-N 3.18Å; L174-T178 PolarHBondContact O-OG1 3.45Å; L175-T178 PolarHBondContact O-N 3.4Å; M176-T178 VanDerWaalsContact C-N 3.25Å; M176-T178 PolarHBondContact O-N 3.03Å; T178-N180 VanDerWaalsContact C-N 3.32Å; T178-N180 PolarHBondContact O-N 3.02Å; T178-V181 WeakPolarHBondContact O-CB 3Å; T178-V181 PolarHBondContact O-N 2.94Å; T178-V181 VanDerWaalsContact O-N 3.12Å; T178-D182 PolarHBondContact O-N 2.64Å; T178-R259 WeakPolarHBondContact OG1-CD 3.32Å
179K97.3Very high97.9Very high89 Ų8937.7 Ų37.739%0.38719%0.192SC..Hα-helixtrans-55.8-45.9174.7-70.2-178.6176.9-170.90111.9L175 M176 V181 D182 F183L175-K179 WeakPolarHBondContact O-CG 3.5Å; L175-K179 PolarHBondContact O-N 3.11Å; M176-K179 WeakPolarHBondContact O-CB 3.27Å; M176-K179 PolarHBondContact O-N 3.41Å; M176-K179 HydrophobicContact SD-CD 4.26Å; K179-V181 VanDerWaalsContact C-N 3.34Å; K179-V181 PolarHBondContact O-N 2.99Å; K179-D182 PolarHBondContact O-N 3.23Å; K179-F183 HydrophobicContact CB-CD2 4.41Å; K179-F183 HydrophobicContact CB-CE2 4.09Å; K179-F183 WeakPolarHBondContact O-CD2 3.2Å; K179-F183 WeakPolarHBondContact O-CG 3.36Å; K179-F183 PolarHBondContact O-N 3.24Å
180N97.4Very high97.8Very high9 Ų942.7 Ų42.75%0.04822%0.216CC..Hα-helixtrans-64.9-37.5178.1-67.1-12.4000112.4M176 L177 T178 D182 V184 L255 S281 E282M176-N180 PolarHBondContact O-N 2.92Å; L177-N180 PolarHBondContact O-N 3.46Å; T178-N180 VanDerWaalsContact C-N 3.32Å; T178-N180 PolarHBondContact O-N 3.02Å; N180-D182 VanDerWaalsContact C-N 3.31Å; N180-D182 PolarHBondContact O-N 3.4Å; N180-V184 VanDerWaalsContact O-CG2 3.31Å; N180-V184 WeakPolarHBondContact O-CG2 3.28Å; N180-V184 PolarHBondContact O-N 3.48Å; N180-V184 VanDerWaalsContact O-N 3.12Å; N180-L255 HydrophobicContact CB-CD1 4.02Å; N180-L255 HydrophobicContact CB-CD2 4.03Å; N180-S281 PolarHBondContact ND2-O 3.39Å; N180-E282 PolarHBondContact ND2-N 2.97Å
181V98.4Very high97.6Very high8 Ų841 Ų415%0.04821%0.209CC..Hα-helixtrans-60.2-44.2172.9167.50000110.9L177 T178 K179 K185 K252 L255 K256L177-V181 VanDerWaalsContact O-CG2 3.3Å; L177-V181 WeakPolarHBondContact O-CG2 3.38Å; L177-V181 PolarHBondContact O-N 3.1Å; T178-V181 WeakPolarHBondContact O-CB 3Å; T178-V181 PolarHBondContact O-N 2.94Å; T178-V181 VanDerWaalsContact O-N 3.12Å; K179-V181 VanDerWaalsContact C-N 3.34Å; K179-V181 PolarHBondContact O-N 2.99Å; V181-K185 VanDerWaalsContact O-CB 3.24Å; V181-K185 WeakPolarHBondContact O-CB 3.44Å; V181-K185 PolarHBondContact O-N 2.91Å; V181-K252 HydrophobicContact CG1-CG 4.49Å; V181-L255 HydrophobicContact CG2-CB 3.59Å; V181-K256 HydrophobicContact CB-CG 4.45Å; V181-K256 HydrophobicContact CG1-CD 4.24Å; V181-K256 HydrophobicContact CG1-CG 3.65Å; V181-K256 HydrophobicContact CG2-CG 3.82Å
182D98.1Very high97.4Very high73 Ų7341.8 Ų41.839%0.3921%0.206SC..Hα-helixtrans-69.7-43.8-177.4-64.3-24.7000111.1T178 K179 N180 V184 K185 D186T178-D182 PolarHBondContact O-N 2.64Å; K179-D182 PolarHBondContact O-N 3.23Å; N180-D182 VanDerWaalsContact C-N 3.31Å; N180-D182 PolarHBondContact O-N 3.4Å; D182-V184 PolarHBondContact O-N 3.4Å; D182-K185 WeakPolarHBondContact O-CB 3.04Å; D182-K185 PolarHBondContact O-N 3.14Å; D182-K185 VanDerWaalsContact O-N 3.12Å; D182-D186 VanDerWaalsContact O-CG 3.27Å; D182-D186 PolarHBondContact O-N 2.86Å
183F97.8Very high97.2Very high115 Ų11548.2 Ų48.250%0.50423%0.23SC..Hα-helixtrans-59.1-47175-70.9-52.7000112.9K179 K185 D186 A187 S285K179-F183 HydrophobicContact CB-CD2 4.41Å; K179-F183 HydrophobicContact CB-CE2 4.09Å; K179-F183 WeakPolarHBondContact O-CD2 3.2Å; K179-F183 WeakPolarHBondContact O-CG 3.36Å; K179-F183 PolarHBondContact O-N 3.24Å; F183-K185 VanDerWaalsContact C-N 3.25Å; F183-K185 PolarHBondContact O-N 3.41Å; F183-D186 PolarHBondContact O-N 2.82Å; F183-A187 PolarHBondContact O-N 3.44Å; F183-S285 WeakPolarHBondContact CB-OG 3.42Å
184V98.3Very high96.8Very high0 Ų049.1 Ų49.10%024%0.238CC..Hα-helixtrans-67.6-30.3178176.30000111.3N180 D182 H188 V248 K252 L255 I284 V288N180-V184 VanDerWaalsContact O-CG2 3.31Å; N180-V184 WeakPolarHBondContact O-CG2 3.28Å; N180-V184 PolarHBondContact O-N 3.48Å; N180-V184 VanDerWaalsContact O-N 3.12Å; D182-V184 PolarHBondContact O-N 3.4Å; V184-H188 WeakPolarHBondContact O-CB 3.42Å; V184-H188 PolarHBondContact O-N 3.02Å; V184-H188 VanDerWaalsContact O-N 3.09Å; V184-V248 HydrophobicContact CG1-CG1 3.98Å; V184-K252 HydrophobicContact CG1-CB 3.92Å; V184-L255 HydrophobicContact CB-CD1 4.35Å; V184-L255 HydrophobicContact CG2-CD1 3.77Å; V184-I284 HydrophobicContact CG2-CG2 4.3Å; V184-V288 HydrophobicContact CG1-CG1 4.38Å; V184-V288 HydrophobicContact CG1-CG2 4.12Å; V184-V288 HydrophobicContact CG2-CB 4.4Å; V184-V288 HydrophobicContact CG2-CG2 4.07Å
185K97.8Very high96.3Very high74 Ų7449.5 Ų49.532%0.32224%0.242SC..Hα-helixtrans-66.4-47.6173.5179.3-158.1159.5-142.80110.6V181 D182 F183 H188 E189 K252V181-K185 VanDerWaalsContact O-CB 3.24Å; V181-K185 WeakPolarHBondContact O-CB 3.44Å; V181-K185 PolarHBondContact O-N 2.91Å; D182-K185 WeakPolarHBondContact O-CB 3.04Å; D182-K185 PolarHBondContact O-N 3.14Å; D182-K185 VanDerWaalsContact O-N 3.12Å; F183-K185 VanDerWaalsContact C-N 3.25Å; F183-K185 PolarHBondContact O-N 3.41Å; K185-H188 WeakPolarHBondContact O-CB 3.32Å; K185-H188 PolarHBondContact O-N 2.85Å; K185-E189 VanDerWaalsContact CE-CD 3.5Å; K185-E189 WeakPolarHBondContact CE-OE1 3.21Å; K185-E189 IonicContact NZ-OE1 3.18Å; K185-E189 IonicContact NZ-OE2 3.61Å; K185-E189 WeakPolarHBondContact O-CG 3.44Å; K185-E189 PolarHBondContact O-N 2.62Å; K185-K252 HydrophobicContact CB-CD 3.74Å; K185-K252 HydrophobicContact CG-CD 4.15Å
186D97.9Very high95.8Very high81 Ų8153.8 Ų53.843%0.43326%0.26SS..Hα-helixtrans-64-44.2-178.8-65.6-14.2000110.6D182 F183 H188 E189 E190D182-D186 VanDerWaalsContact O-CG 3.27Å; D182-D186 PolarHBondContact O-N 2.86Å; F183-D186 PolarHBondContact O-N 2.82Å; D186-H188 PolarHBondContact O-N 2.92Å; D186-E189 PolarHBondContact O-N 3.22Å; D186-E190 WeakPolarHBondContact O-CB 3.5Å; D186-E190 PolarHBondContact O-N 2.93Å
187A96.6Very high95.1Very high15 Ų1560.2 Ų60.212%0.12429%0.29CS..Hα-helixtrans-59.8-42.6174.300000112.4F183 E190 M191 V288F183-A187 PolarHBondContact O-N 3.44Å; A187-E190 PolarHBondContact O-N 3.47Å; A187-M191 WeakPolarHBondContact O-CB 3.4Å; A187-M191 WeakPolarHBondContact O-CG 3.43Å; A187-M191 PolarHBondContact O-N 3.48Å; A187-V288 HydrophobicContact CB-CG1 3.91Å
188H96.9Very high94Very high6 Ų661.4 Ų61.43%0.02830%0.298CS..Hα-helixtrans-62.4-44.3175.3178.1-88.2000112.3V184 K185 D186 E190 M191 E192 V248 R249V184-H188 WeakPolarHBondContact O-CB 3.42Å; V184-H188 PolarHBondContact O-N 3.02Å; V184-H188 VanDerWaalsContact O-N 3.09Å; K185-H188 WeakPolarHBondContact O-CB 3.32Å; K185-H188 PolarHBondContact O-N 2.85Å; D186-H188 PolarHBondContact O-N 2.92Å; H188-E190 VanDerWaalsContact C-N 3.34Å; H188-M191 PolarHBondContact O-N 3.38Å; H188-E192 IonicContact CE1-OE1 3.84Å; H188-E192 PolarHBondContact CE1-OE1 3.38Å; H188-E192 IonicContact CE1-OE2 3.75Å; H188-E192 PolarHBondContact CE1-OE2 2.69Å; H188-E192 IonicContact ND1-OE1 2.62Å; H188-E192 IonicContact ND1-OE2 3.76Å; H188-E192 PolarHBondContact ND1-OE2 3.48Å; H188-E192 IonicContact NE2-OE1 2.69Å; H188-E192 IonicContact NE2-OE2 3.08Å; H188-E192 WeakPolarHBondContact O-CB 3.42Å; H188-E192 WeakPolarHBondContact O-CG 3.38Å; H188-E192 PolarHBondContact O-N 2.73Å; H188-V248 HydrophobicContact CB-CG1 3.83Å; H188-R249 WeakPolarHBondContact NE2-CB 3.48Å; H188-R249 PolarHBondContact NE2-NE 3.08Å
189E96.4Very high92.3Very high70 Ų7063.1 Ų63.133%0.32731%0.306SS..Hα-helixtrans-70.1-31179-72.3174.3-178.300112.1K185 D186 R193K185-E189 VanDerWaalsContact CE-CD 3.5Å; K185-E189 WeakPolarHBondContact CE-OE1 3.21Å; K185-E189 IonicContact NZ-OE1 3.18Å; K185-E189 IonicContact NZ-OE2 3.61Å; K185-E189 WeakPolarHBondContact O-CG 3.44Å; K185-E189 PolarHBondContact O-N 2.62Å; D186-E189 PolarHBondContact O-N 3.22Å; E189-R193 WeakPolarHBondContact O-CB 3.44Å; E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.36Å; E189-R193 PolarHBondContact O-N 3.38Å; E189-R193 VanDerWaalsContact O-N 3.14Å; E189-R193 PolarHBondContact O-NE 2.96Å
190E96.3Very high90.4Very high108 Ų10864 Ų6451%0.50532%0.32SS..Hα-helixtrans-65.6-50.1170.6-173.9-179.4169.800111.5D186 A187 H188 R193 A194D186-E190 WeakPolarHBondContact O-CB 3.5Å; D186-E190 PolarHBondContact O-N 2.93Å; A187-E190 PolarHBondContact O-N 3.47Å; H188-E190 VanDerWaalsContact C-N 3.34Å; E190-R193 PolarHBondContact O-N 3.29Å; E190-A194 WeakPolarHBondContact O-CB 3.38Å; E190-A194 PolarHBondContact O-N 3.44Å
191M93.6Very high88.2Confident4 Ų470.8 Ų70.82%0.0235%0.346CS..Hα-helixtrans-63.3-43.4178.1-66.817067.900112.3A187 H188 A194 V195 L245 V248 A292 I295A187-M191 WeakPolarHBondContact O-CB 3.4Å; A187-M191 WeakPolarHBondContact O-CG 3.43Å; A187-M191 PolarHBondContact O-N 3.48Å; H188-M191 PolarHBondContact O-N 3.38Å; M191-A194 PolarHBondContact O-N 3.28Å; M191-V195 WeakPolarHBondContact O-CG2 3.36Å; M191-V195 PolarHBondContact O-N 2.98Å; M191-V195 VanDerWaalsContact O-N 3.11Å; M191-L245 HydrophobicContact CB-CD2 3.54Å; M191-L245 HydrophobicContact CE-CD2 3.95Å; M191-L245 HydrophobicContact CE-CG 4.41Å; M191-L245 HydrophobicContact SD-CD2 4.42Å; M191-V248 HydrophobicContact CE-CG2 4.36Å; M191-V248 HydrophobicContact SD-CG2 4.09Å; M191-A292 HydrophobicContact CG-CB 4Å; M191-A292 HydrophobicContact SD-CB 3.61Å; M191-I295 HydrophobicContact CE-CD1 3.22Å; M191-I295 HydrophobicContact CE-CG1 4.46Å
192E93.9Very high86.1Confident51 Ų5171.8 Ų71.824%0.23835%0.353CS..Hα-helixtrans-60.7-47.5177.2-79.1-178.5145.500111.2H188 A194 V195 E196 L245 R249H188-E192 IonicContact CE1-OE1 3.84Å; H188-E192 PolarHBondContact CE1-OE1 3.38Å; H188-E192 IonicContact CE1-OE2 3.75Å; H188-E192 PolarHBondContact CE1-OE2 2.69Å; H188-E192 IonicContact ND1-OE1 2.62Å; H188-E192 IonicContact ND1-OE2 3.76Å; H188-E192 PolarHBondContact ND1-OE2 3.48Å; H188-E192 IonicContact NE2-OE1 2.69Å; H188-E192 IonicContact NE2-OE2 3.08Å; H188-E192 WeakPolarHBondContact O-CB 3.42Å; H188-E192 WeakPolarHBondContact O-CG 3.38Å; H188-E192 PolarHBondContact O-N 2.73Å; E192-A194 VanDerWaalsContact C-N 3.33Å; E192-A194 PolarHBondContact O-N 3.43Å; E192-V195 PolarHBondContact O-N 3.18Å; E192-E196 WeakPolarHBondContact O-CG 3.5Å; E192-E196 PolarHBondContact O-N 3.19Å; E192-L245 HydrophobicContact CG-CD1 4.24Å; E192-L245 HydrophobicContact CG-CD2 3.85Å; E192-R249 IonicContact OE1-CZ 2.95Å; E192-R249 IonicContact OE1-NH2 2.63Å; E192-R249 PolarHBondContact OE1-NH2 3.06Å
193R93.7Very high83.8Confident135 Ų13570.7 Ų70.751%0.50936%0.359SS..Hα-helixtrans-61.4-41.7176.9-77.6-179.7-67.7-178.62.8112.2E189 E190 V195 E196 E197E189-R193 WeakPolarHBondContact O-CB 3.44Å; E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.36Å; E189-R193 PolarHBondContact O-N 3.38Å; E189-R193 VanDerWaalsContact O-N 3.14Å; E189-R193 PolarHBondContact O-NE 2.96Å; E190-R193 PolarHBondContact O-N 3.29Å; R193-V195 VanDerWaalsContact C-N 3.28Å; R193-V195 PolarHBondContact O-N 3.28Å; R193-E196 PolarHBondContact O-N 3.04Å; R193-E197 WeakPolarHBondContact O-CB 3.27Å; R193-E197 VanDerWaalsContact O-CG 3.3Å; R193-E197 WeakPolarHBondContact O-CG 3.44Å; R193-E197 PolarHBondContact O-N 3.22Å
194A90.1Very high81.4Confident21 Ų2170.4 Ų70.417%0.17436%0.363CS..Hα-helixtrans-61-40.1179.200000111.7E190 M191 E192 C198 W233 Y296E190-A194 WeakPolarHBondContact O-CB 3.38Å; E190-A194 PolarHBondContact O-N 3.44Å; M191-A194 PolarHBondContact O-N 3.28Å; E192-A194 VanDerWaalsContact C-N 3.33Å; E192-A194 PolarHBondContact O-N 3.43Å; A194-C198 PolarHBondContact O-N 3.41Å; A194-W233 HydrophobicContact CB-CH2 3.85Å; A194-W233 WeakPolarHBondContact O-CZ3 3.34Å; A194-Y296 HydrophobicContact CB-CE1 3.77Å
195V88.5Confident79Confident50 Ų5076.4 Ų76.430%0.30339%0.394SS..Hα-helixtrans-69.1-40.1175.5176.10000111.9M191 E192 R193 C198 W233 I241 L245M191-V195 WeakPolarHBondContact O-CG2 3.36Å; M191-V195 PolarHBondContact O-N 2.98Å; M191-V195 VanDerWaalsContact O-N 3.11Å; E192-V195 PolarHBondContact O-N 3.18Å; R193-V195 VanDerWaalsContact C-N 3.28Å; R193-V195 PolarHBondContact O-N 3.28Å; V195-C198 WeakPolarHBondContact O-CB 3.36Å; V195-C198 PolarHBondContact O-N 3.39Å; V195-W233 HydrophobicContact CG2-CH2 4.48Å; V195-I241 HydrophobicContact CG2-CD1 4.46Å; V195-I241 HydrophobicContact CG2-CG2 3.66Å; V195-L245 HydrophobicContact CG2-CD1 4.42Å
196E87.2Confident76.6Confident154 Ų15478.1 Ų78.172%0.7241%0.407SS*.Hα-helixtrans-66.9-35.2178-73.2174.9-178.600113.1E192 R193 C198E192-E196 WeakPolarHBondContact O-CG 3.5Å; E192-E196 PolarHBondContact O-N 3.19Å; R193-E196 PolarHBondContact O-N 3.04Å; E196-C198 VanDerWaalsContact C-N 3.27Å
197E84.8Confident74.1Confident158 Ų15880.9 Ų80.974%0.73842%0.422SS*.THydrogen-bonded Turntrans-78.1-10.7178.8-71.4175-170.900113R193 D199R193-E197 WeakPolarHBondContact O-CB 3.27Å; R193-E197 VanDerWaalsContact O-CG 3.3Å; R193-E197 WeakPolarHBondContact O-CG 3.44Å; R193-E197 PolarHBondContact O-N 3.22Å; E197-D199 PolarHBondContact O-N 2.96Å
198C74.9Confident71.6Confident26 Ų2684.9 Ų84.918%0.17645%0.445CS..SBendtrans-67.6115.6176-167.50000110.3A194 V195 E196 P200 W233A194-C198 PolarHBondContact O-N 3.41Å; V195-C198 WeakPolarHBondContact O-CB 3.36Å; V195-C198 PolarHBondContact O-N 3.39Å; E196-C198 VanDerWaalsContact C-N 3.27Å; C198-P200 VanDerWaalsContact O-CD 3.25Å; C198-P200 WeakPolarHBondContact O-CD 3.23Å; C198-W233 HydrophobicContact CB-CE3 4.01Å; C198-W233 HydrophobicContact CB-CZ3 4.12Å
199D62.1Low69.2Low79 Ų7992.5 Ų92.542%0.42249%0.486SS..  trans-65.1116.7-178.7179.111.4000111.2E197 Y201 S202E197-D199 PolarHBondContact O-N 2.96Å; D199-Y201 PolarHBondContact O-N 2.9Å; D199-Y201 VanDerWaalsContact O-N 3.07Å; D199-Y201 PolarHBondContact OD1-N 3.34Å; D199-S202 WeakPolarHBondContact O-CB 3.42Å; D199-S202 PolarHBondContact O-N 3.34Å; D199-S202 PolarHBondContact O-OG 2.96Å
200P57Low67Low107 Ų10797.7 Ų97.770%0.69551%0.51SS*.THydrogen-bonded Turntrans-60-16.7176.1-20.932.6000114.1C198C198-P200 VanDerWaalsContact O-CD 3.25Å; C198-P200 WeakPolarHBondContact O-CD 3.23Å
201Y52.2Low64.5Low151 Ų15199.6 Ų99.659%0.59252%0.523SS*.THydrogen-bonded Turntrans-106.92.3-176.8-64.2-82000114D199 G203 L204D199-Y201 PolarHBondContact O-N 2.9Å; D199-Y201 VanDerWaalsContact O-N 3.07Å; D199-Y201 PolarHBondContact OD1-N 3.34Å; Y201-G203 PolarHBondContact O-N 3.27Å; Y201-L204 HydrophobicContact CD1-CD1 3.79Å; Y201-L204 HydrophobicContact CE1-CD1 4.34Å; Y201-L204 PolarHBondContact O-N 2.75Å
202S54Low61.8Low29 Ų29107.4 Ų107.420%0.20357%0.565CS.*THydrogen-bonded Turntrans-59.4-30.7-178.853.80000113.8D199D199-S202 WeakPolarHBondContact O-CB 3.42Å; D199-S202 PolarHBondContact O-N 3.34Å; D199-S202 PolarHBondContact O-OG 2.96Å
203G50.3Low59.6Low50 Ų50109.3 Ų109.352%0.51558%0.584SS.*THydrogen-bonded Turntrans-78.8-20.9173.900000114.9Y201Y201-G203 PolarHBondContact O-N 3.27Å
204L47.8Very low57.1Low110 Ų110109.4 Ų109.458%0.57660%0.595SS**THydrogen-bonded Turntrans-83.1-24.9-174.9-98.2142.8000113.5Y201 T208Y201-L204 HydrophobicContact CD1-CD1 3.79Å; Y201-L204 HydrophobicContact CE1-CD1 4.34Å; Y201-L204 PolarHBondContact O-N 2.75Å; L204-T208 PolarHBondContact O-OG1 3.5Å
205L47.3Very low54.9Low125 Ų125115 Ų11565%0.65462%0.622SS**SBendtrans-81.9-14.6-179.9-65.7176.9000113.5
206N46.7Very low52.5Low111 Ų111124.1 Ų124.159%0.59465%0.651SS**SBendtrans-81-16.2174.4-75.2-16.7000113.1
207D46.5Very low50.5Low139 Ų139124.1 Ų124.174%0.74366%0.656SS**SBendtrans-98.51-179.2-74.9-16.3000113.5
208T42.7Very low48.3Very low99 Ų99124.3 Ų124.361%0.60766%0.662SS**THydrogen-bonded Turntrans-97.510.3-172.5-13.60000116.5L204L204-T208 PolarHBondContact O-OG1 3.5Å
209D47.3Very low46.9Very low166 Ų166132.1 Ų132.189%0.88870%0.696SS**THydrogen-bonded Turntrans-103.722.1174.5-80.2-20.2000114
210E49.1Very low45.7Very low179 Ų179135.9 Ų135.984%0.83672%0.716SS**  trans-109.267.7166.9-70.4-161.8176.400112.1
211N45.1Very low44.7Very low147 Ų147136.9 Ų136.979%0.78672%0.715SS**  trans17891.1142.2-99-33.7000111.6
212N37.3Very low44.2Very low168 Ų168136.7 Ų136.790%0.89873%0.73SS**  trans-147.594.3138.5-95.7-36.3000108.8D214N212-D214 PolarHBondContact O-N 2.67Å
213S45.9Very low43.6Very low91 Ų91141.6 Ų141.664%0.63675%0.753SS**  trans-57.4118.5162.454.50000110
214D42.7Very low43.2Very low137 Ų137142.2 Ų142.273%0.73376%0.76SS**  171.7124111.9-84.4-19.2000112.8N212N212-D214 PolarHBondContact O-N 2.67Å
215N44Very low42.7Very low140 Ų140146.4 Ų146.475%0.74977%0.773SS**  trans66.7102.2152.3-69-46.2000119.3
216R38.1Very low42.6Very low241 Ų241145.6 Ų145.691%0.90978%0.775SS**  177.8139.898.3-90.9158.6-159.9-1093110.8D218R216-D218 PolarHBondContact O-N 3.12Å
217N44.4Very low42.8Very low153 Ų153144.4 Ų144.482%0.81878%0.776SS**  trans-49.4128.5168.3-57.5-31.2000110.9
218D37.9Very low43.2Very low163 Ų163141.6 Ų141.687%0.87276%0.761SS**  trans-158.1131.5132.9-95.7-28.8000109.1R216 D220R216-D218 PolarHBondContact O-N 3.12Å; D218-D220 PolarHBondContact O-N 3.03Å
219E46.2Very low43.9Very low190 Ų190143.8 Ų143.889%0.88876%0.764SS**  trans-80.197.4177.6-59173.1-17100107.4
220D37.1Very low44.7Very low158 Ų158141.1 Ų141.185%0.84575%0.75SS**  trans-154.9115.3163.8-99.9-26.9000110.5D218D218-D220 PolarHBondContact O-N 3.03Å
221D37.1Very low45.9Very low127 Ų127138.3 Ų138.368%0.67974%0.74SS**  trans46.784.6151.8-140.917.2000117.6L223D221-L223 PolarHBondContact O-N 2.85Å
222V41.3Very low47.7Very low148 Ų148136.2 Ų136.290%0.89772%0.722SS**  trans-68.577159.4-179.80000108.2G224V222-G224 VanDerWaalsContact C-N 3.27Å; V222-G224 PolarHBondContact O-N 3.5Å
223L41.2Very low50.2Low132 Ų132129.7 Ų129.769%0.69169%0.685SS**  trans-69.992.4157.8-69.6175000106.5D221 F225D221-L223 PolarHBondContact O-N 2.85Å; L223-F225 PolarHBondContact O-N 3.05Å
224G40.9Very low52.3Low63 Ų63127.8 Ų127.865%0.64967%0.672SS**  trans-51115.2167.300000108.6V222V222-G224 VanDerWaalsContact C-N 3.27Å; V222-G224 PolarHBondContact O-N 3.5Å
225F38.5Very low54.5Low197 Ų197129.3 Ų129.386%0.86467%0.674SS**  trans-49.4129.8165.1-74.9-88.2000107L223 S227L223-F225 PolarHBondContact O-N 3.05Å; F225-S227 PolarHBondContact O-N 3.18Å
226P45.5Very low56.8Low108 Ų108127.9 Ų127.970%0.70167%0.666SS**  trans-53122.2174.6-19.629.6000107N228P226-N228 PolarHBondContact O-N 3.46Å
227S50.8Low59.4Low86 Ų86117.1 Ų117.160%0.60163%0.627SS**  trans-53.3115.5173.5510000107F225 Q229F225-S227 PolarHBondContact O-N 3.18Å; S227-Q229 PolarHBondContact O-N 3.1Å
228N54.3Low61.7Low81 Ų81114 Ų11443%0.43361%0.607SS.*G310 helixtrans-65.416.3177.4-73-33.1000112.5P226 D230 L231 Y232P226-N228 PolarHBondContact O-N 3.46Å; N228-D230 PolarHBondContact O-N 3.01Å; N228-L231 HydrophobicContact CB-CD1 4.29Å; N228-L231 WeakPolarHBondContact O-CB 3.46Å; N228-L231 PolarHBondContact O-N 3.26Å; N228-Y232 HydrophobicContact CB-CD2 4.38Å; N228-Y232 HydrophobicContact CB-CE2 3.75Å; N228-Y232 WeakPolarHBondContact O-CD2 3.49Å; N228-Y232 WeakPolarHBondContact O-CE2 3.48Å
229Q56.2Low64.4Low145 Ų145110.2 Ų110.268%0.67858%0.584SS**G310 helixtrans-55.8-34.9-176.6-148.683.124.800112.3S227 L231 Y232S227-Q229 PolarHBondContact O-N 3.1Å; Q229-L231 PolarHBondContact O-N 3Å; Q229-Y232 PolarHBondContact O-N 3.33Å
230D65.7Low66.8Low110 Ų110101.2 Ų101.259%0.58854%0.542SS*.G310 helixtrans-74.5-6.1-178.9-64.8-23.5000113.7N228 P297 P298N228-D230 PolarHBondContact O-N 3.01Å; D230-P297 CarbonylContact O-C 3.6Å; D230-P297 WeakPolarHBondContact O-CB 3.33Å; D230-P298 HydrophobicContact CB-CB 4.24Å; D230-P298 WeakPolarHBondContact O-CD 3.42Å
231L74.1Confident69.7Low120 Ų12093.8 Ų93.863%0.62850%0.503SS*.G310 helixtrans-102-4.9-179.1-69.4163.2000113.3N228 Q229N228-L231 HydrophobicContact CB-CD1 4.29Å; N228-L231 WeakPolarHBondContact O-CB 3.46Å; N228-L231 PolarHBondContact O-N 3.26Å; Q229-L231 PolarHBondContact O-N 3Å
232Y82.8Confident72.5Confident103 Ų10393.2 Ų93.240%0.40450%0.499SS..SBendtrans-124154.5-174.8-61.4-72.9000112.1N228 Q229N228-Y232 HydrophobicContact CB-CD2 4.38Å; N228-Y232 HydrophobicContact CB-CE2 3.75Å; N228-Y232 WeakPolarHBondContact O-CD2 3.49Å; N228-Y232 WeakPolarHBondContact O-CE2 3.48Å; Q229-Y232 PolarHBondContact O-N 3.33Å
233W89.8Confident75.2Confident31 Ų3186.6 Ų86.612%0.11746%0.459CS..  trans-80.2129.4167.5-71.5-57000110.6A194 V195 C198 D237 Q238 I241 I295 Y296 P297A194-W233 HydrophobicContact CB-CH2 3.85Å; A194-W233 WeakPolarHBondContact O-CZ3 3.34Å; V195-W233 HydrophobicContact CG2-CH2 4.48Å; C198-W233 HydrophobicContact CB-CE3 4.01Å; C198-W233 HydrophobicContact CB-CZ3 4.12Å; W233-D237 HydrophobicContact CB-CB 3.92Å; W233-D237 HydrophobicContact CG-CB 4.19Å; W233-Q238 HydrophobicContact CB-CG 4.05Å; W233-I241 HydrophobicContact CD2-CD1 3.9Å; W233-I241 HydrophobicContact CG-CD1 3.87Å; W233-I241 HydrophobicContact CZ2-CD1 4.29Å; W233-I295 HydrophobicContact CZ2-CG2 4.26Å; W233-I295 PolarHBondContact NE1-O 3.28Å; W233-Y296 HydrophobicContact CH2-CD1 4.3Å; W233-Y296 HydrophobicContact CH2-CE1 4.36Å; W233-Y296 HydrophobicContact CZ2-CD1 4.05Å; W233-Y296 HydrophobicContact CZ2-CE1 4.44Å; W233-P297 HydrophobicContact CD2-CG 4.07Å; W233-P297 HydrophobicContact CG-CG 4.05Å
234S89.9Confident77.9Confident51 Ų5180.3 Ų80.336%0.35743%0.426SS..  trans-69.9168.7166.1660000111.8D236 D237 Q238S234-D236 VanDerWaalsContact C-N 3.25Å; S234-D236 PolarHBondContact O-N 3.48Å; S234-D237 WeakPolarHBondContact CB-OD2 3.47Å; S234-D237 PolarHBondContact N-OD2 3.05Å; S234-D237 WeakPolarHBondContact O-CB 3.31Å; S234-D237 PolarHBondContact O-N 3.37Å; S234-D237 PolarHBondContact OG-N 3.25Å; S234-D237 VanDerWaalsContact OG-N 3.1Å; S234-D237 PolarHBondContact OG-OD1 2.86Å; S234-D237 PolarHBondContact OG-OD2 3.14Å; S234-Q238 WeakPolarHBondContact O-CG 3.3Å; S234-Q238 PolarHBondContact O-N 2.98Å
235E89.6Confident80.7Confident168 Ų16878.2 Ų78.279%0.78540%0.4SS*.Hα-helixtrans-59.3-39.2172.9-65.3-174.917300111.5D237 Q238 E239E235-D237 VanDerWaalsContact C-N 3.35Å; E235-Q238 PolarHBondContact O-N 3.18Å; E235-E239 PolarHBondContact O-N 3.4Å
236D91.4Very high83.5Confident110 Ų11070.3 Ų70.359%0.58837%0.37SS*.Hα-helixtrans-64.8-39.2176.4-64.8-22000111.4S234 E239 L240S234-D236 VanDerWaalsContact C-N 3.25Å; S234-D236 PolarHBondContact O-N 3.48Å; D236-E239 PolarHBondContact O-N 3.01Å; D236-L240 WeakPolarHBondContact O-CB 3.48Å; D236-L240 PolarHBondContact O-N 3.21Å
237D93.6Very high86Confident15 Ų1565.1 Ų65.18%0.0834%0.337CS..Hα-helixtrans-63-47.2173.5-62-35.8000110.8W233 S234 E235 E239 L240 I241 M299 H301W233-D237 HydrophobicContact CB-CB 3.92Å; W233-D237 HydrophobicContact CG-CB 4.19Å; S234-D237 WeakPolarHBondContact CB-OD2 3.47Å; S234-D237 PolarHBondContact N-OD2 3.05Å; S234-D237 WeakPolarHBondContact O-CB 3.31Å; S234-D237 PolarHBondContact O-N 3.37Å; S234-D237 PolarHBondContact OG-N 3.25Å; S234-D237 VanDerWaalsContact OG-N 3.1Å; S234-D237 PolarHBondContact OG-OD1 2.86Å; S234-D237 PolarHBondContact OG-OD2 3.14Å; E235-D237 VanDerWaalsContact C-N 3.35Å; D237-E239 VanDerWaalsContact C-N 3.3Å; D237-E239 PolarHBondContact O-N 3.4Å; D237-L240 CarbonylContact O-C 3.54Å; D237-L240 PolarHBondContact O-N 3.34Å; D237-L240 VanDerWaalsContact O-N 3.12Å; D237-I241 WeakPolarHBondContact O-CD1 3.3Å; D237-I241 WeakPolarHBondContact O-CG1 3.3Å; D237-I241 PolarHBondContact O-N 3.39Å; D237-M299 HydrophobicContact CB-SD 3.7Å; D237-H301 IonicContact OD1-CD2 3.77Å; D237-H301 PolarHBondContact OD1-CD2 3.46Å; D237-H301 IonicContact OD1-CE1 2.9Å; D237-H301 IonicContact OD1-NE2 4Å; D237-H301 PolarHBondContact OD1-NE2 3.23Å
238Q92.2Very high88.3Confident87 Ų8761 Ų6141%0.40731%0.308SS..Hα-helixtrans-59.8-41.2178.5-70.2-17912.200111.7W233 S234 E235 I241W233-Q238 HydrophobicContact CB-CG 4.05Å; S234-Q238 WeakPolarHBondContact O-CG 3.3Å; S234-Q238 PolarHBondContact O-N 2.98Å; E235-Q238 PolarHBondContact O-N 3.18Å; Q238-I241 PolarHBondContact O-N 3.25Å
239E94.8Very high90.4Very high84 Ų8462.8 Ų62.839%0.39331%0.309SS..Hα-helixtrans-65.1-39.4175.6-167.4176.3-172.700111.9E235 D236 D237 P243 R349 L353E235-E239 PolarHBondContact O-N 3.4Å; D236-E239 PolarHBondContact O-N 3.01Å; D237-E239 VanDerWaalsContact C-N 3.3Å; D237-E239 PolarHBondContact O-N 3.4Å; E239-P243 WeakPolarHBondContact O-CD 3.38Å; E239-R349 IonicContact OE1-CZ 3.55Å; E239-R349 IonicContact OE1-NH2 3.78Å; E239-R349 PolarHBondContact OE1-NH2 3.38Å; E239-L353 HydrophobicContact CG-CD1 4.06Å; E239-L353 HydrophobicContact CG-CD2 4.02Å
240L96.8Very high92.3Very high1 Ų156.4 Ų56.41%0.00528%0.281CS..Hα-helixtrans-70.4-29.9177.8-179.656.7000113.4D236 D237 I242 P243 C244 M299 H301 V304 I350 L353 T354D236-L240 WeakPolarHBondContact O-CB 3.48Å; D236-L240 PolarHBondContact O-N 3.21Å; D237-L240 CarbonylContact O-C 3.54Å; D237-L240 PolarHBondContact O-N 3.34Å; D237-L240 VanDerWaalsContact O-N 3.12Å; L240-I242 VanDerWaalsContact C-N 3.33Å; L240-I242 PolarHBondContact O-N 3.5Å; L240-P243 WeakPolarHBondContact O-CD 3.39Å; L240-P243 VanDerWaalsContact O-CG 3.27Å; L240-P243 WeakPolarHBondContact O-CG 3.47Å; L240-C244 PolarHBondContact O-SG 2.75Å; L240-M299 HydrophobicContact CB-CE 4.24Å; L240-M299 HydrophobicContact CD2-CE 3.61Å; L240-M299 HydrophobicContact CG-CE 3.76Å; L240-H301 HydrophobicContact CD2-CB 4.15Å; L240-V304 HydrophobicContact CD2-CB 4.45Å; L240-V304 HydrophobicContact CD2-CG1 4.14Å; L240-V304 HydrophobicContact CG-CG1 4.25Å; L240-I350 HydrophobicContact CD1-CB 4.49Å; L240-I350 HydrophobicContact CD1-CG1 4.37Å; L240-I350 HydrophobicContact CD1-CG2 4.19Å; L240-L353 HydrophobicContact CB-CD1 4.5Å; L240-L353 HydrophobicContact CD1-CB 4.08Å; L240-L353 HydrophobicContact CD1-CD1 4.33Å; L240-T354 HydrophobicContact CD1-CG2 3.75Å; L240-T354 HydrophobicContact CD2-CG2 3.69Å; L240-T354 HydrophobicContact CG-CG2 4.41Å
241I96.7Very high93.9Very high2 Ų251.1 Ų51.11%0.0125%0.253CS..Hα-helixtrans-67-34.7178.7-71.8164.9000111.8V195 W233 D237 Q238 C244 L245 I295 M299V195-I241 HydrophobicContact CG2-CD1 4.46Å; V195-I241 HydrophobicContact CG2-CG2 3.66Å; W233-I241 HydrophobicContact CD2-CD1 3.9Å; W233-I241 HydrophobicContact CG-CD1 3.87Å; W233-I241 HydrophobicContact CZ2-CD1 4.29Å; D237-I241 WeakPolarHBondContact O-CD1 3.3Å; D237-I241 WeakPolarHBondContact O-CG1 3.3Å; D237-I241 PolarHBondContact O-N 3.39Å; Q238-I241 PolarHBondContact O-N 3.25Å; I241-C244 WeakPolarHBondContact O-CA 3.38Å; I241-C244 WeakPolarHBondContact O-CB 3.45Å; I241-C244 PolarHBondContact O-N 3.33Å; I241-L245 HydrophobicContact CG2-CD1 3.82Å; I241-L245 HydrophobicContact CG2-CG 4.01Å; I241-L245 PolarHBondContact O-N 3.48Å; I241-I295 HydrophobicContact CD1-CG2 3.85Å; I241-I295 HydrophobicContact CG1-CG2 3.65Å; I241-I295 HydrophobicContact CG2-CG2 4.47Å; I241-M299 HydrophobicContact CD1-SD 4.37Å; I241-M299 HydrophobicContact CG1-CE 4.08Å; I241-M299 HydrophobicContact CG1-SD 4.17Å
242I96.9Very high95Very high116 Ų11647.3 Ų47.360%0.59523%0.231SC*.Hα-helixtrans-53.2-55.9-178.8-63.9166.2000112.5L240 C244 L245 A246L240-I242 VanDerWaalsContact C-N 3.33Å; L240-I242 PolarHBondContact O-N 3.5Å; I242-C244 VanDerWaalsContact C-N 3.28Å; I242-C244 PolarHBondContact O-N 3.06Å; I242-L245 PolarHBondContact O-N 3.29Å; I242-A246 PolarHBondContact O-N 3.03Å; I242-A246 VanDerWaalsContact O-N 3.09Å
243P98.1Very high95.7Very high9 Ų944.3 Ų44.36%0.05823%0.227CC..Hα-helixtrans-69.4-23.6177.630.3-38.7000113.2E239 L240 L247 R349 I350 L353E239-P243 WeakPolarHBondContact O-CD 3.38Å; L240-P243 WeakPolarHBondContact O-CD 3.39Å; L240-P243 VanDerWaalsContact O-CG 3.27Å; L240-P243 WeakPolarHBondContact O-CG 3.47Å; P243-L247 WeakPolarHBondContact O-CB 3.44Å; P243-L247 PolarHBondContact O-N 3.44Å; P243-R349 HydrophobicContact CB-CB 3.98Å; P243-R349 HydrophobicContact CB-CG 3.89Å; P243-R349 HydrophobicContact CG-CB 4.43Å; P243-R349 HydrophobicContact CG-CG 3.95Å; P243-I350 HydrophobicContact CB-CD1 4.41Å; P243-I350 HydrophobicContact CB-CG1 3.83Å; P243-I350 HydrophobicContact CG-CG1 3.75Å; P243-L353 HydrophobicContact CG-CD1 4.13Å
244C98.3Very high96Very high0 Ų042.9 Ų42.90%022%0.222CC..Hα-helixtrans-68.3-47.2173.2-630000111.7L240 I241 I242 A246 L247 V248 L291 I295 V304L240-C244 PolarHBondContact O-SG 2.75Å; I241-C244 WeakPolarHBondContact O-CA 3.38Å; I241-C244 WeakPolarHBondContact O-CB 3.45Å; I241-C244 PolarHBondContact O-N 3.33Å; I242-C244 VanDerWaalsContact C-N 3.28Å; I242-C244 PolarHBondContact O-N 3.06Å; C244-A246 VanDerWaalsContact C-N 3.3Å; C244-A246 PolarHBondContact O-N 2.9Å; C244-L247 WeakPolarHBondContact O-CB 3.44Å; C244-L247 PolarHBondContact O-N 3.21Å; C244-L247 VanDerWaalsContact O-N 3.09Å; C244-V248 WeakPolarHBondContact O-CG2 3.35Å; C244-V248 PolarHBondContact O-N 2.82Å; C244-L291 HydrophobicContact CB-CD2 4.49Å; C244-I295 HydrophobicContact CB-CD1 3.56Å; C244-V304 VanDerWaalsContact SG-CG1 3.57Å
245L97.8Very high96.4Very high19 Ų1940.4 Ų40.410%0.09921%0.205CC..Hα-helixtrans-58.1-43.3172.9-80.9173.3000111.4M191 E192 V195 I241 I242 L247 V248 R249M191-L245 HydrophobicContact CB-CD2 3.54Å; M191-L245 HydrophobicContact CE-CD2 3.95Å; M191-L245 HydrophobicContact CE-CG 4.41Å; M191-L245 HydrophobicContact SD-CD2 4.42Å; E192-L245 HydrophobicContact CG-CD1 4.24Å; E192-L245 HydrophobicContact CG-CD2 3.85Å; V195-L245 HydrophobicContact CG2-CD1 4.42Å; I241-L245 HydrophobicContact CG2-CD1 3.82Å; I241-L245 HydrophobicContact CG2-CG 4.01Å; I241-L245 PolarHBondContact O-N 3.48Å; I242-L245 PolarHBondContact O-N 3.29Å; L245-L247 VanDerWaalsContact C-N 3.3Å; L245-L247 PolarHBondContact O-N 2.97Å; L245-V248 PolarHBondContact O-N 3.34Å; L245-R249 WeakPolarHBondContact O-CB 3.03Å; L245-R249 PolarHBondContact O-N 2.93Å
246A98.2Very high96.8Very high30 Ų3037.2 Ų37.225%0.24819%0.188CC..Hα-helixtrans-61.2-38.1175.200000112.4I242 C244 R249 A250I242-A246 PolarHBondContact O-N 3.03Å; I242-A246 VanDerWaalsContact O-N 3.09Å; C244-A246 VanDerWaalsContact C-N 3.3Å; C244-A246 PolarHBondContact O-N 2.9Å; A246-R249 WeakPolarHBondContact O-CB 3.4Å; A246-R249 PolarHBondContact O-N 2.87Å; A246-A250 WeakPolarHBondContact O-CB 3.36Å; A246-A250 PolarHBondContact O-N 2.92Å
247L98.6Very high96.9Very high0 Ų035.3 Ų35.30%018%0.175CC..Hα-helixtrans-67.2-42.4175.6-178.661.5000112.2P243 C244 L245 R249 A250 S251 L291 L311 V312 L315 I343 C346 I350P243-L247 WeakPolarHBondContact O-CB 3.44Å; P243-L247 PolarHBondContact O-N 3.44Å; C244-L247 WeakPolarHBondContact O-CB 3.44Å; C244-L247 PolarHBondContact O-N 3.21Å; C244-L247 VanDerWaalsContact O-N 3.09Å; L245-L247 VanDerWaalsContact C-N 3.3Å; L245-L247 PolarHBondContact O-N 2.97Å; L247-R249 VanDerWaalsContact C-N 3.31Å; L247-R249 PolarHBondContact O-N 3.45Å; L247-A250 WeakPolarHBondContact O-CB 3.46Å; L247-A250 PolarHBondContact O-N 3.39Å; L247-S251 PolarHBondContact O-N 3.4Å; L247-S251 PolarHBondContact O-OG 2.87Å; L247-L291 HydrophobicContact CD2-CD2 4.22Å; L247-L311 HydrophobicContact CD2-CD2 3.97Å; L247-L311 HydrophobicContact CD2-CG 4.41Å; L247-L311 HydrophobicContact CG-CD2 3.88Å; L247-L311 HydrophobicContact CG-CG 4.42Å; L247-V312 HydrophobicContact CD1-CG2 3.84Å; L247-V312 HydrophobicContact CD2-CG2 4.01Å; L247-L315 HydrophobicContact CD1-CD1 4.12Å; L247-I343 HydrophobicContact CD1-CG2 4.03Å; L247-C346 HydrophobicContact CB-CB 4.05Å; L247-C346 HydrophobicContact CD1-CB 4.38Å; L247-I350 HydrophobicContact CD2-CD1 4.24Å
248V98.4Very high97.1Very high0 Ų034.6 Ų34.60%017%0.171CC..Hα-helixtrans-62.5-40.8173.6178.70000110.4V184 H188 M191 C244 L245 A250 S251 K252 V288 L291V184-V248 HydrophobicContact CG1-CG1 3.98Å; H188-V248 HydrophobicContact CB-CG1 3.83Å; M191-V248 HydrophobicContact CE-CG2 4.36Å; M191-V248 HydrophobicContact SD-CG2 4.09Å; C244-V248 WeakPolarHBondContact O-CG2 3.35Å; C244-V248 PolarHBondContact O-N 2.82Å; L245-V248 PolarHBondContact O-N 3.34Å; V248-A250 VanDerWaalsContact C-N 3.35Å; V248-A250 PolarHBondContact O-N 3.21Å; V248-S251 VanDerWaalsContact O-CB 3.24Å; V248-S251 WeakPolarHBondContact O-CB 3.09Å; V248-S251 PolarHBondContact O-N 3.18Å; V248-S251 VanDerWaalsContact O-N 3.12Å; V248-K252 PolarHBondContact O-N 3.38Å; V248-V288 HydrophobicContact CG1-CG1 3.73Å; V248-V288 HydrophobicContact CG2-CG1 4.17Å; V248-L291 HydrophobicContact CG2-CD2 4.02Å
249R97.8Very high97.3Very high117 Ų11734.2 Ų34.244%0.44217%0.166SC..Hα-helixtrans-61-42.3174.1-163.8178.6-64.8148.5-5.5112.4H188 E192 L245 A246 L247 S251 K252 A253H188-R249 WeakPolarHBondContact NE2-CB 3.48Å; H188-R249 PolarHBondContact NE2-NE 3.08Å; E192-R249 IonicContact OE1-CZ 2.95Å; E192-R249 IonicContact OE1-NH2 2.63Å; E192-R249 PolarHBondContact OE1-NH2 3.06Å; L245-R249 WeakPolarHBondContact O-CB 3.03Å; L245-R249 PolarHBondContact O-N 2.93Å; A246-R249 WeakPolarHBondContact O-CB 3.4Å; A246-R249 PolarHBondContact O-N 2.87Å; L247-R249 VanDerWaalsContact C-N 3.31Å; L247-R249 PolarHBondContact O-N 3.45Å; R249-S251 VanDerWaalsContact C-N 3.31Å; R249-K252 PolarHBondContact O-N 2.9Å; R249-A253 PolarHBondContact O-N 2.89Å
250A97.6Very high97.4Very high11 Ų1132.7 Ų32.79%0.09116%0.16CC..Hα-helixtrans-63.9-36.9174.400000111.6A246 L247 V248 A253 C254 I343A246-A250 WeakPolarHBondContact O-CB 3.36Å; A246-A250 PolarHBondContact O-N 2.92Å; L247-A250 WeakPolarHBondContact O-CB 3.46Å; L247-A250 PolarHBondContact O-N 3.39Å; V248-A250 VanDerWaalsContact C-N 3.35Å; V248-A250 PolarHBondContact O-N 3.21Å; A250-A253 WeakPolarHBondContact O-CB 3.28Å; A250-A253 PolarHBondContact O-N 3.3Å; A250-C254 PolarHBondContact O-N 3.49Å; A250-C254 PolarHBondContact O-SG 3.12Å; A250-I343 HydrophobicContact CB-CG1 4.11Å
251S98.3Very high97.3Very high0 Ų033.3 Ų33.30%016%0.163CC..Hα-helixtrans-59.6-48.2174.9-52.90000111.6L247 V248 R249 A253 C254 L255 L315L247-S251 PolarHBondContact O-N 3.4Å; L247-S251 PolarHBondContact O-OG 2.87Å; V248-S251 VanDerWaalsContact O-CB 3.24Å; V248-S251 WeakPolarHBondContact O-CB 3.09Å; V248-S251 PolarHBondContact O-N 3.18Å; V248-S251 VanDerWaalsContact O-N 3.12Å; R249-S251 VanDerWaalsContact C-N 3.31Å; S251-A253 VanDerWaalsContact C-N 3.33Å; S251-A253 PolarHBondContact O-N 3.08Å; S251-C254 WeakPolarHBondContact O-CB 3.46Å; S251-C254 PolarHBondContact O-N 3.06Å; S251-L255 PolarHBondContact O-N 3.45Å; S251-L315 WeakPolarHBondContact OG-CD1 3.47Å
252K97.9Very high97.3Very high40 Ų4033.2 Ų33.217%0.17416%0.163CC..Hα-helixtrans-57.8-44172.8-176.6169.865.1-169.50111.9V181 V184 K185 V248 R249 C254 L255 K256V181-K252 HydrophobicContact CG1-CG 4.49Å; V184-K252 HydrophobicContact CG1-CB 3.92Å; K185-K252 HydrophobicContact CB-CD 3.74Å; K185-K252 HydrophobicContact CG-CD 4.15Å; V248-K252 PolarHBondContact O-N 3.38Å; R249-K252 PolarHBondContact O-N 2.9Å; K252-C254 PolarHBondContact O-N 3.45Å; K252-L255 PolarHBondContact O-N 3.12Å; K252-K256 HydrophobicContact CG-CD 4.17Å; K252-K256 HydrophobicContact CG-CG 4.49Å; K252-K256 WeakPolarHBondContact O-CB 3.36Å; K252-K256 WeakPolarHBondContact O-CG 3.05Å; K252-K256 PolarHBondContact O-N 3.36Å
253A96.6Very high97.4Very high39 Ų3930 Ų3032%0.32215%0.153SC..Hα-helixtrans-62.7-40.9178.800000112.2R249 A250 S251 K256 K257 L339R249-A253 PolarHBondContact O-N 2.89Å; A250-A253 WeakPolarHBondContact O-CB 3.28Å; A250-A253 PolarHBondContact O-N 3.3Å; S251-A253 VanDerWaalsContact C-N 3.33Å; S251-A253 PolarHBondContact O-N 3.08Å; A253-K256 PolarHBondContact O-N 3.25Å; A253-K257 WeakPolarHBondContact O-CB 3.49Å; A253-K257 PolarHBondContact O-N 2.89Å; A253-L339 HydrophobicContact CB-CD2 4.29Å
254C96.8Very high97.2Very high1 Ų135.7 Ų35.71%0.00718%0.179CC..Hα-helixtrans-59.6-54.7174.8-65.80000111A250 S251 K252 K256 K257 I258 L315 L319 L339A250-C254 PolarHBondContact O-N 3.49Å; A250-C254 PolarHBondContact O-SG 3.12Å; S251-C254 WeakPolarHBondContact O-CB 3.46Å; S251-C254 PolarHBondContact O-N 3.06Å; K252-C254 PolarHBondContact O-N 3.45Å; C254-K256 PolarHBondContact O-N 3.5Å; C254-K257 PolarHBondContact O-N 2.95Å; C254-K257 VanDerWaalsContact O-N 3.08Å; C254-I258 VanDerWaalsContact O-CG1 3.3Å; C254-I258 WeakPolarHBondContact O-CG1 3.46Å; C254-I258 PolarHBondContact O-N 3.17Å; C254-L315 HydrophobicContact CB-CD2 4.17Å; C254-L319 HydrophobicContact CB-CD2 4.23Å; C254-L339 HydrophobicContact CB-CD1 4.28Å; C254-L339 VanDerWaalsContact SG-CD1 3.55Å
255L98.1Very high97.1Very high0 Ų038.2 Ų38.20%019%0.192CC..Hα-helixtrans-57.6-45.2178.9-77167.9000112.3L177 N180 V181 V184 S251 K252 K257 I258 R259 I284L177-L255 HydrophobicContact CD2-CD2 4.42Å; N180-L255 HydrophobicContact CB-CD1 4.02Å; N180-L255 HydrophobicContact CB-CD2 4.03Å; V181-L255 HydrophobicContact CG2-CB 3.59Å; V184-L255 HydrophobicContact CB-CD1 4.35Å; V184-L255 HydrophobicContact CG2-CD1 3.77Å; S251-L255 PolarHBondContact O-N 3.45Å; K252-L255 PolarHBondContact O-N 3.12Å; L255-K257 VanDerWaalsContact C-N 3.26Å; L255-K257 PolarHBondContact O-N 3.34Å; L255-I258 PolarHBondContact O-N 3.33Å; L255-R259 WeakPolarHBondContact O-CB 3.4Å; L255-R259 PolarHBondContact O-N 3.5Å; L255-I284 HydrophobicContact CD1-CB 4.34Å; L255-I284 HydrophobicContact CD1-CD1 4.49Å; L255-I284 HydrophobicContact CD1-CG2 3.85Å; L255-I284 HydrophobicContact CD2-CD1 3.7Å; L255-I284 HydrophobicContact CG-CD1 3.89Å; L255-I284 HydrophobicContact CG-CG2 4.35Å
256K97.3Very high97Very high101 Ų10137.6 Ų37.644%0.43919%0.191SC..Hα-helixtrans-58.4-41176.4-77.9-178.970.1173.60111.7V181 K252 A253 C254 I260V181-K256 HydrophobicContact CB-CG 4.45Å; V181-K256 HydrophobicContact CG1-CD 4.24Å; V181-K256 HydrophobicContact CG1-CG 3.65Å; V181-K256 HydrophobicContact CG2-CG 3.82Å; K252-K256 HydrophobicContact CG-CD 4.17Å; K252-K256 HydrophobicContact CG-CG 4.49Å; K252-K256 WeakPolarHBondContact O-CB 3.36Å; K252-K256 WeakPolarHBondContact O-CG 3.05Å; K252-K256 PolarHBondContact O-N 3.36Å; A253-K256 PolarHBondContact O-N 3.25Å; C254-K256 PolarHBondContact O-N 3.5Å; K256-I260 VanDerWaalsContact O-CG1 3.28Å; K256-I260 WeakPolarHBondContact O-CG1 3.3Å; K256-I260 PolarHBondContact O-N 2.93Å
257K95.3Very high96.9Very high69 Ų6941.7 Ų41.730%0.320%0.203SC..Hα-helixtrans-77.2-37.8-176.7-165.163.2178173.40112.4A253 C254 L255 R259 I260 L261 W335A253-K257 WeakPolarHBondContact O-CB 3.49Å; A253-K257 PolarHBondContact O-N 2.89Å; C254-K257 PolarHBondContact O-N 2.95Å; C254-K257 VanDerWaalsContact O-N 3.08Å; L255-K257 VanDerWaalsContact C-N 3.26Å; L255-K257 PolarHBondContact O-N 3.34Å; K257-R259 VanDerWaalsContact C-N 3.33Å; K257-R259 PolarHBondContact O-N 3.12Å; K257-I260 HydrophobicContact CD-CD1 4.4Å; K257-I260 PolarHBondContact O-N 3.02Å; K257-L261 PolarHBondContact O-N 3Å; K257-W335 HydrophobicContact CB-CD2 4.39Å; K257-W335 HydrophobicContact CB-CE3 4.2Å; K257-W335 HydrophobicContact CB-CH2 3.7Å; K257-W335 HydrophobicContact CB-CZ2 3.95Å; K257-W335 HydrophobicContact CB-CZ3 3.86Å; K257-W335 HydrophobicContact CD-CD2 4.16Å; K257-W335 HydrophobicContact CD-CG 4.35Å; K257-W335 HydrophobicContact CD-CZ2 4.43Å; K257-W335 VanDerWaalsContact CE-CG 3.47Å; K257-W335 HydrophobicContact CG-CD2 3.33Å; K257-W335 HydrophobicContact CG-CE3 3.59Å; K257-W335 HydrophobicContact CG-CG 4.02Å; K257-W335 HydrophobicContact CG-CH2 3.48Å; K257-W335 VanDerWaalsContact CG-CH2 3.48Å; K257-W335 HydrophobicContact CG-CZ2 3.24Å; K257-W335 HydrophobicContact CG-CZ3 3.66Å
258I96.4Very high96.7Very high0 Ų047.1 Ų47.10%023%0.227CC..Hα-helixtrans-55.9-49.6168.2-66.5169.4000109.7L177 C254 L255 I260 L261 V262 I277 A318 T322L177-I258 HydrophobicContact CD1-CG2 4.15Å; L177-I258 HydrophobicContact CD2-CG2 3.96Å; C254-I258 VanDerWaalsContact O-CG1 3.3Å; C254-I258 WeakPolarHBondContact O-CG1 3.46Å; C254-I258 PolarHBondContact O-N 3.17Å; L255-I258 PolarHBondContact O-N 3.33Å; I258-I260 VanDerWaalsContact C-N 3.32Å; I258-I260 PolarHBondContact O-N 3.14Å; I258-L261 PolarHBondContact O-N 3.48Å; I258-L261 VanDerWaalsContact O-N 3.14Å; I258-V262 HydrophobicContact CG2-CG2 4.4Å; I258-V262 WeakPolarHBondContact O-CG2 3.42Å; I258-V262 PolarHBondContact O-N 2.99Å; I258-I277 HydrophobicContact CG2-CG2 3.56Å; I258-A318 HydrophobicContact CD1-CB 4.19Å; I258-T322 HydrophobicContact CG1-CG2 4.15Å; I258-T322 HydrophobicContact CG2-CG2 4.43Å
259R97.8Very high96.5Very high80 Ų8052.5 Ų52.530%0.30226%0.255SS..Hα-helixtrans-55.7-44.4176.7-169.3-160.174.71805.6112.6L174 L177 T178 L255 K257 V262 A263L174-R259 HydrophobicContact CD2-CG 4.05Å; L177-R259 HydrophobicContact CB-CB 4.07Å; L177-R259 HydrophobicContact CB-CG 4.03Å; L177-R259 HydrophobicContact CD1-CB 4.45Å; T178-R259 WeakPolarHBondContact OG1-CD 3.32Å; L255-R259 WeakPolarHBondContact O-CB 3.4Å; L255-R259 PolarHBondContact O-N 3.5Å; K257-R259 VanDerWaalsContact C-N 3.33Å; K257-R259 PolarHBondContact O-N 3.12Å; R259-V262 PolarHBondContact O-N 3.4Å; R259-A263 WeakPolarHBondContact O-CB 3.36Å; R259-A263 PolarHBondContact O-N 3.1Å
260I95.9Very high96.4Very high52 Ų5249.8 Ų49.827%0.26725%0.247SC..Hα-helixtrans-60.8-46.6177.6-71.4164.1000110.6K256 K257 I258 V262 A263 E264K256-I260 VanDerWaalsContact O-CG1 3.28Å; K256-I260 WeakPolarHBondContact O-CG1 3.3Å; K256-I260 PolarHBondContact O-N 2.93Å; K257-I260 HydrophobicContact CD-CD1 4.4Å; K257-I260 PolarHBondContact O-N 3.02Å; I258-I260 VanDerWaalsContact C-N 3.32Å; I258-I260 PolarHBondContact O-N 3.14Å; I260-V262 PolarHBondContact O-N 3.37Å; I260-A263 WeakPolarHBondContact O-CB 3.42Å; I260-A263 PolarHBondContact O-N 3.02Å; I260-A263 VanDerWaalsContact O-N 3.14Å; I260-E264 HydrophobicContact CG2-CG 4.32Å; I260-E264 WeakPolarHBondContact CG2-OE1 3.28Å; I260-E264 WeakPolarHBondContact O-CG 3.4Å; I260-E264 PolarHBondContact O-N 3.4Å
261L95Very high96.3Very high13 Ų1350.7 Ų50.77%0.06825%0.252CS..Hα-helixtrans-63.3-42.4178.1-69.5-175.5000112.6K257 I258 A263 E264 N265 G266 T322 V327 W335K257-L261 PolarHBondContact O-N 3Å; I258-L261 PolarHBondContact O-N 3.48Å; I258-L261 VanDerWaalsContact O-N 3.14Å; L261-A263 VanDerWaalsContact C-N 3.26Å; L261-A263 PolarHBondContact O-N 3.31Å; L261-E264 PolarHBondContact O-N 2.95Å; L261-N265 WeakPolarHBondContact O-CA 3.42Å; L261-N265 WeakPolarHBondContact O-CB 3.28Å; L261-N265 PolarHBondContact O-N 2.63Å; L261-G266 PolarHBondContact O-N 2.93Å; L261-T322 HydrophobicContact CD1-CG2 3.91Å; L261-V327 HydrophobicContact CB-CB 4.2Å; L261-V327 HydrophobicContact CB-CG2 3.89Å; L261-V327 HydrophobicContact CD1-CG2 4.33Å; L261-W335 HydrophobicContact CD1-CZ2 3.55Å; L261-W335 HydrophobicContact CG-CZ2 4.23Å
262V97.2Very high96.3Very high1 Ų153.9 Ų53.91%0.00628%0.278CS..Hα-helixtrans-61.9-38.1175174.60000110.4K170 A173 L174 L177 I258 R259 I260 G266 L274 I277 V327K170-V262 WeakPolarHBondContact CE-O 3.34Å; A173-V262 HydrophobicContact CB-CG1 4.41Å; L174-V262 HydrophobicContact CD2-CB 4.1Å; L174-V262 HydrophobicContact CD2-CG1 3.83Å; L174-V262 HydrophobicContact CG-CG1 4.07Å; L177-V262 HydrophobicContact CD1-CB 4.12Å; L177-V262 HydrophobicContact CD1-CG1 4.37Å; L177-V262 HydrophobicContact CD1-CG2 3.81Å; I258-V262 HydrophobicContact CG2-CG2 4.4Å; I258-V262 WeakPolarHBondContact O-CG2 3.42Å; I258-V262 PolarHBondContact O-N 2.99Å; R259-V262 PolarHBondContact O-N 3.4Å; I260-V262 PolarHBondContact O-N 3.37Å; V262-G266 WeakPolarHBondContact O-CA 3.34Å; V262-G266 PolarHBondContact O-N 2.9Å; V262-L274 HydrophobicContact CG1-CD2 3.9Å; V262-I277 HydrophobicContact CG2-CD1 4.34Å; V262-I277 HydrophobicContact CG2-CG2 4.22Å; V262-V327 HydrophobicContact CG2-CG1 4.19Å
263A97.4Very high96.3Very high47 Ų4754.9 Ų54.939%0.38828%0.283SS..Hα-helixtrans-65.7-50.4178.300000111.7K170 L174 R259 I260 L261K170-A263 WeakPolarHBondContact CE-O 3.39Å; K170-A263 PolarHBondContact NZ-O 2.78Å; L174-A263 HydrophobicContact CD1-CB 4.46Å; L174-A263 HydrophobicContact CD2-CB 3.81Å; R259-A263 WeakPolarHBondContact O-CB 3.36Å; R259-A263 PolarHBondContact O-N 3.1Å; I260-A263 WeakPolarHBondContact O-CB 3.42Å; I260-A263 PolarHBondContact O-N 3.02Å; I260-A263 VanDerWaalsContact O-N 3.14Å; L261-A263 VanDerWaalsContact C-N 3.26Å; L261-A263 PolarHBondContact O-N 3.31Å
264E95.1Very high96.3Very high130 Ų13053 Ų5361%0.60727%0.268SS*.Hα-helixtrans-72.4-48.1-175.4-68.8173.9171.300112.2I260 L261I260-E264 HydrophobicContact CG2-CG 4.32Å; I260-E264 WeakPolarHBondContact CG2-OE1 3.28Å; I260-E264 WeakPolarHBondContact O-CG 3.4Å; I260-E264 PolarHBondContact O-N 3.4Å; L261-E264 PolarHBondContact O-N 2.95Å
265N95.5Very high96.4Very high52 Ų5253.7 Ų53.728%0.27827%0.272SS..Hα-helixtrans-112.4-13.5-166.9-57.9-37.8000113.8L261 K267 V327 P329L261-N265 WeakPolarHBondContact O-CA 3.42Å; L261-N265 WeakPolarHBondContact O-CB 3.28Å; L261-N265 PolarHBondContact O-N 2.63Å; N265-K267 PolarHBondContact O-N 3.49Å; N265-V327 HydrophobicContact CB-CB 4.33Å; N265-V327 VanDerWaalsContact CB-O 3.29Å; N265-V327 WeakPolarHBondContact CB-O 3.49Å; N265-V327 PolarHBondContact ND2-O 3.15Å; N265-P329 WeakPolarHBondContact ND2-CD 3.46Å
266G96.2Very high96.4Very high6 Ų657.9 Ų57.96%0.06229%0.294CS..  trans-60.6134.9-178.600000112.3K170 L261 V262 H326K170-G266 VanDerWaalsContact CD-O 3.29Å; K170-G266 WeakPolarHBondContact CD-O 3.15Å; K170-G266 VanDerWaalsContact CE-O 3.24Å; K170-G266 WeakPolarHBondContact CE-O 3.42Å; K170-G266 PolarHBondContact NZ-O 3.31Å; L261-G266 PolarHBondContact O-N 2.93Å; V262-G266 WeakPolarHBondContact O-CA 3.34Å; V262-G266 PolarHBondContact O-N 2.9Å; G266-H326 WeakPolarHBondContact CA-NE2 3.4Å
267K96.1Very high96.5Very high117 Ų11753.1 Ų53.151%0.50927%0.274SS..  trans-115.6142178.9-54.9-179.9179.5173.30110.9N265 D269 Q270 L274 H326N265-K267 PolarHBondContact O-N 3.49Å; K267-D269 VanDerWaalsContact C-N 3.29Å; K267-D269 WeakPolarHBondContact CB-OD1 3.44Å; K267-D269 PolarHBondContact O-N 2.96Å; K267-Q270 HydrophobicContact CB-CG 4.01Å; K267-Q270 PolarHBondContact O-N 2.96Å; K267-L274 WeakPolarHBondContact O-CD1 3.39Å; K267-H326 PolarHBondContact N-NE2 3.35Å
268K94.3Very high96.6Very high114 Ų11449.9 Ų49.950%0.49626%0.259SS..THydrogen-bonded Turntrans-69-26.9-172.4-61.6-174-178.2-164.30113.4D168 K170 Q270 V271D168-K268 HydrophobicContact CB-CD 4.18Å; D168-K268 IonicContact OD1-NZ 3.39Å; D168-K268 WeakPolarHBondContact OD2-CE 3.28Å; D168-K268 IonicContact OD2-NZ 2.87Å; D168-K268 PolarHBondContact OD2-NZ 3.47Å; K170-K268 HydrophobicContact CB-CG 4.2Å; K268-Q270 VanDerWaalsContact C-N 3.33Å; K268-V271 WeakPolarHBondContact O-CG2 3.21Å
269D93.1Very high96.7Very high113 Ų11354.2 Ų54.260%0.60428%0.283SS*.THydrogen-bonded Turntrans-75.6-19.2176.856.6-61.2000113.1K267 V271K267-D269 VanDerWaalsContact C-N 3.29Å; K267-D269 WeakPolarHBondContact CB-OD1 3.44Å; K267-D269 PolarHBondContact O-N 2.96Å; D269-V271 PolarHBondContact O-N 3.21Å
270Q95.8Very high96.7Very high59 Ų5950.6 Ų50.628%0.27627%0.269SS..  trans-87.351.2-178.7-61.5-62.7-34.300111.5K267 K268 A272 Q273 L274 H326K267-Q270 HydrophobicContact CB-CG 4.01Å; K267-Q270 PolarHBondContact O-N 2.96Å; K268-Q270 VanDerWaalsContact C-N 3.33Å; Q270-A272 PolarHBondContact O-N 2.96Å; Q270-Q273 PolarHBondContact O-N 3.24Å; Q270-L274 WeakPolarHBondContact O-CG 3.43Å; Q270-L274 PolarHBondContact O-N 3.47Å; Q270-H326 WeakPolarHBondContact CB-CE1 3.39Å; Q270-H326 WeakPolarHBondContact CB-ND1 3.5Å; Q270-H326 HydrophobicContact CG-CB 4.24Å
271V96.8Very high96.8Very high30 Ų3048.1 Ų48.118%0.18226%0.256CS..Hα-helixtrans-56-51.6-171.5175.60000112.2N169 K268 D269 Q273 L274 D275N169-V271 PolarHBondContact ND2-O 3.28Å; K268-V271 WeakPolarHBondContact O-CG2 3.21Å; D269-V271 PolarHBondContact O-N 3.21Å; V271-Q273 PolarHBondContact O-N 2.87Å; V271-L274 PolarHBondContact O-N 3.27Å; V271-D275 PolarHBondContact O-N 2.84Å
272A97.1Very high96.9Very high67 Ų6749.9 Ų49.955%0.55426%0.264SS*.Hα-helixtrans-60.3-45.9-177.800000112.2Q270 L274 D275 D276Q270-A272 PolarHBondContact O-N 2.96Å; A272-L274 VanDerWaalsContact C-N 3.32Å; A272-L274 PolarHBondContact O-N 3.38Å; A272-D275 PolarHBondContact O-N 3.24Å; A272-D275 VanDerWaalsContact O-N 3.15Å; A272-D276 VanDerWaalsContact O-CG 3.22Å; A272-D276 PolarHBondContact O-N 2.9Å
273Q97.7Very high97Very high61 Ų6153.3 Ų53.329%0.28528%0.28SS..Hα-helixtrans-67.5-32.5179.8-64.4-171.84.600112.7Q270 V271 I277 H326Q270-Q273 PolarHBondContact O-N 3.24Å; V271-Q273 PolarHBondContact O-N 2.87Å; Q273-I277 WeakPolarHBondContact O-CD1 3.38Å; Q273-I277 VanDerWaalsContact O-CG1 3.22Å; Q273-I277 WeakPolarHBondContact O-CG1 3.24Å; Q273-I277 PolarHBondContact O-N 3.47Å; Q273-I277 VanDerWaalsContact O-N 3.16Å; Q273-H326 VanDerWaalsContact OE1-CB 3.27Å; Q273-H326 PolarHBondContact OE1-ND1 2.89Å
274L98.5Very high97Very high1 Ų151.1 Ų51.11%0.00526%0.262CS..Hα-helixtrans-66.8-41.4172.4-69.9172.2000111.2N169 K170 A173 V262 K267 Q270 V271 A272 I277 V278N169-L274 HydrophobicContact CB-CD1 4.48Å; K170-L274 HydrophobicContact CB-CD1 4.02Å; A173-L274 HydrophobicContact CB-CB 4.49Å; V262-L274 HydrophobicContact CG1-CD2 3.9Å; K267-L274 WeakPolarHBondContact O-CD1 3.39Å; Q270-L274 WeakPolarHBondContact O-CG 3.43Å; Q270-L274 PolarHBondContact O-N 3.47Å; V271-L274 PolarHBondContact O-N 3.27Å; A272-L274 VanDerWaalsContact C-N 3.32Å; A272-L274 PolarHBondContact O-N 3.38Å; L274-I277 PolarHBondContact O-N 3.45Å; L274-V278 VanDerWaalsContact O-CG2 3.28Å; L274-V278 WeakPolarHBondContact O-CG2 3.31Å; L274-V278 PolarHBondContact O-N 3.42Å; L274-V278 VanDerWaalsContact O-N 3.09Å
275D98.4Very high97.1Very high14 Ų1446 Ų468%0.07524%0.241CC..Hα-helixtrans-64.2-43.9175.5-74.2-29.7000111.4I112 T113 N169 V271 A272 I277 V278 D279I112-D275 WeakPolarHBondContact CB-OD2 3.48Å; I112-D275 PolarHBondContact N-OD1 3.41Å; I112-D275 PolarHBondContact N-OD2 3.46Å; T113-D275 VanDerWaalsContact CB-OD1 3.27Å; T113-D275 WeakPolarHBondContact CB-OD1 3.46Å; T113-D275 PolarHBondContact N-OD1 2.82Å; T113-D275 PolarHBondContact OG1-OD1 2.76Å; N169-D275 VanDerWaalsContact ND2-CG 3.33Å; N169-D275 PolarHBondContact ND2-OD1 3.46Å; N169-D275 PolarHBondContact OD1-OD1 3.35Å; V271-D275 PolarHBondContact O-N 2.84Å; A272-D275 PolarHBondContact O-N 3.24Å; A272-D275 VanDerWaalsContact O-N 3.15Å; D275-I277 VanDerWaalsContact C-N 3.33Å; D275-I277 PolarHBondContact O-N 3.07Å; D275-V278 PolarHBondContact O-N 2.91Å; D275-V278 VanDerWaalsContact O-N 3.17Å; D275-D279 WeakPolarHBondContact O-CB 3.33Å; D275-D279 PolarHBondContact O-N 3.22Å
276D98.3Very high97.3Very high89 Ų8946.9 Ų46.948%0.47625%0.249SC..Hα-helixtrans-59.1-42177.5-65.5-27.3000112.1A272 I280 I321A272-D276 VanDerWaalsContact O-CG 3.22Å; A272-D276 PolarHBondContact O-N 2.9Å; D276-I280 WeakPolarHBondContact O-CG2 3.24Å; D276-I280 PolarHBondContact O-N 3.17Å; D276-I321 HydrophobicContact CB-CG2 4.26Å
277I98.3Very high97.4Very high1 Ų147.4 Ų47.41%0.00525%0.252CS..Hα-helixtrans-65.3-42.8176.7-68.7163.8000110.9I258 V262 Q273 L274 D275 I280 S281 I321 S325 V327I258-I277 HydrophobicContact CG2-CG2 3.56Å; V262-I277 HydrophobicContact CG2-CD1 4.34Å; V262-I277 HydrophobicContact CG2-CG2 4.22Å; Q273-I277 WeakPolarHBondContact O-CD1 3.38Å; Q273-I277 VanDerWaalsContact O-CG1 3.22Å; Q273-I277 WeakPolarHBondContact O-CG1 3.24Å; Q273-I277 PolarHBondContact O-N 3.47Å; Q273-I277 VanDerWaalsContact O-N 3.16Å; L274-I277 PolarHBondContact O-N 3.45Å; D275-I277 VanDerWaalsContact C-N 3.33Å; D275-I277 PolarHBondContact O-N 3.07Å; I277-I280 WeakPolarHBondContact O-CG2 3.29Å; I277-S281 VanDerWaalsContact O-CB 3.23Å; I277-S281 WeakPolarHBondContact O-CB 3.44Å; I277-S281 PolarHBondContact O-N 3.03Å; I277-S281 VanDerWaalsContact O-N 3.12Å; I277-S281 PolarHBondContact O-OG 3.04Å; I277-I321 HydrophobicContact CG1-CG2 4.19Å; I277-S325 WeakPolarHBondContact CD1-OG 3.48Å; I277-V327 HydrophobicContact CD1-CG1 3.94Å; I277-V327 HydrophobicContact CD1-CG2 4.13Å
278V98.4Very high97.5Very high0 Ų041.9 Ų41.90%023%0.228CC..Hα-helixtrans-67.5-45.4-179.9172.40000110.4T113 A173 M176 L274 D275 I280 S281 E282T113-V278 HydrophobicContact CG2-CB 4.48Å; T113-V278 HydrophobicContact CG2-CG1 3.9Å; T113-V278 HydrophobicContact CG2-CG2 4.27Å; A173-V278 HydrophobicContact CB-CG2 3.44Å; A173-V278 VanDerWaalsContact CB-CG2 3.44Å; M176-V278 HydrophobicContact CB-CG1 3.93Å; M176-V278 HydrophobicContact CG-CG1 3.71Å; L274-V278 VanDerWaalsContact O-CG2 3.28Å; L274-V278 WeakPolarHBondContact O-CG2 3.31Å; L274-V278 PolarHBondContact O-N 3.42Å; L274-V278 VanDerWaalsContact O-N 3.09Å; D275-V278 PolarHBondContact O-N 2.91Å; D275-V278 VanDerWaalsContact O-N 3.17Å; V278-I280 PolarHBondContact O-N 3.39Å; V278-S281 CarbonylContact O-C 3.56Å; V278-S281 WeakPolarHBondContact O-CA 3.42Å; V278-S281 WeakPolarHBondContact O-CB 3.47Å; V278-S281 PolarHBondContact O-N 3.42Å; V278-E282 HydrophobicContact CG1-CG 4.17Å; V278-E282 WeakPolarHBondContact O-CG 3.22Å; V278-E282 PolarHBondContact O-N 3.39Å
279D98Very high97.6Very high92 Ų9240.5 Ų40.549%0.49223%0.226SC..Hα-helixtrans-56.7-50.9-177.6-164.959000111.4D275 S281 E282D275-D279 WeakPolarHBondContact O-CB 3.33Å; D275-D279 PolarHBondContact O-N 3.22Å; D279-S281 VanDerWaalsContact C-N 3.3Å; D279-S281 PolarHBondContact O-N 3.2Å; D279-E282 PolarHBondContact O-N 3.12Å
280I98.1Very high97.9Very high3 Ų338.6 Ų38.62%0.01522%0.216CC..Hα-helixtrans-68-29.8176-170.654.3000113D276 I277 V278 E282 E283 V314 K317 A318 I321D276-I280 WeakPolarHBondContact O-CG2 3.24Å; D276-I280 PolarHBondContact O-N 3.17Å; I277-I280 WeakPolarHBondContact O-CG2 3.29Å; V278-I280 PolarHBondContact O-N 3.39Å; I280-E282 VanDerWaalsContact C-N 3.35Å; I280-E283 HydrophobicContact CD1-CB 4.49Å; I280-E283 HydrophobicContact CD1-CG 4.41Å; I280-E283 PolarHBondContact O-N 3.12Å; I280-V314 HydrophobicContact CD1-CG1 4.28Å; I280-K317 HydrophobicContact CD1-CB 4.09Å; I280-K317 HydrophobicContact CD1-CD 3.54Å; I280-K317 HydrophobicContact CD1-CG 3.76Å; I280-K317 HydrophobicContact CG1-CB 4.3Å; I280-K317 HydrophobicContact CG1-CD 4.33Å; I280-K317 HydrophobicContact CG1-CG 4.02Å; I280-A318 HydrophobicContact CG1-CB 3.84Å; I280-A318 HydrophobicContact CG2-CB 4.08Å; I280-I321 HydrophobicContact CB-CD1 3.86Å; I280-I321 HydrophobicContact CG1-CD1 4.05Å; I280-I321 HydrophobicContact CG2-CB 4.33Å; I280-I321 HydrophobicContact CG2-CD1 3.86Å; I280-I321 HydrophobicContact CG2-CG2 4.31Å
281S98.2Very high98Very high0 Ų035.8 Ų35.80%020%0.203CC..Hα-helixtrans-73.4-27.6177.8-61.50000112.5L177 N180 I277 V278 D279 E283 I284L177-S281 WeakPolarHBondContact CD2-OG 3.43Å; N180-S281 PolarHBondContact ND2-O 3.39Å; I277-S281 VanDerWaalsContact O-CB 3.23Å; I277-S281 WeakPolarHBondContact O-CB 3.44Å; I277-S281 PolarHBondContact O-N 3.03Å; I277-S281 VanDerWaalsContact O-N 3.12Å; I277-S281 PolarHBondContact O-OG 3.04Å; V278-S281 CarbonylContact O-C 3.56Å; V278-S281 WeakPolarHBondContact O-CA 3.42Å; V278-S281 WeakPolarHBondContact O-CB 3.47Å; V278-S281 PolarHBondContact O-N 3.42Å; D279-S281 VanDerWaalsContact C-N 3.3Å; D279-S281 PolarHBondContact O-N 3.2Å; S281-E283 VanDerWaalsContact C-N 3.27Å; S281-I284 PolarHBondContact O-N 3.28Å
282E97.4Very high98Very high50 Ų5034.7 Ų34.723%0.23420%0.197CC..Hα-helixtrans-67.1-26.8173.5-74.2-175.915500111.6K116 M176 N180 V278 D279 I280 I284 P286K116-E282 IonicContact NZ-OE2 3.38Å; K116-E282 PolarHBondContact NZ-OE2 3.02Å; M176-E282 WeakPolarHBondContact CE-OE1 3.4Å; M176-E282 HydrophobicContact CG-CG 4.05Å; M176-E282 WeakPolarHBondContact CG-OE1 3.41Å; M176-E282 VanDerWaalsContact SD-OE1 3.42Å; N180-E282 PolarHBondContact ND2-N 2.97Å; V278-E282 HydrophobicContact CG1-CG 4.17Å; V278-E282 WeakPolarHBondContact O-CG 3.22Å; V278-E282 PolarHBondContact O-N 3.39Å; D279-E282 PolarHBondContact O-N 3.12Å; I280-E282 VanDerWaalsContact C-N 3.35Å; E282-I284 VanDerWaalsContact C-N 3.29Å; E282-I284 PolarHBondContact O-N 2.85Å; E282-P286 WeakPolarHBondContact O-CD 3.33Å
283E98.2Very high98Very high74 Ų7436.8 Ų36.835%0.34620%0.198SC..THydrogen-bonded Turntrans-70.4-20.5176-64.3-177.4-14600113.5I280 S281 S287 V314 K317I280-E283 HydrophobicContact CD1-CB 4.49Å; I280-E283 HydrophobicContact CD1-CG 4.41Å; I280-E283 PolarHBondContact O-N 3.12Å; S281-E283 VanDerWaalsContact C-N 3.27Å; E283-S287 WeakPolarHBondContact O-CB 3.27Å; E283-S287 PolarHBondContact O-N 3.43Å; E283-S287 PolarHBondContact O-OG 2.98Å; E283-V314 HydrophobicContact CB-CG1 3.66Å; E283-V314 HydrophobicContact CB-CG2 4.47Å; E283-K317 IonicContact OE1-NZ 3.18Å; E283-K317 PolarHBondContact OE1-NZ 3.37Å
284I98.3Very high97.9Very high0 Ų034.6 Ų34.60%019%0.19CC..Hα-helixtrans-68.8-43.4-176.3-65.2169.8000111.1V184 L255 S281 E282 S287 V288 L311 V314 L315 A318V184-I284 HydrophobicContact CG2-CG2 4.3Å; L255-I284 HydrophobicContact CD1-CB 4.34Å; L255-I284 HydrophobicContact CD1-CD1 4.49Å; L255-I284 HydrophobicContact CD1-CG2 3.85Å; L255-I284 HydrophobicContact CD2-CD1 3.7Å; L255-I284 HydrophobicContact CG-CD1 3.89Å; L255-I284 HydrophobicContact CG-CG2 4.35Å; S281-I284 PolarHBondContact O-N 3.28Å; E282-I284 VanDerWaalsContact C-N 3.29Å; E282-I284 PolarHBondContact O-N 2.85Å; I284-S287 PolarHBondContact O-N 2.88Å; I284-V288 HydrophobicContact CG2-CG2 4.29Å; I284-V288 WeakPolarHBondContact O-CG2 3.3Å; I284-V288 PolarHBondContact O-N 3.47Å; I284-L311 HydrophobicContact CG2-CD1 4.29Å; I284-V314 HydrophobicContact CG1-CG1 3.66Å; I284-L315 HydrophobicContact CD1-CD2 3.88Å; I284-L315 HydrophobicContact CG1-CD2 4.11Å; I284-L315 HydrophobicContact CG2-CD2 4.05Å; I284-A318 HydrophobicContact CD1-CB 4Å
285S97.4Very high97.7Very high24 Ų2434.7 Ų34.717%0.16819%0.19CC..Hα-helixtrans-64.6-47.9-175-166.70000112.6F183 S287 V288 D289F183-S285 WeakPolarHBondContact CB-OG 3.42Å; S285-S287 VanDerWaalsContact C-N 3.28Å; S285-S287 PolarHBondContact O-N 3.25Å; S285-V288 PolarHBondContact O-N 3.19Å; S285-D289 PolarHBondContact O-N 2.93Å
286P97.9Very high97.4Very high70 Ų7037.3 Ų37.346%0.45520%0.199SC..Hα-helixtrans-61.6-34.8173.4-23.735.1000113.1E282 V288 D289 D290E282-P286 WeakPolarHBondContact O-CD 3.33Å; P286-V288 VanDerWaalsContact C-N 3.32Å; P286-V288 PolarHBondContact O-N 3.01Å; P286-D289 WeakPolarHBondContact O-CB 3.48Å; P286-D289 PolarHBondContact O-N 3.25Å; P286-D290 WeakPolarHBondContact O-CB 3.4Å; P286-D290 PolarHBondContact O-N 3.47Å
287S98.4Very high97Very high16 Ų1634.9 Ų34.911%0.11219%0.189CC..Hα-helixtrans-67.9-33.1177-58.80000112.7E283 I284 S285 L291E283-S287 WeakPolarHBondContact O-CB 3.27Å; E283-S287 PolarHBondContact O-N 3.43Å; E283-S287 PolarHBondContact O-OG 2.98Å; I284-S287 PolarHBondContact O-N 2.88Å; S285-S287 VanDerWaalsContact C-N 3.28Å; S285-S287 PolarHBondContact O-N 3.25Å; S287-L291 PolarHBondContact O-N 3.5Å
288V98.5Very high96.7Very high1 Ų139.3 Ų39.31%0.00622%0.218CC..Hα-helixtrans-70-42.5171.7166.90000110.6V184 A187 V248 I284 S285 P286 L291 A292 L311V184-V288 HydrophobicContact CG1-CG1 4.38Å; V184-V288 HydrophobicContact CG1-CG2 4.12Å; V184-V288 HydrophobicContact CG2-CB 4.4Å; V184-V288 HydrophobicContact CG2-CG2 4.07Å; A187-V288 HydrophobicContact CB-CG1 3.91Å; V248-V288 HydrophobicContact CG1-CG1 3.73Å; V248-V288 HydrophobicContact CG2-CG1 4.17Å; I284-V288 HydrophobicContact CG2-CG2 4.29Å; I284-V288 WeakPolarHBondContact O-CG2 3.3Å; I284-V288 PolarHBondContact O-N 3.47Å; S285-V288 PolarHBondContact O-N 3.19Å; P286-V288 VanDerWaalsContact C-N 3.32Å; P286-V288 PolarHBondContact O-N 3.01Å; V288-L291 PolarHBondContact O-N 2.84Å; V288-A292 WeakPolarHBondContact O-CB 3.37Å; V288-A292 PolarHBondContact O-N 3.23Å; V288-L311 HydrophobicContact CG2-CD1 3.8Å; V288-L311 HydrophobicContact CG2-CD2 3.94Å
289D97.9Very high96.4Very high86 Ų8640.4 Ų40.446%0.4622%0.223SC..Hα-helixtrans-60.6-48.3177.2-166.662.3000111.5S285 P286 L291 A292 L293S285-D289 PolarHBondContact O-N 2.93Å; P286-D289 WeakPolarHBondContact O-CB 3.48Å; P286-D289 PolarHBondContact O-N 3.25Å; D289-L291 VanDerWaalsContact C-N 3.26Å; D289-L291 PolarHBondContact O-N 3.26Å; D289-A292 PolarHBondContact O-N 2.85Å; D289-A292 VanDerWaalsContact O-N 3.14Å; D289-L293 WeakPolarHBondContact O-CB 3.41Å; D289-L293 WeakPolarHBondContact O-CG 3.41Å; D289-L293 PolarHBondContact O-N 3.31Å
290D98.1Very high96.3Very high72 Ų7238.9 Ų38.939%0.38522%0.219SC..Hα-helixtrans-56.8-38.5174.4-78.2-13.4000112.4P286 S294 N307P286-D290 WeakPolarHBondContact O-CB 3.4Å; P286-D290 PolarHBondContact O-N 3.47Å; D290-S294 WeakPolarHBondContact O-CB 3.46Å; D290-S294 PolarHBondContact O-N 3.48Å; D290-S294 PolarHBondContact O-OG 3.14Å; D290-N307 PolarHBondContact O-ND2 2.94Å
291L98.3Very high96.2Very high0 Ų040.1 Ų40.10%022%0.224CC..Hα-helixtrans-69.9-47.8175.9176.959.1000111C244 L247 V248 S287 V288 D289 L293 S294 I295 V304 N307 S308 L311C244-L291 HydrophobicContact CB-CD2 4.49Å; L247-L291 HydrophobicContact CD2-CD2 4.22Å; V248-L291 HydrophobicContact CG2-CD2 4.02Å; S287-L291 PolarHBondContact O-N 3.5Å; V288-L291 PolarHBondContact O-N 2.84Å; D289-L291 VanDerWaalsContact C-N 3.26Å; D289-L291 PolarHBondContact O-N 3.26Å; L291-L293 PolarHBondContact O-N 3.22Å; L291-S294 PolarHBondContact O-N 3.4Å; L291-S294 VanDerWaalsContact O-N 3.15Å; L291-S294 PolarHBondContact O-OG 3.4Å; L291-I295 HydrophobicContact CD1-CD1 4Å; L291-I295 HydrophobicContact CD1-CG1 4.49Å; L291-I295 HydrophobicContact CG-CD1 3.98Å; L291-I295 WeakPolarHBondContact O-CD1 3.47Å; L291-I295 WeakPolarHBondContact O-CG1 3.41Å; L291-I295 PolarHBondContact O-N 2.97Å; L291-V304 HydrophobicContact CD1-CG1 4.15Å; L291-N307 HydrophobicContact CB-CB 4.44Å; L291-N307 HydrophobicContact CD1-CB 4.43Å; L291-S308 VanDerWaalsContact CD1-OG 3.27Å; L291-S308 WeakPolarHBondContact CD1-OG 3.23Å; L291-L311 HydrophobicContact CD2-CD2 3.75Å
292A96.8Very high96.1Very high8 Ų843.2 Ų43.27%0.06624%0.24CC..Hα-helixtrans-58.5-48.2179.300000111.2M191 V288 D289 S294 I295 Y296M191-A292 HydrophobicContact CG-CB 4Å; M191-A292 HydrophobicContact SD-CB 3.61Å; V288-A292 WeakPolarHBondContact O-CB 3.37Å; V288-A292 PolarHBondContact O-N 3.23Å; D289-A292 PolarHBondContact O-N 2.85Å; D289-A292 VanDerWaalsContact O-N 3.14Å; A292-S294 VanDerWaalsContact C-N 3.25Å; A292-S294 PolarHBondContact O-N 3.48Å; A292-I295 WeakPolarHBondContact O-CB 3.47Å; A292-I295 PolarHBondContact O-N 3.5Å; A292-Y296 WeakPolarHBondContact O-CD2 3.48Å
293L96Very high96.1Very high110 Ų11043.5 Ų43.558%0.57625%0.246SC*.Hα-helixtrans-60.6-33.8177-70.1173.2000112.6D289 L291 I295D289-L293 WeakPolarHBondContact O-CB 3.41Å; D289-L293 WeakPolarHBondContact O-CG 3.41Å; D289-L293 PolarHBondContact O-N 3.31Å; L291-L293 PolarHBondContact O-N 3.22Å; L293-I295 VanDerWaalsContact C-N 3.25Å; L293-I295 PolarHBondContact O-N 2.91Å
294S96.3Very high96.1Very high15 Ų1540 Ų4011%0.10523%0.229CC..Hα-helixtrans-75.4-12.7177.769.10000114.6D290 L291 A292 V304D290-S294 WeakPolarHBondContact O-CB 3.46Å; D290-S294 PolarHBondContact O-N 3.48Å; D290-S294 PolarHBondContact O-OG 3.14Å; L291-S294 PolarHBondContact O-N 3.4Å; L291-S294 VanDerWaalsContact O-N 3.15Å; L291-S294 PolarHBondContact O-OG 3.4Å; A292-S294 VanDerWaalsContact C-N 3.25Å; A292-S294 PolarHBondContact O-N 3.48Å; S294-V304 VanDerWaalsContact O-CG2 3.23Å; S294-V304 WeakPolarHBondContact O-CG2 3.32Å
295I94.1Very high96.1Very high3 Ų341.6 Ų41.62%0.01524%0.236CC..Hα-helixtrans-86.7-29.7-178.9-76.9161.4000111.6M191 W233 I241 C244 L291 A292 L293 M299 V304M191-I295 HydrophobicContact CE-CD1 3.22Å; M191-I295 HydrophobicContact CE-CG1 4.46Å; W233-I295 HydrophobicContact CZ2-CG2 4.26Å; W233-I295 PolarHBondContact NE1-O 3.28Å; I241-I295 HydrophobicContact CD1-CG2 3.85Å; I241-I295 HydrophobicContact CG1-CG2 3.65Å; I241-I295 HydrophobicContact CG2-CG2 4.47Å; C244-I295 HydrophobicContact CB-CD1 3.56Å; L291-I295 HydrophobicContact CD1-CD1 4Å; L291-I295 HydrophobicContact CD1-CG1 4.49Å; L291-I295 HydrophobicContact CG-CD1 3.98Å; L291-I295 WeakPolarHBondContact O-CD1 3.47Å; L291-I295 WeakPolarHBondContact O-CG1 3.41Å; L291-I295 PolarHBondContact O-N 2.97Å; A292-I295 WeakPolarHBondContact O-CB 3.47Å; A292-I295 PolarHBondContact O-N 3.5Å; L293-I295 VanDerWaalsContact C-N 3.25Å; L293-I295 PolarHBondContact O-N 2.91Å; I295-M299 HydrophobicContact CG1-CE 3.98Å; I295-V304 HydrophobicContact CG1-CG2 4.36Å
296Y92.7Very high96.1Very high69 Ų6944.3 Ų44.327%0.27125%0.247SC..SBendtrans-66.3145.4179.7-71-82.4000112.4A194 W233 A292A194-Y296 HydrophobicContact CB-CE1 3.77Å; W233-Y296 HydrophobicContact CH2-CD1 4.3Å; W233-Y296 HydrophobicContact CH2-CE1 4.36Å; W233-Y296 HydrophobicContact CZ2-CD1 4.05Å; W233-Y296 HydrophobicContact CZ2-CE1 4.44Å; A292-Y296 WeakPolarHBondContact O-CD2 3.48Å
297P89.6Confident96.1Very high39 Ų3941.8 Ų41.825%0.25323%0.23SC..SBendtrans-61.3147.3-179.9-24.735.9000113.6D230 W233D230-P297 CarbonylContact O-C 3.6Å; D230-P297 WeakPolarHBondContact O-CB 3.33Å; W233-P297 HydrophobicContact CD2-CG 4.07Å; W233-P297 HydrophobicContact CG-CG 4.05Å
298P91.5Very high96.1Very high94 Ų9441 Ų4161%0.6122%0.224SC*.SBendcis-74.3125.4-7.229.1-33.3000111.5D230D230-P298 HydrophobicContact CB-CB 4.24Å; D230-P298 WeakPolarHBondContact O-CD 3.42Å
299M93.1Very high96.1Very high23 Ų2343.1 Ų43.111%0.11324%0.242CC..PPolyproline II helixtrans-81.8124.6-172.5-173.6174.7-176.900111.3D237 L240 I241 I295 V304D237-M299 HydrophobicContact CB-SD 3.7Å; L240-M299 HydrophobicContact CB-CE 4.24Å; L240-M299 HydrophobicContact CD2-CE 3.61Å; L240-M299 HydrophobicContact CG-CE 3.76Å; I241-M299 HydrophobicContact CD1-SD 4.37Å; I241-M299 HydrophobicContact CG1-CE 4.08Å; I241-M299 HydrophobicContact CG1-SD 4.17Å; I295-M299 HydrophobicContact CG1-CE 3.98Å; M299-V304 HydrophobicContact CE-CB 4.08Å; M299-V304 HydrophobicContact CE-CG1 3.8Å; M299-V304 HydrophobicContact CE-CG2 3.43Å; M299-V304 VanDerWaalsContact CE-CG2 3.43Å; M299-V304 HydrophobicContact CG-CG2 3.95Å
300C94.9Very high96.2Very high60 Ų6044 Ų4441%0.40524%0.242SC..  trans-100.2105.3174.2177.90000110.4L302 T303 V304C300-L302 VanDerWaalsContact C-N 3.28Å; C300-L302 PolarHBondContact O-N 2.89Å; C300-T303 WeakPolarHBondContact O-CA 3.35Å; C300-T303 WeakPolarHBondContact O-CB 2.86Å; C300-T303 PolarHBondContact O-N 3.09Å; C300-T303 PolarHBondContact SG-OG1 3.41Å; C300-V304 WeakPolarHBondContact O-CG2 3.46Å; C300-V304 PolarHBondContact O-N 2.95Å
301H96.1Very high96.2Very high28 Ų2840.6 Ų40.613%0.1322%0.223CC..Hα-helixtrans-55.2-40.6-176.6-76.7-143.8000113.1D237 L240 V304 R305 T354 E357D237-H301 IonicContact OD1-CD2 3.77Å; D237-H301 PolarHBondContact OD1-CD2 3.46Å; D237-H301 IonicContact OD1-CE1 2.9Å; D237-H301 IonicContact OD1-NE2 4Å; D237-H301 PolarHBondContact OD1-NE2 3.23Å; L240-H301 HydrophobicContact CD2-CB 4.15Å; H301-V304 PolarHBondContact O-N 3.1Å; H301-R305 WeakPolarHBondContact O-CB 3.21Å; H301-R305 PolarHBondContact O-N 2.89Å; H301-T354 HydrophobicContact CB-CG2 4.05Å; H301-E357 HydrophobicContact CB-CG 3.82Å
302L96.4Very high96.2Very high65 Ų6541.1 Ų41.134%0.3423%0.227SC..Hα-helixtrans-62.6-42.4175.3-179.160.6000112.2C300 R305 I306 L358C300-L302 VanDerWaalsContact C-N 3.28Å; C300-L302 PolarHBondContact O-N 2.89Å; L302-R305 PolarHBondContact O-N 3.46Å; L302-I306 HydrophobicContact CD1-CD1 4.22Å; L302-I306 HydrophobicContact CG-CD1 4.06Å; L302-I306 VanDerWaalsContact O-CG1 3.29Å; L302-I306 WeakPolarHBondContact O-CG1 3.39Å; L302-I306 PolarHBondContact O-N 2.97Å; L302-L358 HydrophobicContact CD1-CD2 3.89Å
303T97.5Very high96.3Very high56 Ų5644.4 Ų44.434%0.34425%0.249SC..Hα-helixtrans-65.2-43.6178.1-600000110.8C300 R305 I306 N307C300-T303 WeakPolarHBondContact O-CA 3.35Å; C300-T303 WeakPolarHBondContact O-CB 2.86Å; C300-T303 PolarHBondContact O-N 3.09Å; C300-T303 PolarHBondContact SG-OG1 3.41Å; T303-R305 VanDerWaalsContact C-N 3.34Å; T303-R305 PolarHBondContact O-N 3.44Å; T303-I306 PolarHBondContact O-N 2.95Å; T303-N307 PolarHBondContact O-N 3.09Å
304V98.1Very high96.4Very high0 Ų039.8 Ų39.80%023%0.226CC..Hα-helixtrans-60.3-44.1176.6172.80000110.8L240 C244 L291 S294 I295 M299 C300 H301 I306 N307 S308L240-V304 HydrophobicContact CD2-CB 4.45Å; L240-V304 HydrophobicContact CD2-CG1 4.14Å; L240-V304 HydrophobicContact CG-CG1 4.25Å; C244-V304 VanDerWaalsContact SG-CG1 3.57Å; L291-V304 HydrophobicContact CD1-CG1 4.15Å; S294-V304 VanDerWaalsContact O-CG2 3.23Å; S294-V304 WeakPolarHBondContact O-CG2 3.32Å; I295-V304 HydrophobicContact CG1-CG2 4.36Å; M299-V304 HydrophobicContact CE-CB 4.08Å; M299-V304 HydrophobicContact CE-CG1 3.8Å; M299-V304 HydrophobicContact CE-CG2 3.43Å; M299-V304 VanDerWaalsContact CE-CG2 3.43Å; M299-V304 HydrophobicContact CG-CG2 3.95Å; C300-V304 WeakPolarHBondContact O-CG2 3.46Å; C300-V304 PolarHBondContact O-N 2.95Å; H301-V304 PolarHBondContact O-N 3.1Å; V304-I306 PolarHBondContact O-N 3.22Å; V304-N307 PolarHBondContact O-N 3.42Å; V304-S308 WeakPolarHBondContact O-CB 3.42Å; V304-S308 PolarHBondContact O-N 3.31Å; V304-S308 PolarHBondContact O-OG 3.17Å
305R98.1Very high96.5Very high35 Ų3539.1 Ų39.113%0.13222%0.221CC..Hα-helixtrans-59.5-45.6174.7-173.3-171.3-177.2116.5-8.5111.8H301 L302 T303 A309 M347 I350 K351 T354 L358H301-R305 WeakPolarHBondContact O-CB 3.21Å; H301-R305 PolarHBondContact O-N 2.89Å; L302-R305 PolarHBondContact O-N 3.46Å; T303-R305 VanDerWaalsContact C-N 3.34Å; T303-R305 PolarHBondContact O-N 3.44Å; R305-A309 WeakPolarHBondContact O-CB 3.49Å; R305-A309 PolarHBondContact O-N 3.37Å; R305-M347 HydrophobicContact CG-CE 4.22Å; R305-I350 HydrophobicContact CB-CG2 4.47Å; R305-I350 HydrophobicContact CG-CG2 4.49Å; R305-K351 VanDerWaalsContact NH1-CA 3.35Å; R305-K351 PolarHBondContact NH1-O 2.89Å; R305-T354 HydrophobicContact CB-CG2 4.42Å; R305-T354 WeakPolarHBondContact CD-OG1 3.49Å; R305-T354 PolarHBondContact NH1-O 3.02Å; R305-T354 PolarHBondContact NH1-OG1 2.97Å; R305-L358 VanDerWaalsContact NH2-CD1 3.26Å
306I98.1Very high96.7Very high81 Ų8142.3 Ų42.342%0.41523%0.234SC..Hα-helixtrans-64.1-49.2179.8-70.7165.3000110.8L302 T303 V304 S308 A309 K310L302-I306 HydrophobicContact CD1-CD1 4.22Å; L302-I306 HydrophobicContact CG-CD1 4.06Å; L302-I306 VanDerWaalsContact O-CG1 3.29Å; L302-I306 WeakPolarHBondContact O-CG1 3.39Å; L302-I306 PolarHBondContact O-N 2.97Å; T303-I306 PolarHBondContact O-N 2.95Å; V304-I306 PolarHBondContact O-N 3.22Å; I306-S308 PolarHBondContact O-N 2.9Å; I306-A309 PolarHBondContact O-N 3.27Å; I306-K310 HydrophobicContact CG2-CD 4.46Å; I306-K310 WeakPolarHBondContact O-CG 3.48Å; I306-K310 PolarHBondContact O-N 2.82Å
307N98.5Very high96.9Very high16 Ų1643.5 Ų43.59%0.08624%0.241CC..Hα-helixtrans-67.3-37.2-178.5-72-9.6000111.6D290 L291 T303 V304 A309 K310 L311D290-N307 PolarHBondContact O-ND2 2.94Å; L291-N307 HydrophobicContact CB-CB 4.44Å; L291-N307 HydrophobicContact CD1-CB 4.43Å; T303-N307 PolarHBondContact O-N 3.09Å; V304-N307 PolarHBondContact O-N 3.42Å; N307-A309 PolarHBondContact O-N 3.4Å; N307-K310 PolarHBondContact O-N 3.38Å; N307-K310 PolarHBondContact OD1-NZ 3.25Å; N307-K310 VanDerWaalsContact OD1-NZ 3.14Å; N307-L311 PolarHBondContact O-N 2.96Å
308S98.6Very high97.3Very high0 Ų041.7 Ų41.70%023%0.229CC..Hα-helixtrans-60.5-44.5171.7-61.60000112.1L291 V304 I306 K310 L311 V312L291-S308 VanDerWaalsContact CD1-OG 3.27Å; L291-S308 WeakPolarHBondContact CD1-OG 3.23Å; V304-S308 WeakPolarHBondContact O-CB 3.42Å; V304-S308 PolarHBondContact O-N 3.31Å; V304-S308 PolarHBondContact O-OG 3.17Å; I306-S308 PolarHBondContact O-N 2.9Å; S308-K310 PolarHBondContact O-N 3.02Å; S308-L311 PolarHBondContact O-N 2.85Å; S308-V312 VanDerWaalsContact O-CG2 3.22Å; S308-V312 WeakPolarHBondContact O-CG2 3.36Å; S308-V312 PolarHBondContact O-N 3.2Å
309A98.4Very high97.5Very high45 Ų4537.2 Ų37.237%0.37220%0.2SC..Hα-helixtrans-64.9-38.4177.900000112.5R305 I306 N307 V312 S313 M347R305-A309 WeakPolarHBondContact O-CB 3.49Å; R305-A309 PolarHBondContact O-N 3.37Å; I306-A309 PolarHBondContact O-N 3.27Å; N307-A309 PolarHBondContact O-N 3.4Å; A309-V312 PolarHBondContact O-N 2.86Å; A309-S313 PolarHBondContact O-N 2.88Å; A309-M347 HydrophobicContact CB-CE 4.07Å; A309-M347 HydrophobicContact CB-SD 4.24Å
310K98.5Very high97.6Very high105 Ų10542.6 Ų42.646%0.45723%0.225SC..Hα-helixtrans-60.6-50.1172.5-69.7173.2-172.4162.60110.8I306 N307 S308 V312 S313 V314I306-K310 HydrophobicContact CG2-CD 4.46Å; I306-K310 WeakPolarHBondContact O-CG 3.48Å; I306-K310 PolarHBondContact O-N 2.82Å; N307-K310 PolarHBondContact O-N 3.38Å; N307-K310 PolarHBondContact OD1-NZ 3.25Å; N307-K310 VanDerWaalsContact OD1-NZ 3.14Å; S308-K310 PolarHBondContact O-N 3.02Å; K310-V312 VanDerWaalsContact C-N 3.35Å; K310-V312 PolarHBondContact O-N 2.93Å; K310-S313 WeakPolarHBondContact O-CB 3.46Å; K310-S313 PolarHBondContact O-N 3.4Å; K310-S313 VanDerWaalsContact O-N 3.1Å; K310-V314 WeakPolarHBondContact O-CG2 3.43Å; K310-V314 PolarHBondContact O-N 3.29Å
311L98.7Very high97.7Very high0 Ų042.1 Ų42.10%022%0.218CC..Hα-helixtrans-57.4-46.5178.1176.257.6000111.6L247 I284 V288 L291 N307 S308 S313 V314 L315L247-L311 HydrophobicContact CD2-CD2 3.97Å; L247-L311 HydrophobicContact CD2-CG 4.41Å; L247-L311 HydrophobicContact CG-CD2 3.88Å; L247-L311 HydrophobicContact CG-CG 4.42Å; I284-L311 HydrophobicContact CG2-CD1 4.29Å; V288-L311 HydrophobicContact CG2-CD1 3.8Å; V288-L311 HydrophobicContact CG2-CD2 3.94Å; L291-L311 HydrophobicContact CD2-CD2 3.75Å; N307-L311 PolarHBondContact O-N 2.96Å; S308-L311 PolarHBondContact O-N 2.85Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 2.99Å; L311-V314 PolarHBondContact O-N 3.15Å; L311-L315 HydrophobicContact CD1-CD1 4.25Å; L311-L315 HydrophobicContact CD1-CG 4.1Å; L311-L315 HydrophobicContact CG-CD1 4.14Å; L311-L315 HydrophobicContact CG-CG 4.45Å; L311-L315 VanDerWaalsContact O-CG 3.28Å; L311-L315 WeakPolarHBondContact O-CG 3.37Å; L311-L315 PolarHBondContact O-N 2.65Å
312V98.6Very high97.6Very high12 Ų1240.8 Ų40.87%0.07321%0.212CC..Hα-helixtrans-56.6-44.9175.2168.90000111.7L247 S308 A309 K310 L315 K316 I343 M347L247-V312 HydrophobicContact CD1-CG2 3.84Å; L247-V312 HydrophobicContact CD2-CG2 4.01Å; S308-V312 VanDerWaalsContact O-CG2 3.22Å; S308-V312 WeakPolarHBondContact O-CG2 3.36Å; S308-V312 PolarHBondContact O-N 3.2Å; A309-V312 PolarHBondContact O-N 2.86Å; K310-V312 VanDerWaalsContact C-N 3.35Å; K310-V312 PolarHBondContact O-N 2.93Å; V312-L315 PolarHBondContact O-N 3.45Å; V312-K316 HydrophobicContact CG1-CD 4.24Å; V312-K316 WeakPolarHBondContact O-CG 3.3Å; V312-K316 PolarHBondContact O-N 2.73Å; V312-I343 HydrophobicContact CB-CG2 4.06Å; V312-I343 HydrophobicContact CG1-CG2 3.69Å; V312-I343 HydrophobicContact CG2-CG2 3.71Å; V312-M347 HydrophobicContact CG2-CB 3.88Å; V312-M347 HydrophobicContact CG2-CG 4.02Å; V312-M347 HydrophobicContact CG2-SD 3.83Å
313S98.5Very high97.5Very high76 Ų7642.3 Ų42.353%0.53122%0.216SC..Hα-helixtrans-60.7-45.9178.1-175.30000111.6A309 K310 L311 K316 K317A309-S313 PolarHBondContact O-N 2.88Å; K310-S313 WeakPolarHBondContact O-CB 3.46Å; K310-S313 PolarHBondContact O-N 3.4Å; K310-S313 VanDerWaalsContact O-N 3.1Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 2.99Å; S313-K316 PolarHBondContact O-N 2.69Å; S313-K317 WeakPolarHBondContact O-CB 3.37Å; S313-K317 PolarHBondContact O-N 2.92Å
314V98.5Very high97.3Very high14 Ų1443.8 Ų43.89%0.08523%0.234CC..Hα-helixtrans-63-45.9178.1175.10000110.9I280 E283 I284 K310 L311 K316 K317 A318I280-V314 HydrophobicContact CD1-CG1 4.28Å; E283-V314 HydrophobicContact CB-CG1 3.66Å; E283-V314 HydrophobicContact CB-CG2 4.47Å; I284-V314 HydrophobicContact CG1-CG1 3.66Å; K310-V314 WeakPolarHBondContact O-CG2 3.43Å; K310-V314 PolarHBondContact O-N 3.29Å; L311-V314 PolarHBondContact O-N 3.15Å; V314-K316 PolarHBondContact O-N 3.42Å; V314-K317 PolarHBondContact O-N 3.41Å; V314-A318 WeakPolarHBondContact O-CB 3.41Å; V314-A318 PolarHBondContact O-N 2.96Å
315L98.3Very high97.1Very high0 Ų044.3 Ų44.30%024%0.238CC..Hα-helixtrans-59.6-46.4177.9-68.6171.7000112.2L247 S251 C254 I284 L311 V312 K317 A318 L319 I343L247-L315 HydrophobicContact CD1-CD1 4.12Å; S251-L315 WeakPolarHBondContact OG-CD1 3.47Å; C254-L315 HydrophobicContact CB-CD2 4.17Å; I284-L315 HydrophobicContact CD1-CD2 3.88Å; I284-L315 HydrophobicContact CG1-CD2 4.11Å; I284-L315 HydrophobicContact CG2-CD2 4.05Å; L311-L315 HydrophobicContact CD1-CD1 4.25Å; L311-L315 HydrophobicContact CD1-CG 4.1Å; L311-L315 HydrophobicContact CG-CD1 4.14Å; L311-L315 HydrophobicContact CG-CG 4.45Å; L311-L315 VanDerWaalsContact O-CG 3.28Å; L311-L315 WeakPolarHBondContact O-CG 3.37Å; L311-L315 PolarHBondContact O-N 2.65Å; V312-L315 PolarHBondContact O-N 3.45Å; L315-K317 VanDerWaalsContact C-N 3.35Å; L315-K317 PolarHBondContact O-N 3.46Å; L315-A318 PolarHBondContact O-N 2.98Å; L315-L319 VanDerWaalsContact O-CG 3.28Å; L315-L319 WeakPolarHBondContact O-CG 3.2Å; L315-L319 PolarHBondContact O-N 2.84Å; L315-I343 HydrophobicContact CB-CD1 3.89Å; L315-I343 HydrophobicContact CD1-CD1 3.89Å; L315-I343 HydrophobicContact CD1-CG1 4.07Å; L315-I343 HydrophobicContact CD1-CG2 4.4Å; L315-I343 HydrophobicContact CG-CD1 4.49Å
316K97.8Very high96.9Very high70 Ų7044.4 Ų44.430%0.30424%0.239SC..Hα-helixtrans-62.3-43.4178.6-73.9-174.5177-163.40111.5V312 S313 V314 A318 L319 E320 D344V312-K316 HydrophobicContact CG1-CD 4.24Å; V312-K316 WeakPolarHBondContact O-CG 3.3Å; V312-K316 PolarHBondContact O-N 2.73Å; S313-K316 PolarHBondContact O-N 2.69Å; V314-K316 PolarHBondContact O-N 3.42Å; K316-A318 PolarHBondContact O-N 3.45Å; K316-L319 PolarHBondContact O-N 3.2Å; K316-E320 WeakPolarHBondContact O-CB 3.49Å; K316-E320 PolarHBondContact O-N 3.05Å; K316-D344 WeakPolarHBondContact CE-OD1 3.43Å; K316-D344 IonicContact NZ-OD1 3.48Å; K316-D344 PolarHBondContact NZ-OD1 3.17Å; K316-D344 IonicContact NZ-OD2 2.85Å; K316-D344 PolarHBondContact NZ-OD2 3.48Å
317K98Very high96.7Very high94 Ų9440.6 Ų40.641%0.40922%0.22SC..Hα-helixtrans-61.6-42.5175.4-174.1179163.8-152.10111.6I280 E283 S313 V314 L315 E320 I321I280-K317 HydrophobicContact CD1-CB 4.09Å; I280-K317 HydrophobicContact CD1-CD 3.54Å; I280-K317 HydrophobicContact CD1-CG 3.76Å; I280-K317 HydrophobicContact CG1-CB 4.3Å; I280-K317 HydrophobicContact CG1-CD 4.33Å; I280-K317 HydrophobicContact CG1-CG 4.02Å; E283-K317 IonicContact OE1-NZ 3.18Å; E283-K317 PolarHBondContact OE1-NZ 3.37Å; S313-K317 WeakPolarHBondContact O-CB 3.37Å; S313-K317 PolarHBondContact O-N 2.92Å; V314-K317 PolarHBondContact O-N 3.41Å; L315-K317 VanDerWaalsContact C-N 3.35Å; L315-K317 PolarHBondContact O-N 3.46Å; K317-E320 PolarHBondContact O-N 3.27Å; K317-I321 HydrophobicContact CG-CD1 4.07Å; K317-I321 WeakPolarHBondContact O-CG1 3.38Å; K317-I321 PolarHBondContact O-N 3.41Å
318A97.6Very high96.3Very high1 Ų140.6 Ų40.61%0.00822%0.22CC..Hα-helixtrans-61.8-44.6176.500000112.4I258 I280 I284 V314 L315 K316 T322I258-A318 HydrophobicContact CD1-CB 4.19Å; I280-A318 HydrophobicContact CG1-CB 3.84Å; I280-A318 HydrophobicContact CG2-CB 4.08Å; I284-A318 HydrophobicContact CD1-CB 4Å; V314-A318 WeakPolarHBondContact O-CB 3.41Å; V314-A318 PolarHBondContact O-N 2.96Å; L315-A318 PolarHBondContact O-N 2.98Å; K316-A318 PolarHBondContact O-N 3.45Å; A318-T322 WeakPolarHBondContact O-CB 3.2Å; A318-T322 PolarHBondContact O-N 3.41Å; A318-T322 PolarHBondContact O-OG1 3.39Å
319L95.6Very high94.9Very high0 Ų045 Ų450%025%0.249CC..Hα-helixtrans-66-38.9177.2-68.1176.4000112C254 L315 K316 T322 K323 W335 I336 L339 I340 I343C254-L319 HydrophobicContact CB-CD2 4.23Å; L315-L319 VanDerWaalsContact O-CG 3.28Å; L315-L319 WeakPolarHBondContact O-CG 3.2Å; L315-L319 PolarHBondContact O-N 2.84Å; K316-L319 PolarHBondContact O-N 3.2Å; L319-T322 PolarHBondContact O-N 3.09Å; L319-K323 VanDerWaalsContact O-CB 3.31Å; L319-K323 WeakPolarHBondContact O-CB 3.27Å; L319-K323 PolarHBondContact O-N 2.97Å; L319-W335 HydrophobicContact CD2-CH2 3.62Å; L319-W335 HydrophobicContact CD2-CZ3 3.53Å; L319-I336 HydrophobicContact CB-CG2 4.05Å; L319-I336 HydrophobicContact CD1-CG2 4.46Å; L319-L339 HydrophobicContact CD1-CB 4.34Å; L319-I340 HydrophobicContact CD1-CG1 3.84Å; L319-I343 HydrophobicContact CD1-CD1 4.13Å
320E95.2Very high93.8Very high137 Ų13749.1 Ų49.164%0.6426%0.261SS*.Hα-helixtrans-64.9-48.9177-175.4175.4-168.100112K316 K317 T322 K323 A324K316-E320 WeakPolarHBondContact O-CB 3.49Å; K316-E320 PolarHBondContact O-N 3.05Å; K317-E320 PolarHBondContact O-N 3.27Å; E320-T322 VanDerWaalsContact C-N 3.31Å; E320-T322 PolarHBondContact O-N 3.48Å; E320-K323 WeakPolarHBondContact O-CB 3.39Å; E320-K323 PolarHBondContact O-N 3.25Å; E320-A324 PolarHBondContact O-N 3.04Å
321I95.9Very high92.2Very high50 Ų5046.7 Ų46.726%0.25626%0.256SS..Hα-helixtrans-59.1-44.7175.6-71.3170.3000110.3D276 I277 I280 K317 K323 A324 S325D276-I321 HydrophobicContact CB-CG2 4.26Å; I277-I321 HydrophobicContact CG1-CG2 4.19Å; I280-I321 HydrophobicContact CB-CD1 3.86Å; I280-I321 HydrophobicContact CG1-CD1 4.05Å; I280-I321 HydrophobicContact CG2-CB 4.33Å; I280-I321 HydrophobicContact CG2-CD1 3.86Å; I280-I321 HydrophobicContact CG2-CG2 4.31Å; K317-I321 HydrophobicContact CG-CD1 4.07Å; K317-I321 WeakPolarHBondContact O-CG1 3.38Å; K317-I321 PolarHBondContact O-N 3.41Å; I321-K323 VanDerWaalsContact C-N 3.34Å; I321-K323 PolarHBondContact O-N 3.05Å; I321-A324 PolarHBondContact O-N 2.86Å; I321-S325 WeakPolarHBondContact O-CB 3.43Å; I321-S325 PolarHBondContact O-N 3.44Å; I321-S325 VanDerWaalsContact O-N 3.11Å
322T95Very high90.3Very high0 Ų055.5 Ų55.50%030%0.297CS..Hα-helixtrans-61-43.3177.3-57.60000111.5I258 L261 A318 L319 E320 A324 S325 V327 T328I258-T322 HydrophobicContact CG1-CG2 4.15Å; I258-T322 HydrophobicContact CG2-CG2 4.43Å; L261-T322 HydrophobicContact CD1-CG2 3.91Å; A318-T322 WeakPolarHBondContact O-CB 3.2Å; A318-T322 PolarHBondContact O-N 3.41Å; A318-T322 PolarHBondContact O-OG1 3.39Å; L319-T322 PolarHBondContact O-N 3.09Å; E320-T322 VanDerWaalsContact C-N 3.31Å; E320-T322 PolarHBondContact O-N 3.48Å; T322-A324 VanDerWaalsContact C-N 3.34Å; T322-A324 PolarHBondContact O-N 2.95Å; T322-S325 PolarHBondContact O-N 3.41Å; T322-S325 PolarHBondContact O-OG 2.92Å; T322-V327 HydrophobicContact CG2-CG2 3.75Å; T322-T328 PolarHBondContact O-OG1 3.45Å
323K93.6Very high88.4Confident96 Ų9661.4 Ų61.442%0.41733%0.328SS..Hα-helixtrans-62.2-39.5177.7-172.4-178.9177.1-176.80112.4L319 E320 I321 S325 P331 I336L319-K323 VanDerWaalsContact O-CB 3.31Å; L319-K323 WeakPolarHBondContact O-CB 3.27Å; L319-K323 PolarHBondContact O-N 2.97Å; E320-K323 WeakPolarHBondContact O-CB 3.39Å; E320-K323 PolarHBondContact O-N 3.25Å; I321-K323 VanDerWaalsContact C-N 3.34Å; I321-K323 PolarHBondContact O-N 3.05Å; K323-S325 VanDerWaalsContact C-N 3.3Å; K323-P331 HydrophobicContact CG-CB 4.26Å; K323-I336 HydrophobicContact CB-CD1 3.74Å; K323-I336 HydrophobicContact CG-CD1 4.12Å
324A93.3Very high86.9Confident87 Ų8758.8 Ų58.872%0.71931%0.309SS*.Hα-helixtrans-77.8-14.3-17900000113.7E320 I321 T322E320-A324 PolarHBondContact O-N 3.04Å; I321-A324 PolarHBondContact O-N 2.86Å; T322-A324 VanDerWaalsContact C-N 3.34Å; T322-A324 PolarHBondContact O-N 2.95Å
325S94.4Very high86.1Confident12 Ų1260.3 Ų60.38%0.08431%0.314CS..SBendtrans-86.4168.6-177.278.10000113.9I277 I321 T322 K323 V327 T328I277-S325 WeakPolarHBondContact CD1-OG 3.48Å; I321-S325 WeakPolarHBondContact O-CB 3.43Å; I321-S325 PolarHBondContact O-N 3.44Å; I321-S325 VanDerWaalsContact O-N 3.11Å; T322-S325 PolarHBondContact O-N 3.41Å; T322-S325 PolarHBondContact O-OG 2.92Å; K323-S325 VanDerWaalsContact C-N 3.3Å; S325-V327 PolarHBondContact O-N 3.14Å; S325-V327 VanDerWaalsContact O-N 3.08Å; S325-V327 VanDerWaalsContact OG-CG2 3.23Å; S325-V327 WeakPolarHBondContact OG-CG2 3.45Å; S325-V327 PolarHBondContact OG-N 2.98Å; S325-T328 PolarHBondContact O-N 2.77Å
326H94.5Very high85.5Confident37 Ų3760.5 Ų60.517%0.17132%0.315CS..THydrogen-bonded Turntrans-60.7-15.6176.971.1-80.3000114.7G266 K267 Q270 Q273 T328G266-H326 WeakPolarHBondContact CA-NE2 3.4Å; K267-H326 PolarHBondContact N-NE2 3.35Å; Q270-H326 WeakPolarHBondContact CB-CE1 3.39Å; Q270-H326 WeakPolarHBondContact CB-ND1 3.5Å; Q270-H326 HydrophobicContact CG-CB 4.24Å; Q273-H326 VanDerWaalsContact OE1-CB 3.27Å; Q273-H326 PolarHBondContact OE1-ND1 2.89Å; H326-T328 PolarHBondContact O-N 2.87Å
327V94Very high85.1Confident0 Ų060.1 Ų60.10%032%0.32CS..THydrogen-bonded Turntrans-78-8.5-178.2-47.20000112.6L261 V262 N265 I277 T322 S325 P329L261-V327 HydrophobicContact CB-CB 4.2Å; L261-V327 HydrophobicContact CB-CG2 3.89Å; L261-V327 HydrophobicContact CD1-CG2 4.33Å; V262-V327 HydrophobicContact CG2-CG1 4.19Å; N265-V327 HydrophobicContact CB-CB 4.33Å; N265-V327 VanDerWaalsContact CB-O 3.29Å; N265-V327 WeakPolarHBondContact CB-O 3.49Å; N265-V327 PolarHBondContact ND2-O 3.15Å; I277-V327 HydrophobicContact CD1-CG1 3.94Å; I277-V327 HydrophobicContact CD1-CG2 4.13Å; T322-V327 HydrophobicContact CG2-CG2 3.75Å; S325-V327 PolarHBondContact O-N 3.14Å; S325-V327 VanDerWaalsContact O-N 3.08Å; S325-V327 VanDerWaalsContact OG-CG2 3.23Å; S325-V327 WeakPolarHBondContact OG-CG2 3.45Å; S325-V327 PolarHBondContact OG-N 2.98Å; V327-P329 VanDerWaalsContact O-CD 3.28Å; V327-P329 WeakPolarHBondContact O-CD 3.45Å
328T90.3Very high84.7Confident16 Ų1661.6 Ų61.610%0.09833%0.331CS..  trans-114.585.2178.2-52.30000110.2T322 S325 H326 Q330 P331T322-T328 PolarHBondContact O-OG1 3.45Å; S325-T328 PolarHBondContact O-N 2.77Å; H326-T328 PolarHBondContact O-N 2.87Å; T328-Q330 VanDerWaalsContact C-N 3.31Å; T328-Q330 PolarHBondContact O-N 3.29Å; T328-P331 HydrophobicContact CG2-CB 4.42Å
329P69.3Low84.5Confident94 Ų9463.1 Ų63.161%0.6134%0.339SS*.SBendtrans-72.7-20.5-175.727-33.7000114.1N265 V327N265-P329 WeakPolarHBondContact ND2-CD 3.46Å; V327-P329 VanDerWaalsContact O-CD 3.28Å; V327-P329 WeakPolarHBondContact O-CD 3.45Å
330Q74.3Confident84.4Confident131 Ų13165.4 Ų65.461%0.61235%0.351SS*.  trans-134.392.3176.3-71.1-174.1-22.400109.9T328 E332T328-Q330 VanDerWaalsContact C-N 3.31Å; T328-Q330 PolarHBondContact O-N 3.29Å; Q330-E332 PolarHBondContact O-N 3.16Å
331P64.4Low84.4Confident54 Ų5463.7 Ų63.735%0.35135%0.346SS..SBendtrans-69.2-14.6-176.625.1-32000113.8K323 T328 S334K323-P331 HydrophobicContact CG-CB 4.26Å; T328-P331 HydrophobicContact CG2-CB 4.42Å; P331-S334 WeakPolarHBondContact O-CB 3.36Å; P331-S334 PolarHBondContact O-OG 3.47Å
332E58.9Low84.4Confident185 Ų18563.4 Ų63.486%0.86435%0.351SS*.THydrogen-bonded Turntrans-86.6-28.5-172.5-48.6-154.2-15700113Q330 S334Q330-E332 PolarHBondContact O-N 3.16Å; E332-S334 VanDerWaalsContact C-N 3.28Å; E332-S334 PolarHBondContact O-N 3.24Å
333D58.3Low84.5Confident136 Ų13663.4 Ų63.473%0.72735%0.351SS*.THydrogen-bonded Turntrans-93.829.6173.4-75.2-30.9000112.4
334S68.4Low84.7Confident20 Ų2060.9 Ų60.914%0.1434%0.342CS..  trans-84.4138.1-169.965.90000112.5P331 E332 I336 P337P331-S334 WeakPolarHBondContact O-CB 3.36Å; P331-S334 PolarHBondContact O-OG 3.47Å; E332-S334 VanDerWaalsContact C-N 3.28Å; E332-S334 PolarHBondContact O-N 3.24Å; S334-I336 PolarHBondContact O-N 3.22Å; S334-P337 WeakPolarHBondContact O-CD 3.17Å; S334-P337 WeakPolarHBondContact OG-CD 3.27Å
335W80.8Confident84.9Confident46 Ų4663.2 Ų63.217%0.17434%0.338CS..SBendtrans-68.4-10.6166.850.9-88.7000112.6K257 L261 L319 L338 L339K257-W335 HydrophobicContact CB-CD2 4.39Å; K257-W335 HydrophobicContact CB-CE3 4.2Å; K257-W335 HydrophobicContact CB-CH2 3.7Å; K257-W335 HydrophobicContact CB-CZ2 3.95Å; K257-W335 HydrophobicContact CB-CZ3 3.86Å; K257-W335 HydrophobicContact CD-CD2 4.16Å; K257-W335 HydrophobicContact CD-CG 4.35Å; K257-W335 HydrophobicContact CD-CZ2 4.43Å; K257-W335 VanDerWaalsContact CE-CG 3.47Å; K257-W335 HydrophobicContact CG-CD2 3.33Å; K257-W335 HydrophobicContact CG-CE3 3.59Å; K257-W335 HydrophobicContact CG-CG 4.02Å; K257-W335 HydrophobicContact CG-CH2 3.48Å; K257-W335 VanDerWaalsContact CG-CH2 3.48Å; K257-W335 HydrophobicContact CG-CZ2 3.24Å; K257-W335 HydrophobicContact CG-CZ3 3.66Å; L261-W335 HydrophobicContact CD1-CZ2 3.55Å; L261-W335 HydrophobicContact CG-CZ2 4.23Å; L319-W335 HydrophobicContact CD2-CH2 3.62Å; L319-W335 HydrophobicContact CD2-CZ3 3.53Å; W335-L338 WeakPolarHBondContact O-CB 3.2Å; W335-L338 PolarHBondContact O-N 3.49Å; W335-L338 VanDerWaalsContact O-N 3.12Å; W335-L339 HydrophobicContact CE3-CD1 3.5Å; W335-L339 VanDerWaalsContact CE3-CD1 3.5Å; W335-L339 HydrophobicContact CE3-CG 3.84Å; W335-L339 HydrophobicContact CH2-CD1 4.48Å; W335-L339 HydrophobicContact CZ3-CD1 3.29Å; W335-L339 HydrophobicContact CZ3-CG 4.08Å; W335-L339 PolarHBondContact O-N 2.72Å
336I86.4Confident85Confident5 Ų563.2 Ų63.23%0.02634%0.338CS..Hα-helixtrans-58.6-45.9-175-66.8175.8000112L319 K323 S334 L338 L339 I340L319-I336 HydrophobicContact CB-CG2 4.05Å; L319-I336 HydrophobicContact CD1-CG2 4.46Å; K323-I336 HydrophobicContact CB-CD1 3.74Å; K323-I336 HydrophobicContact CG-CD1 4.12Å; S334-I336 PolarHBondContact O-N 3.22Å; I336-L338 VanDerWaalsContact C-N 3.26Å; I336-L338 PolarHBondContact O-N 3.35Å; I336-L339 PolarHBondContact O-N 3.12Å; I336-I340 HydrophobicContact CG2-CD1 3.7Å; I336-I340 HydrophobicContact CG2-CG1 4.3Å; I336-I340 WeakPolarHBondContact O-CG1 3.41Å; I336-I340 PolarHBondContact O-N 3.39Å
337P89.5Confident85.2Confident62 Ų6261.8 Ų61.840%0.40333%0.331SS..Hα-helixtrans-60.4-34.2175.9-22.335.6000112.9S334 I340 N341S334-P337 WeakPolarHBondContact O-CD 3.17Å; S334-P337 WeakPolarHBondContact OG-CD 3.27Å; P337-I340 PolarHBondContact O-N 3.28Å; P337-N341 WeakPolarHBondContact O-CB 3.35Å; P337-N341 PolarHBondContact O-N 3.37Å; P337-N341 PolarHBondContact O-ND2 3.35Å; P337-N341 PolarHBondContact O-OD1 2.88Å
338L89.9Confident85.4Confident125 Ų12565.4 Ų65.465%0.65435%0.351SS*.Hα-helixtrans-66.5-42.5177.2-61.3175.8000111.5W335 I336 N341 A342W335-L338 WeakPolarHBondContact O-CB 3.2Å; W335-L338 PolarHBondContact O-N 3.49Å; W335-L338 VanDerWaalsContact O-N 3.12Å; I336-L338 VanDerWaalsContact C-N 3.26Å; I336-L338 PolarHBondContact O-N 3.35Å; L338-N341 PolarHBondContact O-N 2.96Å; L338-A342 PolarHBondContact O-N 3.08Å
339L92.3Very high85.8Confident33 Ų3368.9 Ų68.917%0.17336%0.362CS..Hα-helixtrans-68.5-39.5175.1-69.9-167.4000112A253 C254 L319 W335 I336 N341 A342 I343A253-L339 HydrophobicContact CB-CD2 4.29Å; C254-L339 HydrophobicContact CB-CD1 4.28Å; C254-L339 VanDerWaalsContact SG-CD1 3.55Å; L319-L339 HydrophobicContact CD1-CB 4.34Å; W335-L339 HydrophobicContact CE3-CD1 3.5Å; W335-L339 VanDerWaalsContact CE3-CD1 3.5Å; W335-L339 HydrophobicContact CE3-CG 3.84Å; W335-L339 HydrophobicContact CH2-CD1 4.48Å; W335-L339 HydrophobicContact CZ3-CD1 3.29Å; W335-L339 HydrophobicContact CZ3-CG 4.08Å; W335-L339 PolarHBondContact O-N 2.72Å; I336-L339 PolarHBondContact O-N 3.12Å; L339-N341 VanDerWaalsContact C-N 3.32Å; L339-N341 PolarHBondContact O-N 3.43Å; L339-A342 PolarHBondContact O-N 3Å; L339-I343 WeakPolarHBondContact O-CB 3.3Å; L339-I343 WeakPolarHBondContact O-CD1 3.42Å; L339-I343 WeakPolarHBondContact O-CG1 3.37Å; L339-I343 PolarHBondContact O-N 3.47Å
340I94.3Very high87.1Confident47 Ų4764.4 Ų64.424%0.24133%0.333CS..Hα-helixtrans-59.2-45.7174.7-70.6171.5000110.5L319 I336 P337 A342 I343 D344L319-I340 HydrophobicContact CD1-CG1 3.84Å; I336-I340 HydrophobicContact CG2-CD1 3.7Å; I336-I340 HydrophobicContact CG2-CG1 4.3Å; I336-I340 WeakPolarHBondContact O-CG1 3.41Å; I336-I340 PolarHBondContact O-N 3.39Å; P337-I340 PolarHBondContact O-N 3.28Å; I340-A342 VanDerWaalsContact C-N 3.32Å; I340-A342 PolarHBondContact O-N 3.42Å; I340-I343 PolarHBondContact O-N 3.26Å; I340-D344 WeakPolarHBondContact O-CB 3.34Å; I340-D344 PolarHBondContact O-N 3.11Å
341N94.8Very high88.2Confident102 Ų10262.3 Ų62.355%0.54532%0.322SS..Hα-helixtrans-61.7-40177.4-70.9-15.3000112.1P337 L338 L339 D344 H345P337-N341 WeakPolarHBondContact O-CB 3.35Å; P337-N341 PolarHBondContact O-N 3.37Å; P337-N341 PolarHBondContact O-ND2 3.35Å; P337-N341 PolarHBondContact O-OD1 2.88Å; L338-N341 PolarHBondContact O-N 2.96Å; L339-N341 VanDerWaalsContact C-N 3.32Å; L339-N341 PolarHBondContact O-N 3.43Å; N341-D344 PolarHBondContact O-N 3.21Å; N341-H345 WeakPolarHBondContact O-CB 3.47Å; N341-H345 PolarHBondContact O-N 3.05Å
342A95Very high89.7Confident44 Ų4465.5 Ų65.536%0.36433%0.332SS..Hα-helixtrans-65-43175.900000112L338 L339 I340 H345 C346L338-A342 PolarHBondContact O-N 3.08Å; L339-A342 PolarHBondContact O-N 3Å; I340-A342 VanDerWaalsContact C-N 3.32Å; I340-A342 PolarHBondContact O-N 3.42Å; A342-H345 PolarHBondContact O-N 3.25Å; A342-C346 PolarHBondContact O-N 3Å; A342-C346 VanDerWaalsContact O-N 3.1Å; A342-C346 PolarHBondContact O-SG 2.82Å
343I97.6Very high91.5Very high0 Ų058.4 Ų58.40%030%0.3CS..Hα-helixtrans-61.3-46.7175.6-68.6163.3000110.4L247 A250 V312 L315 L319 L339 I340 H345 C346 M347L247-I343 HydrophobicContact CD1-CG2 4.03Å; A250-I343 HydrophobicContact CB-CG1 4.11Å; V312-I343 HydrophobicContact CB-CG2 4.06Å; V312-I343 HydrophobicContact CG1-CG2 3.69Å; V312-I343 HydrophobicContact CG2-CG2 3.71Å; L315-I343 HydrophobicContact CB-CD1 3.89Å; L315-I343 HydrophobicContact CD1-CD1 3.89Å; L315-I343 HydrophobicContact CD1-CG1 4.07Å; L315-I343 HydrophobicContact CD1-CG2 4.4Å; L315-I343 HydrophobicContact CG-CD1 4.49Å; L319-I343 HydrophobicContact CD1-CD1 4.13Å; L339-I343 WeakPolarHBondContact O-CB 3.3Å; L339-I343 WeakPolarHBondContact O-CD1 3.42Å; L339-I343 WeakPolarHBondContact O-CG1 3.37Å; L339-I343 PolarHBondContact O-N 3.47Å; I340-I343 PolarHBondContact O-N 3.26Å; I343-H345 VanDerWaalsContact C-N 3.34Å; I343-H345 PolarHBondContact O-N 3.44Å; I343-C346 PolarHBondContact O-N 2.74Å; I343-M347 PolarHBondContact O-N 3.47Å
344D97.8Very high93.2Very high43 Ų4352 Ų5223%0.2327%0.265CS..Hα-helixtrans-65.2-38179.7-79.2-28.9000112.1K316 I340 N341 M347 N348K316-D344 WeakPolarHBondContact CE-OD1 3.43Å; K316-D344 IonicContact NZ-OD1 3.48Å; K316-D344 PolarHBondContact NZ-OD1 3.17Å; K316-D344 IonicContact NZ-OD2 2.85Å; K316-D344 PolarHBondContact NZ-OD2 3.48Å; I340-D344 WeakPolarHBondContact O-CB 3.34Å; I340-D344 PolarHBondContact O-N 3.11Å; N341-D344 PolarHBondContact O-N 3.21Å; D344-M347 PolarHBondContact O-N 2.7Å; D344-N348 VanDerWaalsContact O-CB 3.3Å; D344-N348 WeakPolarHBondContact O-CB 3.45Å; D344-N348 PolarHBondContact O-N 3.37Å; D344-N348 PolarHBondContact O-ND2 2.64Å
345H97.5Very high94.2Very high135 Ų13554.6 Ų54.663%0.62528%0.276SS*.Hα-helixtrans-60.6-46.7173.5-179.465.9000111.8N341 A342 I343 M347 N348 R349N341-H345 WeakPolarHBondContact O-CB 3.47Å; N341-H345 PolarHBondContact O-N 3.05Å; A342-H345 PolarHBondContact O-N 3.25Å; I343-H345 VanDerWaalsContact C-N 3.34Å; I343-H345 PolarHBondContact O-N 3.44Å; H345-M347 PolarHBondContact O-N 2.87Å; H345-N348 PolarHBondContact O-N 3.12Å; H345-R349 PolarHBondContact O-N 2.93Å
346C97.6Very high94.4Very high12 Ų1256.3 Ų56.38%0.08129%0.294CS..Hα-helixtrans-60.9-47.2176.8-60.10000111.1L247 A342 I343 N348 R349 I350L247-C346 HydrophobicContact CB-CB 4.05Å; L247-C346 HydrophobicContact CD1-CB 4.38Å; A342-C346 PolarHBondContact O-N 3Å; A342-C346 VanDerWaalsContact O-N 3.1Å; A342-C346 PolarHBondContact O-SG 2.82Å; I343-C346 PolarHBondContact O-N 2.74Å; C346-N348 PolarHBondContact O-N 3.1Å; C346-R349 PolarHBondContact O-N 3.27Å; C346-I350 WeakPolarHBondContact O-CG1 3.44Å; C346-I350 PolarHBondContact O-N 3.37Å
347M98.2Very high94.1Very high7 Ų760.7 Ų60.73%0.03432%0.315CS..Hα-helixtrans-65.3-38.2-179.6-169.865.5-133.500112.5R305 A309 V312 I343 D344 H345 R349 I350 K351R305-M347 HydrophobicContact CG-CE 4.22Å; A309-M347 HydrophobicContact CB-CE 4.07Å; A309-M347 HydrophobicContact CB-SD 4.24Å; V312-M347 HydrophobicContact CG2-CB 3.88Å; V312-M347 HydrophobicContact CG2-CG 4.02Å; V312-M347 HydrophobicContact CG2-SD 3.83Å; I343-M347 PolarHBondContact O-N 3.47Å; D344-M347 PolarHBondContact O-N 2.7Å; H345-M347 PolarHBondContact O-N 2.87Å; M347-R349 VanDerWaalsContact C-N 3.34Å; M347-I350 HydrophobicContact CE-CB 4.37Å; M347-I350 HydrophobicContact CE-CG2 4.03Å; M347-I350 PolarHBondContact O-N 2.78Å; M347-K351 HydrophobicContact CE-CD 4.46Å; M347-K351 HydrophobicContact CE-CG 3.78Å; M347-K351 VanDerWaalsContact O-CG 3.3Å; M347-K351 WeakPolarHBondContact O-CG 3.33Å; M347-K351 PolarHBondContact O-N 3.21Å
348N98Very high93.5Very high77 Ų7762.1 Ų62.141%0.41232%0.319SS..Hα-helixtrans-64.2-41.6176.1-71.1-20000110.7D344 H345 C346 I350 K351 E352D344-N348 VanDerWaalsContact O-CB 3.3Å; D344-N348 WeakPolarHBondContact O-CB 3.45Å; D344-N348 PolarHBondContact O-N 3.37Å; D344-N348 PolarHBondContact O-ND2 2.64Å; H345-N348 PolarHBondContact O-N 3.12Å; C346-N348 PolarHBondContact O-N 3.1Å; N348-I350 PolarHBondContact O-N 3.2Å; N348-K351 WeakPolarHBondContact O-CB 3.4Å; N348-K351 PolarHBondContact O-N 2.94Å; N348-E352 WeakPolarHBondContact O-CG 3.16Å; N348-E352 PolarHBondContact O-N 3.4Å
349R97.9Very high92.7Very high88 Ų8862.4 Ų62.433%0.33232%0.316SS..Hα-helixtrans-62.3-43.2174.8-17461-175.8152.70.5112.3E239 P243 H345 C346 M347 K351 E352 L353E239-R349 IonicContact OE1-CZ 3.55Å; E239-R349 IonicContact OE1-NH2 3.78Å; E239-R349 PolarHBondContact OE1-NH2 3.38Å; P243-R349 HydrophobicContact CB-CB 3.98Å; P243-R349 HydrophobicContact CB-CG 3.89Å; P243-R349 HydrophobicContact CG-CB 4.43Å; P243-R349 HydrophobicContact CG-CG 3.95Å; H345-R349 PolarHBondContact O-N 2.93Å; C346-R349 PolarHBondContact O-N 3.27Å; M347-R349 VanDerWaalsContact C-N 3.34Å; R349-K351 VanDerWaalsContact C-N 3.29Å; R349-K351 PolarHBondContact O-N 3.07Å; R349-E352 IonicContact NH1-OE2 2.64Å; R349-E352 PolarHBondContact NH1-OE2 2.83Å; R349-E352 PolarHBondContact O-N 3.2Å; R349-L353 HydrophobicContact CG-CD1 4.2Å; R349-L353 WeakPolarHBondContact O-CG 3.36Å; R349-L353 PolarHBondContact O-N 3.23Å; R349-L353 VanDerWaalsContact O-N 3.08Å
350I97.9Very high90.9Very high0 Ų072.7 Ų72.70%037%0.37CS..Hα-helixtrans-60-41.8174.6-68.6165.4000110.6L240 P243 L247 R305 C346 M347 N348 L353 T354L240-I350 HydrophobicContact CD1-CB 4.49Å; L240-I350 HydrophobicContact CD1-CG1 4.37Å; L240-I350 HydrophobicContact CD1-CG2 4.19Å; P243-I350 HydrophobicContact CB-CD1 4.41Å; P243-I350 HydrophobicContact CB-CG1 3.83Å; P243-I350 HydrophobicContact CG-CG1 3.75Å; L247-I350 HydrophobicContact CD2-CD1 4.24Å; R305-I350 HydrophobicContact CB-CG2 4.47Å; R305-I350 HydrophobicContact CG-CG2 4.49Å; C346-I350 WeakPolarHBondContact O-CG1 3.44Å; C346-I350 PolarHBondContact O-N 3.37Å; M347-I350 HydrophobicContact CE-CB 4.37Å; M347-I350 HydrophobicContact CE-CG2 4.03Å; M347-I350 PolarHBondContact O-N 2.78Å; N348-I350 PolarHBondContact O-N 3.2Å; I350-L353 PolarHBondContact O-N 3.47Å; I350-T354 WeakPolarHBondContact O-CB 3.48Å; I350-T354 WeakPolarHBondContact O-CG2 3.1Å; I350-T354 PolarHBondContact O-N 3.03Å; I350-T354 VanDerWaalsContact O-N 3.12Å; I350-T354 PolarHBondContact O-OG1 2.9Å
351K96.9Very high90.8Very high87 Ų8774 Ų7438%0.37838%0.377SS..Hα-helixtrans-64.7-40178.2-73.5173.2-178.8171.30112.8R305 M347 N348 R349 T354 Q355R305-K351 VanDerWaalsContact NH1-CA 3.35Å; R305-K351 PolarHBondContact NH1-O 2.89Å; M347-K351 HydrophobicContact CE-CD 4.46Å; M347-K351 HydrophobicContact CE-CG 3.78Å; M347-K351 VanDerWaalsContact O-CG 3.3Å; M347-K351 WeakPolarHBondContact O-CG 3.33Å; M347-K351 PolarHBondContact O-N 3.21Å; N348-K351 WeakPolarHBondContact O-CB 3.4Å; N348-K351 PolarHBondContact O-N 2.94Å; R349-K351 VanDerWaalsContact C-N 3.29Å; R349-K351 PolarHBondContact O-N 3.07Å; K351-T354 PolarHBondContact O-N 2.96Å; K351-Q355 PolarHBondContact O-N 3.05Å
352E96.6Very high90.5Very high122 Ų12272.5 Ų72.557%0.5737%0.368SS*.Hα-helixtrans-61.8-47.8176.7-72.6167.1-171.100111.3N348 R349 T354 Q355N348-E352 WeakPolarHBondContact O-CG 3.16Å; N348-E352 PolarHBondContact O-N 3.4Å; R349-E352 IonicContact NH1-OE2 2.64Å; R349-E352 PolarHBondContact NH1-OE2 2.83Å; R349-E352 PolarHBondContact O-N 3.2Å; E352-T354 VanDerWaalsContact C-N 3.26Å; E352-T354 PolarHBondContact O-N 3.21Å; E352-Q355 PolarHBondContact O-N 2.81Å
353L95.5Very high90.3Very high36 Ų3674.1 Ų74.119%0.18837%0.368CS..Hα-helixtrans-70.4-20.7-178.1-69.4174.6000113.8E239 L240 P243 R349 I350E239-L353 HydrophobicContact CG-CD1 4.06Å; E239-L353 HydrophobicContact CG-CD2 4.02Å; L240-L353 HydrophobicContact CB-CD1 4.5Å; L240-L353 HydrophobicContact CD1-CB 4.08Å; L240-L353 HydrophobicContact CD1-CD1 4.33Å; P243-L353 HydrophobicContact CG-CD1 4.13Å; R349-L353 HydrophobicContact CG-CD1 4.2Å; R349-L353 WeakPolarHBondContact O-CG 3.36Å; R349-L353 PolarHBondContact O-N 3.23Å; R349-L353 VanDerWaalsContact O-N 3.08Å; I350-L353 PolarHBondContact O-N 3.47Å
354T94.6Very high89.9Confident0 Ų078.5 Ų78.50%039%0.39CS..THydrogen-bonded Turntrans-112.920-17859.40000112.5L240 H301 R305 I350 K351 E352L240-T354 HydrophobicContact CD1-CG2 3.75Å; L240-T354 HydrophobicContact CD2-CG2 3.69Å; L240-T354 HydrophobicContact CG-CG2 4.41Å; H301-T354 HydrophobicContact CB-CG2 4.05Å; R305-T354 HydrophobicContact CB-CG2 4.42Å; R305-T354 WeakPolarHBondContact CD-OG1 3.49Å; R305-T354 PolarHBondContact NH1-O 3.02Å; R305-T354 PolarHBondContact NH1-OG1 2.97Å; I350-T354 WeakPolarHBondContact O-CB 3.48Å; I350-T354 WeakPolarHBondContact O-CG2 3.1Å; I350-T354 PolarHBondContact O-N 3.03Å; I350-T354 VanDerWaalsContact O-N 3.12Å; I350-T354 PolarHBondContact O-OG1 2.9Å; K351-T354 PolarHBondContact O-N 2.96Å; E352-T354 VanDerWaalsContact C-N 3.26Å; E352-T354 PolarHBondContact O-N 3.21Å
355Q89.6Confident89.4Confident76 Ų7680.7 Ų80.736%0.35540%0.4SS..SBendtrans-72.1-34.9-174.4-174.957.627.600112.4K351 E352 E357 L358 E359K351-Q355 PolarHBondContact O-N 3.05Å; E352-Q355 PolarHBondContact O-N 2.81Å; Q355-E357 PolarHBondContact O-N 3.03Å; Q355-L358 PolarHBondContact O-N 3.01Å; Q355-L358 VanDerWaalsContact O-N 3.15Å; Q355-E359 WeakPolarHBondContact CG-OE1 3.25Å; Q355-E359 PolarHBondContact NE2-OE1 3.34Å
356S84.3Confident88.8Confident81 Ų8177.1 Ų77.157%0.56639%0.385SS*.G310 helixtrans-58.1-33.2176.248.80000113L358 E359S356-L358 PolarHBondContact O-N 3.35Å; S356-L358 VanDerWaalsContact O-N 3.16Å; S356-E359 PolarHBondContact O-N 3.46Å
357E79.9Confident88.2Confident98 Ų9881.7 Ų81.746%0.45841%0.407SS..G310 helixtrans-67.9-11.9179.9-60.2-59.9118.200114H301 Q355H301-E357 HydrophobicContact CB-CG 3.82Å; Q355-E357 PolarHBondContact O-N 3.03Å
358L76.8Confident87.4Confident92 Ų9287.5 Ų87.548%0.48244%0.435SS..G310 helixtrans-111-6.4-178.1-65-178.4000113.6L302 R305 Q355 S356L302-L358 HydrophobicContact CD1-CD2 3.89Å; R305-L358 VanDerWaalsContact NH2-CD1 3.26Å; Q355-L358 PolarHBondContact O-N 3.01Å; Q355-L358 VanDerWaalsContact O-N 3.15Å; S356-L358 PolarHBondContact O-N 3.35Å; S356-L358 VanDerWaalsContact O-N 3.16Å
359E73.2Confident86.6Confident130 Ų13088.3 Ų88.361%0.60744%0.437SS*.  trans-99.7129-179.9-67.1179.6-171.300108.7Q355 S356Q355-E359 WeakPolarHBondContact CG-OE1 3.25Å; Q355-E359 PolarHBondContact NE2-OE1 3.34Å; S356-E359 PolarHBondContact O-N 3.46Å
360L55.5Low85.5Confident250 Ų25088.4 Ų88.4100%1.30945%0.447SS*.  trans-81.60-175.9-77.5168.9000112.9

Retrieved 360 of 360 residues in 394.5 ms (Link to these results)

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