A0A3Q0KCG8_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KCG8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 669 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
1M48.8Very low61.1Low244 Ų244129.6 Ų129.6100%1.20267%0.668SS**  0128.90-80.5170.7156.100107.6
2N62.1Low60.3Low108 Ų108125.6 Ų125.658%0.57866%0.66SS**  trans-82.7123-168.4-169.3-10.6000111N4N2-N4 VanDerWaalsContact C-N 3.28Å; N2-N4 PolarHBondContact O-N 3.48Å; N2-N4 PolarHBondContact OD1-N 3.27Å
3P64.1Low59.8Low101 Ų101124.5 Ų124.566%0.65665%0.653SS**THydrogen-bonded Turntrans-65.3-25.6-176.724.4-33.9000114.3I5 K6P3-I5 PolarHBondContact O-N 3.01Å; P3-K6 PolarHBondContact O-N 3.36Å
4N64.1Low59.4Low111 Ų111124.4 Ų124.459%0.59465%0.652SS**THydrogen-bonded Turntrans-67.9-1.4-172.6-69-1.9000115.8N2N2-N4 VanDerWaalsContact C-N 3.28Å; N2-N4 PolarHBondContact O-N 3.48Å; N2-N4 PolarHBondContact OD1-N 3.27Å
5I69.4Low58.8Low107 Ų107121.4 Ų121.455%0.54965%0.645SS.*Hα-helixtrans-82.3-24.2177.4-67.1175.4000111.9P3 I9P3-I5 PolarHBondContact O-N 3.01Å; I5-I9 HydrophobicContact CG2-CD1 3.84Å; I5-I9 WeakPolarHBondContact O-CG1 3.46Å; I5-I9 PolarHBondContact O-N 3.32Å
6K62.8Low58.1Low171 Ų171119.3 Ų119.374%0.74363%0.634SS**Hα-helixtrans-68.2-45.1-178.9-90.1-172.7169.7-173.90112.9P3 L8 I9 M10P3-K6 PolarHBondContact O-N 3.36Å; K6-L8 VanDerWaalsContact C-N 3.35Å; K6-L8 PolarHBondContact O-N 3.36Å; K6-I9 PolarHBondContact O-N 2.89Å; K6-M10 PolarHBondContact O-N 3.29Å
7D65.5Low57.7Low101 Ų101122.5 Ų122.554%0.5465%0.645SS.*Hα-helixtrans-74.4-29.1-173.3-54.3-32.8000112.1M10 N11D7-M10 PolarHBondContact O-N 3.44Å; D7-N11 PolarHBondContact O-N 3.03Å; D7-N11 VanDerWaalsContact O-N 3.09Å; D7-N11 PolarHBondContact O-ND2 3Å
8L62.6Low57.2Low135 Ų135122.1 Ų122.171%0.70765%0.648SS**Hα-helixtrans-67.2-35.6173.2-117.3159.6000112.5K6 S12K6-L8 VanDerWaalsContact C-N 3.35Å; K6-L8 PolarHBondContact O-N 3.36Å; L8-S12 PolarHBondContact O-N 3.36Å
9I59.6Low56.6Low99 Ų99125.1 Ų125.151%0.50865%0.65SS.*Hα-helixtrans-74.3-37.7174.5-66.3170.6000110.7I5 K6 S12 I13I5-I9 HydrophobicContact CG2-CD1 3.84Å; I5-I9 WeakPolarHBondContact O-CG1 3.46Å; I5-I9 PolarHBondContact O-N 3.32Å; K6-I9 PolarHBondContact O-N 2.89Å; I9-S12 PolarHBondContact O-N 3.06Å; I9-I13 HydrophobicContact CG2-CD1 4.07Å; I9-I13 WeakPolarHBondContact O-CG1 3.49Å
10M57.4Low56.2Low131 Ų131123.5 Ų123.565%0.64564%0.642SS**Hα-helixtrans-71.4-34.9-176.3-147.1152.1-17600112.7K6 D7 I13K6-M10 PolarHBondContact O-N 3.29Å; D7-M10 PolarHBondContact O-N 3.44Å; M10-I13 PolarHBondContact O-N 3.25Å
11N55.4Low55.8Low118 Ų118122.6 Ų122.663%0.63165%0.646SS**Hα-helixtrans-74.1-26.6174.3-73-26.8000113.7D7 I13D7-N11 PolarHBondContact O-N 3.03Å; D7-N11 VanDerWaalsContact O-N 3.09Å; D7-N11 PolarHBondContact O-ND2 3Å; N11-I13 VanDerWaalsContact C-N 3.28Å; N11-I13 PolarHBondContact O-N 3.34Å
12S52.3Low55.9Low81 Ų81113.7 Ų113.757%0.56661%0.608SS**Hα-helixtrans-69.9-22.3174.7176.20000113.7L8 I9L8-S12 PolarHBondContact O-N 3.36Å; I9-S12 PolarHBondContact O-N 3.06Å
13I54Low55.2Low112 Ų112113.3 Ų113.357%0.57461%0.605SS**Hα-helixtrans-85.9-29-175.8-68.8166.8000111.1I9 M10 N11I9-I13 HydrophobicContact CG2-CD1 4.07Å; I9-I13 WeakPolarHBondContact O-CG1 3.49Å; M10-I13 PolarHBondContact O-N 3.25Å; N11-I13 VanDerWaalsContact C-N 3.28Å; N11-I13 PolarHBondContact O-N 3.34Å
14I53.5Low54.4Low123 Ų123119.2 Ų119.263%0.63161%0.614SS**Hα-helixtrans-79.2-22.3-176-63.8170.7000112.3N16I14-N16 PolarHBondContact O-N 2.9Å
15S50.9Low53.5Low79 Ų79119.1 Ų119.155%0.55261%0.614SS**THydrogen-bonded Turntrans-83.1-3.7-18069.10000115.2
16N47.2Very low52.3Low88 Ų88120.3 Ų120.347%0.47162%0.617SS.*SBendtrans-103.2-11.8-170.8-14338.8000114.4I14 T18I14-N16 PolarHBondContact O-N 2.9Å; N16-T18 VanDerWaalsContact C-N 3.27Å; N16-T18 PolarHBondContact O-N 3.18Å
17E51Low51.7Low174 Ų174116.7 Ų116.781%0.81361%0.613SS**THydrogen-bonded Turntrans-73.6-15.1179.2-67.1-165.1146.300113.8
18T48.7Very low50.9Low114 Ų114118.8 Ų118.870%0.69962%0.62SS**THydrogen-bonded Turntrans-85.5-15.9-179.647.80000114.6N16N16-T18 VanDerWaalsContact C-N 3.27Å; N16-T18 PolarHBondContact O-N 3.18Å
19W46.6Very low50.4Low180 Ų180117.3 Ų117.368%0.68261%0.612SS**THydrogen-bonded Turntrans-82.8-35.6-177.8-99.766.3000113.9S21 S22W19-S21 PolarHBondContact O-N 3.32Å; W19-S21 VanDerWaalsContact O-N 3.08Å; W19-S22 PolarHBondContact O-N 3.29Å; W19-S22 PolarHBondContact O-OG 3.29Å
20N48.7Very low49.9Very low92 Ų92120.2 Ų120.249%0.49263%0.627SS.*THydrogen-bonded Turntrans-69.8-8.3-171.3-81.9-9.7000115.1E128N20-E128 PolarHBondContact ND2-OE1 2.92Å
21S47.9Very low49.8Very low105 Ų105118.2 Ų118.273%0.73463%0.626SS**THydrogen-bonded Turntrans-90.3-7.5173.1-150.70000114W19W19-S21 PolarHBondContact O-N 3.32Å; W19-S21 VanDerWaalsContact O-N 3.08Å
22S49.9Very low49.7Very low58 Ų58116.6 Ų116.641%0.40662%0.624SS.*THydrogen-bonded Turntrans-90.5-30.6-175.968.40000114.4W19 W24 N25W19-S22 PolarHBondContact O-N 3.29Å; W19-S22 PolarHBondContact O-OG 3.29Å; S22-W24 PolarHBondContact O-N 2.85Å; S22-N25 PolarHBondContact O-N 3.32Å
23I46.9Very low49.8Very low100 Ų100119.7 Ų119.751%0.51363%0.633SS.*G310 helixtrans-72.3-31.4-168.4-64.6175.7000112.4N25I23-N25 VanDerWaalsContact C-N 3.31Å; I23-N25 PolarHBondContact O-N 2.86Å
24W47.3Very low49.7Very low225 Ų225119.4 Ų119.485%0.85264%0.642SS**G310 helixtrans-77.6-9.5177.9-81.194000114.8S22S22-W24 PolarHBondContact O-N 2.85Å
25N45.6Very low49.6Very low109 Ų109118.4 Ų118.458%0.58365%0.645SS**G310 helixtrans-96-11178.3-99.3-12.6000114.3S22 I23 S27 Q28S22-N25 PolarHBondContact O-N 3.32Å; I23-N25 VanDerWaalsContact C-N 3.31Å; I23-N25 PolarHBondContact O-N 2.86Å; N25-S27 PolarHBondContact O-N 3.11Å; N25-Q28 PolarHBondContact O-N 3.13Å
26Q44.2Very low49.9Very low132 Ų132120.2 Ų120.262%0.61766%0.658SS**Hα-helixtrans-67.8-18.5-178.8-85.8-175.6-1300114.1Q28 I29Q26-Q28 VanDerWaalsContact C-N 3.26Å; Q26-Q28 PolarHBondContact O-N 3.37Å; Q26-I29 HydrophobicContact CG-CD1 4.5Å; Q26-I29 PolarHBondContact O-N 3.07Å
27S50.1Low50.5Low94 Ų94121.3 Ų121.366%0.65767%0.672SS**Hα-helixtrans-70.9-13.7177.357.30000114.6N25N25-S27 PolarHBondContact O-N 3.11Å
28Q49.9Very low50.8Low146 Ų146119.1 Ų119.168%0.68267%0.673SS**Hα-helixtrans-98.8-14.6173.7-67.8-159.5-7.500114.3N25 Q26 L30 S31N25-Q28 PolarHBondContact O-N 3.13Å; Q26-Q28 VanDerWaalsContact C-N 3.26Å; Q26-Q28 PolarHBondContact O-N 3.37Å; Q28-L30 VanDerWaalsContact C-N 3.34Å; Q28-L30 PolarHBondContact O-N 2.99Å; Q28-S31 PolarHBondContact O-N 3.09Å; Q28-S31 PolarHBondContact O-OG 3.31Å
29I50.6Low51.1Low104 Ų104118.6 Ų118.653%0.53368%0.675SS.*Hα-helixtrans-75.2-24-177-63.9176.9000112Q26 S31 S32Q26-I29 HydrophobicContact CG-CD1 4.5Å; Q26-I29 PolarHBondContact O-N 3.07Å; I29-S31 PolarHBondContact O-N 2.9Å; I29-S32 PolarHBondContact O-OG 2.98Å
30L50.1Low51.4Low159 Ų159117.8 Ų117.883%0.83268%0.682SS**THydrogen-bonded Turntrans-71.7-7.6175-88.8149.3000114.4Q28Q28-L30 VanDerWaalsContact C-N 3.34Å; Q28-L30 PolarHBondContact O-N 2.99Å
31S54.1Low51.6Low89 Ų89121.1 Ų121.162%0.62270%0.7SS**THydrogen-bonded Turntrans-90.7-4.8179.7-0.40000114.7Q28 I29Q28-S31 PolarHBondContact O-N 3.09Å; Q28-S31 PolarHBondContact O-OG 3.31Å; I29-S31 PolarHBondContact O-N 2.9Å
32S54.8Low52.2Low84 Ų84121.7 Ų121.759%0.58770%0.703SS**SBendtrans-113.7-2.5-169.857.50000116.1I29 S34I29-S32 PolarHBondContact O-OG 2.98Å; S32-S34 VanDerWaalsContact C-N 3.27Å; S32-S34 PolarHBondContact O-N 3.49Å
33L52.9Low52.4Low146 Ų146124.5 Ų124.576%0.76472%0.72SS**  trans-85.117177.6-83.397.4000114.8S35L33-S35 PolarHBondContact O-N 3.36Å
34S52.5Low52.6Low107 Ų107125.4 Ų125.475%0.74874%0.736SS**  trans-88.962.5179.564.60000113.2S32S32-S34 VanDerWaalsContact C-N 3.27Å; S32-S34 PolarHBondContact O-N 3.49Å
35S51.4Low53Low101 Ų101119.7 Ų119.771%0.70673%0.73SS**  trans-160.7145161.955.60000112.9L33L33-S35 PolarHBondContact O-N 3.36Å
36S56.9Low53.1Low118 Ų118123.9 Ų123.983%0.82574%0.743SS**  trans65.2135.8-175.875.40000115.9
37S60.6Low53.5Low110 Ų110124.6 Ų124.677%0.76975%0.75SS**  cis-153.5156.9-14.2-830000108.9
38P57.4Low53.9Low128 Ų128127.2 Ų127.283%0.83176%0.762SS**  trans-95.9127.8-171.335.2-32.6000114.7
39S55.1Low54.3Low104 Ų104125.6 Ų125.673%0.72776%0.762SS**  trans-166.9105.6155.535.60000109.5
40L53.2Low54.9Low162 Ų162125.4 Ų125.485%0.84877%0.766SS**  88.6129.1105.2-81.7160.5000114.7
41L52.6Low55.6Low163 Ų163126 Ų12685%0.85377%0.765SS**  trans75.182.6163.8-57.1161.5000118.7
42S59.5Low56.4Low116 Ų116126.4 Ų126.481%0.81176%0.763SS**  172.7145.1113.945.40000112.1S44S42-S44 PolarHBondContact O-N 2.99Å
43P55.4Low57.5Low117 Ų117125.8 Ų125.876%0.7675%0.753SS**  trans-83.4101.3-170.931.7-34000113.6S45P43-S45 PolarHBondContact O-N 2.77Å
44S50.6Low59Low120 Ų120122.6 Ų122.684%0.83974%0.74SS**  trans36.178.5130.763.50000117.9S42S42-S44 PolarHBondContact O-N 2.99Å
45S56.6Low60.8Low104 Ų104121.1 Ų121.173%0.72773%0.726SS**  trans-142.2154.1151.450.70000108.1P43P43-S45 PolarHBondContact O-N 2.77Å
46F46.9Very low62.6Low197 Ų197119.5 Ų119.586%0.86471%0.709SS**  trans73.195.8-168.7-77-113.6000117.3
47L53.5Low64.1Low147 Ų147118 Ų11877%0.7769%0.692SS**  179.346.6126.9-99.4167.4000113.1
48V57.5Low65.6Low149 Ų149118.3 Ų118.390%0.90368%0.681SS**  trans-111.757173.6-169.80000109.6
49V58Low67.4Low113 Ų113116 Ų11669%0.68566%0.664SS**SBendtrans-134.9-10.5-170.5-176.50000113.9
50T63Low69.2Low100 Ų100113.2 Ų113.261%0.61364%0.638SS**SBendtrans-106-7.3-169.850.50000116.4
51Q65.5Low71Confident171 Ų171107.2 Ų107.280%0.79961%0.608SS**Hα-helixtrans-83.4-26-172.9-165.7173.2-1.300114.4
52V69.9Low73.1Confident97 Ų97104 Ų10459%0.58859%0.591SS**Hα-helixtrans-74.8-40.4-174.3-178.40000112.1V54 T55V52-V54 VanDerWaalsContact C-N 3.28Å; V52-V54 PolarHBondContact O-N 3.1Å; V52-T55 PolarHBondContact O-N 3.47Å; V52-T55 PolarHBondContact O-OG1 3.4Å
53D78.2Confident74.7Confident71 Ų71100 Ų10038%0.3856%0.56SS.*Hα-helixtrans-63.3-32.1-175.6-68.54.4000113.3L57 N456D53-L57 PolarHBondContact O-N 3.43Å; D53-N456 PolarHBondContact OD2-ND2 3.24Å
54V85.3Confident76.5Confident80 Ų8097.2 Ų97.249%0.48554%0.536SS..Hα-helixtrans-68.2-38.7-177.5-176.60000111.3V52 Q58V52-V54 VanDerWaalsContact C-N 3.28Å; V52-V54 PolarHBondContact O-N 3.1Å; V54-Q58 WeakPolarHBondContact O-CG 3.45Å; V54-Q58 PolarHBondContact O-N 3.3Å; V54-Q58 VanDerWaalsContact O-N 3.15Å
55T90Very high78.5Confident75 Ų7591.9 Ų91.946%0.4650%0.498SS..Hα-helixtrans-69.1-40.4179.241.80000112.1V52 Q58 V59V52-T55 PolarHBondContact O-N 3.47Å; V52-T55 PolarHBondContact O-OG1 3.4Å; T55-Q58 PolarHBondContact O-N 3.38Å; T55-V59 WeakPolarHBondContact O-CG2 3.05Å; T55-V59 PolarHBondContact O-N 2.8Å
56D89.3Confident80.4Confident67 Ų6792.8 Ų92.836%0.35849%0.486SS..Hα-helixtrans-68.4-38.6-178.2-75.6-11.7000112.1V59 Y60 F459 Y464D56-V59 PolarHBondContact O-N 3.48Å; D56-Y60 WeakPolarHBondContact O-CB 3.42Å; D56-Y60 PolarHBondContact O-N 3.25Å; D56-F459 HydrophobicContact CB-CD2 4.31Å; D56-Y464 PolarHBondContact O-OH 3.44Å
57L88.2Confident82.7Confident88 Ų8887.1 Ų87.146%0.46147%0.465SS..Hα-helixtrans-64.2-43.6172.7179.463.7000111.9D53 Y60 V61 F459D53-L57 PolarHBondContact O-N 3.43Å; L57-Y60 PolarHBondContact O-N 3.41Å; L57-V61 HydrophobicContact CD1-CG2 4.32Å; L57-V61 WeakPolarHBondContact O-CG2 3.39Å; L57-V61 PolarHBondContact O-N 3.18Å; L57-F459 HydrophobicContact CB-CE2 4.38Å; L57-F459 HydrophobicContact CD1-CZ 3.98Å
58Q93Very high84.7Confident115 Ų11580.2 Ų80.254%0.53743%0.428SS..Hα-helixtrans-61.8-44.9176.6-75.9-1806.900111.7V54 T55 Y60 V61 I62V54-Q58 WeakPolarHBondContact O-CG 3.45Å; V54-Q58 PolarHBondContact O-N 3.3Å; V54-Q58 VanDerWaalsContact O-N 3.15Å; T55-Q58 PolarHBondContact O-N 3.38Å; Q58-Y60 VanDerWaalsContact C-N 3.33Å; Q58-Y60 PolarHBondContact O-N 3.07Å; Q58-V61 PolarHBondContact O-N 3.24Å; Q58-I62 WeakPolarHBondContact O-CB 3.48Å; Q58-I62 WeakPolarHBondContact O-CD1 3.45Å; Q58-I62 VanDerWaalsContact O-CG1 3.25Å; Q58-I62 WeakPolarHBondContact O-CG1 3.44Å; Q58-I62 PolarHBondContact O-N 2.94Å
59V93.6Very high86.5Confident79 Ų7974.7 Ų74.748%0.47939%0.393SS..Hα-helixtrans-60.4-43.3175.6171.60000110.9T55 D56 I62 L63 Y464T55-V59 WeakPolarHBondContact O-CG2 3.05Å; T55-V59 PolarHBondContact O-N 2.8Å; D56-V59 PolarHBondContact O-N 3.48Å; V59-I62 PolarHBondContact O-N 3.28Å; V59-L63 WeakPolarHBondContact O-CB 3.34Å; V59-L63 PolarHBondContact O-N 2.84Å; V59-Y464 HydrophobicContact CG1-CE1 4.37Å
60Y92.6Very high88.4Confident47 Ų4772.4 Ų72.418%0.18438%0.381CS..Hα-helixtrans-60.8-46.9176.1179-93.3000112.5D56 L57 Q58 I62 L63 K64 D463D56-Y60 WeakPolarHBondContact O-CB 3.42Å; D56-Y60 PolarHBondContact O-N 3.25Å; L57-Y60 PolarHBondContact O-N 3.41Å; Q58-Y60 VanDerWaalsContact C-N 3.33Å; Q58-Y60 PolarHBondContact O-N 3.07Å; Y60-I62 PolarHBondContact O-N 3.4Å; Y60-L63 PolarHBondContact O-N 3.25Å; Y60-K64 HydrophobicContact CE1-CB 4.43Å; Y60-K64 HydrophobicContact CE1-CD 3.79Å; Y60-K64 VanDerWaalsContact O-CB 3.25Å; Y60-K64 WeakPolarHBondContact O-CB 3.26Å; Y60-K64 PolarHBondContact O-N 3.14Å; Y60-D463 HydrophobicContact CE2-CB 4.15Å; Y60-D463 WeakPolarHBondContact CE2-O 3.17Å
61V92.6Very high90Very high36 Ų3669.2 Ų69.222%0.21836%0.36CS..Hα-helixtrans-62.8-43.1178.6168.50000111.5L57 Q58 H65 Y66L57-V61 HydrophobicContact CD1-CG2 4.32Å; L57-V61 WeakPolarHBondContact O-CG2 3.39Å; L57-V61 PolarHBondContact O-N 3.18Å; Q58-V61 PolarHBondContact O-N 3.24Å; V61-H65 PolarHBondContact O-CD2 3.06Å; V61-H65 PolarHBondContact O-N 3.41Å; V61-Y66 HydrophobicContact CG1-CD2 4.42Å; V61-Y66 HydrophobicContact CG1-CE2 4.08Å
62I95.1Very high91.5Very high95 Ų9561 Ų6149%0.48732%0.322SS..Iπ-helixtrans-62.4-46.1175.7-68.4165.2000110.8Q58 V59 Y60 Y66 L67Q58-I62 WeakPolarHBondContact O-CB 3.48Å; Q58-I62 WeakPolarHBondContact O-CD1 3.45Å; Q58-I62 VanDerWaalsContact O-CG1 3.25Å; Q58-I62 WeakPolarHBondContact O-CG1 3.44Å; Q58-I62 PolarHBondContact O-N 2.94Å; V59-I62 PolarHBondContact O-N 3.28Å; Y60-I62 PolarHBondContact O-N 3.4Å; I62-Y66 PolarHBondContact O-N 2.89Å; I62-Y66 VanDerWaalsContact O-N 3.15Å; I62-L67 PolarHBondContact O-N 3.27Å
63L94.6Very high92.8Very high31 Ų3160.8 Ų60.816%0.16232%0.316CS..Iπ-helixtrans-68.4-36.2-178.7-175.365.6000112.9V59 Y60 L67 P68 Y464 P467 I468 I471V59-L63 WeakPolarHBondContact O-CB 3.34Å; V59-L63 PolarHBondContact O-N 2.84Å; Y60-L63 PolarHBondContact O-N 3.25Å; L63-L67 HydrophobicContact CD1-CD2 3.99Å; L63-P68 WeakPolarHBondContact O-CD 3.49Å; L63-Y464 HydrophobicContact CD2-CD1 3.95Å; L63-P467 HydrophobicContact CD2-CG 3.89Å; L63-P467 HydrophobicContact CG-CB 4.13Å; L63-P467 HydrophobicContact CG-CG 3.99Å; L63-I468 HydrophobicContact CD1-CG1 4.44Å; L63-I468 HydrophobicContact CD2-CG1 4.15Å; L63-I471 HydrophobicContact CD1-CD1 3.88Å
64K93.2Very high93.7Very high60 Ų6061.2 Ų61.226%0.26132%0.321SS..Iπ-helixtrans-80.3-40.7-178-175.5-177.8165.3-151.20113.2Y60 P68 D119 P467Y60-K64 HydrophobicContact CE1-CB 4.43Å; Y60-K64 HydrophobicContact CE1-CD 3.79Å; Y60-K64 VanDerWaalsContact O-CB 3.25Å; Y60-K64 WeakPolarHBondContact O-CB 3.26Å; Y60-K64 PolarHBondContact O-N 3.14Å; K64-P68 WeakPolarHBondContact O-CG 3.45Å; K64-D119 VanDerWaalsContact CE-OD2 3.29Å; K64-D119 WeakPolarHBondContact CE-OD2 3.27Å; K64-D119 IonicContact NZ-OD2 3.39Å; K64-D119 PolarHBondContact NZ-OD2 3.14Å; K64-P467 HydrophobicContact CB-CB 4.41Å
65H93.1Very high94.3Very high7 Ų757.4 Ų57.43%0.03230%0.298CS..Iπ-helixtrans-111.9-50.6-170.8-54.1-68000113.1V61 I69 D119 F120V61-H65 PolarHBondContact O-CD2 3.06Å; V61-H65 PolarHBondContact O-N 3.41Å; H65-I69 WeakPolarHBondContact O-CD1 3.47Å; H65-I69 VanDerWaalsContact O-CG1 3.3Å; H65-I69 WeakPolarHBondContact O-CG1 3.23Å; H65-D119 IonicContact CE1-OD1 2.91Å; H65-D119 PolarHBondContact CE1-OD1 3.32Å; H65-D119 IonicContact CE1-OD2 3.41Å; H65-D119 PolarHBondContact CE1-OD2 2.94Å; H65-D119 IonicContact ND1-OD1 2.92Å; H65-D119 PolarHBondContact ND1-OD1 2.93Å; H65-F120 HydrophobicContact CB-CB 4.3Å; H65-F120 WeakPolarHBondContact ND1-CB 3.37Å
66Y94.6Very high94.6Very high123 Ų12355.5 Ų55.548%0.48229%0.285SS..Iπ-helixtrans-76.7-37.4-171.2-70.4-92.1000113.3V61 I62 P70 F121V61-Y66 HydrophobicContact CG1-CD2 4.42Å; V61-Y66 HydrophobicContact CG1-CE2 4.08Å; I62-Y66 PolarHBondContact O-N 2.89Å; I62-Y66 VanDerWaalsContact O-N 3.15Å; Y66-P70 WeakPolarHBondContact O-CD 3.42Å; Y66-F121 HydrophobicContact CE1-CZ 4.37Å
67L96.3Very high95Very high79 Ų7957.1 Ų57.141%0.41429%0.293SS..THydrogen-bonded Turntrans-74.9-40.4-178.3-171.760.5000114.5I62 L63 P70 I71 I471I62-L67 PolarHBondContact O-N 3.27Å; L63-L67 HydrophobicContact CD1-CD2 3.99Å; L67-P70 WeakPolarHBondContact O-CD 3.43Å; L67-P70 WeakPolarHBondContact O-CG 2.84Å; L67-I71 HydrophobicContact CD1-CD1 4.32Å; L67-I71 HydrophobicContact CG-CD1 4.17Å; L67-I71 WeakPolarHBondContact O-CD1 3.33Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; L67-I471 HydrophobicContact CD2-CD1 3.82Å; L67-I471 HydrophobicContact CG-CD1 4.17Å
68P95.8Very high95.4Very high1 Ų153.9 Ų53.91%0.00628%0.277CS..Hα-helixtrans-70.9-35.4-176.3-23.937.5000114.2L63 K64 I71 F72 I471L63-P68 WeakPolarHBondContact O-CD 3.49Å; K64-P68 WeakPolarHBondContact O-CG 3.45Å; P68-I71 WeakPolarHBondContact O-CB 3.36Å; P68-I71 PolarHBondContact O-N 3.03Å; P68-I71 VanDerWaalsContact O-N 3.16Å; P68-F72 HydrophobicContact CB-CD2 3.95Å; P68-F72 HydrophobicContact CB-CE2 3.5Å; P68-F72 HydrophobicContact CB-CZ 4.32Å; P68-F72 WeakPolarHBondContact O-CD2 3.39Å; P68-F72 WeakPolarHBondContact O-CG 3.46Å; P68-F72 PolarHBondContact O-N 2.76Å; P68-I471 HydrophobicContact CB-CG1 4.38Å; P68-I471 HydrophobicContact CG-CD1 4.25Å; P68-I471 HydrophobicContact CG-CG1 3.91Å
69I95.5Very high95.5Very high33 Ų3348.9 Ų48.917%0.16925%0.254CS..Hα-helixtrans-53.5-55.5-176.8-65.7166.2000113.5H65 I71 F72 I73 M118 F121H65-I69 WeakPolarHBondContact O-CD1 3.47Å; H65-I69 VanDerWaalsContact O-CG1 3.3Å; H65-I69 WeakPolarHBondContact O-CG1 3.23Å; I69-I71 VanDerWaalsContact C-N 3.27Å; I69-I71 PolarHBondContact O-N 3.4Å; I69-F72 PolarHBondContact O-N 2.99Å; I69-I73 HydrophobicContact CG2-CD1 3.99Å; I69-I73 WeakPolarHBondContact O-CG1 3.39Å; I69-I73 PolarHBondContact O-N 3.33Å; I69-M118 HydrophobicContact CD1-SD 3.47Å; I69-M118 WeakPolarHBondContact CD1-SD 3.41Å; I69-M118 HydrophobicContact CG1-SD 3.93Å; I69-F121 HydrophobicContact CD1-CD2 4.22Å; I69-F121 HydrophobicContact CD1-CE2 3.69Å
70P96.7Very high95.7Very high66 Ų6648.3 Ų48.343%0.42925%0.248SC..Hα-helixtrans-64.1-32.8179.225.1-34.7000112.4Y66 L67 I73 V74Y66-P70 WeakPolarHBondContact O-CD 3.42Å; L67-P70 WeakPolarHBondContact O-CD 3.43Å; L67-P70 WeakPolarHBondContact O-CG 2.84Å; P70-I73 PolarHBondContact O-N 3.38Å; P70-V74 WeakPolarHBondContact O-CG2 3.48Å; P70-V74 PolarHBondContact O-N 3.13Å; P70-V74 VanDerWaalsContact O-N 3.1Å
71I97.1Very high95.8Very high32 Ų3248.5 Ų48.516%0.16425%0.254CS..Hα-helixtrans-64.4-51175.6-58.6174.8000109.2L67 P68 I69 I73 V74 S75 I471 A474 L475L67-I71 HydrophobicContact CD1-CD1 4.32Å; L67-I71 HydrophobicContact CG-CD1 4.17Å; L67-I71 WeakPolarHBondContact O-CD1 3.33Å; L67-I71 WeakPolarHBondContact O-CG1 3.35Å; P68-I71 WeakPolarHBondContact O-CB 3.36Å; P68-I71 PolarHBondContact O-N 3.03Å; P68-I71 VanDerWaalsContact O-N 3.16Å; I69-I71 VanDerWaalsContact C-N 3.27Å; I69-I71 PolarHBondContact O-N 3.4Å; I71-I73 VanDerWaalsContact C-N 3.3Å; I71-I73 PolarHBondContact O-N 3.01Å; I71-V74 PolarHBondContact O-N 2.7Å; I71-V74 VanDerWaalsContact O-N 3.1Å; I71-S75 PolarHBondContact O-N 3.04Å; I71-S75 PolarHBondContact O-OG 2.92Å; I71-I471 HydrophobicContact CD1-CG2 3.77Å; I71-A474 HydrophobicContact CG2-CB 3.74Å; I71-L475 HydrophobicContact CG2-CD2 4.16Å; I71-L475 HydrophobicContact CG2-CG 4.48Å
72F97.2Very high95.8Very high0 Ų047.2 Ų47.20%025%0.246CC..Hα-helixtrans-56.2-40.8176.3-71.2-53.7000113.1P68 I69 S75 I76 L110 L113 C114 V470 A474P68-F72 HydrophobicContact CB-CD2 3.95Å; P68-F72 HydrophobicContact CB-CE2 3.5Å; P68-F72 HydrophobicContact CB-CZ 4.32Å; P68-F72 WeakPolarHBondContact O-CD2 3.39Å; P68-F72 WeakPolarHBondContact O-CG 3.46Å; P68-F72 PolarHBondContact O-N 2.76Å; I69-F72 PolarHBondContact O-N 2.99Å; F72-S75 PolarHBondContact O-N 3.31Å; F72-I76 VanDerWaalsContact O-CB 3.31Å; F72-I76 WeakPolarHBondContact O-CB 3.31Å; F72-I76 WeakPolarHBondContact O-CD1 3.17Å; F72-I76 WeakPolarHBondContact O-CG1 3.3Å; F72-I76 PolarHBondContact O-N 2.78Å; F72-L110 HydrophobicContact CD1-CD2 4.04Å; F72-L110 HydrophobicContact CE1-CD2 4.2Å; F72-L113 HydrophobicContact CE1-CB 3.7Å; F72-L113 HydrophobicContact CE1-CD1 4.26Å; F72-L113 HydrophobicContact CZ-CB 3.66Å; F72-C114 HydrophobicContact CB-CB 4.16Å; F72-C114 HydrophobicContact CD2-CB 4.08Å; F72-C114 HydrophobicContact CG-CB 4.07Å; F72-V470 HydrophobicContact CE2-CG1 4.39Å; F72-V470 HydrophobicContact CZ-CG1 3.7Å; F72-A474 HydrophobicContact CD1-CB 3.84Å; F72-A474 HydrophobicContact CE1-CB 3.67Å; F72-A474 HydrophobicContact CZ-CB 4.48Å
73I97Very high95.8Very high92 Ų9244.5 Ų44.547%0.47223%0.233SC..Hα-helixtrans-61.6-46.7176.9-67.6166.2000110.6I69 P70 I71 L77I69-I73 HydrophobicContact CG2-CD1 3.99Å; I69-I73 WeakPolarHBondContact O-CG1 3.39Å; I69-I73 PolarHBondContact O-N 3.33Å; P70-I73 PolarHBondContact O-N 3.38Å; I71-I73 VanDerWaalsContact C-N 3.3Å; I71-I73 PolarHBondContact O-N 3.01Å; I73-L77 HydrophobicContact CG2-CD1 4.16Å; I73-L77 VanDerWaalsContact O-CG 3.26Å; I73-L77 WeakPolarHBondContact O-CG 3.34Å; I73-L77 PolarHBondContact O-N 3.46Å; I73-L77 VanDerWaalsContact O-N 3.1Å
74V97Very high95.7Very high80 Ų8046.4 Ų46.449%0.48524%0.242SC..Hα-helixtrans-62.2-47176.1172.60000110.8P70 I71 I76 L77 C78P70-V74 WeakPolarHBondContact O-CG2 3.48Å; P70-V74 PolarHBondContact O-N 3.13Å; P70-V74 VanDerWaalsContact O-N 3.1Å; I71-V74 PolarHBondContact O-N 2.7Å; I71-V74 VanDerWaalsContact O-N 3.1Å; V74-I76 PolarHBondContact O-N 2.79Å; V74-L77 WeakPolarHBondContact O-CB 3.36Å; V74-L77 PolarHBondContact O-N 3.25Å; V74-C78 PolarHBondContact O-N 2.72Å
75S97.2Very high95.6Very high0 Ų043.6 Ų43.60%023%0.23CC..Hα-helixtrans-64.8-41-178.5-46.20000112.9I71 F72 L77 C78 I79 A474 D478I71-S75 PolarHBondContact O-N 3.04Å; I71-S75 PolarHBondContact O-OG 2.92Å; F72-S75 PolarHBondContact O-N 3.31Å; S75-L77 VanDerWaalsContact C-N 3.35Å; S75-L77 PolarHBondContact O-N 3.05Å; S75-C78 PolarHBondContact O-N 3.5Å; S75-I79 WeakPolarHBondContact O-CG1 3.29Å; S75-I79 PolarHBondContact O-N 3.16Å; S75-A474 PolarHBondContact OG-O 3.5Å; S75-D478 WeakPolarHBondContact CA-OD1 3.47Å; S75-D478 WeakPolarHBondContact CB-OD1 3.15Å; S75-D478 VanDerWaalsContact OG-CG 3.29Å; S75-D478 PolarHBondContact OG-OD1 3.45Å; S75-D478 PolarHBondContact OG-OD2 2.91Å
76I97.9Very high95.5Very high34 Ų3444.5 Ų44.517%0.17424%0.236CC..Hα-helixtrans-60.5-44.7173.5-72.6166.5000110.3F72 V74 C78 I79 L80 L107 L110 I111F72-I76 VanDerWaalsContact O-CB 3.31Å; F72-I76 WeakPolarHBondContact O-CB 3.31Å; F72-I76 WeakPolarHBondContact O-CD1 3.17Å; F72-I76 WeakPolarHBondContact O-CG1 3.3Å; F72-I76 PolarHBondContact O-N 2.78Å; V74-I76 PolarHBondContact O-N 2.79Å; I76-C78 PolarHBondContact O-N 2.77Å; I76-I79 PolarHBondContact O-N 3.33Å; I76-L80 HydrophobicContact CG2-CD1 3.88Å; I76-L80 HydrophobicContact CG2-CG 4.4Å; I76-L80 WeakPolarHBondContact O-CB 3.44Å; I76-L80 VanDerWaalsContact O-CG 3.26Å; I76-L80 WeakPolarHBondContact O-CG 3.42Å; I76-L80 PolarHBondContact O-N 3.37Å; I76-L107 HydrophobicContact CG1-CD1 4.34Å; I76-L107 HydrophobicContact CG2-CD1 3.98Å; I76-L110 HydrophobicContact CD1-CB 4.42Å; I76-L110 HydrophobicContact CG1-CB 3.92Å; I76-L110 HydrophobicContact CG1-CD1 3.98Å; I76-I111 HydrophobicContact CD1-CG1 4.17Å
77L96.8Very high95.4Very high102 Ų10243 Ų4353%0.53424%0.239SC..Hα-helixtrans-63-41.5176.1-70.3170.4000112.2I73 V74 S75 L80 V81I73-L77 HydrophobicContact CG2-CD1 4.16Å; I73-L77 VanDerWaalsContact O-CG 3.26Å; I73-L77 WeakPolarHBondContact O-CG 3.34Å; I73-L77 PolarHBondContact O-N 3.46Å; I73-L77 VanDerWaalsContact O-N 3.1Å; V74-L77 WeakPolarHBondContact O-CB 3.36Å; V74-L77 PolarHBondContact O-N 3.25Å; S75-L77 VanDerWaalsContact C-N 3.35Å; S75-L77 PolarHBondContact O-N 3.05Å; L77-L80 PolarHBondContact O-N 3.03Å; L77-V81 WeakPolarHBondContact O-CB 3.44Å; L77-V81 VanDerWaalsContact O-CG2 3.31Å; L77-V81 WeakPolarHBondContact O-CG2 3.5Å; L77-V81 PolarHBondContact O-N 2.97Å
78C96.4Very high95.1Very high19 Ų1945.6 Ų45.613%0.12825%0.25CC..Hα-helixtrans-62.4-43175.6-81.40000112.6V74 S75 I76 T82 F481V74-C78 PolarHBondContact O-N 2.72Å; S75-C78 PolarHBondContact O-N 3.5Å; I76-C78 PolarHBondContact O-N 2.77Å; C78-T82 PolarHBondContact O-N 3.11Å; C78-T82 PolarHBondContact O-OG1 3.43Å; C78-F481 HydrophobicContact CB-CB 4.21Å; C78-F481 HydrophobicContact CB-CD1 3.85Å; C78-F481 HydrophobicContact CB-CE1 4.35Å; C78-F481 HydrophobicContact CB-CG 3.99Å; C78-F481 WeakPolarHBondContact SG-CD1 3.43Å
79I96.2Very high94.6Very high11 Ų1149.5 Ų49.56%0.05626%0.264CS..Hα-helixtrans-65.3-45.2173.9-64-178.6000111.1S75 I76 V81 T82 L83 A103 D106 L107 L110S75-I79 WeakPolarHBondContact O-CG1 3.29Å; S75-I79 PolarHBondContact O-N 3.16Å; I76-I79 PolarHBondContact O-N 3.33Å; I79-V81 PolarHBondContact O-N 3.46Å; I79-T82 CarbonylContact O-C 3.58Å; I79-T82 WeakPolarHBondContact O-CA 3.29Å; I79-T82 VanDerWaalsContact O-CB 3.28Å; I79-T82 WeakPolarHBondContact O-CB 3.38Å; I79-T82 PolarHBondContact O-N 3.39Å; I79-L83 PolarHBondContact O-N 3.41Å; I79-A103 HydrophobicContact CG2-CB 4.16Å; I79-A103 VanDerWaalsContact CG2-O 3.31Å; I79-A103 WeakPolarHBondContact CG2-O 3.5Å; I79-D106 HydrophobicContact CD1-CB 3.92Å; I79-L107 HydrophobicContact CG2-CB 4.02Å; I79-L110 HydrophobicContact CD1-CD1 3.5Å; I79-L110 VanDerWaalsContact CD1-CD1 3.5Å; I79-L110 HydrophobicContact CD1-CG 4.21Å; I79-L110 HydrophobicContact CG1-CD1 4.37Å
80L96.5Very high93.8Very high66 Ų6650.1 Ų50.135%0.34628%0.279SS..Hα-helixtrans-60.8-43.1178.9-72.9171.7000112I76 L77 T82 L83 I84 L107I76-L80 HydrophobicContact CG2-CD1 3.88Å; I76-L80 HydrophobicContact CG2-CG 4.4Å; I76-L80 WeakPolarHBondContact O-CB 3.44Å; I76-L80 VanDerWaalsContact O-CG 3.26Å; I76-L80 WeakPolarHBondContact O-CG 3.42Å; I76-L80 PolarHBondContact O-N 3.37Å; L77-L80 PolarHBondContact O-N 3.03Å; L80-T82 VanDerWaalsContact C-N 3.29Å; L80-T82 PolarHBondContact O-N 3.08Å; L80-L83 PolarHBondContact O-N 3.1Å; L80-I84 WeakPolarHBondContact O-CB 3.34Å; L80-I84 WeakPolarHBondContact O-CD1 3.24Å; L80-I84 VanDerWaalsContact O-CG1 3.23Å; L80-I84 WeakPolarHBondContact O-CG1 3.44Å; L80-I84 PolarHBondContact O-N 3.42Å; L80-L107 HydrophobicContact CD2-CD2 4.06Å
81V94.1Very high92.6Very high51 Ų5150.3 Ų50.331%0.30928%0.276SS..Hα-helixtrans-61.1-39.7173.2167.80000111.2L77 I79 A85 F481 L495L77-V81 WeakPolarHBondContact O-CB 3.44Å; L77-V81 VanDerWaalsContact O-CG2 3.31Å; L77-V81 WeakPolarHBondContact O-CG2 3.5Å; L77-V81 PolarHBondContact O-N 2.97Å; I79-V81 PolarHBondContact O-N 3.46Å; V81-A85 VanDerWaalsContact O-CB 3.25Å; V81-A85 WeakPolarHBondContact O-CB 3.42Å; V81-A85 PolarHBondContact O-N 2.98Å; V81-F481 HydrophobicContact CG1-CE2 4.12Å; V81-F481 HydrophobicContact CG1-CZ 4.34Å; V81-L495 HydrophobicContact CG1-CD1 3.43Å; V81-L495 VanDerWaalsContact CG1-CD1 3.43Å
82T93.3Very high91.6Very high10 Ų1058.4 Ų58.46%0.06131%0.305CS..Hα-helixtrans-61.3-51.5174.5-54.80000111.6C78 I79 L80 I84 A85 V86 F481 F491C78-T82 PolarHBondContact O-N 3.11Å; C78-T82 PolarHBondContact O-OG1 3.43Å; I79-T82 CarbonylContact O-C 3.58Å; I79-T82 WeakPolarHBondContact O-CA 3.29Å; I79-T82 VanDerWaalsContact O-CB 3.28Å; I79-T82 WeakPolarHBondContact O-CB 3.38Å; I79-T82 PolarHBondContact O-N 3.39Å; L80-T82 VanDerWaalsContact C-N 3.29Å; L80-T82 PolarHBondContact O-N 3.08Å; T82-I84 VanDerWaalsContact C-N 3.33Å; T82-I84 PolarHBondContact O-N 3.38Å; T82-A85 PolarHBondContact O-N 3.41Å; T82-V86 HydrophobicContact CG2-CG2 4.23Å; T82-V86 WeakPolarHBondContact O-CB 3.35Å; T82-V86 VanDerWaalsContact O-CG2 3.24Å; T82-V86 WeakPolarHBondContact O-CG2 3.31Å; T82-V86 PolarHBondContact O-N 3.41Å; T82-F481 WeakPolarHBondContact OG1-CD2 3.35Å; T82-F491 HydrophobicContact CG2-CE2 4.03Å; T82-F491 HydrophobicContact CG2-CZ 4.22Å
83L94.5Very high91Very high38 Ų3866.1 Ų66.120%0.19933%0.334CS..Hα-helixtrans-59.1-43.3-179.6-172.265.7000111.4I79 L80 T87 I100 I104I79-L83 PolarHBondContact O-N 3.41Å; L80-L83 PolarHBondContact O-N 3.1Å; L83-T87 VanDerWaalsContact O-CB 3.23Å; L83-T87 WeakPolarHBondContact O-CB 3.29Å; L83-T87 PolarHBondContact O-N 3.01Å; L83-T87 PolarHBondContact O-OG1 2.87Å; L83-I100 HydrophobicContact CD1-CG2 3.99Å; L83-I104 HydrophobicContact CD1-CG1 4.19Å
84I93.4Very high90.4Very high71 Ų7163.3 Ų63.336%0.36432%0.321SS..Hα-helixtrans-63.4-51.1175.4-67.8164.6000111L80 T82 V86 T87 Q88 I498L80-I84 WeakPolarHBondContact O-CB 3.34Å; L80-I84 WeakPolarHBondContact O-CD1 3.24Å; L80-I84 VanDerWaalsContact O-CG1 3.23Å; L80-I84 WeakPolarHBondContact O-CG1 3.44Å; L80-I84 PolarHBondContact O-N 3.42Å; T82-I84 VanDerWaalsContact C-N 3.33Å; T82-I84 PolarHBondContact O-N 3.38Å; I84-V86 VanDerWaalsContact C-N 3.29Å; I84-V86 PolarHBondContact O-N 3.35Å; I84-T87 PolarHBondContact O-N 2.8Å; I84-Q88 HydrophobicContact CG2-CG 4.2Å; I84-Q88 WeakPolarHBondContact O-CB 3.28Å; I84-Q88 WeakPolarHBondContact O-CG 3.48Å; I84-Q88 PolarHBondContact O-N 3.45Å; I84-I498 HydrophobicContact CG2-CD1 4.35Å
85A91.6Very high90Very high1 Ų159.6 Ų59.61%0.00830%0.298CS..Hα-helixtrans-66.1-30.4-176.700000113.1V81 T82 R89 F491 A494 I498V81-A85 VanDerWaalsContact O-CB 3.25Å; V81-A85 WeakPolarHBondContact O-CB 3.42Å; V81-A85 PolarHBondContact O-N 2.98Å; T82-A85 PolarHBondContact O-N 3.41Å; A85-R89 VanDerWaalsContact O-CG 3.25Å; A85-R89 WeakPolarHBondContact O-CG 3.45Å; A85-F491 HydrophobicContact CB-CD2 4.19Å; A85-F491 HydrophobicContact CB-CE2 3.59Å; A85-F491 HydrophobicContact CB-CZ 3.91Å; A85-A494 HydrophobicContact CB-CB 4.44Å; A85-I498 HydrophobicContact CB-CD1 4Å
86V91.3Very high89.8Confident25 Ų2561 Ų6115%0.15231%0.307CS..Hα-helixtrans-75.1-44.9173.4172.30000111.2T82 I84 R89 V96 I100 F491T82-V86 HydrophobicContact CG2-CG2 4.23Å; T82-V86 WeakPolarHBondContact O-CB 3.35Å; T82-V86 VanDerWaalsContact O-CG2 3.24Å; T82-V86 WeakPolarHBondContact O-CG2 3.31Å; T82-V86 PolarHBondContact O-N 3.41Å; I84-V86 VanDerWaalsContact C-N 3.29Å; I84-V86 PolarHBondContact O-N 3.35Å; V86-R89 PolarHBondContact O-N 2.97Å; V86-V96 HydrophobicContact CG1-CG1 3.37Å; V86-I100 HydrophobicContact CG1-CD1 3.9Å; V86-I100 HydrophobicContact CG1-CG1 3.56Å; V86-F491 HydrophobicContact CG2-CD2 4.4Å; V86-F491 HydrophobicContact CG2-CE2 4.15Å
87T91.7Very high89.5Confident91 Ų9161.8 Ų61.856%0.55831%0.314SS*.Hα-helixtrans-67.8-45.1-178.2-56.90000112.2L83 I84 R89L83-T87 VanDerWaalsContact O-CB 3.23Å; L83-T87 WeakPolarHBondContact O-CB 3.29Å; L83-T87 PolarHBondContact O-N 3.01Å; L83-T87 PolarHBondContact O-OG1 2.87Å; I84-T87 PolarHBondContact O-N 2.8Å; T87-R89 PolarHBondContact O-N 2.97Å
88Q90.3Very high89.4Confident134 Ų13457.2 Ų57.263%0.62629%0.289SS*.THydrogen-bonded Turntrans-61.5-17179.5-75.9-175.4-0.700114.2I84I84-Q88 HydrophobicContact CG2-CG 4.2Å; I84-Q88 WeakPolarHBondContact O-CB 3.28Å; I84-Q88 WeakPolarHBondContact O-CG 3.48Å; I84-Q88 PolarHBondContact O-N 3.45Å
89R84.2Confident89.3Confident83 Ų8357.4 Ų57.431%0.31329%0.289SS..THydrogen-bonded Turntrans-82.4-15.7-170.3-95.8-80.2169.567.7-9.8114.7A85 V86 T87 L91 R490 A494A85-R89 VanDerWaalsContact O-CG 3.25Å; A85-R89 WeakPolarHBondContact O-CG 3.45Å; V86-R89 PolarHBondContact O-N 2.97Å; T87-R89 PolarHBondContact O-N 2.97Å; R89-L91 HydrophobicContact CB-CB 4.4Å; R89-L91 HydrophobicContact CB-CD1 4.09Å; R89-L91 HydrophobicContact CB-CG 4.05Å; R89-L91 HydrophobicContact CG-CD1 4.36Å; R89-L91 PolarHBondContact O-N 3.2Å; R89-R490 PolarHBondContact NH1-O 3.03Å; R89-R490 PolarHBondContact NH2-O 3.04Å; R89-A494 VanDerWaalsContact NH1-CB 3.33Å; R89-A494 VanDerWaalsContact NH2-N 3.18Å
90G79.3Confident89.2Confident47 Ų4759.2 Ų59.249%0.48530%0.298SS..THydrogen-bonded Turntrans5618.3-175.600000113.6W92G90-W92 VanDerWaalsContact C-N 3.26Å; G90-W92 PolarHBondContact O-N 2.8Å
91L71.6Confident89.2Confident70 Ų7057.5 Ų57.537%0.36629%0.29SS..  trans-80.278.6-177.8-74.5173.8000108.7R89 R93 V96R89-L91 HydrophobicContact CB-CB 4.4Å; R89-L91 HydrophobicContact CB-CD1 4.09Å; R89-L91 HydrophobicContact CB-CG 4.05Å; R89-L91 HydrophobicContact CG-CD1 4.36Å; R89-L91 PolarHBondContact O-N 3.2Å; L91-R93 PolarHBondContact O-N 3.1Å; L91-V96 HydrophobicContact CB-CG2 4.46Å; L91-V96 WeakPolarHBondContact O-CB 3.27Å; L91-V96 WeakPolarHBondContact O-CG2 3.43Å
92W76.8Confident89.3Confident202 Ų20256 Ų5677%0.76528%0.28SS*.  trans-63.721174.5-61.3101.9000114.4G90 T94G90-W92 VanDerWaalsContact C-N 3.26Å; G90-W92 PolarHBondContact O-N 2.8Å; W92-T94 PolarHBondContact O-N 3.4Å
93R83.5Confident89.4Confident162 Ų16256.1 Ų56.161%0.61128%0.282SS*.  trans-62.9128.4169.3-177.3178.1-68.8-170.6-3.8107.9L91 T95 V96L91-R93 PolarHBondContact O-N 3.1Å; R93-T95 VanDerWaalsContact C-N 3.25Å; R93-T95 PolarHBondContact O-N 3.32Å; R93-V96 HydrophobicContact CB-CG2 4.31Å; R93-V96 WeakPolarHBondContact O-CB 3.31Å; R93-V96 WeakPolarHBondContact O-CG2 3.26Å; R93-V96 PolarHBondContact O-N 2.99Å
94T84.9Confident89.6Confident32 Ų3257.2 Ų57.220%0.19629%0.288CS..Hα-helixtrans-46.7-40.2-171.351.70000115.6W92 V96 T97 E163 R182W92-T94 PolarHBondContact O-N 3.4Å; T94-V96 PolarHBondContact O-N 3.47Å; T94-T97 PolarHBondContact O-N 3.1Å; T94-E163 PolarHBondContact OG1-OE1 3.47Å; T94-R182 VanDerWaalsContact CB-CZ 3.46Å; T94-R182 VanDerWaalsContact CB-NH1 3.28Å; T94-R182 VanDerWaalsContact CG2-CZ 3.45Å; T94-R182 PolarHBondContact OG1-NH1 3.29Å
95T89.3Confident89.8Confident2 Ų254.4 Ų54.41%0.01227%0.274CS..Hα-helixtrans-67.2-22.4179.2-36.70000114R93 T97 Y98 I99 I160 E163 R164R93-T95 VanDerWaalsContact C-N 3.25Å; R93-T95 PolarHBondContact O-N 3.32Å; T95-T97 VanDerWaalsContact C-N 3.27Å; T95-T97 PolarHBondContact O-N 3.09Å; T95-Y98 PolarHBondContact O-N 2.93Å; T95-I99 HydrophobicContact CG2-CD1 4.28Å; T95-I99 WeakPolarHBondContact O-CG1 3.16Å; T95-I99 PolarHBondContact O-N 3.29Å; T95-I99 VanDerWaalsContact O-N 3.09Å; T95-I160 HydrophobicContact CG2-CG2 4.21Å; T95-E163 VanDerWaalsContact CA-OE2 3.29Å; T95-E163 WeakPolarHBondContact CA-OE2 3.25Å; T95-E163 WeakPolarHBondContact CB-OE2 3.32Å; T95-E163 WeakPolarHBondContact CG2-OE2 3.39Å; T95-E163 VanDerWaalsContact OG1-CD 3.23Å; T95-E163 PolarHBondContact OG1-OE1 3.03Å; T95-E163 VanDerWaalsContact OG1-OE1 3.13Å; T95-E163 PolarHBondContact OG1-OE2 3.31Å; T95-R164 VanDerWaalsContact CG2-NH2 3.29Å; T95-R164 PolarHBondContact OG1-NH1 2.9Å
96V91.3Very high90Very high29 Ų2955.4 Ų55.418%0.17628%0.279CS..Hα-helixtrans-64-34.6176.9174.80000110.9V86 L91 R93 T94 Y98 I99 I100V86-V96 HydrophobicContact CG1-CG1 3.37Å; L91-V96 HydrophobicContact CB-CG2 4.46Å; L91-V96 WeakPolarHBondContact O-CB 3.27Å; L91-V96 WeakPolarHBondContact O-CG2 3.43Å; R93-V96 HydrophobicContact CB-CG2 4.31Å; R93-V96 WeakPolarHBondContact O-CB 3.31Å; R93-V96 WeakPolarHBondContact O-CG2 3.26Å; R93-V96 PolarHBondContact O-N 2.99Å; T94-V96 PolarHBondContact O-N 3.47Å; V96-Y98 PolarHBondContact O-N 2.93Å; V96-I99 PolarHBondContact O-N 3.08Å; V96-I100 HydrophobicContact CG1-CD1 3.82Å; V96-I100 HydrophobicContact CG1-CG1 4.21Å; V96-I100 VanDerWaalsContact O-CG1 3.3Å; V96-I100 WeakPolarHBondContact O-CG1 3.4Å; V96-I100 PolarHBondContact O-N 3.03Å
97T93.5Very high90.3Very high52 Ų5255.3 Ų55.332%0.31928%0.278SS..Hα-helixtrans-62.1-43175.4-520000111.7T94 T95 I100 V101 I186T94-T97 PolarHBondContact O-N 3.1Å; T95-T97 VanDerWaalsContact C-N 3.27Å; T95-T97 PolarHBondContact O-N 3.09Å; T97-I100 PolarHBondContact O-N 3.31Å; T97-V101 WeakPolarHBondContact O-CG2 3.48Å; T97-V101 PolarHBondContact O-N 3.01Å; T97-V101 VanDerWaalsContact O-N 3.1Å; T97-I186 HydrophobicContact CG2-CD1 3.88Å
98Y94.8Very high90.6Very high6 Ų656.7 Ų56.72%0.02428%0.276CS..Hα-helixtrans-65.1-41.1175.3-60.7-63.5000112.1T95 V96 V101 L102 L159 I160 E163 R182 I186T95-Y98 PolarHBondContact O-N 2.93Å; V96-Y98 PolarHBondContact O-N 2.93Å; Y98-V101 PolarHBondContact O-N 3.37Å; Y98-L102 VanDerWaalsContact O-CB 3.3Å; Y98-L102 WeakPolarHBondContact O-CB 3.39Å; Y98-L102 PolarHBondContact O-N 2.94Å; Y98-L159 HydrophobicContact CD1-CD2 4Å; Y98-L159 HydrophobicContact CD1-CG 4.39Å; Y98-L159 HydrophobicContact CE1-CD2 3.42Å; Y98-L159 VanDerWaalsContact CE1-CD2 3.42Å; Y98-L159 HydrophobicContact CE1-CG 3.86Å; Y98-I160 VanDerWaalsContact CB-CG1 3.46Å; Y98-I160 HydrophobicContact CD2-CG1 4.46Å; Y98-I160 HydrophobicContact CG-CG1 4.12Å; Y98-E163 WeakPolarHBondContact CD2-OE2 3.28Å; Y98-E163 HydrophobicContact CE2-CB 4.36Å; Y98-E163 HydrophobicContact CE2-CG 4.2Å; Y98-E163 WeakPolarHBondContact CE2-OE2 3.3Å; Y98-R182 WeakPolarHBondContact OH-CB 3.27Å; Y98-I186 HydrophobicContact CD1-CD1 3.54Å; Y98-I186 HydrophobicContact CD1-CG1 3.48Å; Y98-I186 VanDerWaalsContact CD1-CG1 3.48Å; Y98-I186 HydrophobicContact CE1-CD1 3.72Å; Y98-I186 HydrophobicContact CE1-CG1 3.4Å; Y98-I186 VanDerWaalsContact CE1-CG1 3.4Å; Y98-I186 HydrophobicContact CG-CD1 4.48Å
99I93.5Very high91Very high23 Ų2350.7 Ų50.712%0.11825%0.248CC..Hα-helixtrans-64.7-39.2178.2-65.5166.3000111.4T95 V96 A103 Y484T95-I99 HydrophobicContact CG2-CD1 4.28Å; T95-I99 WeakPolarHBondContact O-CG1 3.16Å; T95-I99 PolarHBondContact O-N 3.29Å; T95-I99 VanDerWaalsContact O-N 3.09Å; V96-I99 PolarHBondContact O-N 3.08Å; I99-A103 VanDerWaalsContact O-CB 3.31Å; I99-A103 WeakPolarHBondContact O-CB 3.41Å; I99-A103 PolarHBondContact O-N 3.09Å; I99-Y484 HydrophobicContact CD1-CE1 4.08Å
100I94.8Very high91.6Very high48 Ų4847 Ų4725%0.24624%0.235CC..Hα-helixtrans-62.4-48.5174.6-71.2167.8000110.6L83 V86 V96 T97 A103 I104L83-I100 HydrophobicContact CD1-CG2 3.99Å; V86-I100 HydrophobicContact CG1-CD1 3.9Å; V86-I100 HydrophobicContact CG1-CG1 3.56Å; V96-I100 HydrophobicContact CG1-CD1 3.82Å; V96-I100 HydrophobicContact CG1-CG1 4.21Å; V96-I100 VanDerWaalsContact O-CG1 3.3Å; V96-I100 WeakPolarHBondContact O-CG1 3.4Å; V96-I100 PolarHBondContact O-N 3.03Å; T97-I100 PolarHBondContact O-N 3.31Å; I100-A103 PolarHBondContact O-N 2.9Å; I100-I104 HydrophobicContact CG2-CD1 3.79Å; I100-I104 VanDerWaalsContact O-CG1 3.3Å; I100-I104 WeakPolarHBondContact O-CG1 3.27Å; I100-I104 PolarHBondContact O-N 3.05Å
101V96.4Very high92.4Very high31 Ų3147.9 Ų47.919%0.18823%0.228CC..Hα-helixtrans-66.5-40.4-179.1177.40000111.1T97 Y98 I104 V105 L156 I186 I190T97-V101 WeakPolarHBondContact O-CG2 3.48Å; T97-V101 PolarHBondContact O-N 3.01Å; T97-V101 VanDerWaalsContact O-N 3.1Å; Y98-V101 PolarHBondContact O-N 3.37Å; V101-I104 PolarHBondContact O-N 3.26Å; V101-V105 HydrophobicContact CG1-CG2 4.43Å; V101-V105 WeakPolarHBondContact O-CG2 3.29Å; V101-V105 PolarHBondContact O-N 3.43Å; V101-L156 HydrophobicContact CG1-CD1 3.84Å; V101-I186 HydrophobicContact CB-CG2 4.49Å; V101-I186 HydrophobicContact CG1-CG2 3.92Å; V101-I186 HydrophobicContact CG2-CD1 4.29Å; V101-I186 HydrophobicContact CG2-CG2 4.28Å; V101-I190 HydrophobicContact CG1-CD1 4.43Å
102L95.5Very high93.6Very high19 Ų1944.9 Ų44.910%0.09921%0.213CC..Hα-helixtrans-58.7-48.4173.3-178.363.8000111.2Y98 I104 V105 D106 S153 L156 I160Y98-L102 VanDerWaalsContact O-CB 3.3Å; Y98-L102 WeakPolarHBondContact O-CB 3.39Å; Y98-L102 PolarHBondContact O-N 2.94Å; L102-I104 VanDerWaalsContact C-N 3.28Å; L102-I104 PolarHBondContact O-N 3.34Å; L102-V105 PolarHBondContact O-N 2.93Å; L102-V105 VanDerWaalsContact O-N 3.16Å; L102-D106 WeakPolarHBondContact O-CB 3.38Å; L102-D106 VanDerWaalsContact O-CG 3.3Å; L102-D106 PolarHBondContact O-N 3.28Å; L102-S153 WeakPolarHBondContact CD1-OG 3.27Å; L102-L156 HydrophobicContact CD1-CB 4.25Å; L102-I160 HydrophobicContact CD2-CD1 3.87Å
103A95.9Very high94.6Very high12 Ų1235.6 Ų35.610%0.09918%0.178CC..Hα-helixtrans-61.4-33.8177.100000113.2I79 I99 I100 L107I79-A103 HydrophobicContact CG2-CB 4.16Å; I79-A103 VanDerWaalsContact CG2-O 3.31Å; I79-A103 WeakPolarHBondContact CG2-O 3.5Å; I99-A103 VanDerWaalsContact O-CB 3.31Å; I99-A103 WeakPolarHBondContact O-CB 3.41Å; I99-A103 PolarHBondContact O-N 3.09Å; I100-A103 PolarHBondContact O-N 2.9Å; A103-L107 VanDerWaalsContact O-CB 3.24Å; A103-L107 WeakPolarHBondContact O-CB 3.07Å; A103-L107 PolarHBondContact O-N 3.45Å
104I97.2Very high95.2Very high61 Ų6129.1 Ų29.131%0.31316%0.157SC..Hα-helixtrans-70.1-43.1174.4-69.3165.1000111L83 I100 V101 L102 L107 F108L83-I104 HydrophobicContact CD1-CG1 4.19Å; I100-I104 HydrophobicContact CG2-CD1 3.79Å; I100-I104 VanDerWaalsContact O-CG1 3.3Å; I100-I104 WeakPolarHBondContact O-CG1 3.27Å; I100-I104 PolarHBondContact O-N 3.05Å; V101-I104 PolarHBondContact O-N 3.26Å; L102-I104 VanDerWaalsContact C-N 3.28Å; L102-I104 PolarHBondContact O-N 3.34Å; I104-L107 WeakPolarHBondContact O-CB 3.31Å; I104-L107 PolarHBondContact O-N 3.33Å; I104-F108 HydrophobicContact CG2-CD2 3.79Å; I104-F108 HydrophobicContact CG2-CE2 3.56Å; I104-F108 WeakPolarHBondContact O-CD2 3.49Å; I104-F108 PolarHBondContact O-N 2.94Å
105V97.6Very high95.7Very high12 Ų1231.2 Ų31.27%0.07317%0.166CC..Hα-helixtrans-65.6-44.1177.6171.10000111.1V101 L102 L107 F108 T109 L149 I152 L156V101-V105 HydrophobicContact CG1-CG2 4.43Å; V101-V105 WeakPolarHBondContact O-CG2 3.29Å; V101-V105 PolarHBondContact O-N 3.43Å; L102-V105 PolarHBondContact O-N 2.93Å; L102-V105 VanDerWaalsContact O-N 3.16Å; V105-L107 VanDerWaalsContact C-N 3.34Å; V105-F108 PolarHBondContact O-N 3.08Å; V105-T109 WeakPolarHBondContact O-CB 3.35Å; V105-T109 PolarHBondContact O-N 3.4Å; V105-T109 PolarHBondContact O-OG1 2.8Å; V105-L149 HydrophobicContact CG1-CB 4.24Å; V105-L149 HydrophobicContact CG1-CD2 4.23Å; V105-L149 WeakPolarHBondContact CG1-O 3.37Å; V105-I152 HydrophobicContact CG1-CB 4.18Å; V105-I152 HydrophobicContact CG1-CG2 4.07Å; V105-I152 HydrophobicContact CG2-CG2 3.82Å; V105-L156 HydrophobicContact CG2-CD1 4.2Å
106D97.1Very high95.9Very high22 Ų2232.9 Ų32.912%0.11818%0.175CC..Hα-helixtrans-64.6-38.5175.8-66.1-18.7000110.6I79 L102 T109 L110 S153I79-D106 HydrophobicContact CD1-CB 3.92Å; L102-D106 WeakPolarHBondContact O-CB 3.38Å; L102-D106 VanDerWaalsContact O-CG 3.3Å; L102-D106 PolarHBondContact O-N 3.28Å; D106-T109 WeakPolarHBondContact O-CB 3.2Å; D106-T109 PolarHBondContact O-N 3.03Å; D106-L110 WeakPolarHBondContact O-CG 3.38Å; D106-L110 PolarHBondContact O-N 3.26Å; D106-S153 WeakPolarHBondContact OD1-CB 3.43Å; D106-S153 PolarHBondContact OD1-OG 3.26Å
107L97.6Very high96Very high24 Ų2432.1 Ų32.113%0.12617%0.171CC..Hα-helixtrans-59.8-48.5173.1179.862.7000112.3I76 I79 L80 A103 I104 V105 T109 L110 I111I76-L107 HydrophobicContact CG1-CD1 4.34Å; I76-L107 HydrophobicContact CG2-CD1 3.98Å; I79-L107 HydrophobicContact CG2-CB 4.02Å; L80-L107 HydrophobicContact CD2-CD2 4.06Å; A103-L107 VanDerWaalsContact O-CB 3.24Å; A103-L107 WeakPolarHBondContact O-CB 3.07Å; A103-L107 PolarHBondContact O-N 3.45Å; I104-L107 WeakPolarHBondContact O-CB 3.31Å; I104-L107 PolarHBondContact O-N 3.33Å; V105-L107 VanDerWaalsContact C-N 3.34Å; L107-T109 VanDerWaalsContact C-N 3.27Å; L107-T109 PolarHBondContact O-N 3.38Å; L107-L110 PolarHBondContact O-N 2.78Å; L107-I111 HydrophobicContact CD1-CD1 4Å; L107-I111 HydrophobicContact CD1-CG1 4.4Å; L107-I111 HydrophobicContact CG-CD1 3.92Å; L107-I111 VanDerWaalsContact O-CG1 3.3Å; L107-I111 WeakPolarHBondContact O-CG1 3.38Å; L107-I111 PolarHBondContact O-N 2.94Å
108F98Very high96Very high120 Ų12032.6 Ų32.653%0.52617%0.17SC..Hα-helixtrans-62.2-37.5175.3-78-63.3000111.7I104 V105 I111 S112 L149I104-F108 HydrophobicContact CG2-CD2 3.79Å; I104-F108 HydrophobicContact CG2-CE2 3.56Å; I104-F108 WeakPolarHBondContact O-CD2 3.49Å; I104-F108 PolarHBondContact O-N 2.94Å; V105-F108 PolarHBondContact O-N 3.08Å; F108-I111 PolarHBondContact O-N 3.37Å; F108-S112 WeakPolarHBondContact O-CB 3.19Å; F108-S112 PolarHBondContact O-N 3.15Å; F108-S112 PolarHBondContact O-OG 3.12Å; F108-S112 VanDerWaalsContact O-OG 3.1Å; F108-L149 HydrophobicContact CB-CD1 3.82Å; F108-L149 HydrophobicContact CB-CD2 4.29Å
109T97.3Very high95.9Very high7 Ų732.9 Ų32.94%0.04317%0.173CC..Hα-helixtrans-61.9-47.8176.3-520000111.2V105 D106 L107 S112 L113 V146 L149 L150V105-T109 WeakPolarHBondContact O-CB 3.35Å; V105-T109 PolarHBondContact O-N 3.4Å; V105-T109 PolarHBondContact O-OG1 2.8Å; D106-T109 WeakPolarHBondContact O-CB 3.2Å; D106-T109 PolarHBondContact O-N 3.03Å; L107-T109 VanDerWaalsContact C-N 3.27Å; L107-T109 PolarHBondContact O-N 3.38Å; T109-S112 PolarHBondContact O-N 3.48Å; T109-L113 HydrophobicContact CG2-CD1 4.07Å; T109-L113 WeakPolarHBondContact O-CB 3.2Å; T109-L113 WeakPolarHBondContact O-CG 3.29Å; T109-L113 PolarHBondContact O-N 2.81Å; T109-V146 HydrophobicContact CG2-CG1 4.35Å; T109-L149 WeakPolarHBondContact OG1-CB 3.29Å; T109-L150 HydrophobicContact CG2-CD2 3.78Å; T109-L150 HydrophobicContact CG2-CG 3.93Å
110L97.5Very high95.7Very high5 Ų536 Ų363%0.02619%0.185CC..Hα-helixtrans-63.8-39.9176.9-67.8-174.1000112.7F72 I76 I79 D106 L107 L113 C114 A474F72-L110 HydrophobicContact CD1-CD2 4.04Å; F72-L110 HydrophobicContact CE1-CD2 4.2Å; I76-L110 HydrophobicContact CD1-CB 4.42Å; I76-L110 HydrophobicContact CG1-CB 3.92Å; I76-L110 HydrophobicContact CG1-CD1 3.98Å; I79-L110 HydrophobicContact CD1-CD1 3.5Å; I79-L110 VanDerWaalsContact CD1-CD1 3.5Å; I79-L110 HydrophobicContact CD1-CG 4.21Å; I79-L110 HydrophobicContact CG1-CD1 4.37Å; D106-L110 WeakPolarHBondContact O-CG 3.38Å; D106-L110 PolarHBondContact O-N 3.26Å; L107-L110 PolarHBondContact O-N 2.78Å; L110-L113 PolarHBondContact O-N 3.38Å; L110-C114 WeakPolarHBondContact O-CB 3.34Å; L110-C114 PolarHBondContact O-N 2.96Å; L110-A474 HydrophobicContact CD2-CB 4.39Å
111I97.5Very high95.5Very high66 Ų6637.8 Ų37.834%0.33819%0.192SC..Hα-helixtrans-63.9-45.6177.3-69.4166.9000110.1I76 L107 F108 C114 I115I76-I111 HydrophobicContact CD1-CG1 4.17Å; L107-I111 HydrophobicContact CD1-CD1 4Å; L107-I111 HydrophobicContact CD1-CG1 4.4Å; L107-I111 HydrophobicContact CG-CD1 3.92Å; L107-I111 VanDerWaalsContact O-CG1 3.3Å; L107-I111 WeakPolarHBondContact O-CG1 3.38Å; L107-I111 PolarHBondContact O-N 2.94Å; F108-I111 PolarHBondContact O-N 3.37Å; I111-C114 PolarHBondContact O-N 3.36Å; I111-I115 HydrophobicContact CG2-CD1 4.04Å; I111-I115 WeakPolarHBondContact O-CG1 3.37Å; I111-I115 PolarHBondContact O-N 3.37Å
112S96.8Very high95.2Very high7 Ų738.9 Ų38.95%0.04920%0.196CC..Hα-helixtrans-64.9-41.5177.3-62.20000112.6F108 T109 I115 L116 V146F108-S112 WeakPolarHBondContact O-CB 3.19Å; F108-S112 PolarHBondContact O-N 3.15Å; F108-S112 PolarHBondContact O-OG 3.12Å; F108-S112 VanDerWaalsContact O-OG 3.1Å; T109-S112 PolarHBondContact O-N 3.48Å; S112-I115 PolarHBondContact O-N 3.34Å; S112-L116 WeakPolarHBondContact O-CG 3.47Å; S112-L116 PolarHBondContact O-N 3.3Å; S112-V146 VanDerWaalsContact CB-CG2 3.41Å
113L95.8Very high94.9Very high8 Ų842.4 Ų42.44%0.04221%0.214CC..Hα-helixtrans-63.8-40.9173.5-75.3172.5000112.3F72 T109 L110 I115 L116 S117 V146 V470 L473F72-L113 HydrophobicContact CE1-CB 3.7Å; F72-L113 HydrophobicContact CE1-CD1 4.26Å; F72-L113 HydrophobicContact CZ-CB 3.66Å; T109-L113 HydrophobicContact CG2-CD1 4.07Å; T109-L113 WeakPolarHBondContact O-CB 3.2Å; T109-L113 WeakPolarHBondContact O-CG 3.29Å; T109-L113 PolarHBondContact O-N 2.81Å; L110-L113 PolarHBondContact O-N 3.38Å; L113-I115 PolarHBondContact O-N 3.25Å; L113-L116 PolarHBondContact O-N 3.21Å; L113-S117 PolarHBondContact O-N 3.48Å; L113-S117 PolarHBondContact O-OG 2.96Å; L113-V146 HydrophobicContact CD2-CG1 3.89Å; L113-V146 HydrophobicContact CD2-CG2 4.31Å; L113-V146 HydrophobicContact CG-CG1 4.18Å; L113-V146 HydrophobicContact CG-CG2 4.23Å; L113-V470 HydrophobicContact CD2-CG1 4.45Å; L113-L473 HydrophobicContact CD1-CB 4.38Å; L113-L473 HydrophobicContact CD1-CD1 4.19Å
114C96.4Very high94.6Very high26 Ų2646.6 Ų46.618%0.17624%0.24CC..Hα-helixtrans-61.7-42.8176.3-174.70000111.5F72 L110 I111 L116 S117 M118F72-C114 HydrophobicContact CB-CB 4.16Å; F72-C114 HydrophobicContact CD2-CB 4.08Å; F72-C114 HydrophobicContact CG-CB 4.07Å; L110-C114 WeakPolarHBondContact O-CB 3.34Å; L110-C114 PolarHBondContact O-N 2.96Å; I111-C114 PolarHBondContact O-N 3.36Å; C114-L116 VanDerWaalsContact C-N 3.35Å; C114-L116 PolarHBondContact O-N 3.14Å; C114-S117 PolarHBondContact O-N 3.35Å; C114-M118 VanDerWaalsContact O-CG 3.24Å; C114-M118 WeakPolarHBondContact O-CG 3.44Å; C114-M118 PolarHBondContact O-N 2.86Å; C114-M118 VanDerWaalsContact O-N 3.14Å
115I95.6Very high94.3Very high75 Ų7547.4 Ų47.439%0.38526%0.256SS..Hα-helixtrans-62.4-41.8174.2-65.1162.9000111I111 S112 L113 S117 M118 L142I111-I115 HydrophobicContact CG2-CD1 4.04Å; I111-I115 WeakPolarHBondContact O-CG1 3.37Å; I111-I115 PolarHBondContact O-N 3.37Å; S112-I115 PolarHBondContact O-N 3.34Å; L113-I115 PolarHBondContact O-N 3.25Å; I115-S117 VanDerWaalsContact C-N 3.34Å; I115-S117 PolarHBondContact O-N 3.06Å; I115-M118 PolarHBondContact O-N 2.9Å; I115-L142 HydrophobicContact CB-CD1 4.15Å; I115-L142 HydrophobicContact CG2-CD1 3.52Å
116L93.9Very high93.9Very high38 Ų3849.9 Ų49.920%0.19927%0.268CS..Hα-helixtrans-66-31.2176.7-72.3168.2000113.4S112 L113 C114 E139 L142 V146S112-L116 WeakPolarHBondContact O-CG 3.47Å; S112-L116 PolarHBondContact O-N 3.3Å; L113-L116 PolarHBondContact O-N 3.21Å; C114-L116 VanDerWaalsContact C-N 3.35Å; C114-L116 PolarHBondContact O-N 3.14Å; L116-E139 HydrophobicContact CD2-CB 4.33Å; L116-E139 HydrophobicContact CD2-CG 3.83Å; L116-L142 HydrophobicContact CD1-CB 4.17Å; L116-L142 HydrophobicContact CD2-CB 3.89Å; L116-L142 HydrophobicContact CD2-CD1 4.38Å; L116-L142 HydrophobicContact CG-CB 4.03Å; L116-L142 HydrophobicContact CG-CD1 4.43Å; L116-V146 HydrophobicContact CD1-CG2 4.1Å
117S93.7Very high93.4Very high13 Ų1353 Ų539%0.09129%0.29CS..Hα-helixtrans-82.6-10.4175.5-650000114.5L113 C114 I115 D119L113-S117 PolarHBondContact O-N 3.48Å; L113-S117 PolarHBondContact O-OG 2.96Å; C114-S117 PolarHBondContact O-N 3.35Å; I115-S117 VanDerWaalsContact C-N 3.34Å; I115-S117 PolarHBondContact O-N 3.06Å; S117-D119 VanDerWaalsContact C-N 3.28Å
118M93.6Very high92.9Very high61 Ų6158.6 Ų58.630%0.332%0.315SS..THydrogen-bonded Turntrans-87.65174.9-73.3-70.1-67.400112.8I69 C114 I115 F120 F121 I122I69-M118 HydrophobicContact CD1-SD 3.47Å; I69-M118 WeakPolarHBondContact CD1-SD 3.41Å; I69-M118 HydrophobicContact CG1-SD 3.93Å; C114-M118 VanDerWaalsContact O-CG 3.24Å; C114-M118 WeakPolarHBondContact O-CG 3.44Å; C114-M118 PolarHBondContact O-N 2.86Å; C114-M118 VanDerWaalsContact O-N 3.14Å; I115-M118 PolarHBondContact O-N 2.9Å; M118-F120 VanDerWaalsContact C-N 3.28Å; M118-F120 PolarHBondContact O-N 3.04Å; M118-F121 HydrophobicContact CE-CB 3.98Å; M118-F121 HydrophobicContact CE-CD2 3.95Å; M118-F121 HydrophobicContact CE-CG 4.18Å; M118-F121 PolarHBondContact O-N 3.49Å; M118-F121 HydrophobicContact SD-CD2 3.85Å; M118-F121 HydrophobicContact SD-CE2 4.47Å; M118-I122 HydrophobicContact CB-CD1 3.75Å; M118-I122 HydrophobicContact CB-CG1 4.25Å; M118-I122 VanDerWaalsContact O-CG1 3.3Å; M118-I122 WeakPolarHBondContact O-CG1 2.85Å; M118-I122 PolarHBondContact O-N 3.32Å
119D92Very high92.1Very high13 Ų1355.7 Ų55.77%0.0732%0.319CS..Hα-helixtrans-45.2-47.3176.562.7-31000113.4K64 H65 S117 F121 I122 I123 Y135K64-D119 VanDerWaalsContact CE-OD2 3.29Å; K64-D119 WeakPolarHBondContact CE-OD2 3.27Å; K64-D119 IonicContact NZ-OD2 3.39Å; K64-D119 PolarHBondContact NZ-OD2 3.14Å; H65-D119 IonicContact CE1-OD1 2.91Å; H65-D119 PolarHBondContact CE1-OD1 3.32Å; H65-D119 IonicContact CE1-OD2 3.41Å; H65-D119 PolarHBondContact CE1-OD2 2.94Å; H65-D119 IonicContact ND1-OD1 2.92Å; H65-D119 PolarHBondContact ND1-OD1 2.93Å; S117-D119 VanDerWaalsContact C-N 3.28Å; D119-F121 VanDerWaalsContact C-N 3.27Å; D119-F121 PolarHBondContact O-N 2.95Å; D119-I122 PolarHBondContact O-N 3.4Å; D119-I123 HydrophobicContact CB-CD1 4.36Å; D119-I123 WeakPolarHBondContact O-CB 3.19Å; D119-I123 WeakPolarHBondContact O-CD1 3.46Å; D119-I123 VanDerWaalsContact O-CG1 3.26Å; D119-I123 WeakPolarHBondContact O-CG1 3Å; D119-I123 PolarHBondContact O-N 2.95Å; D119-Y135 HydrophobicContact CB-CE2 4.34Å; D119-Y135 WeakPolarHBondContact CB-OH 3.5Å
120F89.2Confident91.4Very high87 Ų8762.1 Ų62.138%0.38235%0.353SS..Hα-helixtrans-61.8-28.5178.5-175.5-96.6000114.6H65 M118 P124H65-F120 HydrophobicContact CB-CB 4.3Å; H65-F120 WeakPolarHBondContact ND1-CB 3.37Å; M118-F120 VanDerWaalsContact C-N 3.28Å; M118-F120 PolarHBondContact O-N 3.04Å; F120-P124 WeakPolarHBondContact O-CD 3.18Å; F120-P124 VanDerWaalsContact O-CG 3.31Å; F120-P124 WeakPolarHBondContact O-CG 3.08Å
121F91.4Very high90.7Very high87 Ų8765.7 Ų65.738%0.38237%0.368SS..Hα-helixtrans-91.4-28.8176.3-64.5-74.8000112.4Y66 I69 M118 D119 A125Y66-F121 HydrophobicContact CE1-CZ 4.37Å; I69-F121 HydrophobicContact CD1-CD2 4.22Å; I69-F121 HydrophobicContact CD1-CE2 3.69Å; M118-F121 HydrophobicContact CE-CB 3.98Å; M118-F121 HydrophobicContact CE-CD2 3.95Å; M118-F121 HydrophobicContact CE-CG 4.18Å; M118-F121 PolarHBondContact O-N 3.49Å; M118-F121 HydrophobicContact SD-CD2 3.85Å; M118-F121 HydrophobicContact SD-CE2 4.47Å; D119-F121 VanDerWaalsContact C-N 3.27Å; D119-F121 PolarHBondContact O-N 2.95Å; F121-A125 WeakPolarHBondContact O-CB 3.37Å
122I90.4Very high90.2Very high54 Ų5467.5 Ų67.528%0.27738%0.382SS..Hα-helixtrans-76.3-43.6-178.9-68.7166.5000110.7M118 D119 A125 L126 Y135M118-I122 HydrophobicContact CB-CD1 3.75Å; M118-I122 HydrophobicContact CB-CG1 4.25Å; M118-I122 VanDerWaalsContact O-CG1 3.3Å; M118-I122 WeakPolarHBondContact O-CG1 2.85Å; M118-I122 PolarHBondContact O-N 3.32Å; D119-I122 PolarHBondContact O-N 3.4Å; I122-A125 PolarHBondContact O-N 2.91Å; I122-L126 HydrophobicContact CG2-CD1 3.71Å; I122-L126 WeakPolarHBondContact O-CD1 3.49Å; I122-L126 WeakPolarHBondContact O-CG 3.18Å; I122-Y135 HydrophobicContact CG2-CD2 4.05Å; I122-Y135 HydrophobicContact CG2-CE2 4.32Å
123I89.3Confident89.8Confident92 Ų9276 Ų7647%0.47241%0.413SS..G310 helixtrans-60.4-48.8-174.9-68.5163.3000112.5D119 A125 Y135D119-I123 HydrophobicContact CB-CD1 4.36Å; D119-I123 WeakPolarHBondContact O-CB 3.19Å; D119-I123 WeakPolarHBondContact O-CD1 3.46Å; D119-I123 VanDerWaalsContact O-CG1 3.26Å; D119-I123 WeakPolarHBondContact O-CG1 3Å; D119-I123 PolarHBondContact O-N 2.95Å; I123-A125 VanDerWaalsContact C-N 3.28Å; I123-A125 PolarHBondContact O-N 3.25Å; I123-Y135 HydrophobicContact CD1-CE1 4.11Å; I123-Y135 HydrophobicContact CG1-CD1 4.37Å; I123-Y135 HydrophobicContact CG1-CD2 4.44Å; I123-Y135 HydrophobicContact CG1-CE1 4.34Å; I123-Y135 HydrophobicContact CG1-CE2 4.41Å; I123-Y135 HydrophobicContact CG1-CG 4.46Å
124P89.6Confident89.6Confident101 Ų10179.1 Ų79.166%0.65643%0.432SS*.G310 helixtrans-74.2-15.1-179.6-16.932.9000114.3F120 L126F120-P124 WeakPolarHBondContact O-CD 3.18Å; F120-P124 VanDerWaalsContact O-CG 3.31Å; F120-P124 WeakPolarHBondContact O-CG 3.08Å; P124-L126 VanDerWaalsContact C-N 3.29Å; P124-L126 PolarHBondContact O-N 3.46Å
125A90.1Very high89.3Confident78 Ų7879.4 Ų79.465%0.64543%0.43SS*.G310 helixtrans-85.20.4-177.500000113.6F121 I122 I123F121-A125 WeakPolarHBondContact O-CB 3.37Å; I122-A125 PolarHBondContact O-N 2.91Å; I123-A125 VanDerWaalsContact C-N 3.28Å; I123-A125 PolarHBondContact O-N 3.25Å
126L88.3Confident89Confident63 Ų6382.3 Ų82.333%0.3344%0.44SS..SBendtrans-120.3138.2-171.4-66.2168.9000111.2I122 P124 F131I122-L126 HydrophobicContact CG2-CD1 3.71Å; I122-L126 WeakPolarHBondContact O-CD1 3.49Å; I122-L126 WeakPolarHBondContact O-CG 3.18Å; P124-L126 VanDerWaalsContact C-N 3.29Å; P124-L126 PolarHBondContact O-N 3.46Å; L126-F131 HydrophobicContact CB-CB 3.87Å; L126-F131 HydrophobicContact CB-CD1 3.92Å; L126-F131 HydrophobicContact CB-CD2 4.38Å; L126-F131 HydrophobicContact CB-CG 3.78Å; L126-F131 HydrophobicContact CD1-CB 4.32Å; L126-F131 HydrophobicContact CD1-CD1 3.95Å; L126-F131 HydrophobicContact CD1-CG 4.43Å; L126-F131 HydrophobicContact CD2-CD1 3.7Å; L126-F131 HydrophobicContact CD2-CE1 3.74Å; L126-F131 HydrophobicContact CD2-CG 4.42Å; L126-F131 HydrophobicContact CD2-CZ 4.48Å; L126-F131 HydrophobicContact CG-CD1 4.07Å; L126-F131 HydrophobicContact CG-CG 4.43Å
127P88.2Confident88.9Confident88 Ų8885.2 Ų85.257%0.57146%0.455SS*.  trans-54.9149.4179.6-27.233000114.7F131P127-F131 HydrophobicContact CB-CD2 4.13Å; P127-F131 HydrophobicContact CB-CE2 3.94Å; P127-F131 HydrophobicContact CG-CD2 4.41Å; P127-F131 HydrophobicContact CG-CE2 3.87Å; P127-F131 WeakPolarHBondContact O-CD2 3.36Å
128E86.5Confident88.8Confident141 Ų14188.6 Ų88.666%0.65947%0.471SS*.THydrogen-bonded Turntrans-66.2142-178.4-62.5174.1-149.600112.1N20N20-E128 PolarHBondContact ND2-OE1 2.92Å
129G80.7Confident88.8Confident59 Ų5989.5 Ų89.561%0.60848%0.475SS*.THydrogen-bonded Turntrans108.1-79.2171.700000115.8T132G129-T132 PolarHBondContact O-OG1 3.43Å
130L82.7Confident88.8Confident143 Ų14390.7 Ų90.775%0.74948%0.483SS*.THydrogen-bonded Turntrans-74.7-27.4-172.6-71.3176.3000113.7
131F84Confident89Confident80 Ų8090.4 Ų90.435%0.35148%0.484SS..Hα-helixtrans-76.8-27.4-167.6-73.7-88000114.1L126 P127 R133 V134 Y135L126-F131 HydrophobicContact CB-CB 3.87Å; L126-F131 HydrophobicContact CB-CD1 3.92Å; L126-F131 HydrophobicContact CB-CD2 4.38Å; L126-F131 HydrophobicContact CB-CG 3.78Å; L126-F131 HydrophobicContact CD1-CB 4.32Å; L126-F131 HydrophobicContact CD1-CD1 3.95Å; L126-F131 HydrophobicContact CD1-CG 4.43Å; L126-F131 HydrophobicContact CD2-CD1 3.7Å; L126-F131 HydrophobicContact CD2-CE1 3.74Å; L126-F131 HydrophobicContact CD2-CG 4.42Å; L126-F131 HydrophobicContact CD2-CZ 4.48Å; L126-F131 HydrophobicContact CG-CD1 4.07Å; L126-F131 HydrophobicContact CG-CG 4.43Å; P127-F131 HydrophobicContact CB-CD2 4.13Å; P127-F131 HydrophobicContact CB-CE2 3.94Å; P127-F131 HydrophobicContact CG-CD2 4.41Å; P127-F131 HydrophobicContact CG-CE2 3.87Å; P127-F131 WeakPolarHBondContact O-CD2 3.36Å; F131-R133 VanDerWaalsContact C-N 3.33Å; F131-R133 PolarHBondContact O-N 2.95Å; F131-V134 PolarHBondContact O-N 3.32Å; F131-Y135 WeakPolarHBondContact O-CB 3.44Å; F131-Y135 PolarHBondContact O-N 3.06Å
132T86.9Confident89.2Confident103 Ų10387.5 Ų87.563%0.63247%0.472SS*.Hα-helixtrans-60.2-42.2176.255.90000112G129 F136G129-T132 PolarHBondContact O-OG1 3.43Å; T132-F136 VanDerWaalsContact O-CB 3.29Å; T132-F136 WeakPolarHBondContact O-CB 3.45Å; T132-F136 PolarHBondContact O-N 3.17Å
133R87.9Confident89.4Confident185 Ų18586.3 Ų86.370%0.69847%0.474SS*.Hα-helixtrans-67.8-38.8176.9-177-179-73.5-171.8-0112.4F131 L137F131-R133 VanDerWaalsContact C-N 3.33Å; F131-R133 PolarHBondContact O-N 2.95Å; R133-L137 WeakPolarHBondContact O-CB 3.38Å; R133-L137 PolarHBondContact O-N 3.45Å
134V90.4Very high89.6Confident74 Ų7483 Ų8345%0.44846%0.456SS..Hα-helixtrans-72.5-44.6178.6175.80000110.7F131 L137 I138F131-V134 PolarHBondContact O-N 3.32Å; V134-L137 WeakPolarHBondContact O-CB 3.44Å; V134-L137 PolarHBondContact O-N 3.39Å; V134-I138 HydrophobicContact CG1-CD1 3.8Å; V134-I138 HydrophobicContact CG1-CG1 4.44Å; V134-I138 WeakPolarHBondContact O-CG1 3.46Å; V134-I138 PolarHBondContact O-N 3.42Å
135Y91Very high89.9Confident33 Ų3381.4 Ų81.413%0.12944%0.442CS..Hα-helixtrans-58.7-50.7175.7175.1-92.3000111D119 I122 I123 F131 L137 I138 E139D119-Y135 HydrophobicContact CB-CE2 4.34Å; D119-Y135 WeakPolarHBondContact CB-OH 3.5Å; I122-Y135 HydrophobicContact CG2-CD2 4.05Å; I122-Y135 HydrophobicContact CG2-CE2 4.32Å; I123-Y135 HydrophobicContact CD1-CE1 4.11Å; I123-Y135 HydrophobicContact CG1-CD1 4.37Å; I123-Y135 HydrophobicContact CG1-CD2 4.44Å; I123-Y135 HydrophobicContact CG1-CE1 4.34Å; I123-Y135 HydrophobicContact CG1-CE2 4.41Å; I123-Y135 HydrophobicContact CG1-CG 4.46Å; F131-Y135 WeakPolarHBondContact O-CB 3.44Å; F131-Y135 PolarHBondContact O-N 3.06Å; Y135-L137 VanDerWaalsContact C-N 3.28Å; Y135-L137 PolarHBondContact O-N 3.35Å; Y135-I138 CarbonylContact O-C 3.6Å; Y135-I138 PolarHBondContact O-N 3.37Å; Y135-E139 HydrophobicContact CE1-CB 4.24Å; Y135-E139 VanDerWaalsContact CE1-OE2 3.22Å; Y135-E139 WeakPolarHBondContact CE1-OE2 3.39Å; Y135-E139 WeakPolarHBondContact O-CB 3.42Å; Y135-E139 PolarHBondContact O-N 3.08Å
136F89.9Confident90.1Very high136 Ų13677.9 Ų77.960%0.59641%0.412SS*.Hα-helixtrans-58.3-38.8176.6-178.3-96.9000112.4T132 T140T132-F136 VanDerWaalsContact O-CB 3.29Å; T132-F136 WeakPolarHBondContact O-CB 3.45Å; T132-F136 PolarHBondContact O-N 3.17Å; F136-T140 WeakPolarHBondContact O-CB 3.47Å; F136-T140 PolarHBondContact O-N 3.14Å; F136-T140 PolarHBondContact O-OG1 3.23Å
137L91.2Very high90.4Very high99 Ų9975.1 Ų75.152%0.51840%0.398SS..Hα-helixtrans-65.6-42.5174.6-179.165.5000112R133 V134 Y135 T140 I141R133-L137 WeakPolarHBondContact O-CB 3.38Å; R133-L137 PolarHBondContact O-N 3.45Å; V134-L137 WeakPolarHBondContact O-CB 3.44Å; V134-L137 PolarHBondContact O-N 3.39Å; Y135-L137 VanDerWaalsContact C-N 3.28Å; Y135-L137 PolarHBondContact O-N 3.35Å; L137-T140 PolarHBondContact O-N 3.24Å; L137-I141 HydrophobicContact CD1-CD1 3.94Å; L137-I141 HydrophobicContact CD1-CG1 4.38Å; L137-I141 HydrophobicContact CG-CD1 3.87Å; L137-I141 WeakPolarHBondContact O-CB 3.48Å; L137-I141 VanDerWaalsContact O-CG1 3.24Å; L137-I141 WeakPolarHBondContact O-CG1 3.39Å; L137-I141 PolarHBondContact O-N 3.34Å
138I92.6Very high90.8Very high83 Ų8371.4 Ų71.443%0.42637%0.373SS..Hα-helixtrans-65.1-47.7177-71.2168.9000110.7V134 Y135 T140 I141 L142V134-I138 HydrophobicContact CG1-CD1 3.8Å; V134-I138 HydrophobicContact CG1-CG1 4.44Å; V134-I138 WeakPolarHBondContact O-CG1 3.46Å; V134-I138 PolarHBondContact O-N 3.42Å; Y135-I138 CarbonylContact O-C 3.6Å; Y135-I138 PolarHBondContact O-N 3.37Å; I138-T140 VanDerWaalsContact C-N 3.31Å; I138-T140 PolarHBondContact O-N 3.42Å; I138-I141 PolarHBondContact O-N 3.34Å; I138-L142 HydrophobicContact CG2-CD1 3.64Å; I138-L142 HydrophobicContact CG2-CG 4.16Å; I138-L142 VanDerWaalsContact O-CB 3.29Å; I138-L142 WeakPolarHBondContact O-CB 3.44Å; I138-L142 VanDerWaalsContact O-CG 3.3Å; I138-L142 WeakPolarHBondContact O-CG 3.29Å; I138-L142 PolarHBondContact O-N 3.28Å
139E93.2Very high91.3Very high81 Ų8165.6 Ų65.638%0.37935%0.347SS..Hα-helixtrans-56.2-47175.4-176.6-176.3-178.700110.9L116 Y135 L142 G143L116-E139 HydrophobicContact CD2-CB 4.33Å; L116-E139 HydrophobicContact CD2-CG 3.83Å; Y135-E139 HydrophobicContact CE1-CB 4.24Å; Y135-E139 VanDerWaalsContact CE1-OE2 3.22Å; Y135-E139 WeakPolarHBondContact CE1-OE2 3.39Å; Y135-E139 WeakPolarHBondContact O-CB 3.42Å; Y135-E139 PolarHBondContact O-N 3.08Å; E139-L142 PolarHBondContact O-N 3.44Å; E139-G143 PolarHBondContact O-N 3.03Å
140T91.6Very high92.1Very high37 Ų3763 Ų6323%0.22732%0.319CS..Hα-helixtrans-60.2-47.3177.1-630000112F136 L137 I138 E144 L204F136-T140 WeakPolarHBondContact O-CB 3.47Å; F136-T140 PolarHBondContact O-N 3.14Å; F136-T140 PolarHBondContact O-OG1 3.23Å; L137-T140 PolarHBondContact O-N 3.24Å; I138-T140 VanDerWaalsContact C-N 3.31Å; I138-T140 PolarHBondContact O-N 3.42Å; T140-E144 PolarHBondContact O-N 3.19Å; T140-L204 HydrophobicContact CG2-CD1 4.26Å; T140-L204 HydrophobicContact CG2-CD2 3.32Å; T140-L204 HydrophobicContact CG2-CG 3.78Å
141I94.1Very high92.7Very high82 Ų8256.2 Ų56.242%0.42128%0.283SS..Hα-helixtrans-67.3-43.4179-70.7167.8000111.2L137 I138 L145L137-I141 HydrophobicContact CD1-CD1 3.94Å; L137-I141 HydrophobicContact CD1-CG1 4.38Å; L137-I141 HydrophobicContact CG-CD1 3.87Å; L137-I141 WeakPolarHBondContact O-CB 3.48Å; L137-I141 VanDerWaalsContact O-CG1 3.24Å; L137-I141 WeakPolarHBondContact O-CG1 3.39Å; L137-I141 PolarHBondContact O-N 3.34Å; I138-I141 PolarHBondContact O-N 3.34Å; I141-L145 VanDerWaalsContact O-CB 3.23Å; I141-L145 WeakPolarHBondContact O-CB 3.38Å; I141-L145 PolarHBondContact O-N 2.91Å
142L94.9Very high93.3Very high25 Ų2552.8 Ų52.813%0.13127%0.269CS..Hα-helixtrans-66.8-37.7178.3-74.3176.7000111.8I115 L116 I138 E139 L145 V146I115-L142 HydrophobicContact CB-CD1 4.15Å; I115-L142 HydrophobicContact CG2-CD1 3.52Å; L116-L142 HydrophobicContact CD1-CB 4.17Å; L116-L142 HydrophobicContact CD2-CB 3.89Å; L116-L142 HydrophobicContact CD2-CD1 4.38Å; L116-L142 HydrophobicContact CG-CB 4.03Å; L116-L142 HydrophobicContact CG-CD1 4.43Å; I138-L142 HydrophobicContact CG2-CD1 3.64Å; I138-L142 HydrophobicContact CG2-CG 4.16Å; I138-L142 VanDerWaalsContact O-CB 3.29Å; I138-L142 WeakPolarHBondContact O-CB 3.44Å; I138-L142 VanDerWaalsContact O-CG 3.3Å; I138-L142 WeakPolarHBondContact O-CG 3.29Å; I138-L142 PolarHBondContact O-N 3.28Å; E139-L142 PolarHBondContact O-N 3.44Å; L142-L145 HydrophobicContact CD2-CD2 4.22Å; L142-L145 PolarHBondContact O-N 3.25Å; L142-V146 WeakPolarHBondContact O-CB 3.48Å; L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.38Å; L142-V146 PolarHBondContact O-N 3.31Å
143G93.4Very high93.8Very high29 Ų2947.9 Ų47.930%0.29924%0.239SC..Hα-helixtrans-60.4-50.9175.200000112.2E139 L145 V146 D147E139-G143 PolarHBondContact O-N 3.03Å; G143-L145 VanDerWaalsContact C-N 3.33Å; G143-L145 PolarHBondContact O-N 3.44Å; G143-V146 PolarHBondContact O-N 3.3Å; G143-D147 WeakPolarHBondContact O-CB 3.37Å; G143-D147 PolarHBondContact O-N 3.45Å
144E93.8Very high94.2Very high23 Ų2339.1 Ų39.111%0.10721%0.206CC..Hα-helixtrans-68.9-29.4176-66.1-62156.300112.7T140 T148 F201 L204 R419T140-E144 PolarHBondContact O-N 3.19Å; E144-T148 WeakPolarHBondContact O-CB 3.4Å; E144-T148 PolarHBondContact O-N 3.03Å; E144-T148 PolarHBondContact O-OG1 3.43Å; E144-F201 HydrophobicContact CB-CD1 4.26Å; E144-F201 HydrophobicContact CB-CE1 3.57Å; E144-F201 HydrophobicContact CB-CE2 3.88Å; E144-F201 HydrophobicContact CB-CZ 3.35Å; E144-F201 HydrophobicContact CG-CE1 4.36Å; E144-F201 HydrophobicContact CG-CZ 4.46Å; E144-L204 HydrophobicContact CG-CD2 3.69Å; E144-R419 VanDerWaalsContact CD-NH2 3.32Å; E144-R419 IonicContact OE1-CZ 3.3Å; E144-R419 IonicContact OE1-NH2 2.85Å; E144-R419 PolarHBondContact OE1-NH2 3.28Å; E144-R419 IonicContact OE2-NH2 2.68Å; E144-R419 PolarHBondContact OE2-NH2 3.42Å
145L95.7Very high94.5Very high68 Ų6838.1 Ų38.136%0.35619%0.194SC..Hα-helixtrans-65.9-46.3171.7179.564.2000111.6I141 L142 G143 D147 T148 L149I141-L145 VanDerWaalsContact O-CB 3.23Å; I141-L145 WeakPolarHBondContact O-CB 3.38Å; I141-L145 PolarHBondContact O-N 2.91Å; L142-L145 HydrophobicContact CD2-CD2 4.22Å; L142-L145 PolarHBondContact O-N 3.25Å; G143-L145 VanDerWaalsContact C-N 3.33Å; G143-L145 PolarHBondContact O-N 3.44Å; L145-D147 VanDerWaalsContact C-N 3.34Å; L145-D147 PolarHBondContact O-N 2.93Å; L145-T148 CarbonylContact O-C 3.58Å; L145-T148 WeakPolarHBondContact O-CB 3.33Å; L145-T148 PolarHBondContact O-N 2.9Å; L145-T148 VanDerWaalsContact O-N 3.09Å; L145-L149 HydrophobicContact CD1-CD1 4.27Å; L145-L149 HydrophobicContact CD1-CG 4.24Å; L145-L149 HydrophobicContact CG-CD1 3.96Å; L145-L149 HydrophobicContact CG-CG 4.37Å; L145-L149 VanDerWaalsContact O-CG 3.32Å; L145-L149 WeakPolarHBondContact O-CG 3.2Å; L145-L149 PolarHBondContact O-N 3.34Å
146V95.9Very high94.8Very high4 Ų436.6 Ų36.62%0.02419%0.188CC..Hα-helixtrans-59.1-46.5174.61650000110.3T109 S112 L113 L116 L142 G143 T148 L149 L150T109-V146 HydrophobicContact CG2-CG1 4.35Å; S112-V146 VanDerWaalsContact CB-CG2 3.41Å; L113-V146 HydrophobicContact CD2-CG1 3.89Å; L113-V146 HydrophobicContact CD2-CG2 4.31Å; L113-V146 HydrophobicContact CG-CG1 4.18Å; L113-V146 HydrophobicContact CG-CG2 4.23Å; L116-V146 HydrophobicContact CD1-CG2 4.1Å; L142-V146 WeakPolarHBondContact O-CB 3.48Å; L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.38Å; L142-V146 PolarHBondContact O-N 3.31Å; G143-V146 PolarHBondContact O-N 3.3Å; V146-T148 PolarHBondContact O-N 3.5Å; V146-L149 PolarHBondContact O-N 2.94Å; V146-L150 HydrophobicContact CG1-CD1 3.81Å; V146-L150 HydrophobicContact CG1-CG 4.33Å; V146-L150 WeakPolarHBondContact O-CB 3.35Å; V146-L150 VanDerWaalsContact O-CG 3.31Å; V146-L150 WeakPolarHBondContact O-CG 3.17Å; V146-L150 PolarHBondContact O-N 2.91Å
147D94.6Very high95Very high4 Ų431.1 Ų31.12%0.02117%0.166CC..Hα-helixtrans-57.4-36.5174.3-118.24.8000112G143 L145 L151 K197 Q228 F232 R419G143-D147 WeakPolarHBondContact O-CB 3.37Å; G143-D147 PolarHBondContact O-N 3.45Å; L145-D147 VanDerWaalsContact C-N 3.34Å; L145-D147 PolarHBondContact O-N 2.93Å; D147-L151 WeakPolarHBondContact O-CB 3.28Å; D147-L151 PolarHBondContact O-N 3.43Å; D147-K197 VanDerWaalsContact CG-NZ 3.27Å; D147-K197 IonicContact OD2-NZ 2.78Å; D147-K197 PolarHBondContact OD2-NZ 3.37Å; D147-Q228 PolarHBondContact OD1-NE2 3.34Å; D147-Q228 PolarHBondContact OD2-NE2 2.89Å; D147-Q228 PolarHBondContact OD2-OE1 3.23Å; D147-F232 WeakPolarHBondContact O-CE2 3.33Å; D147-R419 IonicContact OD2-CZ 3.73Å; D147-R419 VanDerWaalsContact OD2-CZ 3.3Å; D147-R419 IonicContact OD2-NH1 2.77Å; D147-R419 PolarHBondContact OD2-NH1 3.08Å; D147-R419 IonicContact OD2-NH2 2.68Å; D147-R419 PolarHBondContact OD2-NH2 3.38Å
148T96.5Very high95.3Very high10 Ų1026.9 Ų26.96%0.06114%0.144CC..Hα-helixtrans-75.6-41.9177.6-55.70000112E144 L145 V146 L151 I152 I194 K197E144-T148 WeakPolarHBondContact O-CB 3.4Å; E144-T148 PolarHBondContact O-N 3.03Å; E144-T148 PolarHBondContact O-OG1 3.43Å; L145-T148 CarbonylContact O-C 3.58Å; L145-T148 WeakPolarHBondContact O-CB 3.33Å; L145-T148 PolarHBondContact O-N 2.9Å; L145-T148 VanDerWaalsContact O-N 3.09Å; V146-T148 PolarHBondContact O-N 3.5Å; T148-L151 WeakPolarHBondContact O-CB 3.47Å; T148-L151 PolarHBondContact O-N 3.46Å; T148-I152 HydrophobicContact CG2-CD1 4.37Å; T148-I152 WeakPolarHBondContact O-CG1 3.05Å; T148-I152 PolarHBondContact O-N 2.85Å; T148-I194 HydrophobicContact CG2-CG1 4.28Å; T148-K197 HydrophobicContact CG2-CB 4.38Å; T148-K197 HydrophobicContact CG2-CG 4.39Å; T148-K197 WeakPolarHBondContact OG1-CB 3.21Å; T148-K197 WeakPolarHBondContact OG1-CG 3.35Å
149L97.2Very high95.4Very high20 Ų2024.4 Ų24.411%0.10513%0.131CC..Hα-helixtrans-66.9-40.8177.9-69.6169.3000111.6V105 F108 T109 L145 V146 L151 I152 S153V105-L149 HydrophobicContact CG1-CB 4.24Å; V105-L149 HydrophobicContact CG1-CD2 4.23Å; V105-L149 WeakPolarHBondContact CG1-O 3.37Å; F108-L149 HydrophobicContact CB-CD1 3.82Å; F108-L149 HydrophobicContact CB-CD2 4.29Å; T109-L149 WeakPolarHBondContact OG1-CB 3.29Å; L145-L149 HydrophobicContact CD1-CD1 4.27Å; L145-L149 HydrophobicContact CD1-CG 4.24Å; L145-L149 HydrophobicContact CG-CD1 3.96Å; L145-L149 HydrophobicContact CG-CG 4.37Å; L145-L149 VanDerWaalsContact O-CG 3.32Å; L145-L149 WeakPolarHBondContact O-CG 3.2Å; L145-L149 PolarHBondContact O-N 3.34Å; V146-L149 PolarHBondContact O-N 2.94Å; L149-L151 VanDerWaalsContact C-N 3.34Å; L149-L151 PolarHBondContact O-N 2.91Å; L149-I152 WeakPolarHBondContact O-CB 3.48Å; L149-I152 PolarHBondContact O-N 3.28Å; L149-S153 PolarHBondContact O-N 3.39Å
150L95.9Very high95.5Very high4 Ų421.3 Ų21.32%0.02112%0.117CC..Hα-helixtrans-63.6-39173.3-70.4169.2000111.7T109 V146 I152 S153 N154 F232 F411 L473T109-L150 HydrophobicContact CG2-CD2 3.78Å; T109-L150 HydrophobicContact CG2-CG 3.93Å; V146-L150 HydrophobicContact CG1-CD1 3.81Å; V146-L150 HydrophobicContact CG1-CG 4.33Å; V146-L150 WeakPolarHBondContact O-CB 3.35Å; V146-L150 VanDerWaalsContact O-CG 3.31Å; V146-L150 WeakPolarHBondContact O-CG 3.17Å; V146-L150 PolarHBondContact O-N 2.91Å; L150-I152 VanDerWaalsContact C-N 3.33Å; L150-I152 PolarHBondContact O-N 2.99Å; L150-S153 WeakPolarHBondContact O-CB 3.32Å; L150-S153 PolarHBondContact O-N 2.97Å; L150-N154 PolarHBondContact O-N 2.99Å; L150-N154 PolarHBondContact O-OD1 3.15Å; L150-F232 HydrophobicContact CB-CE2 3.85Å; L150-F232 HydrophobicContact CB-CZ 3.52Å; L150-F232 HydrophobicContact CD1-CZ 4.4Å; L150-F411 HydrophobicContact CD1-CD1 3.99Å; L150-F411 HydrophobicContact CD1-CE1 3.55Å; L150-F411 HydrophobicContact CD1-CZ 4.27Å; L150-L473 HydrophobicContact CD1-CD1 3.96Å; L150-L473 HydrophobicContact CD2-CD1 4.36Å; L150-L473 HydrophobicContact CD2-CD2 4.1Å
151L96.2Very high95.6Very high0 Ų019.7 Ų19.70%011%0.108CC..Hα-helixtrans-59.6-44.8173.4-178.663.4000111D147 T148 L149 N154 W155 I196 K197 F232D147-L151 WeakPolarHBondContact O-CB 3.28Å; D147-L151 PolarHBondContact O-N 3.43Å; T148-L151 WeakPolarHBondContact O-CB 3.47Å; T148-L151 PolarHBondContact O-N 3.46Å; L149-L151 VanDerWaalsContact C-N 3.34Å; L149-L151 PolarHBondContact O-N 2.91Å; L151-N154 PolarHBondContact O-N 3.37Å; L151-W155 VanDerWaalsContact O-CD1 3.25Å; L151-W155 PolarHBondContact O-N 3.02Å; L151-W155 VanDerWaalsContact O-N 3.11Å; L151-I196 HydrophobicContact CD2-CB 4.48Å; L151-I196 HydrophobicContact CD2-CG2 3.92Å; L151-K197 HydrophobicContact CD2-CG 4.11Å; L151-F232 HydrophobicContact CB-CD2 3.86Å; L151-F232 HydrophobicContact CB-CE2 3.99Å; L151-F232 HydrophobicContact CD1-CB 4.17Å; L151-F232 HydrophobicContact CD1-CD2 3.85Å; L151-F232 HydrophobicContact CD1-CG 4.26Å; L151-F232 HydrophobicContact CG-CD2 4.41Å
152I97.6Very high95.7Very high9 Ų917.8 Ų17.85%0.04610%0.1CC..Hα-helixtrans-61.4-46.1175-65.3165.5000110.8V105 T148 L149 L150 N154 W155 L156 I190V105-I152 HydrophobicContact CG1-CB 4.18Å; V105-I152 HydrophobicContact CG1-CG2 4.07Å; V105-I152 HydrophobicContact CG2-CG2 3.82Å; T148-I152 HydrophobicContact CG2-CD1 4.37Å; T148-I152 WeakPolarHBondContact O-CG1 3.05Å; T148-I152 PolarHBondContact O-N 2.85Å; L149-I152 WeakPolarHBondContact O-CB 3.48Å; L149-I152 PolarHBondContact O-N 3.28Å; L150-I152 VanDerWaalsContact C-N 3.33Å; L150-I152 PolarHBondContact O-N 2.99Å; I152-N154 VanDerWaalsContact C-N 3.28Å; I152-N154 PolarHBondContact O-N 2.84Å; I152-W155 PolarHBondContact O-N 3.26Å; I152-L156 HydrophobicContact CG2-CD1 3.7Å; I152-L156 HydrophobicContact CG2-CG 4.13Å; I152-L156 WeakPolarHBondContact O-CB 3.39Å; I152-L156 VanDerWaalsContact O-CG 3.27Å; I152-L156 WeakPolarHBondContact O-CG 3.39Å; I152-L156 PolarHBondContact O-N 2.98Å; I152-I190 HydrophobicContact CD1-CG2 4.33Å; I152-I190 HydrophobicContact CG2-CG1 4.03Å
153S96.2Very high95.7Very high0 Ų017.3 Ų17.30%010%0.097CC..Hα-helixtrans-56.5-40.6176.9-176.20000111.6L102 D106 L149 L150 T157 K476L102-S153 WeakPolarHBondContact CD1-OG 3.27Å; D106-S153 WeakPolarHBondContact OD1-CB 3.43Å; D106-S153 PolarHBondContact OD1-OG 3.26Å; L149-S153 PolarHBondContact O-N 3.39Å; L150-S153 WeakPolarHBondContact O-CB 3.32Å; L150-S153 PolarHBondContact O-N 2.97Å; S153-T157 WeakPolarHBondContact O-CB 3.11Å; S153-T157 PolarHBondContact O-N 3.06Å; S153-T157 PolarHBondContact O-OG1 3.2Å; S153-K476 PolarHBondContact OG-NZ 3.47Å
154N95.6Very high95.6Very high1 Ų119.2 Ų19.21%0.00510%0.095CC..Hα-helixtrans-65.1-51.6177.3-65.68.2000112L150 L151 I152 L156 T157 V158 F232 P236 F404 Q408L150-N154 PolarHBondContact O-N 2.99Å; L150-N154 PolarHBondContact O-OD1 3.15Å; L151-N154 PolarHBondContact O-N 3.37Å; I152-N154 VanDerWaalsContact C-N 3.28Å; I152-N154 PolarHBondContact O-N 2.84Å; N154-L156 PolarHBondContact O-N 2.87Å; N154-T157 WeakPolarHBondContact O-CB 3.25Å; N154-T157 PolarHBondContact O-N 3.16Å; N154-T157 VanDerWaalsContact O-N 3.13Å; N154-V158 WeakPolarHBondContact O-CG2 3.2Å; N154-V158 PolarHBondContact O-N 3.09Å; N154-F232 WeakPolarHBondContact ND2-CD1 3.3Å; N154-F232 WeakPolarHBondContact ND2-CE1 3.23Å; N154-F232 PolarHBondContact ND2-O 3.27Å; N154-P236 HydrophobicContact CB-CB 4.38Å; N154-F404 HydrophobicContact CB-CE2 4.23Å; N154-F404 HydrophobicContact CB-CZ 4.39Å; N154-F404 VanDerWaalsContact OD1-CE2 3.3Å; N154-F404 WeakPolarHBondContact OD1-CE2 3.38Å; N154-Q408 PolarHBondContact ND2-NE2 3.34Å; N154-Q408 VanDerWaalsContact OD1-CD 3.29Å; N154-Q408 PolarHBondContact OD1-NE2 3Å; N154-Q408 PolarHBondContact OD1-OE1 2.99Å; N154-Q408 VanDerWaalsContact OD1-OE1 3.12Å
155W97.7Very high95.6Very high53 Ų5320.6 Ų20.620%0.20110%0.1CC..Hα-helixtrans-68.1-33.5-178.7-77.1104.1000112.7L151 I152 V158 L159 V189 L231 I235 P236 I239L151-W155 VanDerWaalsContact O-CD1 3.25Å; L151-W155 PolarHBondContact O-N 3.02Å; L151-W155 VanDerWaalsContact O-N 3.11Å; I152-W155 PolarHBondContact O-N 3.26Å; W155-V158 PolarHBondContact O-N 3.5Å; W155-L159 WeakPolarHBondContact O-CB 3.33Å; W155-L159 PolarHBondContact O-N 3.16Å; W155-V189 HydrophobicContact CB-CG1 3.51Å; W155-V189 HydrophobicContact CB-CG2 4.46Å; W155-L231 HydrophobicContact CZ2-CD1 3.82Å; W155-I235 HydrophobicContact CH2-CG2 3.67Å; W155-I235 HydrophobicContact CZ2-CG2 4.11Å; W155-P236 HydrophobicContact CZ2-CG 4.04Å; W155-I239 HydrophobicContact CH2-CD1 4.39Å; W155-I239 HydrophobicContact CZ3-CD1 4.22Å
156L96.7Very high95.6Very high0 Ų020.2 Ų20.20%010%0.098CC..Hα-helixtrans-64.4-39.1169.5-71.9175.1000111.9V101 L102 V105 I152 N154 L159 I160 I186 V189V101-L156 HydrophobicContact CG1-CD1 3.84Å; L102-L156 HydrophobicContact CD1-CB 4.25Å; V105-L156 HydrophobicContact CG2-CD1 4.2Å; I152-L156 HydrophobicContact CG2-CD1 3.7Å; I152-L156 HydrophobicContact CG2-CG 4.13Å; I152-L156 WeakPolarHBondContact O-CB 3.39Å; I152-L156 VanDerWaalsContact O-CG 3.27Å; I152-L156 WeakPolarHBondContact O-CG 3.39Å; I152-L156 PolarHBondContact O-N 2.98Å; N154-L156 PolarHBondContact O-N 2.87Å; L156-L159 PolarHBondContact O-N 3.03Å; L156-I160 VanDerWaalsContact O-CG1 3.29Å; L156-I160 WeakPolarHBondContact O-CG1 3.04Å; L156-I160 PolarHBondContact O-N 2.89Å; L156-I186 HydrophobicContact CD2-CG1 4.49Å; L156-I186 HydrophobicContact CD2-CG2 4.42Å; L156-V189 HydrophobicContact CD2-CG1 4.29Å; L156-V189 HydrophobicContact CG-CG1 4.29Å
157T95.2Very high95.5Very high22 Ų2221.8 Ų21.814%0.13511%0.111CC..Hα-helixtrans-63.7-44.5175.9-60.60000111.5S153 N154 L159 I160 A161 L240S153-T157 WeakPolarHBondContact O-CB 3.11Å; S153-T157 PolarHBondContact O-N 3.06Å; S153-T157 PolarHBondContact O-OG1 3.2Å; N154-T157 WeakPolarHBondContact O-CB 3.25Å; N154-T157 PolarHBondContact O-N 3.16Å; N154-T157 VanDerWaalsContact O-N 3.13Å; T157-L159 VanDerWaalsContact C-N 3.34Å; T157-L159 PolarHBondContact O-N 3.48Å; T157-I160 PolarHBondContact O-N 3.44Å; T157-A161 PolarHBondContact O-N 3.23Å; T157-L240 HydrophobicContact CG2-CD1 4.46Å
158V96.4Very high95.3Very high9 Ų924.6 Ų24.66%0.05513%0.128CC..Hα-helixtrans-58.9-45.7172.6173.10000110.9N154 W155 I160 A161 T162 P236 I239N154-V158 WeakPolarHBondContact O-CG2 3.2Å; N154-V158 PolarHBondContact O-N 3.09Å; W155-V158 PolarHBondContact O-N 3.5Å; V158-I160 PolarHBondContact O-N 2.65Å; V158-A161 PolarHBondContact O-N 2.76Å; V158-T162 PolarHBondContact O-N 2.98Å; V158-T162 PolarHBondContact O-OG1 2.8Å; V158-P236 HydrophobicContact CG2-CB 3.79Å; V158-P236 WeakPolarHBondContact CG2-O 3.43Å; V158-I239 HydrophobicContact CG1-CB 4.06Å; V158-I239 HydrophobicContact CG1-CD1 4.5Å; V158-I239 HydrophobicContact CG1-CG2 3.54Å
159L96.2Very high95.2Very high32 Ų3225.5 Ų25.517%0.16814%0.135CC..Hα-helixtrans-63.2-39.2179.7-173.259.6000112.5Y98 W155 L156 T157 T162 E163 F185 V189Y98-L159 HydrophobicContact CD1-CD2 4Å; Y98-L159 HydrophobicContact CD1-CG 4.39Å; Y98-L159 HydrophobicContact CE1-CD2 3.42Å; Y98-L159 VanDerWaalsContact CE1-CD2 3.42Å; Y98-L159 HydrophobicContact CE1-CG 3.86Å; W155-L159 WeakPolarHBondContact O-CB 3.33Å; W155-L159 PolarHBondContact O-N 3.16Å; L156-L159 PolarHBondContact O-N 3.03Å; T157-L159 VanDerWaalsContact C-N 3.34Å; T157-L159 PolarHBondContact O-N 3.48Å; L159-T162 PolarHBondContact O-N 3.27Å; L159-E163 WeakPolarHBondContact O-CB 3.49Å; L159-E163 PolarHBondContact O-N 2.85Å; L159-F185 HydrophobicContact CD2-CB 4.1Å; L159-V189 HydrophobicContact CD2-CG2 4.28Å
160I94.6Very high95Very high15 Ų1529 Ų298%0.07715%0.15CC..Hα-helixtrans-63.1-46.6173.3-70.6163.6000110.8T95 Y98 L102 L156 T157 V158 E163 R164T95-I160 HydrophobicContact CG2-CG2 4.21Å; Y98-I160 VanDerWaalsContact CB-CG1 3.46Å; Y98-I160 HydrophobicContact CD2-CG1 4.46Å; Y98-I160 HydrophobicContact CG-CG1 4.12Å; L102-I160 HydrophobicContact CD2-CD1 3.87Å; L156-I160 VanDerWaalsContact O-CG1 3.29Å; L156-I160 WeakPolarHBondContact O-CG1 3.04Å; L156-I160 PolarHBondContact O-N 2.89Å; T157-I160 PolarHBondContact O-N 3.44Å; V158-I160 PolarHBondContact O-N 2.65Å; I160-E163 PolarHBondContact O-N 3.13Å; I160-R164 WeakPolarHBondContact O-CG 3.33Å; I160-R164 PolarHBondContact O-N 3.23Å
161A94Very high94.9Very high3 Ų332.6 Ų32.63%0.02517%0.174CC..Hα-helixtrans-62.7-43.417800000111.5T157 V158 R164 Y165 L240 V243 L397T157-A161 PolarHBondContact O-N 3.23Å; V158-A161 PolarHBondContact O-N 2.76Å; A161-R164 PolarHBondContact O-N 3.49Å; A161-Y165 WeakPolarHBondContact O-CB 3.32Å; A161-Y165 PolarHBondContact O-N 2.77Å; A161-L240 HydrophobicContact CB-CD1 3.51Å; A161-V243 HydrophobicContact CB-CG1 4.13Å; A161-V243 WeakPolarHBondContact O-CG1 3.44Å; A161-L397 HydrophobicContact CB-CD1 4.33Å
162T95.1Very high94.8Very high42 Ų4239.4 Ų39.426%0.25821%0.209SC..Hα-helixtrans-63.7-41.7175.4-56.40000112V158 L159 R164 Y165 L166V158-T162 PolarHBondContact O-N 2.98Å; V158-T162 PolarHBondContact O-OG1 2.8Å; L159-T162 PolarHBondContact O-N 3.27Å; T162-R164 VanDerWaalsContact C-N 3.33Å; T162-R164 PolarHBondContact O-N 2.74Å; T162-Y165 PolarHBondContact O-N 3.34Å; T162-L166 HydrophobicContact CG2-CD1 4.08Å; T162-L166 HydrophobicContact CG2-CG 4.38Å; T162-L166 WeakPolarHBondContact O-CB 3.26Å; T162-L166 VanDerWaalsContact O-CG 3.29Å; T162-L166 WeakPolarHBondContact O-CG 3.24Å; T162-L166 PolarHBondContact O-N 3.37Å
163E94.6Very high94.6Very high15 Ų1546.5 Ų46.57%0.0724%0.24CC..Hα-helixtrans-59.4-44.6173.8-165.5-147.4169.100111.2T94 T95 Y98 L159 I160 L166 A167 R182T94-E163 PolarHBondContact OG1-OE1 3.47Å; T95-E163 VanDerWaalsContact CA-OE2 3.29Å; T95-E163 WeakPolarHBondContact CA-OE2 3.25Å; T95-E163 WeakPolarHBondContact CB-OE2 3.32Å; T95-E163 WeakPolarHBondContact CG2-OE2 3.39Å; T95-E163 VanDerWaalsContact OG1-CD 3.23Å; T95-E163 PolarHBondContact OG1-OE1 3.03Å; T95-E163 VanDerWaalsContact OG1-OE1 3.13Å; T95-E163 PolarHBondContact OG1-OE2 3.31Å; Y98-E163 WeakPolarHBondContact CD2-OE2 3.28Å; Y98-E163 HydrophobicContact CE2-CB 4.36Å; Y98-E163 HydrophobicContact CE2-CG 4.2Å; Y98-E163 WeakPolarHBondContact CE2-OE2 3.3Å; L159-E163 WeakPolarHBondContact O-CB 3.49Å; L159-E163 PolarHBondContact O-N 2.85Å; I160-E163 PolarHBondContact O-N 3.13Å; E163-L166 PolarHBondContact O-N 3.01Å; E163-A167 VanDerWaalsContact O-CB 3.31Å; E163-A167 WeakPolarHBondContact O-CB 3.43Å; E163-A167 PolarHBondContact O-N 3.1Å; E163-R182 IonicContact OE1-CZ 3.78Å; E163-R182 IonicContact OE1-NH1 2.65Å; E163-R182 PolarHBondContact OE1-NH1 3.06Å
164R92.5Very high94.4Very high69 Ų6947.2 Ų47.226%0.2624%0.244SC..Hα-helixtrans-61.9-47.3177.9-73.6-70.7-173.4-121.6-5.2111.8T95 I160 A161 T162 A167 V168 L247T95-R164 VanDerWaalsContact CG2-NH2 3.29Å; T95-R164 PolarHBondContact OG1-NH1 2.9Å; I160-R164 WeakPolarHBondContact O-CG 3.33Å; I160-R164 PolarHBondContact O-N 3.23Å; A161-R164 PolarHBondContact O-N 3.49Å; T162-R164 VanDerWaalsContact C-N 3.33Å; T162-R164 PolarHBondContact O-N 2.74Å; R164-A167 PolarHBondContact O-N 2.88Å; R164-V168 WeakPolarHBondContact O-CG2 3.31Å; R164-V168 PolarHBondContact O-N 3.31Å; R164-L247 HydrophobicContact CB-CD1 4.45Å
165Y94Very high94.2Very high53 Ų5357.7 Ų57.721%0.20828%0.284CS..Hα-helixtrans-59.9-46.6176.2166.7-99.9000112.7A161 T162 A167 V168 C169 V243 R246 L247A161-Y165 WeakPolarHBondContact O-CB 3.32Å; A161-Y165 PolarHBondContact O-N 2.77Å; T162-Y165 PolarHBondContact O-N 3.34Å; Y165-A167 VanDerWaalsContact C-N 3.31Å; Y165-A167 PolarHBondContact O-N 2.92Å; Y165-V168 PolarHBondContact O-N 2.91Å; Y165-C169 VanDerWaalsContact CD2-SG 3.55Å; Y165-C169 HydrophobicContact CE2-CB 4.35Å; Y165-C169 WeakPolarHBondContact CE2-SG 3.18Å; Y165-C169 WeakPolarHBondContact O-CB 3.34Å; Y165-C169 PolarHBondContact O-N 3.23Å; Y165-C169 PolarHBondContact O-SG 2.92Å; Y165-V243 VanDerWaalsContact CB-CG1 3.48Å; Y165-V243 HydrophobicContact CG-CG1 4.03Å; Y165-R246 HydrophobicContact CD2-CB 4.12Å; Y165-R246 HydrophobicContact CE2-CB 3.57Å; Y165-L247 HydrophobicContact CD2-CB 4.42Å
166L95.2Very high94Very high59 Ų5963 Ų6331%0.30931%0.308SS..Hα-helixtrans-62.5-38.8176.4-70.2173.1000111.6T162 E163 V168 H170 V174T162-L166 HydrophobicContact CG2-CD1 4.08Å; T162-L166 HydrophobicContact CG2-CG 4.38Å; T162-L166 WeakPolarHBondContact O-CB 3.26Å; T162-L166 VanDerWaalsContact O-CG 3.29Å; T162-L166 WeakPolarHBondContact O-CG 3.24Å; T162-L166 PolarHBondContact O-N 3.37Å; E163-L166 PolarHBondContact O-N 3.01Å; L166-V168 VanDerWaalsContact C-N 3.35Å; L166-H170 CarbonylContact O-C 3.54Å; L166-H170 VanDerWaalsContact O-C 3.32Å; L166-H170 WeakPolarHBondContact O-CA 3.39Å; L166-H170 PolarHBondContact O-N 3.26Å; L166-V174 VanDerWaalsContact C-CG2 3.4Å; L166-V174 HydrophobicContact CB-CG2 3.57Å; L166-V174 VanDerWaalsContact O-CG2 3.31Å; L166-V174 WeakPolarHBondContact O-CG2 3.43Å
167A93Very high93.7Very high37 Ų3765.6 Ų65.631%0.30632%0.322SS..Hα-helixtrans-67.1-34.617900000112.8E163 R164 Y165 P171 V174E163-A167 VanDerWaalsContact O-CB 3.31Å; E163-A167 WeakPolarHBondContact O-CB 3.43Å; E163-A167 PolarHBondContact O-N 3.1Å; R164-A167 PolarHBondContact O-N 2.88Å; Y165-A167 VanDerWaalsContact C-N 3.31Å; Y165-A167 PolarHBondContact O-N 2.92Å; A167-P171 WeakPolarHBondContact O-CA 3.4Å; A167-V174 HydrophobicContact CB-CG1 4.4Å
168V91.7Very high93.6Very high63 Ų6369 Ų6938%0.38234%0.34SS..Hα-helixtrans-76.1-47.5176.21720000111.5R164 Y165 L166 L247 T250 V251R164-V168 WeakPolarHBondContact O-CG2 3.31Å; R164-V168 PolarHBondContact O-N 3.31Å; Y165-V168 PolarHBondContact O-N 2.91Å; L166-V168 VanDerWaalsContact C-N 3.35Å; V168-L247 HydrophobicContact CG2-CD1 4.24Å; V168-T250 HydrophobicContact CG1-CG2 4.05Å; V168-V251 HydrophobicContact CG1-CG2 4.34Å
169C93.3Very high93.3Very high29 Ų2972.1 Ų72.120%0.19636%0.36CS..Hα-helixtrans-82.7-30.5-172.9-57.40000113.3Y165Y165-C169 VanDerWaalsContact CD2-SG 3.55Å; Y165-C169 HydrophobicContact CE2-CB 4.35Å; Y165-C169 WeakPolarHBondContact CE2-SG 3.18Å; Y165-C169 WeakPolarHBondContact O-CB 3.34Å; Y165-C169 PolarHBondContact O-N 3.23Å; Y165-C169 PolarHBondContact O-SG 2.92Å
170H94.3Very high93.2Very high94 Ų9478.4 Ų78.444%0.43539%0.386SS..  trans-136.857.8-174.9-56.5-48.5000112.4L166 L172 K173 V174L166-H170 CarbonylContact O-C 3.54Å; L166-H170 VanDerWaalsContact O-C 3.32Å; L166-H170 WeakPolarHBondContact O-CA 3.39Å; L166-H170 PolarHBondContact O-N 3.26Å; H170-L172 PolarHBondContact O-N 3.45Å; H170-L172 VanDerWaalsContact O-N 3.14Å; H170-K173 HydrophobicContact CB-CB 3.98Å; H170-K173 PolarHBondContact O-N 3.32Å; H170-V174 PolarHBondContact O-N 3.42Å
171P92.9Very high93.2Very high80 Ų8084 Ų8452%0.51941%0.407SS..Hα-helixtrans-56-36.4-175.221.8-33.9000113.2A167 R175A167-P171 WeakPolarHBondContact O-CA 3.4Å; P171-R175 PolarHBondContact O-N 3.05Å
172L94.4Very high93.2Very high142 Ų14284.6 Ų84.674%0.74341%0.409SS*.Hα-helixtrans-65.6-40.5176.2-61.2179.8000112.5H170 F176H170-L172 PolarHBondContact O-N 3.45Å; H170-L172 VanDerWaalsContact O-N 3.14Å; L172-F176 WeakPolarHBondContact O-CD2 3.33Å; L172-F176 VanDerWaalsContact O-CE2 3.3Å; L172-F176 WeakPolarHBondContact O-CE2 3.46Å
173K93.3Very high93.2Very high158 Ų15889.6 Ų89.669%0.68742%0.423SS*.Hα-helixtrans-73.3-39.1-178.5-165173.6-177.1177.40111.5H170 R175 F176H170-K173 HydrophobicContact CB-CB 3.98Å; H170-K173 PolarHBondContact O-N 3.32Å; K173-R175 VanDerWaalsContact C-N 3.25Å; K173-R175 PolarHBondContact O-N 3.33Å; K173-F176 PolarHBondContact O-N 3.06Å
174V91.6Very high93.3Very high15 Ų1593.1 Ų93.19%0.09144%0.442CS..Hα-helixtrans-66.5-26.5179.11750000112.9L166 A167 H170 F176 I177 R182L166-V174 VanDerWaalsContact C-CG2 3.4Å; L166-V174 HydrophobicContact CB-CG2 3.57Å; L166-V174 VanDerWaalsContact O-CG2 3.31Å; L166-V174 WeakPolarHBondContact O-CG2 3.43Å; A167-V174 HydrophobicContact CB-CG1 4.4Å; H170-V174 PolarHBondContact O-N 3.42Å; V174-F176 PolarHBondContact O-N 3.14Å; V174-I177 HydrophobicContact CG2-CD1 4.26Å; V174-I177 PolarHBondContact O-N 3.12Å; V174-R182 PolarHBondContact O-NH2 3.48Å
175R91.5Very high93.5Very high222 Ų22294.7 Ų94.784%0.83845%0.451SS*.THydrogen-bonded Turntrans-62-23.4174.8-168172.7-178.3171.51113.4P171 K173P171-R175 PolarHBondContact O-N 3.05Å; K173-R175 VanDerWaalsContact C-N 3.25Å; K173-R175 PolarHBondContact O-N 3.33Å
176F92.6Very high93.7Very high163 Ų16392.6 Ų92.672%0.71544%0.443SS*.THydrogen-bonded Turntrans-88.7-3.8175.1-60.7-76.3000114L172 K173 V174 D178L172-F176 WeakPolarHBondContact O-CD2 3.33Å; L172-F176 VanDerWaalsContact O-CE2 3.3Å; L172-F176 WeakPolarHBondContact O-CE2 3.46Å; K173-F176 PolarHBondContact O-N 3.06Å; V174-F176 PolarHBondContact O-N 3.14Å; F176-D178 PolarHBondContact O-N 3.37Å; F176-D178 VanDerWaalsContact O-N 3.14Å
177I92.4Very high93.8Very high55 Ų5594.4 Ų94.428%0.28245%0.452SS..SBendtrans-84.990.6177.7-54.8176.9000108.8V174 R182V174-I177 HydrophobicContact CG2-CD1 4.26Å; V174-I177 PolarHBondContact O-N 3.12Å; I177-R182 HydrophobicContact CG2-CG 4.1Å; I177-R182 PolarHBondContact O-NE 3.14Å; I177-R182 PolarHBondContact O-NH2 3.31Å; I177-R182 VanDerWaalsContact O-NH2 3.16Å
178D92.3Very high94.1Very high95 Ų9597.1 Ų97.151%0.50846%0.461SS..  trans-54.1153.3179-67.8-36.4000113.2F176 K180 Y181 R182F176-D178 PolarHBondContact O-N 3.37Å; F176-D178 VanDerWaalsContact O-N 3.14Å; D178-K180 PolarHBondContact O-N 2.94Å; D178-K180 VanDerWaalsContact O-N 3.09Å; D178-Y181 HydrophobicContact CB-CD2 3.94Å; D178-Y181 HydrophobicContact CB-CE2 4.32Å; D178-Y181 PolarHBondContact O-N 3.2Å; D178-R182 PolarHBondContact O-N 2.91Å
179C90.6Very high94.4Very high73 Ų7395.1 Ų95.149%0.49345%0.449SS..Hα-helixtrans-55.9-25.9173.1-62.40000113.5R183C179-R183 WeakPolarHBondContact O-CG 3.45Å; C179-R183 PolarHBondContact O-N 3.09Å
180K94.1Very high94.6Very high164 Ų16496.1 Ų96.171%0.71345%0.452SS*.Hα-helixtrans-63.4-51.8176.3-66.4-175.2179.3-178.10111.9D178 R182 R183 I184D178-K180 PolarHBondContact O-N 2.94Å; D178-K180 VanDerWaalsContact O-N 3.09Å; K180-R182 VanDerWaalsContact C-N 3.26Å; K180-R182 PolarHBondContact O-N 3.34Å; K180-R183 PolarHBondContact O-N 2.69Å; K180-I184 WeakPolarHBondContact O-CG1 3.3Å; K180-I184 PolarHBondContact O-N 2.72Å
181Y94.3Very high94.8Very high132 Ų13296.6 Ų96.652%0.51846%0.457SS..Hα-helixtrans-59.5-37.9179-66.8-72.8000112.2D178 I184 F185D178-Y181 HydrophobicContact CB-CD2 3.94Å; D178-Y181 HydrophobicContact CB-CE2 4.32Å; D178-Y181 PolarHBondContact O-N 3.2Å; Y181-I184 WeakPolarHBondContact O-CB 3.31Å; Y181-I184 PolarHBondContact O-N 2.87Å; Y181-F185 WeakPolarHBondContact O-CD2 3.3Å; Y181-F185 PolarHBondContact O-N 3.18Å
182R93.8Very high95Very high16 Ų1695.2 Ų95.26%0.0645%0.449CS..Hα-helixtrans-63.7-43178.9-59.9169.7-172.6-102.99.3111.9T94 Y98 E163 V174 I177 D178 K180 I184 F185 I186T94-R182 VanDerWaalsContact CB-CZ 3.46Å; T94-R182 VanDerWaalsContact CB-NH1 3.28Å; T94-R182 VanDerWaalsContact CG2-CZ 3.45Å; T94-R182 PolarHBondContact OG1-NH1 3.29Å; Y98-R182 WeakPolarHBondContact OH-CB 3.27Å; E163-R182 IonicContact OE1-CZ 3.78Å; E163-R182 IonicContact OE1-NH1 2.65Å; E163-R182 PolarHBondContact OE1-NH1 3.06Å; V174-R182 PolarHBondContact O-NH2 3.48Å; I177-R182 HydrophobicContact CG2-CG 4.1Å; I177-R182 PolarHBondContact O-NE 3.14Å; I177-R182 PolarHBondContact O-NH2 3.31Å; I177-R182 VanDerWaalsContact O-NH2 3.16Å; D178-R182 PolarHBondContact O-N 2.91Å; K180-R182 VanDerWaalsContact C-N 3.26Å; K180-R182 PolarHBondContact O-N 3.34Å; R182-I184 VanDerWaalsContact C-N 3.34Å; R182-F185 PolarHBondContact O-N 3.23Å; R182-I186 WeakPolarHBondContact O-CG1 3.37Å; R182-I186 PolarHBondContact O-N 3.21Å; R182-I186 VanDerWaalsContact O-N 3.08Å
183R95.9Very high95.2Very high148 Ų14888.4 Ų88.456%0.55841%0.413SS*.Hα-helixtrans-62.3-41.1172.3-68.3178.5-175.7-175.41.9111.7C179 K180 I186 I187C179-R183 WeakPolarHBondContact O-CG 3.45Å; C179-R183 PolarHBondContact O-N 3.09Å; K180-R183 PolarHBondContact O-N 2.69Å; R183-I186 PolarHBondContact O-N 3.33Å; R183-I187 WeakPolarHBondContact O-CG1 3.28Å; R183-I187 PolarHBondContact O-N 2.98Å
184I96.7Very high95.4Very high89 Ų8984.9 Ų84.946%0.45640%0.401SS..Hα-helixtrans-60.7-45.5175.3-65.3165.5000110.7K180 Y181 R182 I186 I187 L188K180-I184 WeakPolarHBondContact O-CG1 3.3Å; K180-I184 PolarHBondContact O-N 2.72Å; Y181-I184 WeakPolarHBondContact O-CB 3.31Å; Y181-I184 PolarHBondContact O-N 2.87Å; R182-I184 VanDerWaalsContact C-N 3.34Å; I184-I186 PolarHBondContact O-N 3.24Å; I184-I187 PolarHBondContact O-N 3.42Å; I184-L188 HydrophobicContact CG2-CD1 3.84Å; I184-L188 HydrophobicContact CG2-CG 4.2Å; I184-L188 WeakPolarHBondContact O-CB 3.09Å; I184-L188 VanDerWaalsContact O-CG 3.29Å; I184-L188 WeakPolarHBondContact O-CG 3.46Å; I184-L188 PolarHBondContact O-N 2.84Å
185F96.8Very high95.6Very high101 Ų10190 Ų9044%0.44343%0.428SS..Hα-helixtrans-61.2-39.4176-73.1-61.9000113.2L159 Y181 R182 L188 V189L159-F185 HydrophobicContact CD2-CB 4.1Å; Y181-F185 WeakPolarHBondContact O-CD2 3.3Å; Y181-F185 PolarHBondContact O-N 3.18Å; R182-F185 PolarHBondContact O-N 3.23Å; F185-L188 PolarHBondContact O-N 3.28Å; F185-V189 WeakPolarHBondContact O-CG2 3.38Å; F185-V189 PolarHBondContact O-N 3.08Å
186I97.5Very high95.9Very high10 Ų1081.8 Ų81.85%0.05140%0.399CS..Hα-helixtrans-60.9-49.4173.7-65.5171.3000110.7T97 Y98 V101 L156 R182 R183 I184 L188 V189 I190T97-I186 HydrophobicContact CG2-CD1 3.88Å; Y98-I186 HydrophobicContact CD1-CD1 3.54Å; Y98-I186 HydrophobicContact CD1-CG1 3.48Å; Y98-I186 VanDerWaalsContact CD1-CG1 3.48Å; Y98-I186 HydrophobicContact CE1-CD1 3.72Å; Y98-I186 HydrophobicContact CE1-CG1 3.4Å; Y98-I186 VanDerWaalsContact CE1-CG1 3.4Å; Y98-I186 HydrophobicContact CG-CD1 4.48Å; V101-I186 HydrophobicContact CB-CG2 4.49Å; V101-I186 HydrophobicContact CG1-CG2 3.92Å; V101-I186 HydrophobicContact CG2-CD1 4.29Å; V101-I186 HydrophobicContact CG2-CG2 4.28Å; L156-I186 HydrophobicContact CD2-CG1 4.49Å; L156-I186 HydrophobicContact CD2-CG2 4.42Å; R182-I186 WeakPolarHBondContact O-CG1 3.37Å; R182-I186 PolarHBondContact O-N 3.21Å; R182-I186 VanDerWaalsContact O-N 3.08Å; R183-I186 PolarHBondContact O-N 3.33Å; I184-I186 PolarHBondContact O-N 3.24Å; I186-L188 VanDerWaalsContact C-N 3.32Å; I186-L188 PolarHBondContact O-N 3.35Å; I186-V189 PolarHBondContact O-N 3.02Å; I186-I190 HydrophobicContact CG2-CD1 3.82Å; I186-I190 WeakPolarHBondContact O-CG1 3.44Å; I186-I190 PolarHBondContact O-N 2.78Å
187I97.9Very high96Very high96 Ų9674.2 Ų74.249%0.49237%0.366SS..Hα-helixtrans-62.4-42.1-179.4-67.6164.6000110.4R183 I184 I190 L191R183-I187 WeakPolarHBondContact O-CG1 3.28Å; R183-I187 PolarHBondContact O-N 2.98Å; I184-I187 PolarHBondContact O-N 3.42Å; I187-I190 PolarHBondContact O-N 3.26Å; I187-L191 HydrophobicContact CG2-CD1 3.7Å; I187-L191 HydrophobicContact CG2-CG 4.17Å; I187-L191 WeakPolarHBondContact O-CB 3.23Å; I187-L191 VanDerWaalsContact O-CG 3.31Å; I187-L191 WeakPolarHBondContact O-CG 3.48Å; I187-L191 PolarHBondContact O-N 2.97Å
188L97.9Very high96.1Very high94 Ų9475.5 Ų75.549%0.49237%0.374SS..Hα-helixtrans-61.1-43.4175.6-73.6172.5000112.1I184 F185 I186 L191 S192I184-L188 HydrophobicContact CG2-CD1 3.84Å; I184-L188 HydrophobicContact CG2-CG 4.2Å; I184-L188 WeakPolarHBondContact O-CB 3.09Å; I184-L188 VanDerWaalsContact O-CG 3.29Å; I184-L188 WeakPolarHBondContact O-CG 3.46Å; I184-L188 PolarHBondContact O-N 2.84Å; F185-L188 PolarHBondContact O-N 3.28Å; I186-L188 VanDerWaalsContact C-N 3.32Å; I186-L188 PolarHBondContact O-N 3.35Å; L188-L191 PolarHBondContact O-N 3.42Å; L188-S192 VanDerWaalsContact O-CB 3.28Å; L188-S192 WeakPolarHBondContact O-CB 3.4Å; L188-S192 PolarHBondContact O-N 2.9Å; L188-S192 PolarHBondContact O-OG 2.82Å
189V98Very high96.1Very high21 Ų2173.2 Ų73.213%0.12736%0.364CS..Hα-helixtrans-62.4-41.8176.2163.90000111.9W155 L156 L159 F185 I186 S192 S193W155-V189 HydrophobicContact CB-CG1 3.51Å; W155-V189 HydrophobicContact CB-CG2 4.46Å; L156-V189 HydrophobicContact CD2-CG1 4.29Å; L156-V189 HydrophobicContact CG-CG1 4.29Å; L159-V189 HydrophobicContact CD2-CG2 4.28Å; F185-V189 WeakPolarHBondContact O-CG2 3.38Å; F185-V189 PolarHBondContact O-N 3.08Å; I186-V189 PolarHBondContact O-N 3.02Å; V189-S192 PolarHBondContact O-OG 3.09Å; V189-S192 VanDerWaalsContact O-OG 3.11Å; V189-S193 WeakPolarHBondContact O-CB 3.39Å; V189-S193 PolarHBondContact O-N 3.27Å; V189-S193 VanDerWaalsContact O-N 3.08Å; V189-S193 PolarHBondContact O-OG 3.19Å
190I98.3Very high96.1Very high51 Ų5170 Ų7026%0.26234%0.343SS..Hα-helixtrans-66.1-51.7177.7-66.9167.2000110.2V101 I152 I186 I187 S192 S193 I194V101-I190 HydrophobicContact CG1-CD1 4.43Å; I152-I190 HydrophobicContact CD1-CG2 4.33Å; I152-I190 HydrophobicContact CG2-CG1 4.03Å; I186-I190 HydrophobicContact CG2-CD1 3.82Å; I186-I190 WeakPolarHBondContact O-CG1 3.44Å; I186-I190 PolarHBondContact O-N 2.78Å; I187-I190 PolarHBondContact O-N 3.26Å; I190-S192 PolarHBondContact O-N 3.36Å; I190-S193 PolarHBondContact O-N 3.38Å; I190-I194 HydrophobicContact CG2-CD1 3.87Å; I190-I194 WeakPolarHBondContact O-CG1 3.3Å; I190-I194 PolarHBondContact O-N 3.02Å
191L98.1Very high96Very high103 Ų10365.9 Ų65.954%0.53933%0.325SS..Hα-helixtrans-62.6-42-179.2-70.8176.2000112.3I187 L188 I194 L195I187-L191 HydrophobicContact CG2-CD1 3.7Å; I187-L191 HydrophobicContact CG2-CG 4.17Å; I187-L191 WeakPolarHBondContact O-CB 3.23Å; I187-L191 VanDerWaalsContact O-CG 3.31Å; I187-L191 WeakPolarHBondContact O-CG 3.48Å; I187-L191 PolarHBondContact O-N 2.97Å; L188-L191 PolarHBondContact O-N 3.42Å; L191-I194 PolarHBondContact O-N 3.47Å; L191-L195 VanDerWaalsContact O-CB 3.32Å; L191-L195 WeakPolarHBondContact O-CB 3.49Å; L191-L195 PolarHBondContact O-N 2.94Å
192S97.4Very high95.9Very high51 Ų5163.7 Ų63.736%0.35732%0.322SS..Hα-helixtrans-63.8-42.8176.563.60000111.3L188 V189 I190 I194 L195 I196L188-S192 VanDerWaalsContact O-CB 3.28Å; L188-S192 WeakPolarHBondContact O-CB 3.4Å; L188-S192 PolarHBondContact O-N 2.9Å; L188-S192 PolarHBondContact O-OG 2.82Å; V189-S192 PolarHBondContact O-OG 3.09Å; V189-S192 VanDerWaalsContact O-OG 3.11Å; I190-S192 PolarHBondContact O-N 3.36Å; S192-I194 PolarHBondContact O-N 3.28Å; S192-L195 PolarHBondContact O-N 3.48Å; S192-I196 VanDerWaalsContact O-CB 3.26Å; S192-I196 WeakPolarHBondContact O-CB 3.41Å; S192-I196 VanDerWaalsContact O-CD1 3.24Å; S192-I196 WeakPolarHBondContact O-CD1 3.19Å; S192-I196 WeakPolarHBondContact O-CG1 3.25Å; S192-I196 PolarHBondContact O-N 3.22Å
193S97.7Very high95.7Very high0 Ų064 Ų640%032%0.324CS..Hα-helixtrans-62.9-41.4179.7-57.60000112.3V189 I190 K197V189-S193 WeakPolarHBondContact O-CB 3.39Å; V189-S193 PolarHBondContact O-N 3.27Å; V189-S193 VanDerWaalsContact O-N 3.08Å; V189-S193 PolarHBondContact O-OG 3.19Å; I190-S193 PolarHBondContact O-N 3.38Å; S193-K197 PolarHBondContact O-N 3.13Å
194I97.2Very high95.2Very high84 Ų8459.9 Ų59.943%0.43131%0.313SS..Hα-helixtrans-64-48.9174.4-65.5166000110.4T148 I190 L191 S192 I196 K197 L198T148-I194 HydrophobicContact CG2-CG1 4.28Å; I190-I194 HydrophobicContact CG2-CD1 3.87Å; I190-I194 WeakPolarHBondContact O-CG1 3.3Å; I190-I194 PolarHBondContact O-N 3.02Å; L191-I194 PolarHBondContact O-N 3.47Å; S192-I194 PolarHBondContact O-N 3.28Å; I194-I196 VanDerWaalsContact C-N 3.29Å; I194-I196 PolarHBondContact O-N 3.06Å; I194-K197 PolarHBondContact O-N 2.97Å; I194-K197 VanDerWaalsContact O-N 3.15Å; I194-L198 WeakPolarHBondContact O-CB 3.02Å; I194-L198 PolarHBondContact O-N 2.74Å
195L96.9Very high94.7Very high123 Ų12358 Ų5864%0.64432%0.316SS*.Hα-helixtrans-61.4-37-179.9-176.464.7000112.5L191 S192 P199L191-L195 VanDerWaalsContact O-CB 3.32Å; L191-L195 WeakPolarHBondContact O-CB 3.49Å; L191-L195 PolarHBondContact O-N 2.94Å; S192-L195 PolarHBondContact O-N 3.48Å; L195-P199 VanDerWaalsContact O-CD 3.31Å; L195-P199 WeakPolarHBondContact O-CD 3.44Å
196I96.5Very high94.3Very high48 Ų4859.9 Ų59.925%0.24632%0.321CS..Hα-helixtrans-65.3-37.7176.2-79.3158.2000111.8L151 S192 I194 Y223 V227 L231L151-I196 HydrophobicContact CD2-CB 4.48Å; L151-I196 HydrophobicContact CD2-CG2 3.92Å; S192-I196 VanDerWaalsContact O-CB 3.26Å; S192-I196 WeakPolarHBondContact O-CB 3.41Å; S192-I196 VanDerWaalsContact O-CD1 3.24Å; S192-I196 WeakPolarHBondContact O-CD1 3.19Å; S192-I196 WeakPolarHBondContact O-CG1 3.25Å; S192-I196 PolarHBondContact O-N 3.22Å; I194-I196 VanDerWaalsContact C-N 3.29Å; I194-I196 PolarHBondContact O-N 3.06Å; I196-Y223 PolarHBondContact O-OH 2.97Å; I196-Y223 VanDerWaalsContact O-OH 3.12Å; I196-V227 HydrophobicContact CG2-CG1 3.7Å; I196-V227 HydrophobicContact CG2-CG2 4.36Å; I196-L231 HydrophobicContact CB-CD2 4.44Å; I196-L231 HydrophobicContact CD1-CD2 3.73Å; I196-L231 HydrophobicContact CG1-CD2 4.02Å; I196-L231 HydrophobicContact CG2-CD2 3.54Å
197K94.9Very high93.6Very high4 Ų462 Ų622%0.01734%0.34CS..Hα-helixtrans-86.5-22.2-178.4-80.7-79.9-178.31790113.8D147 T148 L151 S193 I194 G200 F201 Y223D147-K197 VanDerWaalsContact CG-NZ 3.27Å; D147-K197 IonicContact OD2-NZ 2.78Å; D147-K197 PolarHBondContact OD2-NZ 3.37Å; T148-K197 HydrophobicContact CG2-CB 4.38Å; T148-K197 HydrophobicContact CG2-CG 4.39Å; T148-K197 WeakPolarHBondContact OG1-CB 3.21Å; T148-K197 WeakPolarHBondContact OG1-CG 3.35Å; L151-K197 HydrophobicContact CD2-CG 4.11Å; S193-K197 PolarHBondContact O-N 3.13Å; I194-K197 PolarHBondContact O-N 2.97Å; I194-K197 VanDerWaalsContact O-N 3.15Å; K197-G200 WeakPolarHBondContact O-CA 3.45Å; K197-G200 PolarHBondContact O-N 3.42Å; K197-F201 PolarHBondContact O-N 2.94Å; K197-Y223 WeakPolarHBondContact CA-OH 3.38Å; K197-Y223 PolarHBondContact O-OH 3.03Å
198L94.9Very high92.7Very high83 Ų8365 Ų6544%0.43535%0.349SS..Hα-helixtrans-54.3-39.9-178.2-175.8139.3000114.9I194 G200 F201 I202I194-L198 WeakPolarHBondContact O-CB 3.02Å; I194-L198 PolarHBondContact O-N 2.74Å; L198-G200 PolarHBondContact O-N 3.21Å; L198-F201 PolarHBondContact O-N 3Å; L198-I202 HydrophobicContact CD2-CD1 3.64Å; L198-I202 HydrophobicContact CG-CD1 4.47Å; L198-I202 WeakPolarHBondContact O-CG1 3.3Å; L198-I202 PolarHBondContact O-N 3.33Å
199P93.5Very high92Very high46 Ų4668.2 Ų68.230%0.29936%0.362SS..Hα-helixtrans-60.1-32.1172.2-2434.3000113.4L195 I202 I203 Y223L195-P199 VanDerWaalsContact O-CD 3.31Å; L195-P199 WeakPolarHBondContact O-CD 3.44Å; P199-I202 PolarHBondContact O-N 3.28Å; P199-I203 WeakPolarHBondContact O-CD1 3.34Å; P199-I203 WeakPolarHBondContact O-CG1 3.28Å; P199-I203 PolarHBondContact O-N 3.47Å; P199-Y223 HydrophobicContact CB-CD2 4.42Å; P199-Y223 HydrophobicContact CB-CE2 3.82Å; P199-Y223 HydrophobicContact CG-CE2 4.29Å
200G90.6Very high91.1Very high7 Ų771.8 Ų71.87%0.07238%0.379CS..Hα-helixtrans-61-49.2175.400000112.1K197 L198 I202 I203 L204 Y223K197-G200 WeakPolarHBondContact O-CA 3.45Å; K197-G200 PolarHBondContact O-N 3.42Å; L198-G200 PolarHBondContact O-N 3.21Å; G200-I202 VanDerWaalsContact C-N 3.29Å; G200-I202 PolarHBondContact O-N 2.93Å; G200-I203 PolarHBondContact O-N 2.9Å; G200-L204 VanDerWaalsContact O-CB 3.25Å; G200-L204 WeakPolarHBondContact O-CB 3.38Å; G200-L204 PolarHBondContact O-N 3.46Å; G200-Y223 WeakPolarHBondContact CA-OH 3.39Å; G200-Y223 PolarHBondContact N-OH 3.03Å; G200-Y223 VanDerWaalsContact N-OH 3.08Å
201F91.6Very high90.3Very high76 Ų7677.1 Ų77.133%0.33341%0.408SS..Hα-helixtrans-57.7-40.2174.4-75.3-85.9000112.4E144 K197 L198 L204 G205E144-F201 HydrophobicContact CB-CD1 4.26Å; E144-F201 HydrophobicContact CB-CE1 3.57Å; E144-F201 HydrophobicContact CB-CE2 3.88Å; E144-F201 HydrophobicContact CB-CZ 3.35Å; E144-F201 HydrophobicContact CG-CE1 4.36Å; E144-F201 HydrophobicContact CG-CZ 4.46Å; K197-F201 PolarHBondContact O-N 2.94Å; L198-F201 PolarHBondContact O-N 3Å; F201-L204 PolarHBondContact O-N 3.43Å; F201-G205 PolarHBondContact O-N 2.85Å; F201-G205 VanDerWaalsContact O-N 3.11Å
202I92.2Very high89.2Confident87 Ų8775.1 Ų75.145%0.44640%0.403SS..Hα-helixtrans-66.2-48.9178.6-66.1171.5000111.1L198 P199 G200 L204 G205 Y206L198-I202 HydrophobicContact CD2-CD1 3.64Å; L198-I202 HydrophobicContact CG-CD1 4.47Å; L198-I202 WeakPolarHBondContact O-CG1 3.3Å; L198-I202 PolarHBondContact O-N 3.33Å; P199-I202 PolarHBondContact O-N 3.28Å; G200-I202 VanDerWaalsContact C-N 3.29Å; G200-I202 PolarHBondContact O-N 2.93Å; I202-L204 PolarHBondContact O-N 2.95Å; I202-G205 PolarHBondContact O-N 3.32Å; I202-Y206 HydrophobicContact CG2-CD2 3.69Å; I202-Y206 HydrophobicContact CG2-CE2 3.59Å; I202-Y206 VanDerWaalsContact O-CD2 3.31Å; I202-Y206 WeakPolarHBondContact O-CD2 3.35Å; I202-Y206 PolarHBondContact O-N 3.45Å; I202-Y206 VanDerWaalsContact O-N 3.11Å
203I89.5Confident88.8Confident21 Ų2175.8 Ų75.811%0.10841%0.407CS..Hα-helixtrans-58.2-39.2177.5-65.6159.3000110.8P199 G200 Y206 A207 F219 R220 Y223P199-I203 WeakPolarHBondContact O-CD1 3.34Å; P199-I203 WeakPolarHBondContact O-CG1 3.28Å; P199-I203 PolarHBondContact O-N 3.47Å; G200-I203 PolarHBondContact O-N 2.9Å; I203-Y206 PolarHBondContact O-N 3.49Å; I203-A207 WeakPolarHBondContact O-CB 3.34Å; I203-A207 PolarHBondContact O-N 3.32Å; I203-F219 HydrophobicContact CD1-CD1 3.94Å; I203-F219 HydrophobicContact CD1-CE1 3.77Å; I203-F219 HydrophobicContact CG1-CD1 4.39Å; I203-F219 HydrophobicContact CG1-CE1 4.31Å; I203-R220 HydrophobicContact CG2-CB 4.3Å; I203-R220 HydrophobicContact CG2-CG 4.36Å; I203-Y223 HydrophobicContact CD1-CD1 4.2Å; I203-Y223 HydrophobicContact CD1-CG 4.24Å
204L85Confident88.3Confident63 Ų6384 Ų8433%0.3344%0.44SS..Hα-helixtrans-67.9-36.3-178.4-165.360.3000112.5T140 E144 G200 F201 I202T140-L204 HydrophobicContact CG2-CD1 4.26Å; T140-L204 HydrophobicContact CG2-CD2 3.32Å; T140-L204 HydrophobicContact CG2-CG 3.78Å; E144-L204 HydrophobicContact CG-CD2 3.69Å; G200-L204 VanDerWaalsContact O-CB 3.25Å; G200-L204 WeakPolarHBondContact O-CB 3.38Å; G200-L204 PolarHBondContact O-N 3.46Å; F201-L204 PolarHBondContact O-N 3.43Å; I202-L204 PolarHBondContact O-N 2.95Å
205G87.1Confident88Confident49 Ų4984.8 Ų84.851%0.50545%0.448SS..Hα-helixtrans-65.8-50.4170.600000112.6F201 I202 A207 K208F201-G205 PolarHBondContact O-N 2.85Å; F201-G205 VanDerWaalsContact O-N 3.11Å; I202-G205 PolarHBondContact O-N 3.32Å; G205-A207 VanDerWaalsContact C-N 3.29Å; G205-A207 PolarHBondContact O-N 2.95Å; G205-K208 PolarHBondContact O-N 3.46Å
206Y87.4Confident87.6Confident141 Ų14181.9 Ų81.955%0.55343%0.433SS*.Hα-helixtrans-64.6-28.8-178.8-81.1-64.7000114.2I202 I203 K208 E209 I210I202-Y206 HydrophobicContact CG2-CD2 3.69Å; I202-Y206 HydrophobicContact CG2-CE2 3.59Å; I202-Y206 VanDerWaalsContact O-CD2 3.31Å; I202-Y206 WeakPolarHBondContact O-CD2 3.35Å; I202-Y206 PolarHBondContact O-N 3.45Å; I202-Y206 VanDerWaalsContact O-N 3.11Å; I203-Y206 PolarHBondContact O-N 3.49Å; Y206-K208 PolarHBondContact O-N 2.88Å; Y206-E209 PolarHBondContact O-N 2.97Å; Y206-I210 HydrophobicContact CD1-CD1 4.24Å
207A82.1Confident87.2Confident54 Ų5481.7 Ų81.745%0.44643%0.432SS..THydrogen-bonded Turntrans-61.1-12.418000000114.4I203 G205I203-A207 WeakPolarHBondContact O-CB 3.34Å; I203-A207 PolarHBondContact O-N 3.32Å; G205-A207 VanDerWaalsContact C-N 3.29Å; G205-A207 PolarHBondContact O-N 2.95Å
208K80.2Confident86.9Confident158 Ų15884.8 Ų84.869%0.68745%0.448SS*.THydrogen-bonded Turntrans-89.7-25.8-179-171.1176.1177.9-175.90114.5G205 Y206G205-K208 PolarHBondContact O-N 3.46Å; Y206-K208 PolarHBondContact O-N 2.88Å
209E82.3Confident86.8Confident163 Ų16386.3 Ų86.376%0.76245%0.451SS*.THydrogen-bonded Turntrans-111.6-19.8-165.3-68-175.5173.100114.8Y206Y206-E209 PolarHBondContact O-N 2.97Å
210I80.2Confident86.6Confident96 Ų9688.2 Ų88.249%0.49245%0.453SS..SBendtrans-122.1129.8-171.4-55.1178.2000109.9Y206 S212Y206-I210 HydrophobicContact CD1-CD1 4.24Å; I210-S212 WeakPolarHBondContact O-CA 3.3Å; I210-S212 PolarHBondContact O-N 3.45Å
211N81.5Confident86.6Confident163 Ų16392 Ų9287%0.87247%0.467SS*.  trans-50.7105.2167.1-77.8-25.3000108.9S213N211-S213 PolarHBondContact O-N 3.46Å
212S75.3Confident86.6Confident60 Ų6092.7 Ų92.742%0.4247%0.473SS..  trans-64.9105.4-157.7-170.90000111.6I210 Y214 I217I210-S212 WeakPolarHBondContact O-CA 3.3Å; I210-S212 PolarHBondContact O-N 3.45Å; S212-Y214 PolarHBondContact O-N 3.32Å; S212-I217 WeakPolarHBondContact OG-CG1 3.16Å
213S87.8Confident86.7Confident65 Ų6590 Ų9046%0.45546%0.457SS..  trans-56.2137.1174177.80000109.7N211 T215 I216 I217N211-S213 PolarHBondContact O-N 3.46Å; S213-T215 PolarHBondContact O-N 2.85Å; S213-I216 WeakPolarHBondContact O-CB 3.04Å; S213-I216 PolarHBondContact O-N 3.25Å; S213-I217 PolarHBondContact O-N 3.11Å
214Y88.4Confident86.7Confident173 Ų17389.6 Ų89.668%0.67846%0.456SS*.Hα-helixtrans-48.4-34.9-178.2-178.5-106.7000113.1S212 I216 I217 I218S212-Y214 PolarHBondContact O-N 3.32Å; Y214-I216 PolarHBondContact O-N 3Å; Y214-I217 WeakPolarHBondContact O-CB 3.19Å; Y214-I217 PolarHBondContact O-N 3.29Å; Y214-I218 HydrophobicContact CD1-CD1 3.81Å; Y214-I218 HydrophobicContact CE1-CD1 3.28Å; Y214-I218 HydrophobicContact CE1-CG1 4.21Å; Y214-I218 PolarHBondContact O-N 3.35Å
215T89.8Confident87Confident100 Ų10093.4 Ų93.461%0.61347%0.466SS*.Hα-helixtrans-59.1-39.9174.6-500000113.4S213 I217 I218 F219S213-T215 PolarHBondContact O-N 2.85Å; T215-I217 VanDerWaalsContact C-N 3.35Å; T215-I218 PolarHBondContact O-N 3.46Å; T215-F219 WeakPolarHBondContact O-CB 3.26Å; T215-F219 PolarHBondContact O-N 3.1Å
216I89.1Confident87.3Confident62 Ų6294.7 Ų94.732%0.31846%0.46SS..Hα-helixtrans-67.8-38.8178.4-58.5175.5000109.9S213 Y214 F219 R220S213-I216 WeakPolarHBondContact O-CB 3.04Å; S213-I216 PolarHBondContact O-N 3.25Å; Y214-I216 PolarHBondContact O-N 3Å; I216-F219 PolarHBondContact O-N 3.45Å; I216-R220 VanDerWaalsContact O-CB 3.3Å; I216-R220 WeakPolarHBondContact O-CB 3.46Å; I216-R220 PolarHBondContact O-N 3.08Å
217I87Confident87.6Confident45 Ų4588.6 Ų88.623%0.23144%0.438CS..Hα-helixtrans-63.9-44.9176.9-55.8177000110.5S212 S213 Y214 T215 K221 T423S212-I217 WeakPolarHBondContact OG-CG1 3.16Å; S213-I217 PolarHBondContact O-N 3.11Å; Y214-I217 WeakPolarHBondContact O-CB 3.19Å; Y214-I217 PolarHBondContact O-N 3.29Å; T215-I217 VanDerWaalsContact C-N 3.35Å; I217-K221 WeakPolarHBondContact O-CG 3.43Å; I217-K221 PolarHBondContact O-N 3.29Å; I217-T423 HydrophobicContact CG2-CG2 4.26Å
218I90.2Very high88Confident69 Ų6986.1 Ų86.135%0.35442%0.417SS..Hα-helixtrans-62.5-49174.7-71.8178.2000110.9Y214 T215 R220 K221 I222Y214-I218 HydrophobicContact CD1-CD1 3.81Å; Y214-I218 HydrophobicContact CE1-CD1 3.28Å; Y214-I218 HydrophobicContact CE1-CG1 4.21Å; Y214-I218 PolarHBondContact O-N 3.35Å; T215-I218 PolarHBondContact O-N 3.46Å; I218-R220 VanDerWaalsContact C-N 3.31Å; I218-R220 PolarHBondContact O-N 2.68Å; I218-K221 PolarHBondContact O-N 3.02Å; I218-K221 VanDerWaalsContact O-N 3.12Å; I218-I222 HydrophobicContact CG2-CD1 3.64Å; I218-I222 HydrophobicContact CG2-CG1 4.3Å; I218-I222 WeakPolarHBondContact O-CG1 3.31Å; I218-I222 PolarHBondContact O-N 3.25Å
219F91.5Very high88.5Confident114 Ų11480.1 Ų80.150%0.539%0.392SS..Hα-helixtrans-59-43-179.8-175.8-108.3000111.7I203 T215 I216 K221 I222 Y223I203-F219 HydrophobicContact CD1-CD1 3.94Å; I203-F219 HydrophobicContact CD1-CE1 3.77Å; I203-F219 HydrophobicContact CG1-CD1 4.39Å; I203-F219 HydrophobicContact CG1-CE1 4.31Å; T215-F219 WeakPolarHBondContact O-CB 3.26Å; T215-F219 PolarHBondContact O-N 3.1Å; I216-F219 PolarHBondContact O-N 3.45Å; F219-K221 PolarHBondContact O-N 3.42Å; F219-I222 PolarHBondContact O-N 2.9Å; F219-Y223 VanDerWaalsContact O-CB 3.23Å; F219-Y223 WeakPolarHBondContact O-CB 3.4Å; F219-Y223 PolarHBondContact O-N 2.9Å
220R89.9Confident89Confident87 Ų8775.3 Ų75.333%0.32837%0.371SS..Hα-helixtrans-59.6-44.9173.8178.7176.2168.3-172.4-4.9112.1I203 I216 I218 Y223 I224I203-R220 HydrophobicContact CG2-CB 4.3Å; I203-R220 HydrophobicContact CG2-CG 4.36Å; I216-R220 VanDerWaalsContact O-CB 3.3Å; I216-R220 WeakPolarHBondContact O-CB 3.46Å; I216-R220 PolarHBondContact O-N 3.08Å; I218-R220 VanDerWaalsContact C-N 3.31Å; I218-R220 PolarHBondContact O-N 2.68Å; R220-Y223 PolarHBondContact O-N 3.24Å; R220-I224 HydrophobicContact CG-CD1 3.77Å; R220-I224 WeakPolarHBondContact O-CB 3.45Å; R220-I224 WeakPolarHBondContact O-CD1 3.3Å; R220-I224 WeakPolarHBondContact O-CG1 3.43Å; R220-I224 PolarHBondContact O-N 3.36Å
221K90.1Very high89.6Confident87 Ų8772.5 Ų72.538%0.37836%0.357SS..Hα-helixtrans-61.2-47.1176.3-74.9178.7179.5-178.30112I217 I218 F219 I224 W225 T423I217-K221 WeakPolarHBondContact O-CG 3.43Å; I217-K221 PolarHBondContact O-N 3.29Å; I218-K221 PolarHBondContact O-N 3.02Å; I218-K221 VanDerWaalsContact O-N 3.12Å; F219-K221 PolarHBondContact O-N 3.42Å; K221-I224 PolarHBondContact O-N 3.12Å; K221-W225 WeakPolarHBondContact O-CB 3.23Å; K221-W225 PolarHBondContact O-N 2.94Å; K221-T423 HydrophobicContact CD-CG2 4.46Å; K221-T423 HydrophobicContact CG-CG2 4.33Å
222I92.4Very high90.1Very high89 Ų8964.8 Ų64.846%0.45632%0.316SS..Hα-helixtrans-63.8-45.7178.7-66.5172.5000110.7I218 F219 I224 W225 I226I218-I222 HydrophobicContact CG2-CD1 3.64Å; I218-I222 HydrophobicContact CG2-CG1 4.3Å; I218-I222 WeakPolarHBondContact O-CG1 3.31Å; I218-I222 PolarHBondContact O-N 3.25Å; F219-I222 PolarHBondContact O-N 2.9Å; I222-I224 PolarHBondContact O-N 2.83Å; I222-W225 PolarHBondContact O-N 3.48Å; I222-I226 HydrophobicContact CG2-CD1 3.62Å; I222-I226 HydrophobicContact CG2-CG1 4.3Å; I222-I226 WeakPolarHBondContact O-CG1 3.35Å; I222-I226 PolarHBondContact O-N 3.5Å
223Y93.2Very high90.9Very high30 Ų3064.4 Ų64.412%0.11831%0.308CS..Hα-helixtrans-59.2-47177.1173-96.4000112I196 K197 P199 G200 I203 F219 R220 W225 I226 V227I196-Y223 PolarHBondContact O-OH 2.97Å; I196-Y223 VanDerWaalsContact O-OH 3.12Å; K197-Y223 WeakPolarHBondContact CA-OH 3.38Å; K197-Y223 PolarHBondContact O-OH 3.03Å; P199-Y223 HydrophobicContact CB-CD2 4.42Å; P199-Y223 HydrophobicContact CB-CE2 3.82Å; P199-Y223 HydrophobicContact CG-CE2 4.29Å; G200-Y223 WeakPolarHBondContact CA-OH 3.39Å; G200-Y223 PolarHBondContact N-OH 3.03Å; G200-Y223 VanDerWaalsContact N-OH 3.08Å; I203-Y223 HydrophobicContact CD1-CD1 4.2Å; I203-Y223 HydrophobicContact CD1-CG 4.24Å; F219-Y223 VanDerWaalsContact O-CB 3.23Å; F219-Y223 WeakPolarHBondContact O-CB 3.4Å; F219-Y223 PolarHBondContact O-N 2.9Å; R220-Y223 PolarHBondContact O-N 3.24Å; Y223-W225 VanDerWaalsContact C-N 3.33Å; Y223-W225 PolarHBondContact O-N 2.84Å; Y223-I226 PolarHBondContact O-N 3.44Å; Y223-V227 HydrophobicContact CD2-CG2 3.79Å; Y223-V227 HydrophobicContact CE2-CB 4.33Å; Y223-V227 HydrophobicContact CE2-CG2 3.55Å; Y223-V227 HydrophobicContact CG-CG2 4.46Å; Y223-V227 WeakPolarHBondContact O-CB 3.48Å; Y223-V227 PolarHBondContact O-N 3.25Å
224I90.4Very high91.1Very high14 Ų1464.9 Ų64.97%0.07231%0.305CS..Hα-helixtrans-60.1-44.3176.2-69.9163000110.6R220 K221 I222 Q228 R419 F420R220-I224 HydrophobicContact CG-CD1 3.77Å; R220-I224 WeakPolarHBondContact O-CB 3.45Å; R220-I224 WeakPolarHBondContact O-CD1 3.3Å; R220-I224 WeakPolarHBondContact O-CG1 3.43Å; R220-I224 PolarHBondContact O-N 3.36Å; K221-I224 PolarHBondContact O-N 3.12Å; I222-I224 PolarHBondContact O-N 2.83Å; I224-Q228 HydrophobicContact CG2-CB 4.38Å; I224-Q228 WeakPolarHBondContact O-CA 3.49Å; I224-Q228 WeakPolarHBondContact O-CB 3.39Å; I224-Q228 PolarHBondContact O-N 3.44Å; I224-R419 HydrophobicContact CD1-CB 4.31Å; I224-R419 HydrophobicContact CG2-CB 4.45Å; I224-F420 HydrophobicContact CG2-CE2 4.29Å
225W91.4Very high91.5Very high142 Ų14259.3 Ų59.354%0.53829%0.286SS..Iπ-helixtrans-63.9-48.3179.7-165.988.6000112.2K221 I222 Y223 I229 L230K221-W225 WeakPolarHBondContact O-CB 3.23Å; K221-W225 PolarHBondContact O-N 2.94Å; I222-W225 PolarHBondContact O-N 3.48Å; Y223-W225 VanDerWaalsContact C-N 3.33Å; Y223-W225 PolarHBondContact O-N 2.84Å; W225-I229 HydrophobicContact CG-CD1 4.25Å; W225-I229 VanDerWaalsContact O-CB 3.28Å; W225-I229 WeakPolarHBondContact O-CB 3.43Å; W225-I229 PolarHBondContact O-N 3.31Å; W225-L230 PolarHBondContact O-N 3.31Å
226I93.8Very high91.8Very high77 Ų7754.6 Ų54.640%0.39526%0.258SS..Iπ-helixtrans-68.5-48.4-179.5-65175.4000111.4I222 Y223 L230 L231I222-I226 HydrophobicContact CG2-CD1 3.62Å; I222-I226 HydrophobicContact CG2-CG1 4.3Å; I222-I226 WeakPolarHBondContact O-CG1 3.35Å; I222-I226 PolarHBondContact O-N 3.5Å; Y223-I226 PolarHBondContact O-N 3.44Å; I226-L230 WeakPolarHBondContact O-CB 3.44Å; I226-L230 PolarHBondContact O-N 3.11Å; I226-L231 WeakPolarHBondContact O-CB 3.46Å; I226-L231 PolarHBondContact O-N 2.86Å
227V92.9Very high91.9Very high13 Ų1354.1 Ų54.18%0.07925%0.253CS..Iπ-helixtrans-79.7-46-173.8177.40000111.9I196 Y223 F232I196-V227 HydrophobicContact CG2-CG1 3.7Å; I196-V227 HydrophobicContact CG2-CG2 4.36Å; Y223-V227 HydrophobicContact CD2-CG2 3.79Å; Y223-V227 HydrophobicContact CE2-CB 4.33Å; Y223-V227 HydrophobicContact CE2-CG2 3.55Å; Y223-V227 HydrophobicContact CG-CG2 4.46Å; Y223-V227 WeakPolarHBondContact O-CB 3.48Å; Y223-V227 PolarHBondContact O-N 3.25Å; V227-F232 WeakPolarHBondContact O-CB 3.19Å; V227-F232 PolarHBondContact O-N 2.93Å; V227-F232 VanDerWaalsContact O-N 3.12Å
228Q90.2Very high92.3Very high2 Ų254.8 Ų54.81%0.00926%0.262CS..Iπ-helixtrans-84.8-30.6-173.9-158753.600113.5D147 I224 F232 V416D147-Q228 PolarHBondContact OD1-NE2 3.34Å; D147-Q228 PolarHBondContact OD2-NE2 2.89Å; D147-Q228 PolarHBondContact OD2-OE1 3.23Å; I224-Q228 HydrophobicContact CG2-CB 4.38Å; I224-Q228 WeakPolarHBondContact O-CA 3.49Å; I224-Q228 WeakPolarHBondContact O-CB 3.39Å; I224-Q228 PolarHBondContact O-N 3.44Å; Q228-F232 WeakPolarHBondContact O-CB 3.34Å; Q228-V416 HydrophobicContact CB-CG2 4.22Å; Q228-V416 HydrophobicContact CG-CG2 3.73Å
229I90.1Very high92.6Very high32 Ų3254.3 Ų54.316%0.16426%0.26CS..Iπ-helixtrans-96.8-61.8178.6-50-179.6000110.4W225 L233 I234 V416 F420W225-I229 HydrophobicContact CG-CD1 4.25Å; W225-I229 VanDerWaalsContact O-CB 3.28Å; W225-I229 WeakPolarHBondContact O-CB 3.43Å; W225-I229 PolarHBondContact O-N 3.31Å; I229-L233 WeakPolarHBondContact O-CB 3.5Å; I229-L233 PolarHBondContact O-N 3.05Å; I229-I234 HydrophobicContact CG2-CD1 3.87Å; I229-I234 HydrophobicContact CG2-CG1 4.29Å; I229-I234 PolarHBondContact O-N 3.47Å; I229-V416 HydrophobicContact CD1-CG1 3.68Å; I229-V416 HydrophobicContact CD1-CG2 4.42Å; I229-V416 HydrophobicContact CG1-CG1 3.97Å; I229-V416 HydrophobicContact CG1-CG2 3.78Å; I229-F420 HydrophobicContact CD1-CE2 4.28Å
230L93.9Very high92.7Very high62 Ų6249.2 Ų49.233%0.32524%0.238SC..Iπ-helixtrans-67.5-51-172.4178.165.4000112W225 I226 I234 I235W225-L230 PolarHBondContact O-N 3.31Å; I226-L230 WeakPolarHBondContact O-CB 3.44Å; I226-L230 PolarHBondContact O-N 3.11Å; L230-I234 HydrophobicContact CD1-CB 4.27Å; L230-I234 HydrophobicContact CD1-CG2 4.28Å; L230-I234 PolarHBondContact O-N 3.47Å; L230-I235 HydrophobicContact CD1-CD1 4.06Å; L230-I235 HydrophobicContact CD1-CG1 4Å; L230-I235 HydrophobicContact CD2-CD1 4.49Å; L230-I235 HydrophobicContact CG-CD1 3.84Å; L230-I235 HydrophobicContact CG-CG1 4.26Å; L230-I235 WeakPolarHBondContact O-CB 3.33Å; L230-I235 WeakPolarHBondContact O-CG1 3.38Å; L230-I235 PolarHBondContact O-N 3.47Å
231L93.7Very high92.9Very high37 Ų3747.4 Ų47.419%0.19424%0.236CC..Iπ-helixtrans-85.3-30.9-170.2-171.465000114.6W155 I196 I226 I235 P236W155-L231 HydrophobicContact CZ2-CD1 3.82Å; I196-L231 HydrophobicContact CB-CD2 4.44Å; I196-L231 HydrophobicContact CD1-CD2 3.73Å; I196-L231 HydrophobicContact CG1-CD2 4.02Å; I196-L231 HydrophobicContact CG2-CD2 3.54Å; I226-L231 WeakPolarHBondContact O-CB 3.46Å; I226-L231 PolarHBondContact O-N 2.86Å; L231-I235 HydrophobicContact CD1-CD1 4.31Å; L231-P236 WeakPolarHBondContact O-CD 3.44Å; L231-P236 VanDerWaalsContact O-CG 3.28Å; L231-P236 WeakPolarHBondContact O-CG 3.22Å
232F92.1Very high93.1Very high1 Ų148.8 Ų48.80%0.00424%0.243CC..Iπ-helixtrans-87-39.6179.2-172.8-68.9000112.6D147 L150 L151 N154 V227 Q228 P236 Q408 V412D147-F232 WeakPolarHBondContact O-CE2 3.33Å; L150-F232 HydrophobicContact CB-CE2 3.85Å; L150-F232 HydrophobicContact CB-CZ 3.52Å; L150-F232 HydrophobicContact CD1-CZ 4.4Å; L151-F232 HydrophobicContact CB-CD2 3.86Å; L151-F232 HydrophobicContact CB-CE2 3.99Å; L151-F232 HydrophobicContact CD1-CB 4.17Å; L151-F232 HydrophobicContact CD1-CD2 3.85Å; L151-F232 HydrophobicContact CD1-CG 4.26Å; L151-F232 HydrophobicContact CG-CD2 4.41Å; N154-F232 WeakPolarHBondContact ND2-CD1 3.3Å; N154-F232 WeakPolarHBondContact ND2-CE1 3.23Å; N154-F232 PolarHBondContact ND2-O 3.27Å; V227-F232 WeakPolarHBondContact O-CB 3.19Å; V227-F232 PolarHBondContact O-N 2.93Å; V227-F232 VanDerWaalsContact O-N 3.12Å; Q228-F232 WeakPolarHBondContact O-CB 3.34Å; F232-P236 WeakPolarHBondContact O-CG 3.45Å; F232-Q408 VanDerWaalsContact CE1-NE2 3.33Å; F232-V412 HydrophobicContact CD1-CG1 4.14Å; F232-V412 HydrophobicContact CD1-CG2 3.67Å; F232-V412 HydrophobicContact CE1-CB 4.46Å; F232-V412 HydrophobicContact CE1-CG1 4.44Å; F232-V412 HydrophobicContact CE1-CG2 3.19Å; F232-V412 HydrophobicContact CZ-CG2 4.08Å
233L90.4Very high93.3Very high51 Ų5145 Ų4527%0.26722%0.223SC..Iπ-helixtrans-103.1-67.4-175.4-172.568000111.9I229 I235 F237 V412I229-L233 WeakPolarHBondContact O-CB 3.5Å; I229-L233 PolarHBondContact O-N 3.05Å; L233-I235 PolarHBondContact O-N 2.89Å; L233-F237 WeakPolarHBondContact O-CB 3.47Å; L233-F237 PolarHBondContact O-N 3.03Å; L233-V412 HydrophobicContact CB-CG1 4.21Å; L233-V412 HydrophobicContact CD2-CG1 4.34Å
234I93.2Very high93.2Very high75 Ų7543.7 Ų43.739%0.38522%0.218SC..Iπ-helixtrans-64.6-48.3-165.4-62.1175.9000112.5I229 L230 S238I229-I234 HydrophobicContact CG2-CD1 3.87Å; I229-I234 HydrophobicContact CG2-CG1 4.29Å; I229-I234 PolarHBondContact O-N 3.47Å; L230-I234 HydrophobicContact CD1-CB 4.27Å; L230-I234 HydrophobicContact CD1-CG2 4.28Å; L230-I234 PolarHBondContact O-N 3.47Å; I234-S238 WeakPolarHBondContact O-CB 3.31Å; I234-S238 PolarHBondContact O-N 2.86Å; I234-S238 PolarHBondContact O-OG 3.34Å
235I96.2Very high93.3Very high56 Ų5646.4 Ų46.429%0.28724%0.235SC..Hα-helixtrans-67.6-53.9-176.4-70170.5000111.4W155 L230 L231 L233 F237 S238 I239W155-I235 HydrophobicContact CH2-CG2 3.67Å; W155-I235 HydrophobicContact CZ2-CG2 4.11Å; L230-I235 HydrophobicContact CD1-CD1 4.06Å; L230-I235 HydrophobicContact CD1-CG1 4Å; L230-I235 HydrophobicContact CD2-CD1 4.49Å; L230-I235 HydrophobicContact CG-CD1 3.84Å; L230-I235 HydrophobicContact CG-CG1 4.26Å; L230-I235 WeakPolarHBondContact O-CB 3.33Å; L230-I235 WeakPolarHBondContact O-CG1 3.38Å; L230-I235 PolarHBondContact O-N 3.47Å; L231-I235 HydrophobicContact CD1-CD1 4.31Å; L233-I235 PolarHBondContact O-N 2.89Å; I235-F237 VanDerWaalsContact C-N 3.27Å; I235-F237 PolarHBondContact O-N 2.99Å; I235-S238 PolarHBondContact O-N 3.45Å; I235-I239 HydrophobicContact CG2-CD1 3.79Å; I235-I239 WeakPolarHBondContact O-CG1 3.28Å; I235-I239 PolarHBondContact O-N 2.88Å
236P95.3Very high93.5Very high1 Ų144.8 Ų44.81%0.00623%0.229CC..Hα-helixtrans-58-41177.6-27.838.2000112.2N154 W155 V158 L231 F232 L240N154-P236 HydrophobicContact CB-CB 4.38Å; W155-P236 HydrophobicContact CZ2-CG 4.04Å; V158-P236 HydrophobicContact CG2-CB 3.79Å; V158-P236 WeakPolarHBondContact CG2-O 3.43Å; L231-P236 WeakPolarHBondContact O-CD 3.44Å; L231-P236 VanDerWaalsContact O-CG 3.28Å; L231-P236 WeakPolarHBondContact O-CG 3.22Å; F232-P236 WeakPolarHBondContact O-CG 3.45Å; P236-L240 WeakPolarHBondContact O-CB 3.41Å; P236-L240 PolarHBondContact O-N 3.24Å
237F92.3Very high93.5Very high52 Ų5241.2 Ų41.223%0.22821%0.211CC..Hα-helixtrans-63.9-44.5177.9172.3-110.6000112.9L233 I235 L240 T241 F405L233-F237 WeakPolarHBondContact O-CB 3.47Å; L233-F237 PolarHBondContact O-N 3.03Å; I235-F237 VanDerWaalsContact C-N 3.27Å; I235-F237 PolarHBondContact O-N 2.99Å; F237-L240 PolarHBondContact O-N 2.93Å; F237-T241 WeakPolarHBondContact CE2-OG1 3.38Å; F237-T241 HydrophobicContact CZ-CG2 4.42Å; F237-T241 WeakPolarHBondContact CZ-OG1 3.32Å; F237-T241 WeakPolarHBondContact O-CB 3.25Å; F237-T241 PolarHBondContact O-N 2.72Å; F237-T241 PolarHBondContact O-OG1 2.72Å; F237-T241 VanDerWaalsContact O-OG1 3.1Å; F237-F405 HydrophobicContact CD1-CZ 4.48Å; F237-F405 HydrophobicContact CD2-CE1 4.04Å; F237-F405 AromaticContact CD2-CE2 3.95Å; F237-F405 HydrophobicContact CD2-CE2 3.95Å; F237-F405 AromaticContact CD2-CZ 3.65Å; F237-F405 HydrophobicContact CD2-CZ 3.65Å; F237-F405 AromaticContact CE1-CZ 3.92Å; F237-F405 HydrophobicContact CE1-CZ 3.92Å; F237-F405 HydrophobicContact CE2-CD2 4.14Å; F237-F405 AromaticContact CE2-CE1 3.83Å; F237-F405 HydrophobicContact CE2-CE1 3.83Å; F237-F405 AromaticContact CE2-CE2 3.15Å; F237-F405 HydrophobicContact CE2-CE2 3.15Å; F237-F405 AromaticContact CE2-CZ 2.99Å; F237-F405 HydrophobicContact CE2-CZ 2.99Å; F237-F405 HydrophobicContact CG-CZ 4.38Å; F237-F405 HydrophobicContact CZ-CE1 4.11Å; F237-F405 AromaticContact CZ-CE2 3.66Å; F237-F405 HydrophobicContact CZ-CE2 3.66Å; F237-F405 AromaticContact CZ-CZ 3.16Å; F237-F405 HydrophobicContact CZ-CZ 3.16Å
238S95Very high93.4Very high60 Ų6042.6 Ų42.642%0.4222%0.218SC..Hα-helixtrans-65.4-43-179.6-670000111.7I234 I235 F242I234-S238 WeakPolarHBondContact O-CB 3.31Å; I234-S238 PolarHBondContact O-N 2.86Å; I234-S238 PolarHBondContact O-OG 3.34Å; I235-S238 PolarHBondContact O-N 3.45Å; S238-F242 VanDerWaalsContact O-CB 3.26Å; S238-F242 WeakPolarHBondContact O-CB 3.4Å; S238-F242 PolarHBondContact O-N 3.18Å
239I96.7Very high93.6Very high59 Ų5946.4 Ų46.430%0.30324%0.235SC..Hα-helixtrans-64.6-47.5174.9-60.5167.7000110W155 V158 I235 T241 F242 V243W155-I239 HydrophobicContact CH2-CD1 4.39Å; W155-I239 HydrophobicContact CZ3-CD1 4.22Å; V158-I239 HydrophobicContact CG1-CB 4.06Å; V158-I239 HydrophobicContact CG1-CD1 4.5Å; V158-I239 HydrophobicContact CG1-CG2 3.54Å; I235-I239 HydrophobicContact CG2-CD1 3.79Å; I235-I239 WeakPolarHBondContact O-CG1 3.28Å; I235-I239 PolarHBondContact O-N 2.88Å; I239-T241 PolarHBondContact O-N 3.12Å; I239-F242 PolarHBondContact O-N 3.06Å; I239-V243 HydrophobicContact CG2-CG2 4Å; I239-V243 VanDerWaalsContact O-CB 3.27Å; I239-V243 WeakPolarHBondContact O-CB 3.4Å; I239-V243 WeakPolarHBondContact O-CG2 3.44Å; I239-V243 PolarHBondContact O-N 2.96Å
240L94.1Very high93.8Very high7 Ų747.2 Ų47.24%0.03724%0.242CC..Hα-helixtrans-57.5-48.9179.3-174.564.6000111.1T157 A161 P236 F237 V243 N244 I401T157-L240 HydrophobicContact CG2-CD1 4.46Å; A161-L240 HydrophobicContact CB-CD1 3.51Å; P236-L240 WeakPolarHBondContact O-CB 3.41Å; P236-L240 PolarHBondContact O-N 3.24Å; F237-L240 PolarHBondContact O-N 2.93Å; L240-V243 PolarHBondContact O-N 3.24Å; L240-N244 VanDerWaalsContact CD1-ND2 3.27Å; L240-N244 WeakPolarHBondContact CD1-ND2 3.24Å; L240-N244 WeakPolarHBondContact CG-ND2 3.43Å; L240-N244 VanDerWaalsContact O-CB 3.27Å; L240-N244 WeakPolarHBondContact O-CB 3.15Å; L240-N244 PolarHBondContact O-N 3.15Å; L240-N244 PolarHBondContact O-ND2 3.12Å; L240-I401 HydrophobicContact CD2-CG1 4.29Å; L240-I401 HydrophobicContact CD2-CG2 4.47Å; L240-I401 HydrophobicContact CG-CG1 4.25Å
241T92.8Very high93.6Very high48 Ų4845.5 Ų45.529%0.29423%0.234SC..Hα-helixtrans-62.6-48177.8-65.10000112.2F237 I239 V243 N244 V245F237-T241 WeakPolarHBondContact CE2-OG1 3.38Å; F237-T241 HydrophobicContact CZ-CG2 4.42Å; F237-T241 WeakPolarHBondContact CZ-OG1 3.32Å; F237-T241 WeakPolarHBondContact O-CB 3.25Å; F237-T241 PolarHBondContact O-N 2.72Å; F237-T241 PolarHBondContact O-OG1 2.72Å; F237-T241 VanDerWaalsContact O-OG1 3.1Å; I239-T241 PolarHBondContact O-N 3.12Å; T241-V243 PolarHBondContact O-N 3.37Å; T241-N244 PolarHBondContact O-N 2.95Å; T241-V245 HydrophobicContact CG2-CG2 4.24Å; T241-V245 WeakPolarHBondContact O-CB 3.33Å; T241-V245 VanDerWaalsContact O-CG2 3.3Å; T241-V245 WeakPolarHBondContact O-CG2 3.34Å; T241-V245 PolarHBondContact O-N 2.77Å
242F95.7Very high93.6Very high117 Ų11751.6 Ų51.651%0.51325%0.254SS..Hα-helixtrans-57.7-50.5178.1174.1-96.9000111.9S238 I239 N244 V245 R246S238-F242 VanDerWaalsContact O-CB 3.26Å; S238-F242 WeakPolarHBondContact O-CB 3.4Å; S238-F242 PolarHBondContact O-N 3.18Å; I239-F242 PolarHBondContact O-N 3.06Å; F242-N244 VanDerWaalsContact C-N 3.29Å; F242-N244 PolarHBondContact O-N 2.74Å; F242-V245 PolarHBondContact O-N 2.73Å; F242-R246 HydrophobicContact CD1-CG 4.46Å; F242-R246 HydrophobicContact CD2-CG 4.48Å; F242-R246 HydrophobicContact CE1-CG 4.11Å; F242-R246 HydrophobicContact CE2-CG 4.14Å; F242-R246 HydrophobicContact CZ-CG 3.94Å; F242-R246 WeakPolarHBondContact O-CB 3.48Å; F242-R246 VanDerWaalsContact O-CG 3.29Å; F242-R246 WeakPolarHBondContact O-CG 3.43Å; F242-R246 PolarHBondContact O-N 3.5Å
243V95.2Very high93.7Very high8 Ų855.9 Ų55.95%0.04828%0.277CS..Hα-helixtrans-59.4-41.5179.7169.30000111.1A161 Y165 I239 L240 T241 L247A161-V243 HydrophobicContact CB-CG1 4.13Å; A161-V243 WeakPolarHBondContact O-CG1 3.44Å; Y165-V243 VanDerWaalsContact CB-CG1 3.48Å; Y165-V243 HydrophobicContact CG-CG1 4.03Å; I239-V243 HydrophobicContact CG2-CG2 4Å; I239-V243 VanDerWaalsContact O-CB 3.27Å; I239-V243 WeakPolarHBondContact O-CB 3.4Å; I239-V243 WeakPolarHBondContact O-CG2 3.44Å; I239-V243 PolarHBondContact O-N 2.96Å; L240-V243 PolarHBondContact O-N 3.24Å; T241-V243 PolarHBondContact O-N 3.37Å; V243-L247 WeakPolarHBondContact O-CB 3.37Å; V243-L247 PolarHBondContact O-N 3.26Å
244N91.6Very high93.7Very high3 Ų355.3 Ų55.32%0.01628%0.277CS..Hα-helixtrans-77.7-36.7-177-64.2-26.1000112.7L240 T241 F242 L247 I248 L397 I401L240-N244 VanDerWaalsContact CD1-ND2 3.27Å; L240-N244 WeakPolarHBondContact CD1-ND2 3.24Å; L240-N244 WeakPolarHBondContact CG-ND2 3.43Å; L240-N244 VanDerWaalsContact O-CB 3.27Å; L240-N244 WeakPolarHBondContact O-CB 3.15Å; L240-N244 PolarHBondContact O-N 3.15Å; L240-N244 PolarHBondContact O-ND2 3.12Å; T241-N244 PolarHBondContact O-N 2.95Å; F242-N244 VanDerWaalsContact C-N 3.29Å; F242-N244 PolarHBondContact O-N 2.74Å; N244-L247 PolarHBondContact O-N 2.92Å; N244-I248 VanDerWaalsContact O-CG1 3.27Å; N244-I248 WeakPolarHBondContact O-CG1 3.43Å; N244-I248 PolarHBondContact O-N 3.02Å; N244-L397 HydrophobicContact CB-CD2 4.34Å; N244-L397 WeakPolarHBondContact OD1-CD1 3.39Å; N244-L397 WeakPolarHBondContact OD1-CD2 3.4Å; N244-L397 WeakPolarHBondContact OD1-CG 3.46Å; N244-I401 HydrophobicContact CB-CD1 3.61Å; N244-I401 WeakPolarHBondContact ND2-CD1 3.48Å; N244-I401 WeakPolarHBondContact ND2-CG1 3.36Å
245V93.5Very high93.6Very high71 Ų7155.2 Ų55.243%0.4328%0.277SS..Hα-helixtrans-60.5-45.8169.7168.60000110.4T241 F242 L247 I248 Q249T241-V245 HydrophobicContact CG2-CG2 4.24Å; T241-V245 WeakPolarHBondContact O-CB 3.33Å; T241-V245 VanDerWaalsContact O-CG2 3.3Å; T241-V245 WeakPolarHBondContact O-CG2 3.34Å; T241-V245 PolarHBondContact O-N 2.77Å; F242-V245 PolarHBondContact O-N 2.73Å; V245-L247 PolarHBondContact O-N 2.78Å; V245-I248 PolarHBondContact O-N 3Å; V245-Q249 WeakPolarHBondContact O-CG 3.47Å; V245-Q249 PolarHBondContact O-N 3.45Å
246R95.4Very high93.5Very high109 Ų10958.1 Ų58.141%0.41129%0.29SS..Hα-helixtrans-63.1-39.8176-70.4-61-165.9-179.96.5112.4Y165 F242 Q249 T250Y165-R246 HydrophobicContact CD2-CB 4.12Å; Y165-R246 HydrophobicContact CE2-CB 3.57Å; F242-R246 HydrophobicContact CD1-CG 4.46Å; F242-R246 HydrophobicContact CD2-CG 4.48Å; F242-R246 HydrophobicContact CE1-CG 4.11Å; F242-R246 HydrophobicContact CE2-CG 4.14Å; F242-R246 HydrophobicContact CZ-CG 3.94Å; F242-R246 WeakPolarHBondContact O-CB 3.48Å; F242-R246 VanDerWaalsContact O-CG 3.29Å; F242-R246 WeakPolarHBondContact O-CG 3.43Å; F242-R246 PolarHBondContact O-N 3.5Å; R246-Q249 VanDerWaalsContact NH1-OE1 3.15Å; R246-Q249 PolarHBondContact O-N 3.03Å; R246-T250 PolarHBondContact O-N 2.9Å; R246-T250 PolarHBondContact O-OG1 3.02Å
247L92.5Very high93.5Very high1 Ų162.7 Ų62.71%0.00531%0.314CS..Hα-helixtrans-62.7-45.8174.3-173.3148.6000111.7R164 Y165 V168 V243 N244 V245 Q249 T250 V251 T394 L397R164-L247 HydrophobicContact CB-CD1 4.45Å; Y165-L247 HydrophobicContact CD2-CB 4.42Å; V168-L247 HydrophobicContact CG2-CD1 4.24Å; V243-L247 WeakPolarHBondContact O-CB 3.37Å; V243-L247 PolarHBondContact O-N 3.26Å; N244-L247 PolarHBondContact O-N 2.92Å; V245-L247 PolarHBondContact O-N 2.78Å; L247-Q249 VanDerWaalsContact C-N 3.34Å; L247-Q249 PolarHBondContact O-N 3.37Å; L247-T250 PolarHBondContact O-N 3.41Å; L247-V251 HydrophobicContact CD2-CG2 4Å; L247-V251 WeakPolarHBondContact O-CG2 3.35Å; L247-V251 PolarHBondContact O-N 2.93Å; L247-T394 HydrophobicContact CD2-CG2 4Å; L247-L397 HydrophobicContact CB-CD2 4.41Å; L247-L397 HydrophobicContact CD1-CD2 3.67Å; L247-L397 HydrophobicContact CD2-CD2 3.81Å; L247-L397 HydrophobicContact CG-CD2 4.17Å
248I91.8Very high93.4Very high43 Ų4362 Ų6222%0.22131%0.312CS..Hα-helixtrans-61.9-41.7177.2-68.2163000111.1N244 V245 R252 T394 I398N244-I248 VanDerWaalsContact O-CG1 3.27Å; N244-I248 WeakPolarHBondContact O-CG1 3.43Å; N244-I248 PolarHBondContact O-N 3.02Å; V245-I248 PolarHBondContact O-N 3Å; I248-R252 HydrophobicContact CG2-CG 4.46Å; I248-R252 WeakPolarHBondContact O-CB 3.25Å; I248-R252 VanDerWaalsContact O-CG 3.29Å; I248-R252 WeakPolarHBondContact O-CG 3.31Å; I248-R252 PolarHBondContact O-N 3.48Å; I248-T394 HydrophobicContact CG1-CG2 4.06Å; I248-I398 HydrophobicContact CD1-CD1 3.96Å; I248-I398 HydrophobicContact CD1-CG1 4.12Å; I248-I398 HydrophobicContact CG1-CD1 4.48Å
249Q95Very high93.3Very high82 Ų8262.7 Ų62.738%0.38331%0.311SS..Hα-helixtrans-59.1-49.8173.5-73.8174.2-4.200111.2V245 R246 L247 V251 R252 N253V245-Q249 WeakPolarHBondContact O-CG 3.47Å; V245-Q249 PolarHBondContact O-N 3.45Å; R246-Q249 VanDerWaalsContact NH1-OE1 3.15Å; R246-Q249 PolarHBondContact O-N 3.03Å; L247-Q249 VanDerWaalsContact C-N 3.34Å; L247-Q249 PolarHBondContact O-N 3.37Å; Q249-V251 PolarHBondContact O-N 3.47Å; Q249-R252 PolarHBondContact O-N 3.02Å; Q249-N253 WeakPolarHBondContact O-CB 3.24Å; Q249-N253 PolarHBondContact O-N 3.34Å; Q249-N253 PolarHBondContact O-OD1 2.9Å
250T93.2Very high93.2Very high48 Ų4865.8 Ų65.829%0.29432%0.324SS..Hα-helixtrans-61.5-43.6179.7-58.90000112.3V168 R246 L247 N253 S254V168-T250 HydrophobicContact CG1-CG2 4.05Å; R246-T250 PolarHBondContact O-N 2.9Å; R246-T250 PolarHBondContact O-OG1 3.02Å; L247-T250 PolarHBondContact O-N 3.41Å; T250-N253 PolarHBondContact O-N 3.07Å; T250-S254 PolarHBondContact O-N 2.97Å; T250-S254 PolarHBondContact O-OG 3.31Å
251V90.5Very high93.1Very high26 Ų2674.2 Ų74.216%0.15836%0.355CS..Hα-helixtrans-68.3-34.8178.1173.30000112V168 L247 Q249 S254 L255V168-V251 HydrophobicContact CG1-CG2 4.34Å; L247-V251 HydrophobicContact CD2-CG2 4Å; L247-V251 WeakPolarHBondContact O-CG2 3.35Å; L247-V251 PolarHBondContact O-N 2.93Å; Q249-V251 PolarHBondContact O-N 3.47Å; V251-S254 PolarHBondContact O-OG 3.45Å; V251-L255 VanDerWaalsContact O-CB 3.28Å; V251-L255 WeakPolarHBondContact O-CB 3.13Å; V251-L255 PolarHBondContact O-N 3.47Å; V251-L255 VanDerWaalsContact O-N 3.08Å
252R93.3Very high93Very high165 Ų16574.3 Ų74.362%0.62336%0.358SS*.Hα-helixtrans-66.6-43172.5-76.6176177.1-178.3-0.5111.5I248 Q249 L255 Q256I248-R252 HydrophobicContact CG2-CG 4.46Å; I248-R252 WeakPolarHBondContact O-CB 3.25Å; I248-R252 VanDerWaalsContact O-CG 3.29Å; I248-R252 WeakPolarHBondContact O-CG 3.31Å; I248-R252 PolarHBondContact O-N 3.48Å; Q249-R252 PolarHBondContact O-N 3.02Å; R252-L255 PolarHBondContact O-N 2.86Å; R252-Q256 WeakPolarHBondContact O-CG 3.31Å; R252-Q256 PolarHBondContact O-N 3.28Å
253N94.1Very high92.9Very high91 Ų9176.2 Ų76.249%0.48737%0.366SS..Hα-helixtrans-66.5-42179.2-67-4.6000111.7Q249 T250 Q256 L257Q249-N253 WeakPolarHBondContact O-CB 3.24Å; Q249-N253 PolarHBondContact O-N 3.34Å; Q249-N253 PolarHBondContact O-OD1 2.9Å; T250-N253 PolarHBondContact O-N 3.07Å; N253-Q256 PolarHBondContact O-N 3.29Å; N253-L257 WeakPolarHBondContact O-CG 3.32Å; N253-L257 PolarHBondContact O-N 3.3Å; N253-L257 VanDerWaalsContact O-N 3.1Å
254S91.2Very high92.8Very high39 Ų3982.1 Ų82.127%0.27339%0.39SS..Hα-helixtrans-63.5-42.8174.966.40000111.8T250 V251 Q256 L257 I258T250-S254 PolarHBondContact O-N 2.97Å; T250-S254 PolarHBondContact O-OG 3.31Å; V251-S254 PolarHBondContact O-OG 3.45Å; S254-Q256 PolarHBondContact O-N 3.27Å; S254-L257 PolarHBondContact O-N 3.08Å; S254-I258 VanDerWaalsContact O-CG1 3.31Å; S254-I258 WeakPolarHBondContact O-CG1 3.43Å; S254-I258 PolarHBondContact O-N 3.46Å
255L90.4Very high92.8Very high74 Ų7485.4 Ų85.439%0.38741%0.411SS..Hα-helixtrans-62.4-41.1176.3-178.260.8000112.4V251 R252 I258 N259V251-L255 VanDerWaalsContact O-CB 3.28Å; V251-L255 WeakPolarHBondContact O-CB 3.13Å; V251-L255 PolarHBondContact O-N 3.47Å; V251-L255 VanDerWaalsContact O-N 3.08Å; R252-L255 PolarHBondContact O-N 2.86Å; L255-I258 PolarHBondContact O-N 3.25Å; L255-N259 WeakPolarHBondContact O-CB 3.27Å; L255-N259 PolarHBondContact O-N 3.06Å; L255-N259 PolarHBondContact O-ND2 3.05Å
256Q94.8Very high92.6Very high116 Ų11685.8 Ų85.854%0.54241%0.414SS..Hα-helixtrans-61.2-46.2175.1-76.5176.7-3.500111.9R252 N253 S254 I258 N259 Q260R252-Q256 WeakPolarHBondContact O-CG 3.31Å; R252-Q256 PolarHBondContact O-N 3.28Å; N253-Q256 PolarHBondContact O-N 3.29Å; S254-Q256 PolarHBondContact O-N 3.27Å; Q256-I258 PolarHBondContact O-N 3.15Å; Q256-N259 PolarHBondContact O-N 3.25Å; Q256-Q260 WeakPolarHBondContact O-CG 3.33Å; Q256-Q260 PolarHBondContact O-N 2.87Å
257L93.8Very high92.6Very high98 Ų9888.1 Ų88.151%0.51343%0.427SS..Hα-helixtrans-63.6-38.8177.6-69.9172.1000112.4N253 S254 Q260 R261N253-L257 WeakPolarHBondContact O-CG 3.32Å; N253-L257 PolarHBondContact O-N 3.3Å; N253-L257 VanDerWaalsContact O-N 3.1Å; S254-L257 PolarHBondContact O-N 3.08Å; L257-Q260 PolarHBondContact O-N 2.91Å; L257-R261 WeakPolarHBondContact O-CG 3.04Å; L257-R261 PolarHBondContact O-N 2.93Å; L257-R261 VanDerWaalsContact O-N 3.1Å
258I90.8Very high92.5Very high37 Ų3793 Ų9319%0.1945%0.45CS..Hα-helixtrans-64.5-47.8174.6-66.4163.2000110.3S254 L255 Q256 Q260 R261 C262 L383 Q387S254-I258 VanDerWaalsContact O-CG1 3.31Å; S254-I258 WeakPolarHBondContact O-CG1 3.43Å; S254-I258 PolarHBondContact O-N 3.46Å; L255-I258 PolarHBondContact O-N 3.25Å; Q256-I258 PolarHBondContact O-N 3.15Å; I258-Q260 VanDerWaalsContact C-N 3.28Å; I258-Q260 PolarHBondContact O-N 3.23Å; I258-R261 PolarHBondContact O-N 2.9Å; I258-R261 VanDerWaalsContact O-N 3.09Å; I258-C262 PolarHBondContact O-N 3.19Å; I258-C262 PolarHBondContact O-SG 3.12Å; I258-C262 VanDerWaalsContact O-SG 3.37Å; I258-L383 HydrophobicContact CD1-CD1 4.44Å; I258-L383 HydrophobicContact CG2-CD1 4.21Å; I258-L383 HydrophobicContact CG2-CD2 3.8Å; I258-L383 HydrophobicContact CG2-CG 4.26Å; I258-Q387 VanDerWaalsContact CG2-NE2 3.3Å
259N92.7Very high92.4Very high74 Ų7494 Ų9440%0.39646%0.46SS..Hα-helixtrans-61.4-35179-70.4-15.5000112.5L255 Q256 K263L255-N259 WeakPolarHBondContact O-CB 3.27Å; L255-N259 PolarHBondContact O-N 3.06Å; L255-N259 PolarHBondContact O-ND2 3.05Å; Q256-N259 PolarHBondContact O-N 3.25Å; N259-K263 WeakPolarHBondContact O-CB 3.12Å; N259-K263 WeakPolarHBondContact O-CG 3.08Å; N259-K263 PolarHBondContact O-N 2.99Å
260Q95.1Very high92.2Very high124 Ų12495.1 Ų95.158%0.57947%0.468SS*.Hα-helixtrans-65.2-43.7172.7-75174.2-3.900112.1Q256 L257 I258 K263 K264Q256-Q260 WeakPolarHBondContact O-CG 3.33Å; Q256-Q260 PolarHBondContact O-N 2.87Å; L257-Q260 PolarHBondContact O-N 2.91Å; I258-Q260 VanDerWaalsContact C-N 3.28Å; I258-Q260 PolarHBondContact O-N 3.23Å; Q260-K263 PolarHBondContact O-N 3.43Å; Q260-K264 PolarHBondContact O-N 3.4Å
261R92.1Very high92.1Very high184 Ų18499 Ų9969%0.69449%0.486SS*.Hα-helixtrans-62.3-46.8175.8-70.5177.2-173-175.82.4111.6L257 I258 K263 K264 T265L257-R261 WeakPolarHBondContact O-CG 3.04Å; L257-R261 PolarHBondContact O-N 2.93Å; L257-R261 VanDerWaalsContact O-N 3.1Å; I258-R261 PolarHBondContact O-N 2.9Å; I258-R261 VanDerWaalsContact O-N 3.09Å; R261-K263 VanDerWaalsContact C-N 3.35Å; R261-K263 PolarHBondContact O-N 3.43Å; R261-K264 WeakPolarHBondContact O-CB 3.5Å; R261-K264 PolarHBondContact O-N 3.36Å; R261-K264 VanDerWaalsContact O-N 3.08Å; R261-T265 PolarHBondContact O-N 3.49Å; R261-T265 PolarHBondContact O-OG1 3.47Å
262C90.1Very high92Very high51 Ų51101.2 Ų101.235%0.34550%0.503SS..Hα-helixtrans-60.1-42176.2-63.30000112.3I258 K264 T265 T266I258-C262 PolarHBondContact O-N 3.19Å; I258-C262 PolarHBondContact O-SG 3.12Å; I258-C262 VanDerWaalsContact O-SG 3.37Å; C262-K264 VanDerWaalsContact C-N 3.27Å; C262-K264 PolarHBondContact O-N 3.09Å; C262-T265 PolarHBondContact O-N 2.81Å; C262-T265 PolarHBondContact O-OG1 2.88Å; C262-T265 VanDerWaalsContact O-OG1 3.09Å; C262-T266 PolarHBondContact O-N 3.16Å; C262-T266 VanDerWaalsContact O-N 3.1Å; C262-T266 PolarHBondContact O-OG1 2.81Å; C262-T266 VanDerWaalsContact O-OG1 3.08Å
263K93.9Very high91.7Very high157 Ų15797.2 Ų97.268%0.68350%0.5SS*.Hα-helixtrans-63.8-31.4174.7-76.5-179.4178.6-1710113N259 Q260 R261 K267N259-K263 WeakPolarHBondContact O-CB 3.12Å; N259-K263 WeakPolarHBondContact O-CG 3.08Å; N259-K263 PolarHBondContact O-N 2.99Å; Q260-K263 PolarHBondContact O-N 3.43Å; R261-K263 VanDerWaalsContact C-N 3.35Å; R261-K263 PolarHBondContact O-N 3.43Å; K263-K267 WeakPolarHBondContact O-CG 3.33Å; K263-K267 PolarHBondContact O-N 3.5Å
264K94.1Very high91.1Very high131 Ų13196.5 Ų96.557%0.5750%0.502SS*.Hα-helixtrans-72.7-48.6176.4-173.9175170.4177.80111.3Q260 R261 C262 T266 K267 E268Q260-K264 PolarHBondContact O-N 3.4Å; R261-K264 WeakPolarHBondContact O-CB 3.5Å; R261-K264 PolarHBondContact O-N 3.36Å; R261-K264 VanDerWaalsContact O-N 3.08Å; C262-K264 VanDerWaalsContact C-N 3.27Å; C262-K264 PolarHBondContact O-N 3.09Å; K264-T266 VanDerWaalsContact C-N 3.34Å; K264-T266 PolarHBondContact O-N 2.95Å; K264-K267 PolarHBondContact O-N 3.3Å; K264-K267 VanDerWaalsContact O-N 3.11Å; K264-E268 WeakPolarHBondContact CE-OE1 3.31Å; K264-E268 IonicContact NZ-OE1 3.7Å; K264-E268 PolarHBondContact O-N 3.32Å
265T90Very high90.2Very high73 Ų7399.1 Ų99.145%0.44852%0.52SS..Hα-helixtrans-62.6-38.5179.954.70000112.4R261 C262 K267 E268 S269R261-T265 PolarHBondContact O-N 3.49Å; R261-T265 PolarHBondContact O-OG1 3.47Å; C262-T265 PolarHBondContact O-N 2.81Å; C262-T265 PolarHBondContact O-OG1 2.88Å; C262-T265 VanDerWaalsContact O-OG1 3.09Å; T265-K267 VanDerWaalsContact C-N 3.33Å; T265-K267 PolarHBondContact O-N 3.26Å; T265-E268 PolarHBondContact O-N 3.33Å; T265-S269 PolarHBondContact O-N 3.28Å; T265-S269 PolarHBondContact O-OG 3.31Å
266T91Very high89.1Confident79 Ų79101.4 Ų101.449%0.48554%0.537SS..Hα-helixtrans-63.3-35.3174.2-56.70000113C262 K264 S269 I270C262-T266 PolarHBondContact O-N 3.16Å; C262-T266 VanDerWaalsContact O-N 3.1Å; C262-T266 PolarHBondContact O-OG1 2.81Å; C262-T266 VanDerWaalsContact O-OG1 3.08Å; K264-T266 VanDerWaalsContact C-N 3.34Å; K264-T266 PolarHBondContact O-N 2.95Å; T266-S269 WeakPolarHBondContact CA-OG 3.42Å; T266-S269 PolarHBondContact O-OG 2.94Å; T266-I270 HydrophobicContact CG2-CD1 4.06Å; T266-I270 WeakPolarHBondContact O-CD1 3.31Å; T266-I270 VanDerWaalsContact O-CG1 3.23Å; T266-I270 WeakPolarHBondContact O-CG1 3.5Å; T266-I270 PolarHBondContact O-N 2.92Å; T266-I270 VanDerWaalsContact O-N 3.16Å
267K94Very high87.7Confident158 Ų158104.5 Ų104.569%0.68755%0.552SS**Hα-helixtrans-69.3-41.3174.7-75.4-178175.1-165.90111.7K263 K264 T265 I270 L271K263-K267 WeakPolarHBondContact O-CG 3.33Å; K263-K267 PolarHBondContact O-N 3.5Å; K264-K267 PolarHBondContact O-N 3.3Å; K264-K267 VanDerWaalsContact O-N 3.11Å; T265-K267 VanDerWaalsContact C-N 3.33Å; T265-K267 PolarHBondContact O-N 3.26Å; K267-I270 PolarHBondContact O-N 3.24Å; K267-L271 WeakPolarHBondContact O-CB 3.2Å; K267-L271 PolarHBondContact O-N 2.98Å
268E91.5Very high86Confident104 Ų104105.3 Ų105.349%0.48657%0.566SS.*Hα-helixtrans-66-40.3177.8-71.1171.7165.400111.6K264 T265 L271 S272K264-E268 WeakPolarHBondContact CE-OE1 3.31Å; K264-E268 IonicContact NZ-OE1 3.7Å; K264-E268 PolarHBondContact O-N 3.32Å; T265-E268 PolarHBondContact O-N 3.33Å; E268-L271 PolarHBondContact O-N 2.69Å; E268-S272 PolarHBondContact O-N 3.36Å; E268-S272 PolarHBondContact O-OG 3.05Å
269S88.7Confident84.7Confident64 Ų64109.5 Ų109.545%0.44859%0.589SS.*Hα-helixtrans-64.4-43.5175.364.20000112.3T265 T266 L271 S272 S273T265-S269 PolarHBondContact O-N 3.28Å; T265-S269 PolarHBondContact O-OG 3.31Å; T266-S269 WeakPolarHBondContact CA-OG 3.42Å; T266-S269 PolarHBondContact O-OG 2.94Å; S269-L271 PolarHBondContact O-N 3.41Å; S269-S272 PolarHBondContact O-N 2.92Å; S269-S272 PolarHBondContact O-OG 2.95Å; S269-S273 PolarHBondContact O-N 2.77Å
270I91.9Very high83.3Confident105 Ų105111.9 Ų111.954%0.53861%0.608SS.*Hα-helixtrans-60.1-48.4175.6-69.1165.4000110.1T266 K267 S272 S273 S274T266-I270 HydrophobicContact CG2-CD1 4.06Å; T266-I270 WeakPolarHBondContact O-CD1 3.31Å; T266-I270 VanDerWaalsContact O-CG1 3.23Å; T266-I270 WeakPolarHBondContact O-CG1 3.5Å; T266-I270 PolarHBondContact O-N 2.92Å; T266-I270 VanDerWaalsContact O-N 3.16Å; K267-I270 PolarHBondContact O-N 3.24Å; I270-S272 VanDerWaalsContact C-N 3.28Å; I270-S272 PolarHBondContact O-N 3.03Å; I270-S273 PolarHBondContact O-N 3.32Å; I270-S273 PolarHBondContact O-OG 3.35Å; I270-S274 PolarHBondContact O-N 2.82Å; I270-S274 VanDerWaalsContact O-N 3.13Å; I270-S274 PolarHBondContact O-OG 2.78Å
271L91.1Very high81.8Confident129 Ų129109 Ų10968%0.67561%0.612SS**Hα-helixtrans-61-36.9-179.4-150.176.5000112.5K267 E268 S269 S274K267-L271 WeakPolarHBondContact O-CB 3.2Å; K267-L271 PolarHBondContact O-N 2.98Å; E268-L271 PolarHBondContact O-N 2.69Å; S269-L271 PolarHBondContact O-N 3.41Å; L271-S274 PolarHBondContact O-OG 2.85Å
272S87.5Confident80.2Confident73 Ų73106.2 Ų106.251%0.5161%0.609SS.*Hα-helixtrans-70.9-28.2174.970.30000114E268 S269 I270 S275E268-S272 PolarHBondContact O-N 3.36Å; E268-S272 PolarHBondContact O-OG 3.05Å; S269-S272 PolarHBondContact O-N 2.92Å; S269-S272 PolarHBondContact O-OG 2.95Å; I270-S272 VanDerWaalsContact C-N 3.28Å; I270-S272 PolarHBondContact O-N 3.03Å; S272-S275 PolarHBondContact O-OG 3.22Å; S272-S275 VanDerWaalsContact O-OG 3.09Å
273S87Confident78.7Confident80 Ų80111.5 Ų111.556%0.55963%0.633SS**Hα-helixtrans-78.2-25.7176.567.10000113.4S269 I270 T276S269-S273 PolarHBondContact O-N 2.77Å; I270-S273 PolarHBondContact O-N 3.32Å; I270-S273 PolarHBondContact O-OG 3.35Å; S273-T276 PolarHBondContact O-OG1 2.7Å
274S82.4Confident77Confident77 Ų77115.4 Ų115.454%0.53864%0.643SS.*Hα-helixtrans-81.1-15177.247.30000114.6I270 L271 T276I270-S274 PolarHBondContact O-N 2.82Å; I270-S274 VanDerWaalsContact O-N 3.13Å; I270-S274 PolarHBondContact O-OG 2.78Å; L271-S274 PolarHBondContact O-OG 2.85Å; S274-T276 PolarHBondContact O-N 2.87Å
275S72Confident75.1Confident93 Ų93119.4 Ų119.465%0.6566%0.655SS**THydrogen-bonded Turntrans-87.54.9-174550000115.4S272S272-S275 PolarHBondContact O-OG 3.22Å; S272-S275 VanDerWaalsContact O-OG 3.09Å
276T65.9Low73.6Confident122 Ų122124.9 Ų124.975%0.74868%0.677SS**THydrogen-bonded Turntrans-93.4-3.4-179.547.60000114.3S273 S274 S278S273-T276 PolarHBondContact O-OG1 2.7Å; S274-T276 PolarHBondContact O-N 2.87Å; T276-S278 PolarHBondContact O-N 2.83Å
277Q66.4Low72Confident182 Ų182127.9 Ų127.985%0.8570%0.696SS**SBendtrans-84.7101.9170.7-156.816116.900109.3D279Q277-D279 PolarHBondContact O-N 3.24Å
278S58.6Low70.1Confident114 Ų114125 Ų12580%0.79770%0.696SS**  trans-62.4115.8-175.452.10000112.7T276T276-S278 PolarHBondContact O-N 2.83Å
279D63.1Low67.9Low126 Ų126125.4 Ų125.467%0.67471%0.709SS**  trans-133.2107164-158.9-9.4000108.9Q277 G281Q277-D279 PolarHBondContact O-N 3.24Å; D279-G281 PolarHBondContact O-N 2.83Å
280P63.4Low66.2Low123 Ų123133.9 Ų133.980%0.79973%0.732SS**THydrogen-bonded Turntrans-72.85.1-164.527.4-34.4000115.4
281G62.9Low63.9Low65 Ų65134 Ų13467%0.6774%0.74SS**THydrogen-bonded Turntrans-82.8-16-175.100000117.2D279 I283D279-G281 PolarHBondContact O-N 2.83Å; G281-I283 PolarHBondContact O-N 3.34Å
282I57.8Low61.7Low124 Ų124133 Ų13364%0.63674%0.742SS**  trans-10641.5-161-37.4-175.9000114.1
283I60.3Low59.9Low163 Ų163138 Ų13884%0.83676%0.763SS**SBendtrans-85.4-12.4175-71.2178.7000112.9G281G281-I283 PolarHBondContact O-N 3.34Å
284R57.2Low58.1Low238 Ų238138.9 Ų138.990%0.89877%0.769SS**SBendtrans-10310.9-169.5-133.9175.9-169.81713.7117.5
285R55.4Low56.2Low216 Ų216140.7 Ų140.782%0.81578%0.78SS**SBendtrans-125.70.3-178-91.8-173.6-175.31674.3117.4T287R285-T287 VanDerWaalsContact C-N 3.31Å; R285-T287 PolarHBondContact O-N 2.88Å
286M57.3Low54.9Low187 Ų187142 Ų14292%0.92179%0.788SS**THydrogen-bonded Turntrans-84.214.1-174.5-100.1-17417700116.3
287T58.1Low53.9Low142 Ų142143.7 Ų143.787%0.87179%0.791SS**THydrogen-bonded Turntrans-103.8-3.1-176.535.60000116.1R285R285-T287 VanDerWaalsContact C-N 3.31Å; R285-T287 PolarHBondContact O-N 2.88Å
288S53.7Low52.9Low99 Ų99140 Ų14069%0.69279%0.786SS**SBendtrans-113.95.1-168.375.50000117.7
289C45.6Very low52.2Low111 Ų111139.5 Ų139.575%0.7578%0.782SS**  trans-12764.1-175.1-75.30000114.1
290Y51.7Low51.3Low242 Ų242141.3 Ų141.395%0.94979%0.791SS**  trans-115.994.4157.4-95.9-85000110.5
291P44.9Very low50.6Low107 Ų107140.1 Ų140.170%0.69579%0.786SS**  trans-112.2154.5160.234.9-26.2000112.5
292C43.6Very low49.8Very low108 Ų108144.1 Ų144.173%0.7379%0.792SS**SBendtrans69.456.1164.8-63.40000119
293L49.9Very low49.3Very low179 Ų179147.6 Ų147.694%0.93780%0.803SS**SBendtrans-127.211154.5-144.481.1000115.1
294S50.1Low48.6Very low98 Ų98146.5 Ų146.569%0.68580%0.797SS**  trans-130.7-1-17463.60000117.5C296S294-C296 PolarHBondContact O-N 3.24Å
295C42.4Very low48Very low115 Ų115145.5 Ų145.578%0.77780%0.795SS**THydrogen-bonded Turntrans-74.923.5-170.9-68.20000116.9
296C43.9Very low47.6Very low122 Ų122140.2 Ų140.282%0.82479%0.791SS**THydrogen-bonded Turntrans-129.934.6-177.9-66.60000114.4S294S294-C296 PolarHBondContact O-N 3.24Å
297I46.8Very low46.7Very low157 Ų157141.1 Ų141.181%0.80579%0.79SS**SBendtrans-140.8121.3162.2-75.4101.8000111.1
298S44.8Very low46.1Very low105 Ų105142.6 Ų142.673%0.73479%0.786SS**  trans78.3146.1154.8-156.20000122.3
299S43.3Very low45.6Very low102 Ų102145.1 Ų145.171%0.71379%0.787SS**  trans73.9101.5159.3-49.90000116
300N44.4Very low45.3Very low165 Ų165146.2 Ų146.288%0.88280%0.795SS**  76136.459.7-161.119.9000113.9
301S49.7Very low44.8Very low97 Ų97139.5 Ų139.568%0.67878%0.783SS**  trans95.893178.6-171.90000120.5
302N46Very low44.7Very low150 Ų150139.5 Ų139.580%0.80279%0.786SS**  50.5138129.5-61.9-12.2000124.9
303K46.2Very low44.5Very low197 Ų197139.8 Ų139.886%0.85779%0.789SS**  trans98.897.7172.1-62177.2176.9-178.90113.8
304I46.7Very low43.9Very low140 Ų140137.2 Ų137.272%0.71879%0.785SS**  59.8100.370.1-49.9175.7000113.5
305Y43.8Very low43.2Very low217 Ų217141 Ų14185%0.85180%0.796SS**  177.3148.3114.8-95.1-66.4000112.8
306S46.3Very low43.1Very low105 Ų105145.5 Ų145.573%0.73480%0.803SS**  trans30.1114.8162.356.10000119.2
307F38.9Very low43Very low205 Ų205145.6 Ų145.690%0.89980%0.799SS**  cis69.688.239-133.6-79.5000115.4
308H45.9Very low42.7Very low173 Ų173147.2 Ų147.280%0.80180%0.801SS**  trans-144.7103.8155-131.4-81.5000112
309Q44Very low42.4Very low152 Ų152148.2 Ų148.271%0.7181%0.806SS**  trans47.5105.1135.4-147.3163.218.800120.3
310C38.7Very low42.2Very low135 Ų135148.6 Ų148.691%0.91281%0.808SS**  trans-146.690.4153.5-1660000110.7
311S41.6Very low42Very low101 Ų101148 Ų14871%0.70681%0.805SS**  trans-79.7156.3156.552.50000108.7
312S41.5Very low41.6Very low106 Ų106148.6 Ų148.674%0.74181%0.807SS**  cis-151157.4744.10000106
313S40.4Very low41.5Very low115 Ų115150.5 Ų150.580%0.80481%0.809SS**  -163.5154.954.7-720000111.3
314C37.8Very low41.2Very low125 Ų125148.4 Ų148.485%0.84581%0.807SS**  trans-76.7132.4-172.3-66.50000115
315L34Very low41.1Very low176 Ų176148 Ų14892%0.92181%0.805SS**  -154.891.2127.6-143.980.7000111
316K41Very low41Very low210 Ų210143.3 Ų143.391%0.91381%0.805SS**  trans-114104.4173-85.9-177.3174.7176.20109.9
317V41.8Very low41.3Very low124 Ų124143.6 Ų143.675%0.75280%0.802SS**  trans-148145.2153.9-1570000108.9
318F39.9Very low41.7Very low192 Ų192142.8 Ų142.884%0.84280%0.798SS**SBendtrans64.763.4176.1-68.6-71.2000118.2
319C39.7Very low41.9Very low125 Ų125140.2 Ų140.285%0.84580%0.797SS**  trans-147.681.1150.9-156.80000111.4
320C39.1Very low42.5Very low111 Ų111138.9 Ų138.975%0.7580%0.799SS**  trans170.295.8153-99.40000109.9
321D38.4Very low43.1Very low152 Ų152138.7 Ų138.781%0.81379%0.789SS**  trans-121.189.5150.2-91.8-47000107.1F323D321-F323 VanDerWaalsContact C-N 3.3Å; D321-F323 PolarHBondContact O-N 2.93Å
322C41.2Very low43.6Very low109 Ų109140 Ų14074%0.73679%0.788SS**  trans-69.991.3170.3-68.20000107.8N324C322-N324 PolarHBondContact O-N 3.38Å
323F43.9Very low44.1Very low190 Ų190139.1 Ų139.183%0.83378%0.781SS**  trans-63.4102.2173.4-135.4-86.1000108.5D321 L325D321-F323 VanDerWaalsContact C-N 3.3Å; D321-F323 PolarHBondContact O-N 2.93Å; F323-L325 PolarHBondContact O-N 3.15Å
324N39.8Very low44.9Very low153 Ų153141 Ų14182%0.81878%0.777SS**  trans-79.464.1-167.2-151.8-7.2000110.2C322 S326C322-N324 PolarHBondContact O-N 3.38Å; N324-S326 VanDerWaalsContact C-N 3.34Å; N324-S326 PolarHBondContact O-N 3.08Å
325L46.6Very low45.8Very low131 Ų131141.4 Ų141.469%0.68677%0.77SS**  trans-79.686.8178.8-148.480.9000109.1F323 T327F323-L325 PolarHBondContact O-N 3.15Å; L325-T327 HydrophobicContact CD2-CG2 4.33Å; L325-T327 PolarHBondContact O-N 3.48Å
326S40.8Very low47.1Very low120 Ų120139.1 Ų139.184%0.83976%0.755SS**  trans-64.279.2174.2-176.40000111.3N324N324-S326 VanDerWaalsContact C-N 3.34Å; N324-S326 PolarHBondContact O-N 3.08Å
327T51.8Low48.5Very low111 Ų111133.8 Ų133.868%0.68173%0.733SS**  trans-101.6125.5163.353.40000108.7L325L325-T327 HydrophobicContact CD2-CG2 4.33Å; L325-T327 PolarHBondContact O-N 3.48Å
328K47.1Very low49.9Very low187 Ų187132.3 Ų132.381%0.81372%0.721SS**  trans-39.6145.8-176.8-61.4175.2179.4-179.20113.1V330K328-V330 PolarHBondContact O-N 3.23Å
329P52.1Low51.5Low120 Ų120129.8 Ų129.878%0.77971%0.711SS**  trans-59.6107.8176.826.1-34.3000110
330V54.8Low53.3Low123 Ų123129.1 Ų129.175%0.74570%0.696SS**  trans-72.6126.9157.6177.50000105.7K328 N332K328-V330 PolarHBondContact O-N 3.23Å; V330-N332 PolarHBondContact O-N 2.92Å
331N51.4Low55.1Low131 Ų131127.9 Ų127.970%0.70168%0.679SS**  trans-60.693-175.2-71.7-17.2000111.4C333N331-C333 PolarHBondContact O-N 3.34Å
332N53.7Low56.9Low128 Ų128127.5 Ų127.568%0.68467%0.672SS**THydrogen-bonded Turntrans-65.3-2.1177.2-87.2-21000113.8V330 Q334 L335 Q336V330-N332 PolarHBondContact O-N 2.92Å; N332-Q334 PolarHBondContact O-N 2.95Å; N332-Q334 VanDerWaalsContact O-N 3.1Å; N332-L335 PolarHBondContact O-N 3.26Å; N332-Q336 PolarHBondContact O-N 3.39Å
333C51.4Low58.6Low89 Ų89128.6 Ų128.660%0.60167%0.667SS**Hα-helixtrans-47.7-35.7170.1-61.10000112.5N331 Q336 H337N331-C333 PolarHBondContact O-N 3.34Å; C333-Q336 PolarHBondContact O-N 3.38Å; C333-H337 WeakPolarHBondContact O-CB 3.37Å; C333-H337 PolarHBondContact O-N 3.42Å
334Q57.5Low60.3Low155 Ų155125 Ų12572%0.72465%0.653SS**Hα-helixtrans-72.8-34-171.9-149.617116.800114.4N332 N338N332-Q334 PolarHBondContact O-N 2.95Å; N332-Q334 VanDerWaalsContact O-N 3.1Å; Q334-N338 PolarHBondContact O-N 3.34Å
335L56.5Low62.2Low133 Ų133124 Ų12470%0.69664%0.643SS**Hα-helixtrans-76.8-37.9175.2-165.672.3000111.1N332 N338 Q339N332-L335 PolarHBondContact O-N 3.26Å; L335-N338 PolarHBondContact O-N 2.91Å; L335-Q339 PolarHBondContact O-N 3.01Å
336Q61.8Low63.7Low128 Ų128122.7 Ų122.760%0.59864%0.636SS**Hα-helixtrans-67-39.6175.9-162.2168.82.600111.2N332 C333 N338 Q339 Q340N332-Q336 PolarHBondContact O-N 3.39Å; C333-Q336 PolarHBondContact O-N 3.38Å; Q336-N338 PolarHBondContact O-N 3.1Å; Q336-Q339 PolarHBondContact O-N 2.96Å; Q336-Q340 VanDerWaalsContact O-CB 3.26Å; Q336-Q340 WeakPolarHBondContact O-CB 3.42Å; Q336-Q340 PolarHBondContact O-N 3.4Å
337H70.1Confident65.5Low97 Ų97121.7 Ų121.745%0.44962%0.622SS.*Hα-helixtrans-63.6-38.3175.5-168.4-85.9000112.3C333 Q340 Q341C333-H337 WeakPolarHBondContact O-CB 3.37Å; C333-H337 PolarHBondContact O-N 3.42Å; H337-Q340 PolarHBondContact O-N 3.43Å; H337-Q341 PolarHBondContact CE1-NE2 3.25Å; H337-Q341 PolarHBondContact CE1-OE1 3.34Å; H337-Q341 PolarHBondContact ND1-OE1 3.1Å; H337-Q341 WeakPolarHBondContact O-CB 3.4Å; H337-Q341 WeakPolarHBondContact O-CG 3.49Å; H337-Q341 PolarHBondContact O-N 3.4Å
338N70.6Confident66.9Low94 Ų94122.1 Ų122.150%0.50362%0.616SS.*Hα-helixtrans-65.9-38.8174.3-79.9-9.1000112.6Q334 L335 Q336 Q342Q334-N338 PolarHBondContact O-N 3.34Å; L335-N338 PolarHBondContact O-N 2.91Å; Q336-N338 PolarHBondContact O-N 3.1Å; N338-Q342 PolarHBondContact O-N 2.89Å
339Q73.5Confident68.3Low138 Ų138116.8 Ų116.865%0.64560%0.602SS**Hα-helixtrans-67.2-40.4171.7-91.7-173-31.800112.1L335 Q336 Q342 Q343L335-Q339 PolarHBondContact O-N 3.01Å; Q336-Q339 PolarHBondContact O-N 2.96Å; Q339-Q342 PolarHBondContact O-N 3.49Å; Q339-Q343 PolarHBondContact O-N 2.76Å
340Q76.7Confident69.5Low111 Ų111117.8 Ų117.852%0.51959%0.594SS.*Hα-helixtrans-71.3-36.3-177.4-159.4166.312.400112.1Q336 H337 Q343 Q344Q336-Q340 VanDerWaalsContact O-CB 3.26Å; Q336-Q340 WeakPolarHBondContact O-CB 3.42Å; Q336-Q340 PolarHBondContact O-N 3.4Å; H337-Q340 PolarHBondContact O-N 3.43Å; Q340-Q343 PolarHBondContact O-N 2.85Å; Q340-Q344 PolarHBondContact O-N 3.17Å
341Q77.3Confident70.3Confident85 Ų85121.6 Ų121.640%0.39760%0.595SS.*Hα-helixtrans-65.5-41.4171.3-80-173.2-5200112.3H337 Q343 Q344 Q345H337-Q341 PolarHBondContact CE1-NE2 3.25Å; H337-Q341 PolarHBondContact CE1-OE1 3.34Å; H337-Q341 PolarHBondContact ND1-OE1 3.1Å; H337-Q341 WeakPolarHBondContact O-CB 3.4Å; H337-Q341 WeakPolarHBondContact O-CG 3.49Å; H337-Q341 PolarHBondContact O-N 3.4Å; Q341-Q343 VanDerWaalsContact C-N 3.29Å; Q341-Q343 PolarHBondContact O-N 3.39Å; Q341-Q344 PolarHBondContact O-N 2.8Å; Q341-Q345 WeakPolarHBondContact O-CG 3.25Å; Q341-Q345 PolarHBondContact O-N 2.86Å
342Q76.1Confident71.3Confident144 Ų144120.5 Ų120.567%0.67359%0.588SS**Hα-helixtrans-60.9-38.4172.4-89.6-171.3-25.200112N338 Q339 L346N338-Q342 PolarHBondContact O-N 2.89Å; Q339-Q342 PolarHBondContact O-N 3.49Å; Q342-L346 PolarHBondContact O-N 3.5Å; Q342-L346 VanDerWaalsContact O-N 3.14Å
343Q77.5Confident72.1Confident133 Ų133121.4 Ų121.462%0.62159%0.586SS**Hα-helixtrans-71.8-34.6175.7-105174.4-17.400113.6Q339 Q340 Q341 N347Q339-Q343 PolarHBondContact O-N 2.76Å; Q340-Q343 PolarHBondContact O-N 2.85Å; Q341-Q343 VanDerWaalsContact C-N 3.29Å; Q341-Q343 PolarHBondContact O-N 3.39Å; Q343-N347 WeakPolarHBondContact O-CB 3.46Å; Q343-N347 PolarHBondContact O-N 3.18Å; Q343-N347 VanDerWaalsContact O-N 3.11Å
344Q79.3Confident73Confident115 Ų115125.5 Ų125.554%0.53759%0.594SS.*Hα-helixtrans-65.4-48172.6-85.6178.8-5000111.6Q340 Q341 L346 N347 E348Q340-Q344 PolarHBondContact O-N 3.17Å; Q341-Q344 PolarHBondContact O-N 2.8Å; Q344-L346 VanDerWaalsContact C-N 3.29Å; Q344-L346 PolarHBondContact O-N 3.09Å; Q344-N347 PolarHBondContact O-N 2.78Å; Q344-N347 VanDerWaalsContact O-N 3.07Å; Q344-E348 PolarHBondContact O-N 2.79Å
345Q78.8Confident73.5Confident131 Ų131126 Ų12661%0.61259%0.594SS**Hα-helixtrans-59.7-38.5177.3-73-179-13.300112.4Q341 S349Q341-Q345 WeakPolarHBondContact O-CG 3.25Å; Q341-Q345 PolarHBondContact O-N 2.86Å; Q345-S349 WeakPolarHBondContact O-CB 3.4Å; Q345-S349 PolarHBondContact O-N 2.87Å
346L78.6Confident73.7Confident104 Ų104125.3 Ų125.355%0.54559%0.591SS.*Hα-helixtrans-65.8-38.2175.3-157.186.2000112.3Q342 Q344 K350Q342-L346 PolarHBondContact O-N 3.5Å; Q342-L346 VanDerWaalsContact O-N 3.14Å; Q344-L346 VanDerWaalsContact C-N 3.29Å; Q344-L346 PolarHBondContact O-N 3.09Å; L346-K350 WeakPolarHBondContact O-CG 3.32Å; L346-K350 PolarHBondContact O-N 3.27Å; L346-K350 VanDerWaalsContact O-N 3.13Å
347N78.9Confident73.7Confident99 Ų99126.4 Ų126.453%0.52960%0.596SS.*Hα-helixtrans-74-35178-80.9-17.8000112.9Q343 Q344 R351Q343-N347 WeakPolarHBondContact O-CB 3.46Å; Q343-N347 PolarHBondContact O-N 3.18Å; Q343-N347 VanDerWaalsContact O-N 3.11Å; Q344-N347 PolarHBondContact O-N 2.78Å; Q344-N347 VanDerWaalsContact O-N 3.07Å; N347-R351 WeakPolarHBondContact O-CG 3.18Å; N347-R351 PolarHBondContact O-N 3.13Å
348E81.7Confident73.3Confident119 Ų119129.5 Ų129.556%0.55662%0.615SS**Hα-helixtrans-68-44.4173.5-73.1-176.2157.700111.5Q344 K350 R351 I352Q344-E348 PolarHBondContact O-N 2.79Å; E348-K350 VanDerWaalsContact C-N 3.32Å; E348-K350 PolarHBondContact O-N 3.5Å; E348-R351 WeakPolarHBondContact O-CB 3.34Å; E348-R351 PolarHBondContact O-N 2.88Å; E348-I352 WeakPolarHBondContact O-CG1 3.49Å; E348-I352 PolarHBondContact O-N 3.31Å
349S76.6Confident72.8Confident76 Ų76131.5 Ų131.553%0.53162%0.624SS.*Hα-helixtrans-57.3-43.8173.8-175.40000111.9Q345 R351 I352 F353Q345-S349 WeakPolarHBondContact O-CB 3.4Å; Q345-S349 PolarHBondContact O-N 2.87Å; S349-R351 PolarHBondContact O-N 3.44Å; S349-I352 PolarHBondContact O-N 2.96Å; S349-F353 PolarHBondContact O-N 2.82Å
350K76.5Confident71.9Confident141 Ų141134 Ų13461%0.61364%0.636SS**Hα-helixtrans-63.8-34.6172.9-76.5-176.2177-174.20113.8L346 E348 K354L346-K350 WeakPolarHBondContact O-CG 3.32Å; L346-K350 PolarHBondContact O-N 3.27Å; L346-K350 VanDerWaalsContact O-N 3.13Å; E348-K350 VanDerWaalsContact C-N 3.32Å; E348-K350 PolarHBondContact O-N 3.5Å; K350-K354 WeakPolarHBondContact O-CB 3.48Å; K350-K354 PolarHBondContact O-N 2.68Å
351R71.6Confident70.8Confident203 Ų203137.2 Ų137.277%0.76665%0.653SS**Hα-helixtrans-69.8-38.3175-81-177.3175-172.1-1.3112.4N347 E348 S349 K355N347-R351 WeakPolarHBondContact O-CG 3.18Å; N347-R351 PolarHBondContact O-N 3.13Å; E348-R351 WeakPolarHBondContact O-CB 3.34Å; E348-R351 PolarHBondContact O-N 2.88Å; S349-R351 PolarHBondContact O-N 3.44Å; R351-K355 PolarHBondContact O-N 3.48Å
352I72.8Confident70.1Confident108 Ų108139.6 Ų139.655%0.55467%0.669SS**Hα-helixtrans-67.2-47.3176.9-66.2165.3000109.8E348 S349 K354 K355 N356E348-I352 WeakPolarHBondContact O-CG1 3.49Å; E348-I352 PolarHBondContact O-N 3.31Å; S349-I352 PolarHBondContact O-N 2.96Å; I352-K354 VanDerWaalsContact C-N 3.32Å; I352-K354 PolarHBondContact O-N 3.4Å; I352-K355 PolarHBondContact O-N 3.18Å; I352-N356 PolarHBondContact O-N 3.21Å
353F69.5Low69Low147 Ų147139.3 Ų139.365%0.64567%0.671SS**Hα-helixtrans-58-44.3178.6-150.7-86.2000111.9S349 K355 N356S349-F353 PolarHBondContact O-N 2.82Å; F353-K355 PolarHBondContact O-N 3.16Å; F353-N356 PolarHBondContact O-N 2.95Å
354K70.3Confident67.7Low175 Ų175138 Ų13876%0.76168%0.678SS**Hα-helixtrans-73.9-6.9179.3-150.6176.6-175.1-179.10114.7K350 I352K350-K354 WeakPolarHBondContact O-CB 3.48Å; K350-K354 PolarHBondContact O-N 2.68Å; I352-K354 VanDerWaalsContact C-N 3.32Å; I352-K354 PolarHBondContact O-N 3.4Å
355K69.5Low66.6Low164 Ų164137.5 Ų137.571%0.71369%0.687SS**Hα-helixtrans-95.9-20.5175.6-157.6177.2-178.3-1730112.7R351 I352 F353R351-K355 PolarHBondContact O-N 3.48Å; I352-K355 PolarHBondContact O-N 3.18Å; F353-K355 PolarHBondContact O-N 3.16Å
356N61.1Low65.4Low119 Ų119137.5 Ų137.564%0.63670%0.698SS**Hα-helixtrans-90.9-12.6-176.8-70.99.7000114I352 F353 L358I352-N356 PolarHBondContact O-N 3.21Å; F353-N356 PolarHBondContact O-N 2.95Å; N356-L358 VanDerWaalsContact C-N 3.27Å; N356-L358 PolarHBondContact O-N 3.25Å
357E60.9Low64.6Low151 Ų151138.8 Ų138.871%0.70671%0.709SS**THydrogen-bonded Turntrans-76.3-4.3176.3-74.7-174.7133.700114.7
358L61.2Low63.6Low162 Ų162140.5 Ų140.585%0.84872%0.724SS**THydrogen-bonded Turntrans-104.72.2-176.6-146.577.6000114.6N356N356-L358 VanDerWaalsContact C-N 3.27Å; N356-L358 PolarHBondContact O-N 3.25Å
359I60.9Low62.4Low137 Ų137139.8 Ų139.870%0.70373%0.732SS**SBendtrans-143.282.6-176-48.3177.4000110.7
360Q54.1Low61.7Low190 Ų190142 Ų14289%0.88874%0.744SS**  trans171.8105.2139.5-98168.8-13.300110.9
361M54.4Low60.9Low179 Ų179141.3 Ų141.388%0.88275%0.753SS**  trans-91.2160.5142.6-79-170.3168.800108.3
362N61.5Low60Low135 Ų135136.1 Ų136.172%0.72275%0.747SS**SBendtrans82.2109.9176.2-61.415.4000117.4
363D53.1Low59.1Low137 Ų137139 Ų13973%0.73376%0.763SS**  trans74.1106.2133-53.8-29.7000122
364S50.4Low58.9Low107 Ų107137.5 Ų137.575%0.74877%0.766SS**  trans67.489.9134.965.90000119.2
365S55.6Low58.8Low104 Ų104134 Ų13473%0.72777%0.769SS**  170.5142.2119.1-78.50000111.8V367S365-V367 PolarHBondContact O-N 3.49Å
366P54Low58.8Low131 Ų131131.1 Ų131.185%0.85177%0.77SS**  trans-81.687.7-177.433.2-34.2000111.8
367V61.2Low59.4Low130 Ų130133.2 Ų133.279%0.78878%0.776SS**  trans-82.7119.7170.7-179.90000109.9S365 S369S365-V367 PolarHBondContact O-N 3.49Å; V367-S369 PolarHBondContact O-N 3.24Å; V367-S369 VanDerWaalsContact O-N 3.14Å
368T58.5Low59.8Low135 Ų135131.3 Ų131.383%0.82878%0.777SS**  trans-61.8108.3177.6300000111.5
369S57.7Low60.5Low105 Ų105128.1 Ų128.173%0.73476%0.764SS**  trans-66137.8175.852.50000111.1V367 T371V367-S369 PolarHBondContact O-N 3.24Å; V367-S369 VanDerWaalsContact O-N 3.14Å; S369-T371 PolarHBondContact O-N 3.38Å
370P61.7Low61.5Low121 Ų121124.3 Ų124.379%0.78676%0.758SS**  trans-67.7128.2-17926.9-33.5000110S372P370-S372 VanDerWaalsContact C-N 3.33Å; P370-S372 PolarHBondContact O-N 2.84Å
371T58.5Low63.1Low128 Ų128118.3 Ų118.379%0.78574%0.741SS**  trans-56.692175.1-53.40000110.4S369 L373S369-T371 PolarHBondContact O-N 3.38Å; T371-L373 PolarHBondContact O-N 3.11Å
372S53.8Low64.6Low93 Ų93115.7 Ų115.765%0.6573%0.727SS**  trans-63.8112.1169.757.50000107.6P370 T374P370-S372 VanDerWaalsContact C-N 3.33Å; P370-S372 PolarHBondContact O-N 2.84Å; S372-T374 PolarHBondContact O-N 2.75Å
373L54.1Low65.7Low168 Ų168112.4 Ų112.488%0.8871%0.709SS**  trans-65.577.6173.6-77.9160.8000108.8T371 A375T371-L373 PolarHBondContact O-N 3.11Å; L373-A375 PolarHBondContact O-N 3.24Å
374T64.3Low67.3Low117 Ų117107.2 Ų107.272%0.71869%0.688SS**  trans-54.8112.316242.80000106.3S372 S376S372-T374 PolarHBondContact O-N 2.75Å; T374-S376 VanDerWaalsContact C-N 3.33Å; T374-S376 PolarHBondContact O-N 3.31Å
375A68.6Low69.1Low100 Ų100110.5 Ų110.583%0.82668%0.684SS**  trans-59.2102177.400000107L373 E377L373-A375 PolarHBondContact O-N 3.24Å; A375-E377 PolarHBondContact O-N 2.95Å
376S69.8Low70.5Confident105 Ų105108.8 Ų108.873%0.73467%0.669SS**  trans-59.1126-165.845.60000109.2T374T374-S376 VanDerWaalsContact C-N 3.33Å; T374-S376 PolarHBondContact O-N 3.31Å
377E73.6Confident72Confident163 Ų163105.1 Ų105.176%0.76264%0.641SS**  trans-52.8132.4-179-73.6-165.8120.300108.9A375 T379A375-E377 PolarHBondContact O-N 2.95Å; E377-T379 PolarHBondContact O-N 3.29Å
378P69.7Low73.3Confident110 Ų110108.2 Ų108.271%0.71464%0.638SS**  trans-59.6103.8-173.623-33.3000109.1G380P378-G380 PolarHBondContact O-N 3.33Å
379T75Confident74.7Confident96 Ų96107.7 Ų107.759%0.58963%0.627SS**  trans-54.3129.3-168.1-35.90000108.8E377 A381 Q382E377-T379 PolarHBondContact O-N 3.29Å; T379-A381 PolarHBondContact O-N 3.22Å; T379-Q382 PolarHBondContact O-N 3.36Å
380G82.2Confident76Confident56 Ų56106.8 Ų106.858%0.57761%0.611SS**Hα-helixtrans-52.5-22.2-168.500000115.4P378 Q382 L383 G384P378-G380 PolarHBondContact O-N 3.33Å; G380-Q382 VanDerWaalsContact C-N 3.31Å; G380-Q382 PolarHBondContact O-N 3.28Å; G380-L383 PolarHBondContact O-N 3.03Å; G380-G384 PolarHBondContact O-N 3.39Å; G380-G384 VanDerWaalsContact O-N 3.08Å
381A86.5Confident77.2Confident64 Ų64107.9 Ų107.953%0.52960%0.603SS.*Hα-helixtrans-55.6-33.9169.200000115T379 R385T379-A381 PolarHBondContact O-N 3.22Å; A381-R385 WeakPolarHBondContact O-CG 3.45Å; A381-R385 PolarHBondContact O-N 3.5Å
382Q86Confident78.8Confident124 Ų124104.9 Ų104.958%0.57958%0.579SS**Hα-helixtrans-71.5-45.8176.7-68.1-162.17.600111.5T379 G380 G384 R385 T386T379-Q382 PolarHBondContact O-N 3.36Å; G380-Q382 VanDerWaalsContact C-N 3.31Å; G380-Q382 PolarHBondContact O-N 3.28Å; Q382-G384 VanDerWaalsContact C-N 3.32Å; Q382-G384 PolarHBondContact O-N 3.42Å; Q382-R385 WeakPolarHBondContact O-CB 3.31Å; Q382-R385 PolarHBondContact O-N 2.9Å; Q382-T386 PolarHBondContact O-N 2.95Å
383L84.6Confident80.3Confident66 Ų66104.1 Ų104.135%0.34657%0.567SS.*Hα-helixtrans-61.4-40178.6-175.262.2000111.8I258 G380 R385 T386 Q387I258-L383 HydrophobicContact CD1-CD1 4.44Å; I258-L383 HydrophobicContact CG2-CD1 4.21Å; I258-L383 HydrophobicContact CG2-CD2 3.8Å; I258-L383 HydrophobicContact CG2-CG 4.26Å; G380-L383 PolarHBondContact O-N 3.03Å; L383-R385 VanDerWaalsContact C-N 3.26Å; L383-R385 PolarHBondContact O-N 3.32Å; L383-T386 PolarHBondContact O-N 3Å; L383-T386 PolarHBondContact O-OG1 3.36Å; L383-Q387 WeakPolarHBondContact O-CG 3.41Å; L383-Q387 PolarHBondContact O-N 2.68Å; L383-Q387 VanDerWaalsContact O-N 3.17Å
384G87.3Confident81.9Confident29 Ų2997 Ų9730%0.29953%0.53SS..Hα-helixtrans-64.7-25.3174.600000114.2G380 Q382 R388G380-G384 PolarHBondContact O-N 3.39Å; G380-G384 VanDerWaalsContact O-N 3.08Å; Q382-G384 VanDerWaalsContact C-N 3.32Å; Q382-G384 PolarHBondContact O-N 3.42Å; G384-R388 WeakPolarHBondContact O-CG 3.35Å; G384-R388 PolarHBondContact O-N 2.72Å
385R88.9Confident83.2Confident176 Ų17694.5 Ų94.566%0.66451%0.512SS*.Hα-helixtrans-75.3-47.3174.4-71.7173.2-176167.32.8111.3A381 Q382 L383 Q387 R388 E389A381-R385 WeakPolarHBondContact O-CG 3.45Å; A381-R385 PolarHBondContact O-N 3.5Å; Q382-R385 WeakPolarHBondContact O-CB 3.31Å; Q382-R385 PolarHBondContact O-N 2.9Å; L383-R385 VanDerWaalsContact C-N 3.26Å; L383-R385 PolarHBondContact O-N 3.32Å; R385-Q387 PolarHBondContact O-N 3Å; R385-R388 PolarHBondContact O-N 3.47Å; R385-R388 VanDerWaalsContact O-N 3.15Å; R385-E389 PolarHBondContact O-N 2.82Å; R385-E389 VanDerWaalsContact O-N 3.09Å
386T84.9Confident84.2Confident68 Ų6890.8 Ų90.842%0.41748%0.479SS..Hα-helixtrans-61.1-43.6179.854.80000111.6Q382 L383 R388 E389 E390Q382-T386 PolarHBondContact O-N 2.95Å; L383-T386 PolarHBondContact O-N 3Å; L383-T386 PolarHBondContact O-OG1 3.36Å; T386-R388 VanDerWaalsContact C-N 3.32Å; T386-R388 PolarHBondContact O-N 3.01Å; T386-E389 PolarHBondContact O-N 2.73Å; T386-E389 VanDerWaalsContact O-N 3.16Å; T386-E390 WeakPolarHBondContact O-CG 3.44Å; T386-E390 PolarHBondContact O-N 3.35Å
387Q85.3Confident85Confident54 Ų5486.5 Ų86.525%0.25245%0.448SS..Hα-helixtrans-59.8-37.6174.8-72.6-175.3-20.100113.6I258 L383 R385 K391I258-Q387 VanDerWaalsContact CG2-NE2 3.3Å; L383-Q387 WeakPolarHBondContact O-CG 3.41Å; L383-Q387 PolarHBondContact O-N 2.68Å; L383-Q387 VanDerWaalsContact O-N 3.17Å; R385-Q387 PolarHBondContact O-N 3Å; Q387-K391 WeakPolarHBondContact O-CB 3.24Å; Q387-K391 PolarHBondContact O-N 3.43Å
388R88.7Confident85.8Confident195 Ų19582 Ų8274%0.73643%0.428SS*.Hα-helixtrans-67.4-39.3176-77.6178.6-179.4-1711.3111.7G384 R385 T386 K392G384-R388 WeakPolarHBondContact O-CG 3.35Å; G384-R388 PolarHBondContact O-N 2.72Å; R385-R388 PolarHBondContact O-N 3.47Å; R385-R388 VanDerWaalsContact O-N 3.15Å; T386-R388 VanDerWaalsContact C-N 3.32Å; T386-R388 PolarHBondContact O-N 3.01Å; R388-K392 WeakPolarHBondContact O-CG 3.4Å; R388-K392 PolarHBondContact O-N 3.36Å
389E87.6Confident86.9Confident124 Ų12478.1 Ų78.158%0.57940%0.403SS*.Hα-helixtrans-65.6-45.3175.6-67.4-170.2175.600111.7R385 T386 K391 K392 I393R385-E389 PolarHBondContact O-N 2.82Å; R385-E389 VanDerWaalsContact O-N 3.09Å; T386-E389 PolarHBondContact O-N 2.73Å; T386-E389 VanDerWaalsContact O-N 3.16Å; E389-K391 PolarHBondContact O-N 2.9Å; E389-K392 PolarHBondContact O-N 3.39Å; E389-I393 VanDerWaalsContact O-CG1 3.31Å; E389-I393 WeakPolarHBondContact O-CG1 3.5Å; E389-I393 PolarHBondContact O-N 2.89Å
390E84.3Confident87.5Confident85 Ų8575.4 Ų75.440%0.39739%0.385SS..Hα-helixtrans-61.5-42.4176.3-71.2177.7177.700112.6T386 I393 T394T386-E390 WeakPolarHBondContact O-CG 3.44Å; T386-E390 PolarHBondContact O-N 3.35Å; E390-I393 PolarHBondContact O-N 3.21Å; E390-T394 PolarHBondContact O-N 2.92Å; E390-T394 PolarHBondContact O-OG1 2.91Å
391K87.8Confident87.8Confident144 Ų14473.9 Ų73.963%0.62636%0.364SS*.Hα-helixtrans-63.2-44.2174.9-174.8174.5178.6179.20111.5Q387 E389 I393 T394 I395Q387-K391 WeakPolarHBondContact O-CB 3.24Å; Q387-K391 PolarHBondContact O-N 3.43Å; E389-K391 PolarHBondContact O-N 2.9Å; K391-I393 PolarHBondContact O-N 3.01Å; K391-T394 PolarHBondContact O-N 3.42Å; K391-I395 HydrophobicContact CG-CD1 3.88Å; K391-I395 HydrophobicContact CG-CG1 4.46Å; K391-I395 VanDerWaalsContact O-CG1 3.29Å; K391-I395 WeakPolarHBondContact O-CG1 3.31Å; K391-I395 PolarHBondContact O-N 3.36Å
392K91Very high88.1Confident66 Ų6674.2 Ų74.229%0.28736%0.359SS..Hα-helixtrans-57.8-47.6175.2-78-175.2178.9-164.30111.5R388 E389 T394 I395 T396 F487 D489R388-K392 WeakPolarHBondContact O-CG 3.4Å; R388-K392 PolarHBondContact O-N 3.36Å; E389-K392 PolarHBondContact O-N 3.39Å; K392-T394 VanDerWaalsContact C-N 3.35Å; K392-T394 PolarHBondContact O-N 2.91Å; K392-I395 PolarHBondContact O-N 3.37Å; K392-T396 PolarHBondContact O-N 3.11Å; K392-T396 PolarHBondContact O-OG1 3.3Å; K392-F487 HydrophobicContact CB-CD1 4.3Å; K392-F487 HydrophobicContact CG-CD1 4.49Å; K392-D489 IonicContact NZ-OD1 2.72Å; K392-D489 PolarHBondContact NZ-OD1 2.97Å; K392-D489 IonicContact NZ-OD2 2.69Å; K392-D489 PolarHBondContact NZ-OD2 3.06Å
393I86Confident88.5Confident77 Ų7768.7 Ų68.740%0.39533%0.334SS..Hα-helixtrans-60.1-44.9178.9-67.5162.9000111E389 E390 K391 T396 L397E389-I393 VanDerWaalsContact O-CG1 3.31Å; E389-I393 WeakPolarHBondContact O-CG1 3.5Å; E389-I393 PolarHBondContact O-N 2.89Å; E390-I393 PolarHBondContact O-N 3.21Å; K391-I393 PolarHBondContact O-N 3.01Å; I393-T396 WeakPolarHBondContact O-CB 3.23Å; I393-T396 PolarHBondContact O-N 3.44Å; I393-L397 PolarHBondContact O-N 3.4Å
394T87.6Confident88.8Confident18 Ų1866 Ų6611%0.1132%0.319CS..Hα-helixtrans-64.6-40.7-179.8-52.80000111.9L247 I248 E390 K391 K392 L397 I398L247-T394 HydrophobicContact CD2-CG2 4Å; I248-T394 HydrophobicContact CG1-CG2 4.06Å; E390-T394 PolarHBondContact O-N 2.92Å; E390-T394 PolarHBondContact O-OG1 2.91Å; K391-T394 PolarHBondContact O-N 3.42Å; K392-T394 VanDerWaalsContact C-N 3.35Å; K392-T394 PolarHBondContact O-N 2.91Å; T394-L397 WeakPolarHBondContact O-CB 3.15Å; T394-L397 PolarHBondContact O-N 2.75Å; T394-I398 HydrophobicContact CG2-CD1 4.3Å; T394-I398 WeakPolarHBondContact O-CG1 3.42Å; T394-I398 PolarHBondContact O-N 2.91Å; T394-I398 VanDerWaalsContact O-N 3.14Å
395I90.6Very high89Confident64 Ų6469.3 Ų69.333%0.32833%0.325SS..Hα-helixtrans-67.5-43176.2-60.3164.6000110.5K391 K392 L397 I398 C399 F487K391-I395 HydrophobicContact CG-CD1 3.88Å; K391-I395 HydrophobicContact CG-CG1 4.46Å; K391-I395 VanDerWaalsContact O-CG1 3.29Å; K391-I395 WeakPolarHBondContact O-CG1 3.31Å; K391-I395 PolarHBondContact O-N 3.36Å; K392-I395 PolarHBondContact O-N 3.37Å; I395-L397 PolarHBondContact O-N 3.4Å; I395-I398 PolarHBondContact O-N 2.69Å; I395-I398 VanDerWaalsContact O-N 3.12Å; I395-C399 PolarHBondContact O-N 2.95Å; I395-C399 PolarHBondContact O-SG 3.15Å; I395-F487 HydrophobicContact CB-CE1 3.82Å; I395-F487 HydrophobicContact CB-CZ 4.06Å; I395-F487 HydrophobicContact CG2-CE1 3.6Å; I395-F487 HydrophobicContact CG2-CE2 4.46Å; I395-F487 HydrophobicContact CG2-CZ 3.41Å; I395-F487 VanDerWaalsContact CG2-CZ 3.41Å
396T90.1Very high89.3Confident23 Ų2366.1 Ų66.114%0.14132%0.321CS..Hα-helixtrans-53.1-45.4175.5-45.90000111.1K392 I393 C399 L400 F487K392-T396 PolarHBondContact O-N 3.11Å; K392-T396 PolarHBondContact O-OG1 3.3Å; I393-T396 WeakPolarHBondContact O-CB 3.23Å; I393-T396 PolarHBondContact O-N 3.44Å; T396-C399 PolarHBondContact O-N 3.3Å; T396-L400 HydrophobicContact CG2-CD1 4.5Å; T396-L400 WeakPolarHBondContact O-CG 3.44Å; T396-L400 PolarHBondContact O-N 3.05Å; T396-F487 HydrophobicContact CG2-CB 4.36Å; T396-F487 HydrophobicContact CG2-CD2 3.89Å; T396-F487 HydrophobicContact CG2-CG 4.34Å; T396-F487 WeakPolarHBondContact OG1-CB 3.48Å; T396-F487 WeakPolarHBondContact OG1-CD2 3.39Å; T396-F487 WeakPolarHBondContact OG1-CG 3.46Å
397L86.7Confident89.8Confident15 Ų1563.1 Ų63.18%0.07930%0.302CS..Hα-helixtrans-62.4-45.2179.5-170.972.8000111.7A161 N244 L247 I393 T394 I395 L400 I401A161-L397 HydrophobicContact CB-CD1 4.33Å; N244-L397 HydrophobicContact CB-CD2 4.34Å; N244-L397 WeakPolarHBondContact OD1-CD1 3.39Å; N244-L397 WeakPolarHBondContact OD1-CD2 3.4Å; N244-L397 WeakPolarHBondContact OD1-CG 3.46Å; L247-L397 HydrophobicContact CB-CD2 4.41Å; L247-L397 HydrophobicContact CD1-CD2 3.67Å; L247-L397 HydrophobicContact CD2-CD2 3.81Å; L247-L397 HydrophobicContact CG-CD2 4.17Å; I393-L397 PolarHBondContact O-N 3.4Å; T394-L397 WeakPolarHBondContact O-CB 3.15Å; T394-L397 PolarHBondContact O-N 2.75Å; I395-L397 PolarHBondContact O-N 3.4Å; L397-L400 PolarHBondContact O-N 3.38Å; L397-I401 WeakPolarHBondContact O-CG1 3.49Å; L397-I401 PolarHBondContact O-N 3.48Å
398I90.5Very high90.1Very high68 Ų6860.6 Ų60.635%0.34929%0.29SS..Hα-helixtrans-62.4-45.2176.4-66.4164.5000110.8I248 T394 I395 L400 I401 V402I248-I398 HydrophobicContact CD1-CD1 3.96Å; I248-I398 HydrophobicContact CD1-CG1 4.12Å; I248-I398 HydrophobicContact CG1-CD1 4.48Å; T394-I398 HydrophobicContact CG2-CD1 4.3Å; T394-I398 WeakPolarHBondContact O-CG1 3.42Å; T394-I398 PolarHBondContact O-N 2.91Å; T394-I398 VanDerWaalsContact O-N 3.14Å; I395-I398 PolarHBondContact O-N 2.69Å; I395-I398 VanDerWaalsContact O-N 3.12Å; I398-L400 VanDerWaalsContact C-N 3.3Å; I398-L400 PolarHBondContact O-N 3.47Å; I398-I401 WeakPolarHBondContact O-CB 3.43Å; I398-I401 PolarHBondContact O-N 2.92Å; I398-I401 VanDerWaalsContact O-N 3.14Å; I398-V402 HydrophobicContact CG2-CG2 4.43Å; I398-V402 WeakPolarHBondContact O-CG2 3.2Å; I398-V402 PolarHBondContact O-N 3.27Å
399C92.3Very high90.3Very high28 Ų2852.2 Ų52.219%0.18926%0.264CS..Hα-helixtrans-57.1-42.1176.1-68.70000112.2I395 T396 I401 V402 T403 F483I395-C399 PolarHBondContact O-N 2.95Å; I395-C399 PolarHBondContact O-SG 3.15Å; T396-C399 PolarHBondContact O-N 3.3Å; C399-I401 PolarHBondContact O-N 2.88Å; C399-V402 PolarHBondContact O-N 2.86Å; C399-T403 WeakPolarHBondContact O-CB 3.31Å; C399-T403 PolarHBondContact O-N 3.23Å; C399-T403 PolarHBondContact O-OG1 3.38Å; C399-F483 HydrophobicContact CB-CD1 3.98Å; C399-F483 HydrophobicContact CB-CD2 3.83Å; C399-F483 HydrophobicContact CB-CE1 3.84Å; C399-F483 HydrophobicContact CB-CE2 3.68Å; C399-F483 HydrophobicContact CB-CG 3.99Å; C399-F483 HydrophobicContact CB-CZ 3.71Å
400L88.4Confident90.6Very high39 Ų3948.5 Ų48.520%0.20425%0.251CS..Hα-helixtrans-63.5-36.6176.3-70.1171.6000113T396 L397 I398 F404T396-L400 HydrophobicContact CG2-CD1 4.5Å; T396-L400 WeakPolarHBondContact O-CG 3.44Å; T396-L400 PolarHBondContact O-N 3.05Å; L397-L400 PolarHBondContact O-N 3.38Å; I398-L400 VanDerWaalsContact C-N 3.3Å; I398-L400 PolarHBondContact O-N 3.47Å; L400-F404 VanDerWaalsContact O-CB 3.25Å; L400-F404 WeakPolarHBondContact O-CB 3.4Å; L400-F404 PolarHBondContact O-N 3.5Å
401I89.5Confident91Very high25 Ų2545.4 Ų45.413%0.12824%0.236CC..Hα-helixtrans-65.4-47.2174.6-53.6159.8000110.7L240 N244 L397 I398 C399 F404 F405L240-I401 HydrophobicContact CD2-CG1 4.29Å; L240-I401 HydrophobicContact CD2-CG2 4.47Å; L240-I401 HydrophobicContact CG-CG1 4.25Å; N244-I401 HydrophobicContact CB-CD1 3.61Å; N244-I401 WeakPolarHBondContact ND2-CD1 3.48Å; N244-I401 WeakPolarHBondContact ND2-CG1 3.36Å; L397-I401 WeakPolarHBondContact O-CG1 3.49Å; L397-I401 PolarHBondContact O-N 3.48Å; I398-I401 WeakPolarHBondContact O-CB 3.43Å; I398-I401 PolarHBondContact O-N 2.92Å; I398-I401 VanDerWaalsContact O-N 3.14Å; C399-I401 PolarHBondContact O-N 2.88Å; I401-F404 WeakPolarHBondContact O-CB 3.15Å; I401-F404 PolarHBondContact O-N 3.08Å; I401-F405 HydrophobicContact CG2-CD2 4.08Å; I401-F405 HydrophobicContact CG2-CE2 4.3Å; I401-F405 PolarHBondContact O-N 2.99Å
402V93Very high91.2Very high71 Ų7138.6 Ų38.643%0.4321%0.207SC..Hα-helixtrans-65.1-43.9-176.4172.60000110.2I398 C399 F405 I406I398-V402 HydrophobicContact CG2-CG2 4.43Å; I398-V402 WeakPolarHBondContact O-CG2 3.2Å; I398-V402 PolarHBondContact O-N 3.27Å; C399-V402 PolarHBondContact O-N 2.86Å; V402-F405 WeakPolarHBondContact O-CB 3.49Å; V402-F405 PolarHBondContact O-N 3.39Å; V402-I406 HydrophobicContact CG1-CD1 3.6Å; V402-I406 HydrophobicContact CG1-CG1 4.41Å; V402-I406 WeakPolarHBondContact O-CG1 3.47Å; V402-I406 PolarHBondContact O-N 3.14Å
403T93.1Very high91.2Very high8 Ų840.2 Ų40.25%0.04922%0.218CC..Hα-helixtrans-66.2-38.3173.9-74.60000112.5C399 F405 I406 C407 K476 L479 F483C399-T403 WeakPolarHBondContact O-CB 3.31Å; C399-T403 PolarHBondContact O-N 3.23Å; C399-T403 PolarHBondContact O-OG1 3.38Å; T403-F405 VanDerWaalsContact C-N 3.33Å; T403-F405 PolarHBondContact O-N 2.91Å; T403-I406 PolarHBondContact O-N 3.18Å; T403-C407 WeakPolarHBondContact O-CB 3.47Å; T403-C407 PolarHBondContact O-N 3.15Å; T403-K476 HydrophobicContact CG2-CG 4.16Å; T403-L479 HydrophobicContact CG2-CB 3.87Å; T403-L479 HydrophobicContact CG2-CD1 3.99Å; T403-F483 VanDerWaalsContact OG1-CE2 3.3Å; T403-F483 WeakPolarHBondContact OG1-CE2 3.41Å
404F90.9Very high91.5Very high10 Ų1036.8 Ų36.84%0.04420%0.201CC..Hα-helixtrans-56-48.8172.4-178.2-87.3000111.1N154 L400 I401 Q408N154-F404 HydrophobicContact CB-CE2 4.23Å; N154-F404 HydrophobicContact CB-CZ 4.39Å; N154-F404 VanDerWaalsContact OD1-CE2 3.3Å; N154-F404 WeakPolarHBondContact OD1-CE2 3.38Å; L400-F404 VanDerWaalsContact O-CB 3.25Å; L400-F404 WeakPolarHBondContact O-CB 3.4Å; L400-F404 PolarHBondContact O-N 3.5Å; I401-F404 WeakPolarHBondContact O-CB 3.15Å; I401-F404 PolarHBondContact O-N 3.08Å; F404-Q408 VanDerWaalsContact CE2-OE1 3.32Å; F404-Q408 WeakPolarHBondContact O-CB 3.28Å; F404-Q408 PolarHBondContact O-N 3.16Å
405F91.5Very high91.5Very high97 Ų9737 Ų3743%0.42520%0.202SC..Hα-helixtrans-60.3-55.8176.7-95.1-59.6000113.6F237 I401 V402 T403 G409F237-F405 HydrophobicContact CD1-CZ 4.48Å; F237-F405 HydrophobicContact CD2-CE1 4.04Å; F237-F405 AromaticContact CD2-CE2 3.95Å; F237-F405 HydrophobicContact CD2-CE2 3.95Å; F237-F405 AromaticContact CD2-CZ 3.65Å; F237-F405 HydrophobicContact CD2-CZ 3.65Å; F237-F405 AromaticContact CE1-CZ 3.92Å; F237-F405 HydrophobicContact CE1-CZ 3.92Å; F237-F405 HydrophobicContact CE2-CD2 4.14Å; F237-F405 AromaticContact CE2-CE1 3.83Å; F237-F405 HydrophobicContact CE2-CE1 3.83Å; F237-F405 AromaticContact CE2-CE2 3.15Å; F237-F405 HydrophobicContact CE2-CE2 3.15Å; F237-F405 AromaticContact CE2-CZ 2.99Å; F237-F405 HydrophobicContact CE2-CZ 2.99Å; F237-F405 HydrophobicContact CG-CZ 4.38Å; F237-F405 HydrophobicContact CZ-CE1 4.11Å; F237-F405 AromaticContact CZ-CE2 3.66Å; F237-F405 HydrophobicContact CZ-CE2 3.66Å; F237-F405 AromaticContact CZ-CZ 3.16Å; F237-F405 HydrophobicContact CZ-CZ 3.16Å; I401-F405 HydrophobicContact CG2-CD2 4.08Å; I401-F405 HydrophobicContact CG2-CE2 4.3Å; I401-F405 PolarHBondContact O-N 2.99Å; V402-F405 WeakPolarHBondContact O-CB 3.49Å; V402-F405 PolarHBondContact O-N 3.39Å; T403-F405 VanDerWaalsContact C-N 3.33Å; T403-F405 PolarHBondContact O-N 2.91Å; F405-G409 WeakPolarHBondContact O-CA 3.39Å; F405-G409 PolarHBondContact O-N 3.02Å
406I94.9Very high91.4Very high110 Ų11034.7 Ų34.756%0.56419%0.191SC*.Hα-helixtrans-66.7-41.4-171.7-67.1172.6000110.8V402 T403 P410V402-I406 HydrophobicContact CG1-CD1 3.6Å; V402-I406 HydrophobicContact CG1-CG1 4.41Å; V402-I406 WeakPolarHBondContact O-CG1 3.47Å; V402-I406 PolarHBondContact O-N 3.14Å; T403-I406 PolarHBondContact O-N 3.18Å; I406-P410 VanDerWaalsContact O-CD 3.28Å; I406-P410 WeakPolarHBondContact O-CD 3.22Å; I406-P410 WeakPolarHBondContact O-CG 3.33Å
407C95.5Very high91.3Very high4 Ų436.9 Ų36.93%0.02720%0.201CC..Hα-helixtrans-85-34.7-174.8-670000113.9T403 A472 L473 K476T403-C407 WeakPolarHBondContact O-CB 3.47Å; T403-C407 PolarHBondContact O-N 3.15Å; C407-A472 WeakPolarHBondContact CB-O 3.31Å; C407-A472 CarbonylContact O-C 3.58Å; C407-A472 PolarHBondContact SG-O 2.91Å; C407-L473 PolarHBondContact O-N 3.35Å; C407-K476 HydrophobicContact CB-CB 3.67Å; C407-K476 HydrophobicContact CB-CG 4.09Å
408Q92.9Very high91.3Very high2 Ų240 Ų401%0.00922%0.216CC..Hα-helixtrans-107.7-27.3-171.9-171.4165.8-1.900113.7N154 F232 F404 F411 V412 L473N154-Q408 PolarHBondContact ND2-NE2 3.34Å; N154-Q408 VanDerWaalsContact OD1-CD 3.29Å; N154-Q408 PolarHBondContact OD1-NE2 3Å; N154-Q408 PolarHBondContact OD1-OE1 2.99Å; N154-Q408 VanDerWaalsContact OD1-OE1 3.12Å; F232-Q408 VanDerWaalsContact CE1-NE2 3.33Å; F404-Q408 VanDerWaalsContact CE2-OE1 3.32Å; F404-Q408 WeakPolarHBondContact O-CB 3.28Å; F404-Q408 PolarHBondContact O-N 3.16Å; Q408-F411 PolarHBondContact O-N 2.87Å; Q408-V412 HydrophobicContact CG-CG2 4.09Å; Q408-V412 WeakPolarHBondContact O-CG2 3.48Å; Q408-V412 PolarHBondContact O-N 3.42Å; Q408-V412 VanDerWaalsContact O-N 3.1Å; Q408-L473 HydrophobicContact CB-CD2 3.96Å; Q408-L473 HydrophobicContact CG-CD2 3.96Å
409G92Very high91.1Very high18 Ų1839.1 Ų39.119%0.18621%0.208CC..Hα-helixtrans-53.7-52.2176.100000113.4F405 F411 V412 L413F405-G409 WeakPolarHBondContact O-CA 3.39Å; F405-G409 PolarHBondContact O-N 3.02Å; G409-F411 PolarHBondContact O-N 3.2Å; G409-V412 PolarHBondContact O-N 3.42Å; G409-L413 WeakPolarHBondContact O-CB 3.23Å; G409-L413 PolarHBondContact O-N 3.42Å
410P93.7Very high90.7Very high47 Ų4741.6 Ų41.631%0.30522%0.216SC..Hα-helixtrans-58.6-42178.2-27.136.4000113.4I406 L413 T414 S469I406-P410 VanDerWaalsContact O-CD 3.28Å; I406-P410 WeakPolarHBondContact O-CD 3.22Å; I406-P410 WeakPolarHBondContact O-CG 3.33Å; P410-L413 PolarHBondContact O-N 3.03Å; P410-T414 VanDerWaalsContact O-CB 3.32Å; P410-T414 WeakPolarHBondContact O-CB 3.43Å; P410-T414 PolarHBondContact O-N 3.12Å; P410-T414 PolarHBondContact O-OG1 3.24Å; P410-S469 WeakPolarHBondContact CB-OG 3.37Å; P410-S469 PolarHBondContact O-OG 3.13Å
411F93.9Very high90.6Very high19 Ų1942.6 Ų42.68%0.08323%0.226CC..Hα-helixtrans-61.7-52.4178.4-178.4-94.7000111.7L150 Q408 G409 L413 T414 T415 V470 L473L150-F411 HydrophobicContact CD1-CD1 3.99Å; L150-F411 HydrophobicContact CD1-CE1 3.55Å; L150-F411 HydrophobicContact CD1-CZ 4.27Å; Q408-F411 PolarHBondContact O-N 2.87Å; G409-F411 PolarHBondContact O-N 3.2Å; F411-L413 VanDerWaalsContact C-N 3.32Å; F411-L413 PolarHBondContact O-N 3.34Å; F411-T414 PolarHBondContact O-N 2.74Å; F411-T414 VanDerWaalsContact O-N 3.13Å; F411-T415 PolarHBondContact O-N 2.9Å; F411-T415 PolarHBondContact O-OG1 3.44Å; F411-V470 HydrophobicContact CD2-CG2 4.31Å; F411-V470 HydrophobicContact CE2-CG2 4.11Å; F411-L473 HydrophobicContact CB-CD1 3.88Å; F411-L473 HydrophobicContact CB-CD2 4.35Å; F411-L473 HydrophobicContact CB-CG 3.89Å; F411-L473 HydrophobicContact CD1-CD1 3.68Å; F411-L473 HydrophobicContact CD2-CD1 3.45Å; F411-L473 VanDerWaalsContact CD2-CD1 3.45Å; F411-L473 HydrophobicContact CD2-CG 4.22Å; F411-L473 HydrophobicContact CE1-CD1 4.01Å; F411-L473 HydrophobicContact CE2-CD1 3.8Å; F411-L473 HydrophobicContact CG-CD1 3.37Å; F411-L473 HydrophobicContact CG-CG 3.97Å; F411-L473 HydrophobicContact CZ-CD1 4.06Å
412V91.4Very high90Very high1 Ų143.7 Ų43.71%0.00624%0.236CC..Hα-helixtrans-60.5-44.6-179.5-178.20000111.2F232 L233 Q408 G409 T414 T415 V416F232-V412 HydrophobicContact CD1-CG1 4.14Å; F232-V412 HydrophobicContact CD1-CG2 3.67Å; F232-V412 HydrophobicContact CE1-CB 4.46Å; F232-V412 HydrophobicContact CE1-CG1 4.44Å; F232-V412 HydrophobicContact CE1-CG2 3.19Å; F232-V412 HydrophobicContact CZ-CG2 4.08Å; L233-V412 HydrophobicContact CB-CG1 4.21Å; L233-V412 HydrophobicContact CD2-CG1 4.34Å; Q408-V412 HydrophobicContact CG-CG2 4.09Å; Q408-V412 WeakPolarHBondContact O-CG2 3.48Å; Q408-V412 PolarHBondContact O-N 3.42Å; Q408-V412 VanDerWaalsContact O-N 3.1Å; G409-V412 PolarHBondContact O-N 3.42Å; V412-T414 VanDerWaalsContact C-N 3.3Å; V412-T414 PolarHBondContact O-N 2.9Å; V412-T415 PolarHBondContact O-N 3.06Å; V412-V416 HydrophobicContact CG1-CG2 4.39Å; V412-V416 WeakPolarHBondContact O-CB 3.26Å; V412-V416 WeakPolarHBondContact O-CG2 3.43Å; V412-V416 PolarHBondContact O-N 3.32Å
413L90.7Very high89Confident100 Ų10041.2 Ų41.252%0.52422%0.221SC..Hα-helixtrans-59.7-43.1177.4-177.961.1000111G409 P410 F411 V416 I417G409-L413 WeakPolarHBondContact O-CB 3.23Å; G409-L413 PolarHBondContact O-N 3.42Å; P410-L413 PolarHBondContact O-N 3.03Å; F411-L413 VanDerWaalsContact C-N 3.32Å; F411-L413 PolarHBondContact O-N 3.34Å; L413-V416 PolarHBondContact O-N 3.41Å; L413-I417 HydrophobicContact CD1-CD1 4.03Å; L413-I417 HydrophobicContact CD1-CG1 4.42Å; L413-I417 HydrophobicContact CG-CD1 3.86Å; L413-I417 WeakPolarHBondContact O-CB 3.36Å; L413-I417 VanDerWaalsContact O-CG1 3.25Å; L413-I417 WeakPolarHBondContact O-CG1 3.12Å; L413-I417 PolarHBondContact O-N 3.35Å
414T91.4Very high87.7Confident6 Ų642.8 Ų42.84%0.03724%0.239CC..Hα-helixtrans-69.1-44.1179-52.30000112P410 F411 V412 V416 I417 M418 I465 N466 S469P410-T414 VanDerWaalsContact O-CB 3.32Å; P410-T414 WeakPolarHBondContact O-CB 3.43Å; P410-T414 PolarHBondContact O-N 3.12Å; P410-T414 PolarHBondContact O-OG1 3.24Å; F411-T414 PolarHBondContact O-N 2.74Å; F411-T414 VanDerWaalsContact O-N 3.13Å; V412-T414 VanDerWaalsContact C-N 3.3Å; V412-T414 PolarHBondContact O-N 2.9Å; T414-V416 VanDerWaalsContact C-N 3.26Å; T414-V416 PolarHBondContact O-N 3.1Å; T414-I417 PolarHBondContact O-N 2.83Å; T414-M418 HydrophobicContact CG2-CG 4.15Å; T414-M418 VanDerWaalsContact O-CB 3.31Å; T414-M418 WeakPolarHBondContact O-CB 3.35Å; T414-M418 VanDerWaalsContact O-CG 3.24Å; T414-M418 WeakPolarHBondContact O-CG 3.47Å; T414-M418 PolarHBondContact O-N 3.44Å; T414-I465 HydrophobicContact CG2-CB 4.48Å; T414-I465 HydrophobicContact CG2-CG2 4.32Å; T414-I465 WeakPolarHBondContact OG1-CG2 3.3Å; T414-N466 HydrophobicContact CG2-CB 3.99Å; T414-S469 PolarHBondContact OG1-OG 2.96Å
415T88.8Confident86.2Confident21 Ų2147.1 Ų47.113%0.12926%0.258CS..Hα-helixtrans-58.7-39.9173.9-49.50000111.6F411 V412 R419F411-T415 PolarHBondContact O-N 2.9Å; F411-T415 PolarHBondContact O-OG1 3.44Å; V412-T415 PolarHBondContact O-N 3.06Å; T415-R419 WeakPolarHBondContact O-CB 3.26Å; T415-R419 WeakPolarHBondContact O-CG 3.33Å; T415-R419 PolarHBondContact O-N 3.27Å
416V88.2Confident84.4Confident16 Ų1650.3 Ų50.310%0.09727%0.269CS..Hα-helixtrans-64.9-54175.4167.70000110.2Q228 I229 V412 L413 T414 M418 R419 F420Q228-V416 HydrophobicContact CB-CG2 4.22Å; Q228-V416 HydrophobicContact CG-CG2 3.73Å; I229-V416 HydrophobicContact CD1-CG1 3.68Å; I229-V416 HydrophobicContact CD1-CG2 4.42Å; I229-V416 HydrophobicContact CG1-CG1 3.97Å; I229-V416 HydrophobicContact CG1-CG2 3.78Å; V412-V416 HydrophobicContact CG1-CG2 4.39Å; V412-V416 WeakPolarHBondContact O-CB 3.26Å; V412-V416 WeakPolarHBondContact O-CG2 3.43Å; V412-V416 PolarHBondContact O-N 3.32Å; L413-V416 PolarHBondContact O-N 3.41Å; T414-V416 VanDerWaalsContact C-N 3.26Å; T414-V416 PolarHBondContact O-N 3.1Å; V416-M418 VanDerWaalsContact C-N 3.34Å; V416-M418 PolarHBondContact O-N 3.49Å; V416-R419 PolarHBondContact O-N 3.2Å; V416-F420 HydrophobicContact CG1-CD2 3.75Å; V416-F420 HydrophobicContact CG1-CE2 3.93Å; V416-F420 WeakPolarHBondContact O-CD2 3.38Å; V416-F420 PolarHBondContact O-N 3Å
417I88.6Confident82.7Confident69 Ų6949.7 Ų49.735%0.35427%0.266SS..Hα-helixtrans-56-48178.3-70.3166.3000110.6L413 T414 R419 F420 S421L413-I417 HydrophobicContact CD1-CD1 4.03Å; L413-I417 HydrophobicContact CD1-CG1 4.42Å; L413-I417 HydrophobicContact CG-CD1 3.86Å; L413-I417 WeakPolarHBondContact O-CB 3.36Å; L413-I417 VanDerWaalsContact O-CG1 3.25Å; L413-I417 WeakPolarHBondContact O-CG1 3.12Å; L413-I417 PolarHBondContact O-N 3.35Å; T414-I417 PolarHBondContact O-N 2.83Å; I417-R419 PolarHBondContact O-N 2.86Å; I417-F420 PolarHBondContact O-N 3.44Å; I417-S421 VanDerWaalsContact O-CB 3.31Å; I417-S421 WeakPolarHBondContact O-CB 3.25Å; I417-S421 PolarHBondContact O-N 3.45Å; I417-S421 PolarHBondContact O-OG 2.88Å; I417-S421 VanDerWaalsContact O-OG 3.09Å
418M87Confident81.1Confident81 Ų8152.3 Ų52.340%0.39928%0.284SS..Hα-helixtrans-61.4-45.1179.3-71.8-63.9-76.400112.4T414 V416 F420 S422T414-M418 HydrophobicContact CG2-CG 4.15Å; T414-M418 VanDerWaalsContact O-CB 3.31Å; T414-M418 WeakPolarHBondContact O-CB 3.35Å; T414-M418 VanDerWaalsContact O-CG 3.24Å; T414-M418 WeakPolarHBondContact O-CG 3.47Å; T414-M418 PolarHBondContact O-N 3.44Å; V416-M418 VanDerWaalsContact C-N 3.34Å; V416-M418 PolarHBondContact O-N 3.49Å; M418-F420 PolarHBondContact O-N 3.36Å; M418-S422 WeakPolarHBondContact O-CB 3.16Å; M418-S422 PolarHBondContact O-N 3.35Å
419R84.8Confident79.6Confident49 Ų4955.2 Ų55.219%0.18530%0.3CS..Hα-helixtrans-66.3-34.7176.4-76.3-170.8176.2129-8.6112.3E144 D147 I224 T415 V416 I417 T423E144-R419 VanDerWaalsContact CD-NH2 3.32Å; E144-R419 IonicContact OE1-CZ 3.3Å; E144-R419 IonicContact OE1-NH2 2.85Å; E144-R419 PolarHBondContact OE1-NH2 3.28Å; E144-R419 IonicContact OE2-NH2 2.68Å; E144-R419 PolarHBondContact OE2-NH2 3.42Å; D147-R419 IonicContact OD2-CZ 3.73Å; D147-R419 VanDerWaalsContact OD2-CZ 3.3Å; D147-R419 IonicContact OD2-NH1 2.77Å; D147-R419 PolarHBondContact OD2-NH1 3.08Å; D147-R419 IonicContact OD2-NH2 2.68Å; D147-R419 PolarHBondContact OD2-NH2 3.38Å; I224-R419 HydrophobicContact CD1-CB 4.31Å; I224-R419 HydrophobicContact CG2-CB 4.45Å; T415-R419 WeakPolarHBondContact O-CB 3.26Å; T415-R419 WeakPolarHBondContact O-CG 3.33Å; T415-R419 PolarHBondContact O-N 3.27Å; V416-R419 PolarHBondContact O-N 3.2Å; I417-R419 PolarHBondContact O-N 2.86Å; R419-T423 PolarHBondContact O-N 3.22Å; R419-T423 PolarHBondContact O-OG1 3.42Å
420F85.4Confident78.1Confident81 Ų8157.6 Ų57.636%0.35531%0.311SS..Hα-helixtrans-70.9-49.4174.1-88.5-77.1000112.2I224 I229 V416 I417 M418 T423 G424I224-F420 HydrophobicContact CG2-CE2 4.29Å; I229-F420 HydrophobicContact CD1-CE2 4.28Å; V416-F420 HydrophobicContact CG1-CD2 3.75Å; V416-F420 HydrophobicContact CG1-CE2 3.93Å; V416-F420 WeakPolarHBondContact O-CD2 3.38Å; V416-F420 PolarHBondContact O-N 3Å; I417-F420 PolarHBondContact O-N 3.44Å; M418-F420 PolarHBondContact O-N 3.36Å; F420-T423 PolarHBondContact O-N 3.31Å; F420-T423 VanDerWaalsContact O-N 3.15Å; F420-G424 PolarHBondContact O-N 3.11Å; F420-G424 VanDerWaalsContact O-N 3.08Å
421S84.2Confident76.8Confident60 Ų6059.7 Ų59.742%0.4232%0.319SS..Hα-helixtrans-62.3-42.5179.7-66.30000112.5I417 T423 G424 F425I417-S421 VanDerWaalsContact O-CB 3.31Å; I417-S421 WeakPolarHBondContact O-CB 3.25Å; I417-S421 PolarHBondContact O-N 3.45Å; I417-S421 PolarHBondContact O-OG 2.88Å; I417-S421 VanDerWaalsContact O-OG 3.09Å; S421-T423 VanDerWaalsContact C-N 3.29Å; S421-T423 PolarHBondContact O-N 2.8Å; S421-G424 PolarHBondContact O-N 2.81Å; S421-F425 PolarHBondContact O-N 3.1Å
422S78.9Confident75.9Confident48 Ų4864.9 Ų64.934%0.33634%0.342SS..Hα-helixtrans-56.5-44.4173173.80000111.2M418 G424 F425 Y426M418-S422 WeakPolarHBondContact O-CB 3.16Å; M418-S422 PolarHBondContact O-N 3.35Å; S422-G424 PolarHBondContact O-N 3.48Å; S422-F425 PolarHBondContact O-N 2.93Å; S422-Y426 WeakPolarHBondContact O-CD2 3.48Å; S422-Y426 PolarHBondContact O-N 3.26Å
423T71.1Confident75Confident18 Ų1869.7 Ų69.711%0.1137%0.367CS..Hα-helixtrans-68.3-22.5178-470000113I217 K221 R419 F420 S421I217-T423 HydrophobicContact CG2-CG2 4.26Å; K221-T423 HydrophobicContact CD-CG2 4.46Å; K221-T423 HydrophobicContact CG-CG2 4.33Å; R419-T423 PolarHBondContact O-N 3.22Å; R419-T423 PolarHBondContact O-OG1 3.42Å; F420-T423 PolarHBondContact O-N 3.31Å; F420-T423 VanDerWaalsContact O-N 3.15Å; S421-T423 VanDerWaalsContact C-N 3.29Å; S421-T423 PolarHBondContact O-N 2.8Å
424G66.4Low74.3Confident42 Ų4269.6 Ų69.643%0.43337%0.366SS..Hα-helixtrans-81.7-44.6173.600000113.2F420 S421 S422 Y426 L427 S428F420-G424 PolarHBondContact O-N 3.11Å; F420-G424 VanDerWaalsContact O-N 3.08Å; S421-G424 PolarHBondContact O-N 2.81Å; S422-G424 PolarHBondContact O-N 3.48Å; G424-Y426 PolarHBondContact O-N 3.05Å; G424-L427 PolarHBondContact O-N 3.41Å; G424-L427 VanDerWaalsContact O-N 3.11Å; G424-S428 PolarHBondContact O-N 3.34Å; G424-S428 VanDerWaalsContact O-N 3.15Å
425F59.4Low73.6Confident100 Ų10074.2 Ų74.244%0.43939%0.39SS..Hα-helixtrans-61.5-43.4-178.1-105.3-84.7000112.2S421 S422 L427 S428 D429 K457S421-F425 PolarHBondContact O-N 3.1Å; S422-F425 PolarHBondContact O-N 2.93Å; F425-L427 PolarHBondContact O-N 2.94Å; F425-L427 VanDerWaalsContact O-N 3.15Å; F425-S428 PolarHBondContact O-N 3.38Å; F425-D429 WeakPolarHBondContact CD1-OD2 3.34Å; F425-D429 WeakPolarHBondContact O-CB 3.31Å; F425-D429 PolarHBondContact O-N 2.98Å; F425-K457 VanDerWaalsContact CZ-NZ 3.28Å
426Y53.8Low73Confident165 Ų16577.7 Ų77.765%0.64741%0.408SS*.Hα-helixtrans-56.6-33.5175.3-76.1-64.2000113.4S422 G424 T430S422-Y426 WeakPolarHBondContact O-CD2 3.48Å; S422-Y426 PolarHBondContact O-N 3.26Å; G424-Y426 PolarHBondContact O-N 3.05Å; Y426-T430 WeakPolarHBondContact O-CB 3.33Å; Y426-T430 VanDerWaalsContact O-CG2 3.26Å; Y426-T430 WeakPolarHBondContact O-CG2 3.19Å; Y426-T430 PolarHBondContact O-N 3.5Å; Y426-T430 PolarHBondContact O-OG1 2.93Å
427L58.5Low72.2Confident97 Ų9780.3 Ų80.351%0.50842%0.424SS..Hα-helixtrans-77.9-38.9179.2-131.3104.4000112.7G424 F425 T430 N431G424-L427 PolarHBondContact O-N 3.41Å; G424-L427 VanDerWaalsContact O-N 3.11Å; F425-L427 PolarHBondContact O-N 2.94Å; F425-L427 VanDerWaalsContact O-N 3.15Å; L427-T430 PolarHBondContact O-OG1 3.46Å; L427-N431 WeakPolarHBondContact O-CB 3.2Å; L427-N431 PolarHBondContact O-N 3Å; L427-N431 VanDerWaalsContact O-N 3.16Å
428S61.9Low71.7Confident58 Ų5882 Ų8241%0.40643%0.434SS..Hα-helixtrans-66.5-43.7174.8177.70000111G424 F425 N431 K432G424-S428 PolarHBondContact O-N 3.34Å; G424-S428 VanDerWaalsContact O-N 3.15Å; F425-S428 PolarHBondContact O-N 3.38Å; S428-N431 PolarHBondContact O-N 2.83Å; S428-K432 WeakPolarHBondContact O-CB 3.29Å; S428-K432 PolarHBondContact O-N 3.49Å
429D60.4Low71Confident64 Ų6483.6 Ų83.634%0.34244%0.443SS..Hα-helixtrans-76.2-34.4-178.6-67.1-15.4000111.5F425 N431 K432 I433F425-D429 WeakPolarHBondContact CD1-OD2 3.34Å; F425-D429 WeakPolarHBondContact O-CB 3.31Å; F425-D429 PolarHBondContact O-N 2.98Å; D429-N431 VanDerWaalsContact C-N 3.34Å; D429-N431 PolarHBondContact O-N 2.91Å; D429-K432 PolarHBondContact O-N 3.32Å; D429-I433 HydrophobicContact CB-CD1 4.44Å; D429-I433 WeakPolarHBondContact O-CB 3.26Å; D429-I433 WeakPolarHBondContact O-CD1 3.35Å; D429-I433 WeakPolarHBondContact O-CG1 3.49Å; D429-I433 PolarHBondContact O-N 2.79Å
430T62.4Low69.9Low68 Ų6885.1 Ų85.142%0.41745%0.454SS..Hα-helixtrans-64.4-38.5169.451.50000111.9Y426 L427 I433 I434Y426-T430 WeakPolarHBondContact O-CB 3.33Å; Y426-T430 VanDerWaalsContact O-CG2 3.26Å; Y426-T430 WeakPolarHBondContact O-CG2 3.19Å; Y426-T430 PolarHBondContact O-N 3.5Å; Y426-T430 PolarHBondContact O-OG1 2.93Å; L427-T430 PolarHBondContact O-OG1 3.46Å; T430-I433 PolarHBondContact O-N 2.88Å; T430-I434 VanDerWaalsContact O-CB 3.25Å; T430-I434 WeakPolarHBondContact O-CB 3.18Å; T430-I434 WeakPolarHBondContact O-CD1 3.36Å; T430-I434 WeakPolarHBondContact O-CG1 3.41Å; T430-I434 PolarHBondContact O-N 3.25Å
431N65.8Low68.8Low90 Ų9086 Ų8648%0.48147%0.469SS..Hα-helixtrans-69.7-38176-77.1-14.1000112.2L427 S428 D429 N435L427-N431 WeakPolarHBondContact O-CB 3.2Å; L427-N431 PolarHBondContact O-N 3Å; L427-N431 VanDerWaalsContact O-N 3.16Å; S428-N431 PolarHBondContact O-N 2.83Å; D429-N431 VanDerWaalsContact C-N 3.34Å; D429-N431 PolarHBondContact O-N 2.91Å; N431-N435 VanDerWaalsContact O-CB 3.29Å; N431-N435 WeakPolarHBondContact O-CB 3.44Å; N431-N435 VanDerWaalsContact O-CG 3.23Å; N431-N435 PolarHBondContact O-N 3.2Å
432K75.1Confident68.1Low129 Ų12989 Ų8956%0.56148%0.481SS*.Hα-helixtrans-67.7-41.1172.6-83.9-171.3172.6-173.70112.5S428 D429 N436S428-K432 WeakPolarHBondContact O-CB 3.29Å; S428-K432 PolarHBondContact O-N 3.49Å; D429-K432 PolarHBondContact O-N 3.32Å; K432-N436 WeakPolarHBondContact O-CA 3.48Å; K432-N436 WeakPolarHBondContact O-CB 3.45Å; K432-N436 PolarHBondContact O-N 3.38Å; K432-N436 PolarHBondContact O-OD1 2.85Å
433I71.7Confident67.3Low102 Ų10290.4 Ų90.452%0.52349%0.487SS..Hα-helixtrans-67-46176.5-69.6163.3000109.2D429 T430 N435 N436 T437D429-I433 HydrophobicContact CB-CD1 4.44Å; D429-I433 WeakPolarHBondContact O-CB 3.26Å; D429-I433 WeakPolarHBondContact O-CD1 3.35Å; D429-I433 WeakPolarHBondContact O-CG1 3.49Å; D429-I433 PolarHBondContact O-N 2.79Å; T430-I433 PolarHBondContact O-N 2.88Å; I433-N435 PolarHBondContact O-N 3.1Å; I433-N436 PolarHBondContact O-N 3.19Å; I433-T437 WeakPolarHBondContact O-CA 3.39Å; I433-T437 WeakPolarHBondContact O-CB 3.11Å; I433-T437 PolarHBondContact O-N 3.46Å; I433-T437 PolarHBondContact O-OG1 3.48Å
434I76.5Confident66.6Low98 Ų9896.9 Ų96.950%0.50351%0.514SS..Hα-helixtrans-58.5-48.8175.6-71.3163.5000110.5T430 T437 L438T430-I434 VanDerWaalsContact O-CB 3.25Å; T430-I434 WeakPolarHBondContact O-CB 3.18Å; T430-I434 WeakPolarHBondContact O-CD1 3.36Å; T430-I434 WeakPolarHBondContact O-CG1 3.41Å; T430-I434 PolarHBondContact O-N 3.25Å; I434-T437 PolarHBondContact O-N 3.38Å; I434-L438 WeakPolarHBondContact O-CB 3.48Å; I434-L438 PolarHBondContact O-N 2.95Å
435N77.6Confident66.2Low102 Ų102101.1 Ų101.155%0.54553%0.532SS..Hα-helixtrans-66.4-41.3178.8-72.4-9.5000112.6N431 I433 L438 L439N431-N435 VanDerWaalsContact O-CB 3.29Å; N431-N435 WeakPolarHBondContact O-CB 3.44Å; N431-N435 VanDerWaalsContact O-CG 3.23Å; N431-N435 PolarHBondContact O-N 3.2Å; I433-N435 PolarHBondContact O-N 3.1Å; N435-L438 PolarHBondContact O-N 3.47Å; N435-L439 WeakPolarHBondContact O-CB 3.11Å; N435-L439 PolarHBondContact O-N 3.41Å
436N75.1Confident66.1Low94 Ų94103.1 Ų103.150%0.50355%0.547SS..Hα-helixtrans-73.9-29.3178.9-70.9-0.1000112.3K432 I433 L439 L440K432-N436 WeakPolarHBondContact O-CA 3.48Å; K432-N436 WeakPolarHBondContact O-CB 3.45Å; K432-N436 PolarHBondContact O-N 3.38Å; K432-N436 PolarHBondContact O-OD1 2.85Å; I433-N436 PolarHBondContact O-N 3.19Å; N436-L439 PolarHBondContact O-N 2.72Å; N436-L440 WeakPolarHBondContact O-CB 3.47Å; N436-L440 WeakPolarHBondContact O-CD1 3.41Å; N436-L440 VanDerWaalsContact O-CG 3.25Å; N436-L440 WeakPolarHBondContact O-CG 3.47Å; N436-L440 PolarHBondContact O-N 2.96Å
437T72.2Confident66Low72 Ų72103.2 Ų103.244%0.44255%0.553SS.*Hα-helixtrans-74.6-36.4171.9-64.40000110.4I433 I434 L439 L440 C441I433-T437 WeakPolarHBondContact O-CA 3.39Å; I433-T437 WeakPolarHBondContact O-CB 3.11Å; I433-T437 PolarHBondContact O-N 3.46Å; I433-T437 PolarHBondContact O-OG1 3.48Å; I434-T437 PolarHBondContact O-N 3.38Å; T437-L439 VanDerWaalsContact C-N 3.33Å; T437-L440 PolarHBondContact O-N 2.87Å; T437-C441 VanDerWaalsContact O-CB 3.29Å; T437-C441 WeakPolarHBondContact O-CB 3.04Å; T437-C441 PolarHBondContact O-N 3.16Å; T437-C441 PolarHBondContact O-SG 2.84Å; T437-C441 VanDerWaalsContact O-SG 3.37Å
438L76.7Confident65.9Low105 Ų105106 Ų10655%0.5557%0.569SS.*Hα-helixtrans-62.1-41167.3-111.5153.7000111.6I434 N435 N442I434-L438 WeakPolarHBondContact O-CB 3.48Å; I434-L438 PolarHBondContact O-N 2.95Å; N435-L438 PolarHBondContact O-N 3.47Å; L438-N442 PolarHBondContact O-N 3.1Å; L438-N442 PolarHBondContact O-ND2 3.44Å
439L72.2Confident65.6Low113 Ų113111.9 Ų111.959%0.59259%0.59SS**Hα-helixtrans-68.9-43.2176.6-150.9105.8000111.7N435 N436 T437 N442 T443N435-L439 WeakPolarHBondContact O-CB 3.11Å; N435-L439 PolarHBondContact O-N 3.41Å; N436-L439 PolarHBondContact O-N 2.72Å; T437-L439 VanDerWaalsContact C-N 3.33Å; L439-N442 CarbonylContact O-C 3.5Å; L439-N442 WeakPolarHBondContact O-CA 3.41Å; L439-N442 WeakPolarHBondContact O-CB 3.46Å; L439-N442 PolarHBondContact O-N 3.1Å; L439-T443 PolarHBondContact O-N 3.05Å; L439-T443 VanDerWaalsContact O-N 3.08Å; L439-T443 PolarHBondContact O-OG1 2.81Å
440L63Low65.5Low81 Ų81115.7 Ų115.742%0.42461%0.608SS.*Hα-helixtrans-68-37177.5-82.1164.6000112.3N436 T437 N442 T443 F444N436-L440 WeakPolarHBondContact O-CB 3.47Å; N436-L440 WeakPolarHBondContact O-CD1 3.41Å; N436-L440 VanDerWaalsContact O-CG 3.25Å; N436-L440 WeakPolarHBondContact O-CG 3.47Å; N436-L440 PolarHBondContact O-N 2.96Å; T437-L440 PolarHBondContact O-N 2.87Å; L440-N442 PolarHBondContact O-N 3.28Å; L440-T443 WeakPolarHBondContact CA-OG1 3.39Å; L440-T443 PolarHBondContact O-N 2.85Å; L440-T443 VanDerWaalsContact O-N 3.07Å; L440-F444 HydrophobicContact CB-CD2 4.06Å; L440-F444 HydrophobicContact CB-CE2 4.39Å; L440-F444 HydrophobicContact CD2-CD2 3.95Å; L440-F444 HydrophobicContact CD2-CE2 3.82Å; L440-F444 WeakPolarHBondContact O-CB 3.42Å; L440-F444 PolarHBondContact O-N 3.28Å
441C61.4Low65.1Low100 Ų100121.3 Ų121.368%0.67663%0.63SS**Hα-helixtrans-61.4-24.4169.7-79.90000112.7T437T437-C441 VanDerWaalsContact O-CB 3.29Å; T437-C441 WeakPolarHBondContact O-CB 3.04Å; T437-C441 PolarHBondContact O-N 3.16Å; T437-C441 PolarHBondContact O-SG 2.84Å; T437-C441 VanDerWaalsContact O-SG 3.37Å
442N69.4Low64.7Low123 Ų123122.6 Ų122.666%0.65864%0.641SS**THydrogen-bonded Turntrans-90.6-10.9174.4-66.5-21.5000113.8L438 L439 L440L438-N442 PolarHBondContact O-N 3.1Å; L438-N442 PolarHBondContact O-ND2 3.44Å; L439-N442 CarbonylContact O-C 3.5Å; L439-N442 WeakPolarHBondContact O-CA 3.41Å; L439-N442 WeakPolarHBondContact O-CB 3.46Å; L439-N442 PolarHBondContact O-N 3.1Å; L440-N442 PolarHBondContact O-N 3.28Å
443T62.3Low63.9Low77 Ų77124 Ų12447%0.47265%0.653SS.*THydrogen-bonded Turntrans-119.4-8.9-178.958.90000115.4L439 L440 T445L439-T443 PolarHBondContact O-N 3.05Å; L439-T443 VanDerWaalsContact O-N 3.08Å; L439-T443 PolarHBondContact O-OG1 2.81Å; L440-T443 WeakPolarHBondContact CA-OG1 3.39Å; L440-T443 PolarHBondContact O-N 2.85Å; L440-T443 VanDerWaalsContact O-N 3.07Å; T443-T445 PolarHBondContact O-N 2.81Å
444F57.5Low63.2Low155 Ų155124.7 Ų124.768%0.6866%0.662SS**THydrogen-bonded Turntrans-72.312.9179.8-111.4-67.8000115.6L440 D446L440-F444 HydrophobicContact CB-CD2 4.06Å; L440-F444 HydrophobicContact CB-CE2 4.39Å; L440-F444 HydrophobicContact CD2-CD2 3.95Å; L440-F444 HydrophobicContact CD2-CE2 3.82Å; L440-F444 WeakPolarHBondContact O-CB 3.42Å; L440-F444 PolarHBondContact O-N 3.28Å; F444-D446 VanDerWaalsContact C-N 3.3Å
445T58.3Low62.4Low131 Ų131125.9 Ų125.980%0.80468%0.676SS**THydrogen-bonded Turntrans-77.9-10.9171.743.10000114T443T443-T445 PolarHBondContact O-N 2.81Å
446D55.9Low61.8Low141 Ų141126.4 Ų126.475%0.75468%0.679SS**SBendtrans-112.5118.2171.1-91.4-48.6000111.7F444F444-D446 VanDerWaalsContact C-N 3.3Å
447Q52.4Low61.8Low167 Ų167129.4 Ų129.478%0.7869%0.688SS**  trans-79.3158.5169.2-69.2176.4-50.200110.4
448N56.9Low62.1Low157 Ų157131.3 Ų131.384%0.8470%0.701SS**  trans93.645.5170.3-45.3-41.3000118.1
449H55.8Low62.3Low181 Ų181130.5 Ų130.584%0.83869%0.694SS**  trans-122.6126.9160.5-124.8-80.5000114.7
450I57.3Low62.9Low143 Ų143126.4 Ų126.473%0.73368%0.679SS**  trans-57.2141.5-176.7-67157.1000111.4T452I450-T452 VanDerWaalsContact C-N 3.35Å; I450-T452 PolarHBondContact O-N 3.47Å
451E54.7Low64.2Low186 Ų186130.5 Ų130.587%0.86969%0.694SS**  trans-61.388.8173-64.6-175.1151.600111.5I453E451-I453 PolarHBondContact O-N 3.22Å
452T57.1Low65.4Low118 Ų118127.5 Ų127.572%0.72468%0.676SS**  trans-68.9101.1170.249.30000109.4I450 T454I450-T452 VanDerWaalsContact C-N 3.35Å; I450-T452 PolarHBondContact O-N 3.47Å; T452-T454 PolarHBondContact O-N 2.89Å
453I58.1Low66.3Low157 Ų157124.4 Ų124.481%0.80566%0.659SS**  trans-46113.2170.8-60.7171.1000108.6E451E451-I453 PolarHBondContact O-N 3.22Å
454T57.3Low67.8Low117 Ų117122.8 Ų122.872%0.71865%0.645SS**PPolyproline II helixtrans-62.5135-177.6500000110T452 N456T452-T454 PolarHBondContact O-N 2.89Å; T454-N456 PolarHBondContact O-N 3.06Å
455P58.4Low69.5Low123 Ų123117.1 Ų117.180%0.79962%0.621SS**PPolyproline II helixtrans-58136.6-171.822.2-33.7000112K457P455-K457 PolarHBondContact O-N 3.47Å; P455-K457 VanDerWaalsContact O-N 3.15Å
456N66.4Low71.1Confident114 Ų114113.7 Ų113.761%0.6160%0.598SS**PPolyproline II helixtrans-48.7117.9-177-65.5-26.4000110.9D53 T454 P458D53-N456 PolarHBondContact OD2-ND2 3.24Å; T454-N456 PolarHBondContact O-N 3.06Å; N456-P458 WeakPolarHBondContact O-CD 3.39Å
457K74.1Confident72.9Confident156 Ų156107.3 Ų107.368%0.67856%0.564SS**PPolyproline II helixtrans-64.3121.8169.4-178.2-176.1176.3-170.50107.1F425 P455 F459F425-K457 VanDerWaalsContact CZ-NZ 3.28Å; P455-K457 PolarHBondContact O-N 3.47Å; P455-K457 VanDerWaalsContact O-N 3.15Å; K457-F459 PolarHBondContact O-N 3.19Å
458P78.3Confident75Confident112 Ų112103.5 Ų103.573%0.72755%0.548SS*.PPolyproline II helixtrans-60140-176.123.9-34000110.5N456 G460N456-P458 WeakPolarHBondContact O-CD 3.39Å; P458-G460 PolarHBondContact O-N 3.28Å
459F80.6Confident76.9Confident89 Ų8996 Ų9639%0.3951%0.508SS..PPolyproline II helixtrans-54.6124.4178.1-79-76.8000110.2D56 L57 K457 D463 Y464D56-F459 HydrophobicContact CB-CD2 4.31Å; L57-F459 HydrophobicContact CB-CE2 4.38Å; L57-F459 HydrophobicContact CD1-CZ 3.98Å; K457-F459 PolarHBondContact O-N 3.19Å; F459-D463 HydrophobicContact CD1-CB 4.48Å; F459-Y464 HydrophobicContact CB-CE2 3.92Å
460G86.3Confident78.8Confident27 Ų2788.3 Ų88.328%0.27847%0.474SS..PPolyproline II helixtrans-78.6150.7-178.600000110.8P458 A462 D463P458-G460 PolarHBondContact O-N 3.28Å; G460-A462 PolarHBondContact O-N 3.43Å; G460-A462 VanDerWaalsContact O-N 3.08Å; G460-D463 WeakPolarHBondContact CA-OD2 3.24Å; G460-D463 PolarHBondContact N-OD2 2.79Å; G460-D463 WeakPolarHBondContact O-CB 3.44Å; G460-D463 PolarHBondContact O-N 2.66Å
461F89.6Confident80.7Confident167 Ų16782.4 Ų82.473%0.73244%0.444SS*.Hα-helixtrans-49.8-36.7169177.7-123.3000112D463 Y464 I465F461-D463 VanDerWaalsContact C-N 3.27Å; F461-D463 PolarHBondContact O-N 2.94Å; F461-Y464 PolarHBondContact O-N 3.27Å; F461-I465 HydrophobicContact CD1-CD1 3.43Å; F461-I465 VanDerWaalsContact CD1-CD1 3.43Å; F461-I465 HydrophobicContact CD1-CG1 4.05Å; F461-I465 HydrophobicContact CD2-CG1 4.29Å; F461-I465 HydrophobicContact CE1-CD1 3.28Å; F461-I465 HydrophobicContact CE1-CG1 3.78Å; F461-I465 HydrophobicContact CE2-CD1 4.42Å; F461-I465 HydrophobicContact CE2-CG1 4.03Å; F461-I465 HydrophobicContact CG-CD1 4.07Å; F461-I465 HydrophobicContact CG-CG1 4.29Å; F461-I465 HydrophobicContact CZ-CD1 3.82Å; F461-I465 HydrophobicContact CZ-CG1 3.75Å; F461-I465 VanDerWaalsContact O-CG1 3.31Å; F461-I465 WeakPolarHBondContact O-CG1 3.29Å; F461-I465 PolarHBondContact O-N 3.47Å; F461-I465 VanDerWaalsContact O-N 3.1Å
462A87.3Confident82.7Confident37 Ų3774.4 Ų74.431%0.30641%0.409SS..Hα-helixtrans-56.8-34.2175.800000114.3G460 Y464 I465 N466G460-A462 PolarHBondContact O-N 3.43Å; G460-A462 VanDerWaalsContact O-N 3.08Å; A462-Y464 VanDerWaalsContact C-N 3.33Å; A462-Y464 PolarHBondContact O-N 3.14Å; A462-I465 PolarHBondContact O-N 3.28Å; A462-N466 PolarHBondContact O-N 3.48Å
463D87.9Confident84.5Confident57 Ų5769.1 Ų69.131%0.30538%0.377SS..Hα-helixtrans-68.1-35.8-178.7-58.2-47.9000110.9Y60 F459 G460 F461 P467Y60-D463 HydrophobicContact CE2-CB 4.15Å; Y60-D463 WeakPolarHBondContact CE2-O 3.17Å; F459-D463 HydrophobicContact CD1-CB 4.48Å; G460-D463 WeakPolarHBondContact CA-OD2 3.24Å; G460-D463 PolarHBondContact N-OD2 2.79Å; G460-D463 WeakPolarHBondContact O-CB 3.44Å; G460-D463 PolarHBondContact O-N 2.66Å; F461-D463 VanDerWaalsContact C-N 3.27Å; F461-D463 PolarHBondContact O-N 2.94Å; D463-P467 WeakPolarHBondContact O-CD 3.5Å
464Y93.2Very high86.3Confident44 Ų4461.7 Ų61.717%0.17334%0.338CS..Hα-helixtrans-78.5-33.4174.9-65-79.9000113.6D56 V59 L63 F459 F461 A462 N466 P467 I468D56-Y464 PolarHBondContact O-OH 3.44Å; V59-Y464 HydrophobicContact CG1-CE1 4.37Å; L63-Y464 HydrophobicContact CD2-CD1 3.95Å; F459-Y464 HydrophobicContact CB-CE2 3.92Å; F461-Y464 PolarHBondContact O-N 3.27Å; A462-Y464 VanDerWaalsContact C-N 3.33Å; A462-Y464 PolarHBondContact O-N 3.14Å; Y464-N466 VanDerWaalsContact C-N 3.25Å; Y464-N466 PolarHBondContact O-N 3.17Å; Y464-P467 VanDerWaalsContact O-CD 3.28Å; Y464-P467 WeakPolarHBondContact O-CD 3.48Å; Y464-P467 WeakPolarHBondContact O-CG 3.17Å; Y464-I468 WeakPolarHBondContact O-CD1 3.3Å; Y464-I468 VanDerWaalsContact O-CG1 3.22Å; Y464-I468 WeakPolarHBondContact O-CG1 3.44Å; Y464-I468 PolarHBondContact O-N 3.45Å
465I93.8Very high88.2Confident36 Ų3659.5 Ų59.519%0.18532%0.322CS..Hα-helixtrans-62.6-34.7179.4-58160.9000111.2T414 F461 A462 I468 S469T414-I465 HydrophobicContact CG2-CB 4.48Å; T414-I465 HydrophobicContact CG2-CG2 4.32Å; T414-I465 WeakPolarHBondContact OG1-CG2 3.3Å; F461-I465 HydrophobicContact CD1-CD1 3.43Å; F461-I465 VanDerWaalsContact CD1-CD1 3.43Å; F461-I465 HydrophobicContact CD1-CG1 4.05Å; F461-I465 HydrophobicContact CD2-CG1 4.29Å; F461-I465 HydrophobicContact CE1-CD1 3.28Å; F461-I465 HydrophobicContact CE1-CG1 3.78Å; F461-I465 HydrophobicContact CE2-CD1 4.42Å; F461-I465 HydrophobicContact CE2-CG1 4.03Å; F461-I465 HydrophobicContact CG-CD1 4.07Å; F461-I465 HydrophobicContact CG-CG1 4.29Å; F461-I465 HydrophobicContact CZ-CD1 3.82Å; F461-I465 HydrophobicContact CZ-CG1 3.75Å; F461-I465 VanDerWaalsContact O-CG1 3.31Å; F461-I465 WeakPolarHBondContact O-CG1 3.29Å; F461-I465 PolarHBondContact O-N 3.47Å; F461-I465 VanDerWaalsContact O-N 3.1Å; A462-I465 PolarHBondContact O-N 3.28Å; I465-I468 PolarHBondContact O-N 3.42Å; I465-S469 VanDerWaalsContact O-CB 3.27Å; I465-S469 WeakPolarHBondContact O-CB 3.08Å; I465-S469 PolarHBondContact O-N 2.88Å; I465-S469 PolarHBondContact O-OG 3.34Å
466N92.1Very high90Very high58 Ų5854.4 Ų54.431%0.3129%0.287SS..Hα-helixtrans-60.8-57.6-177.1-170.943.9000113.6T414 A462 Y464 I468 S469 V470T414-N466 HydrophobicContact CG2-CB 3.99Å; A462-N466 PolarHBondContact O-N 3.48Å; Y464-N466 VanDerWaalsContact C-N 3.25Å; Y464-N466 PolarHBondContact O-N 3.17Å; N466-I468 VanDerWaalsContact C-N 3.33Å; N466-I468 PolarHBondContact O-N 3.28Å; N466-S469 WeakPolarHBondContact O-CB 3.24Å; N466-S469 PolarHBondContact O-N 2.86Å; N466-S469 VanDerWaalsContact O-N 3.13Å; N466-V470 WeakPolarHBondContact O-CG2 3.49Å; N466-V470 PolarHBondContact O-N 2.76Å
467P94.3Very high91.3Very high7 Ų749.4 Ų49.45%0.04526%0.261CS..Hα-helixtrans-63.6-36.117626.9-35.2000112.5L63 K64 D463 Y464 S469 V470 I471L63-P467 HydrophobicContact CD2-CG 3.89Å; L63-P467 HydrophobicContact CG-CB 4.13Å; L63-P467 HydrophobicContact CG-CG 3.99Å; K64-P467 HydrophobicContact CB-CB 4.41Å; D463-P467 WeakPolarHBondContact O-CD 3.5Å; Y464-P467 VanDerWaalsContact O-CD 3.28Å; Y464-P467 WeakPolarHBondContact O-CD 3.48Å; Y464-P467 WeakPolarHBondContact O-CG 3.17Å; P467-S469 VanDerWaalsContact C-N 3.26Å; P467-S469 PolarHBondContact O-N 3.47Å; P467-V470 PolarHBondContact O-N 3.43Å; P467-I471 WeakPolarHBondContact O-CD1 3.22Å; P467-I471 VanDerWaalsContact O-CG1 3.31Å; P467-I471 WeakPolarHBondContact O-CG1 3.42Å; P467-I471 PolarHBondContact O-N 3.39Å
468I96.2Very high92.3Very high88 Ų8842.6 Ų42.645%0.45123%0.232SC..Hα-helixtrans-58.6-40.8173.3-67.6169.7000110.9L63 Y464 I465 N466 I471 A472L63-I468 HydrophobicContact CD1-CG1 4.44Å; L63-I468 HydrophobicContact CD2-CG1 4.15Å; Y464-I468 WeakPolarHBondContact O-CD1 3.3Å; Y464-I468 VanDerWaalsContact O-CG1 3.22Å; Y464-I468 WeakPolarHBondContact O-CG1 3.44Å; Y464-I468 PolarHBondContact O-N 3.45Å; I465-I468 PolarHBondContact O-N 3.42Å; N466-I468 VanDerWaalsContact C-N 3.33Å; N466-I468 PolarHBondContact O-N 3.28Å; I468-I471 PolarHBondContact O-N 2.68Å; I468-A472 WeakPolarHBondContact O-CB 3.13Å; I468-A472 PolarHBondContact O-N 3.41Å
469S95.9Very high93.1Very high0 Ų040.2 Ų40.20%021%0.213CC..Hα-helixtrans-70.1-34.9178.3-62.30000112.9P410 T414 I465 N466 P467 A472 L473P410-S469 WeakPolarHBondContact CB-OG 3.37Å; P410-S469 PolarHBondContact O-OG 3.13Å; T414-S469 PolarHBondContact OG1-OG 2.96Å; I465-S469 VanDerWaalsContact O-CB 3.27Å; I465-S469 WeakPolarHBondContact O-CB 3.08Å; I465-S469 PolarHBondContact O-N 2.88Å; I465-S469 PolarHBondContact O-OG 3.34Å; N466-S469 WeakPolarHBondContact O-CB 3.24Å; N466-S469 PolarHBondContact O-N 2.86Å; N466-S469 VanDerWaalsContact O-N 3.13Å; P467-S469 VanDerWaalsContact C-N 3.26Å; P467-S469 PolarHBondContact O-N 3.47Å; S469-A472 PolarHBondContact O-N 2.7Å; S469-L473 PolarHBondContact O-N 3.48Å
470V95.7Very high93.6Very high18 Ų1836.9 Ų36.911%0.10920%0.201CC..Hα-helixtrans-66.5-42.7172.9171.60000110.9F72 L113 F411 N466 P467 L473 A474F72-V470 HydrophobicContact CE2-CG1 4.39Å; F72-V470 HydrophobicContact CZ-CG1 3.7Å; L113-V470 HydrophobicContact CD2-CG1 4.45Å; F411-V470 HydrophobicContact CD2-CG2 4.31Å; F411-V470 HydrophobicContact CE2-CG2 4.11Å; N466-V470 WeakPolarHBondContact O-CG2 3.49Å; N466-V470 PolarHBondContact O-N 2.76Å; P467-V470 PolarHBondContact O-N 3.43Å; V470-L473 WeakPolarHBondContact O-CB 3.47Å; V470-L473 PolarHBondContact O-N 3.29Å; V470-A474 PolarHBondContact O-N 2.95Å
471I96.7Very high93.9Very high20 Ų2036.5 Ų36.510%0.10319%0.191CC..Hα-helixtrans-61.9-44.1172.9-67.8160.2000110.6L63 L67 P68 I71 P467 I468 L473 A474 L475L63-I471 HydrophobicContact CD1-CD1 3.88Å; L67-I471 HydrophobicContact CD2-CD1 3.82Å; L67-I471 HydrophobicContact CG-CD1 4.17Å; P68-I471 HydrophobicContact CB-CG1 4.38Å; P68-I471 HydrophobicContact CG-CD1 4.25Å; P68-I471 HydrophobicContact CG-CG1 3.91Å; I71-I471 HydrophobicContact CD1-CG2 3.77Å; P467-I471 WeakPolarHBondContact O-CD1 3.22Å; P467-I471 VanDerWaalsContact O-CG1 3.31Å; P467-I471 WeakPolarHBondContact O-CG1 3.42Å; P467-I471 PolarHBondContact O-N 3.39Å; I468-I471 PolarHBondContact O-N 2.68Å; I471-L473 VanDerWaalsContact C-N 3.31Å; I471-L473 PolarHBondContact O-N 3.43Å; I471-A474 WeakPolarHBondContact O-CB 3.08Å; I471-A474 PolarHBondContact O-N 3.02Å; I471-A474 VanDerWaalsContact O-N 3.12Å; I471-L475 HydrophobicContact CG2-CD1 4.1Å; I471-L475 WeakPolarHBondContact O-CG 3.39Å; I471-L475 PolarHBondContact O-N 3.31Å
472A97Very high94.1Very high18 Ų1834.3 Ų34.315%0.14918%0.182CC..Hα-helixtrans-60.9-39.6177.400000111.8C407 I468 S469 L475 K476C407-A472 WeakPolarHBondContact CB-O 3.31Å; C407-A472 CarbonylContact O-C 3.58Å; C407-A472 PolarHBondContact SG-O 2.91Å; I468-A472 WeakPolarHBondContact O-CB 3.13Å; I468-A472 PolarHBondContact O-N 3.41Å; S469-A472 PolarHBondContact O-N 2.7Å; A472-L475 PolarHBondContact O-N 2.92Å; A472-K476 PolarHBondContact O-N 3.15Å; A472-K476 VanDerWaalsContact O-N 3.16Å
473L96.3Very high94.4Very high7 Ų734.5 Ų34.54%0.03718%0.176CC..Hα-helixtrans-62.1-41.5171.6-82-174.6000113L113 L150 C407 Q408 F411 S469 V470 I471 L475 K476L113-L473 HydrophobicContact CD1-CB 4.38Å; L113-L473 HydrophobicContact CD1-CD1 4.19Å; L150-L473 HydrophobicContact CD1-CD1 3.96Å; L150-L473 HydrophobicContact CD2-CD1 4.36Å; L150-L473 HydrophobicContact CD2-CD2 4.1Å; C407-L473 PolarHBondContact O-N 3.35Å; Q408-L473 HydrophobicContact CB-CD2 3.96Å; Q408-L473 HydrophobicContact CG-CD2 3.96Å; F411-L473 HydrophobicContact CB-CD1 3.88Å; F411-L473 HydrophobicContact CB-CD2 4.35Å; F411-L473 HydrophobicContact CB-CG 3.89Å; F411-L473 HydrophobicContact CD1-CD1 3.68Å; F411-L473 HydrophobicContact CD2-CD1 3.45Å; F411-L473 VanDerWaalsContact CD2-CD1 3.45Å; F411-L473 HydrophobicContact CD2-CG 4.22Å; F411-L473 HydrophobicContact CE1-CD1 4.01Å; F411-L473 HydrophobicContact CE2-CD1 3.8Å; F411-L473 HydrophobicContact CG-CD1 3.37Å; F411-L473 HydrophobicContact CG-CG 3.97Å; F411-L473 HydrophobicContact CZ-CD1 4.06Å; S469-L473 PolarHBondContact O-N 3.48Å; V470-L473 WeakPolarHBondContact O-CB 3.47Å; V470-L473 PolarHBondContact O-N 3.29Å; I471-L473 VanDerWaalsContact C-N 3.31Å; I471-L473 PolarHBondContact O-N 3.43Å; L473-L475 VanDerWaalsContact C-N 3.33Å; L473-L475 PolarHBondContact O-N 2.83Å; L473-K476 WeakPolarHBondContact O-CB 3.41Å; L473-K476 PolarHBondContact O-N 2.93Å
474A96.2Very high94.4Very high0 Ų033.8 Ų33.80%017%0.169CC..Hα-helixtrans-61.3-44.2176.200000111.3I71 F72 S75 L110 V470 I471 K476 S477I71-A474 HydrophobicContact CG2-CB 3.74Å; F72-A474 HydrophobicContact CD1-CB 3.84Å; F72-A474 HydrophobicContact CE1-CB 3.67Å; F72-A474 HydrophobicContact CZ-CB 4.48Å; S75-A474 PolarHBondContact OG-O 3.5Å; L110-A474 HydrophobicContact CD2-CB 4.39Å; V470-A474 PolarHBondContact O-N 2.95Å; I471-A474 WeakPolarHBondContact O-CB 3.08Å; I471-A474 PolarHBondContact O-N 3.02Å; I471-A474 VanDerWaalsContact O-N 3.12Å; A474-K476 PolarHBondContact O-N 3.29Å; A474-S477 PolarHBondContact O-N 3.36Å; A474-S477 PolarHBondContact O-OG 2.95Å
475L96.3Very high94.3Very high72 Ų7232.4 Ų32.438%0.37717%0.166SC..Hα-helixtrans-64.7-20.4176.7-65.6172.3000113.6I71 I471 A472 L473 S477 D478 L479I71-L475 HydrophobicContact CG2-CD2 4.16Å; I71-L475 HydrophobicContact CG2-CG 4.48Å; I471-L475 HydrophobicContact CG2-CD1 4.1Å; I471-L475 WeakPolarHBondContact O-CG 3.39Å; I471-L475 PolarHBondContact O-N 3.31Å; A472-L475 PolarHBondContact O-N 2.92Å; L473-L475 VanDerWaalsContact C-N 3.33Å; L473-L475 PolarHBondContact O-N 2.83Å; L475-S477 VanDerWaalsContact C-N 3.27Å; L475-S477 PolarHBondContact O-N 3.48Å; L475-D478 PolarHBondContact O-N 2.95Å; L475-L479 WeakPolarHBondContact O-CB 3.3Å; L475-L479 WeakPolarHBondContact O-CG 3.29Å; L475-L479 PolarHBondContact O-N 3.15Å
476K95.7Very high94.2Very high16 Ų1640 Ų407%0.0719%0.192CC..Hα-helixtrans-54.1-44.9173.4-171.1-174.4162.7-173.40111.4S153 T403 C407 A472 L473 A474 S480S153-K476 PolarHBondContact OG-NZ 3.47Å; T403-K476 HydrophobicContact CG2-CG 4.16Å; C407-K476 HydrophobicContact CB-CB 3.67Å; C407-K476 HydrophobicContact CB-CG 4.09Å; A472-K476 PolarHBondContact O-N 3.15Å; A472-K476 VanDerWaalsContact O-N 3.16Å; L473-K476 WeakPolarHBondContact O-CB 3.41Å; L473-K476 PolarHBondContact O-N 2.93Å; A474-K476 PolarHBondContact O-N 3.29Å; K476-S480 WeakPolarHBondContact O-CB 3.38Å; K476-S480 PolarHBondContact O-N 3.31Å; K476-S480 VanDerWaalsContact O-N 3.07Å; K476-S480 PolarHBondContact O-OG 2.96Å
477S93.7Very high94Very high9 Ų938.8 Ų38.86%0.06318%0.184CC..Hα-helixtrans-68.3-41.3179.96.80000112.3A474 L475 S480 F481A474-S477 PolarHBondContact O-N 3.36Å; A474-S477 PolarHBondContact O-OG 2.95Å; L475-S477 VanDerWaalsContact C-N 3.27Å; L475-S477 PolarHBondContact O-N 3.48Å; S477-S480 WeakPolarHBondContact O-CB 3.25Å; S477-S480 PolarHBondContact O-N 2.96Å; S477-F481 PolarHBondContact O-N 3.45Å
478D95.4Very high93.6Very high12 Ų1241 Ų416%0.06420%0.2CC..Hα-helixtrans-65.9-49.3179.5-65.7-32.7000111.2S75 L475 S480 F481 F482S75-D478 WeakPolarHBondContact CA-OD1 3.47Å; S75-D478 WeakPolarHBondContact CB-OD1 3.15Å; S75-D478 VanDerWaalsContact OG-CG 3.29Å; S75-D478 PolarHBondContact OG-OD1 3.45Å; S75-D478 PolarHBondContact OG-OD2 2.91Å; L475-D478 PolarHBondContact O-N 2.95Å; D478-S480 VanDerWaalsContact C-N 3.26Å; D478-S480 PolarHBondContact O-N 2.83Å; D478-F481 WeakPolarHBondContact O-CB 3.13Å; D478-F481 PolarHBondContact O-N 2.76Å; D478-F481 VanDerWaalsContact O-N 3.1Å; D478-F482 HydrophobicContact CB-CD2 4.41Å; D478-F482 HydrophobicContact CB-CE2 4.22Å; D478-F482 WeakPolarHBondContact O-CD2 3.39Å; D478-F482 PolarHBondContact O-N 3.32Å
479L95.1Very high93.4Very high63 Ų6341 Ų4133%0.3320%0.2SC..Hα-helixtrans-58.2-41.5175.3-68.3176.3000111.2T403 L475 F481 F482 F483T403-L479 HydrophobicContact CG2-CB 3.87Å; T403-L479 HydrophobicContact CG2-CD1 3.99Å; L475-L479 WeakPolarHBondContact O-CB 3.3Å; L475-L479 WeakPolarHBondContact O-CG 3.29Å; L475-L479 PolarHBondContact O-N 3.15Å; L479-F481 PolarHBondContact O-N 3.37Å; L479-F482 PolarHBondContact O-N 3.23Å; L479-F483 HydrophobicContact CB-CE2 4.03Å; L479-F483 HydrophobicContact CB-CZ 4.36Å; L479-F483 WeakPolarHBondContact O-CD2 3.34Å; L479-F483 WeakPolarHBondContact O-CG 3.36Å; L479-F483 PolarHBondContact O-N 2.97Å
480S92Very high93.1Very high18 Ų1847.9 Ų47.913%0.12623%0.226CC..Hα-helixtrans-59.7-46.6174.1-61.40000111.9K476 S477 D478 F483 Y484K476-S480 WeakPolarHBondContact O-CB 3.38Å; K476-S480 PolarHBondContact O-N 3.31Å; K476-S480 VanDerWaalsContact O-N 3.07Å; K476-S480 PolarHBondContact O-OG 2.96Å; S477-S480 WeakPolarHBondContact O-CB 3.25Å; S477-S480 PolarHBondContact O-N 2.96Å; D478-S480 VanDerWaalsContact C-N 3.26Å; D478-S480 PolarHBondContact O-N 2.83Å; S480-F483 PolarHBondContact O-N 3.23Å; S480-Y484 WeakPolarHBondContact O-CD2 3.29Å; S480-Y484 PolarHBondContact O-N 3.06Å
481F92.3Very high92.7Very high20 Ų2047.5 Ų47.59%0.08822%0.223CC..Hα-helixtrans-60.3-45174.2168.9-112.8000112.7C78 V81 T82 S477 D478 L479 F483 Y484 C485 F491 L495C78-F481 HydrophobicContact CB-CB 4.21Å; C78-F481 HydrophobicContact CB-CD1 3.85Å; C78-F481 HydrophobicContact CB-CE1 4.35Å; C78-F481 HydrophobicContact CB-CG 3.99Å; C78-F481 WeakPolarHBondContact SG-CD1 3.43Å; V81-F481 HydrophobicContact CG1-CE2 4.12Å; V81-F481 HydrophobicContact CG1-CZ 4.34Å; T82-F481 WeakPolarHBondContact OG1-CD2 3.35Å; S477-F481 PolarHBondContact O-N 3.45Å; D478-F481 WeakPolarHBondContact O-CB 3.13Å; D478-F481 PolarHBondContact O-N 2.76Å; D478-F481 VanDerWaalsContact O-N 3.1Å; L479-F481 PolarHBondContact O-N 3.37Å; F481-F483 PolarHBondContact O-N 2.96Å; F481-Y484 PolarHBondContact O-N 3.24Å; F481-C485 WeakPolarHBondContact CE2-SG 3.48Å; F481-C485 VanDerWaalsContact CZ-SG 3.53Å; F481-C485 PolarHBondContact O-N 2.92Å; F481-C485 PolarHBondContact O-SG 3.21Å; F481-F491 HydrophobicContact CD2-CE1 4.23Å; F481-F491 HydrophobicContact CD2-CZ 4.21Å; F481-F491 AromaticContact CE2-CE1 3.77Å; F481-F491 HydrophobicContact CE2-CE1 3.77Å; F481-F491 AromaticContact CE2-CZ 3.92Å; F481-F491 HydrophobicContact CE2-CZ 3.92Å; F481-L495 HydrophobicContact CZ-CD2 4.12Å
482F94.1Very high92.5Very high121 Ų12149.5 Ų49.553%0.53123%0.234SC..Hα-helixtrans-61.9-41.8177.2-74.5-61.8000111.7D478 L479 C485 W486D478-F482 HydrophobicContact CB-CD2 4.41Å; D478-F482 HydrophobicContact CB-CE2 4.22Å; D478-F482 WeakPolarHBondContact O-CD2 3.39Å; D478-F482 PolarHBondContact O-N 3.32Å; L479-F482 PolarHBondContact O-N 3.23Å; F482-C485 WeakPolarHBondContact O-CB 3.25Å; F482-C485 PolarHBondContact O-N 3.26Å; F482-W486 VanDerWaalsContact O-CB 3.26Å; F482-W486 WeakPolarHBondContact O-CB 3.47Å; F482-W486 PolarHBondContact O-N 2.92Å
483F92.5Very high92.3Very high40 Ų4053.5 Ų53.518%0.17525%0.252CS..Hα-helixtrans-65-41.1174-59.5-38.2000112.3C399 T403 L479 S480 F481 C485 W486 F487C399-F483 HydrophobicContact CB-CD1 3.98Å; C399-F483 HydrophobicContact CB-CD2 3.83Å; C399-F483 HydrophobicContact CB-CE1 3.84Å; C399-F483 HydrophobicContact CB-CE2 3.68Å; C399-F483 HydrophobicContact CB-CG 3.99Å; C399-F483 HydrophobicContact CB-CZ 3.71Å; T403-F483 VanDerWaalsContact OG1-CE2 3.3Å; T403-F483 WeakPolarHBondContact OG1-CE2 3.41Å; L479-F483 HydrophobicContact CB-CE2 4.03Å; L479-F483 HydrophobicContact CB-CZ 4.36Å; L479-F483 WeakPolarHBondContact O-CD2 3.34Å; L479-F483 WeakPolarHBondContact O-CG 3.36Å; L479-F483 PolarHBondContact O-N 2.97Å; S480-F483 PolarHBondContact O-N 3.23Å; F481-F483 PolarHBondContact O-N 2.96Å; F483-C485 VanDerWaalsContact C-N 3.32Å; F483-C485 PolarHBondContact O-N 3.23Å; F483-W486 PolarHBondContact O-N 3.35Å; F483-F487 HydrophobicContact CB-CD2 4.02Å; F483-F487 HydrophobicContact CB-CE2 4.16Å; F483-F487 HydrophobicContact CD1-CE2 4.01Å; F483-F487 HydrophobicContact CG-CE2 4.36Å; F483-F487 VanDerWaalsContact O-CD2 3.25Å; F483-F487 WeakPolarHBondContact O-CD2 3.17Å; F483-F487 PolarHBondContact O-N 2.82Å
484Y88.8Confident91.9Very high43 Ų4353.6 Ų53.617%0.16925%0.254CS..Hα-helixtrans-62.3-39.1173.7-74.5-58.4000112.1I99 S480 F481 C488I99-Y484 HydrophobicContact CD1-CE1 4.08Å; S480-Y484 WeakPolarHBondContact O-CD2 3.29Å; S480-Y484 PolarHBondContact O-N 3.06Å; F481-Y484 PolarHBondContact O-N 3.24Å; Y484-C488 WeakPolarHBondContact O-CB 3.48Å; Y484-C488 PolarHBondContact O-N 3.48Å
485C91.1Very high91.6Very high15 Ų1555.1 Ų55.110%0.10126%0.262CS..Hα-helixtrans-63.1-44.1172.8-69.10000112.7F481 F482 F483 F491F481-C485 WeakPolarHBondContact CE2-SG 3.48Å; F481-C485 VanDerWaalsContact CZ-SG 3.53Å; F481-C485 PolarHBondContact O-N 2.92Å; F481-C485 PolarHBondContact O-SG 3.21Å; F482-C485 WeakPolarHBondContact O-CB 3.25Å; F482-C485 PolarHBondContact O-N 3.26Å; F483-C485 VanDerWaalsContact C-N 3.32Å; F483-C485 PolarHBondContact O-N 3.23Å; C485-F491 VanDerWaalsContact SG-CE1 3.52Å
486W91.2Very high91.5Very high196 Ų19656.7 Ų56.774%0.74227%0.265SS*.Hα-helixtrans-74.5-45.7-173-173.6-90.5000113F482 F483F482-W486 VanDerWaalsContact O-CB 3.26Å; F482-W486 WeakPolarHBondContact O-CB 3.47Å; F482-W486 PolarHBondContact O-N 2.92Å; F483-W486 PolarHBondContact O-N 3.35Å
487F87Confident91.3Very high31 Ų3163 Ų6314%0.13629%0.293CS..Hα-helixtrans-89.4-24.8-174.2-65.5-68.5000113.9K392 I395 T396 F483K392-F487 HydrophobicContact CB-CD1 4.3Å; K392-F487 HydrophobicContact CG-CD1 4.49Å; I395-F487 HydrophobicContact CB-CE1 3.82Å; I395-F487 HydrophobicContact CB-CZ 4.06Å; I395-F487 HydrophobicContact CG2-CE1 3.6Å; I395-F487 HydrophobicContact CG2-CE2 4.46Å; I395-F487 HydrophobicContact CG2-CZ 3.41Å; I395-F487 VanDerWaalsContact CG2-CZ 3.41Å; T396-F487 HydrophobicContact CG2-CB 4.36Å; T396-F487 HydrophobicContact CG2-CD2 3.89Å; T396-F487 HydrophobicContact CG2-CG 4.34Å; T396-F487 WeakPolarHBondContact OG1-CB 3.48Å; T396-F487 WeakPolarHBondContact OG1-CD2 3.39Å; T396-F487 WeakPolarHBondContact OG1-CG 3.46Å; F483-F487 HydrophobicContact CB-CD2 4.02Å; F483-F487 HydrophobicContact CB-CE2 4.16Å; F483-F487 HydrophobicContact CD1-CE2 4.01Å; F483-F487 HydrophobicContact CG-CE2 4.36Å; F483-F487 VanDerWaalsContact O-CD2 3.25Å; F483-F487 WeakPolarHBondContact O-CD2 3.17Å; F483-F487 PolarHBondContact O-N 2.82Å
488C87.4Confident91.1Very high55 Ų5564 Ų6437%0.37230%0.297SS..  trans-100.987.8178.4-167.90000110.7Y484 R490 F491 L492Y484-C488 WeakPolarHBondContact O-CB 3.48Å; Y484-C488 PolarHBondContact O-N 3.48Å; C488-R490 CarbonylContact O-C 3.58Å; C488-R490 PolarHBondContact O-N 3.08Å; C488-F491 HydrophobicContact CB-CB 3.67Å; C488-F491 WeakPolarHBondContact O-CA 3.45Å; C488-F491 WeakPolarHBondContact O-CB 3.3Å; C488-F491 PolarHBondContact O-N 3.44Å; C488-F491 PolarHBondContact SG-N 2.75Å; C488-F491 VanDerWaalsContact SG-N 3.42Å; C488-L492 PolarHBondContact O-N 3.15Å
489D91.1Very high90.9Very high87 Ų8766.5 Ų66.547%0.46531%0.313SS..Hα-helixtrans-49.4-36.7175.4-54-35.2000111.7K392 L492 L493K392-D489 IonicContact NZ-OD1 2.72Å; K392-D489 PolarHBondContact NZ-OD1 2.97Å; K392-D489 IonicContact NZ-OD2 2.69Å; K392-D489 PolarHBondContact NZ-OD2 3.06Å; D489-L492 PolarHBondContact O-N 3.32Å; D489-L493 VanDerWaalsContact O-CG 3.3Å; D489-L493 WeakPolarHBondContact O-CG 3.26Å; D489-L493 PolarHBondContact O-N 3.39Å
490R88.9Confident90.7Very high144 Ų14471.2 Ų71.254%0.54333%0.326SS..Hα-helixtrans-61.7-50.5173.2-61.1-174.4-174-1610.8110.8R89 C488 L492 L493 A494R89-R490 PolarHBondContact NH1-O 3.03Å; R89-R490 PolarHBondContact NH2-O 3.04Å; C488-R490 CarbonylContact O-C 3.58Å; C488-R490 PolarHBondContact O-N 3.08Å; R490-L492 VanDerWaalsContact C-N 3.34Å; R490-L492 PolarHBondContact O-N 3.26Å; R490-L493 PolarHBondContact O-N 3.4Å; R490-L493 VanDerWaalsContact O-N 3.15Å; R490-A494 PolarHBondContact O-N 3.24Å
491F88.6Confident90.5Very high11 Ų1177.3 Ų77.35%0.04835%0.353CS..Hα-helixtrans-56.6-48178-174.4-84.8000111.1T82 A85 V86 F481 C485 C488 L493 A494 L495T82-F491 HydrophobicContact CG2-CE2 4.03Å; T82-F491 HydrophobicContact CG2-CZ 4.22Å; A85-F491 HydrophobicContact CB-CD2 4.19Å; A85-F491 HydrophobicContact CB-CE2 3.59Å; A85-F491 HydrophobicContact CB-CZ 3.91Å; V86-F491 HydrophobicContact CG2-CD2 4.4Å; V86-F491 HydrophobicContact CG2-CE2 4.15Å; F481-F491 HydrophobicContact CD2-CE1 4.23Å; F481-F491 HydrophobicContact CD2-CZ 4.21Å; F481-F491 AromaticContact CE2-CE1 3.77Å; F481-F491 HydrophobicContact CE2-CE1 3.77Å; F481-F491 AromaticContact CE2-CZ 3.92Å; F481-F491 HydrophobicContact CE2-CZ 3.92Å; C485-F491 VanDerWaalsContact SG-CE1 3.52Å; C488-F491 HydrophobicContact CB-CB 3.67Å; C488-F491 WeakPolarHBondContact O-CA 3.45Å; C488-F491 WeakPolarHBondContact O-CB 3.3Å; C488-F491 PolarHBondContact O-N 3.44Å; C488-F491 PolarHBondContact SG-N 2.75Å; C488-F491 VanDerWaalsContact SG-N 3.42Å; F491-L493 VanDerWaalsContact C-N 3.27Å; F491-L493 PolarHBondContact O-N 3.37Å; F491-A494 WeakPolarHBondContact O-CA 3.44Å; F491-A494 WeakPolarHBondContact O-CB 3.5Å; F491-A494 PolarHBondContact O-N 3.04Å; F491-L495 PolarHBondContact O-N 2.76Å
492L91.7Very high90Very high61 Ų6183.9 Ų83.932%0.31938%0.381SS..Hα-helixtrans-56.3-40.3175.6-169.172000112.4C488 D489 R490 A494 L495 K496C488-L492 PolarHBondContact O-N 3.15Å; D489-L492 PolarHBondContact O-N 3.32Å; R490-L492 VanDerWaalsContact C-N 3.34Å; R490-L492 PolarHBondContact O-N 3.26Å; L492-A494 VanDerWaalsContact C-N 3.35Å; L492-A494 PolarHBondContact O-N 3.28Å; L492-L495 PolarHBondContact O-N 3Å; L492-K496 HydrophobicContact CG-CD 4.41Å; L492-K496 WeakPolarHBondContact O-CB 3.29Å; L492-K496 WeakPolarHBondContact O-CG 3.17Å; L492-K496 PolarHBondContact O-N 3.21Å
493L92.3Very high89.2Confident103 Ų10383.1 Ų83.154%0.53939%0.389SS..Hα-helixtrans-68-28.4174.5-72.3169.4000113.7D489 R490 F491 K497D489-L493 VanDerWaalsContact O-CG 3.3Å; D489-L493 WeakPolarHBondContact O-CG 3.26Å; D489-L493 PolarHBondContact O-N 3.39Å; R490-L493 PolarHBondContact O-N 3.4Å; R490-L493 VanDerWaalsContact O-N 3.15Å; F491-L493 VanDerWaalsContact C-N 3.27Å; F491-L493 PolarHBondContact O-N 3.37Å; L493-K497 WeakPolarHBondContact O-CB 3.37Å; L493-K497 PolarHBondContact O-N 3.41Å
494A89.1Confident88.1Confident8 Ų888.6 Ų88.67%0.06641%0.409CS..Hα-helixtrans-71.5-48170.700000110.4A85 R89 R490 F491 L492 K496 K497 I498A85-A494 HydrophobicContact CB-CB 4.44Å; R89-A494 VanDerWaalsContact NH1-CB 3.33Å; R89-A494 VanDerWaalsContact NH2-N 3.18Å; R490-A494 PolarHBondContact O-N 3.24Å; F491-A494 WeakPolarHBondContact O-CA 3.44Å; F491-A494 WeakPolarHBondContact O-CB 3.5Å; F491-A494 PolarHBondContact O-N 3.04Å; L492-A494 VanDerWaalsContact C-N 3.35Å; L492-A494 PolarHBondContact O-N 3.28Å; A494-K496 VanDerWaalsContact C-N 3.32Å; A494-K496 PolarHBondContact O-N 3.5Å; A494-K497 CarbonylContact O-C 3.32Å; A494-K497 WeakPolarHBondContact O-CA 3.25Å; A494-K497 WeakPolarHBondContact O-CB 3.5Å; A494-K497 PolarHBondContact O-N 2.85Å; A494-I498 WeakPolarHBondContact O-CG1 3.42Å; A494-I498 PolarHBondContact O-N 3.07Å
495L90.4Very high87.1Confident33 Ų3390 Ų9017%0.17342%0.424CS..Hα-helixtrans-55.9-49.3177-172.461.7000110.4V81 F481 F491 L492 K497 I498 T499V81-L495 HydrophobicContact CG1-CD1 3.43Å; V81-L495 VanDerWaalsContact CG1-CD1 3.43Å; F481-L495 HydrophobicContact CZ-CD2 4.12Å; F491-L495 PolarHBondContact O-N 2.76Å; L492-L495 PolarHBondContact O-N 3Å; L495-K497 PolarHBondContact O-N 3.31Å; L495-I498 PolarHBondContact O-N 2.83Å; L495-I498 VanDerWaalsContact O-N 3.14Å; L495-T499 HydrophobicContact CD1-CG2 4.36Å; L495-T499 HydrophobicContact CG-CG2 4.48Å; L495-T499 WeakPolarHBondContact O-CG2 3.42Å; L495-T499 PolarHBondContact O-N 3Å; L495-T499 PolarHBondContact O-OG1 3.33Å; L495-T499 VanDerWaalsContact O-OG1 3.08Å
496K93.3Very high85.9Confident104 Ų10498.3 Ų98.345%0.45246%0.458SS..Hα-helixtrans-61.2-19.5172.8-73.7-178.9177.3-176.10114.5L492 A494 R500L492-K496 HydrophobicContact CG-CD 4.41Å; L492-K496 WeakPolarHBondContact O-CB 3.29Å; L492-K496 WeakPolarHBondContact O-CG 3.17Å; L492-K496 PolarHBondContact O-N 3.21Å; A494-K496 VanDerWaalsContact C-N 3.32Å; A494-K496 PolarHBondContact O-N 3.5Å; K496-R500 WeakPolarHBondContact O-CB 3.34Å; K496-R500 WeakPolarHBondContact O-CG 3.38Å; K496-R500 PolarHBondContact O-NE 3.04Å
497K92Very high84.6Confident150 Ų15096.2 Ų96.265%0.65246%0.46SS*.Hα-helixtrans-84.9-43.2172.5-173-179.6178.6-176.60110.6L493 A494 L495 H501L493-K497 WeakPolarHBondContact O-CB 3.37Å; L493-K497 PolarHBondContact O-N 3.41Å; A494-K497 CarbonylContact O-C 3.32Å; A494-K497 WeakPolarHBondContact O-CA 3.25Å; A494-K497 WeakPolarHBondContact O-CB 3.5Å; A494-K497 PolarHBondContact O-N 2.85Å; L495-K497 PolarHBondContact O-N 3.31Å; K497-H501 WeakPolarHBondContact O-CB 3.31Å; K497-H501 PolarHBondContact O-N 3.32Å
498I89.2Confident83.4Confident29 Ų29101.5 Ų101.515%0.14948%0.483CS..Hα-helixtrans-64-48.3178.4-65.8164.9000110.6I84 A85 A494 L495 H501 K502I84-I498 HydrophobicContact CG2-CD1 4.35Å; A85-I498 HydrophobicContact CB-CD1 4Å; A494-I498 WeakPolarHBondContact O-CG1 3.42Å; A494-I498 PolarHBondContact O-N 3.07Å; L495-I498 PolarHBondContact O-N 2.83Å; L495-I498 VanDerWaalsContact O-N 3.14Å; I498-H501 PolarHBondContact O-N 3.33Å; I498-K502 HydrophobicContact CG2-CD 4.49Å; I498-K502 PolarHBondContact O-N 3.45Å
499T89.9Confident82.1Confident65 Ų65108.8 Ų108.840%0.39950%0.503SS..Hα-helixtrans-63.4-44.8179.156.40000111.7L495 H501 K502 C503L495-T499 HydrophobicContact CD1-CG2 4.36Å; L495-T499 HydrophobicContact CG-CG2 4.48Å; L495-T499 WeakPolarHBondContact O-CG2 3.42Å; L495-T499 PolarHBondContact O-N 3Å; L495-T499 PolarHBondContact O-OG1 3.33Å; L495-T499 VanDerWaalsContact O-OG1 3.08Å; T499-H501 VanDerWaalsContact C-N 3.32Å; T499-H501 PolarHBondContact O-N 3.23Å; T499-K502 PolarHBondContact O-N 3.37Å; T499-C503 WeakPolarHBondContact O-CB 3.33Å; T499-C503 PolarHBondContact O-N 3.48Å
500R92.5Very high80.7Confident161 Ų161112.6 Ų112.661%0.60852%0.518SS*.Hα-helixtrans-59.8-39.4173.8-80.7-173-77.2-179.5-4.9112.8K496 W504K496-R500 WeakPolarHBondContact O-CB 3.34Å; K496-R500 WeakPolarHBondContact O-CG 3.38Å; K496-R500 PolarHBondContact O-NE 3.04Å; R500-W504 WeakPolarHBondContact O-CB 3.03Å
501H86.9Confident79.3Confident146 Ų146112.6 Ų112.668%0.67653%0.528SS*.Hα-helixtrans-81.8-25.6-177.3-157.5-61.4000114.1K497 I498 T499 P505K497-H501 WeakPolarHBondContact O-CB 3.31Å; K497-H501 PolarHBondContact O-N 3.32Å; I498-H501 PolarHBondContact O-N 3.33Å; T499-H501 VanDerWaalsContact C-N 3.32Å; T499-H501 PolarHBondContact O-N 3.23Å; H501-P505 WeakPolarHBondContact O-CD 3.39Å; H501-P505 WeakPolarHBondContact O-CG 3.16Å
502K82.2Confident77.8Confident159 Ų159118.8 Ų118.869%0.69156%0.556SS**Hα-helixtrans-91.2-40.2177.4-79-167.4171.5-170.90113.8I498 T499 P505I498-K502 HydrophobicContact CG2-CD 4.49Å; I498-K502 PolarHBondContact O-N 3.45Å; T499-K502 PolarHBondContact O-N 3.37Å; K502-P505 WeakPolarHBondContact O-CD 3.42Å
503C76.1Confident76.2Confident104 Ų104125.8 Ų125.870%0.70358%0.579SS**Hα-helixtrans-86-28.7-174-59.30000113.4T499T499-C503 WeakPolarHBondContact O-CB 3.33Å; T499-C503 PolarHBondContact O-N 3.48Å
504W69.8Low74.6Confident156 Ų156128.8 Ų128.859%0.59160%0.596SS**SBendtrans-85.8-27.8-174.2-146.5-72.3000117.9R500 K506 L507R500-W504 WeakPolarHBondContact O-CB 3.03Å; W504-K506 VanDerWaalsContact C-N 3.34Å; W504-K506 PolarHBondContact O-N 2.73Å; W504-L507 PolarHBondContact O-N 3.38Å
505P68.2Low73.2Confident72 Ų72137.6 Ų137.647%0.46863%0.633SS.*THydrogen-bonded Turntrans-71.4-19.5-160.628.8-36.9000115.5H501 K502H501-P505 WeakPolarHBondContact O-CD 3.39Å; H501-P505 WeakPolarHBondContact O-CG 3.16Å; K502-P505 WeakPolarHBondContact O-CD 3.42Å
506K65.9Low71.6Confident189 Ų189142.7 Ų142.782%0.82266%0.656SS**THydrogen-bonded Turntrans-93.1-35.3177.4-86.5-171.3170.8-174.30114.2W504 K508W504-K506 VanDerWaalsContact C-N 3.34Å; W504-K506 PolarHBondContact O-N 2.73Å; K506-K508 VanDerWaalsContact C-N 3.3Å; K506-K508 PolarHBondContact O-N 3.26Å
507L63.4Low69.9Low152 Ų152146.6 Ų146.680%0.79668%0.675SS**THydrogen-bonded Turntrans-70.9-23.5-172-154.771.6000113.6W504W504-L507 PolarHBondContact O-N 3.38Å
508K62Low68.3Low142 Ų142148.2 Ų148.262%0.61769%0.685SS**THydrogen-bonded Turntrans-86.1-2.8-178.2-109.7-164.9-177-171.80116.3K506K506-K508 VanDerWaalsContact C-N 3.3Å; K506-K508 PolarHBondContact O-N 3.26Å
509R60.9Low66.8Low208 Ų208155.1 Ų155.179%0.78572%0.716SS**SBendtrans-93.4-20.9-176.4-76.8-167.3-171.5167.84.7116.2
510H61.8Low65.1Low167 Ų167160.8 Ų160.877%0.77374%0.737SS**SBendtrans-100.9-21.5-174.1-84.2-81.8000116.1
511N58.9Low63.4Low144 Ų144162.4 Ų162.477%0.7775%0.752SS**SBendtrans-108.514.3-174.2-82.511.8000116
512F57.3Low61.9Low142 Ų142165.8 Ų165.862%0.62376%0.758SS**SBendtrans-118.60.9-179.9-125.5-95000115.8H516F512-H516 AromaticContact CE1-CD2 3.74Å
513Y58.2Low60.5Low208 Ų208166 Ų16682%0.81676%0.762SS**SBendtrans-92.2-18.5178.3-105.9-85000114.8
514N59.6Low59.1Low165 Ų165171.3 Ų171.388%0.88277%0.767SS**SBendtrans-106.20.2-175.4-87.85.7000116.1
515F58.8Low58.3Low193 Ų193171.7 Ų171.785%0.84678%0.775SS**SBendtrans-113.3-3.7-175.6-144.5-96.6000115.4
516H56.3Low57.8Low141 Ų141176.4 Ų176.465%0.65380%0.795SS**SBendtrans-105.10.8-170.1-127.1-64.2000116F512F512-H516 AromaticContact CE1-CD2 3.74Å
517H57.4Low57.1Low186 Ų186174.8 Ų174.886%0.86179%0.79SS**SBendtrans-94.1-0.8-169.9-128.5-59.9000116.1
518H58.1Low56.3Low183 Ų183173.6 Ų173.685%0.84779%0.785SS**SBendtrans-121.40.5-164.7-123.3-34.4000118.4
519H58Low55.9Low175 Ų175175.2 Ų175.281%0.8179%0.794SS**SBendtrans-130.911-160.4-123.8-65000120.7
520H54Low55.3Low183 Ų183172.1 Ų172.185%0.84779%0.788SS**  trans-121.429.5-174.2-110.9-61.9000117.8
521H57.9Low54.8Low196 Ų196173 Ų17391%0.90779%0.792SS**  trans-97.313-179.2-130.9-58.7000116.2
522R54Low54.2Low217 Ų217172.7 Ų172.782%0.81979%0.786SS**  trans-125.3136.8-171.4-123.7-178-178.2172.40.2114.4
523H53.2Low53.8Low164 Ų164177.1 Ų177.176%0.75980%0.8SS**  trans73.784.1169.1-61.1-70.8000119.6
524R47.5Very low53.2Low215 Ų215173.5 Ų173.581%0.81179%0.79SS**  trans-75167.5137.1-72.9-179.9170.7171.2-2.4110.4
525H52Low52.6Low163 Ų163176.8 Ų176.876%0.75579%0.79SS**  trans74.7107.5164.2-62.1-78.9000119.2
526L59.6Low52Low171 Ų171174.7 Ų174.790%0.89578%0.783SS**  trans16993.4138.5-102.4135.6000106.1
527H50.2Low51.4Low156 Ų156172.6 Ų172.672%0.72278%0.783SS**  62.2117.373.8-126.5-73.3000114.8
528N46.3Very low51Low127 Ų127174.6 Ų174.668%0.67979%0.785SS**  trans30126.3161.9-62.4-5.4000120.7
529H54.4Low50.5Low176 Ų176173.3 Ų173.382%0.81578%0.779SS**  -165161.1108.9-113.1-81.6000114.2
530H47.6Very low49.7Very low143 Ų143173.4 Ų173.466%0.66278%0.777SS**  trans-52.6153.3179.8-68.6-68000116.4
531H51.6Low49.3Very low184 Ų184170 Ų17085%0.85277%0.773SS**  -16714897.9-108.3-83.2000115.2
532H45.5Very low48.5Very low138 Ų138166 Ų16664%0.63977%0.767SS**  trans-65.8157176.1-85.2-117.2000113.7
533Y50.6Low48.2Very low235 Ų235160.3 Ų160.392%0.92276%0.761SS**  -157.4150.3118.5-120.4-82.4000113.7
534H45.3Very low47.8Very low132 Ų132161 Ų16161%0.61176%0.764SS**  trans-82150.2-168.5-95.8-124.4000116.1
535R45.8Very low47.7Very low234 Ų234155.8 Ų155.888%0.88376%0.758SS**  -174.3124.6109.8-104.8177.4173.3-176.4-1.5115.1
536H46.3Very low47.5Very low149 Ų149156.6 Ų156.669%0.6976%0.761SS**  trans14.6150.3136.2-65.2-86.6000120.8
537C43.6Very low46.7Very low98 Ų98155 Ų15566%0.66275%0.753SS**  cis-173.7139.3-13.5-114.10000107.6
538Y49.1Very low46.3Very low228 Ų228154.1 Ų154.189%0.89475%0.749SS**  172.4130.8123.3-106.5-81.4000112.3
539Q47.8Very low46.1Very low156 Ų156156 Ų15673%0.72975%0.751SS**  trans-72176173.4-68.3158.4-57.500111.2
540K42.5Very low45.5Very low176 Ų176155.2 Ų155.277%0.76575%0.752SS**  cis-163.2147.55.4-130.4161178.6179.50104.8
541C44.1Very low45.1Very low112 Ų112154 Ų15476%0.75776%0.755SS**  -169.4139.869.2-81.10000107.3
542S42.9Very low44.6Very low112 Ų112154.4 Ų154.478%0.78375%0.754SS**  57.2121.676-156.50000112.5
543S46.9Very low44.1Very low98 Ų98152 Ų15269%0.68575%0.753SS**  cis-159.2177.727.352.80000114.9
544H44.2Very low43.8Very low178 Ų178148.7 Ų148.782%0.82475%0.746SS**  trans85.3113.3165.2-85.6-73.3000122.7
545P45Very low43.6Very low106 Ų106149.8 Ų149.869%0.68875%0.751SS**  trans-118.8156.2166.840.4-29.8000114.5
546H48.1Very low43.3Very low180 Ų180144.6 Ų144.683%0.83374%0.741SS**  trans166.3153.7156.1-98.6-68.4000107.2
547L42.7Very low43Very low137 Ų137145.8 Ų145.872%0.71775%0.747SS**  cis-148.9154.72.7-158.8136.7000110.9
548Q41.5Very low42.7Very low138 Ų138149.4 Ų149.465%0.64575%0.754SS**  trans-32.6154.6179.7-63.5177.82.200123.5
549K42.5Very low42Very low165 Ų165147.3 Ų147.372%0.71775%0.749SS**  trans54135.2133.8-65168.7-176.2169.30119.3
550L41.3Very low41.6Very low161 Ų161146.7 Ų146.784%0.84375%0.751SS**  -160.116661.4-120.2119.1000114
551T40.1Very low41.2Very low116 Ų116145.7 Ų145.771%0.71275%0.753SS**  trans-111.6174.7-171.445.20000114
552K40.6Very low41.1Very low194 Ų194148.3 Ų148.384%0.84376%0.757SS**  trans96.3154164.1-59.4177179.4-178.60116.1
553S35.9Very low40.6Very low88 Ų88151.2 Ų151.262%0.61576%0.759SS**  cis-173.1-178.4-26.856.30000109.2
554H44.6Very low40Very low164 Ų164153.4 Ų153.476%0.75976%0.762SS**  trans71.8127.1178.8-65.4-82000116.7
555Q40.9Very low39.8Very low155 Ų155151.9 Ų151.972%0.72476%0.76SS**  cis101.6119.312.7-161.2-176.113.500115.9
556N38Very low39.6Very low125 Ų125155.3 Ų155.367%0.66877%0.769SS**  trans82.9136.1153.9-86.718.4000123.9
557E40.8Very low39.3Very low174 Ų174152.4 Ų152.481%0.81377%0.766SS**  trans111.9149.4131.5-90.8169.7170.300123.9
558Q37.1Very low39.3Very low175 Ų175150.7 Ų150.782%0.81877%0.765SS**  trans-97.1157.9-146.8-60.9175.6-3.900114.4
559K35Very low39.4Very low183 Ų183150 Ų15080%0.79678%0.775SS**  trans12.7122.3143.4-78.5-177.8160.6-168.60119.2
560N39.6Very low39.8Very low143 Ų143145.8 Ų145.877%0.76578%0.779SS**  -178.4123.8109.5-84.4-26000108.1
561I33.7Very low39.9Very low156 Ų156143.2 Ų143.280%0.878%0.775SS**  31.2105.3103.4-42.9-179.7000114.6
562I41.9Very low40.1Very low167 Ų167145.5 Ų145.586%0.85678%0.782SS**  -178.1158.2126.8-91.8158.5000109.2
563E32.6Very low40.1Very low173 Ų173141.4 Ų141.481%0.80878%0.775SS**  trans-80.1174.1-168.3-59.9174.2116.800116.4
564L34.5Very low40.4Very low144 Ų144142 Ų14275%0.75479%0.785SS**  trans104.5127.9147.6-71.8156.7000121.2
565N40.2Very low40.2Very low146 Ų146141.2 Ų141.278%0.78178%0.782SS**  trans83.6113150.1-60.4-17.7000121.8
566M39.3Very low40.1Very low178 Ų178143.5 Ų143.588%0.87779%0.785SS**  trans-84.1-179.2156.6-61.4-175.6173.300111
567P42.6Very low40Very low118 Ų118149.3 Ų149.377%0.76680%0.798SS**  -146.3154.289.437.9-21.4000117.6
568S41.6Very low39.8Very low102 Ų102147.8 Ų147.871%0.71380%0.795SS**  trans33.4142.1145.5680000122.1
569S44.8Very low39.8Very low122 Ų122145 Ų14585%0.85379%0.792SS**  -172.7158.455.245.10000113
570G49.7Very low39.7Very low77 Ų77144.1 Ų144.179%0.79479%0.79SS**  trans145.798.8170.900000117
571S44.7Very low39.5Very low108 Ų108146.2 Ų146.276%0.75580%0.795SS**  trans-33.2131.4172.845.50000118.1
572L43.1Very low39.6Very low164 Ų164147.2 Ų147.286%0.85980%0.796SS**  77.8149.265.1-76.2170.9000115.3
573P40.9Very low39.5Very low108 Ų108150.5 Ų150.570%0.70180%0.799SS**  cis-139.5165.6-14.938.9-21.2000117.6
574A42.5Very low39.7Very low100 Ų100150.6 Ų150.683%0.82680%0.797SS**  trans54.3147152.900000120.7
575E40.3Very low40.2Very low148 Ų148151.1 Ų151.169%0.69280%0.8SS**  cis-152.7172.131.1-158.7-179.4149.400112.6
576Y38.8Very low40.2Very low202 Ų202148.4 Ų148.479%0.79281%0.807SS**  trans77105.1176.6-64.5-81.1000119.6
577R36.4Very low40.4Very low247 Ų247142.8 Ų142.893%0.93279%0.794SS**  trans-100.5143.3166.2-86.5-179.2169.4172.5-2.8111.8
578L36.2Very low40.6Very low143 Ų143144.5 Ų144.575%0.74979%0.792SS**  trans6.7150.1149.9-118.476000121
579P37.4Very low40.6Very low116 Ų116150.4 Ų150.475%0.75380%0.801SS**  -139.1168.390.839.4-27.9000117.1
580H32.8Very low40.4Very low165 Ų165153.6 Ų153.676%0.76480%0.795SS**  trans-44.6142.9175.7-65.4-105000115.7
581H36.6Very low40.1Very low186 Ų186157.7 Ų157.786%0.86179%0.794SS**  trans-140.8134.3154.6-102.1-79.8000113.4
582H35.3Very low39.9Very low178 Ų178162.5 Ų162.582%0.82480%0.797SS**  trans-60.6130.9172.2-91.4-93.6000112
583Y39Very low39.7Very low235 Ų235165 Ų16592%0.92280%0.795SS**  trans-88.2110.2154.7-101-91000109.8
584K37.6Very low39.9Very low175 Ų175166.7 Ų166.776%0.76180%0.796SS**  trans-113.3152.1166.5-130.5176.5-177.6177.80107.6
585D44.8Very low40Very low155 Ų155167.7 Ų167.783%0.82979%0.794SS**  trans6579.4179.3-61.4-13000116.5G587D585-G587 PolarHBondContact O-N 3.33Å
586G39.7Very low40.6Very low89 Ų89167 Ų16792%0.91880%0.8SS**  trans-72.111016600000112.4
587G44.7Very low41.2Very low60 Ų60164.6 Ų164.662%0.61980%0.801SS**  trans-96.6113.4162.500000110.7D585 Y589D585-G587 PolarHBondContact O-N 3.33Å; G587-Y589 PolarHBondContact O-N 3.42Å
588E45.9Very low41.4Very low154 Ų154162.1 Ų162.172%0.7280%0.802SS**  trans-69.4114.7176.1-67.5-173.2163.500111.2
589Y40.9Very low42.1Very low227 Ų227161.2 Ų161.289%0.8980%0.802SS**  trans-92.9119.7165.8-78.6-91.8000110G587 Q591G587-Y589 PolarHBondContact O-N 3.42Å; Y589-Q591 PolarHBondContact O-N 3.38Å
590Y40.9Very low42.9Very low189 Ų189161.9 Ų161.974%0.74181%0.805SS**  trans-72.397.4170.8-69.1-73.9000110.8Y592Y590-Y592 PolarHBondContact O-N 3.44Å
591Q44Very low43.3Very low162 Ų162161.7 Ų161.776%0.75781%0.809SS**  trans-81.9100.9169.5-171.7176.911.100110Y589 R593Y589-Q591 PolarHBondContact O-N 3.38Å; Q591-R593 PolarHBondContact O-N 3.48Å
592Y39.4Very low44Very low209 Ų209161.4 Ų161.482%0.8281%0.808SS**  trans-72.5110.7167.1-76.6-94.4000109.3Y590Y590-Y592 PolarHBondContact O-N 3.44Å
593R39.7Very low44.3Very low217 Ų217161.7 Ų161.782%0.81981%0.81SS**PPolyproline II helixtrans-83.4118.3160.7-73.3-169.4-173.9-166.62.7108.4Q591Q591-R593 PolarHBondContact O-N 3.48Å
594I45.1Very low45Very low143 Ų143159.4 Ų159.473%0.73380%0.804SS**PPolyproline II helixtrans-87.8125.6160.6-60170.7000105.8V596I594-V596 PolarHBondContact O-N 3.37Å
595P44.2Very low45.7Very low121 Ų121158 Ų15879%0.78680%0.804SS**PPolyproline II helixtrans-68.5129.7169.229.3-31.7000108.9
596V53.8Low46.3Very low133 Ų133156.2 Ų156.281%0.80679%0.793SS**  trans-114.3136.9167.5-179.40000106.4I594I594-V596 PolarHBondContact O-N 3.37Å
597D51.6Low47.2Very low153 Ų153161.1 Ų161.182%0.81879%0.789SS**  trans-64.4155.6-168.4-66.2-59.7000114.4V599D597-V599 PolarHBondContact O-N 3.08Å
598M40.6Very low47.6Very low194 Ų194168.2 Ų168.296%0.95680%0.799SS**SBendtrans-75.779.6-171.6-72.1-173.3154.600113.6
599V49.8Very low48.5Very low124 Ų124170.4 Ų170.475%0.75281%0.805SS**  trans-141.1130.2156.4-163.10000110.4D597D597-V599 PolarHBondContact O-N 3.08Å
600T55Low49.4Very low131 Ų131168.7 Ų168.780%0.80480%0.803SS**  trans76.7118.5-178.673.70000118.3Q602T600-Q602 PolarHBondContact O-N 2.73Å
601N40.6Very low50.4Low161 Ų161165.1 Ų165.186%0.86180%0.802SS**  trans-8281.4174.4-88.4-34.1000111.9
602Q52.3Low51.4Low179 Ų179161.4 Ų161.484%0.83680%0.8SS**  trans-140.8109.5161.8-72.8-161.8-1.800112.7T600 K604T600-Q602 PolarHBondContact O-N 2.73Å; Q602-K604 PolarHBondContact O-N 3.07Å
603H40.9Very low52.6Low185 Ų185157.3 Ų157.386%0.85680%0.799SS**  trans-84.690.1175.7-79.367.2000111.5I605H603-I605 PolarHBondContact O-N 3.15Å
604K53.4Low53.6Low187 Ų187154.1 Ų154.181%0.81380%0.797SS**  trans-83.8104.5174.1-166.5170-174172.10111.4Q602 I606Q602-K604 PolarHBondContact O-N 3.07Å; K604-I606 PolarHBondContact O-N 3.19Å; K604-I606 VanDerWaalsContact O-N 3.12Å
605I52.9Low54.5Low146 Ų146152.8 Ų152.875%0.74980%0.798SS**  trans-72.8101.9176.8-57.4174.9000110.1H603 K607H603-I605 PolarHBondContact O-N 3.15Å; I605-K607 HydrophobicContact CG2-CG 4.29Å; I605-K607 PolarHBondContact O-N 3.34Å
606I57.1Low54.8Low116 Ų116155.9 Ų155.960%0.59580%0.799SS**  trans-84.9100.5172.1-58.1178.3000109.3K604 Y608K604-I606 PolarHBondContact O-N 3.19Å; K604-I606 VanDerWaalsContact O-N 3.12Å; I606-Y608 HydrophobicContact CG2-CD2 4.27Å; I606-Y608 HydrophobicContact CG2-CE2 3.9Å; I606-Y608 PolarHBondContact O-N 3.44Å
607K59.1Low54.5Low192 Ų192156.9 Ų156.984%0.83580%0.8SS**  trans-76105170.7-71.7-177.8179.6175.90110I605 K609I605-K607 HydrophobicContact CG2-CG 4.29Å; I605-K607 PolarHBondContact O-N 3.34Å; K607-K609 PolarHBondContact O-N 3.3Å; K607-K609 VanDerWaalsContact O-N 3.15Å
608Y52.4Low54.6Low210 Ų210156.8 Ų156.882%0.82480%0.799SS**  trans-71.5105168.3-72.7-84.5000110.4I606 K610I606-Y608 HydrophobicContact CG2-CD2 4.27Å; I606-Y608 HydrophobicContact CG2-CE2 3.9Å; I606-Y608 PolarHBondContact O-N 3.44Å; Y608-K610 PolarHBondContact O-N 2.97Å
609K64Low55.2Low199 Ų199152.2 Ų152.287%0.86579%0.786SS**PPolyproline II helixtrans-69.5119.7169.4-169.3174.5-176.9178.60108.2K607K607-K609 PolarHBondContact O-N 3.3Å; K607-K609 VanDerWaalsContact O-N 3.15Å
610K60.6Low54.9Low192 Ų192155.7 Ų155.784%0.83579%0.791SS**PPolyproline II helixtrans-53.6127.7173.2-175.3179.1-179.6-179.30108.4Y608 A612Y608-K610 PolarHBondContact O-N 2.97Å; K610-A612 PolarHBondContact O-N 3.48Å
611P63.1Low54.5Low113 Ų113157.5 Ų157.573%0.73479%0.79SS**PPolyproline II helixtrans-59.4134.8177.924-32.8000109.2
612A64.8Low54.9Low85 Ų85156 Ų15670%0.70278%0.782SS**PPolyproline II helixtrans-61.1142.3173.600000109.1K610 L614K610-A612 PolarHBondContact O-N 3.48Å; A612-L614 PolarHBondContact O-N 3.06Å
613P63.9Low54.5Low122 Ų122157.3 Ų157.379%0.79279%0.785SS**PPolyproline II helixtrans-59.9127.3172.525.8-32.7000109.2
614L60.9Low54.9Low150 Ų150157.9 Ų157.979%0.78579%0.79SS**PPolyproline II helixtrans-56.5132.1174.5-83.7156.7000109.8A612 F616A612-L614 PolarHBondContact O-N 3.06Å; L614-F616 PolarHBondContact O-N 3.3Å
615P64.2Low54.5Low116 Ų116158.9 Ų158.975%0.75380%0.795SS**  trans-69106.6174.727.9-32.6000109.3N617P615-N617 VanDerWaalsContact C-N 3.26Å; P615-N617 PolarHBondContact O-N 3.48Å
616F49.3Very low54.5Low185 Ų185162 Ų16281%0.81180%0.803SS**  trans-70.786.9168.2-99.8-84.8000109.4L614 L618L614-F616 PolarHBondContact O-N 3.3Å; F616-L618 HydrophobicContact CD1-CD1 4.46Å; F616-L618 PolarHBondContact O-N 3.44Å
617N48.7Very low53.9Low154 Ų154165.9 Ų165.982%0.82482%0.815SS**  trans-77.885.8176.1-155.5-6.7000109.1P615 S619P615-N617 VanDerWaalsContact C-N 3.26Å; P615-N617 PolarHBondContact O-N 3.48Å; N617-S619 VanDerWaalsContact C-N 3.33Å; N617-S619 PolarHBondContact O-N 3.09Å
618L53.5Low53.4Low152 Ų152162 Ų16280%0.79681%0.813SS**  trans-76.285.1178.4-117.3111000110.1F616 K620F616-L618 HydrophobicContact CD1-CD1 4.46Å; F616-L618 PolarHBondContact O-N 3.44Å; L618-K620 PolarHBondContact O-N 3.39Å
619S51.8Low53.1Low98 Ų98158.2 Ų158.269%0.68581%0.811SS**  trans-58.5128.4172-178.70000111.3N617 H621N617-S619 VanDerWaalsContact C-N 3.33Å; N617-S619 PolarHBondContact O-N 3.09Å; S619-H621 PolarHBondContact O-N 3.49Å
620K44Very low52.4Low197 Ų197156.8 Ų156.886%0.85781%0.811SS**  trans-63.4124.3168.3-74.7172.5173.9171.90109.1L618L618-K620 PolarHBondContact O-N 3.39Å
621H46.1Very low51.4Low168 Ų168152.6 Ų152.678%0.77881%0.806SS**  trans-142.1110.1158.3-126.5-95000113.7S619S619-H621 PolarHBondContact O-N 3.49Å
622N50.2Low50.4Low131 Ų131155.4 Ų155.470%0.70181%0.814SS**  trans17.8117.7152.3-64-27.8000121.3
623K43.6Very low49.4Very low206 Ų206156.7 Ų156.790%0.89682%0.815SS**  10.8115.7129.8-65.1173.3177.81720116.7
624M50Low48.5Very low196 Ų196160.1 Ų160.197%0.96682%0.823SS**  trans-132.9132140.5-98.3-162.5171.700110.8
625K45.2Very low47.4Very low208 Ų208160.7 Ų160.790%0.90483%0.827SS**  trans-83.2139.7174.5-64.4170.3175.7173.80109.1
626K51Low46.2Very low213 Ų213161.3 Ų161.393%0.92683%0.828SS**  trans-141.8136.5149.1-110.2178179.9-179.20109.9
627K45.3Very low45.5Very low196 Ų196162.1 Ų162.185%0.85283%0.831SS**  trans-100141.2-175.6-68.9176.3172.7-178.80110.5
628S47.8Very low44.9Very low112 Ų112161.8 Ų161.878%0.78383%0.828SS**  trans-172.490.7155.851.60000105.9
629V46.7Very low43.9Very low129 Ų129159 Ų15978%0.78282%0.821SS**  52.278.770.7-167.20000111.9
630I49.4Very low42.9Very low169 Ų169166.3 Ų166.387%0.86783%0.834SS**  trans-132.4129.7142.8-63.5-176.3000105.9
631S39.2Very low42.5Very low104 Ų104161.8 Ų161.873%0.72783%0.827SS**  trans-109.1132.8-175.449.60000111
632L42.6Very low41.9Very low173 Ų173159 Ų15991%0.90683%0.826SS**  trans-151.7139.5153.6-99.7168.8000108.2
633P43.7Very low41.6Very low112 Ų112159 Ų15973%0.72783%0.833SS**  trans-101.5149.5-168.537.5-32.9000113.6
634M45Very low41Very low193 Ų193154.4 Ų154.495%0.95183%0.828SS**  trans-161.1130.5135.6-112.2-177.9-174.700111.2
635N38.4Very low40.4Very low162 Ų162151.1 Ų151.187%0.86682%0.822SS**  trans-85.5120.9177.7-83.7-45.4000110.8
636V37.7Very low40.1Very low130 Ų130146.3 Ų146.379%0.78882%0.815SS**  trans-138.9118.8146.2-177.40000108.2I638V636-I638 HydrophobicContact CG1-CD1 4.35Å; V636-I638 HydrophobicContact CG1-CG1 4.04Å
637K34.8Very low39.6Very low201 Ų201143.3 Ų143.387%0.87481%0.809SS**  trans-108.698.5-177.7-173.6-176.7-175.8-175.60108.2
638I37.1Very low39.7Very low148 Ų148141.4 Ų141.476%0.75981%0.808SS**  trans-97.9106.3172.3-61.5175.8000108.1V636V636-I638 HydrophobicContact CG1-CD1 4.35Å; V636-I638 HydrophobicContact CG1-CG1 4.04Å
639S32.8Very low39.3Very low92 Ų92140.3 Ų140.364%0.64380%0.8SS**  trans-75.9135.3172.946.20000110.9
640W30.9Very low39.2Very low252 Ų252145 Ų14596%0.95581%0.806SS**  trans-77.8125161-73.573.4000108.9
641S35.6Very low38.8Very low103 Ų103146.1 Ų146.172%0.7280%0.804SS**  trans-130.8102.4173.753.60000109.7
642S32.9Very low38.9Very low109 Ų109146.5 Ų146.576%0.76281%0.806SS**  trans-77134.7167.7-53.10000109.7
643P43.3Very low38.8Very low130 Ų130142.7 Ų142.784%0.84479%0.794SS**  trans-87.2116.1164.131.2-27.1000110
644S32.1Very low38.8Very low111 Ų111142.5 Ų142.578%0.77680%0.795SS**  trans-104.9109.7165.454.20000109.5
645C37.3Very low38.8Very low126 Ų126138.8 Ų138.885%0.85179%0.788SS**  trans-166.4147.5166.5-87.80000106.4
646S38.8Very low39.5Very low108 Ų108136 Ų13676%0.75578%0.779SS**  cis-166.1153.5-944.60000108.2
647D41.1Very low39.8Very low149 Ų149139.3 Ų139.380%0.79778%0.783SS**  trans-66.6156.2-176.5-61.3-78.2000115.4
648N46.6Very low40.5Very low156 Ų156139.7 Ų139.783%0.83478%0.784SS**  trans178.294.6149.6-89.3-24.3000108
649S39.2Very low40.9Very low89 Ų89142.1 Ų142.162%0.62279%0.789SS**  78.99268.978.70000116.6
650Y44.3Very low41.5Very low229 Ų229143.2 Ų143.290%0.89880%0.795SS**  trans-159.3113.7149.3-82.3-71.8000106.1
651K41.3Very low42.3Very low191 Ų191136.7 Ų136.783%0.8378%0.783SS**  45.613273.7-74.1-172173.51770112.5
652C40.5Very low43Very low113 Ų113137 Ų13776%0.76479%0.785SS**  cis-166.6178.15.7-105.40000107.9
653S41.2Very low43.7Very low93 Ų93136.5 Ų136.565%0.6578%0.782SS**  cis-174.9163.3-14.347.30000109.9
654S44.5Very low44.4Very low108 Ų108137 Ų13776%0.75578%0.783SS**  trans62.2151.6155.757.30000119.6
655S44.4Very low45.5Very low114 Ų114135 Ų13580%0.79778%0.78SS**  cis-164177.61.3-109.90000111.7
656P53.1Low46.1Very low104 Ų104135 Ų13568%0.67578%0.779SS**  trans-124.4169-156.843.7-33.6000119.6
657K43.5Very low46.7Very low200 Ų200134.2 Ų134.287%0.8777%0.774SS**  trans58.8122.4146.7-74.9172.7179.8175.70122.6
658K50.1Low47.5Very low208 Ų208136.4 Ų136.490%0.90478%0.777SS**  trans-176.6124.4131.9-97.3162-176.9-178.80107.1
659K44.7Very low48.1Very low200 Ų200142.5 Ų142.587%0.8780%0.795SS**  75.5140.157.4-105.3-165178.9-170.90115.5
660C46Very low48.6Very low114 Ų114145.2 Ų145.277%0.7780%0.804SS**  trans78.7145.7173.6-70.10000117.3
661T48.5Very low48.8Very low115 Ų115140.7 Ų140.771%0.70680%0.799SS**  cis-175.7157.3-31140000108.2
662S49Very low49.2Very low109 Ų109137.9 Ų137.976%0.76280%0.797SS**  trans60.4153.2156.546.60000119.1
663S48.8Very low49.7Very low99 Ų99139.4 Ų139.469%0.69280%0.799SS**  cis-171.9174.8-11.246.70000109.7
664V57.3Low50.2Low142 Ų142142.3 Ų142.386%0.86181%0.809SS**  trans73.2129.5172.4-163.90000113.1
665G54.6Low50.6Low69 Ų69144.6 Ų144.671%0.71181%0.812SS**  cis105.6138.637.400000107.8
666C51.6Low51.1Low125 Ų125146.8 Ų146.885%0.84581%0.813SS**  cis-158.4144.111.6-149.10000110.6
667S51.4Low50.9Low92 Ų92150.1 Ų150.164%0.64382%0.824SS**  51.4128128.3-162.80000123.7
668K56.6Low51.5Low195 Ų195145.9 Ų145.985%0.84882%0.82SS**  trans68.4102.4150-70.8170.4-177-178.10120.1
669K60Low51.7Low283 Ų283140.3 Ų140.3100%1.2381%0.813SS**  -146.5095.3-134.2176.8-173.2178.20110.7

Retrieved 669 of 669 residues in 330.7 ms (Link to these results)