A0A077YVJ8_TRITR Loading...

G-protein coupled receptors family 1 profile domain-containing protein

AlphaFold DB , UniProt , Accession A0A077YVJ8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 323 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
1M43.2Very low41.9Very low208 Ų208145.9 Ų145.9100%1.02572%0.716SS**  042.20-153.1178.786.800111.5
2N45.3Very low42.4Very low126 Ų126143.1 Ų143.167%0.67472%0.716SS**  trans-135-4.1178.3-95.9-0000113.5
3E46.8Very low42.1Very low172 Ų172146.8 Ų146.880%0.80472%0.719SS**SBendtrans-89.1-29175-73.4176.8144.200112.1M5 V6E3-M5 PolarHBondContact O-N 3.28Å; E3-V6 PolarHBondContact O-N 3.46Å
4E48.5Very low42.5Very low154 Ų154144.5 Ų144.572%0.7271%0.706SS**Hα-helixtrans-71.6-28179.1-67.1-177.7156.200113.2
5M39.8Very low43.9Very low135 Ų135144.3 Ų144.367%0.66570%0.7SS**Hα-helixtrans-80.2-15.7176-74-152.9-64.300113.8E3E3-M5 PolarHBondContact O-N 3.28Å
6V41.2Very low45.5Very low104 Ų104138 Ų13863%0.6368%0.675SS**Hα-helixtrans-80.8-27.5175.9178.20000110.9E3E3-V6 PolarHBondContact O-N 3.46Å
7Q42.3Very low47.4Very low162 Ų162135.9 Ų135.976%0.75766%0.664SS**Hα-helixtrans-77.9-19.3176.6-93174-32.900114.5
8Q44.6Very low49.3Very low166 Ų166132.4 Ų132.478%0.77666%0.655SS**THydrogen-bonded Turntrans-84.7-11-178.4-129.4173-3.300114.3
9N35Very low51.1Low138 Ų138128.3 Ų128.374%0.73863%0.633SS**THydrogen-bonded Turntrans-100.41.1179-114.3-6.8000114.1T11N9-T11 VanDerWaalsContact C-N 3.28Å; N9-T11 PolarHBondContact O-N 3.18Å
10Y36.5Very low52.9Low176 Ų176124.4 Ų124.469%0.6962%0.617SS**SBendtrans-66.897.5160.1-107.3-83.7000107.4
11T38Very low54.7Low64 Ų64124.2 Ų124.239%0.39361%0.612SS.*  trans-53.5137.8-164.262.70000111.2N9 Y13 E14 K15N9-T11 VanDerWaalsContact C-N 3.28Å; N9-T11 PolarHBondContact O-N 3.18Å; T11-Y13 PolarHBondContact O-N 3.18Å; T11-E14 PolarHBondContact O-N 3.49Å; T11-E14 PolarHBondContact OG1-N 3.43Å; T11-E14 VanDerWaalsContact OG1-N 3.17Å; T11-K15 PolarHBondContact O-N 3.44Å
12P48.1Very low56.8Low112 Ų112115.3 Ų115.373%0.72757%0.57SS**Hα-helixtrans-49.7-25.3169.3-2531.4000112.7S16P12-S16 WeakPolarHBondContact O-CB 3.34Å; P12-S16 PolarHBondContact O-N 2.96Å
13Y38.2Very low59Low191 Ų191109.3 Ų109.375%0.74954%0.538SS*.Hα-helixtrans-69-45.1177.8-123.5-87.3000114.2T11 K15 S16 E17T11-Y13 PolarHBondContact O-N 3.18Å; Y13-K15 VanDerWaalsContact C-N 3.33Å; Y13-S16 PolarHBondContact O-N 3.36Å; Y13-S16 PolarHBondContact O-OG 3.19Å; Y13-E17 PolarHBondContact O-N 3.45Å
14E47.8Very low61.3Low115 Ų115108.3 Ų108.354%0.53753%0.527SS..Hα-helixtrans-70.6-35.9-179.7-164171.6-172.600111T11 S18T11-E14 PolarHBondContact O-N 3.49Å; T11-E14 PolarHBondContact OG1-N 3.43Å; T11-E14 VanDerWaalsContact OG1-N 3.17Å; E14-S18 PolarHBondContact O-N 2.87Å
15K62.9Low63.5Low141 Ų141103.6 Ų103.661%0.61351%0.509SS*.Hα-helixtrans-63.3-42.9171.3-135.3-175.3175.8170.40110.9T11 Y13 S18 F19T11-K15 PolarHBondContact O-N 3.44Å; Y13-K15 VanDerWaalsContact C-N 3.33Å; K15-S18 PolarHBondContact O-N 3.38Å; K15-F19 HydrophobicContact CB-CD2 4.41Å; K15-F19 HydrophobicContact CB-CE2 4.23Å; K15-F19 HydrophobicContact CD-CE2 3.72Å; K15-F19 HydrophobicContact CD-CZ 4.36Å; K15-F19 HydrophobicContact CG-CD2 4.07Å; K15-F19 HydrophobicContact CG-CE2 3.47Å; K15-F19 VanDerWaalsContact CG-CE2 3.47Å; K15-F19 HydrophobicContact CG-CZ 4.22Å; K15-F19 WeakPolarHBondContact O-CB 3.14Å; K15-F19 WeakPolarHBondContact O-CD2 3.27Å; K15-F19 WeakPolarHBondContact O-CG 3.33Å; K15-F19 PolarHBondContact O-N 3.35Å
16S70.5Confident66Low44 Ų4497.9 Ų97.931%0.30848%0.48SS..Hα-helixtrans-67.6-38.3-179.476.80000113.2P12 Y13 F19 T20P12-S16 WeakPolarHBondContact O-CB 3.34Å; P12-S16 PolarHBondContact O-N 2.96Å; Y13-S16 PolarHBondContact O-N 3.36Å; Y13-S16 PolarHBondContact O-OG 3.19Å; S16-F19 PolarHBondContact O-N 3.27Å; S16-T20 WeakPolarHBondContact O-CB 3.24Å; S16-T20 PolarHBondContact O-N 3.47Å; S16-T20 PolarHBondContact O-OG1 3.47Å
17E77.5Confident68.7Low103 Ų10393.5 Ų93.548%0.48145%0.454SS..Hα-helixtrans-66-44.7177-167.3-174.9159.500111.1Y13 F19 T20 K21Y13-E17 PolarHBondContact O-N 3.45Å; E17-F19 PolarHBondContact O-N 3.46Å; E17-T20 PolarHBondContact O-N 3.03Å; E17-K21 HydrophobicContact CG-CD 4.49Å; E17-K21 WeakPolarHBondContact O-CG 3.49Å; E17-K21 PolarHBondContact O-N 3.44Å; E17-K21 WeakPolarHBondContact OE1-CE 3.42Å; E17-K21 IonicContact OE1-NZ 3.81Å; E17-K21 PolarHBondContact OE1-NZ 3.36Å
18S81.6Confident71.2Confident72 Ų7288.5 Ų88.550%0.50344%0.441SS..Hα-helixtrans-61.2-44.1176.4-173.60000112E14 K15 K21 T22E14-S18 PolarHBondContact O-N 2.87Å; K15-S18 PolarHBondContact O-N 3.38Å; S18-K21 PolarHBondContact O-N 2.9Å; S18-T22 WeakPolarHBondContact O-CB 3.38Å; S18-T22 PolarHBondContact O-N 3.24Å; S18-T22 PolarHBondContact O-OG1 3.03Å
19F82.8Confident73.6Confident55 Ų5581.7 Ų81.724%0.24141%0.41CS..Hα-helixtrans-65.9-39.5176.5-74.8-54.7000112.8K15 S16 E17 T22 A23 L82K15-F19 HydrophobicContact CB-CD2 4.41Å; K15-F19 HydrophobicContact CB-CE2 4.23Å; K15-F19 HydrophobicContact CD-CE2 3.72Å; K15-F19 HydrophobicContact CD-CZ 4.36Å; K15-F19 HydrophobicContact CG-CD2 4.07Å; K15-F19 HydrophobicContact CG-CE2 3.47Å; K15-F19 VanDerWaalsContact CG-CE2 3.47Å; K15-F19 HydrophobicContact CG-CZ 4.22Å; K15-F19 WeakPolarHBondContact O-CB 3.14Å; K15-F19 WeakPolarHBondContact O-CD2 3.27Å; K15-F19 WeakPolarHBondContact O-CG 3.33Å; K15-F19 PolarHBondContact O-N 3.35Å; S16-F19 PolarHBondContact O-N 3.27Å; E17-F19 PolarHBondContact O-N 3.46Å; F19-T22 PolarHBondContact O-N 2.98Å; F19-A23 WeakPolarHBondContact O-CB 3.49Å; F19-A23 PolarHBondContact O-N 2.91Å; F19-L82 HydrophobicContact CB-CD1 3.99Å; F19-L82 HydrophobicContact CB-CD2 3.99Å
20T87.6Confident76.6Confident50 Ų5075.1 Ų75.131%0.30738%0.375SS..Hα-helixtrans-64.2-44.5177.9-57.30000110.8S16 E17 T22 A23 W24S16-T20 WeakPolarHBondContact O-CB 3.24Å; S16-T20 PolarHBondContact O-N 3.47Å; S16-T20 PolarHBondContact O-OG1 3.47Å; E17-T20 PolarHBondContact O-N 3.03Å; T20-T22 VanDerWaalsContact C-N 3.34Å; T20-T22 PolarHBondContact O-N 3.43Å; T20-A23 PolarHBondContact O-N 2.98Å; T20-W24 VanDerWaalsContact O-CD1 3.23Å; T20-W24 PolarHBondContact O-N 3.17Å; T20-W24 VanDerWaalsContact O-N 3.07Å
21K90.1Very high79.5Confident120 Ų12069 Ų6952%0.52236%0.357SS..Hα-helixtrans-58.1-48173.6-74.6174.5-176.5166.90110.8E17 S18 A23 W24 T25E17-K21 HydrophobicContact CG-CD 4.49Å; E17-K21 WeakPolarHBondContact O-CG 3.49Å; E17-K21 PolarHBondContact O-N 3.44Å; E17-K21 WeakPolarHBondContact OE1-CE 3.42Å; E17-K21 IonicContact OE1-NZ 3.81Å; E17-K21 PolarHBondContact OE1-NZ 3.36Å; S18-K21 PolarHBondContact O-N 2.9Å; K21-A23 VanDerWaalsContact C-N 3.31Å; K21-A23 PolarHBondContact O-N 3.28Å; K21-W24 PolarHBondContact O-N 3Å; K21-T25 WeakPolarHBondContact O-CG2 3.07Å; K21-T25 PolarHBondContact O-N 3.19Å; K21-T25 PolarHBondContact O-OG1 3.41Å
22T88.4Confident82.3Confident22 Ų2268.7 Ų68.714%0.13536%0.355CS..Hα-helixtrans-63-36.3179.4-52.70000112.4S18 F19 T20 T25 M26 R78S18-T22 WeakPolarHBondContact O-CB 3.38Å; S18-T22 PolarHBondContact O-N 3.24Å; S18-T22 PolarHBondContact O-OG1 3.03Å; F19-T22 PolarHBondContact O-N 2.98Å; T20-T22 VanDerWaalsContact C-N 3.34Å; T20-T22 PolarHBondContact O-N 3.43Å; T22-T25 VanDerWaalsContact CA-OG1 3.29Å; T22-T25 WeakPolarHBondContact CA-OG1 3.14Å; T22-T25 PolarHBondContact O-N 3.06Å; T22-T25 PolarHBondContact O-OG1 3.34Å; T22-M26 VanDerWaalsContact O-CG 3.3Å; T22-M26 WeakPolarHBondContact O-CG 3.33Å; T22-M26 PolarHBondContact O-N 3.47Å; T22-R78 VanDerWaalsContact CG2-NH1 3.33Å
23A91.6Very high84.6Confident0 Ų063.4 Ų63.40%032%0.321CS..Hα-helixtrans-66.3-45.7176.700000111.6F19 T20 K21 M26 V27 R78 L79F19-A23 WeakPolarHBondContact O-CB 3.49Å; F19-A23 PolarHBondContact O-N 2.91Å; T20-A23 PolarHBondContact O-N 2.98Å; K21-A23 VanDerWaalsContact C-N 3.31Å; K21-A23 PolarHBondContact O-N 3.28Å; A23-M26 PolarHBondContact O-N 3.34Å; A23-V27 WeakPolarHBondContact O-CG2 3.48Å; A23-V27 PolarHBondContact O-N 3.22Å; A23-R78 HydrophobicContact CB-CB 3.68Å; A23-L79 HydrophobicContact CB-CD2 3.75Å; A23-L79 HydrophobicContact CB-CG 3.85Å
24W94.7Very high87.4Confident151 Ų15158.1 Ų58.157%0.57230%0.302SS*.Hα-helixtrans-64.5-38.2175.3-77.8113.9000112.8T20 K21 V27 A28 L79T20-W24 VanDerWaalsContact O-CD1 3.23Å; T20-W24 PolarHBondContact O-N 3.17Å; T20-W24 VanDerWaalsContact O-N 3.07Å; K21-W24 PolarHBondContact O-N 3Å; W24-V27 PolarHBondContact O-N 3.45Å; W24-A28 WeakPolarHBondContact O-CB 3.4Å; W24-A28 PolarHBondContact O-N 2.87Å; W24-L79 HydrophobicContact CD2-CD1 4.29Å; W24-L79 HydrophobicContact CE3-CD1 4.43Å; W24-L79 HydrophobicContact CH2-CD1 4.25Å; W24-L79 HydrophobicContact CZ2-CD1 4.09Å; W24-L79 HydrophobicContact CZ3-CD1 4.41Å
25T93.8Very high89.8Confident55 Ų5556.3 Ų56.334%0.33730%0.298SS..Hα-helixtrans-65.4-40.4175.557.20000111.2K21 T22 V27 A28 V29K21-T25 WeakPolarHBondContact O-CG2 3.07Å; K21-T25 PolarHBondContact O-N 3.19Å; K21-T25 PolarHBondContact O-OG1 3.41Å; T22-T25 VanDerWaalsContact CA-OG1 3.29Å; T22-T25 WeakPolarHBondContact CA-OG1 3.14Å; T22-T25 PolarHBondContact O-N 3.06Å; T22-T25 PolarHBondContact O-OG1 3.34Å; T25-V27 PolarHBondContact O-N 3.28Å; T25-A28 PolarHBondContact O-N 2.88Å; T25-V29 WeakPolarHBondContact O-CB 3.39Å; T25-V29 VanDerWaalsContact O-CG2 3.22Å; T25-V29 WeakPolarHBondContact O-CG2 3.3Å; T25-V29 PolarHBondContact O-N 2.79Å
26M93.7Very high91.4Very high14 Ų1450.9 Ų50.97%0.06928%0.277CS..Hα-helixtrans-61.9-42.2174.2-73-176.3103.200112.7T22 A23 G30 Y71 A74 R78 L270T22-M26 VanDerWaalsContact O-CG 3.3Å; T22-M26 WeakPolarHBondContact O-CG 3.33Å; T22-M26 PolarHBondContact O-N 3.47Å; A23-M26 PolarHBondContact O-N 3.34Å; M26-G30 PolarHBondContact O-N 2.96Å; M26-Y71 HydrophobicContact CE-CD1 4.07Å; M26-Y71 HydrophobicContact CE-CE1 4.37Å; M26-A74 HydrophobicContact CE-CB 4.13Å; M26-R78 PolarHBondContact SD-NE 3.29Å; M26-R78 PolarHBondContact SD-NH1 3.05Å; M26-L270 HydrophobicContact CG-CD2 3.82Å
27V96.1Very high92.7Very high12 Ų1248.8 Ų48.87%0.07326%0.262CS..Hα-helixtrans-60.5-51.1174.7173.80000110.3A23 W24 T25 G30 C31 T72A23-V27 WeakPolarHBondContact O-CG2 3.48Å; A23-V27 PolarHBondContact O-N 3.22Å; W24-V27 PolarHBondContact O-N 3.45Å; T25-V27 PolarHBondContact O-N 3.28Å; V27-G30 PolarHBondContact O-N 3.19Å; V27-C31 WeakPolarHBondContact O-CB 3.47Å; V27-C31 PolarHBondContact O-N 2.99Å; V27-C31 PolarHBondContact O-SG 3.49Å; V27-T72 HydrophobicContact CG1-CG2 4.48Å
28A96Very high93.6Very high58 Ų5845.8 Ų45.848%0.47925%0.252SS..Hα-helixtrans-61-49.9-178.700000111.6W24 T25 G30 C31 V32W24-A28 WeakPolarHBondContact O-CB 3.4Å; W24-A28 PolarHBondContact O-N 2.87Å; T25-A28 PolarHBondContact O-N 2.88Å; A28-G30 PolarHBondContact O-N 3.49Å; A28-C31 PolarHBondContact O-N 3.41Å; A28-V32 WeakPolarHBondContact O-CG2 3.48Å; A28-V32 PolarHBondContact O-N 3.13Å
29V95.4Very high94.3Very high22 Ų2246.4 Ų46.413%0.13325%0.249CC..Hα-helixtrans-67.4-34.2-178.51700000111.8T25 P33 L270 P273 L274T25-V29 WeakPolarHBondContact O-CB 3.39Å; T25-V29 VanDerWaalsContact O-CG2 3.22Å; T25-V29 WeakPolarHBondContact O-CG2 3.3Å; T25-V29 PolarHBondContact O-N 2.79Å; V29-P33 WeakPolarHBondContact O-CD 3.4Å; V29-L270 WeakPolarHBondContact CG1-O 3.3Å; V29-P273 HydrophobicContact CG1-CB 3.58Å; V29-P273 HydrophobicContact CG1-CG 3.59Å; V29-L274 HydrophobicContact CG1-CD2 4.33Å; V29-L274 HydrophobicContact CG1-CG 4.21Å
30G96.8Very high94.9Very high0 Ų044.3 Ų44.30%024%0.241CC..Hα-helixtrans-72.8-34.217500000113.7M26 V27 A28 V32 P33 F34 G68 T72M26-G30 PolarHBondContact O-N 2.96Å; V27-G30 PolarHBondContact O-N 3.19Å; A28-G30 PolarHBondContact O-N 3.49Å; G30-V32 VanDerWaalsContact C-N 3.27Å; G30-V32 PolarHBondContact O-N 3.19Å; G30-P33 VanDerWaalsContact O-CD 3.22Å; G30-P33 WeakPolarHBondContact O-CD 3.48Å; G30-P33 VanDerWaalsContact O-CG 3.3Å; G30-P33 WeakPolarHBondContact O-CG 3.29Å; G30-F34 WeakPolarHBondContact O-CB 3.49Å; G30-F34 PolarHBondContact O-N 2.87Å; G30-G68 CarbonylContact O-C 3.56Å; G30-G68 WeakPolarHBondContact O-CA 3.26Å; G30-T72 VanDerWaalsContact C-OG1 3.25Å
31C97.3Very high95.3Very high47 Ų4743.6 Ų43.632%0.31824%0.235SC..Hα-helixtrans-63.7-32.1176.3-77.50000112.4V27 A28 F34 V35 T72V27-C31 WeakPolarHBondContact O-CB 3.47Å; V27-C31 PolarHBondContact O-N 2.99Å; V27-C31 PolarHBondContact O-SG 3.49Å; A28-C31 PolarHBondContact O-N 3.41Å; C31-F34 PolarHBondContact O-N 3.44Å; C31-V35 WeakPolarHBondContact O-CB 3.34Å; C31-V35 VanDerWaalsContact O-CG2 3.28Å; C31-V35 WeakPolarHBondContact O-CG2 3.49Å; C31-V35 PolarHBondContact O-N 3.46Å; C31-T72 PolarHBondContact N-OG1 3.01Å
32V97.2Very high95.5Very high59 Ų5943.9 Ų43.936%0.35824%0.241SC..Hα-helixtrans-60.3-59.8179.1-179.90000112.8A28 G30 F34 V35 T36 T277A28-V32 WeakPolarHBondContact O-CG2 3.48Å; A28-V32 PolarHBondContact O-N 3.13Å; G30-V32 VanDerWaalsContact C-N 3.27Å; G30-V32 PolarHBondContact O-N 3.19Å; V32-F34 VanDerWaalsContact C-N 3.28Å; V32-F34 PolarHBondContact O-N 2.87Å; V32-V35 PolarHBondContact O-N 3.24Å; V32-T36 WeakPolarHBondContact O-CB 3.4Å; V32-T36 VanDerWaalsContact O-CG2 3.27Å; V32-T36 WeakPolarHBondContact O-CG2 3.49Å; V32-T36 PolarHBondContact O-N 3.27Å; V32-T36 PolarHBondContact O-OG1 3.35Å; V32-T277 HydrophobicContact CG1-CG2 3.68Å
33P96.8Very high95.7Very high0 Ų043.6 Ų43.60%024%0.239CC..Hα-helixtrans-63.7-32176.224.8-32.9000112.3V29 G30 T36 S37 T64 P273 T277V29-P33 WeakPolarHBondContact O-CD 3.4Å; G30-P33 VanDerWaalsContact O-CD 3.22Å; G30-P33 WeakPolarHBondContact O-CD 3.48Å; G30-P33 VanDerWaalsContact O-CG 3.3Å; G30-P33 WeakPolarHBondContact O-CG 3.29Å; P33-T36 VanDerWaalsContact CA-OG1 3.26Å; P33-T36 WeakPolarHBondContact CA-OG1 3.42Å; P33-T36 PolarHBondContact O-OG1 3.34Å; P33-S37 WeakPolarHBondContact O-CB 3.36Å; P33-S37 PolarHBondContact O-N 3.26Å; P33-S37 PolarHBondContact O-OG 2.83Å; P33-T64 HydrophobicContact CB-CG2 3.62Å; P33-P273 HydrophobicContact CG-CB 3.91Å; P33-T277 WeakPolarHBondContact CA-OG1 3.48Å
34F97.7Very high95.8Very high81 Ų8143.7 Ų43.736%0.35524%0.239SC..Hα-helixtrans-61.6-55.6176-177.8-93000111.6G30 C31 V32 S37 C38 L65 A69G30-F34 WeakPolarHBondContact O-CB 3.49Å; G30-F34 PolarHBondContact O-N 2.87Å; C31-F34 PolarHBondContact O-N 3.44Å; V32-F34 VanDerWaalsContact C-N 3.28Å; V32-F34 PolarHBondContact O-N 2.87Å; F34-S37 PolarHBondContact O-N 2.92Å; F34-C38 WeakPolarHBondContact O-CB 3.4Å; F34-C38 PolarHBondContact O-N 3.26Å; F34-C38 PolarHBondContact O-SG 3.38Å; F34-C38 VanDerWaalsContact O-SG 3.33Å; F34-L65 HydrophobicContact CD2-CD2 4.41Å; F34-L65 HydrophobicContact CD2-CG 4.18Å; F34-L65 HydrophobicContact CE2-CD2 4.16Å; F34-L65 HydrophobicContact CE2-CG 4.27Å; F34-A69 HydrophobicContact CD2-CB 3.93Å; F34-A69 HydrophobicContact CE2-CB 4.1Å
35V97.6Very high95.6Very high76 Ų7640.1 Ų40.146%0.46124%0.237SC..Hα-helixtrans-64.8-45-178.8172.40000110.9C31 V32 S37 C38 I39C31-V35 WeakPolarHBondContact O-CB 3.34Å; C31-V35 VanDerWaalsContact O-CG2 3.28Å; C31-V35 WeakPolarHBondContact O-CG2 3.49Å; C31-V35 PolarHBondContact O-N 3.46Å; V32-V35 PolarHBondContact O-N 3.24Å; V35-S37 PolarHBondContact O-N 3.47Å; V35-C38 WeakPolarHBondContact O-CB 3.31Å; V35-C38 PolarHBondContact O-N 3.03Å; V35-I39 HydrophobicContact CG1-CD1 3.83Å; V35-I39 HydrophobicContact CG1-CG1 4.49Å; V35-I39 WeakPolarHBondContact O-CG1 2.94Å; V35-I39 PolarHBondContact O-N 3.5Å
36T96.2Very high95.4Very high27 Ų2739.2 Ų39.217%0.16623%0.233CC..Hα-helixtrans-64.8-40-179.954.30000112.1V32 P33 I39 I40 T277V32-T36 WeakPolarHBondContact O-CB 3.4Å; V32-T36 VanDerWaalsContact O-CG2 3.27Å; V32-T36 WeakPolarHBondContact O-CG2 3.49Å; V32-T36 PolarHBondContact O-N 3.27Å; V32-T36 PolarHBondContact O-OG1 3.35Å; P33-T36 VanDerWaalsContact CA-OG1 3.26Å; P33-T36 WeakPolarHBondContact CA-OG1 3.42Å; P33-T36 PolarHBondContact O-OG1 3.34Å; T36-I39 PolarHBondContact O-N 3.46Å; T36-I40 WeakPolarHBondContact O-CB 3.43Å; T36-I40 VanDerWaalsContact O-CG1 3.28Å; T36-I40 WeakPolarHBondContact O-CG1 3.38Å; T36-I40 PolarHBondContact O-N 2.89Å; T36-T277 HydrophobicContact CG2-CG2 3.79Å
37S97.2Very high95.2Very high0 Ų039.3 Ų39.30%023%0.234CC..Hα-helixtrans-65.5-41.3174.9-58.90000111.8P33 F34 V35 I39 I40 L41 C61 T64 L280P33-S37 WeakPolarHBondContact O-CB 3.36Å; P33-S37 PolarHBondContact O-N 3.26Å; P33-S37 PolarHBondContact O-OG 2.83Å; F34-S37 PolarHBondContact O-N 2.92Å; V35-S37 PolarHBondContact O-N 3.47Å; S37-I39 PolarHBondContact O-N 3.46Å; S37-I40 PolarHBondContact O-N 3.47Å; S37-L41 VanDerWaalsContact O-CB 3.27Å; S37-L41 WeakPolarHBondContact O-CB 3.24Å; S37-L41 WeakPolarHBondContact O-CG 3.23Å; S37-L41 PolarHBondContact O-N 3.32Å; S37-C61 WeakPolarHBondContact CB-O 3.46Å; S37-C61 PolarHBondContact OG-O 3.2Å; S37-T64 WeakPolarHBondContact OG-CG2 3.47Å; S37-L280 VanDerWaalsContact OG-CD1 3.32Å; S37-L280 WeakPolarHBondContact OG-CD1 3.38Å
38C97.4Very high94.6Very high40 Ų4046.2 Ų46.227%0.2726%0.263SS..Hα-helixtrans-57.2-49.5173.4-76.70000111.7F34 V35 I40 L41 L42 L65F34-C38 WeakPolarHBondContact O-CB 3.4Å; F34-C38 PolarHBondContact O-N 3.26Å; F34-C38 PolarHBondContact O-SG 3.38Å; F34-C38 VanDerWaalsContact O-SG 3.33Å; V35-C38 WeakPolarHBondContact O-CB 3.31Å; V35-C38 PolarHBondContact O-N 3.03Å; C38-I40 PolarHBondContact O-N 2.67Å; C38-L41 PolarHBondContact O-N 3.24Å; C38-L42 VanDerWaalsContact O-CG 3.27Å; C38-L42 WeakPolarHBondContact O-CG 3.32Å; C38-L42 PolarHBondContact O-N 3.31Å; C38-L65 VanDerWaalsContact SG-CD1 3.54Å
39I95.7Very high94Very high86 Ų8650.4 Ų50.444%0.44127%0.272SS..Hα-helixtrans-60.5-47178.8-67.1166.5000110.8V35 T36 S37 L42 L43V35-I39 HydrophobicContact CG1-CD1 3.83Å; V35-I39 HydrophobicContact CG1-CG1 4.49Å; V35-I39 WeakPolarHBondContact O-CG1 2.94Å; V35-I39 PolarHBondContact O-N 3.5Å; T36-I39 PolarHBondContact O-N 3.46Å; S37-I39 PolarHBondContact O-N 3.46Å; I39-L42 PolarHBondContact O-N 2.88Å; I39-L43 HydrophobicContact CG2-CD1 4.1Å; I39-L43 WeakPolarHBondContact O-CG 3.38Å; I39-L43 PolarHBondContact O-N 3.49Å
40I95.4Very high93.5Very high11 Ų1153.2 Ų53.26%0.05628%0.283CS..Hα-helixtrans-65.7-40.8-179.6-67.9168.8000111T36 S37 C38 L42 L43 V44 F57 C61 L280T36-I40 WeakPolarHBondContact O-CB 3.43Å; T36-I40 VanDerWaalsContact O-CG1 3.28Å; T36-I40 WeakPolarHBondContact O-CG1 3.38Å; T36-I40 PolarHBondContact O-N 2.89Å; S37-I40 PolarHBondContact O-N 3.47Å; C38-I40 PolarHBondContact O-N 2.67Å; I40-L42 VanDerWaalsContact C-N 3.33Å; I40-L42 PolarHBondContact O-N 3.23Å; I40-L43 WeakPolarHBondContact O-CB 3.37Å; I40-L43 PolarHBondContact O-N 3.28Å; I40-V44 HydrophobicContact CG2-CG2 4.1Å; I40-V44 WeakPolarHBondContact O-CB 3.4Å; I40-V44 VanDerWaalsContact O-CG2 3.27Å; I40-V44 WeakPolarHBondContact O-CG2 3.43Å; I40-V44 PolarHBondContact O-N 3.47Å; I40-F57 HydrophobicContact CG2-CE1 3.58Å; I40-F57 HydrophobicContact CG2-CZ 3.89Å; I40-C61 VanDerWaalsContact CG2-SG 3.59Å; I40-L280 HydrophobicContact CD1-CB 3.69Å; I40-L280 HydrophobicContact CD1-CD1 4.46Å
41L96.2Very high93.1Very high35 Ų3556.5 Ų56.518%0.18330%0.295CS..Hα-helixtrans-63.1-39.3176.4-74.8170.5000112S37 C38 V44 S45 T58 C61 V62 L65S37-L41 VanDerWaalsContact O-CB 3.27Å; S37-L41 WeakPolarHBondContact O-CB 3.24Å; S37-L41 WeakPolarHBondContact O-CG 3.23Å; S37-L41 PolarHBondContact O-N 3.32Å; C38-L41 PolarHBondContact O-N 3.24Å; L41-V44 PolarHBondContact O-N 3.49Å; L41-S45 VanDerWaalsContact O-CB 3.31Å; L41-S45 WeakPolarHBondContact O-CB 3.42Å; L41-S45 PolarHBondContact O-N 3.48Å; L41-S45 PolarHBondContact O-OG 3.38Å; L41-T58 HydrophobicContact CD2-CG2 3.67Å; L41-C61 HydrophobicContact CD1-CB 4.42Å; L41-C61 HydrophobicContact CD2-CB 3.71Å; L41-C61 HydrophobicContact CG-CB 3.86Å; L41-V62 HydrophobicContact CD1-CG2 4.12Å; L41-V62 HydrophobicContact CD2-CG2 3.99Å; L41-L65 HydrophobicContact CD1-CD1 3.69Å
42L94.6Very high92.7Very high125 Ų12555.3 Ų55.365%0.65429%0.285SS*.Hα-helixtrans-64.3-39173.1-69.9171.9000112.1C38 I39 I40 S45C38-L42 VanDerWaalsContact O-CG 3.27Å; C38-L42 WeakPolarHBondContact O-CG 3.32Å; C38-L42 PolarHBondContact O-N 3.31Å; I39-L42 PolarHBondContact O-N 2.88Å; I40-L42 VanDerWaalsContact C-N 3.33Å; I40-L42 PolarHBondContact O-N 3.23Å; L42-S45 PolarHBondContact O-OG 3.19Å
43L92.9Very high92.3Very high17 Ų1753.2 Ų53.29%0.08927%0.271CS..Hα-helixtrans-66.9-44.6174.9-70.5167.3000111.5I39 I40 S45 S46 C293 I294 L297I39-L43 HydrophobicContact CG2-CD1 4.1Å; I39-L43 WeakPolarHBondContact O-CG 3.38Å; I39-L43 PolarHBondContact O-N 3.49Å; I40-L43 WeakPolarHBondContact O-CB 3.37Å; I40-L43 PolarHBondContact O-N 3.28Å; L43-S45 VanDerWaalsContact C-N 3.35Å; L43-S46 WeakPolarHBondContact O-CB 3.44Å; L43-S46 PolarHBondContact O-N 3.24Å; L43-S46 PolarHBondContact O-OG 2.86Å; L43-C293 HydrophobicContact CD2-CB 4.2Å; L43-I294 HydrophobicContact CD1-CD1 4.31Å; L43-I294 HydrophobicContact CD1-CG1 3.61Å; L43-I294 HydrophobicContact CD2-CG1 4.41Å; L43-L297 HydrophobicContact CD2-CB 4.48Å; L43-L297 HydrophobicContact CD2-CD2 4.06Å
44V93Very high92Very high1 Ų153.2 Ų53.21%0.00627%0.271CS..Hα-helixtrans-71.3-29.7-178.71730000111.9I40 L41 S46 I47 L54 F57 T58 I290I40-V44 HydrophobicContact CG2-CG2 4.1Å; I40-V44 WeakPolarHBondContact O-CB 3.4Å; I40-V44 VanDerWaalsContact O-CG2 3.27Å; I40-V44 WeakPolarHBondContact O-CG2 3.43Å; I40-V44 PolarHBondContact O-N 3.47Å; L41-V44 PolarHBondContact O-N 3.49Å; V44-S46 PolarHBondContact O-N 2.87Å; V44-I47 WeakPolarHBondContact O-CB 3.37Å; V44-I47 PolarHBondContact O-N 2.97Å; V44-L54 HydrophobicContact CG1-CD1 3.86Å; V44-L54 HydrophobicContact CG1-CD2 4.21Å; V44-L54 HydrophobicContact CG1-CG 3.93Å; V44-L54 HydrophobicContact CG2-CD1 4.1Å; V44-F57 HydrophobicContact CG2-CD1 4.44Å; V44-F57 HydrophobicContact CG2-CE1 4.33Å; V44-T58 WeakPolarHBondContact CG1-OG1 3.39Å; V44-I290 HydrophobicContact CG2-CD1 4.07Å; V44-I290 HydrophobicContact CG2-CG1 4.26Å
45S91.1Very high91.9Very high77 Ų7749.9 Ų49.954%0.53826%0.256SS..Hα-helixtrans-67.1-24.8174.472.10000112.7L41 L42 L43 I47L41-S45 VanDerWaalsContact O-CB 3.31Å; L41-S45 WeakPolarHBondContact O-CB 3.42Å; L41-S45 PolarHBondContact O-N 3.48Å; L41-S45 PolarHBondContact O-OG 3.38Å; L42-S45 PolarHBondContact O-OG 3.19Å; L43-S45 VanDerWaalsContact C-N 3.35Å; S45-I47 PolarHBondContact O-N 3.27Å
46S88.8Confident91.7Very high35 Ų3546.3 Ų46.325%0.24524%0.235CC..THydrogen-bonded Turntrans-70.4-13.9173.879.30000113.9L43 V44 K48L43-S46 WeakPolarHBondContact O-CB 3.44Å; L43-S46 PolarHBondContact O-N 3.24Å; L43-S46 PolarHBondContact O-OG 2.86Å; V44-S46 PolarHBondContact O-N 2.87Å; S46-K48 PolarHBondContact O-N 2.63Å
47I89.5Confident91.6Very high16 Ų1645 Ų458%0.08223%0.227CC..  trans-86.7110.5-178.4-57.2172.5000109.8V44 S45 H49 L54 E289 I290V44-I47 WeakPolarHBondContact O-CB 3.37Å; V44-I47 PolarHBondContact O-N 2.97Å; S45-I47 PolarHBondContact O-N 3.27Å; I47-H49 PolarHBondContact O-N 3.23Å; I47-L54 HydrophobicContact CB-CD2 4.23Å; I47-L54 HydrophobicContact CD1-CD2 3.85Å; I47-L54 HydrophobicContact CG2-CD2 3.91Å; I47-E289 HydrophobicContact CD1-CB 4.17Å; I47-I290 HydrophobicContact CD1-CG1 4.36Å
48K83.7Confident91.5Very high157 Ų15746.1 Ų46.168%0.68323%0.234SC*.SBendtrans-64.3-40-175.8-66-178-177.4173.80114.3S46 I304S46-K48 PolarHBondContact O-N 2.63Å; K48-I304 PolarHBondContact NZ-O 3.42Å
49H83.5Confident91.5Very high146 Ų14644.5 Ų44.568%0.67622%0.223SC*.SBendtrans-111.1102.6-177.9-75.6-60.6000111.2I47I47-H49 PolarHBondContact O-N 3.23Å
50K84.4Confident91.5Very high81 Ų8140.4 Ų40.435%0.35220%0.202SC..  trans-87.4115.7179.8-57.9-172179.5-176.70111.3L54 I55K50-L54 HydrophobicContact CB-CD2 4.32Å; K50-L54 HydrophobicContact CG-CD2 4.14Å; K50-I55 HydrophobicContact CB-CD1 4.33Å; K50-I55 HydrophobicContact CB-CG1 3.83Å
51R88.7Confident91.6Very high69 Ų6939.9 Ų39.926%0.2620%0.2SC..  trans-69.5157.5166.159.7169.8178.1-101.7-7.3110.5E53 L54 I55 D287 E289R51-E53 VanDerWaalsContact C-N 3.27Å; R51-E53 HydrophobicContact CG-CB 4.32Å; R51-E53 IonicContact CZ-OE2 3.07Å; R51-E53 IonicContact NE-OE2 2.58Å; R51-E53 PolarHBondContact NE-OE2 3.21Å; R51-E53 IonicContact NH2-OE2 2.95Å; R51-E53 PolarHBondContact O-N 3.37Å; R51-L54 HydrophobicContact CG-CB 3.76Å; R51-L54 WeakPolarHBondContact O-CA 3.49Å; R51-L54 WeakPolarHBondContact O-CB 3.43Å; R51-L54 PolarHBondContact O-N 2.87Å; R51-I55 PolarHBondContact O-N 3.01Å; R51-D287 IonicContact CZ-OD1 2.98Å; R51-D287 IonicContact CZ-OD2 2.91Å; R51-D287 IonicContact NH2-OD1 3.55Å; R51-D287 PolarHBondContact NH2-OD1 3.14Å; R51-D287 IonicContact NH2-OD2 3.47Å; R51-D287 PolarHBondContact NH2-OD2 2.83Å; R51-E289 IonicContact CZ-OE1 3.79Å; R51-E289 IonicContact CZ-OE2 3.3Å; R51-E289 IonicContact NH1-OE1 3.87Å; R51-E289 PolarHBondContact NH1-OE1 3.32Å; R51-E289 IonicContact NH1-OE2 3.7Å; R51-E289 PolarHBondContact NH1-OE2 3.45Å; R51-E289 VanDerWaalsContact NH1-OE2 3.13Å
52K88.6Confident91.7Very high23 Ų2340.6 Ų40.610%0.121%0.205CC..Hα-helixtrans-50.4-46179.3-53-175.7-149.81690113L54 I55 F56 Y132 F135 S137K52-L54 VanDerWaalsContact C-N 3.29Å; K52-L54 PolarHBondContact O-N 3.44Å; K52-I55 WeakPolarHBondContact O-CB 3.5Å; K52-I55 PolarHBondContact O-N 3.26Å; K52-I55 VanDerWaalsContact O-N 3.09Å; K52-F56 VanDerWaalsContact O-CD2 3.3Å; K52-F56 WeakPolarHBondContact O-CD2 3.39Å; K52-F56 PolarHBondContact O-N 2.81Å; K52-Y132 PolarHBondContact NZ-O 3.24Å; K52-F135 HydrophobicContact CD-CD1 4.22Å; K52-F135 WeakPolarHBondContact CD-O 3.42Å; K52-F135 WeakPolarHBondContact CE-O 3.44Å; K52-F135 PolarHBondContact NZ-O 2.93Å; K52-S137 WeakPolarHBondContact CG-OG 3.26Å
53E88.7Confident91.8Very high14 Ų1434.6 Ų34.67%0.06517%0.174CC..Hα-helixtrans-58.3-40.3177.4-167.1-163.1-171.400112.2R51 I55 F56 F57 V234 R237 Y283R51-E53 VanDerWaalsContact C-N 3.27Å; R51-E53 HydrophobicContact CG-CB 4.32Å; R51-E53 IonicContact CZ-OE2 3.07Å; R51-E53 IonicContact NE-OE2 2.58Å; R51-E53 PolarHBondContact NE-OE2 3.21Å; R51-E53 IonicContact NH2-OE2 2.95Å; R51-E53 PolarHBondContact O-N 3.37Å; E53-I55 VanDerWaalsContact C-N 3.35Å; E53-F56 PolarHBondContact O-N 2.96Å; E53-F57 WeakPolarHBondContact O-CB 3.47Å; E53-F57 PolarHBondContact O-N 2.68Å; E53-V234 HydrophobicContact CG-CG1 4.37Å; E53-R237 IonicContact OE1-CZ 2.69Å; E53-R237 IonicContact OE1-NE 3.7Å; E53-R237 PolarHBondContact OE1-NE 3.47Å; E53-R237 IonicContact OE1-NH2 2.81Å; E53-R237 PolarHBondContact OE1-NH2 3.45Å; E53-R237 IonicContact OE2-CZ 3.7Å; E53-R237 IonicContact OE2-NH2 2.78Å; E53-R237 PolarHBondContact OE2-NH2 2.94Å; E53-Y283 VanDerWaalsContact CD-OH 3.32Å; E53-Y283 VanDerWaalsContact CG-OH 3.28Å; E53-Y283 WeakPolarHBondContact CG-OH 3.42Å; E53-Y283 PolarHBondContact OE1-OH 2.69Å
54L91.4Very high92Very high0 Ų033.8 Ų33.80%017%0.17CC..Hα-helixtrans-71.7-31.8177.8-172.364.4000111.4V44 I47 K50 R51 K52 F57 T58 I290V44-L54 HydrophobicContact CG1-CD1 3.86Å; V44-L54 HydrophobicContact CG1-CD2 4.21Å; V44-L54 HydrophobicContact CG1-CG 3.93Å; V44-L54 HydrophobicContact CG2-CD1 4.1Å; I47-L54 HydrophobicContact CB-CD2 4.23Å; I47-L54 HydrophobicContact CD1-CD2 3.85Å; I47-L54 HydrophobicContact CG2-CD2 3.91Å; K50-L54 HydrophobicContact CB-CD2 4.32Å; K50-L54 HydrophobicContact CG-CD2 4.14Å; R51-L54 HydrophobicContact CG-CB 3.76Å; R51-L54 WeakPolarHBondContact O-CA 3.49Å; R51-L54 WeakPolarHBondContact O-CB 3.43Å; R51-L54 PolarHBondContact O-N 2.87Å; K52-L54 VanDerWaalsContact C-N 3.29Å; K52-L54 PolarHBondContact O-N 3.44Å; L54-F57 HydrophobicContact CD1-CD1 4.24Å; L54-T58 WeakPolarHBondContact O-CB 3.48Å; L54-T58 PolarHBondContact O-N 3.21Å; L54-T58 PolarHBondContact O-OG1 3.26Å; L54-I290 HydrophobicContact CD1-CD1 4.13Å; L54-I290 HydrophobicContact CD1-CG1 4.39Å
55I94.7Very high92.3Very high11 Ų1135.6 Ų35.66%0.05618%0.179CC..Hα-helixtrans-64.7-48.6173-66.1164.7000109.9K50 R51 K52 E53 F57 T58 A59 E141 L144K50-I55 HydrophobicContact CB-CD1 4.33Å; K50-I55 HydrophobicContact CB-CG1 3.83Å; R51-I55 PolarHBondContact O-N 3.01Å; K52-I55 WeakPolarHBondContact O-CB 3.5Å; K52-I55 PolarHBondContact O-N 3.26Å; K52-I55 VanDerWaalsContact O-N 3.09Å; E53-I55 VanDerWaalsContact C-N 3.35Å; I55-F57 PolarHBondContact O-N 3.25Å; I55-T58 WeakPolarHBondContact O-CB 3.49Å; I55-T58 PolarHBondContact O-N 3.43Å; I55-A59 PolarHBondContact O-N 2.85Å; I55-E141 HydrophobicContact CD1-CG 4.05Å; I55-E141 HydrophobicContact CG2-CG 3.81Å; I55-L144 HydrophobicContact CG2-CD1 3.54Å
56F94.6Very high92.6Very high1 Ų133.6 Ų33.60%0.00416%0.162CC..Hα-helixtrans-62.1-42.1175-68.1-50.8000112.4K52 E53 T58 A59 L60 V114 L117 L118 D121 F135 A140 L144K52-F56 VanDerWaalsContact O-CD2 3.3Å; K52-F56 WeakPolarHBondContact O-CD2 3.39Å; K52-F56 PolarHBondContact O-N 2.81Å; E53-F56 PolarHBondContact O-N 2.96Å; F56-T58 VanDerWaalsContact C-N 3.31Å; F56-T58 PolarHBondContact O-N 3.35Å; F56-A59 PolarHBondContact O-N 2.95Å; F56-L60 PolarHBondContact O-N 2.97Å; F56-V114 HydrophobicContact CB-CG1 4.46Å; F56-V114 VanDerWaalsContact O-CG1 3.31Å; F56-V114 WeakPolarHBondContact O-CG1 3.32Å; F56-L117 HydrophobicContact CD1-CB 4.25Å; F56-L117 HydrophobicContact CE1-CB 3.81Å; F56-L117 HydrophobicContact CE1-CD1 3.85Å; F56-L117 HydrophobicContact CE1-CG 4.48Å; F56-L117 HydrophobicContact CZ-CB 4.09Å; F56-L118 HydrophobicContact CB-CB 4.22Å; F56-L118 HydrophobicContact CB-CD1 4.12Å; F56-L118 HydrophobicContact CG-CB 4.49Å; F56-D121 HydrophobicContact CE2-CB 4.05Å; F56-F135 HydrophobicContact CE2-CE1 4.11Å; F56-F135 AromaticContact CZ-CE1 3.68Å; F56-F135 HydrophobicContact CZ-CE1 3.68Å; F56-F135 AromaticContact CZ-CZ 3.93Å; F56-F135 HydrophobicContact CZ-CZ 3.93Å; F56-A140 HydrophobicContact CE1-CB 4.06Å; F56-A140 HydrophobicContact CE2-CB 4.4Å; F56-A140 HydrophobicContact CZ-CB 3.77Å; F56-L144 HydrophobicContact CD1-CD1 4.19Å; F56-L144 HydrophobicContact CD1-CD2 4.14Å; F56-L144 HydrophobicContact CD1-CG 4.38Å; F56-L144 HydrophobicContact CE1-CD1 4.5Å; F56-L144 HydrophobicContact CE1-CD2 4.4Å; F56-L144 HydrophobicContact CE1-CG 4.4Å
57F93.8Very high93Very high0 Ų032 Ų320%015%0.15CC..Hα-helixtrans-62.8-37.2174.4-179.7-110.4000112.6I40 V44 E53 L54 I55 A59 L60 C61 L280 Y283 I290I40-F57 HydrophobicContact CG2-CE1 3.58Å; I40-F57 HydrophobicContact CG2-CZ 3.89Å; V44-F57 HydrophobicContact CG2-CD1 4.44Å; V44-F57 HydrophobicContact CG2-CE1 4.33Å; E53-F57 WeakPolarHBondContact O-CB 3.47Å; E53-F57 PolarHBondContact O-N 2.68Å; L54-F57 HydrophobicContact CD1-CD1 4.24Å; I55-F57 PolarHBondContact O-N 3.25Å; F57-A59 VanDerWaalsContact C-N 3.34Å; F57-L60 HydrophobicContact CD2-CD2 4.35Å; F57-L60 WeakPolarHBondContact O-CB 3.23Å; F57-L60 PolarHBondContact O-N 3.44Å; F57-C61 VanDerWaalsContact CE1-SG 3.57Å; F57-C61 VanDerWaalsContact CZ-SG 3.53Å; F57-C61 PolarHBondContact O-N 2.9Å; F57-C61 PolarHBondContact O-SG 2.81Å; F57-L280 HydrophobicContact CD2-CD2 4.47Å; F57-L280 HydrophobicContact CE2-CD2 3.63Å; F57-L280 HydrophobicContact CZ-CD2 4.12Å; F57-Y283 HydrophobicContact CB-CD1 4.41Å; F57-Y283 HydrophobicContact CB-CE1 3.75Å; F57-Y283 AromaticContact CD1-CD1 3.73Å; F57-Y283 HydrophobicContact CD1-CD1 3.73Å; F57-Y283 AromaticContact CD1-CE1 3.54Å; F57-Y283 HydrophobicContact CD1-CE1 3.54Å; F57-Y283 AromaticContact CD2-CD1 3.18Å; F57-Y283 HydrophobicContact CD2-CD1 3.18Å; F57-Y283 HydrophobicContact CD2-CD2 4.19Å; F57-Y283 AromaticContact CD2-CE1 3.42Å; F57-Y283 HydrophobicContact CD2-CE1 3.42Å; F57-Y283 VanDerWaalsContact CD2-CE1 3.42Å; F57-Y283 HydrophobicContact CD2-CE2 4.35Å; F57-Y283 AromaticContact CD2-CG 3.58Å; F57-Y283 HydrophobicContact CD2-CG 3.58Å; F57-Y283 AromaticContact CD2-CZ 3.99Å; F57-Y283 AromaticContact CE1-CD1 3.67Å; F57-Y283 HydrophobicContact CE1-CD1 3.67Å; F57-Y283 AromaticContact CE1-CE1 3.95Å; F57-Y283 HydrophobicContact CE1-CE1 3.95Å; F57-Y283 AromaticContact CE2-CD1 3.13Å; F57-Y283 HydrophobicContact CE2-CD1 3.13Å; F57-Y283 HydrophobicContact CE2-CD2 4.45Å; F57-Y283 AromaticContact CE2-CE1 3.86Å; F57-Y283 HydrophobicContact CE2-CE1 3.86Å; F57-Y283 AromaticContact CE2-CG 3.47Å; F57-Y283 HydrophobicContact CE2-CG 3.47Å; F57-Y283 VanDerWaalsContact CE2-CG 3.47Å; F57-Y283 AromaticContact CG-CD1 3.49Å; F57-Y283 HydrophobicContact CG-CD1 3.49Å; F57-Y283 VanDerWaalsContact CG-CD1 3.49Å; F57-Y283 AromaticContact CG-CE1 3.24Å; F57-Y283 HydrophobicContact CG-CE1 3.24Å; F57-Y283 HydrophobicContact CG-CG 4.29Å; F57-Y283 AromaticContact CG-CZ 3.88Å; F57-Y283 AromaticContact CZ-CD1 3.38Å; F57-Y283 HydrophobicContact CZ-CD1 3.38Å; F57-Y283 HydrophobicContact CZ-CE1 4.1Å; F57-Y283 HydrophobicContact CZ-CG 4.09Å; F57-I290 HydrophobicContact CD1-CD1 3.92Å; F57-I290 HydrophobicContact CE1-CD1 3.57Å; F57-I290 HydrophobicContact CZ-CD1 4.45Å
58T95.8Very high93.4Very high23 Ų2331.2 Ų31.214%0.14115%0.147CC..Hα-helixtrans-61.3-45.2173.9-54.80000110.2L41 V44 L54 I55 F56 L60 C61 V62L41-T58 HydrophobicContact CD2-CG2 3.67Å; V44-T58 WeakPolarHBondContact CG1-OG1 3.39Å; L54-T58 WeakPolarHBondContact O-CB 3.48Å; L54-T58 PolarHBondContact O-N 3.21Å; L54-T58 PolarHBondContact O-OG1 3.26Å; I55-T58 WeakPolarHBondContact O-CB 3.49Å; I55-T58 PolarHBondContact O-N 3.43Å; F56-T58 VanDerWaalsContact C-N 3.31Å; F56-T58 PolarHBondContact O-N 3.35Å; T58-L60 VanDerWaalsContact C-N 3.31Å; T58-L60 PolarHBondContact O-N 2.77Å; T58-C61 WeakPolarHBondContact O-CB 3.41Å; T58-C61 PolarHBondContact O-N 3.43Å; T58-V62 WeakPolarHBondContact O-CG2 3.48Å; T58-V62 PolarHBondContact O-N 2.96Å
59A97.2Very high94.1Very high7 Ų724.6 Ų24.66%0.05812%0.121CC..Hα-helixtrans-64-36.4176.300000112.6I55 F56 F57 V62 S63 V114 L144 Y148I55-A59 PolarHBondContact O-N 2.85Å; F56-A59 PolarHBondContact O-N 2.95Å; F57-A59 VanDerWaalsContact C-N 3.34Å; A59-V62 PolarHBondContact O-N 3.22Å; A59-S63 WeakPolarHBondContact O-CB 3.36Å; A59-S63 PolarHBondContact O-N 2.92Å; A59-S63 PolarHBondContact O-OG 3.43Å; A59-V114 HydrophobicContact CB-CG1 4.28Å; A59-V114 HydrophobicContact CB-CG2 3.82Å; A59-L144 HydrophobicContact CB-CD1 3.78Å; A59-L144 HydrophobicContact CB-CD2 3.6Å; A59-L144 HydrophobicContact CB-CG 4.25Å; A59-Y148 HydrophobicContact CB-CE2 4.39Å; A59-Y148 PolarHBondContact O-OH 3.25Å
60L95.5Very high94.7Very high0 Ų017.6 Ų17.60%09%0.089CC..Hα-helixtrans-62.4-43.9172.9-168.164.6000110.9F56 F57 T58 V62 S63 T64 S111 V114 I241 E279 L280F56-L60 PolarHBondContact O-N 2.97Å; F57-L60 HydrophobicContact CD2-CD2 4.35Å; F57-L60 WeakPolarHBondContact O-CB 3.23Å; F57-L60 PolarHBondContact O-N 3.44Å; T58-L60 VanDerWaalsContact C-N 3.31Å; T58-L60 PolarHBondContact O-N 2.77Å; L60-V62 PolarHBondContact O-N 2.87Å; L60-S63 PolarHBondContact O-N 3.4Å; L60-T64 PolarHBondContact O-N 3.45Å; L60-T64 PolarHBondContact O-OG1 3.45Å; L60-T64 VanDerWaalsContact O-OG1 3.06Å; L60-S111 WeakPolarHBondContact CD1-OG 3.35Å; L60-V114 HydrophobicContact CB-CG1 4.05Å; L60-V114 HydrophobicContact CD1-CG1 4.36Å; L60-I241 HydrophobicContact CD2-CD1 4.28Å; L60-I241 HydrophobicContact CD2-CG2 4.28Å; L60-E279 WeakPolarHBondContact CD2-OE1 3.3Å; L60-L280 HydrophobicContact CD2-CD2 4.28Å; L60-L280 HydrophobicContact CG-CD2 4.19Å
61C97.1Very high95.3Very high0 Ų013.9 Ų13.90%07%0.073CC..Hα-helixtrans-62.2-41174.1-630000112.4S37 I40 L41 F57 T58 S63 T64 L65S37-C61 WeakPolarHBondContact CB-O 3.46Å; S37-C61 PolarHBondContact OG-O 3.2Å; I40-C61 VanDerWaalsContact CG2-SG 3.59Å; L41-C61 HydrophobicContact CD1-CB 4.42Å; L41-C61 HydrophobicContact CD2-CB 3.71Å; L41-C61 HydrophobicContact CG-CB 3.86Å; F57-C61 VanDerWaalsContact CE1-SG 3.57Å; F57-C61 VanDerWaalsContact CZ-SG 3.53Å; F57-C61 PolarHBondContact O-N 2.9Å; F57-C61 PolarHBondContact O-SG 2.81Å; T58-C61 WeakPolarHBondContact O-CB 3.41Å; T58-C61 PolarHBondContact O-N 3.43Å; C61-S63 VanDerWaalsContact C-N 3.35Å; C61-T64 PolarHBondContact O-N 3.48Å; C61-L65 VanDerWaalsContact O-CB 3.3Å; C61-L65 WeakPolarHBondContact O-CB 3.18Å; C61-L65 PolarHBondContact O-N 3Å
62V98Very high95.7Very high49 Ų4911.6 Ų11.630%0.2977%0.067SC..Hα-helixtrans-64.1-42.2175.5172.90000110.6L41 T58 A59 L60 L65 I66 Y148L41-V62 HydrophobicContact CD1-CG2 4.12Å; L41-V62 HydrophobicContact CD2-CG2 3.99Å; T58-V62 WeakPolarHBondContact O-CG2 3.48Å; T58-V62 PolarHBondContact O-N 2.96Å; A59-V62 PolarHBondContact O-N 3.22Å; L60-V62 PolarHBondContact O-N 2.87Å; V62-L65 WeakPolarHBondContact O-CB 3.28Å; V62-L65 PolarHBondContact O-N 3.22Å; V62-I66 HydrophobicContact CG1-CD1 3.96Å; V62-I66 VanDerWaalsContact O-CG1 3.27Å; V62-I66 WeakPolarHBondContact O-CG1 3.37Å; V62-I66 PolarHBondContact O-N 2.77Å; V62-Y148 HydrophobicContact CG1-CE1 4.22Å; V62-Y148 WeakPolarHBondContact CG1-OH 3.42Å
63S97.6Very high96.2Very high0 Ų011.9 Ų11.90%07%0.073CC..Hα-helixtrans-62-46.6176.4-51.90000111.3A59 L60 C61 L65 I66 L67 T110 Y148A59-S63 WeakPolarHBondContact O-CB 3.36Å; A59-S63 PolarHBondContact O-N 2.92Å; A59-S63 PolarHBondContact O-OG 3.43Å; L60-S63 PolarHBondContact O-N 3.4Å; C61-S63 VanDerWaalsContact C-N 3.35Å; S63-L65 VanDerWaalsContact C-N 3.32Å; S63-L65 PolarHBondContact O-N 3.49Å; S63-I66 PolarHBondContact O-N 3.12Å; S63-L67 WeakPolarHBondContact O-CG 3.35Å; S63-L67 PolarHBondContact O-N 3.49Å; S63-T110 WeakPolarHBondContact CB-OG1 3.35Å; S63-T110 PolarHBondContact OG-OG1 2.84Å; S63-Y148 PolarHBondContact N-OH 2.95Å; S63-Y148 PolarHBondContact OG-OH 2.68Å
64T96.8Very high96.5Very high0 Ų011.4 Ų11.40%07%0.072CC..Hα-helixtrans-64.9-33.6175.7-57.90000112.8P33 S37 L60 C61 L67 G68 L276 L280P33-T64 HydrophobicContact CB-CG2 3.62Å; S37-T64 WeakPolarHBondContact OG-CG2 3.47Å; L60-T64 PolarHBondContact O-N 3.45Å; L60-T64 PolarHBondContact O-OG1 3.45Å; L60-T64 VanDerWaalsContact O-OG1 3.06Å; C61-T64 PolarHBondContact O-N 3.48Å; T64-L67 PolarHBondContact O-N 2.9Å; T64-G68 PolarHBondContact O-N 3.2Å; T64-L276 HydrophobicContact CG2-CB 3.73Å; T64-L276 HydrophobicContact CG2-CD1 4.28Å; T64-L280 HydrophobicContact CG2-CD1 3.67Å; T64-L280 HydrophobicContact CG2-CG 4.41Å
65L98.1Very high96.6Very high39 Ų3911.4 Ų11.420%0.2047%0.072CC..Hα-helixtrans-63.8-47.4172.9-177.1153.3000110.9F34 C38 L41 C61 V62 S63 L67 G68 A69F34-L65 HydrophobicContact CD2-CD2 4.41Å; F34-L65 HydrophobicContact CD2-CG 4.18Å; F34-L65 HydrophobicContact CE2-CD2 4.16Å; F34-L65 HydrophobicContact CE2-CG 4.27Å; C38-L65 VanDerWaalsContact SG-CD1 3.54Å; L41-L65 HydrophobicContact CD1-CD1 3.69Å; C61-L65 VanDerWaalsContact O-CB 3.3Å; C61-L65 WeakPolarHBondContact O-CB 3.18Å; C61-L65 PolarHBondContact O-N 3Å; V62-L65 WeakPolarHBondContact O-CB 3.28Å; V62-L65 PolarHBondContact O-N 3.22Å; S63-L65 VanDerWaalsContact C-N 3.32Å; S63-L65 PolarHBondContact O-N 3.49Å; L65-L67 VanDerWaalsContact C-N 3.32Å; L65-L67 PolarHBondContact O-N 3.37Å; L65-G68 PolarHBondContact O-N 2.95Å; L65-A69 WeakPolarHBondContact O-CB 3.43Å; L65-A69 PolarHBondContact O-N 3.09Å
66I98.2Very high96.7Very high34 Ų3417.4 Ų17.417%0.17410%0.095CC..Hα-helixtrans-61.3-43.7177.4-65.8165.5000109.7V62 S63 A69 G70 M103 I106 Y148V62-I66 HydrophobicContact CG1-CD1 3.96Å; V62-I66 VanDerWaalsContact O-CG1 3.27Å; V62-I66 WeakPolarHBondContact O-CG1 3.37Å; V62-I66 PolarHBondContact O-N 2.77Å; S63-I66 PolarHBondContact O-N 3.12Å; I66-A69 PolarHBondContact O-N 3.1Å; I66-G70 PolarHBondContact O-N 3.01Å; I66-M103 HydrophobicContact CG2-CB 3.96Å; I66-M103 HydrophobicContact CG2-CG 4.21Å; I66-M103 VanDerWaalsContact CG2-O 3.29Å; I66-M103 WeakPolarHBondContact CG2-O 3.45Å; I66-I106 HydrophobicContact CD1-CG2 4.06Å; I66-Y148 HydrophobicContact CD1-CE1 3.96Å
67L96.9Very high96.7Very high1 Ų119 Ų191%0.00510%0.1CC..Hα-helixtrans-61.4-47.5174.9-72.2173.6000112.2S63 T64 L65 A69 G70 Y71 F104 E108 L276S63-L67 WeakPolarHBondContact O-CG 3.35Å; S63-L67 PolarHBondContact O-N 3.49Å; T64-L67 PolarHBondContact O-N 2.9Å; L65-L67 VanDerWaalsContact C-N 3.32Å; L65-L67 PolarHBondContact O-N 3.37Å; L67-A69 VanDerWaalsContact C-N 3.31Å; L67-A69 PolarHBondContact O-N 3.03Å; L67-G70 CarbonylContact O-C 3.59Å; L67-G70 WeakPolarHBondContact O-CA 3.45Å; L67-G70 PolarHBondContact O-N 3.21Å; L67-Y71 WeakPolarHBondContact O-CD2 3.43Å; L67-Y71 PolarHBondContact O-N 3.27Å; L67-F104 HydrophobicContact CD2-CD1 4.16Å; L67-E108 HydrophobicContact CD2-CG 3.6Å; L67-L276 HydrophobicContact CB-CD1 4.29Å; L67-L276 HydrophobicContact CD1-CD1 3.58Å
68G97.8Very high96.6Very high0 Ų020.3 Ų20.30%011%0.105CC..Hα-helixtrans-57.1-45.4176.300000112.2G30 T64 L65 G70 Y71 T72G30-G68 CarbonylContact O-C 3.56Å; G30-G68 WeakPolarHBondContact O-CA 3.26Å; T64-G68 PolarHBondContact O-N 3.2Å; L65-G68 PolarHBondContact O-N 2.95Å; G68-G70 VanDerWaalsContact C-N 3.3Å; G68-G70 PolarHBondContact O-N 2.89Å; G68-Y71 PolarHBondContact O-N 2.85Å; G68-T72 PolarHBondContact O-N 3.22Å; G68-T72 PolarHBondContact O-OG1 2.96Å; G68-T72 VanDerWaalsContact O-OG1 3.13Å
69A98.1Very high96.5Very high18 Ų1820.6 Ų20.615%0.14911%0.106CC..Hα-helixtrans-60.3-39.9172.800000112F34 L65 I66 L67 T72 A73 M103F34-A69 HydrophobicContact CD2-CB 3.93Å; F34-A69 HydrophobicContact CE2-CB 4.1Å; L65-A69 WeakPolarHBondContact O-CB 3.43Å; L65-A69 PolarHBondContact O-N 3.09Å; I66-A69 PolarHBondContact O-N 3.1Å; L67-A69 VanDerWaalsContact C-N 3.31Å; L67-A69 PolarHBondContact O-N 3.03Å; A69-T72 PolarHBondContact O-N 3.35Å; A69-A73 WeakPolarHBondContact O-CB 3.44Å; A69-A73 PolarHBondContact O-N 2.93Å; A69-M103 VanDerWaalsContact C-SD 3.53Å; A69-M103 HydrophobicContact CB-CE 4.07Å; A69-M103 HydrophobicContact CB-SD 3.8Å
70G97.7Very high96.2Very high0 Ų025.8 Ų25.80%013%0.125CC..Hα-helixtrans-60.4-48.7175.100000112.8I66 L67 G68 T72 A73 A74 H100 M103 F104I66-G70 PolarHBondContact O-N 3.01Å; L67-G70 CarbonylContact O-C 3.59Å; L67-G70 WeakPolarHBondContact O-CA 3.45Å; L67-G70 PolarHBondContact O-N 3.21Å; G68-G70 VanDerWaalsContact C-N 3.3Å; G68-G70 PolarHBondContact O-N 2.89Å; G70-T72 PolarHBondContact O-N 3.28Å; G70-A73 PolarHBondContact O-N 3.43Å; G70-A74 WeakPolarHBondContact O-CB 3.33Å; G70-A74 PolarHBondContact O-N 3.19Å; G70-H100 VanDerWaalsContact O-CB 3.26Å; G70-H100 WeakPolarHBondContact O-CB 3.47Å; G70-M103 PolarHBondContact N-SD 3.33Å; G70-M103 VanDerWaalsContact N-SD 3.43Å; G70-F104 VanDerWaalsContact C-CE1 3.44Å
71Y96.7Very high96Very high2 Ų226.1 Ų26.11%0.00813%0.127CC..Hα-helixtrans-62.8-42.7177-85.8-85000111.9M26 L67 G68 A74 G75 F104 W269 H272 P273M26-Y71 HydrophobicContact CE-CD1 4.07Å; M26-Y71 HydrophobicContact CE-CE1 4.37Å; L67-Y71 WeakPolarHBondContact O-CD2 3.43Å; L67-Y71 PolarHBondContact O-N 3.27Å; G68-Y71 PolarHBondContact O-N 2.85Å; Y71-A74 PolarHBondContact O-N 2.91Å; Y71-G75 PolarHBondContact O-N 2.71Å; Y71-F104 HydrophobicContact CD1-CE1 4.43Å; Y71-F104 HydrophobicContact CD1-CZ 4.35Å; Y71-F104 HydrophobicContact CD2-CD1 4.5Å; Y71-F104 AromaticContact CD2-CE1 3.56Å; Y71-F104 HydrophobicContact CD2-CE1 3.56Å; Y71-F104 HydrophobicContact CD2-CZ 4.26Å; Y71-F104 HydrophobicContact CE2-CD1 4.48Å; Y71-F104 AromaticContact CE2-CE1 3.79Å; Y71-F104 HydrophobicContact CE2-CE1 3.79Å; Y71-F104 HydrophobicContact CE2-CZ 4.48Å; Y71-F104 AromaticContact CG-CE1 3.9Å; Y71-F104 HydrophobicContact CG-CE1 3.9Å; Y71-F104 HydrophobicContact CG-CZ 4.18Å; Y71-W269 WeakPolarHBondContact CE1-O 3.36Å; Y71-W269 PolarHBondContact OH-O 3.22Å; Y71-H272 PolarHBondContact OH-ND1 3.33Å; Y71-P273 HydrophobicContact CD1-CG 3.85Å; Y71-P273 HydrophobicContact CD2-CB 4.35Å; Y71-P273 HydrophobicContact CD2-CG 3.65Å; Y71-P273 HydrophobicContact CE1-CG 3.59Å; Y71-P273 HydrophobicContact CE2-CB 4.41Å; Y71-P273 HydrophobicContact CE2-CG 3.45Å; Y71-P273 VanDerWaalsContact CE2-CG 3.45Å; Y71-P273 HydrophobicContact CG-CG 3.87Å
72T97.5Very high95.6Very high22 Ų2229 Ų2914%0.13514%0.142CC..Hα-helixtrans-63.7-44.8175.5-61.70000111.5V27 G30 C31 G68 A69 G70 G75 Y76V27-T72 HydrophobicContact CG1-CG2 4.48Å; G30-T72 VanDerWaalsContact C-OG1 3.25Å; C31-T72 PolarHBondContact N-OG1 3.01Å; G68-T72 PolarHBondContact O-N 3.22Å; G68-T72 PolarHBondContact O-OG1 2.96Å; G68-T72 VanDerWaalsContact O-OG1 3.13Å; A69-T72 PolarHBondContact O-N 3.35Å; G70-T72 PolarHBondContact O-N 3.28Å; T72-G75 PolarHBondContact O-N 3.01Å; T72-Y76 HydrophobicContact CG2-CD2 3.77Å; T72-Y76 HydrophobicContact CG2-CE2 3.55Å; T72-Y76 VanDerWaalsContact O-CD2 3.24Å; T72-Y76 WeakPolarHBondContact O-CD2 3.28Å; T72-Y76 PolarHBondContact O-N 3.37Å
73A97.2Very high95.1Very high29 Ų2930.6 Ų30.624%0.2416%0.155CC..Hα-helixtrans-63.4-40.417700000112.1A69 G70 Y76 R77 H100 M103A69-A73 WeakPolarHBondContact O-CB 3.44Å; A69-A73 PolarHBondContact O-N 2.93Å; G70-A73 PolarHBondContact O-N 3.43Å; A73-Y76 PolarHBondContact O-N 3.49Å; A73-R77 WeakPolarHBondContact O-CB 3.21Å; A73-R77 PolarHBondContact O-N 2.9Å; A73-H100 HydrophobicContact CB-CB 4.09Å; A73-M103 HydrophobicContact CB-SD 4.35Å
74A95.1Very high94.4Very high4 Ų438.8 Ų38.83%0.03319%0.187CC..Hα-helixtrans-62.3-43.2174.700000111.4M26 G70 Y71 R77 R78 H100 F104M26-A74 HydrophobicContact CE-CB 4.13Å; G70-A74 WeakPolarHBondContact O-CB 3.33Å; G70-A74 PolarHBondContact O-N 3.19Å; Y71-A74 PolarHBondContact O-N 2.91Å; A74-R77 PolarHBondContact O-N 2.69Å; A74-R78 WeakPolarHBondContact O-CG 3.37Å; A74-R78 PolarHBondContact O-N 3.13Å; A74-H100 HydrophobicContact CB-CB 3.82Å; A74-F104 HydrophobicContact CB-CE2 4.24Å; A74-F104 HydrophobicContact CB-CZ 4.06Å
75G95.3Very high93.1Very high0 Ų039.5 Ų39.50%019%0.193CC..Hα-helixtrans-60.6-47.5174.700000112.8Y71 T72 R77 R78 L79Y71-G75 PolarHBondContact O-N 2.71Å; T72-G75 PolarHBondContact O-N 3.01Å; G75-R77 VanDerWaalsContact C-N 3.35Å; G75-R77 PolarHBondContact O-N 2.77Å; G75-R78 PolarHBondContact O-N 3.5Å; G75-L79 PolarHBondContact O-N 2.78Å
76Y95.8Very high91.7Very high137 Ų13747.3 Ų47.354%0.53723%0.229SC..Hα-helixtrans-62-40.6175-82.2-64.1000112.7T72 A73 R78 L79 Y80T72-Y76 HydrophobicContact CG2-CD2 3.77Å; T72-Y76 HydrophobicContact CG2-CE2 3.55Å; T72-Y76 VanDerWaalsContact O-CD2 3.24Å; T72-Y76 WeakPolarHBondContact O-CD2 3.28Å; T72-Y76 PolarHBondContact O-N 3.37Å; A73-Y76 PolarHBondContact O-N 3.49Å; Y76-R78 VanDerWaalsContact C-N 3.33Å; Y76-R78 PolarHBondContact O-N 3.49Å; Y76-L79 PolarHBondContact O-N 2.86Å; Y76-Y80 WeakPolarHBondContact O-CB 3.48Å; Y76-Y80 PolarHBondContact O-N 2.58Å
77R93.9Very high90.9Very high33 Ų3350.6 Ų50.613%0.12524%0.24CC..Hα-helixtrans-59.6-44.5175.5178.565.2-179.2172.24.3111A73 A74 G75 Y80 V81 P174A73-R77 WeakPolarHBondContact O-CB 3.21Å; A73-R77 PolarHBondContact O-N 2.9Å; A74-R77 PolarHBondContact O-N 2.69Å; G75-R77 VanDerWaalsContact C-N 3.35Å; G75-R77 PolarHBondContact O-N 2.77Å; R77-Y80 PolarHBondContact O-N 3.27Å; R77-V81 WeakPolarHBondContact O-CB 3.49Å; R77-V81 VanDerWaalsContact O-CG2 3.27Å; R77-V81 WeakPolarHBondContact O-CG2 3.44Å; R77-V81 PolarHBondContact O-N 3.4Å; R77-P174 PolarHBondContact NE-O 3.28Å; R77-P174 PolarHBondContact NH2-O 2.91Å
78R92.9Very high90.5Very high29 Ų2957.2 Ų57.211%0.10927%0.268CS..Hα-helixtrans-61.5-45.3176.7-72179.3-180-162.44.2112T22 A23 M26 A74 G75 Y76 Y80 V81 L82 F175T22-R78 VanDerWaalsContact CG2-NH1 3.33Å; A23-R78 HydrophobicContact CB-CB 3.68Å; M26-R78 PolarHBondContact SD-NE 3.29Å; M26-R78 PolarHBondContact SD-NH1 3.05Å; A74-R78 WeakPolarHBondContact O-CG 3.37Å; A74-R78 PolarHBondContact O-N 3.13Å; G75-R78 PolarHBondContact O-N 3.5Å; Y76-R78 VanDerWaalsContact C-N 3.33Å; Y76-R78 PolarHBondContact O-N 3.49Å; R78-Y80 VanDerWaalsContact C-N 3.34Å; R78-Y80 PolarHBondContact O-N 3.4Å; R78-V81 PolarHBondContact O-N 2.91Å; R78-L82 WeakPolarHBondContact O-CB 3.47Å; R78-L82 VanDerWaalsContact O-CG 3.28Å; R78-L82 WeakPolarHBondContact O-CG 3.01Å; R78-L82 PolarHBondContact O-N 2.86Å; R78-F175 HydrophobicContact CB-CD1 4.22Å; R78-F175 HydrophobicContact CB-CE1 4.31Å; R78-F175 HydrophobicContact CG-CD1 3.78Å; R78-F175 HydrophobicContact CG-CE1 4.28Å
79L93Very high90.1Very high29 Ų2957.4 Ų57.415%0.15227%0.269CS..Hα-helixtrans-60.7-43.2175.6-68.5173000112.1A23 W24 G75 Y76 L82 S83A23-L79 HydrophobicContact CB-CD2 3.75Å; A23-L79 HydrophobicContact CB-CG 3.85Å; W24-L79 HydrophobicContact CD2-CD1 4.29Å; W24-L79 HydrophobicContact CE3-CD1 4.43Å; W24-L79 HydrophobicContact CH2-CD1 4.25Å; W24-L79 HydrophobicContact CZ2-CD1 4.09Å; W24-L79 HydrophobicContact CZ3-CD1 4.41Å; G75-L79 PolarHBondContact O-N 2.78Å; Y76-L79 PolarHBondContact O-N 2.86Å; L79-L82 PolarHBondContact O-N 3.49Å; L79-S83 WeakPolarHBondContact O-CB 3.48Å; L79-S83 PolarHBondContact O-N 2.85Å; L79-S83 VanDerWaalsContact O-N 3.11Å; L79-S83 PolarHBondContact O-OG 3.24Å
80Y92Very high89.8Confident116 Ų11657.4 Ų57.446%0.45527%0.268SS..Hα-helixtrans-62.1-45.9177176.2-95.9000111.7Y76 R77 R78 S83 Y84Y76-Y80 WeakPolarHBondContact O-CB 3.48Å; Y76-Y80 PolarHBondContact O-N 2.58Å; R77-Y80 PolarHBondContact O-N 3.27Å; R78-Y80 VanDerWaalsContact C-N 3.34Å; R78-Y80 PolarHBondContact O-N 3.4Å; Y80-S83 PolarHBondContact O-N 2.95Å; Y80-Y84 AromaticContact CD2-CD2 3.59Å; Y80-Y84 HydrophobicContact CD2-CD2 3.59Å; Y80-Y84 HydrophobicContact CD2-CE2 4.11Å; Y80-Y84 AromaticContact CE2-CD2 3.66Å; Y80-Y84 HydrophobicContact CE2-CD2 3.66Å; Y80-Y84 HydrophobicContact CE2-CE2 4.29Å; Y80-Y84 HydrophobicContact CE2-CG 4.25Å; Y80-Y84 HydrophobicContact CG-CD2 4.3Å; Y80-Y84 WeakPolarHBondContact O-CD2 3.31Å; Y80-Y84 PolarHBondContact O-N 3.43Å
81V90.9Very high89.5Confident6 Ų657.7 Ų57.74%0.03627%0.27CS..Hα-helixtrans-62.5-46.3178.9166.50000111.2R77 R78 S83 Y84 A85 P174 F175R77-V81 WeakPolarHBondContact O-CB 3.49Å; R77-V81 VanDerWaalsContact O-CG2 3.27Å; R77-V81 WeakPolarHBondContact O-CG2 3.44Å; R77-V81 PolarHBondContact O-N 3.4Å; R78-V81 PolarHBondContact O-N 2.91Å; V81-S83 PolarHBondContact O-N 3.4Å; V81-Y84 PolarHBondContact O-N 2.87Å; V81-A85 HydrophobicContact CB-CB 4.25Å; V81-A85 HydrophobicContact CG1-CB 4.07Å; V81-A85 HydrophobicContact CG2-CB 4.29Å; V81-A85 PolarHBondContact O-N 2.92Å; V81-P174 HydrophobicContact CG1-CB 3.78Å; V81-P174 HydrophobicContact CG1-CG 3.59Å; V81-P174 HydrophobicContact CG2-CB 4.06Å; V81-P174 WeakPolarHBondContact CG2-O 3.46Å; V81-F175 HydrophobicContact CB-CD1 4.01Å; V81-F175 HydrophobicContact CB-CE1 3.89Å; V81-F175 HydrophobicContact CG1-CD1 3.7Å; V81-F175 HydrophobicContact CG1-CE1 3.46Å; V81-F175 VanDerWaalsContact CG1-CE1 3.46Å; V81-F175 HydrophobicContact CG1-CG 4.38Å; V81-F175 HydrophobicContact CG1-CZ 3.95Å
82L88.5Confident89.3Confident61 Ų6160.5 Ų60.532%0.31928%0.283SS..Hα-helixtrans-62-26.6177.1-71168.2000113.4F19 R78 L79 F175F19-L82 HydrophobicContact CB-CD1 3.99Å; F19-L82 HydrophobicContact CB-CD2 3.99Å; R78-L82 WeakPolarHBondContact O-CB 3.47Å; R78-L82 VanDerWaalsContact O-CG 3.28Å; R78-L82 WeakPolarHBondContact O-CG 3.01Å; R78-L82 PolarHBondContact O-N 2.86Å; L79-L82 PolarHBondContact O-N 3.49Å; L82-F175 HydrophobicContact CD2-CE1 4.37Å; L82-F175 HydrophobicContact CD2-CZ 4Å; L82-F175 HydrophobicContact CG-CE1 4.17Å; L82-F175 HydrophobicContact CG-CZ 4.31Å
83S88.1Confident89.1Confident82 Ų8262.2 Ų62.257%0.57329%0.291SS*.Hα-helixtrans-89.5-29.7-177.9-53.90000113.3L79 Y80 V81L79-S83 WeakPolarHBondContact O-CB 3.48Å; L79-S83 PolarHBondContact O-N 2.85Å; L79-S83 VanDerWaalsContact O-N 3.11Å; L79-S83 PolarHBondContact O-OG 3.24Å; Y80-S83 PolarHBondContact O-N 2.95Å; V81-S83 PolarHBondContact O-N 3.4Å
84Y82.4Confident88.9Confident173 Ų17360.9 Ų60.968%0.67828%0.28SS*.Hα-helixtrans-137.2-16.1-165.1-59.6-73.8000115.8Y80 V81Y80-Y84 AromaticContact CD2-CD2 3.59Å; Y80-Y84 HydrophobicContact CD2-CD2 3.59Å; Y80-Y84 HydrophobicContact CD2-CE2 4.11Å; Y80-Y84 AromaticContact CE2-CD2 3.66Å; Y80-Y84 HydrophobicContact CE2-CD2 3.66Å; Y80-Y84 HydrophobicContact CE2-CE2 4.29Å; Y80-Y84 HydrophobicContact CE2-CG 4.25Å; Y80-Y84 HydrophobicContact CG-CD2 4.3Å; Y80-Y84 WeakPolarHBondContact O-CD2 3.31Å; Y80-Y84 PolarHBondContact O-N 3.43Å; V81-Y84 PolarHBondContact O-N 2.87Å
85A70.1Confident88.8Confident15 Ų1560.9 Ų60.912%0.12428%0.279CS..  trans-112.5105.8-168.900000112.3V81 Y87 P174V81-A85 HydrophobicContact CB-CB 4.25Å; V81-A85 HydrophobicContact CG1-CB 4.07Å; V81-A85 HydrophobicContact CG2-CB 4.29Å; V81-A85 PolarHBondContact O-N 2.92Å; A85-Y87 HydrophobicContact CB-CD1 3.99Å; A85-Y87 HydrophobicContact CB-CE1 3.66Å; A85-P174 HydrophobicContact CB-CB 4.39Å
86E66.8Low88.8Confident203 Ų20364.7 Ų64.795%0.94930%0.302SS*.  trans-101.223.1166.5-63.4-174.1169.400112.1
87Y83.3Confident88.7Confident103 Ų10363.3 Ų63.340%0.40430%0.299SS..SBendtrans-122.1147.1-173.565.4-90.8000113.3A85 P174A85-Y87 HydrophobicContact CB-CD1 3.99Å; A85-Y87 HydrophobicContact CB-CE1 3.66Å; Y87-P174 WeakPolarHBondContact O-CB 3.21Å; Y87-P174 WeakPolarHBondContact O-CG 3.32Å
88F87.3Confident88.7Confident139 Ų13961.8 Ų61.861%0.6129%0.293SS*.  trans-81.1145.6168.6-62.2-88.9000111.2R171F88-R171 HydrophobicContact CB-CB 3.77Å; F88-R171 HydrophobicContact CB-CG 4.27Å; F88-R171 HydrophobicContact CG-CB 4.37Å
89I90.3Very high88.8Confident4 Ų464 Ų642%0.02131%0.31CS..BIsolated β-bridgetrans-115.3154.8-175.7-166.3164.7000111D93 C94 K97 I172I89-D93 HydrophobicContact CD1-CB 3.87Å; I89-D93 HydrophobicContact CG1-CB 3.67Å; I89-C94 HydrophobicContact CG2-CB 4.02Å; I89-K97 HydrophobicContact CD1-CD 4.15Å; I89-I172 HydrophobicContact CG2-CG1 4.01Å; I89-I172 PolarHBondContact N-O 3.49Å; I89-I172 VanDerWaalsContact N-O 3.14Å; I89-I172 WeakPolarHBondContact O-CG1 3.37Å; I89-I172 PolarHBondContact O-N 3.34Å
90S91.2Very high89Confident18 Ų1863.1 Ų63.113%0.12631%0.305CS..  trans-73.7148.2171.276.20000110.4F92 D93 C94S90-F92 VanDerWaalsContact C-N 3.31Å; S90-F92 PolarHBondContact O-N 3.23Å; S90-D93 PolarHBondContact O-N 3.09Å; S90-D93 VanDerWaalsContact OG-CB 3.22Å; S90-D93 WeakPolarHBondContact OG-CB 3.35Å; S90-D93 PolarHBondContact OG-N 2.95Å; S90-D93 VanDerWaalsContact OG-N 3.12Å; S90-D93 PolarHBondContact OG-OD2 3.15Å; S90-C94 VanDerWaalsContact O-CB 3.29Å; S90-C94 WeakPolarHBondContact O-CB 3.26Å; S90-C94 PolarHBondContact O-N 3.05Å
91P92Very high89.2Confident7 Ų757.6 Ų57.65%0.04528%0.284CS..Hα-helixtrans-56-41.2176.1-29.937000113.8C94 L95 T166 T170 I172P91-C94 VanDerWaalsContact O-CB 3.28Å; P91-C94 WeakPolarHBondContact O-CB 3.32Å; P91-C94 PolarHBondContact O-N 2.7Å; P91-L95 WeakPolarHBondContact O-CG 3.49Å; P91-L95 PolarHBondContact O-N 3.34Å; P91-T166 HydrophobicContact CB-CG2 4.04Å; P91-T166 HydrophobicContact CG-CG2 3.64Å; P91-T170 WeakPolarHBondContact CD-O 3.43Å; P91-T170 HydrophobicContact CG-CG2 4.03Å; P91-I172 HydrophobicContact CB-CD1 4.21Å; P91-I172 HydrophobicContact CG-CD1 4.16Å; P91-I172 HydrophobicContact CG-CG1 4.22Å; P91-I172 HydrophobicContact CG-CG2 3.88Å
92F92.5Very high89.4Confident61 Ų6160 Ų6027%0.26830%0.296SS..Hα-helixtrans-63.6-49.7177177-98.5000112.1S90 C94 L95 V96 M159 L163S90-F92 VanDerWaalsContact C-N 3.31Å; S90-F92 PolarHBondContact O-N 3.23Å; F92-C94 PolarHBondContact O-N 3.28Å; F92-L95 PolarHBondContact O-N 3.29Å; F92-L95 VanDerWaalsContact O-N 3.15Å; F92-V96 HydrophobicContact CD1-CG2 4.23Å; F92-V96 HydrophobicContact CE1-CG2 3.76Å; F92-V96 HydrophobicContact CE2-CG2 4.26Å; F92-V96 HydrophobicContact CZ-CG2 3.78Å; F92-V96 WeakPolarHBondContact O-CG2 3.24Å; F92-V96 PolarHBondContact O-N 3.21Å; F92-M159 HydrophobicContact CD2-CE 4.04Å; F92-M159 HydrophobicContact CE2-CE 3.71Å; F92-M159 HydrophobicContact CZ-CE 4.29Å; F92-L163 HydrophobicContact CD1-CD1 4.24Å; F92-L163 HydrophobicContact CD2-CB 3.79Å; F92-L163 HydrophobicContact CD2-CD1 4.11Å; F92-L163 HydrophobicContact CD2-CG 4.49Å; F92-L163 HydrophobicContact CE1-CD1 4.23Å; F92-L163 HydrophobicContact CE2-CB 3.85Å; F92-L163 HydrophobicContact CE2-CD1 4.09Å; F92-L163 HydrophobicContact CE2-CD2 4.36Å; F92-L163 HydrophobicContact CE2-CG 4.33Å; F92-L163 HydrophobicContact CG-CD1 4.18Å; F92-L163 HydrophobicContact CZ-CD1 4.15Å
93D92.2Very high89.8Confident58 Ų5859.4 Ų59.431%0.3129%0.292SS..Hα-helixtrans-59.5-34.7176.8-75.4-48.9000111.7I89 S90 V96 K97I89-D93 HydrophobicContact CD1-CB 3.87Å; I89-D93 HydrophobicContact CG1-CB 3.67Å; S90-D93 PolarHBondContact O-N 3.09Å; S90-D93 VanDerWaalsContact OG-CB 3.22Å; S90-D93 WeakPolarHBondContact OG-CB 3.35Å; S90-D93 PolarHBondContact OG-N 2.95Å; S90-D93 VanDerWaalsContact OG-N 3.12Å; S90-D93 PolarHBondContact OG-OD2 3.15Å; D93-V96 PolarHBondContact O-N 3.26Å; D93-K97 VanDerWaalsContact O-CB 3.27Å; D93-K97 WeakPolarHBondContact O-CB 3.31Å; D93-K97 VanDerWaalsContact O-CG 3.29Å; D93-K97 WeakPolarHBondContact O-CG 3.47Å; D93-K97 PolarHBondContact O-N 3.09Å
94C93Very high90.2Very high0 Ų056.3 Ų56.30%027%0.268CS..Hα-helixtrans-63.3-50.8175.91780000111.1I89 S90 P91 F92 V96 K97 A98 I172 C176 A181I89-C94 HydrophobicContact CG2-CB 4.02Å; S90-C94 VanDerWaalsContact O-CB 3.29Å; S90-C94 WeakPolarHBondContact O-CB 3.26Å; S90-C94 PolarHBondContact O-N 3.05Å; P91-C94 VanDerWaalsContact O-CB 3.28Å; P91-C94 WeakPolarHBondContact O-CB 3.32Å; P91-C94 PolarHBondContact O-N 2.7Å; F92-C94 PolarHBondContact O-N 3.28Å; C94-V96 VanDerWaalsContact C-N 3.27Å; C94-V96 PolarHBondContact O-N 2.81Å; C94-K97 PolarHBondContact O-N 3.1Å; C94-A98 WeakPolarHBondContact O-CA 3.46Å; C94-A98 WeakPolarHBondContact O-CB 3.46Å; C94-A98 PolarHBondContact O-N 3.16Å; C94-I172 HydrophobicContact CB-CD1 3.9Å; C94-C176 WeakPolarHBondContact CA-SG 3.48Å; C94-C176 HydrophobicContact CB-CB 4.32Å; C94-C176 WeakPolarHBondContact CB-SG 3.38Å; C94-C176 WeakPolarHBondContact SG-CA 2.95Å; C94-C176 WeakPolarHBondContact SG-CB 3.41Å; C94-C176 CovalentContact SG-SG 2.02Å; C94-C176 PolarHBondContact SG-SG 2.67Å; C94-A181 HydrophobicContact CB-CB 4.46Å
95L94.4Very high90.8Very high4 Ų448.2 Ų48.22%0.02124%0.237CC..Hα-helixtrans-63.8-29.1176.7-62.8170.3000113.5P91 F92 N101 Y155 I158 M159 A181P91-L95 WeakPolarHBondContact O-CG 3.49Å; P91-L95 PolarHBondContact O-N 3.34Å; F92-L95 PolarHBondContact O-N 3.29Å; F92-L95 VanDerWaalsContact O-N 3.15Å; L95-N101 HydrophobicContact CD2-CB 4.35Å; L95-Y155 PolarHBondContact O-OH 3.43Å; L95-I158 HydrophobicContact CD1-CG2 4.05Å; L95-M159 HydrophobicContact CB-CE 3.83Å; L95-M159 HydrophobicContact CB-SD 3.21Å; L95-M159 WeakPolarHBondContact CB-SD 3.28Å; L95-M159 HydrophobicContact CD1-SD 3.93Å; L95-M159 HydrophobicContact CG-SD 4.17Å; L95-A181 WeakPolarHBondContact CD1-O 3.08Å; L95-A181 HydrophobicContact CD2-CB 3.73Å; L95-A181 HydrophobicContact CG-CB 4.09Å
96V93.8Very high92.1Very high80 Ų8048.4 Ų48.449%0.48524%0.235SC..Hα-helixtrans-72.9-48.5173.9176.30000111.6F92 D93 C94 M159F92-V96 HydrophobicContact CD1-CG2 4.23Å; F92-V96 HydrophobicContact CE1-CG2 3.76Å; F92-V96 HydrophobicContact CE2-CG2 4.26Å; F92-V96 HydrophobicContact CZ-CG2 3.78Å; F92-V96 WeakPolarHBondContact O-CG2 3.24Å; F92-V96 PolarHBondContact O-N 3.21Å; D93-V96 PolarHBondContact O-N 3.26Å; C94-V96 VanDerWaalsContact C-N 3.27Å; C94-V96 PolarHBondContact O-N 2.81Å; V96-M159 HydrophobicContact CB-CE 4.26Å; V96-M159 HydrophobicContact CG2-CE 3.29Å
97K93.3Very high93.5Very high108 Ų10838.8 Ų38.847%0.4719%0.19SC..Hα-helixtrans-85.4-29.1-170.5-66.3175.2-172.4168.80113I89 D93 C94 V99I89-K97 HydrophobicContact CD1-CD 4.15Å; D93-K97 VanDerWaalsContact O-CB 3.27Å; D93-K97 WeakPolarHBondContact O-CB 3.31Å; D93-K97 VanDerWaalsContact O-CG 3.29Å; D93-K97 WeakPolarHBondContact O-CG 3.47Å; D93-K97 PolarHBondContact O-N 3.09Å; C94-K97 PolarHBondContact O-N 3.1Å; K97-V99 PolarHBondContact O-N 3.02Å
98A94.4Very high94.1Very high1 Ų134 Ų341%0.00817%0.172CC..  trans-88.483.1-178.800000110.9C94 H100 N101 C176C94-A98 WeakPolarHBondContact O-CA 3.46Å; C94-A98 WeakPolarHBondContact O-CB 3.46Å; C94-A98 PolarHBondContact O-N 3.16Å; A98-H100 VanDerWaalsContact CB-CE1 3.48Å; A98-H100 WeakPolarHBondContact CB-CE1 3.38Å; A98-H100 PolarHBondContact O-N 2.95Å; A98-N101 WeakPolarHBondContact O-CB 3.39Å; A98-N101 PolarHBondContact O-N 3.36Å; A98-C176 HydrophobicContact CB-CB 3.53Å
99V96Very high94.5Very high77 Ų7727.9 Ų27.947%0.46715%0.146SC..Hα-helixtrans-56.7-23.5-179.6-179.20000112.7K97 N101 I102 M103K97-V99 PolarHBondContact O-N 3.02Å; V99-N101 PolarHBondContact O-N 3.43Å; V99-I102 HydrophobicContact CG1-CG2 4.32Å; V99-I102 WeakPolarHBondContact O-CG2 3.42Å; V99-M103 HydrophobicContact CG1-CE 3.63Å; V99-M103 HydrophobicContact CG1-CG 4.42Å; V99-M103 HydrophobicContact CG1-SD 4.09Å; V99-M103 WeakPolarHBondContact O-CG 3.27Å; V99-M103 PolarHBondContact O-N 3.24Å
100H96.2Very high94.9Very high9 Ų927.7 Ų27.74%0.04215%0.145CC..Hα-helixtrans-63.4-28.7175.864.2-97.8000113.3G70 A73 A74 A98 M103 F104 C176G70-H100 VanDerWaalsContact O-CB 3.26Å; G70-H100 WeakPolarHBondContact O-CB 3.47Å; A73-H100 HydrophobicContact CB-CB 4.09Å; A74-H100 HydrophobicContact CB-CB 3.82Å; A98-H100 VanDerWaalsContact CB-CE1 3.48Å; A98-H100 WeakPolarHBondContact CB-CE1 3.38Å; A98-H100 PolarHBondContact O-N 2.95Å; H100-M103 PolarHBondContact O-N 2.99Å; H100-F104 HydrophobicContact CB-CE2 4.18Å; H100-F104 HydrophobicContact CB-CZ 4.48Å; H100-F104 AromaticContact CD2-CE2 3.79Å; H100-F104 WeakPolarHBondContact O-CD2 3.43Å; H100-F104 VanDerWaalsContact O-CG 3.3Å; H100-F104 WeakPolarHBondContact O-CG 3.25Å; H100-F104 PolarHBondContact O-N 3.43Å; H100-C176 PolarHBondContact NE2-O 3.49Å
101N95.6Very high95.1Very high0 Ų026.9 Ų26.90%014%0.139CC..Hα-helixtrans-65.4-46.3-179.1-74.3-23.4000112.1L95 A98 V99 M103 F104 E105 Y155 C176 Q178L95-N101 HydrophobicContact CD2-CB 4.35Å; A98-N101 WeakPolarHBondContact O-CB 3.39Å; A98-N101 PolarHBondContact O-N 3.36Å; V99-N101 PolarHBondContact O-N 3.43Å; N101-M103 VanDerWaalsContact C-N 3.31Å; N101-M103 PolarHBondContact O-N 3.41Å; N101-F104 PolarHBondContact O-N 3.22Å; N101-E105 WeakPolarHBondContact O-CB 3.29Å; N101-E105 PolarHBondContact O-N 2.97Å; N101-Y155 HydrophobicContact CB-CE2 4.32Å; N101-C176 PolarHBondContact OD1-O 3.39Å; N101-Q178 VanDerWaalsContact OD1-CG 3.23Å; N101-Q178 WeakPolarHBondContact OD1-CG 3.35Å
102I96.5Very high95.3Very high57 Ų5726.5 Ų26.529%0.29214%0.137SC..Hα-helixtrans-66.1-35.7175.1-174.1169.5000111.6V99 I106 Y155V99-I102 HydrophobicContact CG1-CG2 4.32Å; V99-I102 WeakPolarHBondContact O-CG2 3.42Å; I102-I106 HydrophobicContact CD1-CD1 4.07Å; I102-I106 HydrophobicContact CG1-CD1 3.58Å; I102-I106 HydrophobicContact CG1-CG1 4.17Å; I102-I106 WeakPolarHBondContact O-CB 3.34Å; I102-I106 VanDerWaalsContact O-CG1 3.32Å; I102-I106 WeakPolarHBondContact O-CG1 3.47Å; I102-I106 PolarHBondContact O-N 2.95Å; I102-Y155 HydrophobicContact CB-CD1 3.96Å; I102-Y155 HydrophobicContact CB-CD2 4.17Å; I102-Y155 HydrophobicContact CB-CE1 3.65Å; I102-Y155 HydrophobicContact CB-CE2 3.87Å; I102-Y155 HydrophobicContact CB-CG 4.2Å; I102-Y155 HydrophobicContact CD1-CD1 3.67Å; I102-Y155 HydrophobicContact CD1-CE1 3.96Å; I102-Y155 HydrophobicContact CD1-CG 4.27Å; I102-Y155 HydrophobicContact CG1-CD1 3.75Å; I102-Y155 HydrophobicContact CG1-CD2 4.29Å; I102-Y155 HydrophobicContact CG1-CE1 3.97Å; I102-Y155 HydrophobicContact CG1-CE2 4.47Å; I102-Y155 HydrophobicContact CG1-CG 3.92Å
103M97.5Very high95.5Very high49 Ų4925.4 Ų25.424%0.24113%0.133CC..Hα-helixtrans-67.1-42.3177.9-71.4176.6170.900111.8I66 A69 G70 A73 V99 H100 N101 G107I66-M103 HydrophobicContact CG2-CB 3.96Å; I66-M103 HydrophobicContact CG2-CG 4.21Å; I66-M103 VanDerWaalsContact CG2-O 3.29Å; I66-M103 WeakPolarHBondContact CG2-O 3.45Å; A69-M103 VanDerWaalsContact C-SD 3.53Å; A69-M103 HydrophobicContact CB-CE 4.07Å; A69-M103 HydrophobicContact CB-SD 3.8Å; G70-M103 PolarHBondContact N-SD 3.33Å; G70-M103 VanDerWaalsContact N-SD 3.43Å; A73-M103 HydrophobicContact CB-SD 4.35Å; V99-M103 HydrophobicContact CG1-CE 3.63Å; V99-M103 HydrophobicContact CG1-CG 4.42Å; V99-M103 HydrophobicContact CG1-SD 4.09Å; V99-M103 WeakPolarHBondContact O-CG 3.27Å; V99-M103 PolarHBondContact O-N 3.24Å; H100-M103 PolarHBondContact O-N 2.99Å; N101-M103 VanDerWaalsContact C-N 3.31Å; N101-M103 PolarHBondContact O-N 3.41Å; M103-G107 WeakPolarHBondContact O-CA 3.43Å; M103-G107 PolarHBondContact O-N 3.01Å
104F95.5Very high95.6Very high16 Ų1622.6 Ų22.67%0.0712%0.118CC..Hα-helixtrans-64.7-47.9174.1-67.7-30.2000111.5L67 G70 Y71 A74 H100 N101 I106 G107 E108 Q178L67-F104 HydrophobicContact CD2-CD1 4.16Å; G70-F104 VanDerWaalsContact C-CE1 3.44Å; Y71-F104 HydrophobicContact CD1-CE1 4.43Å; Y71-F104 HydrophobicContact CD1-CZ 4.35Å; Y71-F104 HydrophobicContact CD2-CD1 4.5Å; Y71-F104 AromaticContact CD2-CE1 3.56Å; Y71-F104 HydrophobicContact CD2-CE1 3.56Å; Y71-F104 HydrophobicContact CD2-CZ 4.26Å; Y71-F104 HydrophobicContact CE2-CD1 4.48Å; Y71-F104 AromaticContact CE2-CE1 3.79Å; Y71-F104 HydrophobicContact CE2-CE1 3.79Å; Y71-F104 HydrophobicContact CE2-CZ 4.48Å; Y71-F104 AromaticContact CG-CE1 3.9Å; Y71-F104 HydrophobicContact CG-CE1 3.9Å; Y71-F104 HydrophobicContact CG-CZ 4.18Å; A74-F104 HydrophobicContact CB-CE2 4.24Å; A74-F104 HydrophobicContact CB-CZ 4.06Å; H100-F104 HydrophobicContact CB-CE2 4.18Å; H100-F104 HydrophobicContact CB-CZ 4.48Å; H100-F104 AromaticContact CD2-CE2 3.79Å; H100-F104 WeakPolarHBondContact O-CD2 3.43Å; H100-F104 VanDerWaalsContact O-CG 3.3Å; H100-F104 WeakPolarHBondContact O-CG 3.25Å; H100-F104 PolarHBondContact O-N 3.43Å; N101-F104 PolarHBondContact O-N 3.22Å; F104-I106 PolarHBondContact O-N 3.12Å; F104-G107 PolarHBondContact O-N 3.17Å; F104-E108 VanDerWaalsContact O-CB 3.32Å; F104-E108 WeakPolarHBondContact O-CB 2.97Å; F104-E108 VanDerWaalsContact O-CG 3.27Å; F104-E108 WeakPolarHBondContact O-CG 3.3Å; F104-E108 PolarHBondContact O-N 3.47Å; F104-Q178 VanDerWaalsContact CB-NE2 3.28Å; F104-Q178 HydrophobicContact CD2-CG 4.37Å
105E95.4Very high95.6Very high4 Ų422.8 Ų22.82%0.01912%0.119CC..Hα-helixtrans-55.5-56.3178.2-178.263.8-159.400111.6N101 T109 Y155 M182 H190N101-E105 WeakPolarHBondContact O-CB 3.29Å; N101-E105 PolarHBondContact O-N 2.97Å; E105-T109 WeakPolarHBondContact O-CB 3.04Å; E105-T109 VanDerWaalsContact O-CG2 3.26Å; E105-T109 WeakPolarHBondContact O-CG2 3.43Å; E105-T109 PolarHBondContact O-N 3.49Å; E105-T109 VanDerWaalsContact O-N 3.13Å; E105-T109 PolarHBondContact O-OG1 3.03Å; E105-Y155 HydrophobicContact CB-CD2 3.92Å; E105-Y155 HydrophobicContact CG-CD2 4.01Å; E105-M182 WeakPolarHBondContact OE2-CE 3.5Å; E105-H190 IonicContact OE1-ND1 2.65Å; E105-H190 IonicContact OE2-CE1 3.13Å; E105-H190 IonicContact OE2-CG 2.86Å; E105-H190 IonicContact OE2-ND1 2.71Å; E105-H190 IonicContact OE2-NE2 3.88Å
106I97Very high95.7Very high19 Ų1925 Ų2510%0.09713%0.131CC..Hα-helixtrans-64.1-50-178.7-64.4172.5000109.7I66 I102 F104 E108 T109 T110 Y148 C152I66-I106 HydrophobicContact CD1-CG2 4.06Å; I102-I106 HydrophobicContact CD1-CD1 4.07Å; I102-I106 HydrophobicContact CG1-CD1 3.58Å; I102-I106 HydrophobicContact CG1-CG1 4.17Å; I102-I106 WeakPolarHBondContact O-CB 3.34Å; I102-I106 VanDerWaalsContact O-CG1 3.32Å; I102-I106 WeakPolarHBondContact O-CG1 3.47Å; I102-I106 PolarHBondContact O-N 2.95Å; F104-I106 PolarHBondContact O-N 3.12Å; I106-E108 PolarHBondContact O-N 3.45Å; I106-T109 PolarHBondContact O-OG1 2.82Å; I106-T110 HydrophobicContact CG2-CG2 3.97Å; I106-T110 VanDerWaalsContact O-CB 3.31Å; I106-T110 WeakPolarHBondContact O-CB 3.39Å; I106-T110 WeakPolarHBondContact O-CG2 3.24Å; I106-T110 PolarHBondContact O-N 3.39Å; I106-T110 PolarHBondContact O-OG1 3.2Å; I106-Y148 HydrophobicContact CG2-CD1 4Å; I106-Y148 HydrophobicContact CG2-CE1 4.23Å; I106-C152 VanDerWaalsContact CD1-SG 3.58Å
107G97.1Very high95.7Very high0 Ų023.1 Ų23.10%012%0.118CC..Hα-helixtrans-60.5-45.3-175.100000113.2M103 F104 T110 S111M103-G107 WeakPolarHBondContact O-CA 3.43Å; M103-G107 PolarHBondContact O-N 3.01Å; F104-G107 PolarHBondContact O-N 3.17Å; G107-T110 PolarHBondContact O-OG1 2.9Å; G107-S111 WeakPolarHBondContact O-CB 3.18Å; G107-S111 PolarHBondContact O-N 3.05Å; G107-S111 VanDerWaalsContact O-N 3.09Å
108E95.1Very high95.6Very high4 Ų418.2 Ų18.22%0.01910%0.097CC..Hα-helixtrans-72.9-47.5-178.3-65-172.1139.400111.7L67 F104 I106 T110 S111 A112 H190 L194 H272L67-E108 HydrophobicContact CD2-CG 3.6Å; F104-E108 VanDerWaalsContact O-CB 3.32Å; F104-E108 WeakPolarHBondContact O-CB 2.97Å; F104-E108 VanDerWaalsContact O-CG 3.27Å; F104-E108 WeakPolarHBondContact O-CG 3.3Å; F104-E108 PolarHBondContact O-N 3.47Å; I106-E108 PolarHBondContact O-N 3.45Å; E108-T110 PolarHBondContact O-N 3.45Å; E108-S111 PolarHBondContact O-N 3.09Å; E108-A112 WeakPolarHBondContact O-CB 3.39Å; E108-A112 PolarHBondContact O-N 3.43Å; E108-H190 IonicContact OE2-CD2 3.99Å; E108-H190 IonicContact OE2-CE1 3.87Å; E108-H190 IonicContact OE2-NE2 3.68Å; E108-H190 PolarHBondContact OE2-NE2 3.46Å; E108-L194 HydrophobicContact CB-CD1 3.85Å; E108-L194 HydrophobicContact CB-CD2 4.06Å; E108-L194 HydrophobicContact CG-CD1 4.49Å; E108-H272 IonicContact OE1-CE1 3.63Å
109T96.2Very high95.5Very high10 Ų1018.2 Ų18.26%0.06110%0.096CC..Hα-helixtrans-61-47.1-179.954.80000111.4E105 I106 S111 A112 L113 S151 F193E105-T109 WeakPolarHBondContact O-CB 3.04Å; E105-T109 VanDerWaalsContact O-CG2 3.26Å; E105-T109 WeakPolarHBondContact O-CG2 3.43Å; E105-T109 PolarHBondContact O-N 3.49Å; E105-T109 VanDerWaalsContact O-N 3.13Å; E105-T109 PolarHBondContact O-OG1 3.03Å; I106-T109 PolarHBondContact O-OG1 2.82Å; T109-S111 PolarHBondContact O-N 3.46Å; T109-A112 PolarHBondContact O-N 3.5Å; T109-L113 WeakPolarHBondContact O-CB 3.46Å; T109-L113 WeakPolarHBondContact O-CG 3.48Å; T109-L113 PolarHBondContact O-N 3.39Å; T109-S151 WeakPolarHBondContact OG1-CB 3.34Å; T109-S151 PolarHBondContact OG1-OG 2.76Å; T109-F193 HydrophobicContact CG2-CE1 4.29Å
110T97.2Very high95.3Very high0 Ų015.9 Ų15.90%09%0.088CC..Hα-helixtrans-67.9-39.6-179.3660000110.3S63 I106 G107 E108 A112 L113 V114 I147 Y148 S151S63-T110 WeakPolarHBondContact CB-OG1 3.35Å; S63-T110 PolarHBondContact OG-OG1 2.84Å; I106-T110 HydrophobicContact CG2-CG2 3.97Å; I106-T110 VanDerWaalsContact O-CB 3.31Å; I106-T110 WeakPolarHBondContact O-CB 3.39Å; I106-T110 WeakPolarHBondContact O-CG2 3.24Å; I106-T110 PolarHBondContact O-N 3.39Å; I106-T110 PolarHBondContact O-OG1 3.2Å; G107-T110 PolarHBondContact O-OG1 2.9Å; E108-T110 PolarHBondContact O-N 3.45Å; T110-A112 VanDerWaalsContact C-N 3.35Å; T110-A112 PolarHBondContact O-N 3.43Å; T110-L113 PolarHBondContact O-N 3.5Å; T110-V114 VanDerWaalsContact O-CB 3.24Å; T110-V114 WeakPolarHBondContact O-CB 3.36Å; T110-V114 WeakPolarHBondContact O-CG2 3Å; T110-V114 PolarHBondContact O-N 3.49Å; T110-I147 HydrophobicContact CG2-CG2 4.01Å; T110-Y148 HydrophobicContact CG2-CD1 3.51Å; T110-Y148 HydrophobicContact CG2-CE1 3.55Å; T110-Y148 HydrophobicContact CG2-CG 4.05Å; T110-S151 WeakPolarHBondContact CG2-OG 3.5Å
111S95.8Very high95Very high0 Ų016.2 Ų16.20%09%0.091CC..Hα-helixtrans-64.9-38.1178.6-152.30000112.3L60 G107 E108 T109 M115 R245L60-S111 WeakPolarHBondContact CD1-OG 3.35Å; G107-S111 WeakPolarHBondContact O-CB 3.18Å; G107-S111 PolarHBondContact O-N 3.05Å; G107-S111 VanDerWaalsContact O-N 3.09Å; E108-S111 PolarHBondContact O-N 3.09Å; T109-S111 PolarHBondContact O-N 3.46Å; S111-M115 WeakPolarHBondContact O-CB 3.43Å; S111-M115 PolarHBondContact O-N 3.4Å; S111-M115 VanDerWaalsContact O-N 3.12Å; S111-R245 VanDerWaalsContact CB-NH2 3.27Å; S111-R245 PolarHBondContact O-NH2 2.99Å; S111-R245 VanDerWaalsContact O-NH2 3.15Å; S111-R245 PolarHBondContact OG-NH2 3.43Å
112A95.8Very high94.5Very high0 Ų016.4 Ų16.40%09%0.091CC..Hα-helixtrans-66.8-46.8175.400000112E108 T109 T110 M115 L116 L194 A197 Y198E108-A112 WeakPolarHBondContact O-CB 3.39Å; E108-A112 PolarHBondContact O-N 3.43Å; T109-A112 PolarHBondContact O-N 3.5Å; T110-A112 VanDerWaalsContact C-N 3.35Å; T110-A112 PolarHBondContact O-N 3.43Å; A112-M115 WeakPolarHBondContact O-CB 3.49Å; A112-M115 PolarHBondContact O-N 3.25Å; A112-L116 PolarHBondContact O-N 3.15Å; A112-L194 HydrophobicContact CB-CD2 3.69Å; A112-A197 HydrophobicContact CB-CB 3.96Å; A112-Y198 HydrophobicContact CB-CE1 3.91Å; A112-Y198 HydrophobicContact CB-CE2 4.15Å
113L96.7Very high94Very high37 Ų3715.1 Ų15.119%0.1949%0.085CC..Hα-helixtrans-67.8-40.5179.1-71.9174.2000112.5T109 T110 M115 L116 L117 I147 F193T109-L113 WeakPolarHBondContact O-CB 3.46Å; T109-L113 WeakPolarHBondContact O-CG 3.48Å; T109-L113 PolarHBondContact O-N 3.39Å; T110-L113 PolarHBondContact O-N 3.5Å; L113-M115 VanDerWaalsContact C-N 3.29Å; L113-M115 PolarHBondContact O-N 2.88Å; L113-L116 WeakPolarHBondContact O-CB 3.21Å; L113-L116 PolarHBondContact O-N 2.94Å; L113-L117 WeakPolarHBondContact O-CG 3.27Å; L113-L117 PolarHBondContact O-N 3.34Å; L113-I147 HydrophobicContact CB-CD1 4.13Å; L113-I147 HydrophobicContact CB-CG2 4.1Å; L113-I147 HydrophobicContact CD1-CG1 4.28Å; L113-I147 HydrophobicContact CD1-CG2 3.78Å; L113-F193 HydrophobicContact CD1-CZ 4.24Å; L113-F193 HydrophobicContact CD2-CZ 3.86Å; L113-F193 HydrophobicContact CG-CZ 4.01Å
114V96.1Very high93.5Very high0 Ų014.5 Ų14.50%09%0.088CC..Hα-helixtrans-60.3-41.8174.6169.10000110.6F56 A59 L60 T110 L116 L117 L118 L144F56-V114 HydrophobicContact CB-CG1 4.46Å; F56-V114 VanDerWaalsContact O-CG1 3.31Å; F56-V114 WeakPolarHBondContact O-CG1 3.32Å; A59-V114 HydrophobicContact CB-CG1 4.28Å; A59-V114 HydrophobicContact CB-CG2 3.82Å; L60-V114 HydrophobicContact CB-CG1 4.05Å; L60-V114 HydrophobicContact CD1-CG1 4.36Å; T110-V114 VanDerWaalsContact O-CB 3.24Å; T110-V114 WeakPolarHBondContact O-CB 3.36Å; T110-V114 WeakPolarHBondContact O-CG2 3Å; T110-V114 PolarHBondContact O-N 3.49Å; V114-L116 VanDerWaalsContact C-N 3.34Å; V114-L116 PolarHBondContact O-N 3.32Å; V114-L117 PolarHBondContact O-N 3.12Å; V114-L118 WeakPolarHBondContact O-CB 3.45Å; V114-L118 PolarHBondContact O-N 2.94Å; V114-L144 HydrophobicContact CG2-CD2 3.61Å
115M93.1Very high92.9Very high3 Ų314.6 Ų14.62%0.0159%0.09CC..Hα-helixtrans-62-42.1175.9-175.763.5126.400111.9S111 A112 L113 L118 T119 I241 I242 R245S111-M115 WeakPolarHBondContact O-CB 3.43Å; S111-M115 PolarHBondContact O-N 3.4Å; S111-M115 VanDerWaalsContact O-N 3.12Å; A112-M115 WeakPolarHBondContact O-CB 3.49Å; A112-M115 PolarHBondContact O-N 3.25Å; L113-M115 VanDerWaalsContact C-N 3.29Å; L113-M115 PolarHBondContact O-N 2.88Å; M115-L118 PolarHBondContact O-N 3.12Å; M115-L118 HydrophobicContact SD-CD2 4.24Å; M115-T119 WeakPolarHBondContact O-CG2 3.29Å; M115-T119 PolarHBondContact O-N 3.36Å; M115-T119 PolarHBondContact O-OG1 3.18Å; M115-I241 HydrophobicContact CE-CB 4.18Å; M115-I241 HydrophobicContact CE-CG2 3.23Å; M115-I241 HydrophobicContact SD-CG2 3.73Å; M115-I242 HydrophobicContact CE-CB 4.1Å; M115-I242 HydrophobicContact CE-CG1 3.4Å; M115-I242 HydrophobicContact SD-CG1 3.86Å; M115-R245 HydrophobicContact CE-CB 3.84Å; M115-R245 HydrophobicContact CE-CG 4.2Å
116L94.7Very high92.1Very high51 Ų5116.2 Ų16.227%0.26710%0.098SC..Hα-helixtrans-63.5-42175.1-176.862.4000111.9A112 L113 V114 T119 G120 T200 S201A112-L116 PolarHBondContact O-N 3.15Å; L113-L116 WeakPolarHBondContact O-CB 3.21Å; L113-L116 PolarHBondContact O-N 2.94Å; V114-L116 VanDerWaalsContact C-N 3.34Å; V114-L116 PolarHBondContact O-N 3.32Å; L116-T119 PolarHBondContact O-OG1 3.25Å; L116-G120 PolarHBondContact O-N 2.67Å; L116-T200 HydrophobicContact CD1-CG2 3.61Å; L116-S201 VanDerWaalsContact CA-OG 3.26Å; L116-S201 WeakPolarHBondContact CA-OG 3.35Å; L116-S201 PolarHBondContact N-OG 2.84Å
117L94.5Very high91.3Very high41 Ų4121 Ų2122%0.21512%0.122CC..Hα-helixtrans-65.6-41.3175.9-69.7-177.7000112.4F56 L113 V114 G120 D121 L143 L144 I147F56-L117 HydrophobicContact CD1-CB 4.25Å; F56-L117 HydrophobicContact CE1-CB 3.81Å; F56-L117 HydrophobicContact CE1-CD1 3.85Å; F56-L117 HydrophobicContact CE1-CG 4.48Å; F56-L117 HydrophobicContact CZ-CB 4.09Å; L113-L117 WeakPolarHBondContact O-CG 3.27Å; L113-L117 PolarHBondContact O-N 3.34Å; V114-L117 PolarHBondContact O-N 3.12Å; L117-G120 PolarHBondContact O-N 3.12Å; L117-D121 WeakPolarHBondContact O-CB 3.45Å; L117-D121 PolarHBondContact O-N 3.3Å; L117-L143 HydrophobicContact CD1-CD2 3.63Å; L117-L143 HydrophobicContact CD1-CG 3.92Å; L117-L143 HydrophobicContact CD2-CD2 3.56Å; L117-L143 HydrophobicContact CG-CD2 4.26Å; L117-L144 HydrophobicContact CD1-CD2 4.44Å; L117-I147 HydrophobicContact CD1-CD1 3.41Å; L117-I147 VanDerWaalsContact CD1-CD1 3.41Å; L117-I147 HydrophobicContact CG-CD1 4.33Å
118L92.2Very high90.3Very high5 Ų522.6 Ų22.63%0.02613%0.134CC..Hα-helixtrans-67.4-39.3-179.1172.3152.7000111F56 V114 M115 Q122 V238 I241F56-L118 HydrophobicContact CB-CB 4.22Å; F56-L118 HydrophobicContact CB-CD1 4.12Å; F56-L118 HydrophobicContact CG-CB 4.49Å; V114-L118 WeakPolarHBondContact O-CB 3.45Å; V114-L118 PolarHBondContact O-N 2.94Å; M115-L118 PolarHBondContact O-N 3.12Å; M115-L118 HydrophobicContact SD-CD2 4.24Å; L118-Q122 WeakPolarHBondContact O-CG 3.08Å; L118-Q122 PolarHBondContact O-N 2.93Å; L118-V238 HydrophobicContact CD1-CG2 4.35Å; L118-V238 HydrophobicContact CD2-CB 3.8Å; L118-V238 HydrophobicContact CD2-CG1 3.24Å; L118-V238 HydrophobicContact CD2-CG2 3.28Å; L118-V238 HydrophobicContact CG-CG2 3.93Å; L118-I241 HydrophobicContact CD1-CD1 4.5Å
119T92Very high89.4Confident0 Ų027.5 Ų27.50%016%0.155CC..Hα-helixtrans-72.5-38.7172.152.40000112.9M115 L116 Q122 L123 V204 C205 V238 I242M115-T119 WeakPolarHBondContact O-CG2 3.29Å; M115-T119 PolarHBondContact O-N 3.36Å; M115-T119 PolarHBondContact O-OG1 3.18Å; L116-T119 PolarHBondContact O-OG1 3.25Å; T119-Q122 WeakPolarHBondContact O-CB 3.29Å; T119-Q122 PolarHBondContact O-N 3.42Å; T119-L123 PolarHBondContact O-N 2.86Å; T119-V204 WeakPolarHBondContact O-CG1 3.27Å; T119-C205 HydrophobicContact CG2-CB 4.33Å; T119-V238 HydrophobicContact CG2-CG1 3.91Å; T119-I242 HydrophobicContact CG2-CD1 3.28Å; T119-I242 HydrophobicContact CG2-CG1 4.13Å
120G91.3Very high88.5Confident29 Ų2934.9 Ų34.930%0.29919%0.186SC..Hα-helixtrans-61.3-43.4175.300000112.8L116 L117 Q122 L123 A124L116-G120 PolarHBondContact O-N 2.67Å; L117-G120 PolarHBondContact O-N 3.12Å; G120-Q122 VanDerWaalsContact C-N 3.28Å; G120-Q122 PolarHBondContact O-N 3.15Å; G120-L123 PolarHBondContact O-N 3.17Å; G120-A124 VanDerWaalsContact O-CB 3.29Å; G120-A124 WeakPolarHBondContact O-CB 3.32Å; G120-A124 PolarHBondContact O-N 3.4Å
121D89.2Confident87.4Confident16 Ų1643.8 Ų43.89%0.08622%0.22CC..Hα-helixtrans-60.4-39.4176-177.172.4000111.2F56 L117 A124 S125 Y132F56-D121 HydrophobicContact CE2-CB 4.05Å; L117-D121 WeakPolarHBondContact O-CB 3.45Å; L117-D121 PolarHBondContact O-N 3.3Å; D121-A124 PolarHBondContact O-N 3.29Å; D121-S125 WeakPolarHBondContact O-CB 3.17Å; D121-S125 PolarHBondContact O-N 3.3Å; D121-Y132 WeakPolarHBondContact OD1-CE2 3.25Å
122Q85.6Confident86.7Confident4 Ų447.1 Ų47.12%0.01923%0.233CC..Hα-helixtrans-64.6-47.6175.2-68.2-168.2-15.100112.7L118 T119 G120 A124 S125 M126 V234L118-Q122 WeakPolarHBondContact O-CG 3.08Å; L118-Q122 PolarHBondContact O-N 2.93Å; T119-Q122 WeakPolarHBondContact O-CB 3.29Å; T119-Q122 PolarHBondContact O-N 3.42Å; G120-Q122 VanDerWaalsContact C-N 3.28Å; G120-Q122 PolarHBondContact O-N 3.15Å; Q122-A124 VanDerWaalsContact C-N 3.34Å; Q122-S125 PolarHBondContact O-N 2.92Å; Q122-S125 PolarHBondContact O-OG 3.32Å; Q122-M126 WeakPolarHBondContact O-CG 3.3Å; Q122-M126 PolarHBondContact O-N 2.99Å; Q122-V234 HydrophobicContact CG-CG1 4.17Å; Q122-V234 VanDerWaalsContact NE2-C 3.3Å; Q122-V234 VanDerWaalsContact NE2-CG1 3.3Å; Q122-V234 PolarHBondContact NE2-O 2.94Å
123L86.8Confident85.9Confident30 Ų3052 Ų5216%0.15726%0.259CS..Hα-helixtrans-63.5-43.2178.5-175.563.7000110.8T119 G120 S125 M126 I127 V204 V207 A208T119-L123 PolarHBondContact O-N 2.86Å; G120-L123 PolarHBondContact O-N 3.17Å; L123-S125 VanDerWaalsContact C-N 3.28Å; L123-S125 PolarHBondContact O-N 3.29Å; L123-M126 WeakPolarHBondContact O-CB 3.28Å; L123-M126 PolarHBondContact O-N 3.42Å; L123-I127 HydrophobicContact CD1-CD1 3.66Å; L123-I127 HydrophobicContact CD1-CG1 3.95Å; L123-I127 HydrophobicContact CD2-CD1 4.01Å; L123-I127 HydrophobicContact CG-CD1 3.6Å; L123-I127 HydrophobicContact CG-CG1 4.16Å; L123-I127 PolarHBondContact O-N 3.27Å; L123-V204 HydrophobicContact CB-CG1 3.83Å; L123-V204 HydrophobicContact CD2-CG1 3.91Å; L123-V204 HydrophobicContact CG-CG1 4.47Å; L123-V207 HydrophobicContact CD1-CG1 3.93Å; L123-A208 HydrophobicContact CD1-CB 4.08Å
124A86.5Confident85.3Confident36 Ų3656.9 Ų56.930%0.29828%0.278SS..Hα-helixtrans-58.4-41.1175.900000111.6G120 D121 Q122 M126 S128G120-A124 VanDerWaalsContact O-CB 3.29Å; G120-A124 WeakPolarHBondContact O-CB 3.32Å; G120-A124 PolarHBondContact O-N 3.4Å; D121-A124 PolarHBondContact O-N 3.29Å; Q122-A124 VanDerWaalsContact C-N 3.34Å; A124-M126 PolarHBondContact O-N 3.06Å; A124-S128 CarbonylContact O-C 3.51Å; A124-S128 PolarHBondContact O-N 2.97Å; A124-S128 VanDerWaalsContact O-O 3.14Å
125S81.6Confident84.8Confident17 Ų1759.4 Ų59.412%0.11929%0.29CS..Hα-helixtrans-62.9-23.7175.884.50000113.8D121 Q122 L123 Q231D121-S125 WeakPolarHBondContact O-CB 3.17Å; D121-S125 PolarHBondContact O-N 3.3Å; Q122-S125 PolarHBondContact O-N 2.92Å; Q122-S125 PolarHBondContact O-OG 3.32Å; L123-S125 VanDerWaalsContact C-N 3.28Å; L123-S125 PolarHBondContact O-N 3.29Å; S125-Q231 PolarHBondContact O-NE2 3.37Å
126M80.1Confident84.7Confident39 Ų3962.2 Ų62.219%0.19231%0.307CS..Hα-helixtrans-92.1-41.8178.4-66.1-171.4-169.100113.5Q122 L123 A124 A208 C211 R212 V235Q122-M126 WeakPolarHBondContact O-CG 3.3Å; Q122-M126 PolarHBondContact O-N 2.99Å; L123-M126 WeakPolarHBondContact O-CB 3.28Å; L123-M126 PolarHBondContact O-N 3.42Å; A124-M126 PolarHBondContact O-N 3.06Å; M126-A208 HydrophobicContact CE-CB 3.95Å; M126-A208 HydrophobicContact SD-CB 3.91Å; M126-C211 HydrophobicContact SD-CB 4.3Å; M126-R212 HydrophobicContact CE-CB 4.34Å; M126-R212 HydrophobicContact SD-CB 4.32Å; M126-V235 HydrophobicContact CE-CB 4.3Å; M126-V235 HydrophobicContact CE-CG1 4.15Å; M126-V235 HydrophobicContact CE-CG2 3.21Å
127I79.8Confident84.4Confident118 Ų11861.7 Ų61.761%0.60531%0.308SS*.Hα-helixtrans-78.9-45.3-175-64.3-179.1000110.5L123L123-I127 HydrophobicContact CD1-CD1 3.66Å; L123-I127 HydrophobicContact CD1-CG1 3.95Å; L123-I127 HydrophobicContact CD2-CD1 4.01Å; L123-I127 HydrophobicContact CG-CD1 3.6Å; L123-I127 HydrophobicContact CG-CG1 4.16Å; L123-I127 PolarHBondContact O-N 3.27Å
128S76.9Confident84.3Confident34 Ų3469.6 Ų69.624%0.23833%0.334CS..  trans-147.8106.3-172.7-166.50000114A124 K130 W131 Y132A124-S128 CarbonylContact O-C 3.51Å; A124-S128 PolarHBondContact O-N 2.97Å; A124-S128 VanDerWaalsContact O-O 3.14Å; S128-K130 PolarHBondContact O-N 2.83Å; S128-W131 PolarHBondContact O-N 3.44Å; S128-Y132 PolarHBondContact O-N 2.94Å
129F74.7Confident84.4Confident107 Ų10774.6 Ų74.647%0.46936%0.356SS..Hα-helixtrans-56.7-35.9173.3-173.2-112.9000112.8Y132 L133F129-Y132 PolarHBondContact O-N 3.21Å; F129-L133 HydrophobicContact CD1-CD1 3.67Å; F129-L133 HydrophobicContact CD1-CG 4.29Å; F129-L133 HydrophobicContact CE1-CD1 3.27Å; F129-L133 HydrophobicContact CE1-CD2 4.44Å; F129-L133 HydrophobicContact CE1-CG 3.95Å; F129-L133 HydrophobicContact CE2-CD1 4.44Å; F129-L133 HydrophobicContact CE2-CD2 4.42Å; F129-L133 HydrophobicContact CE2-CG 4.24Å; F129-L133 HydrophobicContact CG-CD1 4.42Å; F129-L133 HydrophobicContact CZ-CD1 3.7Å; F129-L133 HydrophobicContact CZ-CD2 4.01Å; F129-L133 HydrophobicContact CZ-CG 3.91Å; F129-L133 WeakPolarHBondContact O-CB 3.33Å; F129-L133 WeakPolarHBondContact O-CG 3.46Å; F129-L133 PolarHBondContact O-N 2.89Å
130K77.9Confident84.5Confident165 Ų16574.6 Ų74.672%0.71736%0.356SS*.Hα-helixtrans-63.4-43.7178.5-69.6-173.1178.7-177.80112S128 K134S128-K130 PolarHBondContact O-N 2.83Å; K130-K134 WeakPolarHBondContact O-CG 3.35Å; K130-K134 PolarHBondContact O-N 3.27Å
131W75Confident84.7Confident187 Ų18777.6 Ų77.671%0.70836%0.362SS*.Hα-helixtrans-68.9-43.1177.4-77.594.1000111.5S128 L133 K134 F135S128-W131 PolarHBondContact O-N 3.44Å; W131-L133 VanDerWaalsContact C-N 3.3Å; W131-L133 PolarHBondContact O-N 2.91Å; W131-K134 PolarHBondContact O-N 2.89Å; W131-K134 VanDerWaalsContact O-N 3.13Å; W131-F135 PolarHBondContact O-N 3.26Å
132Y80Confident85Confident71 Ų7182.3 Ų82.328%0.27839%0.387SS..Hα-helixtrans-60.7-36.9177.9179.7-102.1000113.2K52 D121 S128 F129K52-Y132 PolarHBondContact NZ-O 3.24Å; D121-Y132 WeakPolarHBondContact OD1-CE2 3.25Å; S128-Y132 PolarHBondContact O-N 2.94Å; F129-Y132 PolarHBondContact O-N 3.21Å
133L78.7Confident85.5Confident103 Ų10385 Ų8554%0.53940%0.401SS..Hα-helixtrans-67-36.4174.8-79173.4000113.1F129 W131 F135F129-L133 HydrophobicContact CD1-CD1 3.67Å; F129-L133 HydrophobicContact CD1-CG 4.29Å; F129-L133 HydrophobicContact CE1-CD1 3.27Å; F129-L133 HydrophobicContact CE1-CD2 4.44Å; F129-L133 HydrophobicContact CE1-CG 3.95Å; F129-L133 HydrophobicContact CE2-CD1 4.44Å; F129-L133 HydrophobicContact CE2-CD2 4.42Å; F129-L133 HydrophobicContact CE2-CG 4.24Å; F129-L133 HydrophobicContact CG-CD1 4.42Å; F129-L133 HydrophobicContact CZ-CD1 3.7Å; F129-L133 HydrophobicContact CZ-CD2 4.01Å; F129-L133 HydrophobicContact CZ-CG 3.91Å; F129-L133 WeakPolarHBondContact O-CB 3.33Å; F129-L133 WeakPolarHBondContact O-CG 3.46Å; F129-L133 PolarHBondContact O-N 2.89Å; W131-L133 VanDerWaalsContact C-N 3.3Å; W131-L133 PolarHBondContact O-N 2.91Å; L133-F135 VanDerWaalsContact C-N 3.29Å; L133-F135 PolarHBondContact O-N 3.47Å
134K84.8Confident86Confident138 Ų13884.1 Ų84.160%0.640%0.396SS*.Hα-helixtrans-69.5-26.7179.3-74.8-178.2177.6-173.80113.3K130 W131 T136 K139K130-K134 WeakPolarHBondContact O-CG 3.35Å; K130-K134 PolarHBondContact O-N 3.27Å; W131-K134 PolarHBondContact O-N 2.89Å; W131-K134 VanDerWaalsContact O-N 3.13Å; K134-T136 PolarHBondContact O-N 3.47Å; K134-K139 PolarHBondContact O-NZ 3.29Å
135F86.2Confident86.5Confident53 Ų5386.6 Ų86.623%0.23241%0.408CS..SBendtrans-8686.4179.7-170.4-109.8000109.9K52 F56 W131 L133 K139 A140 L143K52-F135 HydrophobicContact CD-CD1 4.22Å; K52-F135 WeakPolarHBondContact CD-O 3.42Å; K52-F135 WeakPolarHBondContact CE-O 3.44Å; K52-F135 PolarHBondContact NZ-O 2.93Å; F56-F135 HydrophobicContact CE2-CE1 4.11Å; F56-F135 AromaticContact CZ-CE1 3.68Å; F56-F135 HydrophobicContact CZ-CE1 3.68Å; F56-F135 AromaticContact CZ-CZ 3.93Å; F56-F135 HydrophobicContact CZ-CZ 3.93Å; W131-F135 PolarHBondContact O-N 3.26Å; L133-F135 VanDerWaalsContact C-N 3.29Å; L133-F135 PolarHBondContact O-N 3.47Å; F135-K139 HydrophobicContact CD2-CB 4.37Å; F135-K139 HydrophobicContact CE2-CB 4.35Å; F135-A140 HydrophobicContact CE1-CB 3.85Å; F135-A140 HydrophobicContact CZ-CB 3.83Å; F135-L143 HydrophobicContact CE2-CD2 4.17Å; F135-L143 HydrophobicContact CZ-CD2 4.14Å
136T89.6Confident87.3Confident62 Ų6289.5 Ų89.538%0.3842%0.424SS..  trans-80.3162.3-176.361.50000112.2K134 R138 K139 A140K134-T136 PolarHBondContact O-N 3.47Å; T136-R138 PolarHBondContact O-N 3.02Å; T136-K139 WeakPolarHBondContact O-CB 3.35Å; T136-K139 PolarHBondContact O-N 3.2Å; T136-A140 PolarHBondContact O-N 3.02Å; T136-A140 VanDerWaalsContact O-N 3.1Å
137S89.3Confident88.2Confident40 Ų4088.3 Ų88.328%0.2842%0.419SS..Hα-helixtrans-54.7-39.4176-580000113K52 K139 A140 E141K52-S137 WeakPolarHBondContact CG-OG 3.26Å; S137-K139 VanDerWaalsContact C-N 3.3Å; S137-K139 PolarHBondContact O-N 3.27Å; S137-A140 WeakPolarHBondContact O-CB 3.49Å; S137-A140 PolarHBondContact O-N 3.08Å; S137-A140 VanDerWaalsContact O-N 3.12Å; S137-E141 PolarHBondContact O-N 3.44Å
138R92.3Very high89Confident207 Ų20784.8 Ų84.878%0.78140%0.398SS*.Hα-helixtrans-60.8-37.3176.2-68.2-176.4179.2173.5-0.8112.8T136 E141 L142T136-R138 PolarHBondContact O-N 3.02Å; R138-E141 PolarHBondContact O-N 3Å; R138-L142 WeakPolarHBondContact O-CB 3.34Å; R138-L142 PolarHBondContact O-N 2.88Å
139K93.6Very high90Very high111 Ų11186.9 Ų86.948%0.48341%0.41SS..Hα-helixtrans-70.7-36175.8-70.2-179.6-178.4175.80111.5K134 F135 T136 S137 L142 L143K134-K139 PolarHBondContact O-NZ 3.29Å; F135-K139 HydrophobicContact CD2-CB 4.37Å; F135-K139 HydrophobicContact CE2-CB 4.35Å; T136-K139 WeakPolarHBondContact O-CB 3.35Å; T136-K139 PolarHBondContact O-N 3.2Å; S137-K139 VanDerWaalsContact C-N 3.3Å; S137-K139 PolarHBondContact O-N 3.27Å; K139-L142 PolarHBondContact O-N 2.94Å; K139-L143 VanDerWaalsContact O-CB 3.23Å; K139-L143 WeakPolarHBondContact O-CB 3.47Å; K139-L143 PolarHBondContact O-N 3.28Å
140A93.9Very high91.1Very high0 Ų086.5 Ų86.50%041%0.412CS..Hα-helixtrans-63-44.6173.500000111.1F56 F135 T136 S137 L143 L144F56-A140 HydrophobicContact CE1-CB 4.06Å; F56-A140 HydrophobicContact CE2-CB 4.4Å; F56-A140 HydrophobicContact CZ-CB 3.77Å; F135-A140 HydrophobicContact CE1-CB 3.85Å; F135-A140 HydrophobicContact CZ-CB 3.83Å; T136-A140 PolarHBondContact O-N 3.02Å; T136-A140 VanDerWaalsContact O-N 3.1Å; S137-A140 WeakPolarHBondContact O-CB 3.49Å; S137-A140 PolarHBondContact O-N 3.08Å; S137-A140 VanDerWaalsContact O-N 3.12Å; A140-L143 PolarHBondContact O-N 3.35Å; A140-L144 VanDerWaalsContact O-CG 3.26Å; A140-L144 WeakPolarHBondContact O-CG 3.08Å; A140-L144 PolarHBondContact O-N 2.87Å
141E95.4Very high92Very high91 Ų9179 Ų7943%0.42538%0.38SS..Hα-helixtrans-60.3-48.4174.8-70.6170.7175.800112I55 S137 R138 L143 L144 V145I55-E141 HydrophobicContact CD1-CG 4.05Å; I55-E141 HydrophobicContact CG2-CG 3.81Å; S137-E141 PolarHBondContact O-N 3.44Å; R138-E141 PolarHBondContact O-N 3Å; E141-L143 VanDerWaalsContact C-N 3.32Å; E141-L143 PolarHBondContact O-N 3.4Å; E141-L144 WeakPolarHBondContact O-CB 3.31Å; E141-L144 PolarHBondContact O-N 3.28Å; E141-V145 WeakPolarHBondContact O-CG2 3.49Å; E141-V145 PolarHBondContact O-N 2.94Å
142L96.6Very high93.1Very high115 Ų11572.9 Ų72.960%0.60237%0.366SS*.Hα-helixtrans-59.6-43.4176.7-179.463.7000111.8R138 K139 L144 V145 V146R138-L142 WeakPolarHBondContact O-CB 3.34Å; R138-L142 PolarHBondContact O-N 2.88Å; K139-L142 PolarHBondContact O-N 2.94Å; L142-L144 VanDerWaalsContact C-N 3.3Å; L142-L144 PolarHBondContact O-N 2.93Å; L142-V145 PolarHBondContact O-N 2.82Å; L142-V146 WeakPolarHBondContact O-CG2 3.42Å; L142-V146 PolarHBondContact O-N 3.47Å
143L96.2Very high93.9Very high60 Ų6072.9 Ų72.931%0.31437%0.373SS..Hα-helixtrans-62.6-38.8178.6-176.960.1000111.7L117 F135 K139 A140 E141 V146 I147L117-L143 HydrophobicContact CD1-CD2 3.63Å; L117-L143 HydrophobicContact CD1-CG 3.92Å; L117-L143 HydrophobicContact CD2-CD2 3.56Å; L117-L143 HydrophobicContact CG-CD2 4.26Å; F135-L143 HydrophobicContact CE2-CD2 4.17Å; F135-L143 HydrophobicContact CZ-CD2 4.14Å; K139-L143 VanDerWaalsContact O-CB 3.23Å; K139-L143 WeakPolarHBondContact O-CB 3.47Å; K139-L143 PolarHBondContact O-N 3.28Å; A140-L143 PolarHBondContact O-N 3.35Å; E141-L143 VanDerWaalsContact C-N 3.32Å; E141-L143 PolarHBondContact O-N 3.4Å; L143-V146 PolarHBondContact O-N 3.42Å; L143-I147 HydrophobicContact CG-CD1 4.26Å; L143-I147 WeakPolarHBondContact O-CG1 3.41Å; L143-I147 PolarHBondContact O-N 3.42Å
144L97.2Very high94.7Very high12 Ų1270.2 Ų70.26%0.06336%0.36CS..Hα-helixtrans-64.3-45.5174-70.3169.3000111.7I55 F56 A59 V114 L117 A140 E141 L142 V146 I147 Y148I55-L144 HydrophobicContact CG2-CD1 3.54Å; F56-L144 HydrophobicContact CD1-CD1 4.19Å; F56-L144 HydrophobicContact CD1-CD2 4.14Å; F56-L144 HydrophobicContact CD1-CG 4.38Å; F56-L144 HydrophobicContact CE1-CD1 4.5Å; F56-L144 HydrophobicContact CE1-CD2 4.4Å; F56-L144 HydrophobicContact CE1-CG 4.4Å; A59-L144 HydrophobicContact CB-CD1 3.78Å; A59-L144 HydrophobicContact CB-CD2 3.6Å; A59-L144 HydrophobicContact CB-CG 4.25Å; V114-L144 HydrophobicContact CG2-CD2 3.61Å; L117-L144 HydrophobicContact CD1-CD2 4.44Å; A140-L144 VanDerWaalsContact O-CG 3.26Å; A140-L144 WeakPolarHBondContact O-CG 3.08Å; A140-L144 PolarHBondContact O-N 2.87Å; E141-L144 WeakPolarHBondContact O-CB 3.31Å; E141-L144 PolarHBondContact O-N 3.28Å; L142-L144 VanDerWaalsContact C-N 3.3Å; L142-L144 PolarHBondContact O-N 2.93Å; L144-V146 VanDerWaalsContact C-N 3.27Å; L144-V146 PolarHBondContact O-N 2.83Å; L144-I147 PolarHBondContact O-N 3.4Å; L144-I147 VanDerWaalsContact O-N 3.12Å; L144-Y148 VanDerWaalsContact O-CD2 3.25Å; L144-Y148 WeakPolarHBondContact O-CD2 3.27Å; L144-Y148 PolarHBondContact O-N 3.25Å
145V97.8Very high95.2Very high88 Ų8864.3 Ų64.353%0.53334%0.335SS..Hα-helixtrans-57.8-42.8175.8172.50000111.1E141 L142 Y148 T149E141-V145 WeakPolarHBondContact O-CG2 3.49Å; E141-V145 PolarHBondContact O-N 2.94Å; L142-V145 PolarHBondContact O-N 2.82Å; V145-Y148 PolarHBondContact O-N 2.75Å; V145-T149 VanDerWaalsContact O-CB 3.32Å; V145-T149 WeakPolarHBondContact O-CB 3.49Å; V145-T149 PolarHBondContact O-N 3.32Å; V145-T149 PolarHBondContact O-OG1 2.84Å
146V97.8Very high95.7Very high78 Ų7864.5 Ų64.547%0.47335%0.346SS..Hα-helixtrans-61.7-44.4175.5171.30000111.2L142 L143 L144 T149 L150L142-V146 WeakPolarHBondContact O-CG2 3.42Å; L142-V146 PolarHBondContact O-N 3.47Å; L143-V146 PolarHBondContact O-N 3.42Å; L144-V146 VanDerWaalsContact C-N 3.27Å; L144-V146 PolarHBondContact O-N 2.83Å; V146-T149 PolarHBondContact O-N 3.18Å; V146-L150 VanDerWaalsContact O-CB 3.28Å; V146-L150 WeakPolarHBondContact O-CB 3.41Å; V146-L150 PolarHBondContact O-N 3.15Å
147I98Very high96Very high15 Ų1566 Ų668%0.07735%0.351CS..Hα-helixtrans-59.9-50.6177.7-74.5165.7000111.1T110 L113 L117 L143 L144 T149 L150 S151T110-I147 HydrophobicContact CG2-CG2 4.01Å; L113-I147 HydrophobicContact CB-CD1 4.13Å; L113-I147 HydrophobicContact CB-CG2 4.1Å; L113-I147 HydrophobicContact CD1-CG1 4.28Å; L113-I147 HydrophobicContact CD1-CG2 3.78Å; L117-I147 HydrophobicContact CD1-CD1 3.41Å; L117-I147 VanDerWaalsContact CD1-CD1 3.41Å; L117-I147 HydrophobicContact CG-CD1 4.33Å; L143-I147 HydrophobicContact CG-CD1 4.26Å; L143-I147 WeakPolarHBondContact O-CG1 3.41Å; L143-I147 PolarHBondContact O-N 3.42Å; L144-I147 PolarHBondContact O-N 3.4Å; L144-I147 VanDerWaalsContact O-N 3.12Å; I147-T149 VanDerWaalsContact C-N 3.31Å; I147-T149 PolarHBondContact O-N 2.62Å; I147-L150 PolarHBondContact O-N 3.26Å; I147-S151 PolarHBondContact O-N 2.86Å; I147-S151 PolarHBondContact O-OG 2.96Å
148Y98Very high96.3Very high44 Ų4464.2 Ų64.217%0.17334%0.338CS..Hα-helixtrans-61.1-41.6178.2-83.1-76.6000112.2A59 V62 S63 I66 I106 T110 L144 V145 L150 S151 C152A59-Y148 HydrophobicContact CB-CE2 4.39Å; A59-Y148 PolarHBondContact O-OH 3.25Å; V62-Y148 HydrophobicContact CG1-CE1 4.22Å; V62-Y148 WeakPolarHBondContact CG1-OH 3.42Å; S63-Y148 PolarHBondContact N-OH 2.95Å; S63-Y148 PolarHBondContact OG-OH 2.68Å; I66-Y148 HydrophobicContact CD1-CE1 3.96Å; I106-Y148 HydrophobicContact CG2-CD1 4Å; I106-Y148 HydrophobicContact CG2-CE1 4.23Å; T110-Y148 HydrophobicContact CG2-CD1 3.51Å; T110-Y148 HydrophobicContact CG2-CE1 3.55Å; T110-Y148 HydrophobicContact CG2-CG 4.05Å; L144-Y148 VanDerWaalsContact O-CD2 3.25Å; L144-Y148 WeakPolarHBondContact O-CD2 3.27Å; L144-Y148 PolarHBondContact O-N 3.25Å; V145-Y148 PolarHBondContact O-N 2.75Å; Y148-L150 VanDerWaalsContact C-N 3.35Å; Y148-S151 PolarHBondContact O-N 3.46Å; Y148-C152 PolarHBondContact O-N 3.33Å; Y148-C152 VanDerWaalsContact O-N 3.09Å; Y148-C152 PolarHBondContact O-SG 3.09Å; Y148-C152 VanDerWaalsContact O-SG 3.33Å
149T97.6Very high96.3Very high78 Ų7855.8 Ų55.848%0.47931%0.308SS..Hα-helixtrans-65.9-41.5179-56.90000110.6V145 V146 I147 C152 V153V145-T149 VanDerWaalsContact O-CB 3.32Å; V145-T149 WeakPolarHBondContact O-CB 3.49Å; V145-T149 PolarHBondContact O-N 3.32Å; V145-T149 PolarHBondContact O-OG1 2.84Å; V146-T149 PolarHBondContact O-N 3.18Å; I147-T149 VanDerWaalsContact C-N 3.31Å; I147-T149 PolarHBondContact O-N 2.62Å; T149-C152 PolarHBondContact O-N 3.39Å; T149-V153 HydrophobicContact CG2-CG2 4.49Å; T149-V153 VanDerWaalsContact O-CG2 3.3Å; T149-V153 WeakPolarHBondContact O-CG2 3.43Å; T149-V153 PolarHBondContact O-N 3.27Å
150L97.1Very high96.4Very high99 Ų9955.1 Ų55.152%0.51831%0.309SS..Hα-helixtrans-63.5-42.8177-174.662.9000111.4V146 I147 Y148 C152 V153 V154V146-L150 VanDerWaalsContact O-CB 3.28Å; V146-L150 WeakPolarHBondContact O-CB 3.41Å; V146-L150 PolarHBondContact O-N 3.15Å; I147-L150 PolarHBondContact O-N 3.26Å; Y148-L150 VanDerWaalsContact C-N 3.35Å; L150-C152 VanDerWaalsContact C-N 3.33Å; L150-C152 PolarHBondContact O-N 2.79Å; L150-V153 PolarHBondContact O-N 2.66Å; L150-V153 VanDerWaalsContact O-N 3.15Å; L150-V154 HydrophobicContact CG-CG2 4.5Å; L150-V154 WeakPolarHBondContact O-CG2 3.34Å; L150-V154 PolarHBondContact O-N 3.16Å
151S96.9Very high96.4Very high6 Ų657.5 Ų57.54%0.04232%0.324CS..Hα-helixtrans-59.1-42.2174.4-63.30000112.1T109 T110 I147 Y148 V154 Y155T109-S151 WeakPolarHBondContact OG1-CB 3.34Å; T109-S151 PolarHBondContact OG1-OG 2.76Å; T110-S151 WeakPolarHBondContact CG2-OG 3.5Å; I147-S151 PolarHBondContact O-N 2.86Å; I147-S151 PolarHBondContact O-OG 2.96Å; Y148-S151 PolarHBondContact O-N 3.46Å; S151-V154 PolarHBondContact O-N 2.96Å; S151-Y155 PolarHBondContact O-N 3.49Å
152C97.2Very high96.2Very high60 Ų6053.2 Ų53.241%0.40530%0.303SS..Hα-helixtrans-63.6-41.1174.1-66.20000112.5I106 Y148 T149 L150 Y155 A156I106-C152 VanDerWaalsContact CD1-SG 3.58Å; Y148-C152 PolarHBondContact O-N 3.33Å; Y148-C152 VanDerWaalsContact O-N 3.09Å; Y148-C152 PolarHBondContact O-SG 3.09Å; Y148-C152 VanDerWaalsContact O-SG 3.33Å; T149-C152 PolarHBondContact O-N 3.39Å; L150-C152 VanDerWaalsContact C-N 3.33Å; L150-C152 PolarHBondContact O-N 2.79Å; C152-Y155 PolarHBondContact O-N 3.44Å; C152-A156 PolarHBondContact O-N 2.94Å
153V97.5Very high96Very high71 Ų7152.4 Ų52.443%0.4330%0.299SS..Hα-helixtrans-65.6-42.5178169.90000110.8T149 L150 Y155 A156 I157T149-V153 HydrophobicContact CG2-CG2 4.49Å; T149-V153 VanDerWaalsContact O-CG2 3.3Å; T149-V153 WeakPolarHBondContact O-CG2 3.43Å; T149-V153 PolarHBondContact O-N 3.27Å; L150-V153 PolarHBondContact O-N 2.66Å; L150-V153 VanDerWaalsContact O-N 3.15Å; V153-Y155 VanDerWaalsContact C-N 3.34Å; V153-Y155 PolarHBondContact O-N 2.9Å; V153-A156 PolarHBondContact O-N 2.78Å; V153-I157 HydrophobicContact CG1-CD1 3.96Å; V153-I157 VanDerWaalsContact O-CG1 3.31Å; V153-I157 WeakPolarHBondContact O-CG1 3.32Å; V153-I157 PolarHBondContact O-N 3.25Å
154V95.7Very high95.8Very high46 Ų4655.7 Ų55.728%0.27932%0.317SS..Hα-helixtrans-58.7-47.8174.9170.40000109.9L150 S151 A156 I157 I158 F186L150-V154 HydrophobicContact CG-CG2 4.5Å; L150-V154 WeakPolarHBondContact O-CG2 3.34Å; L150-V154 PolarHBondContact O-N 3.16Å; S151-V154 PolarHBondContact O-N 2.96Å; V154-A156 VanDerWaalsContact C-N 3.34Å; V154-A156 PolarHBondContact O-N 2.86Å; V154-I157 WeakPolarHBondContact O-CA 3.27Å; V154-I157 WeakPolarHBondContact O-CB 3.32Å; V154-I157 PolarHBondContact O-N 3.45Å; V154-I158 HydrophobicContact CG1-CD1 4.37Å; V154-I158 WeakPolarHBondContact O-CG1 3.46Å; V154-I158 PolarHBondContact O-N 3.19Å; V154-F186 HydrophobicContact CG1-CE2 4.28Å; V154-F186 HydrophobicContact CG1-CZ 3.85Å
155Y95.8Very high95.4Very high15 Ų1561.3 Ų61.36%0.05935%0.345CS..Hα-helixtrans-59.7-42.7175.9-168.9-96.3000112.6L95 N101 I102 E105 S151 C152 V153 I157 I158 M159L95-Y155 PolarHBondContact O-OH 3.43Å; N101-Y155 HydrophobicContact CB-CE2 4.32Å; I102-Y155 HydrophobicContact CB-CD1 3.96Å; I102-Y155 HydrophobicContact CB-CD2 4.17Å; I102-Y155 HydrophobicContact CB-CE1 3.65Å; I102-Y155 HydrophobicContact CB-CE2 3.87Å; I102-Y155 HydrophobicContact CB-CG 4.2Å; I102-Y155 HydrophobicContact CD1-CD1 3.67Å; I102-Y155 HydrophobicContact CD1-CE1 3.96Å; I102-Y155 HydrophobicContact CD1-CG 4.27Å; I102-Y155 HydrophobicContact CG1-CD1 3.75Å; I102-Y155 HydrophobicContact CG1-CD2 4.29Å; I102-Y155 HydrophobicContact CG1-CE1 3.97Å; I102-Y155 HydrophobicContact CG1-CE2 4.47Å; I102-Y155 HydrophobicContact CG1-CG 3.92Å; E105-Y155 HydrophobicContact CB-CD2 3.92Å; E105-Y155 HydrophobicContact CG-CD2 4.01Å; S151-Y155 PolarHBondContact O-N 3.49Å; C152-Y155 PolarHBondContact O-N 3.44Å; V153-Y155 VanDerWaalsContact C-N 3.34Å; V153-Y155 PolarHBondContact O-N 2.9Å; Y155-I157 VanDerWaalsContact C-N 3.27Å; Y155-I157 PolarHBondContact O-N 3.26Å; Y155-I158 HydrophobicContact CD2-CD1 4.26Å; Y155-I158 WeakPolarHBondContact O-CB 3.46Å; Y155-I158 PolarHBondContact O-N 2.91Å; Y155-I158 VanDerWaalsContact O-N 3.13Å; Y155-M159 HydrophobicContact CD1-CG 3.96Å; Y155-M159 HydrophobicContact CD1-SD 4.45Å; Y155-M159 HydrophobicContact CE1-CG 3.74Å; Y155-M159 HydrophobicContact CE1-SD 3.66Å; Y155-M159 WeakPolarHBondContact O-CG 3.46Å; Y155-M159 PolarHBondContact O-N 3.18Å
156A96.6Very high94.8Very high57 Ų5758.7 Ų58.747%0.47133%0.33SS..Hα-helixtrans-61.6-34.8175.400000112.7C152 V153 V154 M159 L160C152-A156 PolarHBondContact O-N 2.94Å; V153-A156 PolarHBondContact O-N 2.78Å; V154-A156 VanDerWaalsContact C-N 3.34Å; V154-A156 PolarHBondContact O-N 2.86Å; A156-M159 WeakPolarHBondContact O-CB 3.4Å; A156-M159 PolarHBondContact O-N 3.46Å; A156-L160 WeakPolarHBondContact O-CB 3.48Å; A156-L160 PolarHBondContact O-N 3.41Å
157I95.7Very high94.1Very high94 Ų9459.5 Ų59.548%0.48233%0.331SS..Hα-helixtrans-66.7-43.5173-67.2164.4000110.3V153 V154 Y155 M159 L160 V161V153-I157 HydrophobicContact CG1-CD1 3.96Å; V153-I157 VanDerWaalsContact O-CG1 3.31Å; V153-I157 WeakPolarHBondContact O-CG1 3.32Å; V153-I157 PolarHBondContact O-N 3.25Å; V154-I157 WeakPolarHBondContact O-CA 3.27Å; V154-I157 WeakPolarHBondContact O-CB 3.32Å; V154-I157 PolarHBondContact O-N 3.45Å; Y155-I157 VanDerWaalsContact C-N 3.27Å; Y155-I157 PolarHBondContact O-N 3.26Å; I157-M159 VanDerWaalsContact C-N 3.3Å; I157-M159 PolarHBondContact O-N 3.3Å; I157-L160 PolarHBondContact O-N 2.91Å; I157-V161 HydrophobicContact CG2-CG2 4.08Å; I157-V161 WeakPolarHBondContact O-CB 3.08Å; I157-V161 VanDerWaalsContact O-CG2 3.28Å; I157-V161 WeakPolarHBondContact O-CG2 3.5Å; I157-V161 PolarHBondContact O-N 3.47Å
158I94.4Very high93.2Very high2 Ų266.9 Ų66.91%0.0137%0.365CS..Hα-helixtrans-56.2-47174.7-60.3165.7000110.2L95 V154 Y155 L160 V161 S162 M182 P183 F186L95-I158 HydrophobicContact CD1-CG2 4.05Å; V154-I158 HydrophobicContact CG1-CD1 4.37Å; V154-I158 WeakPolarHBondContact O-CG1 3.46Å; V154-I158 PolarHBondContact O-N 3.19Å; Y155-I158 HydrophobicContact CD2-CD1 4.26Å; Y155-I158 WeakPolarHBondContact O-CB 3.46Å; Y155-I158 PolarHBondContact O-N 2.91Å; Y155-I158 VanDerWaalsContact O-N 3.13Å; I158-L160 VanDerWaalsContact C-N 3.35Å; I158-L160 PolarHBondContact O-N 3.15Å; I158-V161 PolarHBondContact O-N 3.26Å; I158-S162 VanDerWaalsContact O-CB 3.26Å; I158-S162 WeakPolarHBondContact O-CB 3.44Å; I158-S162 PolarHBondContact O-N 3.42Å; I158-M182 HydrophobicContact CD1-CE 4.33Å; I158-M182 HydrophobicContact CG2-CG 4.32Å; I158-P183 HydrophobicContact CG2-CG 4.47Å; I158-F186 HydrophobicContact CD1-CD1 3.86Å; I158-F186 HydrophobicContact CD1-CE1 3.14Å; I158-F186 HydrophobicContact CD1-CE2 3.92Å; I158-F186 HydrophobicContact CD1-CZ 3.19Å; I158-F186 HydrophobicContact CG1-CD1 4.12Å; I158-F186 HydrophobicContact CG1-CD2 4.06Å; I158-F186 HydrophobicContact CG1-CE1 3.72Å; I158-F186 HydrophobicContact CG1-CE2 3.62Å; I158-F186 HydrophobicContact CG1-CG 4.31Å; I158-F186 HydrophobicContact CG1-CZ 3.46Å; I158-F186 VanDerWaalsContact CG1-CZ 3.46Å
159M94.3Very high92.5Very high29 Ų2970.7 Ų70.714%0.14339%0.389CS..Hα-helixtrans-57.2-47.3177-66.5-60.9-60.100111.9F92 L95 V96 Y155 A156 I157 S162 L163F92-M159 HydrophobicContact CD2-CE 4.04Å; F92-M159 HydrophobicContact CE2-CE 3.71Å; F92-M159 HydrophobicContact CZ-CE 4.29Å; L95-M159 HydrophobicContact CB-CE 3.83Å; L95-M159 HydrophobicContact CB-SD 3.21Å; L95-M159 WeakPolarHBondContact CB-SD 3.28Å; L95-M159 HydrophobicContact CD1-SD 3.93Å; L95-M159 HydrophobicContact CG-SD 4.17Å; V96-M159 HydrophobicContact CB-CE 4.26Å; V96-M159 HydrophobicContact CG2-CE 3.29Å; Y155-M159 HydrophobicContact CD1-CG 3.96Å; Y155-M159 HydrophobicContact CD1-SD 4.45Å; Y155-M159 HydrophobicContact CE1-CG 3.74Å; Y155-M159 HydrophobicContact CE1-SD 3.66Å; Y155-M159 WeakPolarHBondContact O-CG 3.46Å; Y155-M159 PolarHBondContact O-N 3.18Å; A156-M159 WeakPolarHBondContact O-CB 3.4Å; A156-M159 PolarHBondContact O-N 3.46Å; I157-M159 VanDerWaalsContact C-N 3.3Å; I157-M159 PolarHBondContact O-N 3.3Å; M159-S162 PolarHBondContact O-N 3.18Å; M159-L163 WeakPolarHBondContact O-CB 3.31Å; M159-L163 PolarHBondContact O-N 2.82Å
160L94.8Very high92.1Very high98 Ų9869.7 Ų69.751%0.51338%0.383SS..Hα-helixtrans-65.8-44.5-179.3-178.663.3000111.6A156 I157 I158 L163 L164A156-L160 WeakPolarHBondContact O-CB 3.48Å; A156-L160 PolarHBondContact O-N 3.41Å; I157-L160 PolarHBondContact O-N 2.91Å; I158-L160 VanDerWaalsContact C-N 3.35Å; I158-L160 PolarHBondContact O-N 3.15Å; L160-L163 WeakPolarHBondContact O-CB 3.35Å; L160-L163 PolarHBondContact O-N 3.38Å; L160-L164 HydrophobicContact CD1-CD1 4.21Å; L160-L164 HydrophobicContact CD1-CG 4.44Å; L160-L164 HydrophobicContact CG-CD1 4.07Å; L160-L164 VanDerWaalsContact O-CG 3.27Å; L160-L164 WeakPolarHBondContact O-CG 3.47Å; L160-L164 PolarHBondContact O-N 2.98Å
161V93.3Very high91.7Very high50 Ų5071.9 Ų71.930%0.30338%0.384SS..Hα-helixtrans-64.6-42.7177.6172.70000110.7I157 I158 L163 L164 I165 P183I157-V161 HydrophobicContact CG2-CG2 4.08Å; I157-V161 WeakPolarHBondContact O-CB 3.08Å; I157-V161 VanDerWaalsContact O-CG2 3.28Å; I157-V161 WeakPolarHBondContact O-CG2 3.5Å; I157-V161 PolarHBondContact O-N 3.47Å; I158-V161 PolarHBondContact O-N 3.26Å; V161-L163 VanDerWaalsContact C-N 3.3Å; V161-L163 PolarHBondContact O-N 3.27Å; V161-L164 PolarHBondContact O-N 2.86Å; V161-L164 VanDerWaalsContact O-N 3.16Å; V161-I165 HydrophobicContact CG1-CD1 3.59Å; V161-I165 HydrophobicContact CG1-CG1 4.2Å; V161-I165 WeakPolarHBondContact O-CB 3.4Å; V161-I165 PolarHBondContact O-N 3.27Å; V161-P183 HydrophobicContact CB-CG 4.38Å; V161-P183 HydrophobicContact CG1-CB 4.31Å; V161-P183 HydrophobicContact CG1-CG 3.86Å
162S91.6Very high91.5Very high0 Ų072.4 Ų72.40%039%0.386CS..Hα-helixtrans-58.9-42.3174.9-177.30000111.2I158 M159 L164 T166I158-S162 VanDerWaalsContact O-CB 3.26Å; I158-S162 WeakPolarHBondContact O-CB 3.44Å; I158-S162 PolarHBondContact O-N 3.42Å; M159-S162 PolarHBondContact O-N 3.18Å; S162-L164 VanDerWaalsContact C-N 3.34Å; S162-L164 PolarHBondContact O-N 3.39Å; S162-T166 WeakPolarHBondContact O-CB 3.33Å; S162-T166 PolarHBondContact O-N 3.37Å; S162-T166 VanDerWaalsContact O-N 3.12Å; S162-T166 PolarHBondContact O-OG1 2.98Å; S162-T166 PolarHBondContact OG-OG1 3.43Å
163L91.6Very high91.1Very high99 Ų9970.7 Ų70.752%0.51838%0.375SS..Hα-helixtrans-64.4-35.2176-176.364.2000113.4F92 M159 L160 V161F92-L163 HydrophobicContact CD1-CD1 4.24Å; F92-L163 HydrophobicContact CD2-CB 3.79Å; F92-L163 HydrophobicContact CD2-CD1 4.11Å; F92-L163 HydrophobicContact CD2-CG 4.49Å; F92-L163 HydrophobicContact CE1-CD1 4.23Å; F92-L163 HydrophobicContact CE2-CB 3.85Å; F92-L163 HydrophobicContact CE2-CD1 4.09Å; F92-L163 HydrophobicContact CE2-CD2 4.36Å; F92-L163 HydrophobicContact CE2-CG 4.33Å; F92-L163 HydrophobicContact CG-CD1 4.18Å; F92-L163 HydrophobicContact CZ-CD1 4.15Å; M159-L163 WeakPolarHBondContact O-CB 3.31Å; M159-L163 PolarHBondContact O-N 2.82Å; L160-L163 WeakPolarHBondContact O-CB 3.35Å; L160-L163 PolarHBondContact O-N 3.38Å; V161-L163 VanDerWaalsContact C-N 3.3Å; V161-L163 PolarHBondContact O-N 3.27Å
164L92.3Very high90.8Very high129 Ų12968 Ų6868%0.67536%0.359SS*.Hα-helixtrans-85.7-33.4-174.4-69173.7000113.9L160 V161 S162L160-L164 HydrophobicContact CD1-CD1 4.21Å; L160-L164 HydrophobicContact CD1-CG 4.44Å; L160-L164 HydrophobicContact CG-CD1 4.07Å; L160-L164 VanDerWaalsContact O-CG 3.27Å; L160-L164 WeakPolarHBondContact O-CG 3.47Å; L160-L164 PolarHBondContact O-N 2.98Å; V161-L164 PolarHBondContact O-N 2.86Å; V161-L164 VanDerWaalsContact O-N 3.16Å; S162-L164 VanDerWaalsContact C-N 3.34Å; S162-L164 PolarHBondContact O-N 3.39Å
165I89.5Confident90.6Very high129 Ų12967.2 Ų67.266%0.66235%0.352SS*.Hα-helixtrans-104.1-31.6-171.1-58-176.1000112.3V161 D167V161-I165 HydrophobicContact CG1-CD1 3.59Å; V161-I165 HydrophobicContact CG1-CG1 4.2Å; V161-I165 WeakPolarHBondContact O-CB 3.4Å; V161-I165 PolarHBondContact O-N 3.27Å; I165-D167 PolarHBondContact O-N 3.18Å
166T85Confident90.4Very high34 Ų3466.5 Ų66.521%0.20935%0.349CS..SBendtrans-71.8123.7-174.9-48.10000109.9P91 S162 Q168 T170P91-T166 HydrophobicContact CB-CG2 4.04Å; P91-T166 HydrophobicContact CG-CG2 3.64Å; S162-T166 WeakPolarHBondContact O-CB 3.33Å; S162-T166 PolarHBondContact O-N 3.37Å; S162-T166 VanDerWaalsContact O-N 3.12Å; S162-T166 PolarHBondContact O-OG1 2.98Å; S162-T166 PolarHBondContact OG-OG1 3.43Å; T166-Q168 PolarHBondContact O-N 3.06Å; T166-T170 HydrophobicContact CG2-CG2 4.33Å
167D82.7Confident90.1Very high94 Ų9467 Ų6750%0.50334%0.339SS..  trans-59.3136.9172.1-173.5-5.7000109.2I165 N169 T170I165-D167 PolarHBondContact O-N 3.18Å; D167-N169 PolarHBondContact O-N 3.33Å; D167-N169 PolarHBondContact OD1-N 2.85Å; D167-T170 WeakPolarHBondContact O-CB 3.25Å; D167-T170 PolarHBondContact O-N 3.09Å; D167-T170 PolarHBondContact O-OG1 2.76Å
168Q78.8Confident89.8Confident170 Ų17063.1 Ų63.179%0.79432%0.319SS*.THydrogen-bonded Turntrans-58.8-18.6177.2-64.1-172.3-300112.3T166T166-Q168 PolarHBondContact O-N 3.06Å
169N84.2Confident89.6Confident124 Ų12467.4 Ų67.466%0.66334%0.342SS*.THydrogen-bonded Turntrans-88.9-9.5176.8-62.3-40.8000114.5D167 R171D167-N169 PolarHBondContact O-N 3.33Å; D167-N169 PolarHBondContact OD1-N 2.85Å; N169-R171 PolarHBondContact O-N 2.89Å
170T88.4Confident89.3Confident58 Ų5869.6 Ų69.636%0.35635%0.352SS..  trans-67.4125.5176.3-53.60000109.9P91 T166 D167P91-T170 WeakPolarHBondContact CD-O 3.43Å; P91-T170 HydrophobicContact CG-CG2 4.03Å; T166-T170 HydrophobicContact CG2-CG2 4.33Å; D167-T170 WeakPolarHBondContact O-CB 3.25Å; D167-T170 PolarHBondContact O-N 3.09Å; D167-T170 PolarHBondContact O-OG1 2.76Å
171R89.9Confident89.1Confident144 Ų14465 Ų6554%0.54333%0.328SS..  trans-123.2127.6-176.7-67.8-58.7173.9171.8-7.6109.3F88 N169F88-R171 HydrophobicContact CB-CB 3.77Å; F88-R171 HydrophobicContact CB-CG 4.27Å; F88-R171 HydrophobicContact CG-CB 4.37Å; N169-R171 PolarHBondContact O-N 2.89Å
172I91.5Very high89Confident18 Ų1862.9 Ų62.99%0.09232%0.315CS..BIsolated β-bridgetrans-123.6173.3-179.763.6164000111I89 P91 C94 E180 A181I89-I172 HydrophobicContact CG2-CG1 4.01Å; I89-I172 PolarHBondContact N-O 3.49Å; I89-I172 VanDerWaalsContact N-O 3.14Å; I89-I172 WeakPolarHBondContact O-CG1 3.37Å; I89-I172 PolarHBondContact O-N 3.34Å; P91-I172 HydrophobicContact CB-CD1 4.21Å; P91-I172 HydrophobicContact CG-CD1 4.16Å; P91-I172 HydrophobicContact CG-CG1 4.22Å; P91-I172 HydrophobicContact CG-CG2 3.88Å; C94-I172 HydrophobicContact CB-CD1 3.9Å; I172-E180 HydrophobicContact CB-CB 4.18Å; I172-E180 HydrophobicContact CD1-CB 4.15Å; I172-E180 HydrophobicContact CG2-CB 4.18Å; I172-A181 HydrophobicContact CD1-CB 4.08Å
173S90.2Very high88.8Confident23 Ų2364.1 Ų64.116%0.16132%0.323CS..  trans-61137.2-179.1-176.80000112F175 C176 E180S173-F175 PolarHBondContact O-N 3.27Å; S173-F175 VanDerWaalsContact O-N 3.11Å; S173-F175 VanDerWaalsContact OG-CD2 3.29Å; S173-F175 WeakPolarHBondContact OG-CD2 3.49Å; S173-F175 PolarHBondContact OG-N 2.96Å; S173-C176 PolarHBondContact O-N 3.29Å; S173-C176 VanDerWaalsContact O-N 3.1Å; S173-E180 WeakPolarHBondContact CB-OE2 3.28Å; S173-E180 PolarHBondContact N-OE2 3.33Å
174P90.4Very high88.4Confident16 Ų1662.6 Ų62.610%0.10433%0.331CS..THydrogen-bonded Turntrans-63.7-16.6176.625.2-33.6000113.7R77 V81 A85 Y87 C176R77-P174 PolarHBondContact NE-O 3.28Å; R77-P174 PolarHBondContact NH2-O 2.91Å; V81-P174 HydrophobicContact CG1-CB 3.78Å; V81-P174 HydrophobicContact CG1-CG 3.59Å; V81-P174 HydrophobicContact CG2-CB 4.06Å; V81-P174 WeakPolarHBondContact CG2-O 3.46Å; A85-P174 HydrophobicContact CB-CB 4.39Å; Y87-P174 WeakPolarHBondContact O-CB 3.21Å; Y87-P174 WeakPolarHBondContact O-CG 3.32Å; P174-C176 PolarHBondContact O-N 3.44Å
175F90.7Very high88.1Confident28 Ų2862.2 Ų62.212%0.12333%0.33CS..THydrogen-bonded Turntrans-66.4-19.3174.4-66.2-55.3000113.7R78 V81 L82 S173 Y177R78-F175 HydrophobicContact CB-CD1 4.22Å; R78-F175 HydrophobicContact CB-CE1 4.31Å; R78-F175 HydrophobicContact CG-CD1 3.78Å; R78-F175 HydrophobicContact CG-CE1 4.28Å; V81-F175 HydrophobicContact CB-CD1 4.01Å; V81-F175 HydrophobicContact CB-CE1 3.89Å; V81-F175 HydrophobicContact CG1-CD1 3.7Å; V81-F175 HydrophobicContact CG1-CE1 3.46Å; V81-F175 VanDerWaalsContact CG1-CE1 3.46Å; V81-F175 HydrophobicContact CG1-CG 4.38Å; V81-F175 HydrophobicContact CG1-CZ 3.95Å; L82-F175 HydrophobicContact CD2-CE1 4.37Å; L82-F175 HydrophobicContact CD2-CZ 4Å; L82-F175 HydrophobicContact CG-CE1 4.17Å; L82-F175 HydrophobicContact CG-CZ 4.31Å; S173-F175 PolarHBondContact O-N 3.27Å; S173-F175 VanDerWaalsContact O-N 3.11Å; S173-F175 VanDerWaalsContact OG-CD2 3.29Å; S173-F175 WeakPolarHBondContact OG-CD2 3.49Å; S173-F175 PolarHBondContact OG-N 2.96Å; F175-Y177 HydrophobicContact CB-CD2 4.18Å; F175-Y177 HydrophobicContact CB-CE2 3.71Å; F175-Y177 HydrophobicContact CD2-CE2 4.05Å; F175-Y177 HydrophobicContact CG-CE2 4.3Å
176C92.4Very high88.1Confident0 Ų058.8 Ų58.80%031%0.31CS..  trans6156.5174.9-80.60000113.7C94 A98 H100 N101 S173 P174C94-C176 WeakPolarHBondContact CA-SG 3.48Å; C94-C176 HydrophobicContact CB-CB 4.32Å; C94-C176 WeakPolarHBondContact CB-SG 3.38Å; C94-C176 WeakPolarHBondContact SG-CA 2.95Å; C94-C176 WeakPolarHBondContact SG-CB 3.41Å; C94-C176 CovalentContact SG-SG 2.02Å; C94-C176 PolarHBondContact SG-SG 2.67Å; A98-C176 HydrophobicContact CB-CB 3.53Å; H100-C176 PolarHBondContact NE2-O 3.49Å; N101-C176 PolarHBondContact OD1-O 3.39Å; S173-C176 PolarHBondContact O-N 3.29Å; S173-C176 VanDerWaalsContact O-N 3.1Å; P174-C176 PolarHBondContact O-N 3.44Å
177Y90.4Very high88.4Confident67 Ų6759.5 Ų59.526%0.26331%0.31SS..  trans-65.1142.8170.2-59.7-77.2000110.3F175 D179 E180 A181F175-Y177 HydrophobicContact CB-CD2 4.18Å; F175-Y177 HydrophobicContact CB-CE2 3.71Å; F175-Y177 HydrophobicContact CD2-CE2 4.05Å; F175-Y177 HydrophobicContact CG-CE2 4.3Å; Y177-D179 WeakPolarHBondContact CB-OD1 3.38Å; Y177-D179 PolarHBondContact O-N 2.85Å; Y177-E180 PolarHBondContact O-N 2.95Å; Y177-A181 VanDerWaalsContact O-CB 3.28Å; Y177-A181 WeakPolarHBondContact O-CB 3.31Å; Y177-A181 PolarHBondContact O-N 2.95Å
178Q89.9Confident88.7Confident14 Ų1460.7 Ų60.77%0.06531%0.312CS..Hα-helixtrans-66.2-38-173.5-77.4-179.9-71.400112.4N101 F104 E180 A181 M182 Y187N101-Q178 VanDerWaalsContact OD1-CG 3.23Å; N101-Q178 WeakPolarHBondContact OD1-CG 3.35Å; F104-Q178 VanDerWaalsContact CB-NE2 3.28Å; F104-Q178 HydrophobicContact CD2-CG 4.37Å; Q178-E180 VanDerWaalsContact C-N 3.34Å; Q178-A181 PolarHBondContact O-N 2.94Å; Q178-M182 HydrophobicContact CB-CE 4.47Å; Q178-M182 HydrophobicContact CB-SD 4.4Å; Q178-M182 HydrophobicContact CG-CE 4.46Å; Q178-M182 VanDerWaalsContact O-CB 3.26Å; Q178-M182 WeakPolarHBondContact O-CB 3.44Å; Q178-M182 WeakPolarHBondContact O-CG 3.4Å; Q178-M182 PolarHBondContact O-N 3.26Å; Q178-Y187 HydrophobicContact CB-CD2 3.82Å; Q178-Y187 HydrophobicContact CB-CE2 3.74Å
179D89Confident89.4Confident91 Ų9156.8 Ų56.849%0.48730%0.3SS..Hα-helixtrans-65.1-35177.462.7-39.7000112.7Y177 Y187Y177-D179 WeakPolarHBondContact CB-OD1 3.38Å; Y177-D179 PolarHBondContact O-N 2.85Å; D179-Y187 HydrophobicContact CB-CD1 3.6Å; D179-Y187 HydrophobicContact CB-CE1 3.91Å; D179-Y187 HydrophobicContact CB-CG 3.94Å
180E89.5Confident89.8Confident75 Ų7551.2 Ų51.235%0.3527%0.27SS..Hα-helixtrans-78.3-34.8174.1-66.2-177.4-167.800113I172 S173 Y177 Q178I172-E180 HydrophobicContact CB-CB 4.18Å; I172-E180 HydrophobicContact CD1-CB 4.15Å; I172-E180 HydrophobicContact CG2-CB 4.18Å; S173-E180 WeakPolarHBondContact CB-OE2 3.28Å; S173-E180 PolarHBondContact N-OE2 3.33Å; Y177-E180 PolarHBondContact O-N 2.95Å; Q178-E180 VanDerWaalsContact C-N 3.34Å
181A90Very high89.9Confident1 Ų149.3 Ų49.31%0.00826%0.259CS..Hα-helixtrans-82.9-31.1-173.800000113.3C94 L95 I172 Y177 Q178C94-A181 HydrophobicContact CB-CB 4.46Å; L95-A181 WeakPolarHBondContact CD1-O 3.08Å; L95-A181 HydrophobicContact CD2-CB 3.73Å; L95-A181 HydrophobicContact CG-CB 4.09Å; I172-A181 HydrophobicContact CD1-CB 4.08Å; Y177-A181 VanDerWaalsContact O-CB 3.28Å; Y177-A181 WeakPolarHBondContact O-CB 3.31Å; Y177-A181 PolarHBondContact O-N 2.95Å; Q178-A181 PolarHBondContact O-N 2.94Å
182M90.5Very high90.1Very high6 Ų646.1 Ų46.13%0.0325%0.252CS..SBendtrans-80.7137.6179.9-68.6175.8170.400110.9E105 I158 Q178 G184 F186 Y187E105-M182 WeakPolarHBondContact OE2-CE 3.5Å; I158-M182 HydrophobicContact CD1-CE 4.33Å; I158-M182 HydrophobicContact CG2-CG 4.32Å; Q178-M182 HydrophobicContact CB-CE 4.47Å; Q178-M182 HydrophobicContact CB-SD 4.4Å; Q178-M182 HydrophobicContact CG-CE 4.46Å; Q178-M182 VanDerWaalsContact O-CB 3.26Å; Q178-M182 WeakPolarHBondContact O-CB 3.44Å; Q178-M182 WeakPolarHBondContact O-CG 3.4Å; Q178-M182 PolarHBondContact O-N 3.26Å; M182-G184 PolarHBondContact O-N 3.2Å; M182-F186 HydrophobicContact CB-CB 4.34Å; M182-F186 HydrophobicContact CB-CD1 4.2Å; M182-F186 HydrophobicContact CE-CD1 4.42Å; M182-F186 HydrophobicContact CE-CE1 4.25Å; M182-F186 HydrophobicContact CG-CD1 4.15Å; M182-F186 HydrophobicContact SD-CD1 3.55Å; M182-F186 VanDerWaalsContact SD-CD1 3.55Å; M182-F186 HydrophobicContact SD-CE1 3.94Å; M182-Y187 HydrophobicContact SD-CD2 4.02Å
183P87.4Confident90.2Very high26 Ų2649.3 Ų49.317%0.16927%0.266CS..  trans-72.6129.7-175.828.7-32.8000112.2I158 V161 F186I158-P183 HydrophobicContact CG2-CG 4.47Å; V161-P183 HydrophobicContact CB-CG 4.38Å; V161-P183 HydrophobicContact CG1-CB 4.31Å; V161-P183 HydrophobicContact CG1-CG 3.86Å; P183-F186 WeakPolarHBondContact O-CB 3.37Å; P183-F186 PolarHBondContact O-N 2.91Å
184G83.1Confident90.4Very high68 Ų6848.4 Ų48.470%0.70126%0.259SS*.THydrogen-bonded Turntrans60.9-135.1171.200000113.3M182 F186M182-G184 PolarHBondContact O-N 3.2Å; G184-F186 PolarHBondContact O-N 3.31Å
185N86.6Confident90.6Very high121 Ų12148.6 Ų48.665%0.64726%0.259SS*.THydrogen-bonded Turntrans-84.413.1-176.3-60.7-10.9000113.2Y187 Q188 V189N185-Y187 PolarHBondContact O-N 3.18Å; N185-Q188 PolarHBondContact O-N 3.22Å; N185-V189 WeakPolarHBondContact O-CG2 3.47Å; N185-V189 PolarHBondContact O-N 3.27Å
186F90.2Very high90.8Very high57 Ų5751.7 Ų51.725%0.2528%0.28CS..Hα-helixtrans-60.8-45.1-174.6-176.2-81.8000111.9V154 I158 M182 P183 G184 Q188 V189 H190V154-F186 HydrophobicContact CG1-CE2 4.28Å; V154-F186 HydrophobicContact CG1-CZ 3.85Å; I158-F186 HydrophobicContact CD1-CD1 3.86Å; I158-F186 HydrophobicContact CD1-CE1 3.14Å; I158-F186 HydrophobicContact CD1-CE2 3.92Å; I158-F186 HydrophobicContact CD1-CZ 3.19Å; I158-F186 HydrophobicContact CG1-CD1 4.12Å; I158-F186 HydrophobicContact CG1-CD2 4.06Å; I158-F186 HydrophobicContact CG1-CE1 3.72Å; I158-F186 HydrophobicContact CG1-CE2 3.62Å; I158-F186 HydrophobicContact CG1-CG 4.31Å; I158-F186 HydrophobicContact CG1-CZ 3.46Å; I158-F186 VanDerWaalsContact CG1-CZ 3.46Å; M182-F186 HydrophobicContact CB-CB 4.34Å; M182-F186 HydrophobicContact CB-CD1 4.2Å; M182-F186 HydrophobicContact CE-CD1 4.42Å; M182-F186 HydrophobicContact CE-CE1 4.25Å; M182-F186 HydrophobicContact CG-CD1 4.15Å; M182-F186 HydrophobicContact SD-CD1 3.55Å; M182-F186 VanDerWaalsContact SD-CD1 3.55Å; M182-F186 HydrophobicContact SD-CE1 3.94Å; P183-F186 WeakPolarHBondContact O-CB 3.37Å; P183-F186 PolarHBondContact O-N 2.91Å; G184-F186 PolarHBondContact O-N 3.31Å; F186-Q188 VanDerWaalsContact C-N 3.3Å; F186-Q188 PolarHBondContact O-N 3.27Å; F186-V189 PolarHBondContact O-N 2.94Å; F186-H190 HydrophobicContact CE1-CB 4.18Å; F186-H190 WeakPolarHBondContact O-CB 3.31Å; F186-H190 PolarHBondContact O-N 3.08Å
187Y89.9Confident90.9Very high49 Ų4952 Ų5219%0.19228%0.282CS..Hα-helixtrans-59.3-42.8178.9-179.3-105.6000111.7Q178 D179 M182 N185 H190 C191 W269Q178-Y187 HydrophobicContact CB-CD2 3.82Å; Q178-Y187 HydrophobicContact CB-CE2 3.74Å; D179-Y187 HydrophobicContact CB-CD1 3.6Å; D179-Y187 HydrophobicContact CB-CE1 3.91Å; D179-Y187 HydrophobicContact CB-CG 3.94Å; M182-Y187 HydrophobicContact SD-CD2 4.02Å; N185-Y187 PolarHBondContact O-N 3.18Å; Y187-H190 WeakPolarHBondContact O-CB 3.29Å; Y187-H190 PolarHBondContact O-N 3.42Å; Y187-C191 PolarHBondContact O-N 3.09Å; Y187-C191 PolarHBondContact O-SG 3.42Å; Y187-W269 VanDerWaalsContact OH-CZ2 3.24Å; Y187-W269 WeakPolarHBondContact OH-CZ2 3.32Å
188Q90.7Very high91.1Very high118 Ų11849 Ų4955%0.55127%0.27SS*.Hα-helixtrans-62.6-45.2175.7-174.2175.74.100111.9N185 F186 H190 C191 D192N185-Q188 PolarHBondContact O-N 3.22Å; F186-Q188 VanDerWaalsContact C-N 3.3Å; F186-Q188 PolarHBondContact O-N 3.27Å; Q188-H190 VanDerWaalsContact C-N 3.29Å; Q188-H190 PolarHBondContact O-N 3.44Å; Q188-C191 PolarHBondContact O-N 3.42Å; Q188-D192 WeakPolarHBondContact O-CB 3.3Å; Q188-D192 VanDerWaalsContact O-CG 3.31Å; Q188-D192 PolarHBondContact O-N 3.48Å
189V92.6Very high91.3Very high89 Ų8953.1 Ų53.154%0.53929%0.286SS..Hα-helixtrans-61.3-38.5176.4171.70000111.5N185 F186 D192 F193N185-V189 WeakPolarHBondContact O-CG2 3.47Å; N185-V189 PolarHBondContact O-N 3.27Å; F186-V189 PolarHBondContact O-N 2.94Å; V189-D192 PolarHBondContact O-N 2.97Å; V189-F193 VanDerWaalsContact O-CB 3.27Å; V189-F193 WeakPolarHBondContact O-CB 3.44Å; V189-F193 PolarHBondContact O-N 3.22Å
190H92.2Very high91.6Very high6 Ų651.6 Ų51.63%0.02828%0.28CS..Hα-helixtrans-63.6-48.2174.1173.667000111.3E105 E108 F186 Y187 Q188 D192 F193 L194E105-H190 IonicContact OE1-ND1 2.65Å; E105-H190 IonicContact OE2-CE1 3.13Å; E105-H190 IonicContact OE2-CG 2.86Å; E105-H190 IonicContact OE2-ND1 2.71Å; E105-H190 IonicContact OE2-NE2 3.88Å; E108-H190 IonicContact OE2-CD2 3.99Å; E108-H190 IonicContact OE2-CE1 3.87Å; E108-H190 IonicContact OE2-NE2 3.68Å; E108-H190 PolarHBondContact OE2-NE2 3.46Å; F186-H190 HydrophobicContact CE1-CB 4.18Å; F186-H190 WeakPolarHBondContact O-CB 3.31Å; F186-H190 PolarHBondContact O-N 3.08Å; Y187-H190 WeakPolarHBondContact O-CB 3.29Å; Y187-H190 PolarHBondContact O-N 3.42Å; Q188-H190 VanDerWaalsContact C-N 3.29Å; Q188-H190 PolarHBondContact O-N 3.44Å; H190-D192 PolarHBondContact O-N 3.08Å; H190-F193 WeakPolarHBondContact O-CB 3.19Å; H190-F193 PolarHBondContact O-N 3.3Å; H190-L194 WeakPolarHBondContact NE2-CD1 3.45Å; H190-L194 WeakPolarHBondContact O-CG 3.27Å; H190-L194 PolarHBondContact O-N 3.09Å
191C91.5Very high91.8Very high19 Ų1948.1 Ų48.113%0.12826%0.264CS..Hα-helixtrans-58.5-45.1175.1-66.40000112.4Y187 Q188 L194 L195 M253Y187-C191 PolarHBondContact O-N 3.09Å; Y187-C191 PolarHBondContact O-SG 3.42Å; Q188-C191 PolarHBondContact O-N 3.42Å; C191-L194 PolarHBondContact O-N 3.34Å; C191-L195 WeakPolarHBondContact O-CG 3.27Å; C191-L195 PolarHBondContact O-N 2.97Å; C191-M253 HydrophobicContact CB-CE 3.85Å
192D93.1Very high92Very high77 Ų7750.1 Ų50.141%0.41228%0.275SS..Hα-helixtrans-62.5-43.4177.2-72.8-21.6000111.4Q188 V189 H190 L194 L195 V196Q188-D192 WeakPolarHBondContact O-CB 3.3Å; Q188-D192 VanDerWaalsContact O-CG 3.31Å; Q188-D192 PolarHBondContact O-N 3.48Å; V189-D192 PolarHBondContact O-N 2.97Å; H190-D192 PolarHBondContact O-N 3.08Å; D192-L194 PolarHBondContact O-N 3.3Å; D192-L195 PolarHBondContact O-N 2.8Å; D192-V196 WeakPolarHBondContact O-CB 3.36Å; D192-V196 VanDerWaalsContact O-CG2 3.28Å; D192-V196 WeakPolarHBondContact O-CG2 3.19Å; D192-V196 PolarHBondContact O-N 3.27Å
193F94.9Very high92.1Very high85 Ų8553.7 Ų53.737%0.37330%0.297SS..Hα-helixtrans-59.2-47.1175.4167.3-100000111.7T109 L113 V189 H190 V196 A197T109-F193 HydrophobicContact CG2-CE1 4.29Å; L113-F193 HydrophobicContact CD1-CZ 4.24Å; L113-F193 HydrophobicContact CD2-CZ 3.86Å; L113-F193 HydrophobicContact CG-CZ 4.01Å; V189-F193 VanDerWaalsContact O-CB 3.27Å; V189-F193 WeakPolarHBondContact O-CB 3.44Å; V189-F193 PolarHBondContact O-N 3.22Å; H190-F193 WeakPolarHBondContact O-CB 3.19Å; H190-F193 PolarHBondContact O-N 3.3Å; F193-V196 PolarHBondContact O-N 3.1Å; F193-A197 WeakPolarHBondContact O-CB 3.26Å; F193-A197 PolarHBondContact O-N 2.84Å
194L94Very high92.4Very high3 Ų353.7 Ų53.72%0.01630%0.296CS..Hα-helixtrans-60.3-47.4176.9-68.7179.8000111.1E108 A112 H190 C191 D192 V196 A197 Y198E108-L194 HydrophobicContact CB-CD1 3.85Å; E108-L194 HydrophobicContact CB-CD2 4.06Å; E108-L194 HydrophobicContact CG-CD1 4.49Å; A112-L194 HydrophobicContact CB-CD2 3.69Å; H190-L194 WeakPolarHBondContact NE2-CD1 3.45Å; H190-L194 WeakPolarHBondContact O-CG 3.27Å; H190-L194 PolarHBondContact O-N 3.09Å; C191-L194 PolarHBondContact O-N 3.34Å; D192-L194 PolarHBondContact O-N 3.3Å; L194-V196 PolarHBondContact O-N 3.13Å; L194-A197 PolarHBondContact O-N 3.35Å; L194-Y198 HydrophobicContact CB-CD2 4.37Å; L194-Y198 HydrophobicContact CB-CE2 4.08Å; L194-Y198 WeakPolarHBondContact O-CD2 3.38Å; L194-Y198 PolarHBondContact O-N 3.38Å
195L93.4Very high92.7Very high20 Ų2050.7 Ų50.711%0.10527%0.265CS..Hα-helixtrans-58.1-49.9177.5-78.3172.4000111.4C191 D192 A197 Y198 Y199 M253C191-L195 WeakPolarHBondContact O-CG 3.27Å; C191-L195 PolarHBondContact O-N 2.97Å; D192-L195 PolarHBondContact O-N 2.8Å; L195-A197 VanDerWaalsContact C-N 3.33Å; L195-A197 PolarHBondContact O-N 3.07Å; L195-Y198 PolarHBondContact O-N 3.21Å; L195-Y199 HydrophobicContact CB-CD2 4.45Å; L195-Y199 HydrophobicContact CD2-CE2 4.16Å; L195-Y199 WeakPolarHBondContact O-CB 3.4Å; L195-Y199 WeakPolarHBondContact O-CD2 3.27Å; L195-Y199 PolarHBondContact O-N 3.39Å; L195-M253 HydrophobicContact CD2-CB 3.68Å; L195-M253 HydrophobicContact CG-CB 4.35Å
196V95.4Very high93Very high93 Ų9349.3 Ų49.356%0.56426%0.257SS*.Hα-helixtrans-59-44.4177.8170.10000111D192 F193 L194 Y198 Y199 T200D192-V196 WeakPolarHBondContact O-CB 3.36Å; D192-V196 VanDerWaalsContact O-CG2 3.28Å; D192-V196 WeakPolarHBondContact O-CG2 3.19Å; D192-V196 PolarHBondContact O-N 3.27Å; F193-V196 PolarHBondContact O-N 3.1Å; L194-V196 PolarHBondContact O-N 3.13Å; V196-Y198 PolarHBondContact O-N 2.94Å; V196-Y199 PolarHBondContact O-N 3.19Å; V196-T200 VanDerWaalsContact O-CB 3.24Å; V196-T200 WeakPolarHBondContact O-CB 3.45Å; V196-T200 PolarHBondContact O-N 3.39Å; V196-T200 PolarHBondContact O-OG1 2.97Å
197A95.2Very high93Very high6 Ų649.3 Ų49.35%0.0526%0.261CS..Hα-helixtrans-62.4-43.2178.400000112A112 F193 L194 L195 S201A112-A197 HydrophobicContact CB-CB 3.96Å; F193-A197 WeakPolarHBondContact O-CB 3.26Å; F193-A197 PolarHBondContact O-N 2.84Å; L194-A197 PolarHBondContact O-N 3.35Å; L195-A197 VanDerWaalsContact C-N 3.33Å; L195-A197 PolarHBondContact O-N 3.07Å; A197-S201 WeakPolarHBondContact O-CB 3.49Å; A197-S201 PolarHBondContact O-N 3.45Å; A197-S201 PolarHBondContact O-OG 2.92Å
198Y93.6Very high92.9Very high4 Ų447 Ų472%0.01625%0.252CS..Hα-helixtrans-69.9-43.1178.2-68.9-53000112.8A112 L194 L195 V196 T200 S201 L202 R245 Q249 M250A112-Y198 HydrophobicContact CB-CE1 3.91Å; A112-Y198 HydrophobicContact CB-CE2 4.15Å; L194-Y198 HydrophobicContact CB-CD2 4.37Å; L194-Y198 HydrophobicContact CB-CE2 4.08Å; L194-Y198 WeakPolarHBondContact O-CD2 3.38Å; L194-Y198 PolarHBondContact O-N 3.38Å; L195-Y198 PolarHBondContact O-N 3.21Å; V196-Y198 PolarHBondContact O-N 2.94Å; Y198-T200 VanDerWaalsContact C-N 3.32Å; Y198-T200 PolarHBondContact O-N 2.88Å; Y198-S201 WeakPolarHBondContact O-CB 3.45Å; Y198-S201 PolarHBondContact O-N 3.13Å; Y198-L202 WeakPolarHBondContact O-CB 3.24Å; Y198-L202 PolarHBondContact O-N 3.39Å; Y198-R245 HydrophobicContact CD1-CG 4.03Å; Y198-R245 HydrophobicContact CE1-CG 3.92Å; Y198-R245 PolarHBondContact OH-NH1 2.97Å; Y198-R245 PolarHBondContact OH-NH2 3.01Å; Y198-Q249 VanDerWaalsContact CE2-CD 3.43Å; Y198-Q249 HydrophobicContact CE2-CG 4.22Å; Y198-Q249 PolarHBondContact OH-NE2 3.48Å; Y198-Q249 PolarHBondContact OH-OE1 3.47Å; Y198-M250 HydrophobicContact CG-CG 4.18Å
199Y94.4Very high92.7Very high102 Ų10243.8 Ų43.840%0.424%0.238SC..Hα-helixtrans-63.8-37.8174.7-84.1-65.9000112.4L195 V196 L202 T203 M250 T254L195-Y199 HydrophobicContact CB-CD2 4.45Å; L195-Y199 HydrophobicContact CD2-CE2 4.16Å; L195-Y199 WeakPolarHBondContact O-CB 3.4Å; L195-Y199 WeakPolarHBondContact O-CD2 3.27Å; L195-Y199 PolarHBondContact O-N 3.39Å; V196-Y199 PolarHBondContact O-N 3.19Å; Y199-L202 PolarHBondContact O-N 3.05Å; Y199-T203 WeakPolarHBondContact O-CB 3.38Å; Y199-T203 PolarHBondContact O-N 3.44Å; Y199-T203 PolarHBondContact O-OG1 2.97Å; Y199-M250 HydrophobicContact CD1-CE 3.33Å; Y199-M250 HydrophobicContact CD2-CE 4.04Å; Y199-M250 HydrophobicContact CE1-CE 3.52Å; Y199-M250 HydrophobicContact CE2-CE 4.2Å; Y199-M250 HydrophobicContact CG-CE 3.6Å; Y199-T254 PolarHBondContact OH-OG1 3.26Å; Y199-T254 VanDerWaalsContact OH-OG1 3.05Å
200T95.1Very high92.5Very high58 Ų5843.7 Ų43.736%0.35623%0.234SC..Hα-helixtrans-63.6-45.5173.5-56.70000110.3L116 V196 Y198 L202 T203 V204L116-T200 HydrophobicContact CD1-CG2 3.61Å; V196-T200 VanDerWaalsContact O-CB 3.24Å; V196-T200 WeakPolarHBondContact O-CB 3.45Å; V196-T200 PolarHBondContact O-N 3.39Å; V196-T200 PolarHBondContact O-OG1 2.97Å; Y198-T200 VanDerWaalsContact C-N 3.32Å; Y198-T200 PolarHBondContact O-N 2.88Å; T200-L202 PolarHBondContact O-N 3.4Å; T200-T203 PolarHBondContact O-N 2.83Å; T200-V204 HydrophobicContact CG2-CG2 4.32Å; T200-V204 WeakPolarHBondContact O-CB 3.46Å; T200-V204 VanDerWaalsContact O-CG2 3.23Å; T200-V204 WeakPolarHBondContact O-CG2 3.39Å; T200-V204 PolarHBondContact O-N 3.28Å
201S94.4Very high92.1Very high2 Ų245.2 Ų45.21%0.01425%0.246CC..Hα-helixtrans-59.8-44176.7-58.70000112.3L116 A197 Y198 V204 C205L116-S201 VanDerWaalsContact CA-OG 3.26Å; L116-S201 WeakPolarHBondContact CA-OG 3.35Å; L116-S201 PolarHBondContact N-OG 2.84Å; A197-S201 WeakPolarHBondContact O-CB 3.49Å; A197-S201 PolarHBondContact O-N 3.45Å; A197-S201 PolarHBondContact O-OG 2.92Å; Y198-S201 WeakPolarHBondContact O-CB 3.45Å; Y198-S201 PolarHBondContact O-N 3.13Å; S201-V204 PolarHBondContact O-N 3.32Å; S201-C205 WeakPolarHBondContact O-CB 3.1Å; S201-C205 PolarHBondContact O-N 2.99Å
202L93.2Very high91.4Very high44 Ų4446.9 Ų46.923%0.2325%0.249CC..Hα-helixtrans-61.5-47.5175.5177.161.7000111.1Y198 Y199 T200 V204 C205 L206 I242 M250Y198-L202 WeakPolarHBondContact O-CB 3.24Å; Y198-L202 PolarHBondContact O-N 3.39Å; Y199-L202 PolarHBondContact O-N 3.05Å; T200-L202 PolarHBondContact O-N 3.4Å; L202-V204 PolarHBondContact O-N 3.35Å; L202-C205 PolarHBondContact O-N 3.08Å; L202-L206 HydrophobicContact CD1-CD1 4.46Å; L202-L206 HydrophobicContact CD1-CG 4.37Å; L202-L206 HydrophobicContact CG-CD1 4.3Å; L202-L206 WeakPolarHBondContact O-CG 3.3Å; L202-L206 PolarHBondContact O-N 3.24Å; L202-I242 HydrophobicContact CB-CG2 4.31Å; L202-I242 HydrophobicContact CD1-CG2 3.58Å; L202-M250 HydrophobicContact CB-CE 4.27Å; L202-M250 HydrophobicContact CB-SD 4.45Å; L202-M250 HydrophobicContact CD2-CE 3.91Å; L202-M250 HydrophobicContact CD2-SD 4.41Å
203T93.7Very high90.9Very high81 Ų8150.2 Ų50.250%0.49726%0.26SS..Hα-helixtrans-61.5-46.2179.1-570000111.1Y199 T200 C205 L206 V207Y199-T203 WeakPolarHBondContact O-CB 3.38Å; Y199-T203 PolarHBondContact O-N 3.44Å; Y199-T203 PolarHBondContact O-OG1 2.97Å; T200-T203 PolarHBondContact O-N 2.83Å; T203-C205 VanDerWaalsContact C-N 3.3Å; T203-C205 PolarHBondContact O-N 2.96Å; T203-L206 PolarHBondContact O-N 3.28Å; T203-V207 VanDerWaalsContact O-CG2 3.31Å; T203-V207 WeakPolarHBondContact O-CG2 3.36Å; T203-V207 PolarHBondContact O-N 3.46Å
204V92.4Very high90.2Very high26 Ų2652.1 Ų52.116%0.15827%0.268CS..Hα-helixtrans-58.3-42.7175.6168.80000110.9T119 L123 T200 S201 L202 V207 A208T119-V204 WeakPolarHBondContact O-CG1 3.27Å; L123-V204 HydrophobicContact CB-CG1 3.83Å; L123-V204 HydrophobicContact CD2-CG1 3.91Å; L123-V204 HydrophobicContact CG-CG1 4.47Å; T200-V204 HydrophobicContact CG2-CG2 4.32Å; T200-V204 WeakPolarHBondContact O-CB 3.46Å; T200-V204 VanDerWaalsContact O-CG2 3.23Å; T200-V204 WeakPolarHBondContact O-CG2 3.39Å; T200-V204 PolarHBondContact O-N 3.28Å; S201-V204 PolarHBondContact O-N 3.32Å; L202-V204 PolarHBondContact O-N 3.35Å; V204-V207 PolarHBondContact O-N 2.82Å; V204-A208 WeakPolarHBondContact O-CB 3.26Å; V204-A208 PolarHBondContact O-N 3.47Å
205C90.8Very high89.3Confident5 Ų555.7 Ų55.73%0.03429%0.286CS..Hα-helixtrans-66-42.5175.9178.50000112.8T119 S201 L202 T203 V207 A208 L209 I242T119-C205 HydrophobicContact CG2-CB 4.33Å; S201-C205 WeakPolarHBondContact O-CB 3.1Å; S201-C205 PolarHBondContact O-N 2.99Å; L202-C205 PolarHBondContact O-N 3.08Å; T203-C205 VanDerWaalsContact C-N 3.3Å; T203-C205 PolarHBondContact O-N 2.96Å; C205-V207 VanDerWaalsContact C-N 3.35Å; C205-V207 PolarHBondContact O-N 3Å; C205-A208 WeakPolarHBondContact O-CB 3.44Å; C205-A208 PolarHBondContact O-N 3.46Å; C205-L209 WeakPolarHBondContact O-CG 3.35Å; C205-L209 PolarHBondContact O-N 3.43Å; C205-I242 HydrophobicContact CB-CD1 3.25Å; C205-I242 WeakPolarHBondContact SG-CD1 3.5Å
206L91.6Very high88.1Confident91 Ų9160.8 Ų60.848%0.47631%0.307SS..Hα-helixtrans-61.2-44.7175.9-70.9175.5000111.1L202 T203 A208 L209 L210L202-L206 HydrophobicContact CD1-CD1 4.46Å; L202-L206 HydrophobicContact CD1-CG 4.37Å; L202-L206 HydrophobicContact CG-CD1 4.3Å; L202-L206 WeakPolarHBondContact O-CG 3.3Å; L202-L206 PolarHBondContact O-N 3.24Å; T203-L206 PolarHBondContact O-N 3.28Å; L206-A208 VanDerWaalsContact C-N 3.35Å; L206-A208 PolarHBondContact O-N 2.91Å; L206-L209 PolarHBondContact O-N 2.84Å; L206-L210 WeakPolarHBondContact O-CB 3.41Å; L206-L210 VanDerWaalsContact O-CG 3.3Å; L206-L210 WeakPolarHBondContact O-CG 3.27Å; L206-L210 PolarHBondContact O-N 2.84Å
207V91.3Very high86.8Confident58 Ų5865.2 Ų65.235%0.35232%0.319SS..Hα-helixtrans-60-44.9174.2174.60000110.6L123 T203 V204 C205 L209 L210 C211L123-V207 HydrophobicContact CD1-CG1 3.93Å; T203-V207 VanDerWaalsContact O-CG2 3.31Å; T203-V207 WeakPolarHBondContact O-CG2 3.36Å; T203-V207 PolarHBondContact O-N 3.46Å; V204-V207 PolarHBondContact O-N 2.82Å; C205-V207 VanDerWaalsContact C-N 3.35Å; C205-V207 PolarHBondContact O-N 3Å; V207-L209 VanDerWaalsContact C-N 3.35Å; V207-L209 PolarHBondContact O-N 3.49Å; V207-L210 PolarHBondContact O-N 3.44Å; V207-C211 WeakPolarHBondContact O-CB 3.48Å; V207-C211 PolarHBondContact O-N 2.66Å; V207-C211 PolarHBondContact O-SG 3.47Å
208A87.3Confident85.4Confident0 Ų072.8 Ų72.80%035%0.351CS..Hα-helixtrans-59.8-43.4176.100000112L123 M126 V204 C205 L206 L210 R212L123-A208 HydrophobicContact CD1-CB 4.08Å; M126-A208 HydrophobicContact CE-CB 3.95Å; M126-A208 HydrophobicContact SD-CB 3.91Å; V204-A208 WeakPolarHBondContact O-CB 3.26Å; V204-A208 PolarHBondContact O-N 3.47Å; C205-A208 WeakPolarHBondContact O-CB 3.44Å; C205-A208 PolarHBondContact O-N 3.46Å; L206-A208 VanDerWaalsContact C-N 3.35Å; L206-A208 PolarHBondContact O-N 2.91Å; A208-L210 PolarHBondContact O-N 3.48Å; A208-R212 WeakPolarHBondContact O-CB 3.46Å; A208-R212 PolarHBondContact O-N 3.25Å
209L87Confident83.5Confident50 Ų5075 Ų7526%0.26236%0.363SS..Hα-helixtrans-64-39.4175.7-70.3173.2000112.2C205 L206 V207 R212 K213 V235C205-L209 WeakPolarHBondContact O-CG 3.35Å; C205-L209 PolarHBondContact O-N 3.43Å; L206-L209 PolarHBondContact O-N 2.84Å; V207-L209 VanDerWaalsContact C-N 3.35Å; V207-L209 PolarHBondContact O-N 3.49Å; L209-R212 PolarHBondContact O-N 3.25Å; L209-K213 WeakPolarHBondContact O-CG 3.47Å; L209-K213 PolarHBondContact O-N 3.36Å; L209-V235 HydrophobicContact CD2-CG1 3.67Å; L209-V235 HydrophobicContact CG-CG1 4.5Å
210L87.8Confident81.3Confident87 Ų8777.3 Ų77.346%0.45539%0.388SS..Hα-helixtrans-66.4-51.7175.5-72.3173.8000111.5L206 V207 A208 R212 K213 F214L206-L210 WeakPolarHBondContact O-CB 3.41Å; L206-L210 VanDerWaalsContact O-CG 3.3Å; L206-L210 WeakPolarHBondContact O-CG 3.27Å; L206-L210 PolarHBondContact O-N 2.84Å; V207-L210 PolarHBondContact O-N 3.44Å; A208-L210 PolarHBondContact O-N 3.48Å; L210-R212 PolarHBondContact O-N 2.99Å; L210-K213 WeakPolarHBondContact O-CA 3.48Å; L210-K213 WeakPolarHBondContact O-CB 3.48Å; L210-K213 PolarHBondContact O-N 3.29Å; L210-F214 HydrophobicContact CB-CD2 4.38Å; L210-F214 HydrophobicContact CB-CE2 4.18Å; L210-F214 WeakPolarHBondContact O-CD2 3.48Å; L210-F214 PolarHBondContact O-N 2.95Å
211C84.1Confident79.4Confident39 Ų3977 Ų7726%0.26439%0.391SS..Hα-helixtrans-50.4-44.1174.5-72.70000110.7M126 V207 F214 M215M126-C211 HydrophobicContact SD-CB 4.3Å; V207-C211 WeakPolarHBondContact O-CB 3.48Å; V207-C211 PolarHBondContact O-N 2.66Å; V207-C211 PolarHBondContact O-SG 3.47Å; C211-F214 PolarHBondContact O-N 2.91Å; C211-M215 WeakPolarHBondContact O-CB 3.46Å; C211-M215 WeakPolarHBondContact O-CG 3.34Å; C211-M215 PolarHBondContact O-N 3.44Å
212R77.9Confident77.4Confident54 Ų5481 Ų8120%0.20443%0.425CS..Hα-helixtrans-63-45175.6-177.3-178.5172.2-149.7-4.5113M126 A208 L209 L210 F214 M215 K216 K232M126-R212 HydrophobicContact CE-CB 4.34Å; M126-R212 HydrophobicContact SD-CB 4.32Å; A208-R212 WeakPolarHBondContact O-CB 3.46Å; A208-R212 PolarHBondContact O-N 3.25Å; L209-R212 PolarHBondContact O-N 3.25Å; L210-R212 PolarHBondContact O-N 2.99Å; R212-F214 VanDerWaalsContact C-N 3.34Å; R212-M215 PolarHBondContact O-N 3.49Å; R212-K216 WeakPolarHBondContact O-CG 3.38Å; R212-K216 PolarHBondContact O-N 2.98Å; R212-K232 VanDerWaalsContact NH2-CG 3.27Å
213K81.5Confident75.6Confident146 Ų14682.2 Ų82.264%0.63545%0.447SS*.Hα-helixtrans-60.6-43.6176.3-77.1-177179.5-179.40111.2L209 L210 K217L209-K213 WeakPolarHBondContact O-CG 3.47Å; L209-K213 PolarHBondContact O-N 3.36Å; L210-K213 WeakPolarHBondContact O-CA 3.48Å; L210-K213 WeakPolarHBondContact O-CB 3.48Å; L210-K213 PolarHBondContact O-N 3.29Å; K213-K217 PolarHBondContact O-N 3.19Å
214F80.8Confident73.7Confident125 Ų12584.9 Ų84.955%0.54845%0.448SS..Hα-helixtrans-67-41.4177.8-71.1-64.4000112.7L210 C211 R212 K216 K217 K218L210-F214 HydrophobicContact CB-CD2 4.38Å; L210-F214 HydrophobicContact CB-CE2 4.18Å; L210-F214 WeakPolarHBondContact O-CD2 3.48Å; L210-F214 PolarHBondContact O-N 2.95Å; C211-F214 PolarHBondContact O-N 2.91Å; R212-F214 VanDerWaalsContact C-N 3.34Å; F214-K216 VanDerWaalsContact C-N 3.35Å; F214-K216 PolarHBondContact O-N 3.33Å; F214-K217 PolarHBondContact O-N 3.28Å; F214-K218 PolarHBondContact O-N 3.47Å
215M74.3Confident71.7Confident78 Ų7888.7 Ų88.738%0.38447%0.467SS..Hα-helixtrans-68.9-31.2179.3-70.6-69.8-97.200113.1C211 R212 K217 K218 N219 M228C211-M215 WeakPolarHBondContact O-CB 3.46Å; C211-M215 WeakPolarHBondContact O-CG 3.34Å; C211-M215 PolarHBondContact O-N 3.44Å; R212-M215 PolarHBondContact O-N 3.49Å; M215-K217 VanDerWaalsContact C-N 3.35Å; M215-K218 PolarHBondContact O-N 3.38Å; M215-N219 PolarHBondContact O-N 2.97Å; M215-M228 HydrophobicContact CB-CE 4.26Å
216K69.2Low69.8Low127 Ų12790.5 Ų90.555%0.55249%0.487SS*.Hα-helixtrans-62.7-39172-82.3-176.3177.1-1740112.7R212 F214 K218R212-K216 WeakPolarHBondContact O-CG 3.38Å; R212-K216 PolarHBondContact O-N 2.98Å; F214-K216 VanDerWaalsContact C-N 3.35Å; F214-K216 PolarHBondContact O-N 3.33Å; K216-K218 VanDerWaalsContact C-N 3.27Å; K216-K218 PolarHBondContact O-N 3.18Å
217K66.3Low68.2Low186 Ų18690.5 Ų90.581%0.80948%0.484SS*.Hα-helixtrans-69.2-25178.8-71.2-174.4175.6-172.90112.8K213 F214 M215K213-K217 PolarHBondContact O-N 3.19Å; F214-K217 PolarHBondContact O-N 3.28Å; M215-K217 VanDerWaalsContact C-N 3.35Å
218K66.6Low66.4Low165 Ų16589.9 Ų89.972%0.71748%0.478SS*.Hα-helixtrans-97.8-14.6-169.2-73.6-173.2175.8-174.60116.3F214 M215 K216F214-K218 PolarHBondContact O-N 3.47Å; M215-K218 PolarHBondContact O-N 3.38Å; K216-K218 VanDerWaalsContact C-N 3.27Å; K216-K218 PolarHBondContact O-N 3.18Å
219N52.9Low64.9Low51 Ų5194.7 Ų94.727%0.27350%0.503SS..  trans-110.5114.4-164.6-92.4-47.9000115.8M215 R224 M228M215-N219 PolarHBondContact O-N 2.97Å; N219-R224 PolarHBondContact OD1-NH1 3.13Å; N219-M228 HydrophobicContact CB-CE 4.14Å; N219-M228 VanDerWaalsContact ND2-CE 3.27Å; N219-M228 WeakPolarHBondContact ND2-CE 3.21Å
220T49.6Very low63.6Low151 Ų15199.4 Ų99.493%0.92652%0.521SS*.  trans-94.512.8168.1-22.30000113.1
221A55.2Low62.4Low50 Ų5097.8 Ų97.841%0.41351%0.511SS..  trans-110.6111.1-172.900000113G223 R224A221-G223 PolarHBondContact O-N 2.75Å; A221-R224 PolarHBondContact O-N 3.37Å
222A52.8Low61.2Low88 Ų88101.7 Ų101.773%0.72752%0.524SS*.Hα-helixtrans-55.2-31.7-179.300000114.2R224 L225A222-R224 PolarHBondContact O-N 3.02Å; A222-L225 VanDerWaalsContact O-CB 3.24Å; A222-L225 WeakPolarHBondContact O-CB 3.49Å; A222-L225 PolarHBondContact O-N 2.96Å
223G54.4Low60.7Low69 Ų69104.1 Ų104.171%0.71154%0.536SS*.Hα-helixtrans-66.8-31.9179.100000114.5A221A221-G223 PolarHBondContact O-N 2.75Å
224R54.6Low60.1Low137 Ų13798.8 Ų98.852%0.51752%0.516SS..Hα-helixtrans-78.6-22.1174.4-75.1179.9174.8167.3-2.8112.2N219 A221 A222 G226 Q227 M228N219-R224 PolarHBondContact OD1-NH1 3.13Å; A221-R224 PolarHBondContact O-N 3.37Å; A222-R224 PolarHBondContact O-N 3.02Å; R224-G226 PolarHBondContact O-N 3.37Å; R224-Q227 PolarHBondContact O-N 3.05Å; R224-M228 HydrophobicContact CB-CE 4.43Å; R224-M228 WeakPolarHBondContact O-CG 3.06Å; R224-M228 PolarHBondContact O-N 3.47Å
225L50Low59.8Low105 Ų10593 Ų9355%0.5549%0.49SS..Hα-helixtrans-63.3-41.8-177.5-16473.3000111.9A222 Q227 M228 I229A222-L225 VanDerWaalsContact O-CB 3.24Å; A222-L225 WeakPolarHBondContact O-CB 3.49Å; A222-L225 PolarHBondContact O-N 2.96Å; L225-Q227 PolarHBondContact O-N 3.44Å; L225-M228 PolarHBondContact O-N 3.13Å; L225-I229 HydrophobicContact CG-CD1 4.22Å; L225-I229 VanDerWaalsContact O-CG1 3.3Å; L225-I229 WeakPolarHBondContact O-CG1 3.09Å; L225-I229 PolarHBondContact O-N 3.38Å
226G50.8Low60Low43 Ų4393.6 Ų93.644%0.44349%0.492SS..Hα-helixtrans-62.2-41.1177.800000113.2R224 I229 K230R224-G226 PolarHBondContact O-N 3.37Å; G226-I229 PolarHBondContact O-N 3.33Å; G226-K230 PolarHBondContact O-N 3.47Å
227Q57.9Low60.6Low91 Ų9188.5 Ų88.543%0.42547%0.469SS..Hα-helixtrans-65.7-43171.9-77.1-175.3-29.600111.3R224 L225 I229 K230 Q231R224-Q227 PolarHBondContact O-N 3.05Å; L225-Q227 PolarHBondContact O-N 3.44Å; Q227-I229 VanDerWaalsContact C-N 3.31Å; Q227-I229 PolarHBondContact O-N 3.17Å; Q227-K230 PolarHBondContact O-N 3.12Å; Q227-Q231 WeakPolarHBondContact O-CB 3.26Å; Q227-Q231 WeakPolarHBondContact O-CG 3.5Å; Q227-Q231 PolarHBondContact O-N 3.2Å
228M53.6Low61.5Low45 Ų4579.6 Ų79.622%0.22243%0.431CS..Hα-helixtrans-62.9-32.7176.9-70.7-157.6-15500113.5M215 N219 R224 L225 Q231 K232M215-M228 HydrophobicContact CB-CE 4.26Å; N219-M228 HydrophobicContact CB-CE 4.14Å; N219-M228 VanDerWaalsContact ND2-CE 3.27Å; N219-M228 WeakPolarHBondContact ND2-CE 3.21Å; R224-M228 HydrophobicContact CB-CE 4.43Å; R224-M228 WeakPolarHBondContact O-CG 3.06Å; R224-M228 PolarHBondContact O-N 3.47Å; L225-M228 PolarHBondContact O-N 3.13Å; M228-Q231 PolarHBondContact O-N 3.18Å; M228-K232 WeakPolarHBondContact O-CB 3.44Å; M228-K232 PolarHBondContact O-N 3.39Å
229I55.7Low62.3Low102 Ų10273.3 Ų73.352%0.52341%0.407SS..Hα-helixtrans-69.7-46.6178.6-69.7165000111.1L225 G226 Q227 Q231 K232L225-I229 HydrophobicContact CG-CD1 4.22Å; L225-I229 VanDerWaalsContact O-CG1 3.3Å; L225-I229 WeakPolarHBondContact O-CG1 3.09Å; L225-I229 PolarHBondContact O-N 3.38Å; G226-I229 PolarHBondContact O-N 3.33Å; Q227-I229 VanDerWaalsContact C-N 3.31Å; Q227-I229 PolarHBondContact O-N 3.17Å; I229-Q231 VanDerWaalsContact C-N 3.29Å; I229-Q231 PolarHBondContact O-N 3.06Å; I229-K232 PolarHBondContact O-N 3.32Å
230K58.9Low63.8Low148 Ų14872 Ų7264%0.64340%0.401SS*.Hα-helixtrans-61.6-40.7173.8-75.4-175.2177.6178.90110.7G226 Q227 K232G226-K230 PolarHBondContact O-N 3.47Å; Q227-K230 PolarHBondContact O-N 3.12Å; K230-K232 PolarHBondContact O-N 3.03Å
231Q62.4Low65.6Low54 Ų5464.8 Ų64.825%0.25236%0.357SS..Hα-helixtrans-68.1-30.1178.3-71.5171.4-17.200113.8S125 Q227 M228 I229 K233 V234 V235S125-Q231 PolarHBondContact O-NE2 3.37Å; Q227-Q231 WeakPolarHBondContact O-CB 3.26Å; Q227-Q231 WeakPolarHBondContact O-CG 3.5Å; Q227-Q231 PolarHBondContact O-N 3.2Å; M228-Q231 PolarHBondContact O-N 3.18Å; I229-Q231 VanDerWaalsContact C-N 3.29Å; I229-Q231 PolarHBondContact O-N 3.06Å; Q231-K233 VanDerWaalsContact C-N 3.27Å; Q231-K233 PolarHBondContact O-N 2.84Å; Q231-V234 PolarHBondContact O-N 3.32Å; Q231-V235 WeakPolarHBondContact O-CG2 3.28Å; Q231-V235 PolarHBondContact O-N 3.19Å
232K59.7Low67.1Low121 Ų12162.7 Ų62.753%0.52634%0.339SS..Hα-helixtrans-58-37.7179.8168.2165.4-174.9-165.80112.6R212 M228 I229 K230R212-K232 VanDerWaalsContact NH2-CG 3.27Å; M228-K232 WeakPolarHBondContact O-CB 3.44Å; M228-K232 PolarHBondContact O-N 3.39Å; I229-K232 PolarHBondContact O-N 3.32Å; K230-K232 PolarHBondContact O-N 3.03Å
233K66.5Low68.7Low105 Ų10564.3 Ų64.346%0.45733%0.329SS..Hα-helixtrans-74.1-42.3-178.9-68-176.9178.3175.50111.6Q231 H236 R237Q231-K233 VanDerWaalsContact C-N 3.27Å; Q231-K233 PolarHBondContact O-N 2.84Å; K233-H236 PolarHBondContact O-N 2.71Å; K233-R237 WeakPolarHBondContact O-CG 3.38Å; K233-R237 PolarHBondContact O-N 3.06Å
234V70.5Confident70.3Confident34 Ų3462.9 Ų62.921%0.20630%0.304CS..Hα-helixtrans-61.2-51.6-178175.30000111.5E53 Q122 Q231 H236 R237 V238E53-V234 HydrophobicContact CG-CG1 4.37Å; Q122-V234 HydrophobicContact CG-CG1 4.17Å; Q122-V234 VanDerWaalsContact NE2-C 3.3Å; Q122-V234 VanDerWaalsContact NE2-CG1 3.3Å; Q122-V234 PolarHBondContact NE2-O 2.94Å; Q231-V234 PolarHBondContact O-N 3.32Å; V234-H236 VanDerWaalsContact C-N 3.31Å; V234-H236 PolarHBondContact O-N 3.44Å; V234-R237 PolarHBondContact O-N 3.16Å; V234-V238 PolarHBondContact O-N 3.38Å
235V74.6Confident71.9Confident2 Ų256.6 Ų56.61%0.01228%0.28CS..Hα-helixtrans-63-39-178.2179.90000111.9M126 L209 Q231 R237 V238 S239M126-V235 HydrophobicContact CE-CB 4.3Å; M126-V235 HydrophobicContact CE-CG1 4.15Å; M126-V235 HydrophobicContact CE-CG2 3.21Å; L209-V235 HydrophobicContact CD2-CG1 3.67Å; L209-V235 HydrophobicContact CG-CG1 4.5Å; Q231-V235 WeakPolarHBondContact O-CG2 3.28Å; Q231-V235 PolarHBondContact O-N 3.19Å; V235-R237 PolarHBondContact O-N 3.28Å; V235-V238 PolarHBondContact O-N 3.03Å; V235-S239 WeakPolarHBondContact O-CB 3.45Å; V235-S239 PolarHBondContact O-N 2.95Å; V235-S239 PolarHBondContact O-OG 3.32Å
236H78.2Confident73.7Confident92 Ų9252.5 Ų52.543%0.42626%0.26SS..Hα-helixtrans-62.2-43.3178.1-176.4-72.3000111.7K233 V234 V238 S239 V240K233-H236 PolarHBondContact O-N 2.71Å; V234-H236 VanDerWaalsContact C-N 3.31Å; V234-H236 PolarHBondContact O-N 3.44Å; H236-V238 VanDerWaalsContact C-N 3.34Å; H236-V238 PolarHBondContact O-N 3.44Å; H236-S239 WeakPolarHBondContact CA-OG 3.3Å; H236-S239 PolarHBondContact O-N 3.12Å; H236-S239 PolarHBondContact O-OG 2.94Å; H236-V240 WeakPolarHBondContact O-CG2 3.23Å; H236-V240 PolarHBondContact O-N 2.99Å
237R81.7Confident75.5Confident19 Ų1953.8 Ų53.87%0.07226%0.256CS..Hα-helixtrans-59.5-46.1178.9-72.9-175.5-68.5-157-7.2112E53 K233 V234 V235 V240 I241 Y283 F286 D287E53-R237 IonicContact OE1-CZ 2.69Å; E53-R237 IonicContact OE1-NE 3.7Å; E53-R237 PolarHBondContact OE1-NE 3.47Å; E53-R237 IonicContact OE1-NH2 2.81Å; E53-R237 PolarHBondContact OE1-NH2 3.45Å; E53-R237 IonicContact OE2-CZ 3.7Å; E53-R237 IonicContact OE2-NH2 2.78Å; E53-R237 PolarHBondContact OE2-NH2 2.94Å; K233-R237 WeakPolarHBondContact O-CG 3.38Å; K233-R237 PolarHBondContact O-N 3.06Å; V234-R237 PolarHBondContact O-N 3.16Å; V235-R237 PolarHBondContact O-N 3.28Å; R237-V240 WeakPolarHBondContact O-CB 3.36Å; R237-V240 PolarHBondContact O-N 3.42Å; R237-I241 PolarHBondContact O-N 3.42Å; R237-Y283 HydrophobicContact CB-CD2 3.92Å; R237-Y283 HydrophobicContact CB-CE2 3.86Å; R237-F286 HydrophobicContact CG-CB 3.62Å; R237-D287 IonicContact CZ-OD2 3.63Å; R237-D287 VanDerWaalsContact NH1-CG 3.28Å; R237-D287 IonicContact NH1-OD1 3.93Å; R237-D287 IonicContact NH1-OD2 3.93Å; R237-D287 PolarHBondContact NH1-OD2 3.49Å
238V84.4Confident76.9Confident0 Ų052 Ų520%025%0.247CC..Hα-helixtrans-72.5-35.3-178.9166.50000112.7L118 T119 V234 V235 H236 V240 I241 I242L118-V238 HydrophobicContact CD1-CG2 4.35Å; L118-V238 HydrophobicContact CD2-CB 3.8Å; L118-V238 HydrophobicContact CD2-CG1 3.24Å; L118-V238 HydrophobicContact CD2-CG2 3.28Å; L118-V238 HydrophobicContact CG-CG2 3.93Å; T119-V238 HydrophobicContact CG2-CG1 3.91Å; V234-V238 PolarHBondContact O-N 3.38Å; V235-V238 PolarHBondContact O-N 3.03Å; H236-V238 VanDerWaalsContact C-N 3.34Å; H236-V238 PolarHBondContact O-N 3.44Å; V238-V240 PolarHBondContact O-N 2.67Å; V238-I241 WeakPolarHBondContact O-CB 3.32Å; V238-I241 PolarHBondContact O-N 2.83Å; V238-I241 VanDerWaalsContact O-N 3.15Å; V238-I242 HydrophobicContact CG1-CD1 3.73Å; V238-I242 HydrophobicContact CG1-CG1 4.36Å; V238-I242 WeakPolarHBondContact O-CG1 3.46Å; V238-I242 PolarHBondContact O-N 3.28Å
239S83.4Confident78.6Confident32 Ų3250.1 Ų50.122%0.22424%0.238CC..Hα-helixtrans-61.3-32.2173.260.20000112.5V235 H236 F243V235-S239 WeakPolarHBondContact O-CB 3.45Å; V235-S239 PolarHBondContact O-N 2.95Å; V235-S239 PolarHBondContact O-OG 3.32Å; H236-S239 WeakPolarHBondContact CA-OG 3.3Å; H236-S239 PolarHBondContact O-N 3.12Å; H236-S239 PolarHBondContact O-OG 2.94Å; S239-F243 VanDerWaalsContact O-CB 3.32Å; S239-F243 WeakPolarHBondContact O-CB 3.42Å; S239-F243 PolarHBondContact O-N 2.95Å
240V84.7Confident80.1Confident23 Ų2345.6 Ų45.614%0.13921%0.214CC..Hα-helixtrans-67.7-48.1173.51740000110.2H236 R237 V238 I242 F243 F244 L282 F286H236-V240 WeakPolarHBondContact O-CG2 3.23Å; H236-V240 PolarHBondContact O-N 2.99Å; R237-V240 WeakPolarHBondContact O-CB 3.36Å; R237-V240 PolarHBondContact O-N 3.42Å; V238-V240 PolarHBondContact O-N 2.67Å; V240-I242 VanDerWaalsContact C-N 3.3Å; V240-I242 PolarHBondContact O-N 3.32Å; V240-F243 WeakPolarHBondContact O-CB 3.34Å; V240-F243 PolarHBondContact O-N 3.43Å; V240-F243 VanDerWaalsContact O-N 3.16Å; V240-F244 HydrophobicContact CG1-CD2 3.91Å; V240-F244 HydrophobicContact CG1-CE2 3.98Å; V240-F244 WeakPolarHBondContact O-CD2 3.38Å; V240-F244 PolarHBondContact O-N 2.86Å; V240-F244 VanDerWaalsContact O-N 3.09Å; V240-L282 HydrophobicContact CG1-CB 4Å; V240-L282 HydrophobicContact CG1-CD1 3.98Å; V240-F286 HydrophobicContact CB-CE2 4.36Å; V240-F286 HydrophobicContact CG1-CE2 4.06Å; V240-F286 HydrophobicContact CG2-CD2 4.31Å; V240-F286 HydrophobicContact CG2-CE2 3.84Å
241I86.6Confident81.5Confident1 Ų142.9 Ų42.91%0.00521%0.206CC..Hα-helixtrans-53.2-50.2176.7-64.9174.9000110.5L60 M115 L118 R237 V238 F243 F244 R245 E279 Y283L60-I241 HydrophobicContact CD2-CD1 4.28Å; L60-I241 HydrophobicContact CD2-CG2 4.28Å; M115-I241 HydrophobicContact CE-CB 4.18Å; M115-I241 HydrophobicContact CE-CG2 3.23Å; M115-I241 HydrophobicContact SD-CG2 3.73Å; L118-I241 HydrophobicContact CD1-CD1 4.5Å; R237-I241 PolarHBondContact O-N 3.42Å; V238-I241 WeakPolarHBondContact O-CB 3.32Å; V238-I241 PolarHBondContact O-N 2.83Å; V238-I241 VanDerWaalsContact O-N 3.15Å; I241-F243 VanDerWaalsContact C-N 3.32Å; I241-F243 PolarHBondContact O-N 2.79Å; I241-F244 PolarHBondContact O-N 3.31Å; I241-R245 WeakPolarHBondContact O-CB 3.36Å; I241-R245 PolarHBondContact O-N 3.48Å; I241-E279 HydrophobicContact CB-CG 3.99Å; I241-E279 HydrophobicContact CG1-CG 3.99Å; I241-E279 HydrophobicContact CG2-CG 3.45Å; I241-E279 VanDerWaalsContact CG2-CG 3.45Å; I241-E279 WeakPolarHBondContact CG2-OE1 3.29Å; I241-Y283 HydrophobicContact CD1-CD2 3.22Å; I241-Y283 HydrophobicContact CD1-CE2 3.85Å; I241-Y283 HydrophobicContact CD1-CG 3.94Å; I241-Y283 HydrophobicContact CG1-CD2 3.94Å; I241-Y283 HydrophobicContact CG1-CG 4.49Å
242I87.5Confident82.7Confident6 Ų641.1 Ų41.13%0.03120%0.199CC..Hα-helixtrans-65-36.7-178.3-65.9164.3000112.1M115 T119 L202 C205 V238 V240 R245 S246M115-I242 HydrophobicContact CE-CB 4.1Å; M115-I242 HydrophobicContact CE-CG1 3.4Å; M115-I242 HydrophobicContact SD-CG1 3.86Å; T119-I242 HydrophobicContact CG2-CD1 3.28Å; T119-I242 HydrophobicContact CG2-CG1 4.13Å; L202-I242 HydrophobicContact CB-CG2 4.31Å; L202-I242 HydrophobicContact CD1-CG2 3.58Å; C205-I242 HydrophobicContact CB-CD1 3.25Å; C205-I242 WeakPolarHBondContact SG-CD1 3.5Å; V238-I242 HydrophobicContact CG1-CD1 3.73Å; V238-I242 HydrophobicContact CG1-CG1 4.36Å; V238-I242 WeakPolarHBondContact O-CG1 3.46Å; V238-I242 PolarHBondContact O-N 3.28Å; V240-I242 VanDerWaalsContact C-N 3.3Å; V240-I242 PolarHBondContact O-N 3.32Å; I242-R245 PolarHBondContact O-N 3.33Å; I242-S246 VanDerWaalsContact O-CB 3.31Å; I242-S246 WeakPolarHBondContact O-CB 3.22Å; I242-S246 PolarHBondContact O-N 2.85Å; I242-S246 PolarHBondContact O-OG 3.41Å
243F87.5Confident83.9Confident121 Ų12136.3 Ų36.353%0.53118%0.179SC..Hα-helixtrans-61.1-48.9176.5174.8-99.6000111.4S239 V240 I241 S246 I247S239-F243 VanDerWaalsContact O-CB 3.32Å; S239-F243 WeakPolarHBondContact O-CB 3.42Å; S239-F243 PolarHBondContact O-N 2.95Å; V240-F243 WeakPolarHBondContact O-CB 3.34Å; V240-F243 PolarHBondContact O-N 3.43Å; V240-F243 VanDerWaalsContact O-N 3.16Å; I241-F243 VanDerWaalsContact C-N 3.32Å; I241-F243 PolarHBondContact O-N 2.79Å; F243-S246 WeakPolarHBondContact O-CB 2.88Å; F243-S246 PolarHBondContact O-N 3.43Å; F243-I247 HydrophobicContact CD1-CD1 4.03Å; F243-I247 HydrophobicContact CD2-CD1 4.24Å; F243-I247 HydrophobicContact CE1-CD1 3.43Å; F243-I247 VanDerWaalsContact CE1-CD1 3.43Å; F243-I247 HydrophobicContact CE2-CD1 3.67Å; F243-I247 HydrophobicContact CG-CD1 4.41Å; F243-I247 HydrophobicContact CZ-CD1 3.24Å; F243-I247 WeakPolarHBondContact O-CG1 3.47Å; F243-I247 PolarHBondContact O-N 3.45Å; F243-I247 VanDerWaalsContact O-N 3.1Å
244F87.5Confident84.9Confident39 Ų3932.9 Ų32.917%0.17117%0.167CC..Hα-helixtrans-64.4-43176.7-82.3-91.4000111.6V240 I241 S246 I247 F248 L278 E279 L282V240-F244 HydrophobicContact CG1-CD2 3.91Å; V240-F244 HydrophobicContact CG1-CE2 3.98Å; V240-F244 WeakPolarHBondContact O-CD2 3.38Å; V240-F244 PolarHBondContact O-N 2.86Å; V240-F244 VanDerWaalsContact O-N 3.09Å; I241-F244 PolarHBondContact O-N 3.31Å; F244-S246 VanDerWaalsContact C-N 3.27Å; F244-S246 PolarHBondContact O-N 2.88Å; F244-I247 PolarHBondContact O-N 3.36Å; F244-F248 AromaticContact CD1-CD2 3.95Å; F244-F248 HydrophobicContact CD1-CD2 3.95Å; F244-F248 AromaticContact CD1-CE2 3.65Å; F244-F248 HydrophobicContact CD1-CE2 3.65Å; F244-F248 HydrophobicContact CE1-CE2 4.07Å; F244-F248 WeakPolarHBondContact O-CB 3.13Å; F244-F248 WeakPolarHBondContact O-CD2 3.4Å; F244-F248 PolarHBondContact O-N 2.9Å; F244-L278 HydrophobicContact CD1-CB 3.96Å; F244-L278 HydrophobicContact CD1-CD1 4.38Å; F244-L278 HydrophobicContact CE1-CB 4.06Å; F244-L278 HydrophobicContact CE1-CD1 4.1Å; F244-E279 HydrophobicContact CB-CB 4.39Å; F244-L282 HydrophobicContact CD1-CD1 4.42Å; F244-L282 HydrophobicContact CD2-CD1 3.64Å; F244-L282 HydrophobicContact CE1-CD1 3.93Å; F244-L282 HydrophobicContact CE2-CD1 3.06Å; F244-L282 HydrophobicContact CG-CD1 4.31Å; F244-L282 HydrophobicContact CZ-CD1 3.23Å
245R88.3Confident85.7Confident6 Ų635.2 Ų35.22%0.02318%0.177CC..Hα-helixtrans-59.6-38.2174.6-154.471.8111.1112.824.3113S111 M115 Y198 I241 I242 Q249 M250 L276 E279S111-R245 VanDerWaalsContact CB-NH2 3.27Å; S111-R245 PolarHBondContact O-NH2 2.99Å; S111-R245 VanDerWaalsContact O-NH2 3.15Å; S111-R245 PolarHBondContact OG-NH2 3.43Å; M115-R245 HydrophobicContact CE-CB 3.84Å; M115-R245 HydrophobicContact CE-CG 4.2Å; Y198-R245 HydrophobicContact CD1-CG 4.03Å; Y198-R245 HydrophobicContact CE1-CG 3.92Å; Y198-R245 PolarHBondContact OH-NH1 2.97Å; Y198-R245 PolarHBondContact OH-NH2 3.01Å; I241-R245 WeakPolarHBondContact O-CB 3.36Å; I241-R245 PolarHBondContact O-N 3.48Å; I242-R245 PolarHBondContact O-N 3.33Å; R245-Q249 VanDerWaalsContact CD-OE1 3.23Å; R245-Q249 HydrophobicContact CG-CB 4.46Å; R245-Q249 WeakPolarHBondContact O-CA 3.22Å; R245-Q249 WeakPolarHBondContact O-CB 3.41Å; R245-Q249 PolarHBondContact O-N 3.3Å; R245-M250 PolarHBondContact O-N 3.38Å; R245-L276 VanDerWaalsContact NH1-CD2 3.26Å; R245-E279 VanDerWaalsContact CD-OE2 3.3Å; R245-E279 WeakPolarHBondContact CD-OE2 3.34Å; R245-E279 IonicContact NE-OE1 3.98Å; R245-E279 IonicContact NE-OE2 3.91Å; R245-E279 PolarHBondContact NE-OE2 2.85Å
246S87Confident86.1Confident19 Ų1936.9 Ų36.913%0.13319%0.186CC..Iπ-helixtrans-64-44.8177.5-58.40000110.9I242 F243 F244 M250 I251I242-S246 VanDerWaalsContact O-CB 3.31Å; I242-S246 WeakPolarHBondContact O-CB 3.22Å; I242-S246 PolarHBondContact O-N 2.85Å; I242-S246 PolarHBondContact O-OG 3.41Å; F243-S246 WeakPolarHBondContact O-CB 2.88Å; F243-S246 PolarHBondContact O-N 3.43Å; F244-S246 VanDerWaalsContact C-N 3.27Å; F244-S246 PolarHBondContact O-N 2.88Å; S246-M250 PolarHBondContact O-N 2.99Å; S246-I251 WeakPolarHBondContact O-CG1 3.28Å; S246-I251 PolarHBondContact O-N 3.37Å
247I89.1Confident86.2Confident70 Ų7036.3 Ų36.336%0.35919%0.193SC..Iπ-helixtrans-72.5-46.4-177.8-68.1174000112.2F243 F244 P252F243-I247 HydrophobicContact CD1-CD1 4.03Å; F243-I247 HydrophobicContact CD2-CD1 4.24Å; F243-I247 HydrophobicContact CE1-CD1 3.43Å; F243-I247 VanDerWaalsContact CE1-CD1 3.43Å; F243-I247 HydrophobicContact CE2-CD1 3.67Å; F243-I247 HydrophobicContact CG-CD1 4.41Å; F243-I247 HydrophobicContact CZ-CD1 3.24Å; F243-I247 WeakPolarHBondContact O-CG1 3.47Å; F243-I247 PolarHBondContact O-N 3.45Å; F243-I247 VanDerWaalsContact O-N 3.1Å; F244-I247 PolarHBondContact O-N 3.36Å; I247-P252 WeakPolarHBondContact O-CD 3.44Å
248F88Confident86.3Confident54 Ų5443.6 Ų43.624%0.23723%0.225CC..Iπ-helixtrans-93.5-12.6-170-74.4-81.3000114.5F244 A271 G275 L278F244-F248 AromaticContact CD1-CD2 3.95Å; F244-F248 HydrophobicContact CD1-CD2 3.95Å; F244-F248 AromaticContact CD1-CE2 3.65Å; F244-F248 HydrophobicContact CD1-CE2 3.65Å; F244-F248 HydrophobicContact CE1-CE2 4.07Å; F244-F248 WeakPolarHBondContact O-CB 3.13Å; F244-F248 WeakPolarHBondContact O-CD2 3.4Å; F244-F248 PolarHBondContact O-N 2.9Å; F248-A271 HydrophobicContact CD1-CB 4.3Å; F248-G275 VanDerWaalsContact CG-CA 3.48Å; F248-L278 HydrophobicContact CE2-CD1 4.23Å; F248-L278 HydrophobicContact CZ-CD1 4.11Å
249Q87.6Confident86.3Confident5 Ų545.4 Ų45.42%0.02324%0.236CC..Iπ-helixtrans-131-53179.5-168.9174.21500113Y198 R245 M253 H272Y198-Q249 VanDerWaalsContact CE2-CD 3.43Å; Y198-Q249 HydrophobicContact CE2-CG 4.22Å; Y198-Q249 PolarHBondContact OH-NE2 3.48Å; Y198-Q249 PolarHBondContact OH-OE1 3.47Å; R245-Q249 VanDerWaalsContact CD-OE1 3.23Å; R245-Q249 HydrophobicContact CG-CB 4.46Å; R245-Q249 WeakPolarHBondContact O-CA 3.22Å; R245-Q249 WeakPolarHBondContact O-CB 3.41Å; R245-Q249 PolarHBondContact O-N 3.3Å; Q249-M253 HydrophobicContact CG-CG 4.19Å; Q249-M253 VanDerWaalsContact O-CB 3.24Å; Q249-M253 WeakPolarHBondContact O-CB 3.47Å; Q249-M253 WeakPolarHBondContact O-CG 3.2Å; Q249-M253 PolarHBondContact O-N 3.49Å; Q249-H272 PolarHBondContact NE2-NE2 3.28Å; Q249-H272 PolarHBondContact OE1-NE2 2.9Å
250M88.1Confident86.1Confident6 Ų653 Ų533%0.0327%0.268CS..Iπ-helixtrans-64.7-49.8-174.7-60.8177.162.100112.4Y198 Y199 L202 R245 S246 M253 T254Y198-M250 HydrophobicContact CG-CG 4.18Å; Y199-M250 HydrophobicContact CD1-CE 3.33Å; Y199-M250 HydrophobicContact CD2-CE 4.04Å; Y199-M250 HydrophobicContact CE1-CE 3.52Å; Y199-M250 HydrophobicContact CE2-CE 4.2Å; Y199-M250 HydrophobicContact CG-CE 3.6Å; L202-M250 HydrophobicContact CB-CE 4.27Å; L202-M250 HydrophobicContact CB-SD 4.45Å; L202-M250 HydrophobicContact CD2-CE 3.91Å; L202-M250 HydrophobicContact CD2-SD 4.41Å; R245-M250 PolarHBondContact O-N 3.38Å; S246-M250 PolarHBondContact O-N 2.99Å; M250-M253 PolarHBondContact O-N 3.34Å; M250-T254 WeakPolarHBondContact O-CB 3.47Å; M250-T254 PolarHBondContact O-N 3.48Å; M250-T254 PolarHBondContact O-OG1 2.98Å
251I87.8Confident85.9Confident91 Ų9155.5 Ų55.547%0.46728%0.281SS..Hα-helixtrans-62.2-51179.6-69.7170.9000110.3S246 M253 T254 L255S246-I251 WeakPolarHBondContact O-CG1 3.28Å; S246-I251 PolarHBondContact O-N 3.37Å; I251-M253 PolarHBondContact O-N 2.84Å; I251-T254 PolarHBondContact O-N 3.13Å; I251-L255 HydrophobicContact CG2-CD1 3.71Å; I251-L255 HydrophobicContact CG2-CG 4.23Å; I251-L255 WeakPolarHBondContact O-CB 3.44Å; I251-L255 VanDerWaalsContact O-CG 3.29Å; I251-L255 WeakPolarHBondContact O-CG 3.18Å; I251-L255 PolarHBondContact O-N 3.34Å
252P87.6Confident85.4Confident17 Ų1762.9 Ų62.911%0.1132%0.315CS..Hα-helixtrans-54.3-52174.1-30.937.4000113.3I247 T254 L255 L256 M268I247-P252 WeakPolarHBondContact O-CD 3.44Å; P252-T254 VanDerWaalsContact C-N 3.26Å; P252-T254 PolarHBondContact O-N 2.99Å; P252-L255 CarbonylContact O-C 3.57Å; P252-L255 PolarHBondContact O-N 3.25Å; P252-L255 VanDerWaalsContact O-N 3.08Å; P252-L256 WeakPolarHBondContact O-CB 3.28Å; P252-L256 VanDerWaalsContact O-CG 3.25Å; P252-L256 WeakPolarHBondContact O-CG 3.29Å; P252-L256 PolarHBondContact O-N 3.39Å; P252-M268 HydrophobicContact CB-CB 4.04Å; P252-M268 HydrophobicContact CB-CG 3.99Å; P252-M268 HydrophobicContact CB-SD 3.98Å
253M85.7Confident84.9Confident20 Ų2065.7 Ų65.710%0.09934%0.336CS..Hα-helixtrans-59.4-37.3179.5-72.9-68-67.700112.8C191 L195 Q249 M250 I251 L256 S257C191-M253 HydrophobicContact CB-CE 3.85Å; L195-M253 HydrophobicContact CD2-CB 3.68Å; L195-M253 HydrophobicContact CG-CB 4.35Å; Q249-M253 HydrophobicContact CG-CG 4.19Å; Q249-M253 VanDerWaalsContact O-CB 3.24Å; Q249-M253 WeakPolarHBondContact O-CB 3.47Å; Q249-M253 WeakPolarHBondContact O-CG 3.2Å; Q249-M253 PolarHBondContact O-N 3.49Å; M250-M253 PolarHBondContact O-N 3.34Å; I251-M253 PolarHBondContact O-N 2.84Å; M253-L256 HydrophobicContact SD-CD1 4.11Å; M253-S257 PolarHBondContact O-N 3.31Å; M253-S257 PolarHBondContact O-OG 3.42Å
254T88Confident84.4Confident33 Ų3363.7 Ų63.720%0.20233%0.33CS..Hα-helixtrans-69.6-41.9176.2-52.60000111Y199 M250 I251 P252 L256 S257 F258Y199-T254 PolarHBondContact OH-OG1 3.26Å; Y199-T254 VanDerWaalsContact OH-OG1 3.05Å; M250-T254 WeakPolarHBondContact O-CB 3.47Å; M250-T254 PolarHBondContact O-N 3.48Å; M250-T254 PolarHBondContact O-OG1 2.98Å; I251-T254 PolarHBondContact O-N 3.13Å; P252-T254 VanDerWaalsContact C-N 3.26Å; P252-T254 PolarHBondContact O-N 2.99Å; T254-L256 VanDerWaalsContact C-N 3.34Å; T254-S257 WeakPolarHBondContact O-CB 3Å; T254-S257 PolarHBondContact O-N 3.44Å; T254-F258 HydrophobicContact CG2-CE2 4.05Å; T254-F258 WeakPolarHBondContact O-CD2 3.38Å
255L86.4Confident84.1Confident83 Ų8364.3 Ų64.344%0.43533%0.334SS..Hα-helixtrans-66.3-36.6177-71173000112I251 P252 S257 F258 T259 M268I251-L255 HydrophobicContact CG2-CD1 3.71Å; I251-L255 HydrophobicContact CG2-CG 4.23Å; I251-L255 WeakPolarHBondContact O-CB 3.44Å; I251-L255 VanDerWaalsContact O-CG 3.29Å; I251-L255 WeakPolarHBondContact O-CG 3.18Å; I251-L255 PolarHBondContact O-N 3.34Å; P252-L255 CarbonylContact O-C 3.57Å; P252-L255 PolarHBondContact O-N 3.25Å; P252-L255 VanDerWaalsContact O-N 3.08Å; L255-S257 PolarHBondContact O-N 2.98Å; L255-F258 PolarHBondContact O-N 3.43Å; L255-T259 VanDerWaalsContact O-CG2 3.29Å; L255-T259 WeakPolarHBondContact O-CG2 2.75Å; L255-T259 PolarHBondContact O-N 3.34Å; L255-M268 HydrophobicContact CB-CE 3.94Å; L255-M268 HydrophobicContact CB-SD 4.38Å; L255-M268 HydrophobicContact CD1-CE 3.82Å
256L83.7Confident83.5Confident37 Ų3767.6 Ų67.619%0.19435%0.353CS..Hα-helixtrans-56.3-34.5174.5-73.9178.6000111.9P252 M253 T254 F258 T259 I265 M268 W269P252-L256 WeakPolarHBondContact O-CB 3.28Å; P252-L256 VanDerWaalsContact O-CG 3.25Å; P252-L256 WeakPolarHBondContact O-CG 3.29Å; P252-L256 PolarHBondContact O-N 3.39Å; M253-L256 HydrophobicContact SD-CD1 4.11Å; T254-L256 VanDerWaalsContact C-N 3.34Å; L256-F258 PolarHBondContact O-N 2.85Å; L256-T259 HydrophobicContact CD2-CG2 4.41Å; L256-I265 HydrophobicContact CD2-CB 3.8Å; L256-I265 HydrophobicContact CD2-CD1 4.37Å; L256-I265 HydrophobicContact CD2-CG1 3.52Å; L256-I265 HydrophobicContact CD2-CG2 3.7Å; L256-M268 HydrophobicContact CD2-SD 3.91Å; L256-M268 HydrophobicContact CG-SD 4.03Å; L256-W269 HydrophobicContact CD1-CZ2 4.45Å
257S80.1Confident83.3Confident80 Ų8071.7 Ų71.756%0.55937%0.373SS*.THydrogen-bonded Turntrans-69.5-12.9175.6-51.90000114.3M253 T254 L255M253-S257 PolarHBondContact O-N 3.31Å; M253-S257 PolarHBondContact O-OG 3.42Å; T254-S257 WeakPolarHBondContact O-CB 3Å; T254-S257 PolarHBondContact O-N 3.44Å; L255-S257 PolarHBondContact O-N 2.98Å
258F84.2Confident83.1Confident173 Ų17369.9 Ų69.976%0.75936%0.363SS*.THydrogen-bonded Turntrans-121-8.5-176.7-62.6-71.4000114.5T254 L255 L256T254-F258 HydrophobicContact CG2-CE2 4.05Å; T254-F258 WeakPolarHBondContact O-CD2 3.38Å; L255-F258 PolarHBondContact O-N 3.43Å; L256-F258 PolarHBondContact O-N 2.85Å
259T83.2Confident82.7Confident38 Ų3870 Ų7023%0.23336%0.362CS..  trans-107.9136.8-175.5-174.20000111.7L255 L256 N261 I265L255-T259 VanDerWaalsContact O-CG2 3.29Å; L255-T259 WeakPolarHBondContact O-CG2 2.75Å; L255-T259 PolarHBondContact O-N 3.34Å; L256-T259 HydrophobicContact CD2-CG2 4.41Å; T259-N261 PolarHBondContact OG1-N 3.48Å; T259-I265 HydrophobicContact CG2-CG1 4.4Å
260E79.6Confident82.7Confident191 Ų19171.1 Ų71.189%0.89337%0.368SS*.  trans-97.4-3171.6-63.8179.7175.200112.4E262E260-E262 PolarHBondContact O-N 2.81Å
261N80.9Confident82.8Confident76 Ų7672.3 Ų72.341%0.40638%0.379SS..  trans-80.1100.5-175.1-175.1-10.1000112.5T259 S263 L264 I265T259-N261 PolarHBondContact OG1-N 3.48Å; N261-S263 VanDerWaalsContact C-N 3.27Å; N261-S263 PolarHBondContact O-N 3.2Å; N261-S263 PolarHBondContact OD1-N 3.44Å; N261-S263 PolarHBondContact OD1-OG 3.24Å; N261-L264 HydrophobicContact CB-CB 4.39Å; N261-L264 HydrophobicContact CB-CD1 4.04Å; N261-L264 HydrophobicContact CB-CG 4.27Å; N261-L264 WeakPolarHBondContact O-CB 3.02Å; N261-L264 PolarHBondContact O-N 3.47Å; N261-I265 WeakPolarHBondContact O-CG1 3.46Å; N261-I265 PolarHBondContact O-N 3.15Å
262E75.5Confident82.9Confident156 Ų15668.5 Ų68.573%0.72936%0.359SS*.Hα-helixtrans-49.6-41.2179.4-62.8-175.9168.800113.9E260 L264 I265 D266E260-E262 PolarHBondContact O-N 2.81Å; E262-L264 VanDerWaalsContact C-N 3.28Å; E262-L264 PolarHBondContact O-N 3.01Å; E262-I265 WeakPolarHBondContact O-CB 3.48Å; E262-I265 PolarHBondContact O-N 3.35Å; E262-D266 PolarHBondContact O-N 3.19Å; E262-D266 VanDerWaalsContact O-N 3.12Å
263S77.2Confident83.1Confident65 Ų6567.7 Ų67.746%0.45535%0.354SS..Hα-helixtrans-65.8-30.9-178.569.80000113.2N261 N267N261-S263 VanDerWaalsContact C-N 3.27Å; N261-S263 PolarHBondContact O-N 3.2Å; N261-S263 PolarHBondContact OD1-N 3.44Å; N261-S263 PolarHBondContact OD1-OG 3.24Å; S263-N267 PolarHBondContact O-N 2.93Å; S263-N267 PolarHBondContact O-ND2 3.3Å
264L78.1Confident83.4Confident78 Ų7870.2 Ų70.241%0.40837%0.368SS..Hα-helixtrans-72.9-35.9173.9-71.9176.5000110.6N261 E262 N267 M268N261-L264 HydrophobicContact CB-CB 4.39Å; N261-L264 HydrophobicContact CB-CD1 4.04Å; N261-L264 HydrophobicContact CB-CG 4.27Å; N261-L264 WeakPolarHBondContact O-CB 3.02Å; N261-L264 PolarHBondContact O-N 3.47Å; E262-L264 VanDerWaalsContact C-N 3.28Å; E262-L264 PolarHBondContact O-N 3.01Å; L264-N267 PolarHBondContact O-N 3.01Å; L264-M268 WeakPolarHBondContact O-CB 3.21Å; L264-M268 WeakPolarHBondContact O-CG 3.38Å; L264-M268 PolarHBondContact O-N 2.02Å
265I79.3Confident83.6Confident52 Ų5268.8 Ų68.827%0.26736%0.359SS..Hα-helixtrans-60.1-54.3179.2-56.8-179000109.9L256 T259 N261 E262 N267 M268 W269L256-I265 HydrophobicContact CD2-CB 3.8Å; L256-I265 HydrophobicContact CD2-CD1 4.37Å; L256-I265 HydrophobicContact CD2-CG1 3.52Å; L256-I265 HydrophobicContact CD2-CG2 3.7Å; T259-I265 HydrophobicContact CG2-CG1 4.4Å; N261-I265 WeakPolarHBondContact O-CG1 3.46Å; N261-I265 PolarHBondContact O-N 3.15Å; E262-I265 WeakPolarHBondContact O-CB 3.48Å; E262-I265 PolarHBondContact O-N 3.35Å; I265-N267 VanDerWaalsContact C-N 3.33Å; I265-N267 PolarHBondContact O-N 2.96Å; I265-M268 WeakPolarHBondContact O-CB 3.12Å; I265-M268 PolarHBondContact O-N 3.27Å; I265-M268 VanDerWaalsContact O-N 3.13Å; I265-W269 PolarHBondContact O-N 2.81Å
266D77.5Confident83.9Confident76 Ų7664.9 Ų64.941%0.40634%0.339SS..Hα-helixtrans-59-43.2-178.7-79.2-26000112.6E262 M268 W269 L270E262-D266 PolarHBondContact O-N 3.19Å; E262-D266 VanDerWaalsContact O-N 3.12Å; D266-M268 PolarHBondContact O-N 2.93Å; D266-W269 PolarHBondContact O-N 3.04Å; D266-L270 WeakPolarHBondContact O-CG 3.26Å; D266-L270 PolarHBondContact O-N 3.36Å
267N81.5Confident84.4Confident104 Ų10463.5 Ų63.556%0.55633%0.332SS*.Hα-helixtrans-65.7-37.3178.1-75.5-44.5000112.4S263 L264 I265 L270 A271S263-N267 PolarHBondContact O-N 2.93Å; S263-N267 PolarHBondContact O-ND2 3.3Å; L264-N267 PolarHBondContact O-N 3.01Å; I265-N267 VanDerWaalsContact C-N 3.33Å; I265-N267 PolarHBondContact O-N 2.96Å; N267-L270 PolarHBondContact O-N 2.82Å; N267-A271 PolarHBondContact O-N 2.96Å; N267-A271 VanDerWaalsContact O-N 3.13Å
268M84.7Confident84.9Confident33 Ų3363 Ų6316%0.16332%0.323CS..Hα-helixtrans-64.5-42.7176.1-78.5179.9-173.400111.8P252 L255 L256 L264 I265 D266 L270 A271 H272P252-M268 HydrophobicContact CB-CB 4.04Å; P252-M268 HydrophobicContact CB-CG 3.99Å; P252-M268 HydrophobicContact CB-SD 3.98Å; L255-M268 HydrophobicContact CB-CE 3.94Å; L255-M268 HydrophobicContact CB-SD 4.38Å; L255-M268 HydrophobicContact CD1-CE 3.82Å; L256-M268 HydrophobicContact CD2-SD 3.91Å; L256-M268 HydrophobicContact CG-SD 4.03Å; L264-M268 WeakPolarHBondContact O-CB 3.21Å; L264-M268 WeakPolarHBondContact O-CG 3.38Å; L264-M268 PolarHBondContact O-N 2.02Å; I265-M268 WeakPolarHBondContact O-CB 3.12Å; I265-M268 PolarHBondContact O-N 3.27Å; I265-M268 VanDerWaalsContact O-N 3.13Å; D266-M268 PolarHBondContact O-N 2.93Å; M268-L270 VanDerWaalsContact C-N 3.29Å; M268-L270 PolarHBondContact O-N 3.43Å; M268-A271 PolarHBondContact O-N 2.97Å; M268-H272 PolarHBondContact O-N 3.1Å
269W81Confident85.3Confident55 Ų5554.9 Ų54.921%0.20829%0.287CS..Hα-helixtrans-64.5-31.8177-79.8104.1000113.3Y71 Y187 L256 I265 D266 P273Y71-W269 WeakPolarHBondContact CE1-O 3.36Å; Y71-W269 PolarHBondContact OH-O 3.22Å; Y187-W269 VanDerWaalsContact OH-CZ2 3.24Å; Y187-W269 WeakPolarHBondContact OH-CZ2 3.32Å; L256-W269 HydrophobicContact CD1-CZ2 4.45Å; I265-W269 PolarHBondContact O-N 2.81Å; D266-W269 PolarHBondContact O-N 3.04Å; W269-P273 WeakPolarHBondContact O-CD 3.24Å
270L86.4Confident85.8Confident30 Ų3053 Ų5316%0.15728%0.276CS..Hα-helixtrans-77.8-23.7175.5-69.1173.3000113.4M26 V29 D266 N267 M268 P273M26-L270 HydrophobicContact CG-CD2 3.82Å; V29-L270 WeakPolarHBondContact CG1-O 3.3Å; D266-L270 WeakPolarHBondContact O-CG 3.26Å; D266-L270 PolarHBondContact O-N 3.36Å; N267-L270 PolarHBondContact O-N 2.82Å; M268-L270 VanDerWaalsContact C-N 3.29Å; M268-L270 PolarHBondContact O-N 3.43Å; L270-P273 WeakPolarHBondContact O-CD 3.39Å
271A89.6Confident86.5Confident31 Ų3147.8 Ų47.826%0.25625%0.253SS..Hα-helixtrans-76.1-30.317700000112.6F248 N267 M268 L274 G275F248-A271 HydrophobicContact CD1-CB 4.3Å; N267-A271 PolarHBondContact O-N 2.96Å; N267-A271 VanDerWaalsContact O-N 3.13Å; M268-A271 PolarHBondContact O-N 2.97Å; A271-L274 PolarHBondContact O-N 3.36Å; A271-G275 PolarHBondContact O-N 2.97Å; A271-G275 VanDerWaalsContact O-N 3.09Å
272H91Very high87Confident10 Ų1046.4 Ų46.45%0.04625%0.245CC..Hα-helixtrans-55.7-49.2-175.7172.9-143.2000114Y71 E108 Q249 M268 L274 G275 L276Y71-H272 PolarHBondContact OH-ND1 3.33Å; E108-H272 IonicContact OE1-CE1 3.63Å; Q249-H272 PolarHBondContact NE2-NE2 3.28Å; Q249-H272 PolarHBondContact OE1-NE2 2.9Å; M268-H272 PolarHBondContact O-N 3.1Å; H272-L274 VanDerWaalsContact C-N 3.31Å; H272-L274 PolarHBondContact O-N 2.96Å; H272-G275 WeakPolarHBondContact O-CA 3.3Å; H272-G275 PolarHBondContact O-N 3.42Å; H272-G275 VanDerWaalsContact O-N 3.1Å; H272-L276 PolarHBondContact O-N 2.88Å; H272-L276 VanDerWaalsContact O-N 3.08Å
273P92.3Very high87.7Confident0 Ų039 Ų390%021%0.21CC..Hα-helixtrans-68-30-177.7-18.933.3000113.5V29 P33 Y71 W269 L270 L276 T277V29-P273 HydrophobicContact CG1-CB 3.58Å; V29-P273 HydrophobicContact CG1-CG 3.59Å; P33-P273 HydrophobicContact CG-CB 3.91Å; Y71-P273 HydrophobicContact CD1-CG 3.85Å; Y71-P273 HydrophobicContact CD2-CB 4.35Å; Y71-P273 HydrophobicContact CD2-CG 3.65Å; Y71-P273 HydrophobicContact CE1-CG 3.59Å; Y71-P273 HydrophobicContact CE2-CB 4.41Å; Y71-P273 HydrophobicContact CE2-CG 3.45Å; Y71-P273 VanDerWaalsContact CE2-CG 3.45Å; Y71-P273 HydrophobicContact CG-CG 3.87Å; W269-P273 WeakPolarHBondContact O-CD 3.24Å; L270-P273 WeakPolarHBondContact O-CD 3.39Å; P273-L276 PolarHBondContact O-N 2.98Å; P273-T277 PolarHBondContact O-N 3.32Å; P273-T277 VanDerWaalsContact O-N 3.08Å; P273-T277 PolarHBondContact O-OG1 3.06Å
274L91Very high88.4Confident74 Ų7436.1 Ų36.139%0.38719%0.19SC..Hα-helixtrans-67.4-41.2172.9-60.2178.8000110.5V29 A271 H272 L276 T277 L278V29-L274 HydrophobicContact CG1-CD2 4.33Å; V29-L274 HydrophobicContact CG1-CG 4.21Å; A271-L274 PolarHBondContact O-N 3.36Å; H272-L274 VanDerWaalsContact C-N 3.31Å; H272-L274 PolarHBondContact O-N 2.96Å; L274-L276 PolarHBondContact O-N 3.18Å; L274-T277 WeakPolarHBondContact O-CB 3.45Å; L274-T277 PolarHBondContact O-N 3.47Å; L274-L278 WeakPolarHBondContact O-CG 3.29Å; L274-L278 PolarHBondContact O-N 3.33Å
275G91.7Very high89Confident2 Ų234.4 Ų34.42%0.02119%0.188CC..Hα-helixtrans-56.7-46.7172.600000112.8F248 A271 H272 T277 L278 E279F248-G275 VanDerWaalsContact CG-CA 3.48Å; A271-G275 PolarHBondContact O-N 2.97Å; A271-G275 VanDerWaalsContact O-N 3.09Å; H272-G275 WeakPolarHBondContact O-CA 3.3Å; H272-G275 PolarHBondContact O-N 3.42Å; H272-G275 VanDerWaalsContact O-N 3.1Å; G275-T277 VanDerWaalsContact C-N 3.31Å; G275-T277 PolarHBondContact O-N 3.33Å; G275-L278 PolarHBondContact O-N 3.38Å; G275-E279 WeakPolarHBondContact O-CB 3.35Å; G275-E279 PolarHBondContact O-N 2.94Å
276L92.6Very high89.4Confident1 Ų135.9 Ų35.91%0.00519%0.192CC..Hα-helixtrans-60.8-40.7176.3-61.3175.4000112.1T64 L67 R245 H272 P273 L274 E279 L280T64-L276 HydrophobicContact CG2-CB 3.73Å; T64-L276 HydrophobicContact CG2-CD1 4.28Å; L67-L276 HydrophobicContact CB-CD1 4.29Å; L67-L276 HydrophobicContact CD1-CD1 3.58Å; R245-L276 VanDerWaalsContact NH1-CD2 3.26Å; H272-L276 PolarHBondContact O-N 2.88Å; H272-L276 VanDerWaalsContact O-N 3.08Å; P273-L276 PolarHBondContact O-N 2.98Å; L274-L276 PolarHBondContact O-N 3.18Å; L276-E279 WeakPolarHBondContact O-CB 3.22Å; L276-E279 PolarHBondContact O-N 3.49Å; L276-L280 WeakPolarHBondContact O-CG 3.27Å; L276-L280 PolarHBondContact O-N 3.32Å; L276-L280 VanDerWaalsContact O-N 3.09Å
277T94Very high89.9Confident8 Ų832.3 Ų32.35%0.04917%0.173CC..Hα-helixtrans-63-48.2177.2-58.90000111.2V32 P33 T36 P273 L274 G275 E279 L280 I281V32-T277 HydrophobicContact CG1-CG2 3.68Å; P33-T277 WeakPolarHBondContact CA-OG1 3.48Å; T36-T277 HydrophobicContact CG2-CG2 3.79Å; P273-T277 PolarHBondContact O-N 3.32Å; P273-T277 VanDerWaalsContact O-N 3.08Å; P273-T277 PolarHBondContact O-OG1 3.06Å; L274-T277 WeakPolarHBondContact O-CB 3.45Å; L274-T277 PolarHBondContact O-N 3.47Å; G275-T277 VanDerWaalsContact C-N 3.31Å; G275-T277 PolarHBondContact O-N 3.33Å; T277-E279 VanDerWaalsContact C-N 3.3Å; T277-E279 PolarHBondContact O-N 3.36Å; T277-L280 PolarHBondContact O-N 3.38Å; T277-I281 HydrophobicContact CG2-CD1 3.71Å; T277-I281 HydrophobicContact CG2-CG1 4.33Å; T277-I281 WeakPolarHBondContact O-CG1 3.42Å; T277-I281 PolarHBondContact O-N 2.99Å
278L92.4Very high90.2Very high71 Ų7132.7 Ų32.737%0.37217%0.172SC..Hα-helixtrans-61.1-40.8178.6-70.3172.8000111.4F244 F248 L274 G275 I281 L282F244-L278 HydrophobicContact CD1-CB 3.96Å; F244-L278 HydrophobicContact CD1-CD1 4.38Å; F244-L278 HydrophobicContact CE1-CB 4.06Å; F244-L278 HydrophobicContact CE1-CD1 4.1Å; F248-L278 HydrophobicContact CE2-CD1 4.23Å; F248-L278 HydrophobicContact CZ-CD1 4.11Å; L274-L278 WeakPolarHBondContact O-CG 3.29Å; L274-L278 PolarHBondContact O-N 3.33Å; G275-L278 PolarHBondContact O-N 3.38Å; L278-I281 PolarHBondContact O-N 3.28Å; L278-L282 VanDerWaalsContact O-CB 3.27Å; L278-L282 WeakPolarHBondContact O-CB 3.41Å; L278-L282 WeakPolarHBondContact O-CG 3.27Å; L278-L282 PolarHBondContact O-N 3.48Å
279E91.4Very high90.3Very high1 Ų134.6 Ų34.61%0.00518%0.18CC..Hα-helixtrans-55.6-50.9174.4174.3177.6143.600111.8L60 I241 F244 R245 G275 L276 T277 Y283L60-E279 WeakPolarHBondContact CD2-OE1 3.3Å; I241-E279 HydrophobicContact CB-CG 3.99Å; I241-E279 HydrophobicContact CG1-CG 3.99Å; I241-E279 HydrophobicContact CG2-CG 3.45Å; I241-E279 VanDerWaalsContact CG2-CG 3.45Å; I241-E279 WeakPolarHBondContact CG2-OE1 3.29Å; F244-E279 HydrophobicContact CB-CB 4.39Å; R245-E279 VanDerWaalsContact CD-OE2 3.3Å; R245-E279 WeakPolarHBondContact CD-OE2 3.34Å; R245-E279 IonicContact NE-OE1 3.98Å; R245-E279 IonicContact NE-OE2 3.91Å; R245-E279 PolarHBondContact NE-OE2 2.85Å; G275-E279 WeakPolarHBondContact O-CB 3.35Å; G275-E279 PolarHBondContact O-N 2.94Å; L276-E279 WeakPolarHBondContact O-CB 3.22Å; L276-E279 PolarHBondContact O-N 3.49Å; T277-E279 VanDerWaalsContact C-N 3.3Å; T277-E279 PolarHBondContact O-N 3.36Å; E279-Y283 WeakPolarHBondContact O-CB 3.48Å; E279-Y283 PolarHBondContact O-N 2.81Å
280L93.8Very high90.6Very high0 Ų032 Ų320%017%0.17CC..Hα-helixtrans-66.8-42.2179.8-64.9-171.8000112.9S37 I40 F57 L60 T64 L276 T277 S284S37-L280 VanDerWaalsContact OG-CD1 3.32Å; S37-L280 WeakPolarHBondContact OG-CD1 3.38Å; I40-L280 HydrophobicContact CD1-CB 3.69Å; I40-L280 HydrophobicContact CD1-CD1 4.46Å; F57-L280 HydrophobicContact CD2-CD2 4.47Å; F57-L280 HydrophobicContact CE2-CD2 3.63Å; F57-L280 HydrophobicContact CZ-CD2 4.12Å; L60-L280 HydrophobicContact CD2-CD2 4.28Å; L60-L280 HydrophobicContact CG-CD2 4.19Å; T64-L280 HydrophobicContact CG2-CD1 3.67Å; T64-L280 HydrophobicContact CG2-CG 4.41Å; L276-L280 WeakPolarHBondContact O-CG 3.27Å; L276-L280 PolarHBondContact O-N 3.32Å; L276-L280 VanDerWaalsContact O-N 3.09Å; T277-L280 PolarHBondContact O-N 3.38Å; L280-S284 VanDerWaalsContact O-CB 3.31Å; L280-S284 WeakPolarHBondContact O-CB 3.44Å; L280-S284 PolarHBondContact O-N 3.12Å; L280-S284 PolarHBondContact O-OG 3.32Å
281I94Very high90.8Very high81 Ų8135.2 Ų35.242%0.41518%0.181SC..Hα-helixtrans-63.4-46.7178.5-69.9174000110.2T277 L278 S284 A285T277-I281 HydrophobicContact CG2-CD1 3.71Å; T277-I281 HydrophobicContact CG2-CG1 4.33Å; T277-I281 WeakPolarHBondContact O-CG1 3.42Å; T277-I281 PolarHBondContact O-N 2.99Å; L278-I281 PolarHBondContact O-N 3.28Å; I281-S284 WeakPolarHBondContact O-CB 3.29Å; I281-S284 PolarHBondContact O-N 3.3Å; I281-A285 WeakPolarHBondContact O-CB 3.42Å; I281-A285 PolarHBondContact O-N 2.86Å
282L91.6Very high90.7Very high46 Ų4638.2 Ų38.224%0.24119%0.189CC..Hα-helixtrans-66.5-42.6-179.1-73.4171.1000111.6V240 F244 L278 S284 A285 F286V240-L282 HydrophobicContact CG1-CB 4Å; V240-L282 HydrophobicContact CG1-CD1 3.98Å; F244-L282 HydrophobicContact CD1-CD1 4.42Å; F244-L282 HydrophobicContact CD2-CD1 3.64Å; F244-L282 HydrophobicContact CE1-CD1 3.93Å; F244-L282 HydrophobicContact CE2-CD1 3.06Å; F244-L282 HydrophobicContact CG-CD1 4.31Å; F244-L282 HydrophobicContact CZ-CD1 3.23Å; L278-L282 VanDerWaalsContact O-CB 3.27Å; L278-L282 WeakPolarHBondContact O-CB 3.41Å; L278-L282 WeakPolarHBondContact O-CG 3.27Å; L278-L282 PolarHBondContact O-N 3.48Å; L282-S284 VanDerWaalsContact C-N 3.3Å; L282-S284 PolarHBondContact O-N 2.88Å; L282-A285 PolarHBondContact O-N 3.48Å; L282-F286 HydrophobicContact CB-CE2 4.34Å; L282-F286 HydrophobicContact CD2-CE2 4.38Å; L282-F286 WeakPolarHBondContact O-CD2 3.48Å; L282-F286 PolarHBondContact O-N 3.3Å
283Y91.2Very high90.5Very high0 Ų037.9 Ų37.90%019%0.188CC..Hα-helixtrans-57.8-47.5173.6-176.6-85.4000111E53 F57 R237 I241 E279 A285 F286 D287 I290E53-Y283 VanDerWaalsContact CD-OH 3.32Å; E53-Y283 VanDerWaalsContact CG-OH 3.28Å; E53-Y283 WeakPolarHBondContact CG-OH 3.42Å; E53-Y283 PolarHBondContact OE1-OH 2.69Å; F57-Y283 HydrophobicContact CB-CD1 4.41Å; F57-Y283 HydrophobicContact CB-CE1 3.75Å; F57-Y283 AromaticContact CD1-CD1 3.73Å; F57-Y283 HydrophobicContact CD1-CD1 3.73Å; F57-Y283 AromaticContact CD1-CE1 3.54Å; F57-Y283 HydrophobicContact CD1-CE1 3.54Å; F57-Y283 AromaticContact CD2-CD1 3.18Å; F57-Y283 HydrophobicContact CD2-CD1 3.18Å; F57-Y283 HydrophobicContact CD2-CD2 4.19Å; F57-Y283 AromaticContact CD2-CE1 3.42Å; F57-Y283 HydrophobicContact CD2-CE1 3.42Å; F57-Y283 VanDerWaalsContact CD2-CE1 3.42Å; F57-Y283 HydrophobicContact CD2-CE2 4.35Å; F57-Y283 AromaticContact CD2-CG 3.58Å; F57-Y283 HydrophobicContact CD2-CG 3.58Å; F57-Y283 AromaticContact CD2-CZ 3.99Å; F57-Y283 AromaticContact CE1-CD1 3.67Å; F57-Y283 HydrophobicContact CE1-CD1 3.67Å; F57-Y283 AromaticContact CE1-CE1 3.95Å; F57-Y283 HydrophobicContact CE1-CE1 3.95Å; F57-Y283 AromaticContact CE2-CD1 3.13Å; F57-Y283 HydrophobicContact CE2-CD1 3.13Å; F57-Y283 HydrophobicContact CE2-CD2 4.45Å; F57-Y283 AromaticContact CE2-CE1 3.86Å; F57-Y283 HydrophobicContact CE2-CE1 3.86Å; F57-Y283 AromaticContact CE2-CG 3.47Å; F57-Y283 HydrophobicContact CE2-CG 3.47Å; F57-Y283 VanDerWaalsContact CE2-CG 3.47Å; F57-Y283 AromaticContact CG-CD1 3.49Å; F57-Y283 HydrophobicContact CG-CD1 3.49Å; F57-Y283 VanDerWaalsContact CG-CD1 3.49Å; F57-Y283 AromaticContact CG-CE1 3.24Å; F57-Y283 HydrophobicContact CG-CE1 3.24Å; F57-Y283 HydrophobicContact CG-CG 4.29Å; F57-Y283 AromaticContact CG-CZ 3.88Å; F57-Y283 AromaticContact CZ-CD1 3.38Å; F57-Y283 HydrophobicContact CZ-CD1 3.38Å; F57-Y283 HydrophobicContact CZ-CE1 4.1Å; F57-Y283 HydrophobicContact CZ-CG 4.09Å; R237-Y283 HydrophobicContact CB-CD2 3.92Å; R237-Y283 HydrophobicContact CB-CE2 3.86Å; I241-Y283 HydrophobicContact CD1-CD2 3.22Å; I241-Y283 HydrophobicContact CD1-CE2 3.85Å; I241-Y283 HydrophobicContact CD1-CG 3.94Å; I241-Y283 HydrophobicContact CG1-CD2 3.94Å; I241-Y283 HydrophobicContact CG1-CG 4.49Å; E279-Y283 WeakPolarHBondContact O-CB 3.48Å; E279-Y283 PolarHBondContact O-N 2.81Å; Y283-A285 VanDerWaalsContact C-N 3.29Å; Y283-A285 PolarHBondContact O-N 2.98Å; Y283-F286 PolarHBondContact O-N 2.91Å; Y283-F286 VanDerWaalsContact O-N 3.12Å; Y283-D287 HydrophobicContact CE1-CB 4.38Å; Y283-D287 PolarHBondContact O-N 2.91Å; Y283-I290 HydrophobicContact CD1-CD1 4.28Å; Y283-I290 HydrophobicContact CE1-CD1 4.15Å
284S91.1Very high90.2Very high5 Ų540.8 Ų40.84%0.03520%0.203CC..Hα-helixtrans-59.7-39177.3-59.90000112.3L280 I281 L282 D287L280-S284 VanDerWaalsContact O-CB 3.31Å; L280-S284 WeakPolarHBondContact O-CB 3.44Å; L280-S284 PolarHBondContact O-N 3.12Å; L280-S284 PolarHBondContact O-OG 3.32Å; I281-S284 WeakPolarHBondContact O-CB 3.29Å; I281-S284 PolarHBondContact O-N 3.3Å; L282-S284 VanDerWaalsContact C-N 3.3Å; L282-S284 PolarHBondContact O-N 2.88Å; S284-D287 PolarHBondContact O-N 3.06Å
285A90.5Very high90.1Very high43 Ų4344 Ų4436%0.35521%0.213SC..Hα-helixtrans-70.2-29.1176.900000113.1I281 L282 Y283 R291I281-A285 WeakPolarHBondContact O-CB 3.42Å; I281-A285 PolarHBondContact O-N 2.86Å; L282-A285 PolarHBondContact O-N 3.48Å; Y283-A285 VanDerWaalsContact C-N 3.29Å; Y283-A285 PolarHBondContact O-N 2.98Å; A285-R291 WeakPolarHBondContact O-CD 3.28Å; A285-R291 VanDerWaalsContact O-CZ 3.25Å; A285-R291 PolarHBondContact O-NE 2.95Å; A285-R291 VanDerWaalsContact O-NE 3.09Å; A285-R291 PolarHBondContact O-NH1 3.07Å
286F88.6Confident89.7Confident82 Ų8245 Ų4536%0.3622%0.218SC..Hα-helixtrans-85.7-23.3175.3-70.4-58.5000113R237 V240 L282 Y283 R291R237-F286 HydrophobicContact CG-CB 3.62Å; V240-F286 HydrophobicContact CB-CE2 4.36Å; V240-F286 HydrophobicContact CG1-CE2 4.06Å; V240-F286 HydrophobicContact CG2-CD2 4.31Å; V240-F286 HydrophobicContact CG2-CE2 3.84Å; L282-F286 HydrophobicContact CB-CE2 4.34Å; L282-F286 HydrophobicContact CD2-CE2 4.38Å; L282-F286 WeakPolarHBondContact O-CD2 3.48Å; L282-F286 PolarHBondContact O-N 3.3Å; Y283-F286 PolarHBondContact O-N 2.91Å; Y283-F286 VanDerWaalsContact O-N 3.12Å; F286-R291 PolarHBondContact O-NH2 3.33Å
287D88.4Confident89.3Confident1 Ų150.7 Ų50.71%0.00525%0.248CC..  trans-72.4126.4177.1-152.3-61000112.1R51 R237 Y283 S284 E289 I290 R291R51-D287 IonicContact CZ-OD1 2.98Å; R51-D287 IonicContact CZ-OD2 2.91Å; R51-D287 IonicContact NH2-OD1 3.55Å; R51-D287 PolarHBondContact NH2-OD1 3.14Å; R51-D287 IonicContact NH2-OD2 3.47Å; R51-D287 PolarHBondContact NH2-OD2 2.83Å; R237-D287 IonicContact CZ-OD2 3.63Å; R237-D287 VanDerWaalsContact NH1-CG 3.28Å; R237-D287 IonicContact NH1-OD1 3.93Å; R237-D287 IonicContact NH1-OD2 3.93Å; R237-D287 PolarHBondContact NH1-OD2 3.49Å; Y283-D287 HydrophobicContact CE1-CB 4.38Å; Y283-D287 PolarHBondContact O-N 2.91Å; S284-D287 PolarHBondContact O-N 3.06Å; D287-E289 PolarHBondContact OD1-N 3.32Å; D287-I290 HydrophobicContact CB-CB 4Å; D287-I290 HydrophobicContact CB-CD1 3.8Å; D287-I290 HydrophobicContact CB-CG1 3.87Å; D287-R291 VanDerWaalsContact O-CB 3.29Å; D287-R291 WeakPolarHBondContact O-CB 3.42Å; D287-R291 VanDerWaalsContact O-CG 3.25Å; D287-R291 WeakPolarHBondContact O-CG 2.93Å; D287-R291 PolarHBondContact O-N 2.92Å; D287-R291 PolarHBondContact O-NE 3.11Å; D287-R291 VanDerWaalsContact O-NE 3.12Å
288Q86.9Confident88.7Confident112 Ų11255.4 Ų55.452%0.52328%0.28SS..Hα-helixtrans-71.7-34.2179.3-76.4-176.4-4700112.5R291 H292Q288-R291 VanDerWaalsContact CG-NH2 3.27Å; Q288-H292 WeakPolarHBondContact O-CB 3.5Å; Q288-H292 PolarHBondContact O-N 3.28Å; Q288-H292 VanDerWaalsContact O-N 3.15Å
289E86.9Confident88.4Confident73 Ų7356.4 Ų56.434%0.34129%0.289SS..Hα-helixtrans-73.9-48-177.9-71.9166.9-16200110.2I47 R51 D287 R291 H292 C293I47-E289 HydrophobicContact CD1-CB 4.17Å; R51-E289 IonicContact CZ-OE1 3.79Å; R51-E289 IonicContact CZ-OE2 3.3Å; R51-E289 IonicContact NH1-OE1 3.87Å; R51-E289 PolarHBondContact NH1-OE1 3.32Å; R51-E289 IonicContact NH1-OE2 3.7Å; R51-E289 PolarHBondContact NH1-OE2 3.45Å; R51-E289 VanDerWaalsContact NH1-OE2 3.13Å; D287-E289 PolarHBondContact OD1-N 3.32Å; E289-R291 PolarHBondContact O-N 3.24Å; E289-H292 WeakPolarHBondContact O-CB 3.35Å; E289-H292 PolarHBondContact O-N 3.47Å; E289-H292 VanDerWaalsContact O-N 3.09Å; E289-C293 PolarHBondContact O-N 2.92Å
290I87.9Confident87.5Confident0 Ų059.7 Ų59.70%032%0.323CS..Hα-helixtrans-62.2-44.4178.5-54.6175.6000110.3V44 I47 L54 F57 Y283 D287 H292 C293 I294V44-I290 HydrophobicContact CG2-CD1 4.07Å; V44-I290 HydrophobicContact CG2-CG1 4.26Å; I47-I290 HydrophobicContact CD1-CG1 4.36Å; L54-I290 HydrophobicContact CD1-CD1 4.13Å; L54-I290 HydrophobicContact CD1-CG1 4.39Å; F57-I290 HydrophobicContact CD1-CD1 3.92Å; F57-I290 HydrophobicContact CE1-CD1 3.57Å; F57-I290 HydrophobicContact CZ-CD1 4.45Å; Y283-I290 HydrophobicContact CD1-CD1 4.28Å; Y283-I290 HydrophobicContact CE1-CD1 4.15Å; D287-I290 HydrophobicContact CB-CB 4Å; D287-I290 HydrophobicContact CB-CD1 3.8Å; D287-I290 HydrophobicContact CB-CG1 3.87Å; I290-H292 VanDerWaalsContact C-N 3.26Å; I290-H292 PolarHBondContact O-N 2.91Å; I290-C293 WeakPolarHBondContact O-CB 3.12Å; I290-C293 PolarHBondContact O-N 3.47Å; I290-C293 VanDerWaalsContact O-N 3.15Å; I290-I294 HydrophobicContact CG2-CD1 3.98Å; I290-I294 HydrophobicContact CG2-CG1 4.37Å; I290-I294 WeakPolarHBondContact O-CG1 3.44Å; I290-I294 PolarHBondContact O-N 2.72Å
291R89.4Confident86.3Confident99 Ų9965.7 Ų65.737%0.37435%0.351SS..Hα-helixtrans-58.5-37174.3-82.4-171.3-69.4-166.24.6113.6A285 F286 D287 Q288 E289 I294 K295A285-R291 WeakPolarHBondContact O-CD 3.28Å; A285-R291 VanDerWaalsContact O-CZ 3.25Å; A285-R291 PolarHBondContact O-NE 2.95Å; A285-R291 VanDerWaalsContact O-NE 3.09Å; A285-R291 PolarHBondContact O-NH1 3.07Å; F286-R291 PolarHBondContact O-NH2 3.33Å; D287-R291 VanDerWaalsContact O-CB 3.29Å; D287-R291 WeakPolarHBondContact O-CB 3.42Å; D287-R291 VanDerWaalsContact O-CG 3.25Å; D287-R291 WeakPolarHBondContact O-CG 2.93Å; D287-R291 PolarHBondContact O-N 2.92Å; D287-R291 PolarHBondContact O-NE 3.11Å; D287-R291 VanDerWaalsContact O-NE 3.12Å; Q288-R291 VanDerWaalsContact CG-NH2 3.27Å; E289-R291 PolarHBondContact O-N 3.24Å; R291-I294 PolarHBondContact O-N 3.32Å; R291-K295 WeakPolarHBondContact O-CG 3.39Å; R291-K295 PolarHBondContact O-N 3.06Å
292H87.5Confident84.6Confident94 Ų9465.4 Ų65.444%0.43536%0.361SS..Hα-helixtrans-67.3-42.3178-169.564.1000110.5Q288 E289 I290 I294 K295 L296Q288-H292 WeakPolarHBondContact O-CB 3.5Å; Q288-H292 PolarHBondContact O-N 3.28Å; Q288-H292 VanDerWaalsContact O-N 3.15Å; E289-H292 WeakPolarHBondContact O-CB 3.35Å; E289-H292 PolarHBondContact O-N 3.47Å; E289-H292 VanDerWaalsContact O-N 3.09Å; I290-H292 VanDerWaalsContact C-N 3.26Å; I290-H292 PolarHBondContact O-N 2.91Å; H292-I294 PolarHBondContact O-N 2.96Å; H292-K295 PolarHBondContact O-N 3.49Å; H292-L296 WeakPolarHBondContact O-CG 3.43Å; H292-L296 PolarHBondContact O-N 3.32Å
293C86.5Confident82.9Confident3 Ų364.4 Ų64.42%0.0236%0.358CS..Hα-helixtrans-60.4-42.5171.7-65.40000112.5L43 E289 I290 K295 L296 L297L43-C293 HydrophobicContact CD2-CB 4.2Å; E289-C293 PolarHBondContact O-N 2.92Å; I290-C293 WeakPolarHBondContact O-CB 3.12Å; I290-C293 PolarHBondContact O-N 3.47Å; I290-C293 VanDerWaalsContact O-N 3.15Å; C293-K295 PolarHBondContact O-N 3.19Å; C293-L296 PolarHBondContact O-N 3.01Å; C293-L297 WeakPolarHBondContact O-CB 3.39Å; C293-L297 PolarHBondContact O-N 3.5Å
294I87.7Confident81.2Confident61 Ų6170.2 Ų70.231%0.31339%0.388SS..Hα-helixtrans-60.3-46.6175.5-68.3166.8000110.4L43 I290 R291 H292 L296 L297 C298L43-I294 HydrophobicContact CD1-CD1 4.31Å; L43-I294 HydrophobicContact CD1-CG1 3.61Å; L43-I294 HydrophobicContact CD2-CG1 4.41Å; I290-I294 HydrophobicContact CG2-CD1 3.98Å; I290-I294 HydrophobicContact CG2-CG1 4.37Å; I290-I294 WeakPolarHBondContact O-CG1 3.44Å; I290-I294 PolarHBondContact O-N 2.72Å; R291-I294 PolarHBondContact O-N 3.32Å; H292-I294 PolarHBondContact O-N 2.96Å; I294-L296 VanDerWaalsContact C-N 3.34Å; I294-L296 PolarHBondContact O-N 3.44Å; I294-L297 PolarHBondContact O-N 3Å; I294-C298 PolarHBondContact O-N 3.26Å; I294-C298 PolarHBondContact O-SG 3.43Å
295K87.3Confident79Confident141 Ų14176.8 Ų76.861%0.61342%0.422SS*.Hα-helixtrans-61.1-42.6178-75.4-179.7179-168.10112.2R291 H292 C293 C298 T299R291-K295 WeakPolarHBondContact O-CG 3.39Å; R291-K295 PolarHBondContact O-N 3.06Å; H292-K295 PolarHBondContact O-N 3.49Å; C293-K295 PolarHBondContact O-N 3.19Å; K295-C298 PolarHBondContact O-N 3Å; K295-T299 WeakPolarHBondContact O-CG2 3.4Å; K295-T299 PolarHBondContact O-N 2.65Å; K295-T299 PolarHBondContact O-OG1 3.44Å
296L84.4Confident77.2Confident24 Ų2477.9 Ų77.913%0.12642%0.422CS..Hα-helixtrans-62.9-42.3177.1-74.4169.9000111.9H292 C293 I294 C298 T299 G300 Q301H292-L296 WeakPolarHBondContact O-CG 3.43Å; H292-L296 PolarHBondContact O-N 3.32Å; C293-L296 PolarHBondContact O-N 3.01Å; I294-L296 VanDerWaalsContact C-N 3.34Å; I294-L296 PolarHBondContact O-N 3.44Å; L296-C298 VanDerWaalsContact C-N 3.33Å; L296-C298 PolarHBondContact O-N 3.32Å; L296-T299 PolarHBondContact O-N 2.89Å; L296-T299 PolarHBondContact O-OG1 3.32Å; L296-G300 PolarHBondContact O-N 3.01Å; L296-Q301 CarbonylContact C-O 3.45Å; L296-Q301 HydrophobicContact CD2-CB 3.96Å; L296-Q301 PolarHBondContact O-N 3.46Å; L296-Q301 VanDerWaalsContact O-N 3.08Å; L296-Q301 VanDerWaalsContact O-O 3.12Å
297L83.4Confident75.1Confident120 Ų12079.2 Ų79.263%0.62844%0.439SS*.Hα-helixtrans-61.2-42.6174.3-17071.3000111.2L43 C293 I294 G300L43-L297 HydrophobicContact CD2-CB 4.48Å; L43-L297 HydrophobicContact CD2-CD2 4.06Å; C293-L297 WeakPolarHBondContact O-CB 3.39Å; C293-L297 PolarHBondContact O-N 3.5Å; I294-L297 PolarHBondContact O-N 3Å; L297-G300 PolarHBondContact O-N 3.21Å
298C82.7Confident73.1Confident106 Ų10685.4 Ų85.472%0.71647%0.471SS*.Hα-helixtrans-68.2-31177.1-66.60000113.6I294 K295 L296 G300I294-C298 PolarHBondContact O-N 3.26Å; I294-C298 PolarHBondContact O-SG 3.43Å; K295-C298 PolarHBondContact O-N 3Å; L296-C298 VanDerWaalsContact C-N 3.33Å; L296-C298 PolarHBondContact O-N 3.32Å; C298-G300 VanDerWaalsContact C-N 3.29Å
299T84.3Confident70.9Confident92 Ų9283.8 Ų83.856%0.56447%0.472SS*.THydrogen-bonded Turntrans-85.91.5177.157.10000113.4K295 L296 Q301K295-T299 WeakPolarHBondContact O-CG2 3.4Å; K295-T299 PolarHBondContact O-N 2.65Å; K295-T299 PolarHBondContact O-OG1 3.44Å; L296-T299 PolarHBondContact O-N 2.89Å; L296-T299 PolarHBondContact O-OG1 3.32Å; T299-Q301 PolarHBondContact O-N 3.38Å
300G73.5Confident68.6Low70 Ų7086 Ų8672%0.72249%0.493SS*.THydrogen-bonded Turntrans68.710.6-177.500000114L296 L297 C298L296-G300 PolarHBondContact O-N 3.01Å; L297-G300 PolarHBondContact O-N 3.21Å; C298-G300 VanDerWaalsContact C-N 3.29Å
301Q67.8Low66.3Low127 Ų12790.2 Ų90.259%0.59352%0.521SS*.  trans-87113.1174.5-81.9176.5-24.300109.1L296 T299 C303L296-Q301 CarbonylContact C-O 3.45Å; L296-Q301 HydrophobicContact CD2-CB 3.96Å; L296-Q301 PolarHBondContact O-N 3.46Å; L296-Q301 VanDerWaalsContact O-N 3.08Å; L296-Q301 VanDerWaalsContact O-O 3.12Å; T299-Q301 PolarHBondContact O-N 3.38Å; Q301-C303 PolarHBondContact O-N 3.23Å
302A58.9Low63.7Low75 Ų7590.8 Ų90.862%0.6254%0.539SS*.  trans-57.1127.7177.600000111I304A302-I304 HydrophobicContact CB-CD1 4.3Å; A302-I304 HydrophobicContact CB-CG1 4.29Å; A302-I304 PolarHBondContact O-N 3.11Å
303C55.6Low60.9Low25 Ų2597.6 Ų97.617%0.16956%0.561CS.*G310 helixtrans-58.91.6177.8-76.20000115.2Q301 N305Q301-C303 PolarHBondContact O-N 3.23Å; C303-N305 VanDerWaalsContact C-N 3.26Å; C303-N305 PolarHBondContact O-N 2.74Å
304I55.9Low58.4Low122 Ų122101.9 Ų101.963%0.62659%0.591SS**G310 helixtrans-67.1-26.5-170.1-61.5174.8000112K48 A302K48-I304 PolarHBondContact NZ-O 3.42Å; A302-I304 HydrophobicContact CB-CD1 4.3Å; A302-I304 HydrophobicContact CB-CG1 4.29Å; A302-I304 PolarHBondContact O-N 3.11Å
305N45.8Very low55.9Low142 Ų142105.7 Ų105.776%0.75962%0.617SS**G310 helixtrans-112.549.6-174.8-68.5-25.4000113.7C303 P307C303-N305 VanDerWaalsContact C-N 3.26Å; C303-N305 PolarHBondContact O-N 2.74Å; N305-P307 WeakPolarHBondContact O-CD 3.32Å
306L51.6Low53.4Low66 Ų66105 Ų10535%0.34663%0.625SS.*  trans-66.9109.1170.3-98141.4000111.2
307P44.2Very low51Low111 Ų111111.2 Ų111.272%0.72166%0.658SS**  trans-68.213216029.5-33.2000108.6N305 S309N305-P307 WeakPolarHBondContact O-CD 3.32Å; P307-S309 PolarHBondContact O-N 3.49Å
308L46.7Very low48.8Very low130 Ų130111.8 Ų111.868%0.68167%0.667SS**  trans-45.1123.7174.4-77.1135.9000110.5
309S41.8Very low46.8Very low79 Ų79115.6 Ų115.655%0.55268%0.675SS**  trans-46.9131.9164.7160.40000109.4P307 C311P307-S309 PolarHBondContact O-N 3.49Å; S309-C311 PolarHBondContact O-N 2.93Å
310P38.6Very low44.8Very low119 Ų119117 Ų11777%0.77368%0.683SS**G310 helixtrans-65.1-1.1-172.922.2-30.4000114.4C312 R313P310-C312 PolarHBondContact O-N 2.88Å; P310-R313 PolarHBondContact O-N 3.17Å
311C38.8Very low43.7Very low88 Ų88120.9 Ų120.960%0.59569%0.686SS**G310 helixtrans-69.5-8.2176.8-82.60000115.5S309S309-C311 PolarHBondContact O-N 2.93Å
312C34.2Very low42.3Very low111 Ų111122 Ų12275%0.7570%0.696SS**G310 helixtrans-102.43.3176.7-74.70000114.6P310 S314P310-C312 PolarHBondContact O-N 2.88Å; C312-S314 PolarHBondContact O-N 3.06Å
313R29.7Very low41.8Very low237 Ų237131.6 Ų131.689%0.89472%0.724SS**  trans-98.440.5-179-154.9-175.2-97.4-164.8-5113.7P310P310-R313 PolarHBondContact O-N 3.17Å
314S34.1Very low41.1Very low93 Ų93136.9 Ų136.965%0.6575%0.751SS**  trans-134.785.2170.872.90000111C312C312-S314 PolarHBondContact O-N 3.06Å
315T35.2Very low40.3Very low141 Ų141137.7 Ų137.787%0.86576%0.758SS**SBendtrans17267.2146.945.80000109.6
316T33.9Very low40Very low128 Ų128137.4 Ų137.479%0.78576%0.758SS**SBendtrans-156104.915444.10000104.4
317N33.3Very low39.4Very low153 Ų153141.6 Ų141.682%0.81878%0.782SS**  trans141.480.6165.1-72.1-3.5000109.8
318T38.6Very low39.1Very low133 Ų133143.6 Ų143.682%0.81679%0.786SS**  trans-17872.2144.125.80000109.7
319E39.7Very low38.6Very low186 Ų186144.5 Ų144.587%0.86979%0.793SS**  trans-12767.2152.1-81.6-173.5165.400107.4
320T43.2Very low38.3Very low121 Ų121149.1 Ų149.174%0.74281%0.81SS**  trans-10589.4152.740.60000105.2D322T320-D322 PolarHBondContact O-N 2.91Å
321I49.6Very low38.3Very low152 Ų152151.5 Ų151.578%0.77981%0.813SS**  trans-91.686.6165.3-62.1176.9000105.1
322D39.8Very low38.3Very low151 Ų151156.8 Ų156.881%0.80783%0.831SS**  trans-86.8112.1158-87.3-34.2000107.6T320T320-D322 PolarHBondContact O-N 2.91Å
323K47.9Very low38.6Very low275 Ų275160.9 Ų160.9100%1.19684%0.838SS**  trans158.70141.5-89.3179.7-177.5-175.80110.7

Retrieved 323 of 323 residues in 226.1 ms (Link to these results)

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