A0A3Q0KMW4_SCHMA Loading...

Putative rhodopsin-like orphan GPCR

AlphaFold DB , UniProt , Accession A0A3Q0KMW4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 481 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
1M52.5Low46.3Very low33 Ų3349.6 Ų49.616%0.16325%0.245CC..  086.30-179.7-170.417400103.7D3 V294 Q297 K310 D314M1-D3 PolarHBondContact O-N 3.19Å; M1-V294 HydrophobicContact CE-CG2 4.14Å; M1-V294 HydrophobicContact CG-CG2 4.34Å; M1-V294 HydrophobicContact SD-CG2 3.4Å; M1-V294 WeakPolarHBondContact SD-CG2 3.09Å; M1-Q297 VanDerWaalsContact CE-OE1 3.25Å; M1-K310 WeakPolarHBondContact O-CE 3.32Å; M1-K310 PolarHBondContact O-NZ 3.36Å; M1-D314 PolarHBondContact N-OD1 3.24Å
2L45.2Very low46.6Very low16 Ų1654.8 Ų54.88%0.08429%0.29CS..  trans-85.3114.6-171.6-68.4143.5000105.8G4 E80 Y81 S109 R164L2-G4 PolarHBondContact O-N 2.91Å; L2-E80 WeakPolarHBondContact CD1-OE2 3.31Å; L2-E80 WeakPolarHBondContact CD2-OE1 3.48Å; L2-E80 WeakPolarHBondContact CD2-OE2 3.48Å; L2-Y81 HydrophobicContact CD2-CE2 3.98Å; L2-S109 WeakPolarHBondContact CD1-OG 3.34Å; L2-R164 PolarHBondContact O-NH2 3.47Å
3D51.4Low46.8Very low65 Ų6557.1 Ų57.135%0.34831%0.308SS..  trans-79.8104.9169.1-71.9-16.5000103.3M1 T5 K310M1-D3 PolarHBondContact O-N 3.19Å; D3-T5 HydrophobicContact CB-CG2 4.45Å; D3-T5 PolarHBondContact O-N 3.37Å; D3-K310 IonicContact OD1-NZ 2.83Å; D3-K310 PolarHBondContact OD1-NZ 3.41Å; D3-K310 IonicContact OD2-NZ 3.38Å; D3-K310 PolarHBondContact OD2-NZ 3.31Å
4G41.7Very low47.1Very low12 Ų1255.2 Ų55.212%0.12430%0.3CS..  trans-65.215.2177.300000113.7L2 L6 N106 D168L2-G4 PolarHBondContact O-N 2.91Å; G4-L6 VanDerWaalsContact C-N 3.27Å; G4-L6 PolarHBondContact O-N 3.38Å; G4-N106 WeakPolarHBondContact CA-ND2 3.46Å; G4-D168 VanDerWaalsContact CA-OD1 3.24Å; G4-D168 WeakPolarHBondContact CA-OD1 3.49Å
5T43.6Very low47.1Very low46 Ų4661.3 Ų61.328%0.28233%0.333SS..  trans-65.489.7176.757.30000109.5D3 W7 Y169D3-T5 HydrophobicContact CB-CG2 4.45Å; D3-T5 PolarHBondContact O-N 3.37Å; T5-W7 PolarHBondContact O-N 3.37Å; T5-W7 VanDerWaalsContact O-N 3.12Å; T5-Y169 HydrophobicContact CG2-CE1 4Å
6L45Very low47.2Very low30 Ų3060.5 Ų60.516%0.15734%0.343CS..  trans-69.1101.4168.3-175.366.1000107.3G4 I8 I94 F102G4-L6 VanDerWaalsContact C-N 3.27Å; G4-L6 PolarHBondContact O-N 3.38Å; L6-I8 HydrophobicContact CD2-CD1 3.95Å; L6-I8 HydrophobicContact CD2-CG1 4.13Å; L6-I8 HydrophobicContact CG-CD1 4.14Å; L6-I8 HydrophobicContact CG-CG1 3.78Å; L6-I8 PolarHBondContact O-N 3.11Å; L6-I94 HydrophobicContact CD2-CD1 3.47Å; L6-I94 VanDerWaalsContact CD2-CD1 3.47Å; L6-I94 HydrophobicContact CG-CD1 4.19Å; L6-F102 HydrophobicContact CD1-CD1 4.45Å; L6-F102 HydrophobicContact CD1-CE1 3.93Å; L6-F102 HydrophobicContact CD1-CE2 4.45Å; L6-F102 HydrophobicContact CD1-CZ 3.95Å; L6-F102 HydrophobicContact CD2-CD1 4.3Å; L6-F102 HydrophobicContact CD2-CD2 3.55Å; L6-F102 HydrophobicContact CD2-CE1 4.27Å; L6-F102 HydrophobicContact CD2-CE2 3.59Å; L6-F102 HydrophobicContact CD2-CG 3.95Å; L6-F102 HydrophobicContact CD2-CZ 3.94Å
7W47.3Very low47Very low133 Ų13365.8 Ų65.850%0.50437%0.371SS..  trans-81.5114.2173.4-115.868.9000108.5T5 E9 I171T5-W7 PolarHBondContact O-N 3.37Å; T5-W7 VanDerWaalsContact O-N 3.12Å; W7-E9 HydrophobicContact CE3-CG 3.88Å; W7-E9 HydrophobicContact CZ3-CG 3.77Å; W7-E9 WeakPolarHBondContact CZ3-OE1 3.49Å; W7-I171 HydrophobicContact CZ2-CD1 4.2Å
8I48.5Very low47.2Very low15 Ų1569.6 Ų69.68%0.07739%0.388CS..  trans-117.8104.1177.9-44.1158.9000106.7L6 Y10 I94 A170L6-I8 HydrophobicContact CD2-CD1 3.95Å; L6-I8 HydrophobicContact CD2-CG1 4.13Å; L6-I8 HydrophobicContact CG-CD1 4.14Å; L6-I8 HydrophobicContact CG-CG1 3.78Å; L6-I8 PolarHBondContact O-N 3.11Å; I8-Y10 HydrophobicContact CB-CD2 4.22Å; I8-Y10 HydrophobicContact CB-CE2 3.62Å; I8-Y10 HydrophobicContact CD1-CE2 4.25Å; I8-Y10 HydrophobicContact CG2-CD2 3.9Å; I8-Y10 HydrophobicContact CG2-CE1 4.25Å; I8-Y10 HydrophobicContact CG2-CE2 3.36Å; I8-Y10 WeakPolarHBondContact O-CD2 3.35Å; I8-Y10 PolarHBondContact O-N 3.16Å; I8-I94 HydrophobicContact CD1-CB 4.09Å; I8-I94 HydrophobicContact CD1-CD1 3.25Å; I8-I94 HydrophobicContact CD1-CG1 3.66Å; I8-I94 HydrophobicContact CG1-CD1 3.57Å; I8-I94 HydrophobicContact CG1-CG1 4.21Å; I8-I94 HydrophobicContact CG2-CD1 4.4Å; I8-I94 HydrophobicContact CG2-CG1 4.27Å; I8-A170 HydrophobicContact CD1-CB 4.41Å
9E43.4Very low47.2Very low80 Ų8067.6 Ų67.637%0.37438%0.38SS..  trans-79.6118.2169.5-76.8178.9-179.400108.8W7 P91W7-E9 HydrophobicContact CE3-CG 3.88Å; W7-E9 HydrophobicContact CZ3-CG 3.77Å; W7-E9 WeakPolarHBondContact CZ3-OE1 3.49Å; E9-P91 WeakPolarHBondContact O-CB 3.43Å
10Y45.4Very low47.4Very low23 Ų2369.4 Ų69.49%0.0939%0.392CS..  trans-94.1115.9173.8-70.7-93.1000109I8 M93 I94 V172I8-Y10 HydrophobicContact CB-CD2 4.22Å; I8-Y10 HydrophobicContact CB-CE2 3.62Å; I8-Y10 HydrophobicContact CD1-CE2 4.25Å; I8-Y10 HydrophobicContact CG2-CD2 3.9Å; I8-Y10 HydrophobicContact CG2-CE1 4.25Å; I8-Y10 HydrophobicContact CG2-CE2 3.36Å; I8-Y10 WeakPolarHBondContact O-CD2 3.35Å; I8-Y10 PolarHBondContact O-N 3.16Å; Y10-M93 HydrophobicContact CD1-CE 3.72Å; Y10-M93 HydrophobicContact CD1-CG 3.77Å; Y10-M93 HydrophobicContact CD1-SD 3.65Å; Y10-M93 VanDerWaalsContact CE1-CA 3.47Å; Y10-M93 HydrophobicContact CE1-CB 3.87Å; Y10-M93 HydrophobicContact CE1-CE 4.02Å; Y10-M93 HydrophobicContact CE1-CG 3.47Å; Y10-M93 VanDerWaalsContact CE1-CG 3.47Å; Y10-M93 HydrophobicContact CE1-SD 3.3Å; Y10-M93 WeakPolarHBondContact CE1-SD 3.18Å; Y10-I94 PolarHBondContact OH-N 3.45Å; Y10-V172 HydrophobicContact CE2-CG2 4.2Å
11N45.6Very low47.7Very low93 Ų9368 Ų6850%0.49739%0.385SS..  trans76.9132.6170.4-157.51.8000115.7T13 C14N11-T13 VanDerWaalsContact CG-OG1 3.3Å; N11-T13 PolarHBondContact ND2-OG1 3.48Å; N11-T13 VanDerWaalsContact ND2-OG1 3.13Å; N11-T13 PolarHBondContact O-N 3.1Å; N11-C14 PolarHBondContact O-N 3.21Å; N11-C14 VanDerWaalsContact O-N 3.09Å
12S49.5Very low47.9Very low112 Ų11268.4 Ų68.478%0.78340%0.398SS*.THydrogen-bonded Turntrans-63.3-3.9178.958.10000114.1
13T49Very low48.6Very low84 Ų8472.8 Ų72.852%0.51542%0.42SS..THydrogen-bonded Turntrans-89.6-10.7177.256.90000113.2N11 N15N11-T13 VanDerWaalsContact CG-OG1 3.3Å; N11-T13 PolarHBondContact ND2-OG1 3.48Å; N11-T13 VanDerWaalsContact ND2-OG1 3.13Å; N11-T13 PolarHBondContact O-N 3.1Å; T13-N15 PolarHBondContact O-N 3.5Å
14C51.1Low49.2Very low31 Ų3172.2 Ų72.221%0.20942%0.417CS..  trans-71.584.6164.5-83.70000108.6N11 G16 C173N11-C14 PolarHBondContact O-N 3.21Å; N11-C14 VanDerWaalsContact O-N 3.09Å; C14-G16 PolarHBondContact O-N 3.35Å; C14-C173 WeakPolarHBondContact SG-CB 3.48Å
15N48Very low50.6Low146 Ų14675.6 Ų75.678%0.78143%0.428SS*.  trans-68.433.3169.8-113.715.3000111.8T13 N17T13-N15 PolarHBondContact O-N 3.5Å; N15-N17 PolarHBondContact O-N 3.36Å
16G47.7Very low52.1Low49 Ų4976.5 Ų76.551%0.50543%0.431SS..SBendtrans-62.9110.1155.700000104.5C14 I18C14-G16 PolarHBondContact O-N 3.35Å; G16-I18 PolarHBondContact O-N 2.65Å
17N44Very low53.9Low151 Ų15181.6 Ų81.681%0.80745%0.454SS*.  trans-29.2111.9177.8-82.5-23.8000108.3N15 S19N15-N17 PolarHBondContact O-N 3.36Å; N17-S19 WeakPolarHBondContact O-CA 2.9Å; N17-S19 PolarHBondContact O-N 2.88Å
18I50Low55.7Low134 Ų13479.2 Ų79.269%0.68745%0.445SS*.  trans-3898.8179.5-68.9168.1000105.1G16 T20 I23G16-I18 PolarHBondContact O-N 2.65Å; I18-T20 PolarHBondContact O-N 3.14Å; I18-I23 HydrophobicContact CG2-CD1 4.36Å
19S48.9Very low57.5Low32 Ų3279 Ų7922%0.22445%0.445CS..  trans-71.5122.5-159.965.90000102.7N17 T21 G22N17-S19 WeakPolarHBondContact O-CA 2.9Å; N17-S19 PolarHBondContact O-N 2.88Å; S19-T21 PolarHBondContact O-N 3.27Å; S19-T21 PolarHBondContact OG-OG1 3.27Å; S19-G22 PolarHBondContact O-N 3.18Å
20T50.7Low59.8Low103 Ų10379.8 Ų79.863%0.63245%0.451SS*.Hα-helixtrans-46.9-24.5-179.245.60000111.2I18 G22 I23 I24I18-T20 PolarHBondContact O-N 3.14Å; T20-G22 PolarHBondContact O-N 2.68Å; T20-I23 PolarHBondContact O-N 3.33Å; T20-I24 WeakPolarHBondContact O-CB 3.23Å; T20-I24 VanDerWaalsContact O-CD1 3.27Å; T20-I24 WeakPolarHBondContact O-CD1 3.48Å; T20-I24 WeakPolarHBondContact O-CG1 3.34Å; T20-I24 PolarHBondContact O-N 3.42Å; T20-I24 VanDerWaalsContact O-N 3.11Å
21T54.3Low62.1Low39 Ų3981.3 Ų81.324%0.23946%0.464CS..Hα-helixtrans-51.4-39170.384.50000115.8S19 K25S19-T21 PolarHBondContact O-N 3.27Å; S19-T21 PolarHBondContact OG-OG1 3.27Å; T21-K25 WeakPolarHBondContact O-CB 3.25Å; T21-K25 VanDerWaalsContact O-CG 3.26Å; T21-K25 WeakPolarHBondContact O-CG 3.49Å; T21-K25 PolarHBondContact O-N 3.43Å
22G55.7Low64.4Low42 Ų4277 Ų7743%0.43344%0.441SS..Hα-helixtrans-69.7-44.6-177.800000113S19 T20 K25 L26S19-G22 PolarHBondContact O-N 3.18Å; T20-G22 PolarHBondContact O-N 2.68Å; G22-K25 PolarHBondContact O-N 2.94Å; G22-L26 PolarHBondContact O-N 2.83Å
23I59.6Low66.6Low108 Ų10872.8 Ų72.855%0.55441%0.409SS*.Hα-helixtrans-67.5-43177-61174.6000110.1I18 T20 K25 L26 E27I18-I23 HydrophobicContact CG2-CD1 4.36Å; T20-I23 PolarHBondContact O-N 3.33Å; I23-K25 VanDerWaalsContact C-N 3.31Å; I23-K25 PolarHBondContact O-N 3.12Å; I23-L26 WeakPolarHBondContact O-CB 3.18Å; I23-L26 PolarHBondContact O-N 2.96Å; I23-L26 VanDerWaalsContact O-N 3.12Å; I23-E27 PolarHBondContact O-N 3.28Å
24I65.2Low68.8Low54 Ų5473.1 Ų73.128%0.27741%0.407SS..Hα-helixtrans-61-39.9178.3-70.1168.1000111.2T20 L26 E27 Y28T20-I24 WeakPolarHBondContact O-CB 3.23Å; T20-I24 VanDerWaalsContact O-CD1 3.27Å; T20-I24 WeakPolarHBondContact O-CD1 3.48Å; T20-I24 WeakPolarHBondContact O-CG1 3.34Å; T20-I24 PolarHBondContact O-N 3.42Å; T20-I24 VanDerWaalsContact O-N 3.11Å; I24-L26 VanDerWaalsContact C-N 3.3Å; I24-L26 PolarHBondContact O-N 2.93Å; I24-E27 PolarHBondContact O-N 3.18Å; I24-Y28 HydrophobicContact CB-CE2 4.49Å; I24-Y28 HydrophobicContact CG2-CD2 3.78Å; I24-Y28 HydrophobicContact CG2-CE2 3.12Å; I24-Y28 WeakPolarHBondContact O-CD2 3.47Å; I24-Y28 PolarHBondContact O-N 3.12Å
25K70.3Confident71Confident83 Ų8372.8 Ų72.836%0.36140%0.403SS..Hα-helixtrans-60.6-39.1175.4-79.3175.4-179.6-176.20112.2T21 G22 I23 Y28 S29T21-K25 WeakPolarHBondContact O-CB 3.25Å; T21-K25 VanDerWaalsContact O-CG 3.26Å; T21-K25 WeakPolarHBondContact O-CG 3.49Å; T21-K25 PolarHBondContact O-N 3.43Å; G22-K25 PolarHBondContact O-N 2.94Å; I23-K25 VanDerWaalsContact C-N 3.31Å; I23-K25 PolarHBondContact O-N 3.12Å; K25-Y28 PolarHBondContact O-N 3.05Å; K25-S29 PolarHBondContact O-N 3.04Å; K25-S29 VanDerWaalsContact O-N 3.11Å; K25-S29 PolarHBondContact O-OG 3.01Å; K25-S29 VanDerWaalsContact O-OG 3.05Å
26L75.2Confident73.3Confident64 Ų6465.8 Ų65.834%0.33537%0.366SS..Hα-helixtrans-64.5-43.9-177.9-166.366.1000112.7G22 I23 I24 Y28 S29 L85 S88G22-L26 PolarHBondContact O-N 2.83Å; I23-L26 WeakPolarHBondContact O-CB 3.18Å; I23-L26 PolarHBondContact O-N 2.96Å; I23-L26 VanDerWaalsContact O-N 3.12Å; I24-L26 VanDerWaalsContact C-N 3.3Å; I24-L26 PolarHBondContact O-N 2.93Å; L26-Y28 PolarHBondContact O-N 3.35Å; L26-S29 PolarHBondContact O-N 2.93Å; L26-L85 HydrophobicContact CD1-CD1 3.56Å; L26-L85 HydrophobicContact CG-CD1 4.39Å; L26-S88 WeakPolarHBondContact CD1-OG 3.23Å
27E82.6Confident75.7Confident138 Ų13867 Ų6765%0.64536%0.36SS*.Hα-helixtrans-63.1-32.5179.8-68.1-170.9162.800112.1I23 I24 P31I23-E27 PolarHBondContact O-N 3.28Å; I24-E27 PolarHBondContact O-N 3.18Å; E27-P31 WeakPolarHBondContact O-CD 3.02Å
28Y84.3Confident78.3Confident82 Ų8263.4 Ų63.432%0.32234%0.34SS..Hα-helixtrans-81.6-26.4179-62.3-36.5000114.3I24 K25 L26 P31 L311I24-Y28 HydrophobicContact CB-CE2 4.49Å; I24-Y28 HydrophobicContact CG2-CD2 3.78Å; I24-Y28 HydrophobicContact CG2-CE2 3.12Å; I24-Y28 WeakPolarHBondContact O-CD2 3.47Å; I24-Y28 PolarHBondContact O-N 3.12Å; K25-Y28 PolarHBondContact O-N 3.05Å; L26-Y28 PolarHBondContact O-N 3.35Å; Y28-P31 VanDerWaalsContact O-CD 3.3Å; Y28-P31 WeakPolarHBondContact O-CD 3.28Å; Y28-P31 VanDerWaalsContact O-CG 3.31Å; Y28-P31 WeakPolarHBondContact O-CG 3.39Å; Y28-L311 HydrophobicContact CD1-CD2 3.22Å; Y28-L311 HydrophobicContact CD1-CG 4.47Å; Y28-L311 HydrophobicContact CD2-CD2 4.12Å; Y28-L311 HydrophobicContact CE1-CD2 3.59Å; Y28-L311 HydrophobicContact CE2-CD2 4.4Å; Y28-L311 HydrophobicContact CG-CD1 4.36Å; Y28-L311 HydrophobicContact CG-CD2 3.53Å; Y28-L311 HydrophobicContact CG-CG 4.46Å
29S87.4Confident80.5Confident11 Ų1157 Ų578%0.07731%0.307CS..Hα-helixtrans-68.2-36179-68.50000113K25 L26 I32 L33 Y81K25-S29 PolarHBondContact O-N 3.04Å; K25-S29 VanDerWaalsContact O-N 3.11Å; K25-S29 PolarHBondContact O-OG 3.01Å; K25-S29 VanDerWaalsContact O-OG 3.05Å; L26-S29 PolarHBondContact O-N 2.93Å; S29-I32 PolarHBondContact O-N 3.44Å; S29-L33 WeakPolarHBondContact O-CB 3.46Å; S29-L33 PolarHBondContact O-N 3.23Å; S29-Y81 WeakPolarHBondContact OG-CD1 3.23Å
30L91.8Very high82.9Confident96 Ų9657.6 Ų57.650%0.50331%0.307SS..Hα-helixtrans-61.7-50.2-176.9-171.6149.4000114.2I32 L33 I34L30-I32 VanDerWaalsContact C-N 3.32Å; L30-I32 PolarHBondContact O-N 2.94Å; L30-L33 PolarHBondContact O-N 3.29Å; L30-I34 HydrophobicContact CD2-CD1 3.47Å; L30-I34 VanDerWaalsContact CD2-CD1 3.47Å; L30-I34 HydrophobicContact CD2-CG1 4.31Å; L30-I34 HydrophobicContact CG-CD1 4.31Å; L30-I34 WeakPolarHBondContact O-CG1 3.21Å; L30-I34 PolarHBondContact O-N 3.45Å
31P93.2Very high85.1Confident55 Ų5557.5 Ų57.536%0.35730%0.302SS..Hα-helixtrans-63.5-37178.523.1-33.7000112.6E27 Y28 I34 L35E27-P31 WeakPolarHBondContact O-CD 3.02Å; Y28-P31 VanDerWaalsContact O-CD 3.3Å; Y28-P31 WeakPolarHBondContact O-CD 3.28Å; Y28-P31 VanDerWaalsContact O-CG 3.31Å; Y28-P31 WeakPolarHBondContact O-CG 3.39Å; P31-I34 PolarHBondContact O-N 2.94Å; P31-L35 VanDerWaalsContact O-CB 3.26Å; P31-L35 WeakPolarHBondContact O-CB 3.41Å; P31-L35 PolarHBondContact O-N 3.45Å
32I93.8Very high87.2Confident4 Ų458.3 Ų58.32%0.02131%0.305CS..Hα-helixtrans-66.1-42.6176.5-57.7172.6000110.4S29 L30 L35 S36 V77 Y81 L311 D314 L315S29-I32 PolarHBondContact O-N 3.44Å; L30-I32 VanDerWaalsContact C-N 3.32Å; L30-I32 PolarHBondContact O-N 2.94Å; I32-L35 PolarHBondContact O-N 3.14Å; I32-S36 VanDerWaalsContact O-CB 3.32Å; I32-S36 WeakPolarHBondContact O-CB 3.33Å; I32-S36 PolarHBondContact O-N 3.41Å; I32-S36 PolarHBondContact O-OG 3.44Å; I32-V77 HydrophobicContact CG2-CG1 4.44Å; I32-Y81 HydrophobicContact CB-CE1 4.44Å; I32-Y81 HydrophobicContact CB-CE2 4.22Å; I32-Y81 HydrophobicContact CD1-CE1 3.95Å; I32-Y81 HydrophobicContact CD1-CE2 4.4Å; I32-Y81 VanDerWaalsContact CD1-OH 3.25Å; I32-Y81 WeakPolarHBondContact CD1-OH 3.18Å; I32-Y81 HydrophobicContact CG2-CD2 3.9Å; I32-Y81 HydrophobicContact CG2-CE1 4.48Å; I32-Y81 HydrophobicContact CG2-CE2 3.43Å; I32-Y81 VanDerWaalsContact CG2-CE2 3.43Å; I32-L311 HydrophobicContact CD1-CD1 3.63Å; I32-L311 HydrophobicContact CG1-CD1 4.04Å; I32-D314 HydrophobicContact CD1-CB 4.37Å; I32-L315 HydrophobicContact CG1-CD2 3.87Å; I32-L315 HydrophobicContact CG1-CG 4.28Å
33L95.3Very high89.1Confident22 Ų2256.3 Ų56.312%0.11528%0.284CS..Hα-helixtrans-60.8-46.7176.4-17961.5000111.6S29 L30 L35 S36 I37 C78S29-L33 WeakPolarHBondContact O-CB 3.46Å; S29-L33 PolarHBondContact O-N 3.23Å; L30-L33 PolarHBondContact O-N 3.29Å; L33-L35 VanDerWaalsContact C-N 3.35Å; L33-L35 PolarHBondContact O-N 2.91Å; L33-S36 WeakPolarHBondContact CA-OG 3.37Å; L33-S36 PolarHBondContact O-N 3.05Å; L33-S36 PolarHBondContact O-OG 3.5Å; L33-I37 HydrophobicContact CD1-CD1 4.12Å; L33-I37 HydrophobicContact CD1-CG1 4.39Å; L33-I37 HydrophobicContact CG-CD1 4.05Å; L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.42Å; L33-I37 PolarHBondContact O-N 3.26Å; L33-C78 HydrophobicContact CD1-CB 4.3Å
34I96.6Very high91Very high91 Ų9152.6 Ų52.647%0.46727%0.273SS..Hα-helixtrans-61.8-45.6177.6-67.6175.3000110.6L30 P31 I37 I38L30-I34 HydrophobicContact CD2-CD1 3.47Å; L30-I34 VanDerWaalsContact CD2-CD1 3.47Å; L30-I34 HydrophobicContact CD2-CG1 4.31Å; L30-I34 HydrophobicContact CG-CD1 4.31Å; L30-I34 WeakPolarHBondContact O-CG1 3.21Å; L30-I34 PolarHBondContact O-N 3.45Å; P31-I34 PolarHBondContact O-N 2.94Å; I34-I37 PolarHBondContact O-N 3.33Å; I34-I38 HydrophobicContact CG2-CD1 3.98Å; I34-I38 WeakPolarHBondContact O-CG1 3.41Å; I34-I38 PolarHBondContact O-N 3.33Å
35L96.4Very high92.4Very high24 Ų2453.1 Ų53.113%0.12628%0.276CS..Hα-helixtrans-67.4-37.8-177.6-16370.6000111.8P31 I32 L33 I38 A39 L315 T318 F319 I322P31-L35 VanDerWaalsContact O-CB 3.26Å; P31-L35 WeakPolarHBondContact O-CB 3.41Å; P31-L35 PolarHBondContact O-N 3.45Å; I32-L35 PolarHBondContact O-N 3.14Å; L33-L35 VanDerWaalsContact C-N 3.35Å; L33-L35 PolarHBondContact O-N 2.91Å; L35-I38 PolarHBondContact O-N 3.36Å; L35-A39 WeakPolarHBondContact O-CB 3.31Å; L35-A39 PolarHBondContact O-N 3.2Å; L35-L315 HydrophobicContact CD2-CD2 4.16Å; L35-T318 HydrophobicContact CB-CG2 3.83Å; L35-T318 HydrophobicContact CD2-CG2 3.56Å; L35-T318 HydrophobicContact CG-CG2 3.5Å; L35-F319 HydrophobicContact CD1-CD1 4.49Å; L35-F319 HydrophobicContact CD1-CE1 3.96Å; L35-F319 HydrophobicContact CD1-CZ 4.18Å; L35-F319 HydrophobicContact CD2-CD1 4.26Å; L35-F319 HydrophobicContact CD2-CD2 3.98Å; L35-F319 HydrophobicContact CD2-CE1 4.12Å; L35-F319 HydrophobicContact CD2-CE2 3.82Å; L35-F319 HydrophobicContact CD2-CG 4.19Å; L35-F319 HydrophobicContact CD2-CZ 3.89Å; L35-I322 HydrophobicContact CD1-CD1 3.45Å; L35-I322 VanDerWaalsContact CD1-CD1 3.45Å; L35-I322 HydrophobicContact CG-CD1 3.81Å
36S96.7Very high93.7Very high0 Ų049.2 Ų49.20%026%0.259CS..Hα-helixtrans-68.9-37.7175.156.80000112.5I32 L33 I38 A39 L40 C78I32-S36 VanDerWaalsContact O-CB 3.32Å; I32-S36 WeakPolarHBondContact O-CB 3.33Å; I32-S36 PolarHBondContact O-N 3.41Å; I32-S36 PolarHBondContact O-OG 3.44Å; L33-S36 WeakPolarHBondContact CA-OG 3.37Å; L33-S36 PolarHBondContact O-N 3.05Å; L33-S36 PolarHBondContact O-OG 3.5Å; S36-I38 PolarHBondContact O-N 3.49Å; S36-A39 PolarHBondContact O-N 3.1Å; S36-L40 VanDerWaalsContact O-CB 3.27Å; S36-L40 WeakPolarHBondContact O-CB 2.83Å; S36-L40 PolarHBondContact O-N 3.25Å; S36-C78 PolarHBondContact OG-SG 3.49Å; S36-C78 VanDerWaalsContact OG-SG 3.39Å
37I97.9Very high94.7Very high74 Ų7448.2 Ų48.238%0.37925%0.254SS..Hα-helixtrans-61.7-44.4171.9-69.1166.4000110.7L33 I34 L40 I41L33-I37 HydrophobicContact CD1-CD1 4.12Å; L33-I37 HydrophobicContact CD1-CG1 4.39Å; L33-I37 HydrophobicContact CG-CD1 4.05Å; L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.42Å; L33-I37 PolarHBondContact O-N 3.26Å; I34-I37 PolarHBondContact O-N 3.33Å; I37-L40 WeakPolarHBondContact O-CB 3.48Å; I37-L40 PolarHBondContact O-N 3.15Å; I37-I41 HydrophobicContact CG2-CD1 3.97Å; I37-I41 WeakPolarHBondContact O-CG1 3.17Å; I37-I41 PolarHBondContact O-N 3.48Å
38I97.9Very high95.4Very high76 Ų7643.6 Ų43.639%0.3924%0.236SC..Hα-helixtrans-60.5-48.7175.6-68.6167.1000110I34 L35 S36 L40 I41 L42 I322I34-I38 HydrophobicContact CG2-CD1 3.98Å; I34-I38 WeakPolarHBondContact O-CG1 3.41Å; I34-I38 PolarHBondContact O-N 3.33Å; L35-I38 PolarHBondContact O-N 3.36Å; S36-I38 PolarHBondContact O-N 3.49Å; I38-L40 VanDerWaalsContact C-N 3.31Å; I38-L40 PolarHBondContact O-N 3.3Å; I38-I41 PolarHBondContact O-N 3.4Å; I38-L42 HydrophobicContact CG2-CD1 3.69Å; I38-L42 HydrophobicContact CG2-CG 4.22Å; I38-L42 WeakPolarHBondContact O-CB 3.41Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.49Å; I38-L42 PolarHBondContact O-N 2.77Å; I38-I322 HydrophobicContact CG2-CD1 4.44Å
39A97.5Very high95.9Very high0 Ų039.9 Ų39.90%022%0.222CC..Hα-helixtrans-61.8-37.7178.900000112.4L35 S36 N43 I322L35-A39 WeakPolarHBondContact O-CB 3.31Å; L35-A39 PolarHBondContact O-N 3.2Å; S36-A39 PolarHBondContact O-N 3.1Å; A39-N43 WeakPolarHBondContact O-CB 3.2Å; A39-N43 PolarHBondContact O-N 3.33Å; A39-N43 PolarHBondContact O-ND2 3.05Å; A39-I322 HydrophobicContact CB-CG1 4.01Å
40L97.9Very high96.3Very high43 Ų4339.9 Ų39.923%0.22522%0.221CC..Hα-helixtrans-61.2-50.9175.3-177.768.6000111.2S36 I37 I38 N43 G44 V71 H74 F75S36-L40 VanDerWaalsContact O-CB 3.27Å; S36-L40 WeakPolarHBondContact O-CB 2.83Å; S36-L40 PolarHBondContact O-N 3.25Å; I37-L40 WeakPolarHBondContact O-CB 3.48Å; I37-L40 PolarHBondContact O-N 3.15Å; I38-L40 VanDerWaalsContact C-N 3.31Å; I38-L40 PolarHBondContact O-N 3.3Å; L40-N43 PolarHBondContact O-N 3.37Å; L40-G44 PolarHBondContact O-N 3.19Å; L40-V71 HydrophobicContact CD1-CB 4.34Å; L40-V71 HydrophobicContact CD1-CG1 3.8Å; L40-V71 VanDerWaalsContact CD1-O 3.23Å; L40-V71 WeakPolarHBondContact CD1-O 3.43Å; L40-H74 HydrophobicContact CB-CB 3.97Å; L40-H74 HydrophobicContact CD1-CB 4.18Å; L40-F75 HydrophobicContact CD1-CB 4.12Å
41I97.8Very high96.3Very high101 Ų10138.9 Ų38.952%0.51822%0.222SC..Hα-helixtrans-61.3-48.6179-66.9167.1000110.2I37 I38 N43 G44 L45I37-I41 HydrophobicContact CG2-CD1 3.97Å; I37-I41 WeakPolarHBondContact O-CG1 3.17Å; I37-I41 PolarHBondContact O-N 3.48Å; I38-I41 PolarHBondContact O-N 3.4Å; I41-N43 PolarHBondContact O-N 3.2Å; I41-G44 PolarHBondContact O-N 2.91Å; I41-L45 HydrophobicContact CG2-CD1 4.47Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.08Å
42L97.2Very high96.3Very high56 Ų5644.1 Ų44.129%0.29324%0.235SC..Hα-helixtrans-64.6-41.9-177.8-65.5173.7000111.7I38 L45 C46 I322 I325I38-L42 HydrophobicContact CG2-CD1 3.69Å; I38-L42 HydrophobicContact CG2-CG 4.22Å; I38-L42 WeakPolarHBondContact O-CB 3.41Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.49Å; I38-L42 PolarHBondContact O-N 2.77Å; L42-L45 WeakPolarHBondContact O-CB 3.43Å; L42-L45 PolarHBondContact O-N 2.9Å; L42-C46 PolarHBondContact O-N 3.01Å; L42-C46 PolarHBondContact O-SG 2.73Å; L42-I322 HydrophobicContact CD1-CG2 4.36Å; L42-I325 VanDerWaalsContact C-CD1 3.46Å; L42-I325 HydrophobicContact CB-CD1 3.22Å; L42-I325 HydrophobicContact CD1-CD1 4.37Å; L42-I325 HydrophobicContact CG-CD1 4.4Å
43N97.4Very high96.1Very high0 Ų045.7 Ų45.70%024%0.242CC..Hα-helixtrans-69.3-33.5175.6-79.3-71.6000112.3A39 L40 I41 L45 C46 I47 E70 V71A39-N43 WeakPolarHBondContact O-CB 3.2Å; A39-N43 PolarHBondContact O-N 3.33Å; A39-N43 PolarHBondContact O-ND2 3.05Å; L40-N43 PolarHBondContact O-N 3.37Å; I41-N43 PolarHBondContact O-N 3.2Å; N43-L45 VanDerWaalsContact C-N 3.33Å; N43-L45 PolarHBondContact O-N 2.99Å; N43-C46 WeakPolarHBondContact O-CB 3.35Å; N43-C46 PolarHBondContact O-N 2.88Å; N43-C46 VanDerWaalsContact O-N 3.16Å; N43-I47 WeakPolarHBondContact O-CG1 3.41Å; N43-I47 PolarHBondContact O-N 3.31Å; N43-E70 HydrophobicContact CB-CB 4.17Å; N43-V71 HydrophobicContact CB-CG2 3.58Å
44G97.7Very high95.6Very high31 Ų3153.2 Ų53.232%0.3228%0.276SS..Hα-helixtrans-59.8-42.6170.200000112.4L40 I41 I47 S48L40-G44 PolarHBondContact O-N 3.19Å; I41-G44 PolarHBondContact O-N 2.91Å; G44-I47 PolarHBondContact O-N 2.87Å; G44-S48 PolarHBondContact O-N 3.28Å
45L96.5Very high95.1Very high64 Ų6455.9 Ų55.934%0.33528%0.28SS..Hα-helixtrans-62.6-41.1172.2-68.1174.9000111.7I41 L42 N43 I47 S48 I49I41-L45 HydrophobicContact CG2-CD1 4.47Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.08Å; L42-L45 WeakPolarHBondContact O-CB 3.43Å; L42-L45 PolarHBondContact O-N 2.9Å; N43-L45 VanDerWaalsContact C-N 3.33Å; N43-L45 PolarHBondContact O-N 2.99Å; L45-I47 PolarHBondContact O-N 3.26Å; L45-S48 WeakPolarHBondContact O-CB 3.45Å; L45-S48 PolarHBondContact O-N 3.07Å; L45-I49 WeakPolarHBondContact O-CG1 3.34Å; L45-I49 PolarHBondContact O-N 3.02Å
46C96.9Very high94.5Very high1 Ų163.3 Ų63.31%0.00731%0.311CS..Hα-helixtrans-58.2-46.2174.7-690000112.2L42 N43 S48 I49 F50 F335L42-C46 PolarHBondContact O-N 3.01Å; L42-C46 PolarHBondContact O-SG 2.73Å; N43-C46 WeakPolarHBondContact O-CB 3.35Å; N43-C46 PolarHBondContact O-N 2.88Å; N43-C46 VanDerWaalsContact O-N 3.16Å; C46-S48 VanDerWaalsContact C-N 3.32Å; C46-S48 PolarHBondContact O-N 3.43Å; C46-I49 PolarHBondContact O-N 3.01Å; C46-F50 HydrophobicContact CB-CD2 4.34Å; C46-F50 HydrophobicContact CB-CE2 4.17Å; C46-F50 WeakPolarHBondContact O-CD2 3.46Å; C46-F50 WeakPolarHBondContact O-CG 3.41Å; C46-F50 PolarHBondContact O-N 3.06Å; C46-F335 HydrophobicContact CB-CE2 4.31Å
47I97Very high94.1Very high44 Ų4464.8 Ų64.823%0.22632%0.322CS..Hα-helixtrans-59.7-45.1176.4-65.4172000110.4N43 G44 L45 I49 F50 S51 A68 V71N43-I47 WeakPolarHBondContact O-CG1 3.41Å; N43-I47 PolarHBondContact O-N 3.31Å; G44-I47 PolarHBondContact O-N 2.87Å; L45-I47 PolarHBondContact O-N 3.26Å; I47-I49 VanDerWaalsContact C-N 3.35Å; I47-I49 PolarHBondContact O-N 3.44Å; I47-F50 PolarHBondContact O-N 3.4Å; I47-S51 WeakPolarHBondContact O-CB 3.3Å; I47-S51 PolarHBondContact O-N 2.94Å; I47-S51 PolarHBondContact O-OG 3.14Å; I47-A68 HydrophobicContact CD1-CB 4.19Å; I47-V71 HydrophobicContact CD1-CB 4.05Å; I47-V71 HydrophobicContact CD1-CG2 3.52Å; I47-V71 HydrophobicContact CG1-CG2 4.48Å
48S95.8Very high93.7Very high41 Ų4162.9 Ų62.929%0.28731%0.313SS..Hα-helixtrans-59.3-45178.2-174.70000111.9G44 L45 C46 R52G44-S48 PolarHBondContact O-N 3.28Å; L45-S48 WeakPolarHBondContact O-CB 3.45Å; L45-S48 PolarHBondContact O-N 3.07Å; C46-S48 VanDerWaalsContact C-N 3.32Å; C46-S48 PolarHBondContact O-N 3.43Å; S48-R52 WeakPolarHBondContact O-CG 3.3Å; S48-R52 PolarHBondContact O-N 3.32Å
49I95.4Very high93.3Very high4 Ų460.5 Ų60.52%0.02130%0.301CS..Hα-helixtrans-64.9-48.7178.1-67165.5000110.9L45 C46 I47 S51 R52 F335 Y338 L339 M342L45-I49 WeakPolarHBondContact O-CG1 3.34Å; L45-I49 PolarHBondContact O-N 3.02Å; C46-I49 PolarHBondContact O-N 3.01Å; I47-I49 VanDerWaalsContact C-N 3.35Å; I47-I49 PolarHBondContact O-N 3.44Å; I49-S51 PolarHBondContact O-N 3.25Å; I49-R52 PolarHBondContact O-N 3.43Å; I49-F335 HydrophobicContact CB-CD2 4.19Å; I49-F335 HydrophobicContact CB-CE2 3.99Å; I49-F335 HydrophobicContact CD1-CD2 4.34Å; I49-F335 HydrophobicContact CD1-CE2 3.74Å; I49-F335 HydrophobicContact CD1-CZ 3.87Å; I49-F335 HydrophobicContact CG1-CE2 4.48Å; I49-F335 HydrophobicContact CG2-CD2 3.53Å; I49-F335 HydrophobicContact CG2-CE2 3.85Å; I49-F335 HydrophobicContact CG2-CG 4.35Å; I49-Y338 HydrophobicContact CG2-CG 4.37Å; I49-L339 HydrophobicContact CD1-CB 4.05Å; I49-L339 HydrophobicContact CD1-CD1 4.33Å; I49-L339 HydrophobicContact CD1-CG 4.38Å; I49-M342 HydrophobicContact CD1-SD 4.47Å; I49-M342 HydrophobicContact CG1-SD 3.87Å
50F94.9Very high93Very high10 Ų1063.1 Ų63.14%0.04431%0.311CS..Hα-helixtrans-67.5-35-179.2-68.9-48.3000112.7C46 I47 R52 Q53 L63 L64 Y328 L332 F335C46-F50 HydrophobicContact CB-CD2 4.34Å; C46-F50 HydrophobicContact CB-CE2 4.17Å; C46-F50 WeakPolarHBondContact O-CD2 3.46Å; C46-F50 WeakPolarHBondContact O-CG 3.41Å; C46-F50 PolarHBondContact O-N 3.06Å; I47-F50 PolarHBondContact O-N 3.4Å; F50-R52 VanDerWaalsContact C-N 3.34Å; F50-R52 PolarHBondContact O-N 3.32Å; F50-Q53 PolarHBondContact O-N 3.3Å; F50-L63 HydrophobicContact CE1-CD1 4.39Å; F50-L63 HydrophobicContact CE2-CB 4.16Å; F50-L63 HydrophobicContact CZ-CB 4.16Å; F50-L63 HydrophobicContact CZ-CD1 4.19Å; F50-L64 HydrophobicContact CB-CB 4.24Å; F50-L64 HydrophobicContact CB-CD1 4.25Å; F50-L64 HydrophobicContact CB-CG 4.48Å; F50-Y328 HydrophobicContact CE2-CD2 4.23Å; F50-Y328 HydrophobicContact CE2-CE2 4.39Å; F50-Y328 HydrophobicContact CZ-CD2 4.2Å; F50-Y328 HydrophobicContact CZ-CG 4.34Å; F50-L332 HydrophobicContact CE1-CD1 4.25Å; F50-L332 HydrophobicContact CZ-CD1 4.31Å; F50-F335 HydrophobicContact CD1-CD2 4.32Å; F50-F335 AromaticContact CE1-CD2 3.65Å; F50-F335 HydrophobicContact CE1-CD2 3.65Å; F50-F335 HydrophobicContact CE1-CE2 4.29Å; F50-F335 HydrophobicContact CE2-CD2 4.34Å; F50-F335 HydrophobicContact CE2-CE2 4.17Å; F50-F335 AromaticContact CZ-CD2 3.65Å; F50-F335 HydrophobicContact CZ-CD2 3.65Å; F50-F335 AromaticContact CZ-CE2 3.91Å; F50-F335 HydrophobicContact CZ-CE2 3.91Å
51S93.6Very high92.7Very high76 Ų7662.2 Ų62.253%0.53131%0.307SS..Hα-helixtrans-67.2-33.4178.2-61.40000112.7I47 I49 Q53I47-S51 WeakPolarHBondContact O-CB 3.3Å; I47-S51 PolarHBondContact O-N 2.94Å; I47-S51 PolarHBondContact O-OG 3.14Å; I49-S51 PolarHBondContact O-N 3.25Å; S51-Q53 PolarHBondContact O-N 3.31Å
52R93Very high92.5Very high165 Ų16557.8 Ų57.862%0.62329%0.285SS*.Hα-helixtrans-72.2-16.3177.1-75.9179.2175-168.2-1.8113.3S48 I49 F50 H54S48-R52 WeakPolarHBondContact O-CG 3.3Å; S48-R52 PolarHBondContact O-N 3.32Å; I49-R52 PolarHBondContact O-N 3.43Å; F50-R52 VanDerWaalsContact C-N 3.34Å; F50-R52 PolarHBondContact O-N 3.32Å; R52-H54 PolarHBondContact O-N 3.47Å
53Q89.6Confident92.4Very high37 Ų3755.2 Ų55.217%0.17327%0.272CS..  trans-83.899.7-173.8-149.8177.71400111.5F50 S51 R55 R60 Y338F50-Q53 PolarHBondContact O-N 3.3Å; S51-Q53 PolarHBondContact O-N 3.31Å; Q53-R55 VanDerWaalsContact C-N 3.28Å; Q53-R55 PolarHBondContact O-N 3.44Å; Q53-R55 VanDerWaalsContact O-N 3.08Å; Q53-R60 VanDerWaalsContact CG-NH1 3.31Å; Q53-R60 VanDerWaalsContact OE1-CD 3.29Å; Q53-Y338 HydrophobicContact CG-CE2 4.31Å
54H83.6Confident92.3Very high179 Ų17957.9 Ų57.983%0.82929%0.285SS*.  trans-58.1-26.3-171.7-172.1-93.1000116R52 K56R52-H54 PolarHBondContact O-N 3.47Å; H54-K56 PolarHBondContact O-N 3.44Å
55R85.7Confident92.2Very high147 Ų14757.5 Ų57.556%0.55528%0.277SS*.SBendtrans-76.6121.5-178.8-42.2-175.1176.8172.1-3.2111.4Q53 S57 R60 L481Q53-R55 VanDerWaalsContact C-N 3.28Å; Q53-R55 PolarHBondContact O-N 3.44Å; Q53-R55 VanDerWaalsContact O-N 3.08Å; R55-S57 PolarHBondContact O-N 3.32Å; R55-R60 VanDerWaalsContact CB-NH1 3.3Å; R55-R60 PolarHBondContact O-NH1 3.26Å; R55-L481 PolarHBondContact NH1-O 3.15Å; R55-L481 PolarHBondContact NH1-OXT 3.06Å
56K84.5Confident92.2Very high181 Ų18154.5 Ų54.579%0.78726%0.261SS*.  trans-78.778.9179.9-63.3179.5-179.21740110.9H54H54-K56 PolarHBondContact O-N 3.44Å
57S88.7Confident92.2Very high31 Ų3154.4 Ų54.422%0.21726%0.261CS..  trans-92.3138171.1178.70000110.4R55 M59 R60 T61R55-S57 PolarHBondContact O-N 3.32Å; S57-M59 PolarHBondContact O-N 2.7Å; S57-M59 PolarHBondContact OG-N 3.48Å; S57-R60 WeakPolarHBondContact O-CB 3.47Å; S57-R60 PolarHBondContact O-N 2.83Å; S57-T61 PolarHBondContact O-N 3.38Å; S57-T61 PolarHBondContact O-OG1 3.44Å
58V88.7Confident92.2Very high33 Ų3353.8 Ų53.820%0.226%0.262CS..Hα-helixtrans-51.2-42.3173.7172.60000111.5R60 T61 S62 H143 I146V58-R60 VanDerWaalsContact C-N 3.3Å; V58-R60 PolarHBondContact O-N 3.18Å; V58-T61 PolarHBondContact O-N 3.31Å; V58-S62 PolarHBondContact O-N 3.45Å; V58-S62 PolarHBondContact O-OG 2.89Å; V58-S62 VanDerWaalsContact O-OG 3.14Å; V58-H143 HydrophobicContact CG2-CB 4.38Å; V58-I146 HydrophobicContact CG1-CD1 3.3Å
59M90.1Very high92.2Very high26 Ų2652 Ų5213%0.12825%0.249CC..Hα-helixtrans-57-44.8177.2-172.7-176.8-169.100112.1S57 S62 L63 R127 A272 I276 L332S57-M59 PolarHBondContact O-N 2.7Å; S57-M59 PolarHBondContact OG-N 3.48Å; M59-S62 PolarHBondContact O-N 3.06Å; M59-L63 HydrophobicContact CE-CD1 4.22Å; M59-L63 HydrophobicContact CG-CD1 4.13Å; M59-L63 HydrophobicContact CG-CG 4.47Å; M59-L63 VanDerWaalsContact O-CG 3.31Å; M59-L63 WeakPolarHBondContact O-CG 3.13Å; M59-L63 PolarHBondContact O-N 3.22Å; M59-R127 PolarHBondContact SD-NH2 3.28Å; M59-A272 HydrophobicContact CE-CB 4.14Å; M59-A272 HydrophobicContact SD-CB 4.21Å; M59-I276 HydrophobicContact CE-CD1 3.87Å; M59-I276 HydrophobicContact CE-CG1 4.14Å; M59-L332 HydrophobicContact CE-CD2 3.87Å; M59-L332 HydrophobicContact SD-CD2 4.41Å
60R90.9Very high92.3Very high56 Ų5651.9 Ų51.921%0.21125%0.249CC..Hα-helixtrans-69.8-40.4-176.9-68179.6-170.2167.71.4110.8Q53 R55 S57 V58 S62 L63 L64Q53-R60 VanDerWaalsContact CG-NH1 3.31Å; Q53-R60 VanDerWaalsContact OE1-CD 3.29Å; R55-R60 VanDerWaalsContact CB-NH1 3.3Å; R55-R60 PolarHBondContact O-NH1 3.26Å; S57-R60 WeakPolarHBondContact O-CB 3.47Å; S57-R60 PolarHBondContact O-N 2.83Å; V58-R60 VanDerWaalsContact C-N 3.3Å; V58-R60 PolarHBondContact O-N 3.18Å; R60-S62 VanDerWaalsContact C-N 3.3Å; R60-S62 PolarHBondContact O-N 3.23Å; R60-L63 PolarHBondContact O-N 3.46Å; R60-L64 VanDerWaalsContact O-CB 3.24Å; R60-L64 WeakPolarHBondContact O-CB 3.45Å; R60-L64 PolarHBondContact O-N 2.97Å
61T92.5Very high92.5Very high24 Ų2453 Ų5315%0.14726%0.257CS..Hα-helixtrans-59.3-45174.1-55.80000110.4S57 V58 L64 V65 H143S57-T61 PolarHBondContact O-N 3.38Å; S57-T61 PolarHBondContact O-OG1 3.44Å; V58-T61 PolarHBondContact O-N 3.31Å; T61-L64 PolarHBondContact O-N 3.21Å; T61-V65 HydrophobicContact CG2-CG2 4.49Å; T61-V65 WeakPolarHBondContact O-CB 3.43Å; T61-V65 WeakPolarHBondContact O-CG2 3.33Å; T61-V65 PolarHBondContact O-N 2.98Å; T61-H143 PolarHBondContact OG1-CD2 3.22Å; T61-H143 VanDerWaalsContact OG1-CD2 3.27Å; T61-H143 PolarHBondContact OG1-NE2 2.9Å
62S93.8Very high92.7Very high7 Ų753 Ų535%0.04925%0.25CC..Hα-helixtrans-64.7-41.2177.1-52.80000113V58 M59 R60 V65 L66V58-S62 PolarHBondContact O-N 3.45Å; V58-S62 PolarHBondContact O-OG 2.89Å; V58-S62 VanDerWaalsContact O-OG 3.14Å; M59-S62 PolarHBondContact O-N 3.06Å; R60-S62 VanDerWaalsContact C-N 3.3Å; R60-S62 PolarHBondContact O-N 3.23Å; S62-V65 PolarHBondContact O-N 3.27Å; S62-L66 PolarHBondContact O-N 2.83Å
63L94.5Very high92.8Very high3 Ų345.3 Ų45.32%0.01622%0.221CC..Hα-helixtrans-67.1-38.2175.9-70.2177.2000112.8F50 M59 R60 L66 S67 L279 Y328 L332F50-L63 HydrophobicContact CE1-CD1 4.39Å; F50-L63 HydrophobicContact CE2-CB 4.16Å; F50-L63 HydrophobicContact CZ-CB 4.16Å; F50-L63 HydrophobicContact CZ-CD1 4.19Å; M59-L63 HydrophobicContact CE-CD1 4.22Å; M59-L63 HydrophobicContact CG-CD1 4.13Å; M59-L63 HydrophobicContact CG-CG 4.47Å; M59-L63 VanDerWaalsContact O-CG 3.31Å; M59-L63 WeakPolarHBondContact O-CG 3.13Å; M59-L63 PolarHBondContact O-N 3.22Å; R60-L63 PolarHBondContact O-N 3.46Å; L63-L66 PolarHBondContact O-N 3.45Å; L63-S67 PolarHBondContact O-N 3.37Å; L63-S67 PolarHBondContact O-OG 3.13Å; L63-L279 HydrophobicContact CD2-CD1 4.11Å; L63-Y328 HydrophobicContact CD2-CD1 4.32Å; L63-Y328 HydrophobicContact CD2-CE1 3.53Å; L63-L332 HydrophobicContact CD1-CD1 3.63Å
64L95.2Very high93.2Very high55 Ų5543.5 Ų43.529%0.28821%0.213SC..Hα-helixtrans-63.8-44.2174.8-177.3156.9000110.4F50 R60 T61 L66 S67 A68F50-L64 HydrophobicContact CB-CB 4.24Å; F50-L64 HydrophobicContact CB-CD1 4.25Å; F50-L64 HydrophobicContact CB-CG 4.48Å; R60-L64 VanDerWaalsContact O-CB 3.24Å; R60-L64 WeakPolarHBondContact O-CB 3.45Å; R60-L64 PolarHBondContact O-N 2.97Å; T61-L64 PolarHBondContact O-N 3.21Å; L64-L66 VanDerWaalsContact C-N 3.34Å; L64-S67 PolarHBondContact O-N 3.05Å; L64-A68 WeakPolarHBondContact O-CB 3.31Å; L64-A68 PolarHBondContact O-N 3.43Å
65V95.3Very high93.9Very high24 Ų2439.7 Ų39.715%0.14519%0.194CC..Hα-helixtrans-61.7-43.2175.7170.40000110.7T61 S62 A68 T69 Y150T61-V65 HydrophobicContact CG2-CG2 4.49Å; T61-V65 WeakPolarHBondContact O-CB 3.43Å; T61-V65 WeakPolarHBondContact O-CG2 3.33Å; T61-V65 PolarHBondContact O-N 2.98Å; S62-V65 PolarHBondContact O-N 3.27Å; V65-A68 PolarHBondContact O-N 3.46Å; V65-T69 PolarHBondContact O-N 3.46Å; V65-T69 PolarHBondContact O-OG1 3.12Å; V65-Y150 HydrophobicContact CG1-CD1 3.99Å; V65-Y150 HydrophobicContact CG1-CD2 3.31Å; V65-Y150 HydrophobicContact CG1-CE1 3.87Å; V65-Y150 HydrophobicContact CG1-CE2 3.13Å; V65-Y150 HydrophobicContact CG1-CG 3.73Å; V65-Y150 VanDerWaalsContact CG1-CZ 3.46Å
66L96.4Very high94.4Very high0 Ų034.8 Ų34.80%018%0.177CC..Hα-helixtrans-60.9-49.6175-178.560.2000111.5S62 L63 L64 A68 T69 E70 R116 C119 I123 Y328S62-L66 PolarHBondContact O-N 2.83Å; L63-L66 PolarHBondContact O-N 3.45Å; L64-L66 VanDerWaalsContact C-N 3.34Å; L66-A68 VanDerWaalsContact C-N 3.27Å; L66-A68 PolarHBondContact O-N 2.99Å; L66-T69 WeakPolarHBondContact CA-OG1 3.34Å; L66-T69 PolarHBondContact O-N 3.3Å; L66-T69 PolarHBondContact O-OG1 3.48Å; L66-E70 HydrophobicContact CD1-CG 4.48Å; L66-E70 WeakPolarHBondContact O-CG 3.24Å; L66-E70 PolarHBondContact O-N 3.18Å; L66-R116 HydrophobicContact CD1-CG 4.18Å; L66-C119 HydrophobicContact CD1-CB 4.18Å; L66-I123 HydrophobicContact CB-CD1 3.87Å; L66-I123 HydrophobicContact CD2-CD1 3.59Å; L66-I123 HydrophobicContact CG-CD1 4.25Å; L66-Y328 WeakPolarHBondContact CD2-OH 3.44Å
67S97.2Very high94.9Very high0 Ų026.4 Ų26.40%014%0.14CC..Hα-helixtrans-60.8-34.8175.5-64.70000112.7L63 L64 E70 V71L63-S67 PolarHBondContact O-N 3.37Å; L63-S67 PolarHBondContact O-OG 3.13Å; L64-S67 PolarHBondContact O-N 3.05Å; S67-E70 PolarHBondContact O-N 3.24Å; S67-V71 WeakPolarHBondContact O-CG2 3.34Å; S67-V71 PolarHBondContact O-N 3.47Å
68A96.9Very high95.2Very high31 Ų3125.5 Ų25.526%0.25613%0.134SC..Hα-helixtrans-66.8-42.6174.500000112.4I47 L64 V65 L66 E70 V71 L72I47-A68 HydrophobicContact CD1-CB 4.19Å; L64-A68 WeakPolarHBondContact O-CB 3.31Å; L64-A68 PolarHBondContact O-N 3.43Å; V65-A68 PolarHBondContact O-N 3.46Å; L66-A68 VanDerWaalsContact C-N 3.27Å; L66-A68 PolarHBondContact O-N 2.99Å; A68-E70 VanDerWaalsContact C-N 3.3Å; A68-E70 PolarHBondContact O-N 3.39Å; A68-V71 PolarHBondContact O-N 3.35Å; A68-L72 WeakPolarHBondContact O-CG 3.39Å; A68-L72 PolarHBondContact O-N 2.99Å
69T96.9Very high95.5Very high3 Ų326.4 Ų26.42%0.01814%0.137CC..Hα-helixtrans-62.7-37.8172.9480000112.4V65 L66 L72 F73 T115 Y150V65-T69 PolarHBondContact O-N 3.46Å; V65-T69 PolarHBondContact O-OG1 3.12Å; L66-T69 WeakPolarHBondContact CA-OG1 3.34Å; L66-T69 PolarHBondContact O-N 3.3Å; L66-T69 PolarHBondContact O-OG1 3.48Å; T69-L72 PolarHBondContact O-N 2.99Å; T69-F73 VanDerWaalsContact O-CB 3.32Å; T69-F73 WeakPolarHBondContact O-CB 3.24Å; T69-F73 PolarHBondContact O-N 3.16Å; T69-T115 HydrophobicContact CG2-CG2 3.84Å; T69-Y150 HydrophobicContact CG2-CE2 3.76Å; T69-Y150 WeakPolarHBondContact CG2-OH 3.27Å
70E97.1Very high95.6Very high1 Ų125.5 Ų25.51%0.00513%0.133CC..Hα-helixtrans-67.2-41.3178.2-67.6-80.9-160.500111.3N43 L66 S67 A68 F73 H74 R116 S321 N324N43-E70 HydrophobicContact CB-CB 4.17Å; L66-E70 HydrophobicContact CD1-CG 4.48Å; L66-E70 WeakPolarHBondContact O-CG 3.24Å; L66-E70 PolarHBondContact O-N 3.18Å; S67-E70 PolarHBondContact O-N 3.24Å; A68-E70 VanDerWaalsContact C-N 3.3Å; A68-E70 PolarHBondContact O-N 3.39Å; E70-F73 PolarHBondContact O-N 2.91Å; E70-H74 WeakPolarHBondContact O-CB 3.32Å; E70-H74 PolarHBondContact O-CD2 3.29Å; E70-H74 PolarHBondContact O-N 3.22Å; E70-H74 IonicContact OE2-CD2 3.12Å; E70-H74 IonicContact OE2-NE2 3.75Å; E70-R116 VanDerWaalsContact CD-CD 3.49Å; E70-R116 WeakPolarHBondContact OE1-CD 3.42Å; E70-R116 WeakPolarHBondContact OE2-CD 3.19Å; E70-R116 IonicContact OE2-NH1 3.75Å; E70-S321 VanDerWaalsContact CD-OG 3.24Å; E70-S321 PolarHBondContact OE1-OG 3.27Å; E70-S321 WeakPolarHBondContact OE2-CB 3.32Å; E70-S321 PolarHBondContact OE2-OG 3.48Å; E70-N324 PolarHBondContact OE1-ND2 2.77Å
71V98.1Very high95.6Very high35 Ų3523.6 Ų23.621%0.21213%0.126CC..Hα-helixtrans-60.7-45.8173.1167.80000111L40 N43 I47 S67 A68 F75L40-V71 HydrophobicContact CD1-CB 4.34Å; L40-V71 HydrophobicContact CD1-CG1 3.8Å; L40-V71 VanDerWaalsContact CD1-O 3.23Å; L40-V71 WeakPolarHBondContact CD1-O 3.43Å; N43-V71 HydrophobicContact CB-CG2 3.58Å; I47-V71 HydrophobicContact CD1-CB 4.05Å; I47-V71 HydrophobicContact CD1-CG2 3.52Å; I47-V71 HydrophobicContact CG1-CG2 4.48Å; S67-V71 WeakPolarHBondContact O-CG2 3.34Å; S67-V71 PolarHBondContact O-N 3.47Å; A68-V71 PolarHBondContact O-N 3.35Å; V71-F75 WeakPolarHBondContact O-CB 3.35Å; V71-F75 PolarHBondContact O-N 3.49Å
72L97.4Very high95.6Very high74 Ų7425.1 Ų25.139%0.38714%0.135SC..Hα-helixtrans-62.8-44.5177.7-72.5173.8000111.8A68 T69 F75 F76A68-L72 WeakPolarHBondContact O-CG 3.39Å; A68-L72 PolarHBondContact O-N 2.99Å; T69-L72 PolarHBondContact O-N 2.99Å; L72-F75 WeakPolarHBondContact O-CB 3.43Å; L72-F75 PolarHBondContact O-N 3.3Å; L72-F76 WeakPolarHBondContact O-CD2 3.5Å; L72-F76 PolarHBondContact O-N 3.16Å
73F96.9Very high95.3Very high4 Ų426.1 Ų26.12%0.01814%0.141CC..Hα-helixtrans-59.2-54.4177.4172.8-110.4000111.7T69 E70 F75 F76 V77 S112 L113 L317T69-F73 VanDerWaalsContact O-CB 3.32Å; T69-F73 WeakPolarHBondContact O-CB 3.24Å; T69-F73 PolarHBondContact O-N 3.16Å; E70-F73 PolarHBondContact O-N 2.91Å; F73-F75 PolarHBondContact O-N 3.49Å; F73-F76 PolarHBondContact O-N 3.46Å; F73-V77 HydrophobicContact CD2-CG2 4.1Å; F73-V77 HydrophobicContact CE1-CG2 4.14Å; F73-V77 HydrophobicContact CE2-CG2 3.63Å; F73-V77 HydrophobicContact CZ-CG2 3.65Å; F73-V77 WeakPolarHBondContact O-CG2 3.27Å; F73-V77 PolarHBondContact O-N 3.15Å; F73-S112 VanDerWaalsContact CA-OG 3.32Å; F73-S112 WeakPolarHBondContact CA-OG 3.48Å; F73-L113 HydrophobicContact CD2-CB 3.97Å; F73-L113 HydrophobicContact CD2-CD1 4.5Å; F73-L113 HydrophobicContact CE2-CB 3.92Å; F73-L113 HydrophobicContact CE2-CD1 4.06Å; F73-L113 HydrophobicContact CE2-CD2 4.36Å; F73-L113 HydrophobicContact CE2-CG 4.33Å; F73-L113 HydrophobicContact CZ-CD1 4.33Å; F73-L317 HydrophobicContact CE1-CD2 4.34Å; F73-L317 HydrophobicContact CE2-CD2 4.44Å; F73-L317 HydrophobicContact CZ-CD2 3.64Å; F73-L317 HydrophobicContact CZ-CG 4.32Å
74H97.5Very high94.9Very high0 Ų028.9 Ų28.90%015%0.154CC..Hα-helixtrans-65.5-28.1179.1-74.7-62.3000112.8L40 E70 C78 S321L40-H74 HydrophobicContact CB-CB 3.97Å; L40-H74 HydrophobicContact CD1-CB 4.18Å; E70-H74 WeakPolarHBondContact O-CB 3.32Å; E70-H74 PolarHBondContact O-CD2 3.29Å; E70-H74 PolarHBondContact O-N 3.22Å; E70-H74 IonicContact OE2-CD2 3.12Å; E70-H74 IonicContact OE2-NE2 3.75Å; H74-C78 VanDerWaalsContact O-CB 3.27Å; H74-C78 WeakPolarHBondContact O-CB 3.45Å; H74-C78 PolarHBondContact O-N 2.94Å; H74-C78 PolarHBondContact O-SG 3.13Å; H74-S321 WeakPolarHBondContact NE2-CB 3.15Å; H74-S321 PolarHBondContact NE2-OG 2.95Å
75F97.9Very high94.5Very high98 Ų9829.1 Ų29.143%0.4316%0.155SC..Hα-helixtrans-64.2-49.1173176.4-103.7000111.7L40 V71 L72 F73 C78 I79L40-F75 HydrophobicContact CD1-CB 4.12Å; V71-F75 WeakPolarHBondContact O-CB 3.35Å; V71-F75 PolarHBondContact O-N 3.49Å; L72-F75 WeakPolarHBondContact O-CB 3.43Å; L72-F75 PolarHBondContact O-N 3.3Å; F73-F75 PolarHBondContact O-N 3.49Å; F75-C78 PolarHBondContact O-N 3.25Å; F75-I79 HydrophobicContact CD1-CD1 3.85Å; F75-I79 HydrophobicContact CD2-CD1 4.32Å; F75-I79 HydrophobicContact CE1-CD1 3.37Å; F75-I79 HydrophobicContact CE2-CD1 3.89Å; F75-I79 HydrophobicContact CG-CD1 4.31Å; F75-I79 HydrophobicContact CZ-CD1 3.42Å; F75-I79 VanDerWaalsContact CZ-CD1 3.42Å; F75-I79 WeakPolarHBondContact O-CG1 3.5Å; F75-I79 PolarHBondContact O-N 2.93Å
76F96.6Very high94.1Very high45 Ų4532.8 Ų32.820%0.19717%0.173CC..Hα-helixtrans-64.9-42.5176.8-72.8-65.2000112.1L72 F73 C78 I79 E80 G108L72-F76 WeakPolarHBondContact O-CD2 3.5Å; L72-F76 PolarHBondContact O-N 3.16Å; F73-F76 PolarHBondContact O-N 3.46Å; F76-C78 PolarHBondContact O-N 3.01Å; F76-I79 PolarHBondContact O-N 3.37Å; F76-E80 WeakPolarHBondContact O-CB 3.47Å; F76-E80 PolarHBondContact O-N 3.31Å; F76-G108 WeakPolarHBondContact CD2-O 3.34Å
77V93.6Very high93.4Very high4 Ų434.7 Ų34.72%0.02419%0.185CC..Hα-helixtrans-59.4-45174.9170.30000111.3I32 F73 I79 E80 Y81I32-V77 HydrophobicContact CG2-CG1 4.44Å; F73-V77 HydrophobicContact CD2-CG2 4.1Å; F73-V77 HydrophobicContact CE1-CG2 4.14Å; F73-V77 HydrophobicContact CE2-CG2 3.63Å; F73-V77 HydrophobicContact CZ-CG2 3.65Å; F73-V77 WeakPolarHBondContact O-CG2 3.27Å; F73-V77 PolarHBondContact O-N 3.15Å; V77-I79 VanDerWaalsContact C-N 3.34Å; V77-I79 PolarHBondContact O-N 3.4Å; V77-E80 PolarHBondContact O-N 3.05Å; V77-Y81 HydrophobicContact CG1-CD2 3.64Å; V77-Y81 HydrophobicContact CG1-CE2 3.78Å; V77-Y81 WeakPolarHBondContact O-CD2 3.46Å; V77-Y81 PolarHBondContact O-N 2.8Å
78C96.3Very high92.5Very high13 Ų1337.6 Ų37.69%0.08821%0.206CC..Hα-helixtrans-59.7-45.2176.6-74.30000111.4L33 S36 H74 F75 F76 T82L33-C78 HydrophobicContact CD1-CB 4.3Å; S36-C78 PolarHBondContact OG-SG 3.49Å; S36-C78 VanDerWaalsContact OG-SG 3.39Å; H74-C78 VanDerWaalsContact O-CB 3.27Å; H74-C78 WeakPolarHBondContact O-CB 3.45Å; H74-C78 PolarHBondContact O-N 2.94Å; H74-C78 PolarHBondContact O-SG 3.13Å; F75-C78 PolarHBondContact O-N 3.25Å; F76-C78 PolarHBondContact O-N 3.01Å; C78-T82 WeakPolarHBondContact O-CB 3.23Å; C78-T82 PolarHBondContact O-N 3.34Å; C78-T82 PolarHBondContact O-OG1 2.85Å
79I95.4Very high91.8Very high52 Ų5239.9 Ų39.927%0.26722%0.22SC..Hα-helixtrans-63.9-45.1178.7-66.4169000110.2F75 F76 V77 T82 T83 I105F75-I79 HydrophobicContact CD1-CD1 3.85Å; F75-I79 HydrophobicContact CD2-CD1 4.32Å; F75-I79 HydrophobicContact CE1-CD1 3.37Å; F75-I79 HydrophobicContact CE2-CD1 3.89Å; F75-I79 HydrophobicContact CG-CD1 4.31Å; F75-I79 HydrophobicContact CZ-CD1 3.42Å; F75-I79 VanDerWaalsContact CZ-CD1 3.42Å; F75-I79 WeakPolarHBondContact O-CG1 3.5Å; F75-I79 PolarHBondContact O-N 2.93Å; F76-I79 PolarHBondContact O-N 3.37Å; V77-I79 VanDerWaalsContact C-N 3.34Å; V77-I79 PolarHBondContact O-N 3.4Å; I79-T82 PolarHBondContact O-N 2.95Å; I79-T83 WeakPolarHBondContact O-CB 3.34Å; I79-T83 PolarHBondContact O-N 3.14Å; I79-T83 PolarHBondContact O-OG1 3.4Å; I79-I105 HydrophobicContact CG2-CD1 3.43Å; I79-I105 VanDerWaalsContact CG2-CD1 3.43Å; I79-I105 HydrophobicContact CG2-CG1 3.72Å; I79-I105 HydrophobicContact CG2-CG2 4.36Å
80E91.4Very high91Very high7 Ų744 Ų443%0.03324%0.242CC..Hα-helixtrans-58.3-55.9179.9-169.7-174.816200111.5L2 F76 V77 T82 T83 Q84 I105L2-E80 WeakPolarHBondContact CD1-OE2 3.31Å; L2-E80 WeakPolarHBondContact CD2-OE1 3.48Å; L2-E80 WeakPolarHBondContact CD2-OE2 3.48Å; F76-E80 WeakPolarHBondContact O-CB 3.47Å; F76-E80 PolarHBondContact O-N 3.31Å; V77-E80 PolarHBondContact O-N 3.05Å; E80-T82 VanDerWaalsContact C-N 3.34Å; E80-T82 PolarHBondContact O-N 2.97Å; E80-T83 PolarHBondContact O-N 2.87Å; E80-T83 VanDerWaalsContact O-N 3.13Å; E80-Q84 WeakPolarHBondContact O-CG 3.48Å; E80-Q84 PolarHBondContact O-N 2.93Å; E80-Q84 PolarHBondContact OE1-NE2 3.37Å; E80-I105 HydrophobicContact CB-CG2 3.72Å; E80-I105 HydrophobicContact CG-CG2 4.27Å
81Y90.9Very high89.8Confident16 Ų1648.3 Ų48.36%0.06327%0.27CS..Hα-helixtrans-67-33.2-179.7-78.8-73.1000113L2 S29 I32 V77 T83 L85L2-Y81 HydrophobicContact CD2-CE2 3.98Å; S29-Y81 WeakPolarHBondContact OG-CD1 3.23Å; I32-Y81 HydrophobicContact CB-CE1 4.44Å; I32-Y81 HydrophobicContact CB-CE2 4.22Å; I32-Y81 HydrophobicContact CD1-CE1 3.95Å; I32-Y81 HydrophobicContact CD1-CE2 4.4Å; I32-Y81 VanDerWaalsContact CD1-OH 3.25Å; I32-Y81 WeakPolarHBondContact CD1-OH 3.18Å; I32-Y81 HydrophobicContact CG2-CD2 3.9Å; I32-Y81 HydrophobicContact CG2-CE1 4.48Å; I32-Y81 HydrophobicContact CG2-CE2 3.43Å; I32-Y81 VanDerWaalsContact CG2-CE2 3.43Å; V77-Y81 HydrophobicContact CG1-CD2 3.64Å; V77-Y81 HydrophobicContact CG1-CE2 3.78Å; V77-Y81 WeakPolarHBondContact O-CD2 3.46Å; V77-Y81 PolarHBondContact O-N 2.8Å; Y81-T83 VanDerWaalsContact C-N 3.33Å; Y81-L85 WeakPolarHBondContact O-CB 3.43Å; Y81-L85 PolarHBondContact O-N 3.39Å
82T92.4Very high88.7Confident56 Ų5655.2 Ų55.234%0.34429%0.292SS..Hα-helixtrans-64.1-42.1172.4-60.30000110.6C78 I79 E80 L85 I86C78-T82 WeakPolarHBondContact O-CB 3.23Å; C78-T82 PolarHBondContact O-N 3.34Å; C78-T82 PolarHBondContact O-OG1 2.85Å; I79-T82 PolarHBondContact O-N 2.95Å; E80-T82 VanDerWaalsContact C-N 3.34Å; E80-T82 PolarHBondContact O-N 2.97Å; T82-L85 WeakPolarHBondContact O-CB 3.14Å; T82-L85 PolarHBondContact O-N 2.79Å; T82-I86 HydrophobicContact CG2-CD1 3.9Å; T82-I86 VanDerWaalsContact O-CG1 3.3Å; T82-I86 WeakPolarHBondContact O-CG1 3.27Å; T82-I86 PolarHBondContact O-N 3.35Å
83T88.6Confident87.5Confident28 Ų2858.7 Ų58.717%0.17231%0.308CS..Hα-helixtrans-69.9-39.3-179.6-45.90000110.9I79 E80 Y81 L85 I86 C87 F102I79-T83 WeakPolarHBondContact O-CB 3.34Å; I79-T83 PolarHBondContact O-N 3.14Å; I79-T83 PolarHBondContact O-OG1 3.4Å; E80-T83 PolarHBondContact O-N 2.87Å; E80-T83 VanDerWaalsContact O-N 3.13Å; Y81-T83 VanDerWaalsContact C-N 3.33Å; T83-L85 VanDerWaalsContact C-N 3.33Å; T83-L85 PolarHBondContact O-N 3.3Å; T83-I86 PolarHBondContact O-N 2.99Å; T83-C87 WeakPolarHBondContact O-CB 3.31Å; T83-C87 PolarHBondContact O-N 3.29Å; T83-C87 PolarHBondContact O-SG 3.14Å; T83-C87 VanDerWaalsContact O-SG 3.33Å; T83-F102 HydrophobicContact CG2-CD1 4.22Å; T83-F102 HydrophobicContact CG2-CE1 3.13Å; T83-F102 HydrophobicContact CG2-CE2 4.41Å; T83-F102 HydrophobicContact CG2-CZ 3.25Å
84Q84.6Confident86.5Confident61 Ų6160.1 Ų60.129%0.28532%0.316SS..Hα-helixtrans-58.1-43.2171.3-70.7176.711.400112E80 C87 S88E80-Q84 WeakPolarHBondContact O-CG 3.48Å; E80-Q84 PolarHBondContact O-N 2.93Å; E80-Q84 PolarHBondContact OE1-NE2 3.37Å; Q84-C87 PolarHBondContact O-N 3.35Å; Q84-S88 WeakPolarHBondContact O-CB 3.48Å; Q84-S88 PolarHBondContact O-N 2.85Å; Q84-S88 PolarHBondContact O-OG 3.05Å
85L87.3Confident85.9Confident59 Ų5961.9 Ų61.931%0.30933%0.328SS..Hα-helixtrans-64.1-38.5177.4-169.780.4000112.6L26 Y81 T82 T83 S88 S89L26-L85 HydrophobicContact CD1-CD1 3.56Å; L26-L85 HydrophobicContact CG-CD1 4.39Å; Y81-L85 WeakPolarHBondContact O-CB 3.43Å; Y81-L85 PolarHBondContact O-N 3.39Å; T82-L85 WeakPolarHBondContact O-CB 3.14Å; T82-L85 PolarHBondContact O-N 2.79Å; T83-L85 VanDerWaalsContact C-N 3.33Å; T83-L85 PolarHBondContact O-N 3.3Å; L85-S88 PolarHBondContact O-OG 2.93Å; L85-S89 PolarHBondContact O-N 3.46Å; L85-S89 PolarHBondContact O-OG 3.28Å
86I87.6Confident85.2Confident102 Ų10262.3 Ų62.352%0.52334%0.341SS..Hα-helixtrans-70.4-46.3177.6-68166.6000110.3T82 T83 S89 N90T82-I86 HydrophobicContact CG2-CD1 3.9Å; T82-I86 VanDerWaalsContact O-CG1 3.3Å; T82-I86 WeakPolarHBondContact O-CG1 3.27Å; T82-I86 PolarHBondContact O-N 3.35Å; T83-I86 PolarHBondContact O-N 2.99Å; I86-S89 PolarHBondContact O-N 3.17Å; I86-N90 PolarHBondContact O-N 2.93Å
87C81.8Confident84.8Confident39 Ų3965.1 Ų65.126%0.26436%0.362SS..Hα-helixtrans-65.1-39.1-179.9-72.40000112.6T83 Q84 S89 N90T83-C87 WeakPolarHBondContact O-CB 3.31Å; T83-C87 PolarHBondContact O-N 3.29Å; T83-C87 PolarHBondContact O-SG 3.14Å; T83-C87 VanDerWaalsContact O-SG 3.33Å; Q84-C87 PolarHBondContact O-N 3.35Å; C87-S89 PolarHBondContact O-N 3.32Å; C87-N90 CarbonylContact O-C 3.38Å; C87-N90 PolarHBondContact O-N 3.47Å
88S78.1Confident84.5Confident62 Ų6269 Ų6943%0.43438%0.38SS..Hα-helixtrans-65.8-26.9176.565.30000112.9L26 Q84 L85L26-S88 WeakPolarHBondContact CD1-OG 3.23Å; Q84-S88 WeakPolarHBondContact O-CB 3.48Å; Q84-S88 PolarHBondContact O-N 2.85Å; Q84-S88 PolarHBondContact O-OG 3.05Å; L85-S88 PolarHBondContact O-OG 2.93Å
89S81.7Confident83.9Confident78 Ų7872.2 Ų72.255%0.54539%0.392SS..Hα-helixtrans-81.9-24.9-178.3-58.50000112.9L85 I86 C87L85-S89 PolarHBondContact O-N 3.46Å; L85-S89 PolarHBondContact O-OG 3.28Å; I86-S89 PolarHBondContact O-N 3.17Å; C87-S89 PolarHBondContact O-N 3.32Å
90N79.7Confident83.5Confident89 Ų8974.6 Ų74.648%0.47640%0.404SS..SBendtrans-144.989.1-179.2-76.7-65000109.9I86 C87 R92I86-N90 PolarHBondContact O-N 2.93Å; C87-N90 CarbonylContact O-C 3.38Å; C87-N90 PolarHBondContact O-N 3.47Å; N90-R92 HydrophobicContact CB-CG 4.44Å; N90-R92 PolarHBondContact O-N 3.15Å
91P71.6Confident83.5Confident93 Ų9378.8 Ų78.860%0.60443%0.427SS*.  trans-61.9109.2173.625.1-32.1000108.8E9E9-P91 WeakPolarHBondContact O-CB 3.43Å
92R76.4Confident83.3Confident179 Ų17979.1 Ų79.168%0.67543%0.428SS*.  trans-130.3157.9179.1-69.4-176.8-176.5-176.52.9109.3N90 I94N90-R92 HydrophobicContact CB-CG 4.44Å; N90-R92 PolarHBondContact O-N 3.15Å; R92-I94 PolarHBondContact O-N 2.92Å
93M70.4Confident83.2Confident147 Ų14777.2 Ų77.272%0.72442%0.418SS*.PPolyproline II helixtrans-61.9120.4172.4-71.2-105.9-178.400110.9Y10 S95Y10-M93 HydrophobicContact CD1-CE 3.72Å; Y10-M93 HydrophobicContact CD1-CG 3.77Å; Y10-M93 HydrophobicContact CD1-SD 3.65Å; Y10-M93 VanDerWaalsContact CE1-CA 3.47Å; Y10-M93 HydrophobicContact CE1-CB 3.87Å; Y10-M93 HydrophobicContact CE1-CE 4.02Å; Y10-M93 HydrophobicContact CE1-CG 3.47Å; Y10-M93 VanDerWaalsContact CE1-CG 3.47Å; Y10-M93 HydrophobicContact CE1-SD 3.3Å; Y10-M93 WeakPolarHBondContact CE1-SD 3.18Å; M93-S95 PolarHBondContact O-N 2.96Å
94I76Confident83.4Confident34 Ų3480.2 Ų80.217%0.17443%0.433CS..PPolyproline II helixtrans-79.1121.6-179.3-61.5-160.3000108.4L6 I8 Y10 R92 E98 F102L6-I94 HydrophobicContact CD2-CD1 3.47Å; L6-I94 VanDerWaalsContact CD2-CD1 3.47Å; L6-I94 HydrophobicContact CG-CD1 4.19Å; I8-I94 HydrophobicContact CD1-CB 4.09Å; I8-I94 HydrophobicContact CD1-CD1 3.25Å; I8-I94 HydrophobicContact CD1-CG1 3.66Å; I8-I94 HydrophobicContact CG1-CD1 3.57Å; I8-I94 HydrophobicContact CG1-CG1 4.21Å; I8-I94 HydrophobicContact CG2-CD1 4.4Å; I8-I94 HydrophobicContact CG2-CG1 4.27Å; Y10-I94 PolarHBondContact OH-N 3.45Å; R92-I94 PolarHBondContact O-N 2.92Å; I94-E98 WeakPolarHBondContact CA-OE2 3.19Å; I94-E98 HydrophobicContact CG2-CB 3.56Å; I94-F102 HydrophobicContact CD1-CE2 3.92Å; I94-F102 HydrophobicContact CD1-CZ 4.49Å; I94-F102 HydrophobicContact CG2-CE2 4.25Å
95S86Confident83.8Confident38 Ų3877.7 Ų77.727%0.26642%0.421SS..PPolyproline II helixtrans-67.3152.217561.20000110.9M93 T97 E98 F99M93-S95 PolarHBondContact O-N 2.96Å; S95-T97 PolarHBondContact O-N 3.09Å; S95-T97 VanDerWaalsContact O-N 3.09Å; S95-T97 PolarHBondContact OG-OG1 3.49Å; S95-E98 PolarHBondContact N-OE2 3.18Å; S95-E98 PolarHBondContact O-N 3.05Å; S95-E98 WeakPolarHBondContact OG-CB 3.15Å; S95-E98 VanDerWaalsContact OG-CG 3.22Å; S95-E98 WeakPolarHBondContact OG-CG 3.43Å; S95-E98 PolarHBondContact OG-N 3.47Å; S95-E98 PolarHBondContact OG-OE2 3.02Å; S95-F99 PolarHBondContact O-N 3.32Å
96P83.7Confident83.9Confident107 Ų10775.6 Ų75.670%0.69541%0.41SS*.Hα-helixtrans-54.4-31.4174.2-26.734.5000113.3F99 I100P96-F99 PolarHBondContact O-N 2.88Å; P96-I100 WeakPolarHBondContact O-CG1 3.43Å; P96-I100 PolarHBondContact O-N 3.44Å
97T88.1Confident84.2Confident103 Ų10374.2 Ų74.263%0.63240%0.399SS*.Hα-helixtrans-67.9-39.2176.1420000113.1S95 I100 L101S95-T97 PolarHBondContact O-N 3.09Å; S95-T97 VanDerWaalsContact O-N 3.09Å; S95-T97 PolarHBondContact OG-OG1 3.49Å; T97-I100 PolarHBondContact O-N 2.82Å; T97-L101 PolarHBondContact O-N 3.34Å
98E86.5Confident84.9Confident86 Ų8672.5 Ų72.540%0.40239%0.387SS..Hα-helixtrans-68.5-40.2174.5-75162.1153.900110.3I94 S95 I100 L101 F102I94-E98 WeakPolarHBondContact CA-OE2 3.19Å; I94-E98 HydrophobicContact CG2-CB 3.56Å; S95-E98 PolarHBondContact N-OE2 3.18Å; S95-E98 PolarHBondContact O-N 3.05Å; S95-E98 WeakPolarHBondContact OG-CB 3.15Å; S95-E98 VanDerWaalsContact OG-CG 3.22Å; S95-E98 WeakPolarHBondContact OG-CG 3.43Å; S95-E98 PolarHBondContact OG-N 3.47Å; S95-E98 PolarHBondContact OG-OE2 3.02Å; E98-I100 VanDerWaalsContact C-N 3.35Å; E98-I100 PolarHBondContact O-N 3.24Å; E98-L101 CarbonylContact O-C 3.6Å; E98-L101 WeakPolarHBondContact O-CA 3.41Å; E98-L101 WeakPolarHBondContact O-CB 3.41Å; E98-L101 PolarHBondContact O-N 3.47Å; E98-F102 HydrophobicContact CB-CE2 4.23Å; E98-F102 WeakPolarHBondContact O-CD2 3.22Å; E98-F102 PolarHBondContact O-N 2.95Å
99F83.3Confident85.6Confident81 Ų8169.6 Ų69.636%0.35537%0.367SS..Hα-helixtrans-57.1-46.5173.8-177.5-96.4000112.2S95 P96 L101 F102 A103S95-F99 PolarHBondContact O-N 3.32Å; P96-F99 PolarHBondContact O-N 2.88Å; F99-L101 VanDerWaalsContact C-N 3.28Å; F99-L101 PolarHBondContact O-N 3.34Å; F99-F102 PolarHBondContact O-N 3.4Å; F99-A103 PolarHBondContact O-N 3.18Å
100I88.5Confident86.2Confident101 Ų10166.2 Ų66.252%0.51834%0.343SS..Hα-helixtrans-60.6-40.1174.6-67.5164.4000110.9P96 T97 E98 A103 L104P96-I100 WeakPolarHBondContact O-CG1 3.43Å; P96-I100 PolarHBondContact O-N 3.44Å; T97-I100 PolarHBondContact O-N 2.82Å; E98-I100 VanDerWaalsContact C-N 3.35Å; E98-I100 PolarHBondContact O-N 3.24Å; I100-A103 PolarHBondContact O-N 2.91Å; I100-L104 HydrophobicContact CG2-CD1 4.08Å; I100-L104 HydrophobicContact CG2-CG 4.43Å; I100-L104 WeakPolarHBondContact O-CB 3.47Å; I100-L104 VanDerWaalsContact O-CG 3.3Å; I100-L104 WeakPolarHBondContact O-CG 3.48Å; I100-L104 PolarHBondContact O-N 3.25Å
101L90.7Very high86.9Confident96 Ų9662.1 Ų62.150%0.50332%0.321SS..Hα-helixtrans-62.9-44177.2-174.369.8000111.5T97 E98 F99 L104 I105T97-L101 PolarHBondContact O-N 3.34Å; E98-L101 CarbonylContact O-C 3.6Å; E98-L101 WeakPolarHBondContact O-CA 3.41Å; E98-L101 WeakPolarHBondContact O-CB 3.41Å; E98-L101 PolarHBondContact O-N 3.47Å; F99-L101 VanDerWaalsContact C-N 3.28Å; F99-L101 PolarHBondContact O-N 3.34Å; L101-L104 PolarHBondContact O-N 2.87Å; L101-I105 HydrophobicContact CG-CD1 3.93Å; L101-I105 WeakPolarHBondContact O-CD1 2.87Å; L101-I105 VanDerWaalsContact O-CG1 3.23Å; L101-I105 WeakPolarHBondContact O-CG1 3.31Å; L101-I105 PolarHBondContact O-N 2.91Å
102F87.2Confident88.1Confident22 Ų2257.9 Ų57.910%0.09629%0.294CS..Hα-helixtrans-60-47.5175.1-75-67.7000112.1L6 T83 I94 E98 F99 L104 I105 N106L6-F102 HydrophobicContact CD1-CD1 4.45Å; L6-F102 HydrophobicContact CD1-CE1 3.93Å; L6-F102 HydrophobicContact CD1-CE2 4.45Å; L6-F102 HydrophobicContact CD1-CZ 3.95Å; L6-F102 HydrophobicContact CD2-CD1 4.3Å; L6-F102 HydrophobicContact CD2-CD2 3.55Å; L6-F102 HydrophobicContact CD2-CE1 4.27Å; L6-F102 HydrophobicContact CD2-CE2 3.59Å; L6-F102 HydrophobicContact CD2-CG 3.95Å; L6-F102 HydrophobicContact CD2-CZ 3.94Å; T83-F102 HydrophobicContact CG2-CD1 4.22Å; T83-F102 HydrophobicContact CG2-CE1 3.13Å; T83-F102 HydrophobicContact CG2-CE2 4.41Å; T83-F102 HydrophobicContact CG2-CZ 3.25Å; I94-F102 HydrophobicContact CD1-CE2 3.92Å; I94-F102 HydrophobicContact CD1-CZ 4.49Å; I94-F102 HydrophobicContact CG2-CE2 4.25Å; E98-F102 HydrophobicContact CB-CE2 4.23Å; E98-F102 WeakPolarHBondContact O-CD2 3.22Å; E98-F102 PolarHBondContact O-N 2.95Å; F99-F102 PolarHBondContact O-N 3.4Å; F102-L104 VanDerWaalsContact C-N 3.26Å; F102-L104 PolarHBondContact O-N 3.42Å; F102-I105 PolarHBondContact O-N 2.97Å; F102-I105 VanDerWaalsContact O-N 3.12Å; F102-N106 PolarHBondContact O-N 2.87Å
103A88.8Confident89Confident16 Ų1649.6 Ų49.613%0.13226%0.263CS..Hα-helixtrans-58.5-40.1176.200000111.6F99 I100 W107 A165F99-A103 PolarHBondContact O-N 3.18Å; I100-A103 PolarHBondContact O-N 2.91Å; A103-W107 WeakPolarHBondContact O-CB 3.44Å; A103-W107 PolarHBondContact O-N 3Å; A103-A165 HydrophobicContact CB-CB 4.46Å
104L93Very high90.2Very high92 Ų9242.6 Ų42.648%0.48223%0.229SC..Hα-helixtrans-68.1-36.5175.6-73.5173.6000113.2I100 L101 F102 W107 G108I100-L104 HydrophobicContact CG2-CD1 4.08Å; I100-L104 HydrophobicContact CG2-CG 4.43Å; I100-L104 WeakPolarHBondContact O-CB 3.47Å; I100-L104 VanDerWaalsContact O-CG 3.3Å; I100-L104 WeakPolarHBondContact O-CG 3.48Å; I100-L104 PolarHBondContact O-N 3.25Å; L101-L104 PolarHBondContact O-N 2.87Å; F102-L104 VanDerWaalsContact C-N 3.26Å; F102-L104 PolarHBondContact O-N 3.42Å; L104-W107 HydrophobicContact CD2-CE3 4.48Å; L104-G108 PolarHBondContact O-N 3.15Å
105I92.8Very high91.2Very high7 Ų741 Ų414%0.03622%0.221CC..Hα-helixtrans-65.5-48.6175.9-68.8157.2000109.8I79 E80 L101 F102 G108 S109I79-I105 HydrophobicContact CG2-CD1 3.43Å; I79-I105 VanDerWaalsContact CG2-CD1 3.43Å; I79-I105 HydrophobicContact CG2-CG1 3.72Å; I79-I105 HydrophobicContact CG2-CG2 4.36Å; E80-I105 HydrophobicContact CB-CG2 3.72Å; E80-I105 HydrophobicContact CG-CG2 4.27Å; L101-I105 HydrophobicContact CG-CD1 3.93Å; L101-I105 WeakPolarHBondContact O-CD1 2.87Å; L101-I105 VanDerWaalsContact O-CG1 3.23Å; L101-I105 WeakPolarHBondContact O-CG1 3.31Å; L101-I105 PolarHBondContact O-N 2.91Å; F102-I105 PolarHBondContact O-N 2.97Å; F102-I105 VanDerWaalsContact O-N 3.12Å; I105-G108 PolarHBondContact O-N 3.37Å; I105-S109 WeakPolarHBondContact O-CB 3.45Å; I105-S109 PolarHBondContact O-N 3.41Å
106N90.1Very high91.7Very high15 Ų1539.2 Ų39.28%0.0821%0.208CC..Hα-helixtrans-63.6-45.2178.9-70.9-11.5000110.9G4 F102 G108 S109 D110 D168G4-N106 WeakPolarHBondContact CA-ND2 3.46Å; F102-N106 PolarHBondContact O-N 2.87Å; N106-G108 VanDerWaalsContact C-N 3.33Å; N106-G108 PolarHBondContact O-N 3.18Å; N106-S109 PolarHBondContact O-N 2.98Å; N106-D110 WeakPolarHBondContact O-CB 3.27Å; N106-D110 PolarHBondContact O-N 3.4Å; N106-D168 PolarHBondContact ND2-OD2 3.44Å
107W94Very high92.3Very high73 Ų7334.1 Ų34.128%0.27718%0.175SC..Hα-helixtrans-53.8-47.9171.7175.271.5000112.5A103 L104 C111 G158 A165A103-W107 WeakPolarHBondContact O-CB 3.44Å; A103-W107 PolarHBondContact O-N 3Å; L104-W107 HydrophobicContact CD2-CE3 4.48Å; W107-C111 WeakPolarHBondContact O-CB 3.49Å; W107-C111 PolarHBondContact O-N 3.05Å; W107-G158 PolarHBondContact NE1-O 3.33Å; W107-A165 HydrophobicContact CB-CB 3.92Å
108G95.4Very high92.8Very high3 Ų331 Ų313%0.03115%0.151CC..Hα-helixtrans-64.7-42.5179.600000112.8F76 L104 I105 N106 S112F76-G108 WeakPolarHBondContact CD2-O 3.34Å; L104-G108 PolarHBondContact O-N 3.15Å; I105-G108 PolarHBondContact O-N 3.37Å; N106-G108 VanDerWaalsContact C-N 3.33Å; N106-G108 PolarHBondContact O-N 3.18Å; G108-S112 VanDerWaalsContact O-CB 3.24Å; G108-S112 WeakPolarHBondContact O-CB 3.24Å; G108-S112 PolarHBondContact O-N 3.21Å; G108-S112 PolarHBondContact O-OG 3.36Å
109S94Very high93.3Very high1 Ų127 Ų271%0.00713%0.133CC..Hα-helixtrans-61.4-49.1176.7-166.50000111.4L2 I105 N106 S112 L113L2-S109 WeakPolarHBondContact CD1-OG 3.34Å; I105-S109 WeakPolarHBondContact O-CB 3.45Å; I105-S109 PolarHBondContact O-N 3.41Å; N106-S109 PolarHBondContact O-N 2.98Å; S109-S112 PolarHBondContact O-N 3.39Å; S109-S112 PolarHBondContact O-OG 3.18Å; S109-L113 VanDerWaalsContact O-CB 3.27Å; S109-L113 WeakPolarHBondContact O-CB 3.43Å; S109-L113 PolarHBondContact O-N 2.9Å
110D93.2Very high93.9Very high8 Ų823.4 Ų23.44%0.04312%0.118CC..Hα-helixtrans-67.3-42.9179.5-82.9-35.2000113N106 L113 C114 A161 R164 F227N106-D110 WeakPolarHBondContact O-CB 3.27Å; N106-D110 PolarHBondContact O-N 3.4Å; D110-L113 PolarHBondContact O-N 3.47Å; D110-C114 VanDerWaalsContact O-CB 3.31Å; D110-C114 WeakPolarHBondContact O-CB 3.34Å; D110-C114 PolarHBondContact O-N 3.27Å; D110-A161 HydrophobicContact CB-CB 3.88Å; D110-R164 IonicContact OD1-NE 2.74Å; D110-R164 WeakPolarHBondContact OD2-CD 3.47Å; D110-R164 WeakPolarHBondContact OD2-CG 3.18Å; D110-R164 IonicContact OD2-NE 3.68Å; D110-R164 PolarHBondContact OD2-NE 3.25Å; D110-F227 HydrophobicContact CB-CZ 3.83Å
111C96.2Very high94.3Very high2 Ų219.3 Ų19.31%0.01410%0.097CC..Hα-helixtrans-61.6-46176.5178.20000111.5W107 C114 T115 A161W107-C111 WeakPolarHBondContact O-CB 3.49Å; W107-C111 PolarHBondContact O-N 3.05Å; C111-C114 PolarHBondContact O-N 3.05Å; C111-T115 WeakPolarHBondContact O-CB 3.33Å; C111-T115 PolarHBondContact O-N 2.89Å; C111-T115 PolarHBondContact O-OG1 2.94Å; C111-A161 HydrophobicContact CB-CB 4.07Å
112S96.5Very high94.6Very high4 Ų415.8 Ų15.83%0.0288%0.079CC..Hα-helixtrans-67.6-41.6179.760.60000112F73 G108 S109 T115 R116F73-S112 VanDerWaalsContact CA-OG 3.32Å; F73-S112 WeakPolarHBondContact CA-OG 3.48Å; G108-S112 VanDerWaalsContact O-CB 3.24Å; G108-S112 WeakPolarHBondContact O-CB 3.24Å; G108-S112 PolarHBondContact O-N 3.21Å; G108-S112 PolarHBondContact O-OG 3.36Å; S109-S112 PolarHBondContact O-N 3.39Å; S109-S112 PolarHBondContact O-OG 3.18Å; S112-T115 PolarHBondContact O-N 2.88Å; S112-R116 VanDerWaalsContact O-CB 3.27Å; S112-R116 WeakPolarHBondContact O-CB 3.16Å; S112-R116 PolarHBondContact O-N 3.06Å
113L94.9Very high95Very high6 Ų615.1 Ų15.13%0.0318%0.076CC..Hα-helixtrans-61.7-45175.618054.8000112F73 S109 D110 R116 N117 L317F73-L113 HydrophobicContact CD2-CB 3.97Å; F73-L113 HydrophobicContact CD2-CD1 4.5Å; F73-L113 HydrophobicContact CE2-CB 3.92Å; F73-L113 HydrophobicContact CE2-CD1 4.06Å; F73-L113 HydrophobicContact CE2-CD2 4.36Å; F73-L113 HydrophobicContact CE2-CG 4.33Å; F73-L113 HydrophobicContact CZ-CD1 4.33Å; S109-L113 VanDerWaalsContact O-CB 3.27Å; S109-L113 WeakPolarHBondContact O-CB 3.43Å; S109-L113 PolarHBondContact O-N 2.9Å; D110-L113 PolarHBondContact O-N 3.47Å; L113-R116 WeakPolarHBondContact O-CB 3.47Å; L113-R116 PolarHBondContact O-N 3.31Å; L113-N117 PolarHBondContact O-N 3.15Å; L113-N117 VanDerWaalsContact O-N 3.14Å; L113-N117 PolarHBondContact O-OD1 3.19Å; L113-L317 HydrophobicContact CD1-CD1 4.21Å; L113-L317 HydrophobicContact CD1-CD2 3.96Å; L113-L317 HydrophobicContact CD1-CG 4.45Å; L113-L317 HydrophobicContact CD2-CD2 4.22Å
114C96Very high95.3Very high0 Ų014.6 Ų14.60%07%0.071CC..Hα-helixtrans-64.2-47.1177.4-166.70000111.6D110 C111 R116 N117 W118 F230 Q231D110-C114 VanDerWaalsContact O-CB 3.31Å; D110-C114 WeakPolarHBondContact O-CB 3.34Å; D110-C114 PolarHBondContact O-N 3.27Å; C111-C114 PolarHBondContact O-N 3.05Å; C114-R116 VanDerWaalsContact C-N 3.3Å; C114-R116 PolarHBondContact O-N 3.35Å; C114-N117 PolarHBondContact O-N 2.81Å; C114-W118 VanDerWaalsContact O-CD1 3.31Å; C114-W118 PolarHBondContact O-N 3.24Å; C114-F230 WeakPolarHBondContact SG-CD1 3.33Å; C114-F230 WeakPolarHBondContact SG-CE1 3.38Å; C114-Q231 HydrophobicContact CB-CG 4.09Å
115T96.9Very high95.4Very high1 Ų112 Ų121%0.0066%0.061CC..Hα-helixtrans-60.9-39.7177.7-55.20000111.7T69 C111 S112 W118 C119 Y150 W154T69-T115 HydrophobicContact CG2-CG2 3.84Å; C111-T115 WeakPolarHBondContact O-CB 3.33Å; C111-T115 PolarHBondContact O-N 2.89Å; C111-T115 PolarHBondContact O-OG1 2.94Å; S112-T115 PolarHBondContact O-N 2.88Å; T115-W118 PolarHBondContact O-N 2.89Å; T115-C119 WeakPolarHBondContact O-CB 3.34Å; T115-C119 PolarHBondContact O-N 2.67Å; T115-Y150 HydrophobicContact CG2-CD2 4.25Å; T115-Y150 HydrophobicContact CG2-CE2 3.39Å; T115-W154 HydrophobicContact CG2-CB 4.21Å; T115-W154 HydrophobicContact CG2-CG 4.5Å
116R96.3Very high95.5Very high0 Ų012.3 Ų12.30%06%0.064CC..Hα-helixtrans-59.2-47.8175.8-175.7-166.572.1154.110.9111.5L66 E70 S112 L113 C114 W118 C119 N120 L317L66-R116 HydrophobicContact CD1-CG 4.18Å; E70-R116 VanDerWaalsContact CD-CD 3.49Å; E70-R116 WeakPolarHBondContact OE1-CD 3.42Å; E70-R116 WeakPolarHBondContact OE2-CD 3.19Å; E70-R116 IonicContact OE2-NH1 3.75Å; S112-R116 VanDerWaalsContact O-CB 3.27Å; S112-R116 WeakPolarHBondContact O-CB 3.16Å; S112-R116 PolarHBondContact O-N 3.06Å; L113-R116 WeakPolarHBondContact O-CB 3.47Å; L113-R116 PolarHBondContact O-N 3.31Å; C114-R116 VanDerWaalsContact C-N 3.3Å; C114-R116 PolarHBondContact O-N 3.35Å; R116-W118 PolarHBondContact O-N 2.93Å; R116-C119 VanDerWaalsContact O-CB 3.27Å; R116-C119 WeakPolarHBondContact O-CB 3.35Å; R116-C119 PolarHBondContact O-N 3.34Å; R116-C119 VanDerWaalsContact O-N 3.13Å; R116-N120 PolarHBondContact O-N 2.85Å; R116-L317 PolarHBondContact NH1-O 2.94Å
117N96.6Very high95.6Very high0 Ų013.2 Ų13.20%07%0.067CC..Hα-helixtrans-63.4-42.2179.7-67.4-4.8000111.5L113 C114 C119 N120 V121 Q231 P235 F283L113-N117 PolarHBondContact O-N 3.15Å; L113-N117 VanDerWaalsContact O-N 3.14Å; L113-N117 PolarHBondContact O-OD1 3.19Å; C114-N117 PolarHBondContact O-N 2.81Å; N117-C119 VanDerWaalsContact C-N 3.32Å; N117-C119 PolarHBondContact O-N 3.18Å; N117-N120 WeakPolarHBondContact O-CB 3.49Å; N117-N120 PolarHBondContact O-N 2.9Å; N117-V121 PolarHBondContact O-N 2.95Å; N117-Q231 PolarHBondContact ND2-O 3.1Å; N117-P235 HydrophobicContact CB-CB 3.99Å; N117-P235 HydrophobicContact CB-CG 4.16Å; N117-F283 HydrophobicContact CB-CE2 4.3Å; N117-F283 HydrophobicContact CB-CZ 4.26Å; N117-F283 WeakPolarHBondContact OD1-CE2 3.34Å
118W97.7Very high95.6Very high36 Ų3610.4 Ų10.414%0.1366%0.057CC..Hα-helixtrans-68.1-29.5174.1-81.6104.3000113.4C114 T115 R116 N120 V121 L122 L153 F230 A234 P235 F238C114-W118 VanDerWaalsContact O-CD1 3.31Å; C114-W118 PolarHBondContact O-N 3.24Å; T115-W118 PolarHBondContact O-N 2.89Å; R116-W118 PolarHBondContact O-N 2.93Å; W118-N120 VanDerWaalsContact C-N 3.31Å; W118-N120 PolarHBondContact O-N 3.39Å; W118-V121 HydrophobicContact CE3-CB 4.2Å; W118-V121 HydrophobicContact CE3-CG1 4.31Å; W118-V121 HydrophobicContact CE3-CG2 4.21Å; W118-V121 HydrophobicContact CZ3-CG1 4.34Å; W118-V121 WeakPolarHBondContact O-CB 3.38Å; W118-V121 PolarHBondContact O-N 3.37Å; W118-L122 PolarHBondContact O-N 2.99Å; W118-L153 HydrophobicContact CB-CD1 4.17Å; W118-L153 HydrophobicContact CB-CD2 4.45Å; W118-L153 HydrophobicContact CD2-CD2 4Å; W118-L153 HydrophobicContact CE3-CD2 4.07Å; W118-L153 HydrophobicContact CG-CD2 4.17Å; W118-F230 AromaticContact CD1-CE1 3.81Å; W118-F230 AromaticContact CD1-CZ 3.88Å; W118-F230 AromaticContact CE2-CE2 3.63Å; W118-F230 AromaticContact CE2-CZ 3.68Å; W118-F230 HydrophobicContact CH2-CE2 4.47Å; W118-F230 AromaticContact CZ2-CD2 3.72Å; W118-F230 HydrophobicContact CZ2-CD2 3.72Å; W118-F230 AromaticContact CZ2-CE2 3.48Å; W118-F230 HydrophobicContact CZ2-CE2 3.48Å; W118-F230 VanDerWaalsContact CZ2-CE2 3.48Å; W118-F230 HydrophobicContact CZ2-CG 4.45Å; W118-F230 HydrophobicContact CZ2-CZ 4.04Å; W118-F230 AromaticContact NE1-CD1 3.64Å; W118-F230 AromaticContact NE1-CD2 3.92Å; W118-F230 AromaticContact NE1-CE1 3.27Å; W118-F230 VanDerWaalsContact NE1-CE1 3.27Å; W118-F230 AromaticContact NE1-CE2 3.56Å; W118-F230 AromaticContact NE1-CG 3.95Å; W118-F230 AromaticContact NE1-CZ 3.22Å; W118-F230 PolarHBondContact NE1-O 3.49Å; W118-A234 HydrophobicContact CZ2-CB 4.38Å; W118-P235 HydrophobicContact CD2-CG 4.16Å; W118-P235 HydrophobicContact CG-CG 4.35Å; W118-P235 HydrophobicContact CZ2-CG 4.26Å; W118-F238 HydrophobicContact CH2-CD2 4.4Å; W118-F238 HydrophobicContact CH2-CE2 4.28Å; W118-F238 HydrophobicContact CZ3-CD2 4.46Å
119C96.6Very high95.5Very high2 Ų211.6 Ų11.61%0.0146%0.062CC..Hα-helixtrans-61.7-40.6172.4-165.60000111.5L66 T115 R116 N117 V121 L122 I123L66-C119 HydrophobicContact CD1-CB 4.18Å; T115-C119 WeakPolarHBondContact O-CB 3.34Å; T115-C119 PolarHBondContact O-N 2.67Å; R116-C119 VanDerWaalsContact O-CB 3.27Å; R116-C119 WeakPolarHBondContact O-CB 3.35Å; R116-C119 PolarHBondContact O-N 3.34Å; R116-C119 VanDerWaalsContact O-N 3.13Å; N117-C119 VanDerWaalsContact C-N 3.32Å; N117-C119 PolarHBondContact O-N 3.18Å; C119-V121 VanDerWaalsContact C-N 3.32Å; C119-V121 PolarHBondContact O-N 3.24Å; C119-L122 PolarHBondContact O-N 3.27Å; C119-L122 VanDerWaalsContact O-N 3.14Å; C119-I123 WeakPolarHBondContact O-CG1 3.45Å; C119-I123 PolarHBondContact O-N 3.48Å
120N96.5Very high95.4Very high7 Ų712.6 Ų12.64%0.0377%0.068CC..Hα-helixtrans-62-38.2173.7-74.3-27.9000112.3R116 N117 W118 I123 T124 V239 F283R116-N120 PolarHBondContact O-N 2.85Å; N117-N120 WeakPolarHBondContact O-CB 3.49Å; N117-N120 PolarHBondContact O-N 2.9Å; W118-N120 VanDerWaalsContact C-N 3.31Å; W118-N120 PolarHBondContact O-N 3.39Å; N120-I123 PolarHBondContact O-N 3.25Å; N120-T124 WeakPolarHBondContact O-CB 3.25Å; N120-T124 WeakPolarHBondContact O-CG2 3.29Å; N120-T124 PolarHBondContact O-N 3.43Å; N120-T124 PolarHBondContact O-OG1 2.8Å; N120-V239 HydrophobicContact CB-CG2 4.34Å; N120-F283 HydrophobicContact CB-CG 4.47Å; N120-F283 WeakPolarHBondContact ND2-CD2 3.48Å
121V97.3Very high95.3Very high14 Ų1412.5 Ų12.59%0.0857%0.068CC..Hα-helixtrans-61.7-44.5171.8-179.30000111.1N117 W118 C119 T124 S125 P235 F238 V239N117-V121 PolarHBondContact O-N 2.95Å; W118-V121 HydrophobicContact CE3-CB 4.2Å; W118-V121 HydrophobicContact CE3-CG1 4.31Å; W118-V121 HydrophobicContact CE3-CG2 4.21Å; W118-V121 HydrophobicContact CZ3-CG1 4.34Å; W118-V121 WeakPolarHBondContact O-CB 3.38Å; W118-V121 PolarHBondContact O-N 3.37Å; C119-V121 VanDerWaalsContact C-N 3.32Å; C119-V121 PolarHBondContact O-N 3.24Å; V121-T124 WeakPolarHBondContact CA-OG1 3.27Å; V121-T124 PolarHBondContact O-N 3.13Å; V121-T124 PolarHBondContact O-OG1 2.72Å; V121-S125 WeakPolarHBondContact O-CB 3.39Å; V121-S125 PolarHBondContact O-N 2.94Å; V121-P235 VanDerWaalsContact CG2-CA 3.49Å; V121-P235 HydrophobicContact CG2-CB 3.69Å; V121-P235 HydrophobicContact CG2-CG 4.47Å; V121-F238 HydrophobicContact CG1-CB 3.86Å; V121-F238 HydrophobicContact CG1-CG 4.36Å; V121-F238 HydrophobicContact CG2-CB 4.18Å; V121-V239 HydrophobicContact CG2-CG2 4Å
122L96.1Very high95.1Very high22 Ų2213.4 Ų13.412%0.1157%0.073CC..Hα-helixtrans-64.1-42.9178.2-68.6-177.9000112.5W118 C119 A126 I149 L153W118-L122 PolarHBondContact O-N 2.99Å; C119-L122 PolarHBondContact O-N 3.27Å; C119-L122 VanDerWaalsContact O-N 3.14Å; L122-A126 VanDerWaalsContact O-CB 3.27Å; L122-A126 WeakPolarHBondContact O-CB 3.33Å; L122-A126 PolarHBondContact O-N 2.93Å; L122-I149 HydrophobicContact CD1-CG2 4.16Å; L122-I149 HydrophobicContact CD2-CG2 3.62Å; L122-L153 HydrophobicContact CD1-CD1 3.79Å; L122-L153 HydrophobicContact CD2-CD1 4.14Å; L122-L153 HydrophobicContact CG-CD1 4.03Å
123I95.6Very high94.7Very high9 Ų919.2 Ų19.25%0.04610%0.095CC..Hα-helixtrans-62-48177.7-73.5163.9000110.7L66 C119 N120 R127 I276L66-I123 HydrophobicContact CB-CD1 3.87Å; L66-I123 HydrophobicContact CD2-CD1 3.59Å; L66-I123 HydrophobicContact CG-CD1 4.25Å; C119-I123 WeakPolarHBondContact O-CG1 3.45Å; C119-I123 PolarHBondContact O-N 3.48Å; N120-I123 PolarHBondContact O-N 3.25Å; I123-R127 WeakPolarHBondContact O-CB 3.13Å; I123-R127 VanDerWaalsContact O-CG 3.22Å; I123-R127 WeakPolarHBondContact O-CG 3.33Å; I123-R127 PolarHBondContact O-N 2.9Å; I123-R127 VanDerWaalsContact O-N 3.15Å; I123-I276 HydrophobicContact CG2-CD1 3.67Å; I123-I276 HydrophobicContact CG2-CG1 4.46Å; I123-I276 HydrophobicContact CG2-CG2 3.94Å
124T96.2Very high94.2Very high4 Ų423.1 Ų23.13%0.02512%0.121CC..Hα-helixtrans-67.3-42.9179.750.60000111.4N120 V121 R127 T128 V239 I276 A280N120-T124 WeakPolarHBondContact O-CB 3.25Å; N120-T124 WeakPolarHBondContact O-CG2 3.29Å; N120-T124 PolarHBondContact O-N 3.43Å; N120-T124 PolarHBondContact O-OG1 2.8Å; V121-T124 WeakPolarHBondContact CA-OG1 3.27Å; V121-T124 PolarHBondContact O-N 3.13Å; V121-T124 PolarHBondContact O-OG1 2.72Å; T124-R127 CarbonylContact O-C 3.58Å; T124-R127 WeakPolarHBondContact O-CB 3.34Å; T124-R127 PolarHBondContact O-N 3.49Å; T124-R127 VanDerWaalsContact O-N 3.1Å; T124-T128 PolarHBondContact O-N 3.21Å; T124-T128 PolarHBondContact O-OG1 3.1Å; T124-V239 HydrophobicContact CG2-CG1 4.23Å; T124-V239 HydrophobicContact CG2-CG2 4.38Å; T124-I276 HydrophobicContact CG2-CG2 4.28Å; T124-A280 HydrophobicContact CG2-CB 3.95Å
125S95.1Very high93.6Very high38 Ų3831.7 Ų31.727%0.26616%0.163SC..Hα-helixtrans-59.7-47.3175.3-178.80000112.6V121 R127 T128 E129V121-S125 WeakPolarHBondContact O-CB 3.39Å; V121-S125 PolarHBondContact O-N 2.94Å; S125-R127 PolarHBondContact O-N 3.39Å; S125-T128 PolarHBondContact O-N 3.11Å; S125-E129 PolarHBondContact O-N 2.89Å
126A93.7Very high93Very high13 Ų1339.2 Ų39.211%0.10719%0.192CC..Hα-helixtrans-58.4-32.5175.100000112.4L122 V130 L141L122-A126 VanDerWaalsContact O-CB 3.27Å; L122-A126 WeakPolarHBondContact O-CB 3.33Å; L122-A126 PolarHBondContact O-N 2.93Å; A126-V130 WeakPolarHBondContact O-CG2 3.2Å; A126-V130 PolarHBondContact O-N 3.04Å; A126-L141 VanDerWaalsContact CA-CD1 3.41Å; A126-L141 HydrophobicContact CB-CD1 3.94Å
127R93.2Very high92.3Very high35 Ų3546.1 Ų46.113%0.13222%0.222CC..Hα-helixtrans-80.6-37.8178.9-73.7-86.1171.1-139.27.6112.3M59 I123 T124 S125 E129 V130 V131 I246 I276M59-R127 PolarHBondContact SD-NH2 3.28Å; I123-R127 WeakPolarHBondContact O-CB 3.13Å; I123-R127 VanDerWaalsContact O-CG 3.22Å; I123-R127 WeakPolarHBondContact O-CG 3.33Å; I123-R127 PolarHBondContact O-N 2.9Å; I123-R127 VanDerWaalsContact O-N 3.15Å; T124-R127 CarbonylContact O-C 3.58Å; T124-R127 WeakPolarHBondContact O-CB 3.34Å; T124-R127 PolarHBondContact O-N 3.49Å; T124-R127 VanDerWaalsContact O-N 3.1Å; S125-R127 PolarHBondContact O-N 3.39Å; R127-E129 VanDerWaalsContact C-N 3.32Å; R127-E129 PolarHBondContact O-N 3.37Å; R127-V130 PolarHBondContact O-N 2.87Å; R127-V131 VanDerWaalsContact O-CG2 3.31Å; R127-V131 WeakPolarHBondContact O-CG2 3.47Å; R127-V131 PolarHBondContact O-N 3.03Å; R127-I246 HydrophobicContact CB-CD1 4.28Å; R127-I276 HydrophobicContact CB-CG2 4.12Å; R127-I276 HydrophobicContact CG-CB 4.2Å; R127-I276 HydrophobicContact CG-CG1 3.81Å; R127-I276 HydrophobicContact CG-CG2 3.94Å
128T94.5Very high91.2Very high13 Ų1350.6 Ų50.68%0.0824%0.238CC..Hα-helixtrans-58.9-43.9170.6-55.10000110.9T124 S125 V130 V131 V132 M242 I245 I246T124-T128 PolarHBondContact O-N 3.21Å; T124-T128 PolarHBondContact O-OG1 3.1Å; S125-T128 PolarHBondContact O-N 3.11Å; T128-V130 VanDerWaalsContact C-N 3.33Å; T128-V130 PolarHBondContact O-N 3.39Å; T128-V131 PolarHBondContact O-N 2.79Å; T128-V132 HydrophobicContact CG2-CG2 3.74Å; T128-V132 WeakPolarHBondContact O-CB 3.5Å; T128-V132 WeakPolarHBondContact O-CG2 3.18Å; T128-V132 PolarHBondContact O-N 3.29Å; T128-M242 HydrophobicContact CG2-SD 3.75Å; T128-I245 HydrophobicContact CG2-CG2 3.96Å; T128-I246 WeakPolarHBondContact OG1-CD1 3.11Å
129E93Very high90.2Very high28 Ų2858.9 Ų58.913%0.13127%0.27CS..Hα-helixtrans-57.9-45.4176.9-173.9180177.100111.5S125 R127 V131 Y133 L141S125-E129 PolarHBondContact O-N 2.89Å; R127-E129 VanDerWaalsContact C-N 3.32Å; R127-E129 PolarHBondContact O-N 3.37Å; E129-V131 PolarHBondContact O-N 2.97Å; E129-Y133 CarbonylContact O-C 3.6Å; E129-Y133 WeakPolarHBondContact O-CA 3.39Å; E129-Y133 WeakPolarHBondContact O-CB 3.5Å; E129-Y133 PolarHBondContact O-N 3.44Å; E129-L141 HydrophobicContact CB-CD1 4.49Å; E129-L141 WeakPolarHBondContact OE2-CB 3.48Å; E129-L141 WeakPolarHBondContact OE2-CD1 3.35Å; E129-L141 WeakPolarHBondContact OE2-CG 3.35Å
130V90.7Very high89.3Confident22 Ų2264.1 Ų64.113%0.13330%0.297CS..Hα-helixtrans-66.1-37.4179.8173.30000112.5A126 R127 T128A126-V130 WeakPolarHBondContact O-CG2 3.2Å; A126-V130 PolarHBondContact O-N 3.04Å; R127-V130 PolarHBondContact O-N 2.87Å; T128-V130 VanDerWaalsContact C-N 3.33Å; T128-V130 PolarHBondContact O-N 3.39Å
131V91.3Very high88.6Confident7 Ų764.6 Ų64.64%0.04230%0.299CS..Hα-helixtrans-78.5-44.1-177.4171.60000111.7R127 T128 E129 V250 T273R127-V131 VanDerWaalsContact O-CG2 3.31Å; R127-V131 WeakPolarHBondContact O-CG2 3.47Å; R127-V131 PolarHBondContact O-N 3.03Å; T128-V131 PolarHBondContact O-N 2.79Å; E129-V131 PolarHBondContact O-N 2.97Å; V131-V250 HydrophobicContact CG1-CG2 4.29Å; V131-T273 HydrophobicContact CG2-CG2 3.81Å
132V92.2Very high88Confident20 Ų2066.7 Ų66.712%0.12131%0.314CS..Hα-helixtrans-81.1-35.7-175.4178.90000111.6T128 P134 I245 Y249T128-V132 HydrophobicContact CG2-CG2 3.74Å; T128-V132 WeakPolarHBondContact O-CB 3.5Å; T128-V132 WeakPolarHBondContact O-CG2 3.18Å; T128-V132 PolarHBondContact O-N 3.29Å; V132-P134 WeakPolarHBondContact O-CD 3.25Å; V132-I245 HydrophobicContact CG2-CG2 3.71Å; V132-Y249 HydrophobicContact CB-CE1 4.5Å; V132-Y249 HydrophobicContact CG1-CE1 4.07Å; V132-Y249 HydrophobicContact CG1-CE2 4.39Å; V132-Y249 HydrophobicContact CG2-CD1 4.37Å; V132-Y249 HydrophobicContact CG2-CD2 4.02Å; V132-Y249 HydrophobicContact CG2-CE1 4.44Å; V132-Y249 HydrophobicContact CG2-CE2 4.09Å; V132-Y249 HydrophobicContact CG2-CG 4.16Å
133Y89.2Confident87.5Confident126 Ų12668.4 Ų68.449%0.49432%0.322SS..  trans-123.959.8-174.6-56.2-68.6000113.3E129 M135 R136E129-Y133 CarbonylContact O-C 3.6Å; E129-Y133 WeakPolarHBondContact O-CA 3.39Å; E129-Y133 WeakPolarHBondContact O-CB 3.5Å; E129-Y133 PolarHBondContact O-N 3.44Å; Y133-M135 PolarHBondContact O-N 3.32Å; Y133-R136 PolarHBondContact O-N 2.89Å; Y133-R136 VanDerWaalsContact O-N 3.17Å
134P83.6Confident87.2Confident88 Ų8872.2 Ų72.257%0.57135%0.349SS*.THydrogen-bonded Turntrans-61.7-22.3-175.225.7-35.4000114.2V132V132-P134 WeakPolarHBondContact O-CD 3.25Å
135M83Confident87Confident180 Ų18073.6 Ų73.689%0.88736%0.359SS*.THydrogen-bonded Turntrans-99.2-9-177.6-64.2-62.5-174.800114.2Y133Y133-M135 PolarHBondContact O-N 3.32Å
136R84.9Confident86.8Confident160 Ų16072.3 Ų72.360%0.60435%0.349SS*.SBendtrans-82129.2-178.1-167.5173.6-176.3167.60.4109Y133 R138Y133-R136 PolarHBondContact O-N 2.89Å; Y133-R136 VanDerWaalsContact O-N 3.17Å; R136-R138 PolarHBondContact O-N 3.08Å; R136-R138 VanDerWaalsContact O-N 3.09Å
137K80.7Confident86.7Confident145 Ų14577.1 Ų77.163%0.6337%0.368SS*.  trans-57.1117.9170.3-174.3171.5-175.9172.10108R139K137-R139 PolarHBondContact O-N 3.34Å
138R75.1Confident86.8Confident93 Ų9382.8 Ų82.835%0.35139%0.393SS..  trans-60.499.4-179.4-63.5-177.9-168.5147.910.8108.9R136 D480R136-R138 PolarHBondContact O-N 3.08Å; R136-R138 VanDerWaalsContact O-N 3.09Å; R138-D480 IonicContact CZ-OD2 3.74Å; R138-D480 IonicContact NH1-OD1 3.36Å; R138-D480 PolarHBondContact NH1-OD1 2.95Å; R138-D480 IonicContact NH1-OD2 3.02Å; R138-D480 PolarHBondContact NH1-OD2 3.14Å; R138-D480 VanDerWaalsContact NH1-OD2 3.12Å; R138-D480 IonicContact NH2-OD2 2.66Å; R138-D480 PolarHBondContact NH2-OD2 3.06Å
139R76Confident86.8Confident211 Ų21184.2 Ų84.280%0.79640%0.4SS*.  trans-97.3-36.2177.8-72.4-171.5-173.9174.41.5111.9K137K137-R139 PolarHBondContact O-N 3.34Å
140I77.7Confident86.9Confident112 Ų11284.8 Ų84.857%0.57440%0.401SS*.SBendtrans-85.4-46.5-168.6-58.5173.4000110.6S142 S145I140-S142 PolarHBondContact O-N 3.28Å; I140-S145 WeakPolarHBondContact O-CB 3.41Å; I140-S145 PolarHBondContact O-OG 3.36Å
141L81.5Confident87.1Confident16 Ų1685.1 Ų85.18%0.08441%0.409CS..SBendtrans-104.450-176.6-59.4175.6000112.2A126 E129 I146 I149A126-L141 VanDerWaalsContact CA-CD1 3.41Å; A126-L141 HydrophobicContact CB-CD1 3.94Å; E129-L141 HydrophobicContact CB-CD1 4.49Å; E129-L141 WeakPolarHBondContact OE2-CB 3.48Å; E129-L141 WeakPolarHBondContact OE2-CD1 3.35Å; E129-L141 WeakPolarHBondContact OE2-CG 3.35Å; L141-I146 HydrophobicContact CB-CD1 4.24Å; L141-I146 HydrophobicContact CB-CG1 4.27Å; L141-I146 HydrophobicContact CD2-CG1 4.27Å; L141-I149 HydrophobicContact CD2-CD1 4.07Å
142S85.8Confident87.4Confident59 Ų5990.4 Ų90.441%0.41343%0.432SS..  trans-63.9154.31671750000110.7I140 S144 S145 I146I140-S142 PolarHBondContact O-N 3.28Å; S142-S144 PolarHBondContact O-N 3.42Å; S142-S144 VanDerWaalsContact O-N 3.15Å; S142-S145 WeakPolarHBondContact O-CA 2.96Å; S142-S145 WeakPolarHBondContact O-CB 3.09Å; S142-S145 PolarHBondContact O-N 2.88Å; S142-I146 PolarHBondContact O-N 2.91Å
143H85.6Confident87.6Confident57 Ų5790.1 Ų90.126%0.26443%0.429SS..Hα-helixtrans-53.8-34.9177.8179.7-99.7000113.1V58 T61 K147V58-H143 HydrophobicContact CG2-CB 4.38Å; T61-H143 PolarHBondContact OG1-CD2 3.22Å; T61-H143 VanDerWaalsContact OG1-CD2 3.27Å; T61-H143 PolarHBondContact OG1-NE2 2.9Å; H143-K147 WeakPolarHBondContact CE1-CE 3.47Å; H143-K147 PolarHBondContact CE1-NZ 3.38Å
144S89.3Confident88Confident89 Ų8989.4 Ų89.462%0.62243%0.426SS*.Hα-helixtrans-72.2-42.5174.7-166.30000111.9S142 I146 K147 F148S142-S144 PolarHBondContact O-N 3.42Å; S142-S144 VanDerWaalsContact O-N 3.15Å; S144-I146 PolarHBondContact O-N 3.38Å; S144-K147 PolarHBondContact O-N 3.07Å; S144-F148 PolarHBondContact O-N 2.9Å; S144-F148 VanDerWaalsContact O-N 3.1Å
145S91.3Very high88.6Confident34 Ų3489.6 Ų89.624%0.23842%0.421CS..Hα-helixtrans-62.3-43.4179.8-174.70000111.8I140 S142 K147 F148 I149I140-S145 WeakPolarHBondContact O-CB 3.41Å; I140-S145 PolarHBondContact O-OG 3.36Å; S142-S145 WeakPolarHBondContact O-CA 2.96Å; S142-S145 WeakPolarHBondContact O-CB 3.09Å; S142-S145 PolarHBondContact O-N 2.88Å; S145-K147 VanDerWaalsContact C-N 3.3Å; S145-K147 PolarHBondContact O-N 3.06Å; S145-F148 PolarHBondContact O-N 3.29Å; S145-F148 VanDerWaalsContact O-N 3.13Å; S145-I149 WeakPolarHBondContact O-CB 3.32Å; S145-I149 VanDerWaalsContact O-CG1 3.24Å; S145-I149 WeakPolarHBondContact O-CG1 3.4Å; S145-I149 PolarHBondContact O-N 3.48Å; S145-I149 WeakPolarHBondContact OG-CD1 3.32Å
146I90.3Very high89.3Confident11 Ų1183.7 Ų83.76%0.05639%0.393CS..Hα-helixtrans-60.3-40.5178.7-69.7167.2000111.5V58 L141 S142 S144 Y150V58-I146 HydrophobicContact CG1-CD1 3.3Å; L141-I146 HydrophobicContact CB-CD1 4.24Å; L141-I146 HydrophobicContact CB-CG1 4.27Å; L141-I146 HydrophobicContact CD2-CG1 4.27Å; S142-I146 PolarHBondContact O-N 2.91Å; S144-I146 PolarHBondContact O-N 3.38Å; I146-Y150 WeakPolarHBondContact O-CB 3.5Å; I146-Y150 PolarHBondContact O-N 2.91Å
147K92.1Very high89.9Confident114 Ų11476.1 Ų76.150%0.49636%0.364SS..Hα-helixtrans-65.3-42.2176.4-68.3-179.2177.6-168.10111.8H143 S144 S145 G151H143-K147 WeakPolarHBondContact CE1-CE 3.47Å; H143-K147 PolarHBondContact CE1-NZ 3.38Å; S144-K147 PolarHBondContact O-N 3.07Å; S145-K147 VanDerWaalsContact C-N 3.3Å; S145-K147 PolarHBondContact O-N 3.06Å; K147-G151 PolarHBondContact O-N 3.39Å
148F94.6Very high90.7Very high153 Ų15369.7 Ų69.767%0.67134%0.339SS*.Hα-helixtrans-64.5-49177-180-96.8000111.8S144 S145 Y150 G151 F152S144-F148 PolarHBondContact O-N 2.9Å; S144-F148 VanDerWaalsContact O-N 3.1Å; S145-F148 PolarHBondContact O-N 3.29Å; S145-F148 VanDerWaalsContact O-N 3.13Å; F148-Y150 VanDerWaalsContact C-N 3.32Å; F148-Y150 PolarHBondContact O-N 2.85Å; F148-G151 PolarHBondContact O-N 2.57Å; F148-F152 WeakPolarHBondContact O-CB 3.24Å; F148-F152 PolarHBondContact O-N 3.32Å
149I95Very high91.7Very high44 Ų4472 Ų7223%0.22635%0.352CS..Hα-helixtrans-60.3-44.2177.7-65164.5000110.3L122 L141 S145 F152 L153L122-I149 HydrophobicContact CD1-CG2 4.16Å; L122-I149 HydrophobicContact CD2-CG2 3.62Å; L141-I149 HydrophobicContact CD2-CD1 4.07Å; S145-I149 WeakPolarHBondContact O-CB 3.32Å; S145-I149 VanDerWaalsContact O-CG1 3.24Å; S145-I149 WeakPolarHBondContact O-CG1 3.4Å; S145-I149 PolarHBondContact O-N 3.48Å; S145-I149 WeakPolarHBondContact OG-CD1 3.32Å; I149-F152 PolarHBondContact O-N 2.87Å; I149-L153 HydrophobicContact CG2-CD1 3.79Å; I149-L153 HydrophobicContact CG2-CG 4.37Å; I149-L153 WeakPolarHBondContact O-CB 3.27Å; I149-L153 VanDerWaalsContact O-CG 3.28Å; I149-L153 WeakPolarHBondContact O-CG 3.4Å; I149-L153 PolarHBondContact O-N 3.43Å
150Y94.8Very high92.5Very high40 Ų4063.2 Ų63.216%0.15732%0.321CS..Hα-helixtrans-62.4-45.9176.7175.5-94.7000112.2V65 T69 T115 I146 F148 F152 L153 W154V65-Y150 HydrophobicContact CG1-CD1 3.99Å; V65-Y150 HydrophobicContact CG1-CD2 3.31Å; V65-Y150 HydrophobicContact CG1-CE1 3.87Å; V65-Y150 HydrophobicContact CG1-CE2 3.13Å; V65-Y150 HydrophobicContact CG1-CG 3.73Å; V65-Y150 VanDerWaalsContact CG1-CZ 3.46Å; T69-Y150 HydrophobicContact CG2-CE2 3.76Å; T69-Y150 WeakPolarHBondContact CG2-OH 3.27Å; T115-Y150 HydrophobicContact CG2-CD2 4.25Å; T115-Y150 HydrophobicContact CG2-CE2 3.39Å; I146-Y150 WeakPolarHBondContact O-CB 3.5Å; I146-Y150 PolarHBondContact O-N 2.91Å; F148-Y150 VanDerWaalsContact C-N 3.32Å; F148-Y150 PolarHBondContact O-N 2.85Å; Y150-F152 VanDerWaalsContact C-N 3.31Å; Y150-F152 PolarHBondContact O-N 3.17Å; Y150-L153 PolarHBondContact O-N 2.88Å; Y150-W154 PolarHBondContact O-N 2.9Å
151G96Very high93.3Very high28 Ų2857.9 Ų57.929%0.28929%0.293SS..Hα-helixtrans-59.9-41175.500000112.5K147 F148 W154 I155K147-G151 PolarHBondContact O-N 3.39Å; F148-G151 PolarHBondContact O-N 2.57Å; G151-W154 PolarHBondContact O-N 3.24Å; G151-I155 VanDerWaalsContact O-CG1 3.31Å; G151-I155 WeakPolarHBondContact O-CG1 3.44Å; G151-I155 PolarHBondContact O-N 3.1Å
152F97.1Very high93.8Very high119 Ų11960.9 Ų60.952%0.52231%0.309SS..Hα-helixtrans-62.2-45.5173.8175.1-98.3000112.3F148 I149 Y150 W154 I155 L156F148-F152 WeakPolarHBondContact O-CB 3.24Å; F148-F152 PolarHBondContact O-N 3.32Å; I149-F152 PolarHBondContact O-N 2.87Å; Y150-F152 VanDerWaalsContact C-N 3.31Å; Y150-F152 PolarHBondContact O-N 3.17Å; F152-W154 VanDerWaalsContact C-N 3.32Å; F152-W154 PolarHBondContact O-N 2.92Å; F152-I155 PolarHBondContact O-N 3.48Å; F152-L156 HydrophobicContact CE1-CD2 4.13Å; F152-L156 HydrophobicContact CZ-CD2 4.44Å; F152-L156 WeakPolarHBondContact O-CB 3.46Å; F152-L156 PolarHBondContact O-N 3.38Å
153L96.6Very high94Very high14 Ų1460.2 Ų60.27%0.07330%0.302CS..Hα-helixtrans-64.7-35.9177.8-71.4165.4000112.2W118 L122 I149 Y150 S157W118-L153 HydrophobicContact CB-CD1 4.17Å; W118-L153 HydrophobicContact CB-CD2 4.45Å; W118-L153 HydrophobicContact CD2-CD2 4Å; W118-L153 HydrophobicContact CE3-CD2 4.07Å; W118-L153 HydrophobicContact CG-CD2 4.17Å; L122-L153 HydrophobicContact CD1-CD1 3.79Å; L122-L153 HydrophobicContact CD2-CD1 4.14Å; L122-L153 HydrophobicContact CG-CD1 4.03Å; I149-L153 HydrophobicContact CG2-CD1 3.79Å; I149-L153 HydrophobicContact CG2-CG 4.37Å; I149-L153 WeakPolarHBondContact O-CB 3.27Å; I149-L153 VanDerWaalsContact O-CG 3.28Å; I149-L153 WeakPolarHBondContact O-CG 3.4Å; I149-L153 PolarHBondContact O-N 3.43Å; Y150-L153 PolarHBondContact O-N 2.88Å; L153-S157 VanDerWaalsContact O-CB 3.26Å; L153-S157 WeakPolarHBondContact O-CB 3.45Å; L153-S157 PolarHBondContact O-N 3.3Å; L153-S157 PolarHBondContact O-OG 2.85Å
154W96.9Very high94.1Very high111 Ų11158.4 Ų58.442%0.4229%0.293SS..Hα-helixtrans-65.6-45.9174.7-17375.7000111.6T115 Y150 G151 F152 S157 G158T115-W154 HydrophobicContact CG2-CB 4.21Å; T115-W154 HydrophobicContact CG2-CG 4.5Å; Y150-W154 PolarHBondContact O-N 2.9Å; G151-W154 PolarHBondContact O-N 3.24Å; F152-W154 VanDerWaalsContact C-N 3.32Å; F152-W154 PolarHBondContact O-N 2.92Å; W154-S157 PolarHBondContact O-N 3.34Å; W154-G158 PolarHBondContact O-N 3.35Å
155I97.6Very high94Very high91 Ų9154.5 Ų54.547%0.46727%0.266SS..Hα-helixtrans-60.8-47.4175.3-68.8167000110.7G151 F152 S157 G158 F159G151-I155 VanDerWaalsContact O-CG1 3.31Å; G151-I155 WeakPolarHBondContact O-CG1 3.44Å; G151-I155 PolarHBondContact O-N 3.1Å; F152-I155 PolarHBondContact O-N 3.48Å; I155-S157 VanDerWaalsContact C-N 3.34Å; I155-S157 PolarHBondContact O-N 2.99Å; I155-G158 PolarHBondContact O-N 3.19Å; I155-F159 HydrophobicContact CG2-CD2 3.64Å; I155-F159 HydrophobicContact CG2-CE2 3.4Å; I155-F159 VanDerWaalsContact CG2-CE2 3.4Å; I155-F159 VanDerWaalsContact O-CD2 3.22Å; I155-F159 WeakPolarHBondContact O-CD2 3.29Å; I155-F159 PolarHBondContact O-N 3.14Å
156L97Very high93.5Very high57 Ų5758.6 Ų58.630%0.29828%0.28SS..Hα-helixtrans-61.7-42178.5-177.360.2000111.9F152 G158 F159 L160 F230F152-L156 HydrophobicContact CE1-CD2 4.13Å; F152-L156 HydrophobicContact CZ-CD2 4.44Å; F152-L156 WeakPolarHBondContact O-CB 3.46Å; F152-L156 PolarHBondContact O-N 3.38Å; L156-G158 VanDerWaalsContact C-N 3.34Å; L156-F159 PolarHBondContact O-N 3.48Å; L156-L160 HydrophobicContact CG-CD1 4.5Å; L156-L160 WeakPolarHBondContact O-CG 3.35Å; L156-L160 PolarHBondContact O-N 2.89Å; L156-L160 VanDerWaalsContact O-N 3.08Å; L156-F230 HydrophobicContact CD2-CE2 3.67Å; L156-F230 HydrophobicContact CD2-CZ 3.55Å; L156-F230 HydrophobicContact CG-CE1 4.47Å; L156-F230 HydrophobicContact CG-CE2 4.31Å; L156-F230 HydrophobicContact CG-CZ 3.84Å
157S97Very high92.9Very high0 Ų059.1 Ų59.10%028%0.281CS..Hα-helixtrans-62.6-41.1175.1-60.40000111.7L153 W154 I155 L160 A161L153-S157 VanDerWaalsContact O-CB 3.26Å; L153-S157 WeakPolarHBondContact O-CB 3.45Å; L153-S157 PolarHBondContact O-N 3.3Å; L153-S157 PolarHBondContact O-OG 2.85Å; W154-S157 PolarHBondContact O-N 3.34Å; I155-S157 VanDerWaalsContact C-N 3.34Å; I155-S157 PolarHBondContact O-N 2.99Å; S157-L160 PolarHBondContact O-N 3.45Å; S157-A161 VanDerWaalsContact O-CB 3.28Å; S157-A161 WeakPolarHBondContact O-CB 3.41Å; S157-A161 PolarHBondContact O-N 3.07Å
158G96.7Very high91.7Very high10 Ų1054.9 Ų54.910%0.10326%0.263CS..Hα-helixtrans-64-40.517600000113.1W107 W154 I155 L156 L160 A161 I162W107-G158 PolarHBondContact NE1-O 3.33Å; W154-G158 PolarHBondContact O-N 3.35Å; I155-G158 PolarHBondContact O-N 3.19Å; L156-G158 VanDerWaalsContact C-N 3.34Å; G158-L160 VanDerWaalsContact C-N 3.34Å; G158-A161 PolarHBondContact O-N 3.28Å; G158-I162 PolarHBondContact O-N 3.47Å
159F96.1Very high90Very high142 Ų14252 Ų5262%0.62325%0.249SC*.Hα-helixtrans-66.3-33.2174.6-82.3-63.5000113.2I155 L156 I162I155-F159 HydrophobicContact CG2-CD2 3.64Å; I155-F159 HydrophobicContact CG2-CE2 3.4Å; I155-F159 VanDerWaalsContact CG2-CE2 3.4Å; I155-F159 VanDerWaalsContact O-CD2 3.22Å; I155-F159 WeakPolarHBondContact O-CD2 3.29Å; I155-F159 PolarHBondContact O-N 3.14Å; L156-F159 PolarHBondContact O-N 3.48Å; F159-I162 WeakPolarHBondContact O-CG2 3.38Å
160L94.5Very high88.2Confident26 Ų2650.9 Ų50.914%0.13625%0.246CC..Hα-helixtrans-77.5-41175.4-67.5172.6000111.4L156 S157 G158 I162 V163 Y222 F227 F230L156-L160 HydrophobicContact CG-CD1 4.5Å; L156-L160 WeakPolarHBondContact O-CG 3.35Å; L156-L160 PolarHBondContact O-N 2.89Å; L156-L160 VanDerWaalsContact O-N 3.08Å; S157-L160 PolarHBondContact O-N 3.45Å; G158-L160 VanDerWaalsContact C-N 3.34Å; L160-I162 PolarHBondContact O-N 3.46Å; L160-V163 PolarHBondContact O-N 2.8Å; L160-Y222 VanDerWaalsContact CA-OH 3.26Å; L160-Y222 WeakPolarHBondContact CA-OH 3.34Å; L160-Y222 WeakPolarHBondContact CD2-OH 3.17Å; L160-Y222 PolarHBondContact O-OH 2.9Å; L160-F227 HydrophobicContact CB-CD2 4.13Å; L160-F227 HydrophobicContact CB-CE2 4.44Å; L160-F230 HydrophobicContact CD1-CB 4.11Å; L160-F230 HydrophobicContact CD1-CD1 3.27Å; L160-F230 HydrophobicContact CD1-CD2 4.19Å; L160-F230 HydrophobicContact CD1-CE1 3.63Å; L160-F230 HydrophobicContact CD1-CE2 4.49Å; L160-F230 HydrophobicContact CD1-CG 3.59Å; L160-F230 HydrophobicContact CD1-CZ 4.24Å
161A93.9Very high86.3Confident0 Ų050.1 Ų50.10%024%0.244CC..Hα-helixtrans-64.6-27.4177.600000112.9D110 C111 S157 G158 V163 R164 A165 F227D110-A161 HydrophobicContact CB-CB 3.88Å; C111-A161 HydrophobicContact CB-CB 4.07Å; S157-A161 VanDerWaalsContact O-CB 3.28Å; S157-A161 WeakPolarHBondContact O-CB 3.41Å; S157-A161 PolarHBondContact O-N 3.07Å; G158-A161 PolarHBondContact O-N 3.28Å; A161-V163 VanDerWaalsContact C-N 3.25Å; A161-V163 PolarHBondContact O-N 3Å; A161-R164 PolarHBondContact O-N 3.43Å; A161-R164 VanDerWaalsContact O-N 3.15Å; A161-A165 PolarHBondContact O-N 3.47Å; A161-A165 VanDerWaalsContact O-N 3.07Å; A161-F227 HydrophobicContact CB-CE2 4.46Å
162I92.4Very high84.3Confident79 Ų7950.6 Ų50.641%0.40524%0.242SC..Hα-helixtrans-62.3-34.2-178.2-153176000112.2G158 F159 L160 R164 A165 F166G158-I162 PolarHBondContact O-N 3.47Å; F159-I162 WeakPolarHBondContact O-CG2 3.38Å; L160-I162 PolarHBondContact O-N 3.46Å; I162-R164 VanDerWaalsContact C-N 3.3Å; I162-R164 PolarHBondContact O-N 3.13Å; I162-A165 WeakPolarHBondContact O-CB 3.5Å; I162-A165 PolarHBondContact O-N 3.46Å; I162-F166 HydrophobicContact CG1-CE2 4.14Å; I162-F166 WeakPolarHBondContact O-CD2 3.34Å
163V90.4Very high82.3Confident45 Ų4546.2 Ų46.227%0.27323%0.225SC..Hα-helixtrans-65-41.2178.8-1790000109.7L160 A161 F166 Y167 Y222L160-V163 PolarHBondContact O-N 2.8Å; A161-V163 VanDerWaalsContact C-N 3.25Å; A161-V163 PolarHBondContact O-N 3Å; V163-F166 PolarHBondContact O-N 3.33Å; V163-Y167 HydrophobicContact CG1-CE1 3.82Å; V163-Y167 VanDerWaalsContact O-CD1 3.24Å; V163-Y167 WeakPolarHBondContact O-CD1 3.12Å; V163-Y167 VanDerWaalsContact O-CE1 3.26Å; V163-Y167 WeakPolarHBondContact O-CE1 3.28Å; V163-Y222 HydrophobicContact CB-CD1 4.46Å; V163-Y222 HydrophobicContact CB-CE1 3.78Å; V163-Y222 HydrophobicContact CB-CE2 4.22Å; V163-Y222 HydrophobicContact CG1-CD1 4.02Å; V163-Y222 HydrophobicContact CG1-CD2 4.25Å; V163-Y222 HydrophobicContact CG1-CE1 3.83Å; V163-Y222 HydrophobicContact CG1-CE2 4.1Å; V163-Y222 HydrophobicContact CG1-CG 4.2Å; V163-Y222 HydrophobicContact CG2-CE1 4.44Å; V163-Y222 HydrophobicContact CG2-CE2 4.08Å
164R87.3Confident80.3Confident20 Ų2050.3 Ų50.38%0.07525%0.248CC..Hα-helixtrans-69.4-30.5178.6-173.5165.3171.6112.410.9113L2 D110 A161 I162 F166 Y167 E223L2-R164 PolarHBondContact O-NH2 3.47Å; D110-R164 IonicContact OD1-NE 2.74Å; D110-R164 WeakPolarHBondContact OD2-CD 3.47Å; D110-R164 WeakPolarHBondContact OD2-CG 3.18Å; D110-R164 IonicContact OD2-NE 3.68Å; D110-R164 PolarHBondContact OD2-NE 3.25Å; A161-R164 PolarHBondContact O-N 3.43Å; A161-R164 VanDerWaalsContact O-N 3.15Å; I162-R164 VanDerWaalsContact C-N 3.3Å; I162-R164 PolarHBondContact O-N 3.13Å; R164-F166 PolarHBondContact O-N 3.19Å; R164-F166 VanDerWaalsContact O-N 3.13Å; R164-Y167 HydrophobicContact CB-CD2 4.14Å; R164-Y167 HydrophobicContact CB-CE2 4.24Å; R164-Y167 HydrophobicContact CG-CD2 3.83Å; R164-Y167 HydrophobicContact CG-CE2 4.24Å; R164-Y167 VanDerWaalsContact O-CB 3.29Å; R164-Y167 WeakPolarHBondContact O-CB 3.31Å; R164-Y167 PolarHBondContact O-N 3.03Å; R164-E223 IonicContact CZ-OE1 3.72Å; R164-E223 IonicContact NH1-OE1 3.98Å; R164-E223 PolarHBondContact NH1-OE1 2.98Å; R164-E223 IonicContact NH2-OE1 3.45Å
165A86.2Confident78.4Confident6 Ų647.5 Ų47.55%0.0524%0.244CC..Hα-helixtrans-60.9-20.9174.500000113.6A103 W107 A161 I162A103-A165 HydrophobicContact CB-CB 4.46Å; W107-A165 HydrophobicContact CB-CB 3.92Å; A161-A165 PolarHBondContact O-N 3.47Å; A161-A165 VanDerWaalsContact O-N 3.07Å; I162-A165 WeakPolarHBondContact O-CB 3.5Å; I162-A165 PolarHBondContact O-N 3.46Å
166F81.6Confident76.5Confident121 Ų12145.1 Ų45.153%0.53124%0.235SC..THydrogen-bonded Turntrans-96.36.3175.7-65.2-72.3000113.7I162 V163 R164I162-F166 HydrophobicContact CG1-CE2 4.14Å; I162-F166 WeakPolarHBondContact O-CD2 3.34Å; V163-F166 PolarHBondContact O-N 3.33Å; R164-F166 PolarHBondContact O-N 3.19Å; R164-F166 VanDerWaalsContact O-N 3.13Å
167Y77.5Confident74.7Confident22 Ų2248.7 Ų48.79%0.08625%0.254CS..  trans-80.9-22.1178.1-68-4.5000113.1V163 R164 Y169 L214 I219 Y222V163-Y167 HydrophobicContact CG1-CE1 3.82Å; V163-Y167 VanDerWaalsContact O-CD1 3.24Å; V163-Y167 WeakPolarHBondContact O-CD1 3.12Å; V163-Y167 VanDerWaalsContact O-CE1 3.26Å; V163-Y167 WeakPolarHBondContact O-CE1 3.28Å; R164-Y167 HydrophobicContact CB-CD2 4.14Å; R164-Y167 HydrophobicContact CB-CE2 4.24Å; R164-Y167 HydrophobicContact CG-CD2 3.83Å; R164-Y167 HydrophobicContact CG-CE2 4.24Å; R164-Y167 VanDerWaalsContact O-CB 3.29Å; R164-Y167 WeakPolarHBondContact O-CB 3.31Å; R164-Y167 PolarHBondContact O-N 3.03Å; Y167-Y169 PolarHBondContact O-N 2.88Å; Y167-Y169 VanDerWaalsContact O-N 3.15Å; Y167-L214 HydrophobicContact CE1-CD2 4.3Å; Y167-I219 HydrophobicContact CD1-CD1 4.12Å; Y167-I219 HydrophobicContact CD1-CG1 3.95Å; Y167-I219 HydrophobicContact CD1-CG2 4.21Å; Y167-I219 HydrophobicContact CD2-CG2 3.77Å; Y167-I219 HydrophobicContact CE1-CB 4.3Å; Y167-I219 HydrophobicContact CE1-CD1 4.45Å; Y167-I219 HydrophobicContact CE1-CG1 3.77Å; Y167-I219 HydrophobicContact CE1-CG2 4.14Å; Y167-I219 HydrophobicContact CE2-CG2 3.69Å; Y167-I219 HydrophobicContact CG-CG2 4.02Å; Y167-Y222 HydrophobicContact CE2-CD1 4.4Å; Y167-Y222 AromaticContact CZ-CD1 3.92Å; Y167-Y222 VanDerWaalsContact OH-CB 3.26Å; Y167-Y222 WeakPolarHBondContact OH-CB 3.48Å; Y167-Y222 WeakPolarHBondContact OH-CD1 3.3Å; Y167-Y222 VanDerWaalsContact OH-CG 3.28Å
168D66.3Low72.7Confident24 Ų2454.8 Ų54.813%0.12829%0.287CS..  trans-70.8114.4-174.7-62.1-30.8000110.1G4 N106G4-D168 VanDerWaalsContact CA-OD1 3.24Å; G4-D168 WeakPolarHBondContact CA-OD1 3.49Å; N106-D168 PolarHBondContact ND2-OD2 3.44Å
169Y60.3Low70.7Confident94 Ų9462 Ų6237%0.36932%0.322SS..PPolyproline II helixtrans-95.7142.8172.558.8-87.2000109.4T5 Y167 I171T5-Y169 HydrophobicContact CG2-CE1 4Å; Y167-Y169 PolarHBondContact O-N 2.88Å; Y167-Y169 VanDerWaalsContact O-N 3.15Å; Y169-I171 HydrophobicContact CD2-CG1 3.85Å; Y169-I171 HydrophobicContact CE2-CD1 3.95Å; Y169-I171 HydrophobicContact CE2-CG1 3.74Å
170A56.5Low68.7Low20 Ų2062.1 Ų62.117%0.16533%0.328CS..PPolyproline II helixtrans-97.7121.2168.900000108.4I8 V172I8-A170 HydrophobicContact CD1-CB 4.41Å; A170-V172 PolarHBondContact O-N 3.32Å
171I54.1Low66.7Low23 Ų2368.7 Ų68.712%0.11836%0.36CS..EExtended strand (participates in β ladder)trans-79.4116.6167-55.6177.1000106.7W7 Y169 V207W7-I171 HydrophobicContact CZ2-CD1 4.2Å; Y169-I171 HydrophobicContact CD2-CG1 3.85Å; Y169-I171 HydrophobicContact CE2-CD1 3.95Å; Y169-I171 HydrophobicContact CE2-CG1 3.74Å; I171-V207 HydrophobicContact CG2-CG1 3.77Å
172V54.5Low64.9Low39 Ų3977.3 Ų77.324%0.23640%0.4CS..EExtended strand (participates in β ladder)trans-104.7109.8173-179.80000107.6Y10 A170 N174 T208 I210Y10-V172 HydrophobicContact CE2-CG2 4.2Å; A170-V172 PolarHBondContact O-N 3.32Å; V172-N174 PolarHBondContact O-N 3.36Å; V172-T208 VanDerWaalsContact O-O 3.11Å; V172-T208 PolarHBondContact O-OG1 3.46Å; V172-I210 HydrophobicContact CB-CD1 4.31Å; V172-I210 HydrophobicContact CG2-CD1 3.54Å; V172-I210 HydrophobicContact CG2-CG1 4.35Å
173C55.3Low63.1Low26 Ų2679 Ų7918%0.17642%0.419CS..EExtended strand (participates in β ladder)trans-82111.6169.9-59.40000108.9C14C14-C173 WeakPolarHBondContact SG-CB 3.48Å
174N54.1Low61.5Low101 Ų10181.7 Ų81.754%0.5444%0.44SS..  trans-89123.7171.9-166.19.4000108.6V172 S176V172-N174 PolarHBondContact O-N 3.36Å; N174-S176 PolarHBondContact O-N 2.75Å; N174-S176 VanDerWaalsContact O-N 3.09Å
175P57.2Low59.8Low52 Ų5290.1 Ų90.134%0.33848%0.477SS..  trans-60.6117169.625.1-32.8000108.5N177P175-N177 PolarHBondContact O-N 2.83Å
176S58Low58.3Low40 Ų4096.2 Ų96.228%0.2851%0.514SS..  trans-61.9109.1170.641.50000108.1N174 D178N174-S176 PolarHBondContact O-N 2.75Å; N174-S176 VanDerWaalsContact O-N 3.09Å; S176-D178 PolarHBondContact O-N 3.39Å
177N58.6Low57.1Low132 Ų13295.4 Ų95.471%0.70652%0.523SS*.G310 helixtrans-67.99174.2-84-19.3000113.1P175 L179 I180P175-N177 PolarHBondContact O-N 2.83Å; N177-L179 PolarHBondContact O-N 2.97Å; N177-L179 VanDerWaalsContact O-N 3.12Å; N177-I180 PolarHBondContact O-N 2.84Å
178D56.3Low55.6Low129 Ų12999.7 Ų99.769%0.6955%0.554SS**G310 helixtrans-70.6-7.4-173.8-73.7-23.5000114S176 I180S176-D178 PolarHBondContact O-N 3.39Å; D178-I180 VanDerWaalsContact C-N 3.25Å; D178-I180 PolarHBondContact O-N 3.33Å
179L54.4Low54.8Low160 Ų160105.5 Ų105.584%0.83858%0.584SS**G310 helixtrans-72.8-8.8174.1-96.1153.1000114.7N177N177-L179 PolarHBondContact O-N 2.97Å; N177-L179 VanDerWaalsContact O-N 3.12Å
180I54.4Low54.4Low145 Ų145110.6 Ų110.674%0.74460%0.604SS**G310 helixtrans-92.7-11.8178.4-58.5-179000112.5N177 D178N177-I180 PolarHBondContact O-N 2.84Å; D178-I180 VanDerWaalsContact C-N 3.25Å; D178-I180 PolarHBondContact O-N 3.33Å
181M52.3Low54.1Low165 Ų165115.3 Ų115.381%0.81363%0.631SS**SBendtrans-108.131.3-178.3-153.4154.271.400114.7
182Q54.7Low53.8Low181 Ų181121.3 Ų121.385%0.84666%0.663SS**SBendtrans-125.6-3.1165.2-90.1-177.58.300115S184Q182-S184 PolarHBondContact O-N 3.03Å
183S55.1Low53.7Low114 Ų114127 Ų12780%0.79769%0.692SS**THydrogen-bonded Turntrans-88.411.2-176.6-169.40000115.7
184S57.1Low53.4Low102 Ų102133.7 Ų133.771%0.71373%0.726SS**THydrogen-bonded Turntrans-123.820-175.973.60000116.1Q182Q182-S184 PolarHBondContact O-N 3.03Å
185K51.8Low53.1Low196 Ų196136.7 Ų136.785%0.85274%0.741SS**  trans-110.878.1165-77.8-176.1179.6174.50110.9S187K185-S187 PolarHBondContact O-N 2.91Å; K185-S187 VanDerWaalsContact O-N 3.14Å
186T54.8Low52.8Low134 Ų134142.1 Ų142.182%0.82277%0.767SS**  trans-6399.9154.743.90000109.3
187S55.5Low52.5Low105 Ų105145.3 Ų145.373%0.73479%0.789SS**  trans-130.6104.2160.5-59.10000107.9K185K185-S187 PolarHBondContact O-N 2.91Å; K185-S187 VanDerWaalsContact O-N 3.14Å
188P46.3Very low52Low111 Ų111146.9 Ų146.972%0.72180%0.797SS**  trans-82129.7165.332.5-25.7000107.6
189L49Very low51.6Low147 Ų147147.8 Ų147.877%0.7780%0.802SS**  trans165.9121.7134.8-103.8109.6000109.5
190Y51.6Low51.3Low201 Ų201149.9 Ų149.979%0.78881%0.805SS**  trans49.2121.9135.5-72.7-99.2000117.3
191T50.8Low51Low119 Ų119150.2 Ų150.273%0.7381%0.808SS**  cis-170.3139.749.338.20000110.9
192N48.3Very low51.2Low148 Ų148149.8 Ų149.879%0.79180%0.804SS**  trans-5.4123.4148.8-55.4-17.9000117.7
193N51.8Low51Low158 Ų158148 Ų14885%0.84580%0.801SS**  trans173.289.6139-81-19.6000104.9
194L48.5Very low51Low168 Ų168147 Ų14788%0.8879%0.79SS**  36.18092.3-153.991.7000112.1
195D49.6Very low50.7Low163 Ų163146.1 Ų146.187%0.87278%0.777SS**  trans-145.3140.7140.4-99.5-29.8000111.2
196L50.6Low50.7Low167 Ų167140.9 Ų140.987%0.87476%0.762SS**  trans-99.6102.7-158.8-175.986.6000107.7
197S51.2Low50.6Low106 Ų106137.8 Ų137.874%0.74174%0.742SS**  trans-147.3108.1162.1590000109.9D199S197-D199 PolarHBondContact O-N 3.35Å
198N47.2Very low50.4Low165 Ų165136.1 Ų136.188%0.88273%0.728SS**  trans-57.1103.2163.1-62.6-41.9000107.9
199D48.6Very low50.8Low149 Ų149136.3 Ų136.380%0.79772%0.719SS**  trans-124.4127.1159.5-122.3-19.1000108.3S197 D201S197-D199 PolarHBondContact O-N 3.35Å; D199-D201 PolarHBondContact O-N 2.9Å
200F48.4Very low51.3Low203 Ų203133.9 Ų133.989%0.8971%0.706SS**  trans-57.3100.4-179.8-123.6-108.6000107.3E202F200-E202 PolarHBondContact O-N 3.46Å
201D48.2Very low51.6Low152 Ų152130.8 Ų130.881%0.81370%0.703SS**  trans-68.190.6170.6-122.3-13000107D199 N203D199-D201 PolarHBondContact O-N 2.9Å; D201-N203 PolarHBondContact O-N 3.4Å
202E55.1Low52.3Low157 Ų157126.9 Ų126.973%0.73468%0.682SS**  trans-62.481.6169.8-158.3177-157.300106.6F200 T204F200-E202 PolarHBondContact O-N 3.46Å; E202-T204 HydrophobicContact CB-CG2 4.36Å; E202-T204 HydrophobicContact CG-CG2 3.88Å; E202-T204 WeakPolarHBondContact O-CG2 3.37Å; E202-T204 PolarHBondContact O-N 2.89Å
203N52.3Low53.4Low144 Ų144127.4 Ų127.477%0.7768%0.684SS**  trans-61.585.4163.6-92.1-17.7000107.1D201 N205D201-N203 PolarHBondContact O-N 3.4Å; N203-N205 PolarHBondContact O-N 3.22Å
204T53.6Low54.7Low92 Ų92123.1 Ų123.156%0.56466%0.661SS**  trans-68.190.8-176.938.10000108.5E202 T206E202-T204 HydrophobicContact CB-CG2 4.36Å; E202-T204 HydrophobicContact CG-CG2 3.88Å; E202-T204 WeakPolarHBondContact O-CG2 3.37Å; E202-T204 PolarHBondContact O-N 2.89Å; T204-T206 PolarHBondContact O-N 3.33Å
205N52.3Low56.4Low84 Ų84120 Ų12045%0.44965%0.646SS.*  trans-56.9107.8154.9-69.1-28.3000106.4N203 V207N203-N205 PolarHBondContact O-N 3.22Å; N205-V207 VanDerWaalsContact C-N 3.33Å; N205-V207 PolarHBondContact O-N 3.41Å
206T50.7Low58Low86 Ų86119 Ų11953%0.52864%0.636SS.*  trans-67.392.4177.441.90000108.7T204 T208T204-T206 PolarHBondContact O-N 3.33Å; T206-T208 PolarHBondContact O-N 2.89Å
207V52.9Low59.8Low68 Ų68118.8 Ų118.841%0.41262%0.624SS.*EExtended strand (participates in β ladder)trans-68.8104.8172.2-178.80000107.5I171 N205 H209I171-V207 HydrophobicContact CG2-CG1 3.77Å; N205-V207 VanDerWaalsContact C-N 3.33Å; N205-V207 PolarHBondContact O-N 3.41Å; V207-H209 PolarHBondContact O-N 3.42Å
208T51.8Low61.5Low71 Ų71117.8 Ų117.844%0.43661%0.61SS.*EExtended strand (participates in β ladder)trans-76.6104.1170.846.40000108.9V172 T206 I210V172-T208 VanDerWaalsContact O-O 3.11Å; V172-T208 PolarHBondContact O-OG1 3.46Å; T206-T208 PolarHBondContact O-N 2.89Å; T208-I210 PolarHBondContact O-N 2.99Å
209H54Low63.3Low115 Ų115111.1 Ų111.153%0.53257%0.574SS.*EExtended strand (participates in β ladder)trans-73.3121.5168.9-70.9-85.8000108.6V207 D211V207-H209 PolarHBondContact O-N 3.42Å; H209-D211 PolarHBondContact O-N 2.96Å
210I59.6Low65.1Low96 Ų96107.9 Ų107.949%0.49256%0.555SS.*  trans-77.399.6162.6-59.3179.3000104.9V172 T208 A212V172-I210 HydrophobicContact CB-CD1 4.31Å; V172-I210 HydrophobicContact CG2-CD1 3.54Å; V172-I210 HydrophobicContact CG2-CG1 4.35Å; T208-I210 PolarHBondContact O-N 2.99Å; I210-A212 PolarHBondContact O-N 3.28Å
211D57.8Low67.1Low136 Ų136100.2 Ų100.273%0.72752%0.524SS*.  trans-57.7139.2179.5-71.3-28.3000110.1H209H209-D211 PolarHBondContact O-N 2.96Å
212A64.7Low69.2Low36 Ų3695 Ų9530%0.29849%0.493SS..  trans-54.8144.6173.300000109.7I210 L214 I219I210-A212 PolarHBondContact O-N 3.28Å; A212-L214 PolarHBondContact O-N 3.34Å; A212-I219 HydrophobicContact CB-CD1 3.94Å
213L71.6Confident70.7Confident160 Ų16089 Ų8984%0.83847%0.465SS*.SBendtrans-59.8-16.4178.7-73.4168.9000113.2
214L78.9Confident72.3Confident67 Ų6782.5 Ų82.535%0.35143%0.432SS..SBendtrans-117.8138.4-179.1-13671.6000109.9Y167 A212 Q216 I218 I219Y167-L214 HydrophobicContact CE1-CD2 4.3Å; A212-L214 PolarHBondContact O-N 3.34Å; L214-Q216 PolarHBondContact O-N 3.45Å; L214-I218 HydrophobicContact CD2-CB 4.18Å; L214-I218 HydrophobicContact CD2-CG2 3.58Å; L214-I218 HydrophobicContact CG-CB 4.29Å; L214-I218 HydrophobicContact CG-CG2 4.08Å; L214-I219 HydrophobicContact CB-CD1 4.19Å; L214-I219 HydrophobicContact CB-CG1 3.98Å; L214-I219 HydrophobicContact CD2-CG1 4.33Å; L214-I219 WeakPolarHBondContact O-CD1 3.38Å
215D85.2Confident74Confident104 Ų10484.6 Ų84.656%0.55643%0.43SS*.  trans-55.7135.1175.5-177.36.4000110.7Y217 I218 I219D215-Y217 PolarHBondContact O-N 2.85Å; D215-Y217 VanDerWaalsContact O-N 3.12Å; D215-Y217 PolarHBondContact OD1-N 2.82Å; D215-I218 HydrophobicContact CB-CD1 4.14Å; D215-I218 HydrophobicContact CB-CG1 4.21Å; D215-I218 WeakPolarHBondContact O-CA 3.42Å; D215-I218 WeakPolarHBondContact O-CB 3.26Å; D215-I218 PolarHBondContact O-N 2.66Å; D215-I219 PolarHBondContact O-N 3.46Å; D215-I219 VanDerWaalsContact O-N 3.13Å
216Q83.2Confident75.9Confident142 Ų14283 Ų8366%0.66443%0.425SS*.Hα-helixtrans-54.1-34.6-178.2-173179.24.100111.7L214 I218 I219 I220L214-Q216 PolarHBondContact O-N 3.45Å; Q216-I218 VanDerWaalsContact C-N 3.34Å; Q216-I218 PolarHBondContact O-N 2.9Å; Q216-I219 PolarHBondContact O-N 3.13Å; Q216-I220 HydrophobicContact CG-CD1 3.92Å; Q216-I220 HydrophobicContact CG-CG1 4.47Å; Q216-I220 VanDerWaalsContact O-CG1 3.31Å; Q216-I220 WeakPolarHBondContact O-CG1 3.37Å; Q216-I220 PolarHBondContact O-N 3.43Å
217Y87.6Confident77.8Confident161 Ų16179 Ų7963%0.63140%0.401SS*.Hα-helixtrans-62.1-40175.1-179.1-103.8000112.6D215 N221D215-Y217 PolarHBondContact O-N 2.85Å; D215-Y217 VanDerWaalsContact O-N 3.12Å; D215-Y217 PolarHBondContact OD1-N 2.82Å; Y217-N221 WeakPolarHBondContact CD1-ND2 3.28Å; Y217-N221 WeakPolarHBondContact CE1-ND2 3.38Å; Y217-N221 VanDerWaalsContact CE2-ND2 3.3Å; Y217-N221 WeakPolarHBondContact CE2-ND2 3.17Å; Y217-N221 WeakPolarHBondContact O-CB 3.16Å; Y217-N221 VanDerWaalsContact O-CG 3.31Å; Y217-N221 PolarHBondContact O-N 3.39Å; Y217-N221 PolarHBondContact O-ND2 2.94Å
218I87.6Confident79.6Confident85 Ų8576.3 Ų76.344%0.43638%0.383SS..Hα-helixtrans-69.5-42.7178.5-59.8175.3000110L214 D215 Q216 N221 Y222L214-I218 HydrophobicContact CD2-CB 4.18Å; L214-I218 HydrophobicContact CD2-CG2 3.58Å; L214-I218 HydrophobicContact CG-CB 4.29Å; L214-I218 HydrophobicContact CG-CG2 4.08Å; D215-I218 HydrophobicContact CB-CD1 4.14Å; D215-I218 HydrophobicContact CB-CG1 4.21Å; D215-I218 WeakPolarHBondContact O-CA 3.42Å; D215-I218 WeakPolarHBondContact O-CB 3.26Å; D215-I218 PolarHBondContact O-N 2.66Å; Q216-I218 VanDerWaalsContact C-N 3.34Å; Q216-I218 PolarHBondContact O-N 2.9Å; I218-N221 PolarHBondContact O-N 2.86Å; I218-Y222 VanDerWaalsContact O-CB 3.27Å; I218-Y222 WeakPolarHBondContact O-CB 3.38Å; I218-Y222 PolarHBondContact O-N 3.01Å
219I85.9Confident81.6Confident25 Ų2576.3 Ų76.313%0.12838%0.38CS..Hα-helixtrans-57.5-53.6179.1-65.6179.1000110.6Y167 A212 L214 D215 Q216 N221 Y222 E223Y167-I219 HydrophobicContact CD1-CD1 4.12Å; Y167-I219 HydrophobicContact CD1-CG1 3.95Å; Y167-I219 HydrophobicContact CD1-CG2 4.21Å; Y167-I219 HydrophobicContact CD2-CG2 3.77Å; Y167-I219 HydrophobicContact CE1-CB 4.3Å; Y167-I219 HydrophobicContact CE1-CD1 4.45Å; Y167-I219 HydrophobicContact CE1-CG1 3.77Å; Y167-I219 HydrophobicContact CE1-CG2 4.14Å; Y167-I219 HydrophobicContact CE2-CG2 3.69Å; Y167-I219 HydrophobicContact CG-CG2 4.02Å; A212-I219 HydrophobicContact CB-CD1 3.94Å; L214-I219 HydrophobicContact CB-CD1 4.19Å; L214-I219 HydrophobicContact CB-CG1 3.98Å; L214-I219 HydrophobicContact CD2-CG1 4.33Å; L214-I219 WeakPolarHBondContact O-CD1 3.38Å; D215-I219 PolarHBondContact O-N 3.46Å; D215-I219 VanDerWaalsContact O-N 3.13Å; Q216-I219 PolarHBondContact O-N 3.13Å; I219-N221 PolarHBondContact O-N 3.08Å; I219-Y222 PolarHBondContact O-N 3.27Å; I219-E223 WeakPolarHBondContact O-CB 3.37Å; I219-E223 PolarHBondContact O-N 2.87Å
220I86Confident83.6Confident81 Ų8172.6 Ų72.642%0.41536%0.362SS..Hα-helixtrans-60-46.1-178.8-67.7168.3000110.6Q216 E223 A224Q216-I220 HydrophobicContact CG-CD1 3.92Å; Q216-I220 HydrophobicContact CG-CG1 4.47Å; Q216-I220 VanDerWaalsContact O-CG1 3.31Å; Q216-I220 WeakPolarHBondContact O-CG1 3.37Å; Q216-I220 PolarHBondContact O-N 3.43Å; I220-E223 PolarHBondContact O-N 3.46Å; I220-A224 VanDerWaalsContact O-CB 3.25Å; I220-A224 WeakPolarHBondContact O-CB 3.32Å; I220-A224 PolarHBondContact O-N 2.77Å
221N89.5Confident85.2Confident42 Ų4268.7 Ų68.723%0.22534%0.342CS..Hα-helixtrans-66.9-41-179.7-75.1-42.2000112.6Y217 I218 I219 Y225Y217-N221 WeakPolarHBondContact CD1-ND2 3.28Å; Y217-N221 WeakPolarHBondContact CE1-ND2 3.38Å; Y217-N221 VanDerWaalsContact CE2-ND2 3.3Å; Y217-N221 WeakPolarHBondContact CE2-ND2 3.17Å; Y217-N221 WeakPolarHBondContact O-CB 3.16Å; Y217-N221 VanDerWaalsContact O-CG 3.31Å; Y217-N221 PolarHBondContact O-N 3.39Å; Y217-N221 PolarHBondContact O-ND2 2.94Å; I218-N221 PolarHBondContact O-N 2.86Å; I219-N221 PolarHBondContact O-N 3.08Å; N221-Y225 HydrophobicContact CB-CD2 4.19Å; N221-Y225 WeakPolarHBondContact O-CB 3.32Å; N221-Y225 VanDerWaalsContact O-CD2 3.29Å; N221-Y225 WeakPolarHBondContact O-CD2 3.5Å; N221-Y225 PolarHBondContact O-N 3.44Å; N221-Y225 WeakPolarHBondContact OD1-CE2 3.11Å
222Y91.9Very high86.9Confident42 Ų4262.6 Ų62.617%0.16531%0.309CS..Hα-helixtrans-65.3-44177.7178.6-86000111.5L160 V163 Y167 I218 I219 C226 F227L160-Y222 VanDerWaalsContact CA-OH 3.26Å; L160-Y222 WeakPolarHBondContact CA-OH 3.34Å; L160-Y222 WeakPolarHBondContact CD2-OH 3.17Å; L160-Y222 PolarHBondContact O-OH 2.9Å; V163-Y222 HydrophobicContact CB-CD1 4.46Å; V163-Y222 HydrophobicContact CB-CE1 3.78Å; V163-Y222 HydrophobicContact CB-CE2 4.22Å; V163-Y222 HydrophobicContact CG1-CD1 4.02Å; V163-Y222 HydrophobicContact CG1-CD2 4.25Å; V163-Y222 HydrophobicContact CG1-CE1 3.83Å; V163-Y222 HydrophobicContact CG1-CE2 4.1Å; V163-Y222 HydrophobicContact CG1-CG 4.2Å; V163-Y222 HydrophobicContact CG2-CE1 4.44Å; V163-Y222 HydrophobicContact CG2-CE2 4.08Å; Y167-Y222 HydrophobicContact CE2-CD1 4.4Å; Y167-Y222 AromaticContact CZ-CD1 3.92Å; Y167-Y222 VanDerWaalsContact OH-CB 3.26Å; Y167-Y222 WeakPolarHBondContact OH-CB 3.48Å; Y167-Y222 WeakPolarHBondContact OH-CD1 3.3Å; Y167-Y222 VanDerWaalsContact OH-CG 3.28Å; I218-Y222 VanDerWaalsContact O-CB 3.27Å; I218-Y222 WeakPolarHBondContact O-CB 3.38Å; I218-Y222 PolarHBondContact O-N 3.01Å; I219-Y222 PolarHBondContact O-N 3.27Å; Y222-C226 HydrophobicContact CD2-CB 4Å; Y222-C226 HydrophobicContact CE2-CB 4.08Å; Y222-C226 HydrophobicContact CG-CB 4.4Å; Y222-C226 WeakPolarHBondContact O-CA 3.02Å; Y222-C226 VanDerWaalsContact O-CB 3.3Å; Y222-C226 WeakPolarHBondContact O-CB 3.25Å; Y222-C226 PolarHBondContact O-N 2.91Å; Y222-F227 HydrophobicContact CD1-CB 4.2Å; Y222-F227 HydrophobicContact CE1-CB 3.85Å; Y222-F227 HydrophobicContact CE1-CD2 4.5Å; Y222-F227 HydrophobicContact CE1-CG 4.49Å; Y222-F227 PolarHBondContact O-N 3.26Å
223E87.7Confident88.2Confident31 Ų3162.7 Ų62.715%0.14530%0.304CS..Iπ-helixtrans-60.6-50.3177.2-176167.9-162.300110.9R164 I219 I220 F228R164-E223 IonicContact CZ-OE1 3.72Å; R164-E223 IonicContact NH1-OE1 3.98Å; R164-E223 PolarHBondContact NH1-OE1 2.98Å; R164-E223 IonicContact NH2-OE1 3.45Å; I219-E223 WeakPolarHBondContact O-CB 3.37Å; I219-E223 PolarHBondContact O-N 2.87Å; I220-E223 PolarHBondContact O-N 3.46Å; E223-F228 WeakPolarHBondContact O-CB 3.5Å; E223-F228 PolarHBondContact O-N 2.85Å
224A86.2Confident89.3Confident9 Ų956 Ų567%0.07427%0.273CS..Iπ-helixtrans-66.2-51.1-177.300000113.3I220I220-A224 VanDerWaalsContact O-CB 3.25Å; I220-A224 WeakPolarHBondContact O-CB 3.32Å; I220-A224 PolarHBondContact O-N 2.77Å
225Y88.7Confident90.1Very high136 Ų13652.9 Ų52.953%0.53326%0.256SS..Iπ-helixtrans-99.8-22.3-165.2-62.9-68.8000114.1N221 I229N221-Y225 HydrophobicContact CB-CD2 4.19Å; N221-Y225 WeakPolarHBondContact O-CB 3.32Å; N221-Y225 VanDerWaalsContact O-CD2 3.29Å; N221-Y225 WeakPolarHBondContact O-CD2 3.5Å; N221-Y225 PolarHBondContact O-N 3.44Å; N221-Y225 WeakPolarHBondContact OD1-CE2 3.11Å; Y225-I229 WeakPolarHBondContact O-CD1 3.32Å; Y225-I229 VanDerWaalsContact O-CG1 3.32Å; Y225-I229 WeakPolarHBondContact O-CG1 3.17Å
226C92Very high90.6Very high51 Ų5148.5 Ų48.535%0.34523%0.233SC..Iπ-helixtrans-107.6-65.8-178.7-167.70000110.8Y222 F230Y222-C226 HydrophobicContact CD2-CB 4Å; Y222-C226 HydrophobicContact CE2-CB 4.08Å; Y222-C226 HydrophobicContact CG-CB 4.4Å; Y222-C226 WeakPolarHBondContact O-CA 3.02Å; Y222-C226 VanDerWaalsContact O-CB 3.3Å; Y222-C226 WeakPolarHBondContact O-CB 3.25Å; Y222-C226 PolarHBondContact O-N 2.91Å; C226-F230 WeakPolarHBondContact O-CB 3.37Å; C226-F230 PolarHBondContact O-N 3.03Å; C226-F230 VanDerWaalsContact O-N 3.08Å
227F91.6Very high91.2Very high2 Ų245.9 Ų45.91%0.00922%0.223CC..Iπ-helixtrans-67.7-50.4-170.2-171.1-105.2000111.6D110 L160 A161 Y222 I229 F230 Q231D110-F227 HydrophobicContact CB-CZ 3.83Å; L160-F227 HydrophobicContact CB-CD2 4.13Å; L160-F227 HydrophobicContact CB-CE2 4.44Å; A161-F227 HydrophobicContact CB-CE2 4.46Å; Y222-F227 HydrophobicContact CD1-CB 4.2Å; Y222-F227 HydrophobicContact CE1-CB 3.85Å; Y222-F227 HydrophobicContact CE1-CD2 4.5Å; Y222-F227 HydrophobicContact CE1-CG 4.49Å; Y222-F227 PolarHBondContact O-N 3.26Å; F227-I229 PolarHBondContact O-N 3.33Å; F227-F230 PolarHBondContact O-N 3.28Å; F227-Q231 WeakPolarHBondContact O-CB 3.47Å; F227-Q231 PolarHBondContact O-N 2.65Å
228F90.7Very high91.6Very high11 Ų1142.7 Ų42.75%0.04821%0.213CC..Hα-helixtrans-64.4-40.8-178.9179-117.5000112.9E223 F230 V232 I233 F291 V294 I295E223-F228 WeakPolarHBondContact O-CB 3.5Å; E223-F228 PolarHBondContact O-N 2.85Å; F228-F230 VanDerWaalsContact C-N 3.35Å; F228-F230 PolarHBondContact O-N 3.29Å; F228-V232 HydrophobicContact CD2-CB 3.92Å; F228-V232 HydrophobicContact CD2-CG2 3.9Å; F228-V232 HydrophobicContact CE2-CB 3.65Å; F228-V232 HydrophobicContact CE2-CG1 3.92Å; F228-V232 HydrophobicContact CE2-CG2 3.85Å; F228-V232 HydrophobicContact CZ-CB 4.39Å; F228-V232 HydrophobicContact CZ-CG1 4.42Å; F228-V232 PolarHBondContact O-N 2.85Å; F228-I233 HydrophobicContact CD1-CD1 3.67Å; F228-I233 HydrophobicContact CD1-CG1 3.79Å; F228-I233 HydrophobicContact CE1-CD1 3.49Å; F228-I233 VanDerWaalsContact CE1-CD1 3.49Å; F228-I233 HydrophobicContact CE1-CG1 3.57Å; F228-I233 HydrophobicContact CG-CG1 4.48Å; F228-I233 HydrophobicContact CZ-CD1 4.43Å; F228-I233 HydrophobicContact CZ-CG1 4.09Å; F228-I233 PolarHBondContact O-N 3.4Å; F228-F291 HydrophobicContact CE1-CD2 4.2Å; F228-F291 HydrophobicContact CE1-CE2 4.4Å; F228-F291 HydrophobicContact CE2-CD2 4.43Å; F228-F291 AromaticContact CZ-CD2 3.58Å; F228-F291 HydrophobicContact CZ-CD2 3.58Å; F228-F291 HydrophobicContact CZ-CE2 4.21Å; F228-F291 HydrophobicContact CZ-CG 4.41Å; F228-V294 HydrophobicContact CD1-CG1 3.78Å; F228-V294 HydrophobicContact CD2-CB 3.97Å; F228-V294 HydrophobicContact CD2-CG1 3.48Å; F228-V294 VanDerWaalsContact CD2-CG1 3.48Å; F228-V294 HydrophobicContact CD2-CG2 4.04Å; F228-V294 HydrophobicContact CE1-CB 4.14Å; F228-V294 HydrophobicContact CE1-CG1 3.69Å; F228-V294 HydrophobicContact CE2-CB 3.38Å; F228-V294 HydrophobicContact CE2-CG1 3.4Å; F228-V294 HydrophobicContact CE2-CG2 3.59Å; F228-V294 HydrophobicContact CG-CG1 3.67Å; F228-V294 HydrophobicContact CZ-CB 3.48Å; F228-V294 VanDerWaalsContact CZ-CB 3.48Å; F228-V294 HydrophobicContact CZ-CG1 3.5Å; F228-V294 HydrophobicContact CZ-CG2 4.2Å; F228-I295 HydrophobicContact CE1-CG1 4Å; F228-I295 HydrophobicContact CZ-CG1 4.27Å
229I93.4Very high92.1Very high70 Ų7038.6 Ų38.636%0.35919%0.192SC..Iπ-helixtrans-59.6-48176-57.6-163.2000110.5Y225 F227 I233 A234Y225-I229 WeakPolarHBondContact O-CD1 3.32Å; Y225-I229 VanDerWaalsContact O-CG1 3.32Å; Y225-I229 WeakPolarHBondContact O-CG1 3.17Å; F227-I229 PolarHBondContact O-N 3.33Å; I229-I233 HydrophobicContact CG1-CD1 4.04Å; I229-I233 PolarHBondContact O-N 3.41Å; I229-A234 WeakPolarHBondContact O-CB 3.23Å; I229-A234 PolarHBondContact O-N 2.94Å
230F94.9Very high92.6Very high37 Ų3741.8 Ų41.816%0.16221%0.209CC..Iπ-helixtrans-70.7-40.5-178.2-176.8-99.2000113.1C114 W118 L156 L160 C226 F227 F228 P235C114-F230 WeakPolarHBondContact SG-CD1 3.33Å; C114-F230 WeakPolarHBondContact SG-CE1 3.38Å; W118-F230 AromaticContact CD1-CE1 3.81Å; W118-F230 AromaticContact CD1-CZ 3.88Å; W118-F230 AromaticContact CE2-CE2 3.63Å; W118-F230 AromaticContact CE2-CZ 3.68Å; W118-F230 HydrophobicContact CH2-CE2 4.47Å; W118-F230 AromaticContact CZ2-CD2 3.72Å; W118-F230 HydrophobicContact CZ2-CD2 3.72Å; W118-F230 AromaticContact CZ2-CE2 3.48Å; W118-F230 HydrophobicContact CZ2-CE2 3.48Å; W118-F230 VanDerWaalsContact CZ2-CE2 3.48Å; W118-F230 HydrophobicContact CZ2-CG 4.45Å; W118-F230 HydrophobicContact CZ2-CZ 4.04Å; W118-F230 AromaticContact NE1-CD1 3.64Å; W118-F230 AromaticContact NE1-CD2 3.92Å; W118-F230 AromaticContact NE1-CE1 3.27Å; W118-F230 VanDerWaalsContact NE1-CE1 3.27Å; W118-F230 AromaticContact NE1-CE2 3.56Å; W118-F230 AromaticContact NE1-CG 3.95Å; W118-F230 AromaticContact NE1-CZ 3.22Å; W118-F230 PolarHBondContact NE1-O 3.49Å; L156-F230 HydrophobicContact CD2-CE2 3.67Å; L156-F230 HydrophobicContact CD2-CZ 3.55Å; L156-F230 HydrophobicContact CG-CE1 4.47Å; L156-F230 HydrophobicContact CG-CE2 4.31Å; L156-F230 HydrophobicContact CG-CZ 3.84Å; L160-F230 HydrophobicContact CD1-CB 4.11Å; L160-F230 HydrophobicContact CD1-CD1 3.27Å; L160-F230 HydrophobicContact CD1-CD2 4.19Å; L160-F230 HydrophobicContact CD1-CE1 3.63Å; L160-F230 HydrophobicContact CD1-CE2 4.49Å; L160-F230 HydrophobicContact CD1-CG 3.59Å; L160-F230 HydrophobicContact CD1-CZ 4.24Å; C226-F230 WeakPolarHBondContact O-CB 3.37Å; C226-F230 PolarHBondContact O-N 3.03Å; C226-F230 VanDerWaalsContact O-N 3.08Å; F227-F230 PolarHBondContact O-N 3.28Å; F228-F230 VanDerWaalsContact C-N 3.35Å; F228-F230 PolarHBondContact O-N 3.29Å; F230-P235 WeakPolarHBondContact O-CD 3.45Å; F230-P235 WeakPolarHBondContact O-CG 3.12Å
231Q94.4Very high93.1Very high15 Ų1542.2 Ų42.27%0.0721%0.211CC..Iπ-helixtrans-77.7-40.2-174.6-175.9-169.719.800112.7C114 N117 F227C114-Q231 HydrophobicContact CB-CG 4.09Å; N117-Q231 PolarHBondContact ND2-O 3.1Å; F227-Q231 WeakPolarHBondContact O-CB 3.47Å; F227-Q231 PolarHBondContact O-N 2.65Å
232V92.3Very high93.5Very high7 Ų742.3 Ų42.34%0.04221%0.211CC..Iπ-helixtrans-120.9-55.8-168.1-175.30000112F228 T236 Q287 F291F228-V232 HydrophobicContact CD2-CB 3.92Å; F228-V232 HydrophobicContact CD2-CG2 3.9Å; F228-V232 HydrophobicContact CE2-CB 3.65Å; F228-V232 HydrophobicContact CE2-CG1 3.92Å; F228-V232 HydrophobicContact CE2-CG2 3.85Å; F228-V232 HydrophobicContact CZ-CB 4.39Å; F228-V232 HydrophobicContact CZ-CG1 4.42Å; F228-V232 PolarHBondContact O-N 2.85Å; V232-T236 VanDerWaalsContact O-CB 3.23Å; V232-T236 WeakPolarHBondContact O-CB 3.49Å; V232-T236 PolarHBondContact O-N 3.13Å; V232-T236 VanDerWaalsContact O-N 3.07Å; V232-T236 PolarHBondContact O-OG1 3.22Å; V232-Q287 HydrophobicContact CG1-CG 4.29Å; V232-F291 HydrophobicContact CG1-CB 3.7Å; V232-F291 HydrophobicContact CG1-CD2 3.97Å; V232-F291 HydrophobicContact CG1-CG 4.29Å
233I92.6Very high93.7Very high38 Ų3840.8 Ų40.820%0.19521%0.206CC..Iπ-helixtrans-63.8-55.1-170.4-47.7-163.7000111F228 I229 T236 L237 F291F228-I233 HydrophobicContact CD1-CD1 3.67Å; F228-I233 HydrophobicContact CD1-CG1 3.79Å; F228-I233 HydrophobicContact CE1-CD1 3.49Å; F228-I233 VanDerWaalsContact CE1-CD1 3.49Å; F228-I233 HydrophobicContact CE1-CG1 3.57Å; F228-I233 HydrophobicContact CG-CG1 4.48Å; F228-I233 HydrophobicContact CZ-CD1 4.43Å; F228-I233 HydrophobicContact CZ-CG1 4.09Å; F228-I233 PolarHBondContact O-N 3.4Å; I229-I233 HydrophobicContact CG1-CD1 4.04Å; I229-I233 PolarHBondContact O-N 3.41Å; I233-T236 PolarHBondContact O-N 2.87Å; I233-L237 HydrophobicContact CG2-CD1 3.82Å; I233-L237 HydrophobicContact CG2-CG 4.29Å; I233-L237 WeakPolarHBondContact O-CB 3.34Å; I233-L237 WeakPolarHBondContact O-CG 3.4Å; I233-L237 PolarHBondContact O-N 3.46Å; I233-F291 HydrophobicContact CB-CE2 4.19Å; I233-F291 HydrophobicContact CD1-CE2 4.01Å; I233-F291 HydrophobicContact CG1-CD2 4.06Å; I233-F291 HydrophobicContact CG1-CE2 3.66Å; I233-F291 HydrophobicContact CG2-CE2 4.09Å
234A95.2Very high94.1Very high21 Ų2145.4 Ų45.417%0.17423%0.226CC..Hα-helixtrans-62.2-49.5-17600000111.9W118 I229 T236 L237 F238W118-A234 HydrophobicContact CZ2-CB 4.38Å; I229-A234 WeakPolarHBondContact O-CB 3.23Å; I229-A234 PolarHBondContact O-N 2.94Å; A234-T236 VanDerWaalsContact C-N 3.34Å; A234-T236 PolarHBondContact O-N 3.44Å; A234-L237 PolarHBondContact O-N 3Å; A234-F238 HydrophobicContact CB-CD2 4.43Å; A234-F238 HydrophobicContact CB-CE2 4.35Å; A234-F238 WeakPolarHBondContact O-CD2 3.4Å; A234-F238 PolarHBondContact O-N 2.97Å
235P96.4Very high94.6Very high0 Ų047.5 Ų47.50%024%0.235CC..Hα-helixtrans-58-42.5176-29.238000113.9N117 W118 V121 F230 F238 V239N117-P235 HydrophobicContact CB-CB 3.99Å; N117-P235 HydrophobicContact CB-CG 4.16Å; W118-P235 HydrophobicContact CD2-CG 4.16Å; W118-P235 HydrophobicContact CG-CG 4.35Å; W118-P235 HydrophobicContact CZ2-CG 4.26Å; V121-P235 VanDerWaalsContact CG2-CA 3.49Å; V121-P235 HydrophobicContact CG2-CB 3.69Å; V121-P235 HydrophobicContact CG2-CG 4.47Å; F230-P235 WeakPolarHBondContact O-CD 3.45Å; F230-P235 WeakPolarHBondContact O-CG 3.12Å; P235-F238 PolarHBondContact O-N 3.31Å; P235-V239 WeakPolarHBondContact O-CB 3.3Å; P235-V239 VanDerWaalsContact O-CG2 3.29Å; P235-V239 WeakPolarHBondContact O-CG2 3.18Å; P235-V239 PolarHBondContact O-N 2.9Å
236T94.8Very high94.9Very high12 Ų1241.2 Ų41.27%0.07421%0.211CC..Hα-helixtrans-62.3-47178.7-570000111.2V232 I233 A234 V239 L240 L284V232-T236 VanDerWaalsContact O-CB 3.23Å; V232-T236 WeakPolarHBondContact O-CB 3.49Å; V232-T236 PolarHBondContact O-N 3.13Å; V232-T236 VanDerWaalsContact O-N 3.07Å; V232-T236 PolarHBondContact O-OG1 3.22Å; I233-T236 PolarHBondContact O-N 2.87Å; A234-T236 VanDerWaalsContact C-N 3.34Å; A234-T236 PolarHBondContact O-N 3.44Å; T236-V239 PolarHBondContact O-N 3.49Å; T236-L240 VanDerWaalsContact O-CB 3.27Å; T236-L240 WeakPolarHBondContact O-CB 3.27Å; T236-L240 PolarHBondContact O-N 2.95Å; T236-L284 HydrophobicContact CG2-CD2 3.62Å
237L95.5Very high95Very high88 Ų8841.3 Ų41.346%0.46121%0.212SC..Hα-helixtrans-63.7-44.5177.7-71.1177.5000112.1I233 A234 L240 I241I233-L237 HydrophobicContact CG2-CD1 3.82Å; I233-L237 HydrophobicContact CG2-CG 4.29Å; I233-L237 WeakPolarHBondContact O-CB 3.34Å; I233-L237 WeakPolarHBondContact O-CG 3.4Å; I233-L237 PolarHBondContact O-N 3.46Å; A234-L237 PolarHBondContact O-N 3Å; L237-L240 PolarHBondContact O-N 2.67Å; L237-I241 WeakPolarHBondContact O-CB 3.5Å; L237-I241 VanDerWaalsContact O-CG1 3.25Å; L237-I241 WeakPolarHBondContact O-CG1 3.29Å; L237-I241 PolarHBondContact O-N 3.04Å
238F97.4Very high95.1Very high93 Ų9347.1 Ų47.141%0.40824%0.237SC..Hα-helixtrans-63-46.1177.5-79.8-62.1000111.9W118 V121 A234 P235 L240 I241 M242W118-F238 HydrophobicContact CH2-CD2 4.4Å; W118-F238 HydrophobicContact CH2-CE2 4.28Å; W118-F238 HydrophobicContact CZ3-CD2 4.46Å; V121-F238 HydrophobicContact CG1-CB 3.86Å; V121-F238 HydrophobicContact CG1-CG 4.36Å; V121-F238 HydrophobicContact CG2-CB 4.18Å; A234-F238 HydrophobicContact CB-CD2 4.43Å; A234-F238 HydrophobicContact CB-CE2 4.35Å; A234-F238 WeakPolarHBondContact O-CD2 3.4Å; A234-F238 PolarHBondContact O-N 2.97Å; P235-F238 PolarHBondContact O-N 3.31Å; F238-L240 VanDerWaalsContact C-N 3.33Å; F238-L240 PolarHBondContact O-N 2.74Å; F238-I241 PolarHBondContact O-N 3.22Å; F238-M242 VanDerWaalsContact O-CB 3.3Å; F238-M242 WeakPolarHBondContact O-CB 3.34Å; F238-M242 WeakPolarHBondContact O-CG 3.29Å; F238-M242 PolarHBondContact O-N 3.32Å
239V97.1Very high95.1Very high0 Ų052.1 Ų52.10%026%0.257CS..Hα-helixtrans-61.4-42.7176.91690000110.8N120 V121 T124 P235 T236 S243 A280 F283 L284N120-V239 HydrophobicContact CB-CG2 4.34Å; V121-V239 HydrophobicContact CG2-CG2 4Å; T124-V239 HydrophobicContact CG2-CG1 4.23Å; T124-V239 HydrophobicContact CG2-CG2 4.38Å; P235-V239 WeakPolarHBondContact O-CB 3.3Å; P235-V239 VanDerWaalsContact O-CG2 3.29Å; P235-V239 WeakPolarHBondContact O-CG2 3.18Å; P235-V239 PolarHBondContact O-N 2.9Å; T236-V239 PolarHBondContact O-N 3.49Å; V239-S243 WeakPolarHBondContact O-CB 3.46Å; V239-S243 PolarHBondContact O-N 3.47Å; V239-S243 PolarHBondContact O-OG 2.88Å; V239-A280 HydrophobicContact CG1-CB 3.78Å; V239-F283 HydrophobicContact CB-CD1 4.21Å; V239-F283 HydrophobicContact CB-CE1 4.19Å; V239-F283 HydrophobicContact CG1-CD1 3.93Å; V239-F283 HydrophobicContact CG1-CE1 4.42Å; V239-F283 HydrophobicContact CG2-CD1 4.14Å; V239-F283 HydrophobicContact CG2-CE1 3.98Å; V239-L284 HydrophobicContact CG1-CD1 4.41Å; V239-L284 HydrophobicContact CG1-CD2 4.32Å; V239-L284 HydrophobicContact CG1-CG 4.18Å
240L96.3Very high94.8Very high91 Ų9151.1 Ų51.148%0.47625%0.254SS..Hα-helixtrans-60.7-52.4177.6-177.370.2000111.7T236 L237 F238 M242 S243 F244 L284T236-L240 VanDerWaalsContact O-CB 3.27Å; T236-L240 WeakPolarHBondContact O-CB 3.27Å; T236-L240 PolarHBondContact O-N 2.95Å; L237-L240 PolarHBondContact O-N 2.67Å; F238-L240 VanDerWaalsContact C-N 3.33Å; F238-L240 PolarHBondContact O-N 2.74Å; L240-M242 PolarHBondContact O-N 3.47Å; L240-S243 PolarHBondContact O-N 3.28Å; L240-F244 WeakPolarHBondContact O-CB 3.48Å; L240-F244 PolarHBondContact O-N 2.8Å; L240-L284 HydrophobicContact CB-CD1 4.4Å; L240-L284 HydrophobicContact CB-CD2 4.3Å; L240-L284 HydrophobicContact CD1-CD1 3.84Å
241I97.5Very high94.3Very high90 Ų9052.8 Ų52.846%0.46227%0.27SS..Hα-helixtrans-60.3-47.5-179.7-68.1165.5000110.5L237 F238 S243 F244 I245L237-I241 WeakPolarHBondContact O-CB 3.5Å; L237-I241 VanDerWaalsContact O-CG1 3.25Å; L237-I241 WeakPolarHBondContact O-CG1 3.29Å; L237-I241 PolarHBondContact O-N 3.04Å; F238-I241 PolarHBondContact O-N 3.22Å; I241-S243 PolarHBondContact O-N 2.94Å; I241-F244 WeakPolarHBondContact O-CB 3.12Å; I241-F244 PolarHBondContact O-N 3.4Å; I241-I245 HydrophobicContact CG2-CD1 3.9Å; I241-I245 VanDerWaalsContact O-CG1 3.29Å; I241-I245 WeakPolarHBondContact O-CG1 3.35Å; I241-I245 PolarHBondContact O-N 3.43Å
242M96.9Very high93.5Very high45 Ų4555.9 Ų55.922%0.22229%0.292CS..Hα-helixtrans-65.3-40.8-179.7-68.9-59.2172.500112T128 F238 L240 F244 I245 I246T128-M242 HydrophobicContact CG2-SD 3.75Å; F238-M242 VanDerWaalsContact O-CB 3.3Å; F238-M242 WeakPolarHBondContact O-CB 3.34Å; F238-M242 WeakPolarHBondContact O-CG 3.29Å; F238-M242 PolarHBondContact O-N 3.32Å; L240-M242 PolarHBondContact O-N 3.47Å; M242-F244 VanDerWaalsContact C-N 3.32Å; M242-F244 PolarHBondContact O-N 2.86Å; M242-I245 PolarHBondContact O-N 2.93Å; M242-I245 HydrophobicContact SD-CD1 4.29Å; M242-I246 VanDerWaalsContact O-CG1 3.29Å; M242-I246 WeakPolarHBondContact O-CG1 3.32Å; M242-I246 PolarHBondContact O-N 3.14Å
243S96.4Very high92.5Very high10 Ų1059.1 Ų59.17%0.0730%0.303CS..Hα-helixtrans-65.2-37.6177-60.20000112V239 L240 I241 I246 S247 A280V239-S243 WeakPolarHBondContact O-CB 3.46Å; V239-S243 PolarHBondContact O-N 3.47Å; V239-S243 PolarHBondContact O-OG 2.88Å; L240-S243 PolarHBondContact O-N 3.28Å; I241-S243 PolarHBondContact O-N 2.94Å; S243-I246 PolarHBondContact O-N 3.49Å; S243-S247 WeakPolarHBondContact O-CB 3.3Å; S243-S247 PolarHBondContact O-N 3.42Å; S243-S247 PolarHBondContact O-OG 3.46Å; S243-A280 VanDerWaalsContact OG-CB 3.25Å; S243-A280 WeakPolarHBondContact OG-CB 3.27Å
244F96.3Very high91.5Very high128 Ų12867.3 Ų67.356%0.56133%0.332SS*.Hα-helixtrans-64.8-45.5174.2-173.6-117.9000111.7L240 I241 M242 S247 F248L240-F244 WeakPolarHBondContact O-CB 3.48Å; L240-F244 PolarHBondContact O-N 2.8Å; I241-F244 WeakPolarHBondContact O-CB 3.12Å; I241-F244 PolarHBondContact O-N 3.4Å; M242-F244 VanDerWaalsContact C-N 3.32Å; M242-F244 PolarHBondContact O-N 2.86Å; F244-S247 PolarHBondContact O-N 3.48Å; F244-F248 HydrophobicContact CD1-CD2 4.01Å; F244-F248 AromaticContact CD1-CE2 3.7Å; F244-F248 HydrophobicContact CD1-CE2 3.7Å; F244-F248 HydrophobicContact CD2-CD2 4.39Å; F244-F248 HydrophobicContact CD2-CE2 4.02Å; F244-F248 AromaticContact CE1-CD2 3.92Å; F244-F248 HydrophobicContact CE1-CD2 3.92Å; F244-F248 AromaticContact CE1-CE2 3.15Å; F244-F248 HydrophobicContact CE1-CE2 3.15Å; F244-F248 HydrophobicContact CE1-CZ 4Å; F244-F248 HydrophobicContact CE2-CD2 4.25Å; F244-F248 AromaticContact CE2-CE2 3.47Å; F244-F248 HydrophobicContact CE2-CE2 3.47Å; F244-F248 VanDerWaalsContact CE2-CE2 3.47Å; F244-F248 AromaticContact CE2-CZ 3.67Å; F244-F248 HydrophobicContact CE2-CZ 3.67Å; F244-F248 HydrophobicContact CG-CD2 4.29Å; F244-F248 HydrophobicContact CG-CE2 4.14Å; F244-F248 HydrophobicContact CZ-CD2 4.04Å; F244-F248 AromaticContact CZ-CE2 3.01Å; F244-F248 HydrophobicContact CZ-CE2 3.01Å; F244-F248 AromaticContact CZ-CZ 3.38Å; F244-F248 HydrophobicContact CZ-CZ 3.38Å; F244-F248 WeakPolarHBondContact O-CD2 3.31Å; F244-F248 PolarHBondContact O-N 3.45Å
245I96.5Very high90.5Very high53 Ų5371.4 Ų71.427%0.27235%0.35SS..Hα-helixtrans-58.4-50.1173.6-67.3165.7000110.5T128 V132 I241 M242 S247 F248 Y249T128-I245 HydrophobicContact CG2-CG2 3.96Å; V132-I245 HydrophobicContact CG2-CG2 3.71Å; I241-I245 HydrophobicContact CG2-CD1 3.9Å; I241-I245 VanDerWaalsContact O-CG1 3.29Å; I241-I245 WeakPolarHBondContact O-CG1 3.35Å; I241-I245 PolarHBondContact O-N 3.43Å; M242-I245 PolarHBondContact O-N 2.93Å; M242-I245 HydrophobicContact SD-CD1 4.29Å; I245-S247 VanDerWaalsContact C-N 3.29Å; I245-S247 PolarHBondContact O-N 2.92Å; I245-F248 PolarHBondContact O-N 3.43Å; I245-Y249 HydrophobicContact CG2-CD2 3.88Å; I245-Y249 HydrophobicContact CG2-CE2 4.04Å; I245-Y249 WeakPolarHBondContact O-CD2 3.26Å; I245-Y249 PolarHBondContact O-N 3.34Å
246I95.1Very high89.3Confident4 Ų476.9 Ų76.92%0.02138%0.384CS..Hα-helixtrans-56.8-44.8177.7-70.1166.7000110.6R127 T128 M242 S243 F248 Y249 V250 T273 L277R127-I246 HydrophobicContact CB-CD1 4.28Å; T128-I246 WeakPolarHBondContact OG1-CD1 3.11Å; M242-I246 VanDerWaalsContact O-CG1 3.29Å; M242-I246 WeakPolarHBondContact O-CG1 3.32Å; M242-I246 PolarHBondContact O-N 3.14Å; S243-I246 PolarHBondContact O-N 3.49Å; I246-F248 PolarHBondContact O-N 3.22Å; I246-Y249 PolarHBondContact O-N 2.87Å; I246-V250 HydrophobicContact CG2-CG2 4.06Å; I246-V250 WeakPolarHBondContact O-CB 3.45Å; I246-V250 WeakPolarHBondContact O-CG2 3.17Å; I246-V250 PolarHBondContact O-N 3.5Å; I246-T273 HydrophobicContact CG2-CG2 3.43Å; I246-T273 VanDerWaalsContact CG2-CG2 3.43Å; I246-L277 HydrophobicContact CG2-CD1 4.37Å
247S93.8Very high88.2Confident53 Ų5385.9 Ų85.937%0.37142%0.422SS..Hα-helixtrans-61.3-43.6-178.8-60.90000112.1S243 F244 I245 V250 S251 L277S243-S247 WeakPolarHBondContact O-CB 3.3Å; S243-S247 PolarHBondContact O-N 3.42Å; S243-S247 PolarHBondContact O-OG 3.46Å; F244-S247 PolarHBondContact O-N 3.48Å; I245-S247 VanDerWaalsContact C-N 3.29Å; I245-S247 PolarHBondContact O-N 2.92Å; S247-V250 PolarHBondContact O-N 3.46Å; S247-S251 PolarHBondContact O-N 3.36Å; S247-S251 VanDerWaalsContact O-N 3.1Å; S247-L277 WeakPolarHBondContact OG-CD1 3.37Å
248F93.3Very high86.8Confident123 Ų12387.4 Ų87.454%0.53943%0.43SS..Hα-helixtrans-66.8-42175.9-80.4-52.6000113.1F244 I245 I246 V250 S251 P252F244-F248 HydrophobicContact CD1-CD2 4.01Å; F244-F248 AromaticContact CD1-CE2 3.7Å; F244-F248 HydrophobicContact CD1-CE2 3.7Å; F244-F248 HydrophobicContact CD2-CD2 4.39Å; F244-F248 HydrophobicContact CD2-CE2 4.02Å; F244-F248 AromaticContact CE1-CD2 3.92Å; F244-F248 HydrophobicContact CE1-CD2 3.92Å; F244-F248 AromaticContact CE1-CE2 3.15Å; F244-F248 HydrophobicContact CE1-CE2 3.15Å; F244-F248 HydrophobicContact CE1-CZ 4Å; F244-F248 HydrophobicContact CE2-CD2 4.25Å; F244-F248 AromaticContact CE2-CE2 3.47Å; F244-F248 HydrophobicContact CE2-CE2 3.47Å; F244-F248 VanDerWaalsContact CE2-CE2 3.47Å; F244-F248 AromaticContact CE2-CZ 3.67Å; F244-F248 HydrophobicContact CE2-CZ 3.67Å; F244-F248 HydrophobicContact CG-CD2 4.29Å; F244-F248 HydrophobicContact CG-CE2 4.14Å; F244-F248 HydrophobicContact CZ-CD2 4.04Å; F244-F248 AromaticContact CZ-CE2 3.01Å; F244-F248 HydrophobicContact CZ-CE2 3.01Å; F244-F248 AromaticContact CZ-CZ 3.38Å; F244-F248 HydrophobicContact CZ-CZ 3.38Å; F244-F248 WeakPolarHBondContact O-CD2 3.31Å; F244-F248 PolarHBondContact O-N 3.45Å; I245-F248 PolarHBondContact O-N 3.43Å; I246-F248 PolarHBondContact O-N 3.22Å; F248-V250 VanDerWaalsContact C-N 3.32Å; F248-V250 PolarHBondContact O-N 2.95Å; F248-S251 PolarHBondContact O-N 2.91Å; F248-P252 WeakPolarHBondContact O-CD 3.28Å
249Y90.8Very high85.2Confident116 Ų11684.9 Ų84.946%0.45542%0.42SS..Hα-helixtrans-69.7-31179-88.3-98.1000112.5V132 I245 I246 W253V132-Y249 HydrophobicContact CB-CE1 4.5Å; V132-Y249 HydrophobicContact CG1-CE1 4.07Å; V132-Y249 HydrophobicContact CG1-CE2 4.39Å; V132-Y249 HydrophobicContact CG2-CD1 4.37Å; V132-Y249 HydrophobicContact CG2-CD2 4.02Å; V132-Y249 HydrophobicContact CG2-CE1 4.44Å; V132-Y249 HydrophobicContact CG2-CE2 4.09Å; V132-Y249 HydrophobicContact CG2-CG 4.16Å; I245-Y249 HydrophobicContact CG2-CD2 3.88Å; I245-Y249 HydrophobicContact CG2-CE2 4.04Å; I245-Y249 WeakPolarHBondContact O-CD2 3.26Å; I245-Y249 PolarHBondContact O-N 3.34Å; I246-Y249 PolarHBondContact O-N 2.87Å; Y249-W253 PolarHBondContact O-NE1 2.96Å
250V87.6Confident84Confident50 Ų5093 Ų9330%0.30346%0.458SS..Hα-helixtrans-76.3-25.4176.5171.90000112V131 I246 S247 F248 W253 T273V131-V250 HydrophobicContact CG1-CG2 4.29Å; I246-V250 HydrophobicContact CG2-CG2 4.06Å; I246-V250 WeakPolarHBondContact O-CB 3.45Å; I246-V250 WeakPolarHBondContact O-CG2 3.17Å; I246-V250 PolarHBondContact O-N 3.5Å; S247-V250 PolarHBondContact O-N 3.46Å; F248-V250 VanDerWaalsContact C-N 3.32Å; F248-V250 PolarHBondContact O-N 2.95Å; V250-W253 VanDerWaalsContact O-CB 3.31Å; V250-W253 WeakPolarHBondContact O-CB 3.22Å; V250-W253 PolarHBondContact O-N 3.46Å; V250-T273 HydrophobicContact CG2-CG2 3.87Å
251S85.1Confident82.5Confident71 Ų7195.4 Ų95.450%0.49748%0.476SS..G310 helixtrans-58.1-48.5-177.6-178.30000113.9S247 F248 W253 R254S247-S251 PolarHBondContact O-N 3.36Å; S247-S251 VanDerWaalsContact O-N 3.1Å; F248-S251 PolarHBondContact O-N 2.91Å; S251-W253 PolarHBondContact O-N 3.45Å; S251-W253 VanDerWaalsContact O-N 3.07Å; S251-R254 WeakPolarHBondContact O-CB 3.3Å; S251-R254 PolarHBondContact O-N 2.92Å
252P76.7Confident81.4Confident81 Ų8194.1 Ų94.153%0.52647%0.473SS..G310 helixtrans-60.3-18.1174.3-25.132.5000114.7F248 R254 D255F248-P252 WeakPolarHBondContact O-CD 3.28Å; P252-R254 PolarHBondContact O-N 3.48Å; P252-D255 PolarHBondContact O-N 3.03Å
253W72.1Confident80.3Confident74 Ų7494.3 Ų94.328%0.2847%0.474SS..G310 helixtrans-76.4-2.8-177.7-6034.3000112.2Y249 V250 S251 D255 M270Y249-W253 PolarHBondContact O-NE1 2.96Å; V250-W253 VanDerWaalsContact O-CB 3.31Å; V250-W253 WeakPolarHBondContact O-CB 3.22Å; V250-W253 PolarHBondContact O-N 3.46Å; S251-W253 PolarHBondContact O-N 3.45Å; S251-W253 VanDerWaalsContact O-N 3.07Å; W253-D255 VanDerWaalsContact C-N 3.3Å; W253-M270 HydrophobicContact CB-CE 3.52Å; W253-M270 HydrophobicContact CD2-CE 4.31Å; W253-M270 HydrophobicContact CE3-CE 3.66Å; W253-M270 HydrophobicContact CE3-CG 4.06Å; W253-M270 HydrophobicContact CG-CE 4.34Å; W253-M270 HydrophobicContact CZ3-CG 4.45Å
254R70.6Confident79.4Confident211 Ų21198.2 Ų98.280%0.79650%0.498SS*.G310 helixtrans-76.1-14.8172.7-72.8-175.7163.6-169.6-3.1113.5S251 P252 T256S251-R254 WeakPolarHBondContact O-CB 3.3Å; S251-R254 PolarHBondContact O-N 2.92Å; P252-R254 PolarHBondContact O-N 3.48Å; R254-T256 PolarHBondContact O-N 2.89Å
255D74.3Confident78.4Confident106 Ų10698.3 Ų98.357%0.56749%0.494SS*.  trans-70.8101.7-179.2-77.5-22.8000111.6P252 W253 K257 I258 I259P252-D255 PolarHBondContact O-N 3.03Å; W253-D255 VanDerWaalsContact C-N 3.3Å; D255-K257 PolarHBondContact O-N 3.06Å; D255-I258 PolarHBondContact O-N 2.86Å; D255-I259 WeakPolarHBondContact O-CG1 3.31Å
256T70.6Confident77.7Confident116 Ų116100 Ų10071%0.71250%0.497SS*.G310 helixtrans-57.6-23.2-173.951.10000114.3R254 I258 I259R254-T256 PolarHBondContact O-N 2.89Å; T256-I258 VanDerWaalsContact C-N 3.31Å; T256-I258 PolarHBondContact O-N 3.24Å; T256-I259 PolarHBondContact O-N 3.39Å
257K72.8Confident77.2Confident200 Ų200106.3 Ų106.387%0.8752%0.521SS*.G310 helixtrans-70.5-20-176.5-64.7-176.6-179.7178.20114.3D255D255-K257 PolarHBondContact O-N 3.06Å
258I65Low76.7Confident121 Ų121109.9 Ų109.962%0.62153%0.531SS*.G310 helixtrans-99.3-0-175.7-54.9173.3000111.9D255 T256 R266D255-I258 PolarHBondContact O-N 2.86Å; T256-I258 VanDerWaalsContact C-N 3.31Å; T256-I258 PolarHBondContact O-N 3.24Å; I258-R266 PolarHBondContact O-NH1 3.2Å
259I64.1Low76.4Confident39 Ų39106.8 Ų106.820%0.252%0.518CS..  trans-93.6-20.3-158.6-69.7-175.6000113.7D255 T256 V261 N263D255-I259 WeakPolarHBondContact O-CG1 3.31Å; T256-I259 PolarHBondContact O-N 3.39Å; I259-V261 PolarHBondContact O-N 2.92Å; I259-N263 VanDerWaalsContact CG2-CG 3.48Å; I259-N263 WeakPolarHBondContact CG2-OD1 3.39Å; I259-N263 WeakPolarHBondContact O-CB 3.36Å; I259-N263 PolarHBondContact O-ND2 2.96Å; I259-N263 VanDerWaalsContact O-ND2 3.15Å; I259-N263 PolarHBondContact O-OD1 2.93Å
260E71.4Confident76.3Confident171 Ų171104.1 Ų104.180%0.79951%0.511SS*.G310 helixtrans-65.1-38.4-161.4-157.3165.3-173.100115.4N263E260-N263 WeakPolarHBondContact CA-ND2 3.44Å; E260-N263 PolarHBondContact O-ND2 3.12Å
261V66.6Low76.5Confident142 Ų142107.1 Ų107.186%0.86152%0.52SS*.G310 helixtrans-89.6-19.4-169-172.10000114.3I259I259-V261 PolarHBondContact O-N 2.92Å
262T73.6Confident76.8Confident63 Ų63104.5 Ų104.539%0.38750%0.503SS..G310 helixtrans-120.724.7-176.551.60000113.2V264 R266T262-V264 PolarHBondContact O-N 3.27Å; T262-R266 PolarHBondContact O-N 2.92Å; T262-R266 WeakPolarHBondContact OG1-CD 3.46Å; T262-R266 PolarHBondContact OG1-NE 2.95Å; T262-R266 PolarHBondContact OG1-NH1 3.32Å; T262-R266 PolarHBondContact OG1-NH2 3.5Å
263N73Confident77.6Confident48 Ų48101.2 Ų101.226%0.25748%0.481SS..Hα-helixtrans-65.7-37.3-158.7-125.9-31.7000115I259 E260 R267I259-N263 VanDerWaalsContact CG2-CG 3.48Å; I259-N263 WeakPolarHBondContact CG2-OD1 3.39Å; I259-N263 WeakPolarHBondContact O-CB 3.36Å; I259-N263 PolarHBondContact O-ND2 2.96Å; I259-N263 VanDerWaalsContact O-ND2 3.15Å; I259-N263 PolarHBondContact O-OD1 2.93Å; E260-N263 WeakPolarHBondContact CA-ND2 3.44Å; E260-N263 PolarHBondContact O-ND2 3.12Å; N263-R267 WeakPolarHBondContact O-CB 3.49Å; N263-R267 WeakPolarHBondContact O-CG 3.25Å; N263-R267 PolarHBondContact O-N 2.97Å; N263-R267 PolarHBondContact O-NE 2.96Å
264V78.2Confident78.6Confident92 Ų92104.3 Ų104.356%0.55849%0.493SS*.Hα-helixtrans-73.9-50.1-175.1-1790000110.8T262 R266 R267 H268T262-V264 PolarHBondContact O-N 3.27Å; V264-R266 PolarHBondContact O-N 2.94Å; V264-R267 PolarHBondContact O-N 3.37Å; V264-H268 PolarHBondContact O-CD2 3.21Å; V264-H268 PolarHBondContact O-N 2.94Å
265R75.7Confident79.7Confident131 Ų13194.4 Ų94.449%0.49446%0.456SS..Hα-helixtrans-62.3-45.1-178.5-174.2176.7-176.61604.4111.9R267 H268 Q269R265-R267 VanDerWaalsContact C-N 3.34Å; R265-R267 PolarHBondContact O-N 3.07Å; R265-H268 PolarHBondContact O-N 3.48Å; R265-Q269 PolarHBondContact O-N 2.86Å
266R80.9Confident80.7Confident88 Ų8889.5 Ų89.533%0.33243%0.43SS..Hα-helixtrans-62.4-39.7179-73.2-175.2177.9166.94.6112I258 T262 V264 H268 Q269 M270I258-R266 PolarHBondContact O-NH1 3.2Å; T262-R266 PolarHBondContact O-N 2.92Å; T262-R266 WeakPolarHBondContact OG1-CD 3.46Å; T262-R266 PolarHBondContact OG1-NE 2.95Å; T262-R266 PolarHBondContact OG1-NH1 3.32Å; T262-R266 PolarHBondContact OG1-NH2 3.5Å; V264-R266 PolarHBondContact O-N 2.94Å; R266-H268 PolarHBondContact O-N 3.03Å; R266-Q269 PolarHBondContact O-N 3.31Å; R266-M270 WeakPolarHBondContact O-CB 3.38Å; R266-M270 VanDerWaalsContact O-CG 3.3Å; R266-M270 WeakPolarHBondContact O-CG 3.18Å; R266-M270 PolarHBondContact O-N 3.46Å
267R84.7Confident81.9Confident137 Ų13785.8 Ų85.852%0.51741%0.405SS..Hα-helixtrans-61.2-41.5177.5-80.3-175.7-72.9175.6-3.5112.9N263 V264 R265 K271N263-R267 WeakPolarHBondContact O-CB 3.49Å; N263-R267 WeakPolarHBondContact O-CG 3.25Å; N263-R267 PolarHBondContact O-N 2.97Å; N263-R267 PolarHBondContact O-NE 2.96Å; V264-R267 PolarHBondContact O-N 3.37Å; R265-R267 VanDerWaalsContact C-N 3.34Å; R265-R267 PolarHBondContact O-N 3.07Å; R267-K271 WeakPolarHBondContact O-CG 3.37Å; R267-K271 PolarHBondContact O-N 3.36Å; R267-K271 VanDerWaalsContact O-N 3.13Å
268H84.8Confident83Confident128 Ų12881.3 Ų81.359%0.59339%0.386SS*.Hα-helixtrans-65.3-43176-78.5-77000112V264 R265 R266 K271 A272V264-H268 PolarHBondContact O-CD2 3.21Å; V264-H268 PolarHBondContact O-N 2.94Å; R265-H268 PolarHBondContact O-N 3.48Å; R266-H268 PolarHBondContact O-N 3.03Å; H268-K271 PolarHBondContact O-N 2.97Å; H268-A272 PolarHBondContact O-N 3.25Å; H268-A272 VanDerWaalsContact O-N 3.15Å
269Q87.1Confident84.5Confident57 Ų5775.8 Ų75.827%0.26636%0.358SS..Hα-helixtrans-64.3-44176.4-71.5-174.9-25.800112.3R265 R266 K271 A272 T273R265-Q269 PolarHBondContact O-N 2.86Å; R266-Q269 PolarHBondContact O-N 3.31Å; Q269-K271 VanDerWaalsContact C-N 3.32Å; Q269-K271 PolarHBondContact O-N 3.3Å; Q269-A272 PolarHBondContact O-N 3Å; Q269-A272 VanDerWaalsContact O-N 3.16Å; Q269-T273 PolarHBondContact O-N 2.7Å; Q269-T273 PolarHBondContact O-OG1 2.88Å; Q269-T273 VanDerWaalsContact O-OG1 3.14Å
270M87.7Confident86Confident60 Ų6074.1 Ų74.130%0.29635%0.349SS..Hα-helixtrans-58.2-42.3176.4-75.5176.2169.200112.3W253 R266 T273 R274W253-M270 HydrophobicContact CB-CE 3.52Å; W253-M270 HydrophobicContact CD2-CE 4.31Å; W253-M270 HydrophobicContact CE3-CE 3.66Å; W253-M270 HydrophobicContact CE3-CG 4.06Å; W253-M270 HydrophobicContact CG-CE 4.34Å; W253-M270 HydrophobicContact CZ3-CG 4.45Å; R266-M270 WeakPolarHBondContact O-CB 3.38Å; R266-M270 VanDerWaalsContact O-CG 3.3Å; R266-M270 WeakPolarHBondContact O-CG 3.18Å; R266-M270 PolarHBondContact O-N 3.46Å; M270-T273 PolarHBondContact O-N 3.08Å; M270-R274 VanDerWaalsContact O-CB 3.27Å; M270-R274 WeakPolarHBondContact O-CB 3.19Å; M270-R274 PolarHBondContact O-N 2.93Å
271K91.1Very high87.2Confident114 Ų11469.7 Ų69.750%0.49633%0.33SS..Hα-helixtrans-63.2-42.1176.7-74.5179.9179.2-176.90111.8R267 H268 Q269 R274 T275R267-K271 WeakPolarHBondContact O-CG 3.37Å; R267-K271 PolarHBondContact O-N 3.36Å; R267-K271 VanDerWaalsContact O-N 3.13Å; H268-K271 PolarHBondContact O-N 2.97Å; Q269-K271 VanDerWaalsContact C-N 3.32Å; Q269-K271 PolarHBondContact O-N 3.3Å; K271-R274 PolarHBondContact O-N 3.11Å; K271-T275 PolarHBondContact O-N 3.43Å; K271-T275 PolarHBondContact O-OG1 2.78Å
272A91.4Very high88.7Confident16 Ų1663.3 Ų63.313%0.13229%0.292CS..Hα-helixtrans-64.1-48.5176.200000111.4M59 H268 Q269 R274 T275 I276M59-A272 HydrophobicContact CE-CB 4.14Å; M59-A272 HydrophobicContact SD-CB 4.21Å; H268-A272 PolarHBondContact O-N 3.25Å; H268-A272 VanDerWaalsContact O-N 3.15Å; Q269-A272 PolarHBondContact O-N 3Å; Q269-A272 VanDerWaalsContact O-N 3.16Å; A272-R274 VanDerWaalsContact C-N 3.33Å; A272-R274 PolarHBondContact O-N 2.99Å; A272-T275 WeakPolarHBondContact O-CB 3.39Å; A272-T275 PolarHBondContact O-N 3.05Å; A272-T275 VanDerWaalsContact O-N 3.15Å; A272-I276 WeakPolarHBondContact O-CG1 3.41Å; A272-I276 PolarHBondContact O-N 3.41Å
273T93.1Very high89.7Confident11 Ų1160.4 Ų60.47%0.06727%0.274CS..Hα-helixtrans-59.3-43.3176.9-58.20000111.8V131 I246 V250 Q269 M270 T275 I276 L277V131-T273 HydrophobicContact CG2-CG2 3.81Å; I246-T273 HydrophobicContact CG2-CG2 3.43Å; I246-T273 VanDerWaalsContact CG2-CG2 3.43Å; V250-T273 HydrophobicContact CG2-CG2 3.87Å; Q269-T273 PolarHBondContact O-N 2.7Å; Q269-T273 PolarHBondContact O-OG1 2.88Å; Q269-T273 VanDerWaalsContact O-OG1 3.14Å; M270-T273 PolarHBondContact O-N 3.08Å; T273-T275 VanDerWaalsContact C-N 3.32Å; T273-T275 PolarHBondContact O-N 3.4Å; T273-I276 PolarHBondContact O-N 3.29Å; T273-L277 WeakPolarHBondContact O-CB 3.4Å; T273-L277 PolarHBondContact O-N 3.42Å
274R93.9Very high90.8Very high139 Ų13959.2 Ų59.253%0.52527%0.268SS..Hα-helixtrans-60.6-41175.8-175.217969.3177.25.4112.1M270 K271 A272 L277 F278M270-R274 VanDerWaalsContact O-CB 3.27Å; M270-R274 WeakPolarHBondContact O-CB 3.19Å; M270-R274 PolarHBondContact O-N 2.93Å; K271-R274 PolarHBondContact O-N 3.11Å; A272-R274 VanDerWaalsContact C-N 3.33Å; A272-R274 PolarHBondContact O-N 2.99Å; R274-L277 PolarHBondContact O-N 3.42Å; R274-F278 HydrophobicContact CG-CD2 3.87Å; R274-F278 HydrophobicContact CG-CE2 3.45Å; R274-F278 VanDerWaalsContact CG-CE2 3.45Å; R274-F278 HydrophobicContact CG-CZ 4.26Å; R274-F278 WeakPolarHBondContact O-CD2 3.11Å; R274-F278 PolarHBondContact O-N 3.3Å
275T94.8Very high91.7Very high4 Ų458.5 Ų58.53%0.02527%0.266CS..Hα-helixtrans-62.4-44.6177-54.30000110.9K271 A272 T273 F278 L279 I327 G331K271-T275 PolarHBondContact O-N 3.43Å; K271-T275 PolarHBondContact O-OG1 2.78Å; A272-T275 WeakPolarHBondContact O-CB 3.39Å; A272-T275 PolarHBondContact O-N 3.05Å; A272-T275 VanDerWaalsContact O-N 3.15Å; T273-T275 VanDerWaalsContact C-N 3.32Å; T273-T275 PolarHBondContact O-N 3.4Å; T275-F278 PolarHBondContact O-N 2.89Å; T275-L279 WeakPolarHBondContact O-CG 3.39Å; T275-L279 PolarHBondContact O-N 3.42Å; T275-I327 HydrophobicContact CG2-CG2 3.79Å; T275-G331 WeakPolarHBondContact OG1-CA 3.29Å
276I94.4Very high92.7Very high3 Ų354.1 Ų54.12%0.01525%0.25CS..Hα-helixtrans-67.1-37.7178-60.7-57.4000112M59 I123 T124 R127 A272 T273 F278 L279 A280M59-I276 HydrophobicContact CE-CD1 3.87Å; M59-I276 HydrophobicContact CE-CG1 4.14Å; I123-I276 HydrophobicContact CG2-CD1 3.67Å; I123-I276 HydrophobicContact CG2-CG1 4.46Å; I123-I276 HydrophobicContact CG2-CG2 3.94Å; T124-I276 HydrophobicContact CG2-CG2 4.28Å; R127-I276 HydrophobicContact CB-CG2 4.12Å; R127-I276 HydrophobicContact CG-CB 4.2Å; R127-I276 HydrophobicContact CG-CG1 3.81Å; R127-I276 HydrophobicContact CG-CG2 3.94Å; A272-I276 WeakPolarHBondContact O-CG1 3.41Å; A272-I276 PolarHBondContact O-N 3.41Å; T273-I276 PolarHBondContact O-N 3.29Å; I276-F278 VanDerWaalsContact C-N 3.3Å; I276-F278 PolarHBondContact O-N 3.4Å; I276-L279 HydrophobicContact CD1-CD1 3.74Å; I276-L279 WeakPolarHBondContact O-CB 2.98Å; I276-L279 PolarHBondContact O-N 3.33Å; I276-A280 WeakPolarHBondContact O-CB 3.25Å; I276-A280 PolarHBondContact O-N 2.89Å
277L95.5Very high93.3Very high38 Ų3850.1 Ų50.120%0.19924%0.236CC..Hα-helixtrans-63.9-37.9174.7-175.1148.4000111.2I246 S247 T273 R274 A280 I281I246-L277 HydrophobicContact CG2-CD1 4.37Å; S247-L277 WeakPolarHBondContact OG-CD1 3.37Å; T273-L277 WeakPolarHBondContact O-CB 3.4Å; T273-L277 PolarHBondContact O-N 3.42Å; R274-L277 PolarHBondContact O-N 3.42Å; L277-A280 PolarHBondContact O-N 2.9Å; L277-I281 HydrophobicContact CD2-CD1 3.44Å; L277-I281 VanDerWaalsContact CD2-CD1 3.44Å; L277-I281 HydrophobicContact CD2-CG1 4.26Å; L277-I281 HydrophobicContact CG-CD1 4.35Å; L277-I281 VanDerWaalsContact O-CG1 3.29Å; L277-I281 WeakPolarHBondContact O-CG1 3.5Å; L277-I281 PolarHBondContact O-N 2.93Å
278F96.4Very high93.6Very high106 Ų10645.9 Ų45.947%0.46523%0.225SC..Hα-helixtrans-64.9-40.4171.7-75.1-53.8000112.9R274 T275 I276 A280 I281 S282 I327R274-F278 HydrophobicContact CG-CD2 3.87Å; R274-F278 HydrophobicContact CG-CE2 3.45Å; R274-F278 VanDerWaalsContact CG-CE2 3.45Å; R274-F278 HydrophobicContact CG-CZ 4.26Å; R274-F278 WeakPolarHBondContact O-CD2 3.11Å; R274-F278 PolarHBondContact O-N 3.3Å; T275-F278 PolarHBondContact O-N 2.89Å; I276-F278 VanDerWaalsContact C-N 3.3Å; I276-F278 PolarHBondContact O-N 3.4Å; F278-A280 VanDerWaalsContact C-N 3.34Å; F278-I281 PolarHBondContact O-N 2.89Å; F278-S282 WeakPolarHBondContact O-CB 3.48Å; F278-S282 PolarHBondContact O-N 3.48Å; F278-I327 HydrophobicContact CB-CD1 4.34Å; F278-I327 HydrophobicContact CB-CG2 4.17Å
279L96Very high93.9Very high5 Ų541.8 Ų41.83%0.02621%0.209CC..Hα-helixtrans-61.1-44.1173.3-67.1170.2000111.4L63 T275 I276 S282 F283 N324 I327 Y328L63-L279 HydrophobicContact CD2-CD1 4.11Å; T275-L279 WeakPolarHBondContact O-CG 3.39Å; T275-L279 PolarHBondContact O-N 3.42Å; I276-L279 HydrophobicContact CD1-CD1 3.74Å; I276-L279 WeakPolarHBondContact O-CB 2.98Å; I276-L279 PolarHBondContact O-N 3.33Å; L279-S282 WeakPolarHBondContact O-CB 3.5Å; L279-S282 PolarHBondContact O-N 2.9Å; L279-F283 WeakPolarHBondContact O-CB 3.34Å; L279-F283 PolarHBondContact O-N 3.45Å; L279-N324 HydrophobicContact CD2-CB 4.12Å; L279-N324 VanDerWaalsContact CD2-OD1 3.23Å; L279-N324 WeakPolarHBondContact CD2-OD1 3.23Å; L279-I327 HydrophobicContact CD2-CB 3.86Å; L279-I327 HydrophobicContact CD2-CD1 3.93Å; L279-I327 HydrophobicContact CD2-CG2 3.63Å; L279-I327 HydrophobicContact CG-CG2 3.81Å; L279-Y328 HydrophobicContact CD1-CE1 3.73Å; L279-Y328 HydrophobicContact CD2-CD1 4.28Å; L279-Y328 HydrophobicContact CD2-CE1 3.62Å; L279-Y328 HydrophobicContact CG-CE1 4.29Å
280A96.4Very high93.9Very high3 Ų339.6 Ų39.63%0.02520%0.2CC..Hα-helixtrans-65-41.5178.800000112.3T124 V239 S243 I276 L277 F278 F283 L284T124-A280 HydrophobicContact CG2-CB 3.95Å; V239-A280 HydrophobicContact CG1-CB 3.78Å; S243-A280 VanDerWaalsContact OG-CB 3.25Å; S243-A280 WeakPolarHBondContact OG-CB 3.27Å; I276-A280 WeakPolarHBondContact O-CB 3.25Å; I276-A280 PolarHBondContact O-N 2.89Å; L277-A280 PolarHBondContact O-N 2.9Å; F278-A280 VanDerWaalsContact C-N 3.34Å; A280-F283 PolarHBondContact O-N 2.57Å; A280-L284 WeakPolarHBondContact O-CB 3.48Å; A280-L284 VanDerWaalsContact O-CG 3.25Å; A280-L284 WeakPolarHBondContact O-CG 3.42Å; A280-L284 PolarHBondContact O-N 2.67Å
281I96.4Very high93.9Very high79 Ų7939 Ų3941%0.40520%0.197SC..Hα-helixtrans-64-44.3174.5-70174000110.6L277 F278 L284 C285L277-I281 HydrophobicContact CD2-CD1 3.44Å; L277-I281 VanDerWaalsContact CD2-CD1 3.44Å; L277-I281 HydrophobicContact CD2-CG1 4.26Å; L277-I281 HydrophobicContact CG-CD1 4.35Å; L277-I281 VanDerWaalsContact O-CG1 3.29Å; L277-I281 WeakPolarHBondContact O-CG1 3.5Å; L277-I281 PolarHBondContact O-N 2.93Å; F278-I281 PolarHBondContact O-N 2.89Å; I281-L284 PolarHBondContact O-N 2.93Å; I281-C285 WeakPolarHBondContact O-CB 3.22Å; I281-C285 PolarHBondContact O-N 2.89Å; I281-C285 PolarHBondContact O-SG 3.42Å
282S96.8Very high93.9Very high8 Ų837.3 Ų37.36%0.05619%0.192CC..Hα-helixtrans-55.3-55.3175.1-173.40000110.4F278 L279 L284 C285 F286 D320 I323F278-S282 WeakPolarHBondContact O-CB 3.48Å; F278-S282 PolarHBondContact O-N 3.48Å; L279-S282 WeakPolarHBondContact O-CB 3.5Å; L279-S282 PolarHBondContact O-N 2.9Å; S282-L284 VanDerWaalsContact C-N 3.31Å; S282-L284 PolarHBondContact O-N 3.01Å; S282-C285 PolarHBondContact O-N 3.06Å; S282-F286 WeakPolarHBondContact O-CD2 3.16Å; S282-F286 PolarHBondContact O-N 3.22Å; S282-F286 WeakPolarHBondContact OG-CD2 3.22Å; S282-D320 PolarHBondContact OG-OD1 2.95Å; S282-I323 WeakPolarHBondContact OG-CG2 3.48Å
283F96.3Very high93.8Very high1 Ų138.2 Ų38.20%0.00419%0.194CC..Hα-helixtrans-52.4-47.9177.8171.7-105000112N117 N120 V239 L279 A280 Q287 D320N117-F283 HydrophobicContact CB-CE2 4.3Å; N117-F283 HydrophobicContact CB-CZ 4.26Å; N117-F283 WeakPolarHBondContact OD1-CE2 3.34Å; N120-F283 HydrophobicContact CB-CG 4.47Å; N120-F283 WeakPolarHBondContact ND2-CD2 3.48Å; V239-F283 HydrophobicContact CB-CD1 4.21Å; V239-F283 HydrophobicContact CB-CE1 4.19Å; V239-F283 HydrophobicContact CG1-CD1 3.93Å; V239-F283 HydrophobicContact CG1-CE1 4.42Å; V239-F283 HydrophobicContact CG2-CD1 4.14Å; V239-F283 HydrophobicContact CG2-CE1 3.98Å; L279-F283 WeakPolarHBondContact O-CB 3.34Å; L279-F283 PolarHBondContact O-N 3.45Å; A280-F283 PolarHBondContact O-N 2.57Å; F283-Q287 HydrophobicContact CD2-CB 4.36Å; F283-Q287 HydrophobicContact CE2-CB 4.14Å; F283-Q287 HydrophobicContact CE2-CG 4.08Å; F283-Q287 HydrophobicContact CZ-CB 4.4Å; F283-Q287 HydrophobicContact CZ-CG 4.17Å; F283-Q287 WeakPolarHBondContact O-CB 3.16Å; F283-Q287 PolarHBondContact O-N 2.82Å; F283-D320 PolarHBondContact N-OD1 3.28Å
284L96.1Very high93.3Very high24 Ų2438.1 Ų38.113%0.12619%0.194CC..Hα-helixtrans-62.5-46.5177.3-69.5172.1000111.6T236 V239 L240 A280 I281 S282 F286 T288T236-L284 HydrophobicContact CG2-CD2 3.62Å; V239-L284 HydrophobicContact CG1-CD1 4.41Å; V239-L284 HydrophobicContact CG1-CD2 4.32Å; V239-L284 HydrophobicContact CG1-CG 4.18Å; L240-L284 HydrophobicContact CB-CD1 4.4Å; L240-L284 HydrophobicContact CB-CD2 4.3Å; L240-L284 HydrophobicContact CD1-CD1 3.84Å; A280-L284 WeakPolarHBondContact O-CB 3.48Å; A280-L284 VanDerWaalsContact O-CG 3.25Å; A280-L284 WeakPolarHBondContact O-CG 3.42Å; A280-L284 PolarHBondContact O-N 2.67Å; I281-L284 PolarHBondContact O-N 2.93Å; S282-L284 VanDerWaalsContact C-N 3.31Å; S282-L284 PolarHBondContact O-N 3.01Å; L284-F286 PolarHBondContact O-N 3.07Å; L284-T288 WeakPolarHBondContact O-CB 3.01Å; L284-T288 PolarHBondContact O-N 3.37Å; L284-T288 PolarHBondContact O-OG1 2.94Å
285C96.4Very high93Very high77 Ų7734.1 Ų34.152%0.5218%0.182SC..Hα-helixtrans-62.6-42-178.8-73.50000112.9I281 S282 P289I281-C285 WeakPolarHBondContact O-CB 3.22Å; I281-C285 PolarHBondContact O-N 2.89Å; I281-C285 PolarHBondContact O-SG 3.42Å; S282-C285 PolarHBondContact O-N 3.06Å; C285-P289 WeakPolarHBondContact O-CD 3.45Å
286F96Very high92.8Very high38 Ų3836.3 Ų36.317%0.16719%0.193CC..Hα-helixtrans-85.5-29.4-177.1-70.4-73.6000113.5S282 L284 L316 F319 D320 I323S282-F286 WeakPolarHBondContact O-CD2 3.16Å; S282-F286 PolarHBondContact O-N 3.22Å; S282-F286 WeakPolarHBondContact OG-CD2 3.22Å; L284-F286 PolarHBondContact O-N 3.07Å; F286-L316 HydrophobicContact CD1-CB 3.91Å; F286-L316 HydrophobicContact CD1-CD2 3.57Å; F286-L316 HydrophobicContact CD1-CG 4.33Å; F286-L316 VanDerWaalsContact CD1-O 3.28Å; F286-L316 WeakPolarHBondContact CD1-O 3.36Å; F286-L316 HydrophobicContact CE1-CD2 3.67Å; F286-F319 HydrophobicContact CD1-CB 4.34Å; F286-F319 HydrophobicContact CE1-CB 4.11Å; F286-D320 HydrophobicContact CB-CB 3.7Å; F286-D320 HydrophobicContact CD2-CB 4.11Å; F286-D320 HydrophobicContact CG-CB 3.97Å; F286-I323 HydrophobicContact CD2-CD1 4.22Å; F286-I323 HydrophobicContact CE1-CD1 3.9Å; F286-I323 HydrophobicContact CE2-CD1 3.21Å; F286-I323 HydrophobicContact CE2-CG1 4.46Å; F286-I323 HydrophobicContact CZ-CD1 3.03Å
287Q93Very high92.3Very high5 Ų540.2 Ų40.22%0.02321%0.211CC..Hα-helixtrans-84.5-28.7179.1-164.97030.300113V232 F283 S290 F291V232-Q287 HydrophobicContact CG1-CG 4.29Å; F283-Q287 HydrophobicContact CD2-CB 4.36Å; F283-Q287 HydrophobicContact CE2-CB 4.14Å; F283-Q287 HydrophobicContact CE2-CG 4.08Å; F283-Q287 HydrophobicContact CZ-CB 4.4Å; F283-Q287 HydrophobicContact CZ-CG 4.17Å; F283-Q287 WeakPolarHBondContact O-CB 3.16Å; F283-Q287 PolarHBondContact O-N 2.82Å; Q287-S290 WeakPolarHBondContact O-CB 3.4Å; Q287-S290 PolarHBondContact O-N 3.31Å; Q287-F291 PolarHBondContact O-N 2.95Å
288T91.7Very high91.7Very high48 Ų4841 Ų4129%0.29421%0.214SC..Hα-helixtrans-58.8-42.3-176.7-66.70000113.2L284 S290 F291 I292L284-T288 WeakPolarHBondContact O-CB 3.01Å; L284-T288 PolarHBondContact O-N 3.37Å; L284-T288 PolarHBondContact O-OG1 2.94Å; T288-S290 VanDerWaalsContact C-N 3.34Å; T288-S290 PolarHBondContact O-N 3.27Å; T288-F291 WeakPolarHBondContact O-CB 3.5Å; T288-F291 PolarHBondContact O-N 2.99Å; T288-F291 VanDerWaalsContact O-N 3.16Å; T288-I292 HydrophobicContact CG2-CD1 3.64Å; T288-I292 HydrophobicContact CG2-CG1 4.1Å; T288-I292 WeakPolarHBondContact O-CG1 3.36Å; T288-I292 PolarHBondContact O-N 3.34Å
289P91.2Very high91.2Very high41 Ų4142.5 Ų42.527%0.26622%0.218SC..Hα-helixtrans-58.5-43.5176.1-30.641000112.9C285 F291 I292 L293 L316C285-P289 WeakPolarHBondContact O-CD 3.45Å; P289-F291 VanDerWaalsContact C-N 3.33Å; P289-F291 PolarHBondContact O-N 3.09Å; P289-I292 PolarHBondContact O-N 2.83Å; P289-L293 VanDerWaalsContact O-CG 3.32Å; P289-L293 WeakPolarHBondContact O-CG 3.12Å; P289-L293 PolarHBondContact O-N 2.79Å; P289-L316 HydrophobicContact CB-CD1 3.89Å; P289-L316 HydrophobicContact CG-CD1 3.79Å
290S87.8Confident90.7Very high11 Ų1144.6 Ų44.68%0.07723%0.23CC..Hα-helixtrans-61.5-41.7175.1-47.70000111.9Q287 T288 L293 V294 A313Q287-S290 WeakPolarHBondContact O-CB 3.4Å; Q287-S290 PolarHBondContact O-N 3.31Å; T288-S290 VanDerWaalsContact C-N 3.34Å; T288-S290 PolarHBondContact O-N 3.27Å; S290-L293 PolarHBondContact O-N 3.05Å; S290-V294 WeakPolarHBondContact O-CG2 3.36Å; S290-V294 PolarHBondContact O-N 3.45Å; S290-V294 VanDerWaalsContact O-N 3.14Å; S290-A313 WeakPolarHBondContact OG-CB 3.35Å
291F87.4Confident90Very high49 Ų4952.5 Ų52.522%0.21527%0.272CS..Hα-helixtrans-60.8-46.8174.6166.3-103.1000112.3F228 V232 I233 Q287 T288 P289 V294 I295F228-F291 HydrophobicContact CE1-CD2 4.2Å; F228-F291 HydrophobicContact CE1-CE2 4.4Å; F228-F291 HydrophobicContact CE2-CD2 4.43Å; F228-F291 AromaticContact CZ-CD2 3.58Å; F228-F291 HydrophobicContact CZ-CD2 3.58Å; F228-F291 HydrophobicContact CZ-CE2 4.21Å; F228-F291 HydrophobicContact CZ-CG 4.41Å; V232-F291 HydrophobicContact CG1-CB 3.7Å; V232-F291 HydrophobicContact CG1-CD2 3.97Å; V232-F291 HydrophobicContact CG1-CG 4.29Å; I233-F291 HydrophobicContact CB-CE2 4.19Å; I233-F291 HydrophobicContact CD1-CE2 4.01Å; I233-F291 HydrophobicContact CG1-CD2 4.06Å; I233-F291 HydrophobicContact CG1-CE2 3.66Å; I233-F291 HydrophobicContact CG2-CE2 4.09Å; Q287-F291 PolarHBondContact O-N 2.95Å; T288-F291 WeakPolarHBondContact O-CB 3.5Å; T288-F291 PolarHBondContact O-N 2.99Å; T288-F291 VanDerWaalsContact O-N 3.16Å; P289-F291 VanDerWaalsContact C-N 3.33Å; P289-F291 PolarHBondContact O-N 3.09Å; F291-V294 PolarHBondContact O-N 2.69Å; F291-I295 HydrophobicContact CD1-CD1 4.14Å; F291-I295 HydrophobicContact CD2-CD1 4.02Å; F291-I295 HydrophobicContact CE1-CD1 3.57Å; F291-I295 HydrophobicContact CE2-CD1 3.42Å; F291-I295 VanDerWaalsContact CE2-CD1 3.42Å; F291-I295 HydrophobicContact CE2-CG1 4.32Å; F291-I295 HydrophobicContact CG-CD1 4.36Å; F291-I295 HydrophobicContact CZ-CD1 3.18Å; F291-I295 HydrophobicContact CZ-CG1 4.46Å; F291-I295 WeakPolarHBondContact O-CG1 3.36Å; F291-I295 PolarHBondContact O-N 3.02Å; F291-I295 VanDerWaalsContact O-N 3.17Å
292I91.1Very high89.4Confident78 Ų7853.3 Ų53.340%0.428%0.277SS..Hα-helixtrans-63.2-43.4179.1-68.9170.3000110.6T288 P289 V294 I295 I296T288-I292 HydrophobicContact CG2-CD1 3.64Å; T288-I292 HydrophobicContact CG2-CG1 4.1Å; T288-I292 WeakPolarHBondContact O-CG1 3.36Å; T288-I292 PolarHBondContact O-N 3.34Å; P289-I292 PolarHBondContact O-N 2.83Å; I292-V294 PolarHBondContact O-N 2.92Å; I292-I295 PolarHBondContact O-N 3Å; I292-I296 HydrophobicContact CG2-CD1 3.61Å; I292-I296 HydrophobicContact CG2-CG1 4.24Å; I292-I296 VanDerWaalsContact O-CG1 3.3Å; I292-I296 WeakPolarHBondContact O-CG1 3.32Å; I292-I296 PolarHBondContact O-N 3.42Å
293L88.3Confident88.4Confident34 Ų3463 Ų6318%0.17832%0.318CS..Hα-helixtrans-63.7-42.2-179.2-71.4175.4000112.7P289 S290 I295 I296 Q297 F306 A309 A313P289-L293 VanDerWaalsContact O-CG 3.32Å; P289-L293 WeakPolarHBondContact O-CG 3.12Å; P289-L293 PolarHBondContact O-N 2.79Å; S290-L293 PolarHBondContact O-N 3.05Å; L293-I295 VanDerWaalsContact C-N 3.33Å; L293-I295 PolarHBondContact O-N 3.25Å; L293-I296 PolarHBondContact O-N 2.87Å; L293-Q297 VanDerWaalsContact O-CB 3.31Å; L293-Q297 WeakPolarHBondContact O-CB 3.42Å; L293-Q297 PolarHBondContact O-N 3.42Å; L293-F306 HydrophobicContact CD2-CD1 4.41Å; L293-A309 VanDerWaalsContact CD1-C 3.47Å; L293-A309 HydrophobicContact CD1-CB 3.79Å; L293-A309 WeakPolarHBondContact CD1-O 3.46Å; L293-A309 HydrophobicContact CD2-CB 3.58Å; L293-A309 HydrophobicContact CG-CB 4.36Å; L293-A313 HydrophobicContact CD1-CB 3.71Å
294V83.8Confident87.4Confident10 Ų1067.8 Ų67.86%0.06134%0.343CS..Hα-helixtrans-62.2-43.6176175.40000110.8M1 F228 S290 F291 I292 I296 Q297 H298M1-V294 HydrophobicContact CE-CG2 4.14Å; M1-V294 HydrophobicContact CG-CG2 4.34Å; M1-V294 HydrophobicContact SD-CG2 3.4Å; M1-V294 WeakPolarHBondContact SD-CG2 3.09Å; F228-V294 HydrophobicContact CD1-CG1 3.78Å; F228-V294 HydrophobicContact CD2-CB 3.97Å; F228-V294 HydrophobicContact CD2-CG1 3.48Å; F228-V294 VanDerWaalsContact CD2-CG1 3.48Å; F228-V294 HydrophobicContact CD2-CG2 4.04Å; F228-V294 HydrophobicContact CE1-CB 4.14Å; F228-V294 HydrophobicContact CE1-CG1 3.69Å; F228-V294 HydrophobicContact CE2-CB 3.38Å; F228-V294 HydrophobicContact CE2-CG1 3.4Å; F228-V294 HydrophobicContact CE2-CG2 3.59Å; F228-V294 HydrophobicContact CG-CG1 3.67Å; F228-V294 HydrophobicContact CZ-CB 3.48Å; F228-V294 VanDerWaalsContact CZ-CB 3.48Å; F228-V294 HydrophobicContact CZ-CG1 3.5Å; F228-V294 HydrophobicContact CZ-CG2 4.2Å; S290-V294 WeakPolarHBondContact O-CG2 3.36Å; S290-V294 PolarHBondContact O-N 3.45Å; S290-V294 VanDerWaalsContact O-N 3.14Å; F291-V294 PolarHBondContact O-N 2.69Å; I292-V294 PolarHBondContact O-N 2.92Å; V294-I296 PolarHBondContact O-N 2.82Å; V294-Q297 PolarHBondContact O-N 3.05Å; V294-H298 WeakPolarHBondContact O-CB 3.26Å; V294-H298 PolarHBondContact O-N 2.88Å; V294-H298 PolarHBondContact O-ND1 3.3Å
295I88.1Confident86.4Confident54 Ų5474.1 Ų74.128%0.27737%0.372SS..Hα-helixtrans-60.7-47176.7-72175.9000110.6F228 F291 I292 L293 Q297 H298 Y299F228-I295 HydrophobicContact CE1-CG1 4Å; F228-I295 HydrophobicContact CZ-CG1 4.27Å; F291-I295 HydrophobicContact CD1-CD1 4.14Å; F291-I295 HydrophobicContact CD2-CD1 4.02Å; F291-I295 HydrophobicContact CE1-CD1 3.57Å; F291-I295 HydrophobicContact CE2-CD1 3.42Å; F291-I295 VanDerWaalsContact CE2-CD1 3.42Å; F291-I295 HydrophobicContact CE2-CG1 4.32Å; F291-I295 HydrophobicContact CG-CD1 4.36Å; F291-I295 HydrophobicContact CZ-CD1 3.18Å; F291-I295 HydrophobicContact CZ-CG1 4.46Å; F291-I295 WeakPolarHBondContact O-CG1 3.36Å; F291-I295 PolarHBondContact O-N 3.02Å; F291-I295 VanDerWaalsContact O-N 3.17Å; I292-I295 PolarHBondContact O-N 3Å; L293-I295 VanDerWaalsContact C-N 3.33Å; L293-I295 PolarHBondContact O-N 3.25Å; I295-Q297 VanDerWaalsContact C-N 3.33Å; I295-Q297 PolarHBondContact O-N 3.32Å; I295-H298 PolarHBondContact O-N 3.07Å; I295-Y299 HydrophobicContact CB-CD2 4.38Å; I295-Y299 HydrophobicContact CG2-CD2 3.93Å; I295-Y299 WeakPolarHBondContact O-CB 3.3Å; I295-Y299 WeakPolarHBondContact O-CD2 3.08Å; I295-Y299 PolarHBondContact O-N 3.42Å
296I89.4Confident85.7Confident51 Ų5173 Ų7326%0.26236%0.358SS..Hα-helixtrans-60.1-47.3178-69.1171000109.8I292 L293 V294 H298 T300 F306I292-I296 HydrophobicContact CG2-CD1 3.61Å; I292-I296 HydrophobicContact CG2-CG1 4.24Å; I292-I296 VanDerWaalsContact O-CG1 3.3Å; I292-I296 WeakPolarHBondContact O-CG1 3.32Å; I292-I296 PolarHBondContact O-N 3.42Å; L293-I296 PolarHBondContact O-N 2.87Å; V294-I296 PolarHBondContact O-N 2.82Å; I296-H298 VanDerWaalsContact C-N 3.31Å; I296-H298 PolarHBondContact O-N 2.94Å; I296-T300 HydrophobicContact CG2-CG2 4.34Å; I296-T300 WeakPolarHBondContact CG2-OG1 3.06Å; I296-T300 WeakPolarHBondContact O-CA 3.19Å; I296-T300 VanDerWaalsContact O-CB 3.3Å; I296-T300 WeakPolarHBondContact O-CB 3.4Å; I296-T300 PolarHBondContact O-N 2.94Å; I296-T300 PolarHBondContact O-OG1 2.87Å; I296-F306 HydrophobicContact CG2-CE1 3.93Å; I296-F306 HydrophobicContact CG2-CE2 4.42Å; I296-F306 HydrophobicContact CG2-CZ 3.58Å
297Q84.1Confident85.1Confident84 Ų8474.4 Ų74.439%0.39337%0.365SS..Hα-helixtrans-61.6-36.2-178.8-177.6174.8-13.100113.2M1 L293 V294 I295M1-Q297 VanDerWaalsContact CE-OE1 3.25Å; L293-Q297 VanDerWaalsContact O-CB 3.31Å; L293-Q297 WeakPolarHBondContact O-CB 3.42Å; L293-Q297 PolarHBondContact O-N 3.42Å; V294-Q297 PolarHBondContact O-N 3.05Å; I295-Q297 VanDerWaalsContact C-N 3.33Å; I295-Q297 PolarHBondContact O-N 3.32Å
298H82.3Confident84.8Confident54 Ų5479.2 Ų79.225%0.2539%0.39CS..Hα-helixtrans-91.4-33.3-175.6-73.960.2000113.7V294 I295 I296V294-H298 WeakPolarHBondContact O-CB 3.26Å; V294-H298 PolarHBondContact O-N 2.88Å; V294-H298 PolarHBondContact O-ND1 3.3Å; I295-H298 PolarHBondContact O-N 3.07Å; I296-H298 VanDerWaalsContact C-N 3.31Å; I296-H298 PolarHBondContact O-N 2.94Å
299Y86Confident84.7Confident139 Ų13978.4 Ų78.455%0.54539%0.389SS..Hα-helixtrans-105-10.6-173.5-67.1-79.4000113.8I295I295-Y299 HydrophobicContact CB-CD2 4.38Å; I295-Y299 HydrophobicContact CG2-CD2 3.93Å; I295-Y299 WeakPolarHBondContact O-CB 3.3Å; I295-Y299 WeakPolarHBondContact O-CD2 3.08Å; I295-Y299 PolarHBondContact O-N 3.42Å
300T86.8Confident84.5Confident48 Ų4878.8 Ų78.829%0.29439%0.386SS..  trans-112.4131.4174.477.90000109.8I296 L302I296-T300 HydrophobicContact CG2-CG2 4.34Å; I296-T300 WeakPolarHBondContact CG2-OG1 3.06Å; I296-T300 WeakPolarHBondContact O-CA 3.19Å; I296-T300 VanDerWaalsContact O-CB 3.3Å; I296-T300 WeakPolarHBondContact O-CB 3.4Å; I296-T300 PolarHBondContact O-N 2.94Å; I296-T300 PolarHBondContact O-OG1 2.87Å; T300-L302 PolarHBondContact O-N 3.48Å
301N81.6Confident84.5Confident170 Ų17079.2 Ų79.291%0.90939%0.388SS*.  trans-73.625.2172.9-72.7-23.7000112.4K303N301-K303 PolarHBondContact O-N 3.29Å; N301-K303 VanDerWaalsContact O-N 3.15Å
302L84Confident84.8Confident96 Ų9680.2 Ų80.250%0.50340%0.398SS..  trans-74.9105.3-179.4-68.4176.7000108.8T300 I304 F306T300-L302 PolarHBondContact O-N 3.48Å; L302-I304 HydrophobicContact CB-CD1 4.22Å; L302-I304 HydrophobicContact CB-CG1 4.24Å; L302-I304 HydrophobicContact CD1-CD1 4.32Å; L302-I304 HydrophobicContact CD2-CD1 4.47Å; L302-I304 PolarHBondContact O-N 3.15Å; L302-F306 HydrophobicContact CB-CZ 4.39Å
303K74Confident84.8Confident211 Ų21176.7 Ų76.792%0.91738%0.38SS*.  trans-73.942.8171.8-62.4-174.4177.3-175.40112.2N301N301-K303 PolarHBondContact O-N 3.29Å; N301-K303 VanDerWaalsContact O-N 3.15Å
304I76.1Confident85Confident102 Ų10275.6 Ų75.652%0.52338%0.375SS..  trans-86.6135.3177.3-60.5173.1000107.6L302 F306L302-I304 HydrophobicContact CB-CD1 4.22Å; L302-I304 HydrophobicContact CB-CG1 4.24Å; L302-I304 HydrophobicContact CD1-CD1 4.32Å; L302-I304 HydrophobicContact CD2-CD1 4.47Å; L302-I304 PolarHBondContact O-N 3.15Å; I304-F306 HydrophobicContact CB-CE1 4.39Å; I304-F306 HydrophobicContact CB-CE2 4.07Å; I304-F306 HydrophobicContact CB-CZ 3.96Å; I304-F306 WeakPolarHBondContact O-CD2 3.36Å; I304-F306 WeakPolarHBondContact O-CE2 3.43Å; I304-F306 PolarHBondContact O-N 2.84Å
305E75.4Confident85.4Confident157 Ų15777 Ų7773%0.73438%0.382SS*.  trans-66.898172.9-67.2-174163.200109.8Q307E305-Q307 PolarHBondContact O-N 3.34Å; E305-Q307 VanDerWaalsContact O-N 3.14Å
306F82.5Confident85.8Confident52 Ų5276.5 Ų76.523%0.22838%0.379CS..  trans-79.718-177.9-69.9-75.3000114L293 I296 L302 I304 L308 A309 K310L293-F306 HydrophobicContact CD2-CD1 4.41Å; I296-F306 HydrophobicContact CG2-CE1 3.93Å; I296-F306 HydrophobicContact CG2-CE2 4.42Å; I296-F306 HydrophobicContact CG2-CZ 3.58Å; L302-F306 HydrophobicContact CB-CZ 4.39Å; I304-F306 HydrophobicContact CB-CE1 4.39Å; I304-F306 HydrophobicContact CB-CE2 4.07Å; I304-F306 HydrophobicContact CB-CZ 3.96Å; I304-F306 WeakPolarHBondContact O-CD2 3.36Å; I304-F306 WeakPolarHBondContact O-CE2 3.43Å; I304-F306 PolarHBondContact O-N 2.84Å; F306-L308 PolarHBondContact O-N 3.45Å; F306-A309 HydrophobicContact CD1-CB 4.37Å; F306-A309 PolarHBondContact O-N 3.39Å; F306-K310 WeakPolarHBondContact O-CB 3.41Å; F306-K310 PolarHBondContact O-N 3.33Å
307Q83Confident86Confident68 Ų6874.4 Ų74.432%0.31837%0.368SS..Hα-helixtrans-58.9-47.7-173.8-65-173.72.600112.5E305 A309 K310 L311E305-Q307 PolarHBondContact O-N 3.34Å; E305-Q307 VanDerWaalsContact O-N 3.14Å; Q307-A309 PolarHBondContact O-N 3.39Å; Q307-K310 PolarHBondContact O-N 3.23Å; Q307-L311 PolarHBondContact O-N 3.4Å
308L86.4Confident86.5Confident106 Ų10670.6 Ų70.656%0.55535%0.351SS*.Hα-helixtrans-64.6-40.5178-179.564.1000111.8F306 K310 L311 V312F306-L308 PolarHBondContact O-N 3.45Å; L308-K310 VanDerWaalsContact C-N 3.33Å; L308-K310 PolarHBondContact O-N 3.34Å; L308-L311 HydrophobicContact CD1-CD2 4.26Å; L308-L311 WeakPolarHBondContact O-CB 3.17Å; L308-L311 PolarHBondContact O-N 3.48Å; L308-V312 VanDerWaalsContact O-CG2 3.3Å; L308-V312 WeakPolarHBondContact O-CG2 3.37Å; L308-V312 PolarHBondContact O-N 3.34Å
309A89.3Confident87.2Confident32 Ų3272.1 Ų72.126%0.26436%0.357SS..Hα-helixtrans-66-40.6-179.800000111.3L293 F306 Q307 V312 A313L293-A309 VanDerWaalsContact CD1-C 3.47Å; L293-A309 HydrophobicContact CD1-CB 3.79Å; L293-A309 WeakPolarHBondContact CD1-O 3.46Å; L293-A309 HydrophobicContact CD2-CB 3.58Å; L293-A309 HydrophobicContact CG-CB 4.36Å; F306-A309 HydrophobicContact CD1-CB 4.37Å; F306-A309 PolarHBondContact O-N 3.39Å; Q307-A309 PolarHBondContact O-N 3.39Å; A309-V312 PolarHBondContact O-N 3.13Å; A309-A313 WeakPolarHBondContact O-CB 3.47Å; A309-A313 PolarHBondContact O-N 3.34Å
310K87.4Confident87.7Confident48 Ų4865.6 Ų65.621%0.20933%0.331CS..Hα-helixtrans-61.2-47.1174.1-173.1-179-174.2177.80111.8M1 D3 F306 Q307 L308 V312 A313 D314M1-K310 WeakPolarHBondContact O-CE 3.32Å; M1-K310 PolarHBondContact O-NZ 3.36Å; D3-K310 IonicContact OD1-NZ 2.83Å; D3-K310 PolarHBondContact OD1-NZ 3.41Å; D3-K310 IonicContact OD2-NZ 3.38Å; D3-K310 PolarHBondContact OD2-NZ 3.31Å; F306-K310 WeakPolarHBondContact O-CB 3.41Å; F306-K310 PolarHBondContact O-N 3.33Å; Q307-K310 PolarHBondContact O-N 3.23Å; L308-K310 VanDerWaalsContact C-N 3.33Å; L308-K310 PolarHBondContact O-N 3.34Å; K310-V312 VanDerWaalsContact C-N 3.33Å; K310-V312 PolarHBondContact O-N 2.91Å; K310-A313 WeakPolarHBondContact O-CB 2.73Å; K310-A313 PolarHBondContact O-N 3.19Å; K310-A313 VanDerWaalsContact O-N 3.13Å; K310-D314 PolarHBondContact O-N 2.97Å
311L88.2Confident88.2Confident20 Ų2063.3 Ų63.311%0.10532%0.317CS..Hα-helixtrans-54.7-49.1173.217163000111.6Y28 I32 Q307 L308 A313 D314 L315Y28-L311 HydrophobicContact CD1-CD2 3.22Å; Y28-L311 HydrophobicContact CD1-CG 4.47Å; Y28-L311 HydrophobicContact CD2-CD2 4.12Å; Y28-L311 HydrophobicContact CE1-CD2 3.59Å; Y28-L311 HydrophobicContact CE2-CD2 4.4Å; Y28-L311 HydrophobicContact CG-CD1 4.36Å; Y28-L311 HydrophobicContact CG-CD2 3.53Å; Y28-L311 HydrophobicContact CG-CG 4.46Å; I32-L311 HydrophobicContact CD1-CD1 3.63Å; I32-L311 HydrophobicContact CG1-CD1 4.04Å; Q307-L311 PolarHBondContact O-N 3.4Å; L308-L311 HydrophobicContact CD1-CD2 4.26Å; L308-L311 WeakPolarHBondContact O-CB 3.17Å; L308-L311 PolarHBondContact O-N 3.48Å; L311-A313 VanDerWaalsContact C-N 3.29Å; L311-A313 PolarHBondContact O-N 2.99Å; L311-D314 PolarHBondContact O-N 2.66Å; L311-L315 HydrophobicContact CD1-CD1 4.01Å; L311-L315 HydrophobicContact CD1-CG 4.12Å; L311-L315 HydrophobicContact CG-CD1 4.03Å; L311-L315 WeakPolarHBondContact O-CB 3.09Å; L311-L315 WeakPolarHBondContact O-CG 3.26Å; L311-L315 PolarHBondContact O-N 3.4Å
312V92Very high88.9Confident70 Ų7056.4 Ų56.442%0.42428%0.281SS..Hα-helixtrans-60.3-42.2178.4170.60000110.6L308 A309 K310 L315 L316L308-V312 VanDerWaalsContact O-CG2 3.3Å; L308-V312 WeakPolarHBondContact O-CG2 3.37Å; L308-V312 PolarHBondContact O-N 3.34Å; A309-V312 PolarHBondContact O-N 3.13Å; K310-V312 VanDerWaalsContact C-N 3.33Å; K310-V312 PolarHBondContact O-N 2.91Å; V312-L315 PolarHBondContact O-N 3.14Å; V312-L316 HydrophobicContact CG1-CD1 3.92Å; V312-L316 HydrophobicContact CG1-CG 4.31Å; V312-L316 WeakPolarHBondContact O-CB 3.24Å; V312-L316 WeakPolarHBondContact O-CG 2.92Å; V312-L316 PolarHBondContact O-N 3.4Å
313A92.5Very high89.5Confident5 Ų554 Ų544%0.04127%0.268CS..Hα-helixtrans-63.3-42.817700000113.1S290 L293 A309 K310 L311 L316 L317S290-A313 WeakPolarHBondContact OG-CB 3.35Å; L293-A313 HydrophobicContact CD1-CB 3.71Å; A309-A313 WeakPolarHBondContact O-CB 3.47Å; A309-A313 PolarHBondContact O-N 3.34Å; K310-A313 WeakPolarHBondContact O-CB 2.73Å; K310-A313 PolarHBondContact O-N 3.19Å; K310-A313 VanDerWaalsContact O-N 3.13Å; L311-A313 VanDerWaalsContact C-N 3.29Å; L311-A313 PolarHBondContact O-N 2.99Å; A313-L316 PolarHBondContact O-N 3.44Å; A313-L317 WeakPolarHBondContact O-CB 3.24Å; A313-L317 PolarHBondContact O-N 3.16Å
314D91Very high90.6Very high11 Ų1144 Ų446%0.05922%0.224CC..Hα-helixtrans-70.8-34.4177.9-66.7-31000111.8M1 I32 K310 L311 L317 T318M1-D314 PolarHBondContact N-OD1 3.24Å; I32-D314 HydrophobicContact CD1-CB 4.37Å; K310-D314 PolarHBondContact O-N 2.97Å; L311-D314 PolarHBondContact O-N 2.66Å; D314-L317 WeakPolarHBondContact O-CB 3.49Å; D314-L317 PolarHBondContact O-N 3.36Å; D314-T318 PolarHBondContact O-N 3.27Å; D314-T318 VanDerWaalsContact O-N 3.08Å; D314-T318 PolarHBondContact O-OG1 3.47Å
315L94.1Very high91.5Very high40 Ų4039.9 Ų39.921%0.20920%0.203CC..Hα-helixtrans-63.5-47.3170.5-75.8171.7000111.5I32 L35 L311 V312 L317 T318 F319I32-L315 HydrophobicContact CG1-CD2 3.87Å; I32-L315 HydrophobicContact CG1-CG 4.28Å; L35-L315 HydrophobicContact CD2-CD2 4.16Å; L311-L315 HydrophobicContact CD1-CD1 4.01Å; L311-L315 HydrophobicContact CD1-CG 4.12Å; L311-L315 HydrophobicContact CG-CD1 4.03Å; L311-L315 WeakPolarHBondContact O-CB 3.09Å; L311-L315 WeakPolarHBondContact O-CG 3.26Å; L311-L315 PolarHBondContact O-N 3.4Å; V312-L315 PolarHBondContact O-N 3.14Å; L315-L317 VanDerWaalsContact C-N 3.28Å; L315-L317 PolarHBondContact O-N 3.46Å; L315-T318 WeakPolarHBondContact O-CB 3.3Å; L315-T318 PolarHBondContact O-N 2.87Å; L315-T318 VanDerWaalsContact O-N 3.13Å; L315-F319 WeakPolarHBondContact O-CD2 3.45Å; L315-F319 PolarHBondContact O-N 2.74Å
316L95.8Very high92.5Very high42 Ų4237.9 Ų37.922%0.2220%0.195CC..Hα-helixtrans-59.3-40.6176.3-74173000111.4F286 P289 V312 A313 T318 F319 D320F286-L316 HydrophobicContact CD1-CB 3.91Å; F286-L316 HydrophobicContact CD1-CD2 3.57Å; F286-L316 HydrophobicContact CD1-CG 4.33Å; F286-L316 VanDerWaalsContact CD1-O 3.28Å; F286-L316 WeakPolarHBondContact CD1-O 3.36Å; F286-L316 HydrophobicContact CE1-CD2 3.67Å; P289-L316 HydrophobicContact CB-CD1 3.89Å; P289-L316 HydrophobicContact CG-CD1 3.79Å; V312-L316 HydrophobicContact CG1-CD1 3.92Å; V312-L316 HydrophobicContact CG1-CG 4.31Å; V312-L316 WeakPolarHBondContact O-CB 3.24Å; V312-L316 WeakPolarHBondContact O-CG 2.92Å; V312-L316 PolarHBondContact O-N 3.4Å; A313-L316 PolarHBondContact O-N 3.44Å; L316-T318 VanDerWaalsContact C-N 3.28Å; L316-T318 PolarHBondContact O-N 3.2Å; L316-F319 PolarHBondContact O-N 2.88Å; L316-D320 PolarHBondContact O-N 3.21Å
317L93.8Very high93.2Very high7 Ų736.5 Ų36.54%0.03719%0.19CC..Hα-helixtrans-59.5-39.4175.4-162.872.9000112.5F73 L113 R116 A313 D314 L315F73-L317 HydrophobicContact CE1-CD2 4.34Å; F73-L317 HydrophobicContact CE2-CD2 4.44Å; F73-L317 HydrophobicContact CZ-CD2 3.64Å; F73-L317 HydrophobicContact CZ-CG 4.32Å; L113-L317 HydrophobicContact CD1-CD1 4.21Å; L113-L317 HydrophobicContact CD1-CD2 3.96Å; L113-L317 HydrophobicContact CD1-CG 4.45Å; L113-L317 HydrophobicContact CD2-CD2 4.22Å; R116-L317 PolarHBondContact NH1-O 2.94Å; A313-L317 WeakPolarHBondContact O-CB 3.24Å; A313-L317 PolarHBondContact O-N 3.16Å; D314-L317 WeakPolarHBondContact O-CB 3.49Å; D314-L317 PolarHBondContact O-N 3.36Å; L315-L317 VanDerWaalsContact C-N 3.28Å; L315-L317 PolarHBondContact O-N 3.46Å
318T94.9Very high93.8Very high4 Ų433.3 Ų33.33%0.02518%0.175CC..Hα-helixtrans-74.5-38178.7-52.40000111.2L35 D314 L315 L316 D320 S321L35-T318 HydrophobicContact CB-CG2 3.83Å; L35-T318 HydrophobicContact CD2-CG2 3.56Å; L35-T318 HydrophobicContact CG-CG2 3.5Å; D314-T318 PolarHBondContact O-N 3.27Å; D314-T318 VanDerWaalsContact O-N 3.08Å; D314-T318 PolarHBondContact O-OG1 3.47Å; L315-T318 WeakPolarHBondContact O-CB 3.3Å; L315-T318 PolarHBondContact O-N 2.87Å; L315-T318 VanDerWaalsContact O-N 3.13Å; L316-T318 VanDerWaalsContact C-N 3.28Å; L316-T318 PolarHBondContact O-N 3.2Å; T318-D320 VanDerWaalsContact C-N 3.32Å; T318-D320 PolarHBondContact O-N 3.34Å; T318-S321 PolarHBondContact O-N 3.44Å
319F96.2Very high94.3Very high87 Ų8729.6 Ų29.638%0.38216%0.159SC..Hα-helixtrans-63.6-34.7174.5-84-63.4000113L35 F286 L315 L316 S321 I322 I323L35-F319 HydrophobicContact CD1-CD1 4.49Å; L35-F319 HydrophobicContact CD1-CE1 3.96Å; L35-F319 HydrophobicContact CD1-CZ 4.18Å; L35-F319 HydrophobicContact CD2-CD1 4.26Å; L35-F319 HydrophobicContact CD2-CD2 3.98Å; L35-F319 HydrophobicContact CD2-CE1 4.12Å; L35-F319 HydrophobicContact CD2-CE2 3.82Å; L35-F319 HydrophobicContact CD2-CG 4.19Å; L35-F319 HydrophobicContact CD2-CZ 3.89Å; F286-F319 HydrophobicContact CD1-CB 4.34Å; F286-F319 HydrophobicContact CE1-CB 4.11Å; L315-F319 WeakPolarHBondContact O-CD2 3.45Å; L315-F319 PolarHBondContact O-N 2.74Å; L316-F319 PolarHBondContact O-N 2.88Å; F319-S321 VanDerWaalsContact C-N 3.28Å; F319-S321 PolarHBondContact O-N 3.39Å; F319-I322 HydrophobicContact CD1-CD1 4.46Å; F319-I322 PolarHBondContact O-N 2.98Å; F319-I322 VanDerWaalsContact O-N 3.08Å; F319-I323 HydrophobicContact CB-CD1 4.45Å; F319-I323 WeakPolarHBondContact O-CB 3.38Å; F319-I323 WeakPolarHBondContact O-CG1 3.26Å; F319-I323 PolarHBondContact O-N 3.08Å
320D96.6Very high94.6Very high1 Ų134.4 Ų34.41%0.00518%0.179CC..Hα-helixtrans-55.1-45.4176.3-169.245.5000111.4S282 F283 F286 L316 T318 I322 I323 N324S282-D320 PolarHBondContact OG-OD1 2.95Å; F283-D320 PolarHBondContact N-OD1 3.28Å; F286-D320 HydrophobicContact CB-CB 3.7Å; F286-D320 HydrophobicContact CD2-CB 4.11Å; F286-D320 HydrophobicContact CG-CB 3.97Å; L316-D320 PolarHBondContact O-N 3.21Å; T318-D320 VanDerWaalsContact C-N 3.32Å; T318-D320 PolarHBondContact O-N 3.34Å; D320-I322 VanDerWaalsContact C-N 3.3Å; D320-I322 PolarHBondContact O-N 3.13Å; D320-I323 PolarHBondContact O-N 3.01Å; D320-N324 PolarHBondContact O-N 2.93Å; D320-N324 PolarHBondContact O-ND2 2.74Å
321S96.4Very high94.9Very high0 Ų032.8 Ų32.80%018%0.176CC..Hα-helixtrans-62.2-34.8178-51.10000112.9E70 H74 T318 F319 I325E70-S321 VanDerWaalsContact CD-OG 3.24Å; E70-S321 PolarHBondContact OE1-OG 3.27Å; E70-S321 WeakPolarHBondContact OE2-CB 3.32Å; E70-S321 PolarHBondContact OE2-OG 3.48Å; H74-S321 WeakPolarHBondContact NE2-CB 3.15Å; H74-S321 PolarHBondContact NE2-OG 2.95Å; T318-S321 PolarHBondContact O-N 3.44Å; F319-S321 VanDerWaalsContact C-N 3.28Å; F319-S321 PolarHBondContact O-N 3.39Å; S321-I325 WeakPolarHBondContact O-CG1 3.32Å
322I96.9Very high95.2Very high26 Ų2633.1 Ų33.113%0.13318%0.178CC..Hα-helixtrans-73.6-42.8176.4-63.1173.7000110.3L35 I38 A39 L42 F319 D320 N324 I325 M326L35-I322 HydrophobicContact CD1-CD1 3.45Å; L35-I322 VanDerWaalsContact CD1-CD1 3.45Å; L35-I322 HydrophobicContact CG-CD1 3.81Å; I38-I322 HydrophobicContact CG2-CD1 4.44Å; A39-I322 HydrophobicContact CB-CG1 4.01Å; L42-I322 HydrophobicContact CD1-CG2 4.36Å; F319-I322 HydrophobicContact CD1-CD1 4.46Å; F319-I322 PolarHBondContact O-N 2.98Å; F319-I322 VanDerWaalsContact O-N 3.08Å; D320-I322 VanDerWaalsContact C-N 3.3Å; D320-I322 PolarHBondContact O-N 3.13Å; I322-N324 VanDerWaalsContact C-N 3.31Å; I322-N324 PolarHBondContact O-N 3.27Å; I322-I325 WeakPolarHBondContact O-CB 3.1Å; I322-I325 PolarHBondContact O-N 2.96Å; I322-I325 VanDerWaalsContact O-N 3.11Å; I322-M326 PolarHBondContact O-N 3.12Å
323I97.3Very high95.2Very high45 Ų4533.1 Ų33.123%0.23118%0.179CC..Hα-helixtrans-66.2-35.8-179.3-72166.9000111.1S282 F286 F319 D320 I325 M326 I327S282-I323 WeakPolarHBondContact OG-CG2 3.48Å; F286-I323 HydrophobicContact CD2-CD1 4.22Å; F286-I323 HydrophobicContact CE1-CD1 3.9Å; F286-I323 HydrophobicContact CE2-CD1 3.21Å; F286-I323 HydrophobicContact CE2-CG1 4.46Å; F286-I323 HydrophobicContact CZ-CD1 3.03Å; F319-I323 HydrophobicContact CB-CD1 4.45Å; F319-I323 WeakPolarHBondContact O-CB 3.38Å; F319-I323 WeakPolarHBondContact O-CG1 3.26Å; F319-I323 PolarHBondContact O-N 3.08Å; D320-I323 PolarHBondContact O-N 3.01Å; I323-I325 PolarHBondContact O-N 3.11Å; I323-M326 CarbonylContact O-C 3.6Å; I323-M326 WeakPolarHBondContact O-CA 3.31Å; I323-M326 WeakPolarHBondContact O-CB 3.3Å; I323-M326 PolarHBondContact O-N 3.49Å; I323-I327 HydrophobicContact CG2-CD1 3.75Å; I323-I327 HydrophobicContact CG2-CG1 4.18Å; I323-I327 WeakPolarHBondContact O-CG1 3.44Å; I323-I327 PolarHBondContact O-N 2.95Å
324N96.3Very high95.2Very high1 Ų134.1 Ų34.11%0.00519%0.19CC..Hα-helixtrans-52.7-38.9172.4-74.4-25.6000111.7E70 L279 D320 I322 I327 Y328E70-N324 PolarHBondContact OE1-ND2 2.77Å; L279-N324 HydrophobicContact CD2-CB 4.12Å; L279-N324 VanDerWaalsContact CD2-OD1 3.23Å; L279-N324 WeakPolarHBondContact CD2-OD1 3.23Å; D320-N324 PolarHBondContact O-N 2.93Å; D320-N324 PolarHBondContact O-ND2 2.74Å; I322-N324 VanDerWaalsContact C-N 3.31Å; I322-N324 PolarHBondContact O-N 3.27Å; N324-I327 PolarHBondContact O-N 3.37Å; N324-Y328 HydrophobicContact CB-CE2 4.38Å; N324-Y328 VanDerWaalsContact O-CD1 3.23Å; N324-Y328 WeakPolarHBondContact O-CD1 3.4Å; N324-Y328 VanDerWaalsContact O-CD2 3.31Å; N324-Y328 WeakPolarHBondContact O-CD2 3.44Å; N324-Y328 PolarHBondContact O-N 2.84Å
325I95.5Very high95.3Very high15 Ų1533.8 Ų33.88%0.07719%0.188CC..Hα-helixtrans-72-40.7178.6-56.4177.4000111.4L42 S321 I322 I323 I327 Y328 A329L42-I325 VanDerWaalsContact C-CD1 3.46Å; L42-I325 HydrophobicContact CB-CD1 3.22Å; L42-I325 HydrophobicContact CD1-CD1 4.37Å; L42-I325 HydrophobicContact CG-CD1 4.4Å; S321-I325 WeakPolarHBondContact O-CG1 3.32Å; I322-I325 WeakPolarHBondContact O-CB 3.1Å; I322-I325 PolarHBondContact O-N 2.96Å; I322-I325 VanDerWaalsContact O-N 3.11Å; I323-I325 PolarHBondContact O-N 3.11Å; I325-I327 VanDerWaalsContact C-N 3.28Å; I325-I327 PolarHBondContact O-N 3.44Å; I325-Y328 WeakPolarHBondContact O-CB 3.34Å; I325-Y328 PolarHBondContact O-N 3.39Å; I325-A329 PolarHBondContact O-N 3.4Å
326M96.8Very high95.4Very high115 Ų11537.5 Ų37.557%0.56720%0.199SC*.Hα-helixtrans-60.4-41.3172.3-62.1-171.174.800111I322 I323 Y328 A329 I330I322-M326 PolarHBondContact O-N 3.12Å; I323-M326 CarbonylContact O-C 3.6Å; I323-M326 WeakPolarHBondContact O-CA 3.31Å; I323-M326 WeakPolarHBondContact O-CB 3.3Å; I323-M326 PolarHBondContact O-N 3.49Å; M326-Y328 VanDerWaalsContact C-N 3.34Å; M326-Y328 PolarHBondContact O-N 3.5Å; M326-A329 PolarHBondContact O-N 2.88Å; M326-I330 VanDerWaalsContact O-CG1 3.32Å; M326-I330 WeakPolarHBondContact O-CG1 3.3Å; M326-I330 PolarHBondContact O-N 3.48Å
327I97.2Very high95.3Very high24 Ų2439.2 Ų39.212%0.12321%0.208CC..Hα-helixtrans-63.9-39.6175.7-66.6166.4000110.6T275 F278 L279 I323 N324 I325 I330 G331T275-I327 HydrophobicContact CG2-CG2 3.79Å; F278-I327 HydrophobicContact CB-CD1 4.34Å; F278-I327 HydrophobicContact CB-CG2 4.17Å; L279-I327 HydrophobicContact CD2-CB 3.86Å; L279-I327 HydrophobicContact CD2-CD1 3.93Å; L279-I327 HydrophobicContact CD2-CG2 3.63Å; L279-I327 HydrophobicContact CG-CG2 3.81Å; I323-I327 HydrophobicContact CG2-CD1 3.75Å; I323-I327 HydrophobicContact CG2-CG1 4.18Å; I323-I327 WeakPolarHBondContact O-CG1 3.44Å; I323-I327 PolarHBondContact O-N 2.95Å; N324-I327 PolarHBondContact O-N 3.37Å; I325-I327 VanDerWaalsContact C-N 3.28Å; I325-I327 PolarHBondContact O-N 3.44Å; I327-I330 PolarHBondContact O-N 3.19Å; I327-G331 WeakPolarHBondContact O-CA 3.36Å; I327-G331 PolarHBondContact O-N 3.14Å
328Y95.8Very high95.3Very high1 Ų142.8 Ų42.80%0.00422%0.222CC..Hα-helixtrans-63.2-45.6173.9-57-25.4000112F50 L63 L66 L279 N324 I325 M326 I330 L332F50-Y328 HydrophobicContact CE2-CD2 4.23Å; F50-Y328 HydrophobicContact CE2-CE2 4.39Å; F50-Y328 HydrophobicContact CZ-CD2 4.2Å; F50-Y328 HydrophobicContact CZ-CG 4.34Å; L63-Y328 HydrophobicContact CD2-CD1 4.32Å; L63-Y328 HydrophobicContact CD2-CE1 3.53Å; L66-Y328 WeakPolarHBondContact CD2-OH 3.44Å; L279-Y328 HydrophobicContact CD1-CE1 3.73Å; L279-Y328 HydrophobicContact CD2-CD1 4.28Å; L279-Y328 HydrophobicContact CD2-CE1 3.62Å; L279-Y328 HydrophobicContact CG-CE1 4.29Å; N324-Y328 HydrophobicContact CB-CE2 4.38Å; N324-Y328 VanDerWaalsContact O-CD1 3.23Å; N324-Y328 WeakPolarHBondContact O-CD1 3.4Å; N324-Y328 VanDerWaalsContact O-CD2 3.31Å; N324-Y328 WeakPolarHBondContact O-CD2 3.44Å; N324-Y328 PolarHBondContact O-N 2.84Å; I325-Y328 WeakPolarHBondContact O-CB 3.34Å; I325-Y328 PolarHBondContact O-N 3.39Å; M326-Y328 VanDerWaalsContact C-N 3.34Å; M326-Y328 PolarHBondContact O-N 3.5Å; Y328-I330 VanDerWaalsContact C-N 3.31Å; Y328-I330 PolarHBondContact O-N 3.39Å; Y328-L332 HydrophobicContact CD1-CD1 4.4Å; Y328-L332 VanDerWaalsContact O-CB 3.3Å; Y328-L332 WeakPolarHBondContact O-CB 3.39Å; Y328-L332 PolarHBondContact O-N 3.01Å
329A95.9Very high95.2Very high27 Ų2744.4 Ų44.422%0.22323%0.23CC..Hα-helixtrans-61-38.1178.600000112.9I325 M326 F335I325-A329 PolarHBondContact O-N 3.4Å; M326-A329 PolarHBondContact O-N 2.88Å; A329-F335 HydrophobicContact CB-CD1 4.42Å; A329-F335 HydrophobicContact CB-CE1 4.34Å
330I95.9Very high95.1Very high134 Ų13444 Ų4469%0.68723%0.232SC*.Hα-helixtrans-82-42.9179.8-65.1167.6000111.4M326 I327 Y328M326-I330 VanDerWaalsContact O-CG1 3.32Å; M326-I330 WeakPolarHBondContact O-CG1 3.3Å; M326-I330 PolarHBondContact O-N 3.48Å; I327-I330 PolarHBondContact O-N 3.19Å; Y328-I330 VanDerWaalsContact C-N 3.31Å; Y328-I330 PolarHBondContact O-N 3.39Å
331G93.9Very high94.9Very high14 Ų1451.6 Ų51.614%0.14426%0.261CS..Hα-helixtrans-81.1-30.1-171.500000114.5T275 I327T275-G331 WeakPolarHBondContact OG1-CA 3.29Å; I327-G331 WeakPolarHBondContact O-CA 3.36Å; I327-G331 PolarHBondContact O-N 3.14Å
332L94Very high94.7Very high27 Ų2753.7 Ų53.714%0.14127%0.271CS..  trans-115.499.5-172.3-57.8173.7000110.8F50 M59 L63 Y328 G334 F335 R336F50-L332 HydrophobicContact CE1-CD1 4.25Å; F50-L332 HydrophobicContact CZ-CD1 4.31Å; M59-L332 HydrophobicContact CE-CD2 3.87Å; M59-L332 HydrophobicContact SD-CD2 4.41Å; L63-L332 HydrophobicContact CD1-CD1 3.63Å; Y328-L332 HydrophobicContact CD1-CD1 4.4Å; Y328-L332 VanDerWaalsContact O-CB 3.3Å; Y328-L332 WeakPolarHBondContact O-CB 3.39Å; Y328-L332 PolarHBondContact O-N 3.01Å; L332-G334 VanDerWaalsContact C-N 3.27Å; L332-G334 PolarHBondContact O-N 3.49Å; L332-F335 HydrophobicContact CB-CB 3.74Å; L332-F335 WeakPolarHBondContact O-CB 3.25Å; L332-F335 PolarHBondContact O-N 2.85Å; L332-R336 PolarHBondContact O-N 3.29Å; L332-R336 VanDerWaalsContact O-N 3.14Å
333P92.6Very high94.3Very high70 Ų7057.8 Ų57.846%0.45529%0.288SS..Hα-helixtrans-60.4-37.7-177.823.2-33.2000112.3F335 R336 D337P333-F335 VanDerWaalsContact C-N 3.33Å; P333-F335 PolarHBondContact O-N 3.48Å; P333-R336 PolarHBondContact O-N 3.47Å; P333-D337 PolarHBondContact O-N 2.89Å
334G92.1Very high94.1Very high25 Ų2561.6 Ų61.626%0.25831%0.308SS..Hα-helixtrans-62-40.2176.400000112.6L332 D337 Y338L332-G334 VanDerWaalsContact C-N 3.27Å; L332-G334 PolarHBondContact O-N 3.49Å; G334-D337 PolarHBondContact O-N 3.28Å; G334-Y338 WeakPolarHBondContact O-CD2 3.47Å; G334-Y338 PolarHBondContact O-N 3.45Å; G334-Y338 VanDerWaalsContact O-N 3.15Å
335F93.7Very high93.7Very high5 Ų566.6 Ų66.62%0.02234%0.342CS..Hα-helixtrans-62.8-46.3176.5179.6-92.7000110.8C46 I49 F50 A329 L332 P333 D337 Y338 L339C46-F335 HydrophobicContact CB-CE2 4.31Å; I49-F335 HydrophobicContact CB-CD2 4.19Å; I49-F335 HydrophobicContact CB-CE2 3.99Å; I49-F335 HydrophobicContact CD1-CD2 4.34Å; I49-F335 HydrophobicContact CD1-CE2 3.74Å; I49-F335 HydrophobicContact CD1-CZ 3.87Å; I49-F335 HydrophobicContact CG1-CE2 4.48Å; I49-F335 HydrophobicContact CG2-CD2 3.53Å; I49-F335 HydrophobicContact CG2-CE2 3.85Å; I49-F335 HydrophobicContact CG2-CG 4.35Å; F50-F335 HydrophobicContact CD1-CD2 4.32Å; F50-F335 AromaticContact CE1-CD2 3.65Å; F50-F335 HydrophobicContact CE1-CD2 3.65Å; F50-F335 HydrophobicContact CE1-CE2 4.29Å; F50-F335 HydrophobicContact CE2-CD2 4.34Å; F50-F335 HydrophobicContact CE2-CE2 4.17Å; F50-F335 AromaticContact CZ-CD2 3.65Å; F50-F335 HydrophobicContact CZ-CD2 3.65Å; F50-F335 AromaticContact CZ-CE2 3.91Å; F50-F335 HydrophobicContact CZ-CE2 3.91Å; A329-F335 HydrophobicContact CB-CD1 4.42Å; A329-F335 HydrophobicContact CB-CE1 4.34Å; L332-F335 HydrophobicContact CB-CB 3.74Å; L332-F335 WeakPolarHBondContact O-CB 3.25Å; L332-F335 PolarHBondContact O-N 2.85Å; P333-F335 VanDerWaalsContact C-N 3.33Å; P333-F335 PolarHBondContact O-N 3.48Å; F335-D337 PolarHBondContact O-N 3.47Å; F335-Y338 PolarHBondContact O-N 3.12Å; F335-L339 HydrophobicContact CD1-CD1 4.22Å; F335-L339 HydrophobicContact CE1-CD1 3.44Å; F335-L339 VanDerWaalsContact CE1-CD1 3.44Å; F335-L339 HydrophobicContact CZ-CD1 3.93Å; F335-L339 VanDerWaalsContact O-CB 3.31Å; F335-L339 WeakPolarHBondContact O-CB 3.27Å; F335-L339 PolarHBondContact O-N 2.96Å
336R95Very high93.3Very high118 Ų11871.6 Ų71.645%0.44537%0.368SS..Hα-helixtrans-59.3-43.3176.3-174.8-176.865-165.60.4112.9L332 P333 Y338 L339 N340L332-R336 PolarHBondContact O-N 3.29Å; L332-R336 VanDerWaalsContact O-N 3.14Å; P333-R336 PolarHBondContact O-N 3.47Å; R336-Y338 VanDerWaalsContact C-N 3.31Å; R336-Y338 PolarHBondContact O-N 3.02Å; R336-L339 PolarHBondContact O-N 3.17Å; R336-N340 WeakPolarHBondContact O-CB 3.26Å; R336-N340 VanDerWaalsContact O-CG 3.29Å; R336-N340 PolarHBondContact O-N 3.43Å
337D94.2Very high92.6Very high77 Ų7769.9 Ų69.941%0.41237%0.366SS..Hα-helixtrans-63.9-38.9179.7-64.3-17.3000111.2P333 G334 F335 R341P333-D337 PolarHBondContact O-N 2.89Å; G334-D337 PolarHBondContact O-N 3.28Å; F335-D337 PolarHBondContact O-N 3.47Å; D337-R341 VanDerWaalsContact O-CG 3.25Å; D337-R341 WeakPolarHBondContact O-CG 3.35Å; D337-R341 PolarHBondContact O-N 2.91Å; D337-R341 VanDerWaalsContact O-N 3.1Å
338Y93.6Very high91.6Very high82 Ų8274 Ų7432%0.32240%0.395SS..Hα-helixtrans-69.1-42.8173.8-84.5-72.4000112.8I49 Q53 G334 F335 R336 R341 M342I49-Y338 HydrophobicContact CG2-CG 4.37Å; Q53-Y338 HydrophobicContact CG-CE2 4.31Å; G334-Y338 WeakPolarHBondContact O-CD2 3.47Å; G334-Y338 PolarHBondContact O-N 3.45Å; G334-Y338 VanDerWaalsContact O-N 3.15Å; F335-Y338 PolarHBondContact O-N 3.12Å; R336-Y338 VanDerWaalsContact C-N 3.31Å; R336-Y338 PolarHBondContact O-N 3.02Å; Y338-R341 WeakPolarHBondContact O-CB 3.29Å; Y338-R341 PolarHBondContact O-N 3.48Å; Y338-M342 WeakPolarHBondContact O-CG 3.04Å; Y338-M342 PolarHBondContact O-N 2.86Å
339L93Very high90Very high39 Ų3984.7 Ų84.720%0.20444%0.435CS..Hα-helixtrans-60.4-46.8178.3-171150.1000110.2I49 F335 R336 R341 M342 F343I49-L339 HydrophobicContact CD1-CB 4.05Å; I49-L339 HydrophobicContact CD1-CD1 4.33Å; I49-L339 HydrophobicContact CD1-CG 4.38Å; F335-L339 HydrophobicContact CD1-CD1 4.22Å; F335-L339 HydrophobicContact CE1-CD1 3.44Å; F335-L339 VanDerWaalsContact CE1-CD1 3.44Å; F335-L339 HydrophobicContact CZ-CD1 3.93Å; F335-L339 VanDerWaalsContact O-CB 3.31Å; F335-L339 WeakPolarHBondContact O-CB 3.27Å; F335-L339 PolarHBondContact O-N 2.96Å; R336-L339 PolarHBondContact O-N 3.17Å; L339-R341 PolarHBondContact O-N 3.32Å; L339-M342 PolarHBondContact O-N 3.43Å; L339-M342 VanDerWaalsContact O-N 3.14Å; L339-F343 HydrophobicContact CD2-CD2 3.58Å; L339-F343 HydrophobicContact CD2-CE2 3.38Å; L339-F343 HydrophobicContact CG-CD2 4.17Å; L339-F343 HydrophobicContact CG-CE2 3.84Å; L339-F343 WeakPolarHBondContact O-CD2 2.95Å; L339-F343 PolarHBondContact O-N 3.38Å
340N93.8Very high88.7Confident78 Ų7889.9 Ų89.942%0.41746%0.459SS..Hα-helixtrans-59.4-42.7173.7-72.7-11.9000112.5R336 M342 F343 I344R336-N340 WeakPolarHBondContact O-CB 3.26Å; R336-N340 VanDerWaalsContact O-CG 3.29Å; R336-N340 PolarHBondContact O-N 3.43Å; N340-M342 VanDerWaalsContact C-N 3.32Å; N340-M342 PolarHBondContact O-N 3.15Å; N340-F343 PolarHBondContact O-N 2.96Å; N340-I344 WeakPolarHBondContact O-CD1 3.29Å; N340-I344 VanDerWaalsContact O-CG1 3.23Å; N340-I344 WeakPolarHBondContact O-CG1 3.33Å; N340-I344 PolarHBondContact O-N 3.13Å
341R93.7Very high87.3Confident161 Ų16190.7 Ų90.761%0.60846%0.459SS*.Hα-helixtrans-61.8-39.3175.3-74.5172.4-176.4-159.70.3112.1D337 Y338 L339 I344 C345D337-R341 VanDerWaalsContact O-CG 3.25Å; D337-R341 WeakPolarHBondContact O-CG 3.35Å; D337-R341 PolarHBondContact O-N 2.91Å; D337-R341 VanDerWaalsContact O-N 3.1Å; Y338-R341 WeakPolarHBondContact O-CB 3.29Å; Y338-R341 PolarHBondContact O-N 3.48Å; L339-R341 PolarHBondContact O-N 3.32Å; R341-I344 PolarHBondContact O-N 3.39Å; R341-C345 PolarHBondContact O-N 2.98Å; R341-C345 PolarHBondContact O-SG 2.92Å
342M90.6Very high85.9Confident43 Ų4396 Ų9621%0.21249%0.485CS..Hα-helixtrans-65.5-43.2176.3-70.5-164.979.900111.8I49 Y338 L339 N340 I344 C345 L346I49-M342 HydrophobicContact CD1-SD 4.47Å; I49-M342 HydrophobicContact CG1-SD 3.87Å; Y338-M342 WeakPolarHBondContact O-CG 3.04Å; Y338-M342 PolarHBondContact O-N 2.86Å; L339-M342 PolarHBondContact O-N 3.43Å; L339-M342 VanDerWaalsContact O-N 3.14Å; N340-M342 VanDerWaalsContact C-N 3.32Å; N340-M342 PolarHBondContact O-N 3.15Å; M342-I344 PolarHBondContact O-N 2.92Å; M342-C345 PolarHBondContact O-N 2.95Å; M342-L346 WeakPolarHBondContact O-CB 3.33Å; M342-L346 WeakPolarHBondContact O-CG 3.27Å; M342-L346 PolarHBondContact O-N 2.78Å
343F90.1Very high84.3Confident112 Ų112101.4 Ų101.449%0.49151%0.514SS..Hα-helixtrans-64.5-38.6175.8-79.4-70.4000112.9L339 N340 C345 L346 C347L339-F343 HydrophobicContact CD2-CD2 3.58Å; L339-F343 HydrophobicContact CD2-CE2 3.38Å; L339-F343 HydrophobicContact CG-CD2 4.17Å; L339-F343 HydrophobicContact CG-CE2 3.84Å; L339-F343 WeakPolarHBondContact O-CD2 2.95Å; L339-F343 PolarHBondContact O-N 3.38Å; N340-F343 PolarHBondContact O-N 2.96Å; F343-C345 VanDerWaalsContact C-N 3.31Å; F343-C345 PolarHBondContact O-N 3.37Å; F343-L346 PolarHBondContact O-N 2.79Å; F343-C347 PolarHBondContact O-N 2.61Å
344I91.3Very high82.7Confident126 Ų126105.8 Ų105.865%0.64653%0.528SS*.Hα-helixtrans-62.5-38.6174.1-67.8163.7000111.1N340 R341 M342 C347N340-I344 WeakPolarHBondContact O-CD1 3.29Å; N340-I344 VanDerWaalsContact O-CG1 3.23Å; N340-I344 WeakPolarHBondContact O-CG1 3.33Å; N340-I344 PolarHBondContact O-N 3.13Å; R341-I344 PolarHBondContact O-N 3.39Å; M342-I344 PolarHBondContact O-N 2.92Å; I344-C347 VanDerWaalsContact O-O 3.06Å
345C88.4Confident81.3Confident106 Ų106112.8 Ų112.872%0.71656%0.559SS**Hα-helixtrans-74.2-29.8176.9-66.30000113.6R341 M342 F343R341-C345 PolarHBondContact O-N 2.98Å; R341-C345 PolarHBondContact O-SG 2.92Å; M342-C345 PolarHBondContact O-N 2.95Å; F343-C345 VanDerWaalsContact C-N 3.31Å; F343-C345 PolarHBondContact O-N 3.37Å
346L86.8Confident79.8Confident120 Ų120119.1 Ų119.163%0.62859%0.592SS**Hα-helixtrans-81.4-24.7-179.5-76.1171.5000113.4M342 F343 P348M342-L346 WeakPolarHBondContact O-CB 3.33Å; M342-L346 WeakPolarHBondContact O-CG 3.27Å; M342-L346 PolarHBondContact O-N 2.78Å; F343-L346 PolarHBondContact O-N 2.79Å; L346-P348 WeakPolarHBondContact O-CD 3.4Å
347C84Confident78.1Confident79 Ų79116.5 Ų116.553%0.53460%0.602SS.*SBendtrans-94.485.1166.2-64.80000107.5F343 I344 W349F343-C347 PolarHBondContact O-N 2.61Å; I344-C347 VanDerWaalsContact O-O 3.06Å; C347-W349 PolarHBondContact O-N 2.95Å
348P75.7Confident76.4Confident111 Ų111120.4 Ų120.472%0.72162%0.623SS**  trans-61.592.9163.427.2-30.9000105.2L346 N350L346-P348 WeakPolarHBondContact O-CD 3.4Å; P348-N350 PolarHBondContact O-N 3.13Å
349W62.1Low75Confident225 Ų225123.7 Ų123.785%0.85265%0.646SS**  trans-56.4114.1178-134.622.3000104.1C347 H351C347-W349 PolarHBondContact O-N 2.95Å; W349-H351 PolarHBondContact O-N 2.93Å
350N68.6Low73.7Confident135 Ų135128 Ų12872%0.72267%0.669SS**  trans-66.773-177.2-173.820.7000107.6P348 N352P348-N350 PolarHBondContact O-N 3.13Å; N350-N352 PolarHBondContact O-N 3.09Å
351H65.5Low72.2Confident151 Ų151130 Ų13070%0.69968%0.68SS**  trans-81.23.3179.4-144.4-41.3000110.9W349 N353W349-H351 PolarHBondContact O-N 2.93Å; H351-N353 PolarHBondContact O-N 3.3Å; H351-N353 VanDerWaalsContact O-N 3.1Å
352N64.5Low70.7Confident126 Ų126128.6 Ų128.667%0.67468%0.684SS**  trans-75.791.5165-74.9-9.6000108.6N350N350-N352 PolarHBondContact O-N 3.09Å
353N60.8Low69.1Low141 Ų141133.1 Ų133.175%0.75471%0.71SS**  trans163.556.5136.4-77.8-15.7000113.4H351H351-N353 PolarHBondContact O-N 3.3Å; H351-N353 VanDerWaalsContact O-N 3.1Å
354H59.7Low67.6Low161 Ų161134.1 Ų134.175%0.74572%0.72SS**  trans-130.247.8153-110.8-59.5000111.6I356H354-I356 VanDerWaalsContact C-N 3.28Å
355N62.1Low65.9Low172 Ų172134.2 Ų134.292%0.9272%0.722SS**  trans-96.164.9147.8-90.2-10.4000107.5
356I61.6Low64.2Low138 Ų138135.5 Ų135.571%0.70872%0.722SS**  trans-108.7119.1160.5-67.2178.7000105.1H354H354-I356 VanDerWaalsContact C-N 3.28Å
357G60.4Low62.7Low64 Ų64136.3 Ų136.366%0.6673%0.727SS**  trans-61.1152.2-159.300000114.7
358N59Low60.9Low159 Ų159141.7 Ų141.785%0.8575%0.749SS**  -143.793.5126-127.8-8.3000108.3N360N358-N360 PolarHBondContact O-N 3.46Å
359N63.5Low59.8Low150 Ų150142.1 Ų142.180%0.80274%0.744SS**  trans-51.7114.2146.7-90.5-19.2000106.3
360N65.2Low59.1Low130 Ų130138.4 Ų138.470%0.69574%0.74SS**  trans-172.3117134.5-94.6-23.9000110.8N358N358-N360 PolarHBondContact O-N 3.46Å
361N62.7Low57.9Low121 Ų121140.1 Ų140.165%0.64775%0.748SS**  69.6109.5129.8-61.8-19.5000118.3
362N61.8Low57.1Low130 Ų130140 Ų14070%0.69575%0.753SS**  74.6113.2121-65.7-13.7000117.7
363N58.5Low56.2Low139 Ų139138.8 Ų138.874%0.74375%0.754SS**  76.4142129.2-74.2-12.2000118.3
364N57.4Low55.5Low132 Ų132139.3 Ų139.371%0.70676%0.762SS**  trans85.599.8158-64.1-16.3000116
365N55.6Low54.9Low128 Ų128135.5 Ų135.568%0.68476%0.758SS**  60.1120.7114.7-65.7-12.9000117
366N52.5Low54.3Low134 Ų134134.7 Ų134.772%0.71775%0.753SS**  trans64.895.6142.6-53.7-16.4000114.4
367N56.8Low53.5Low137 Ų137133.8 Ų133.873%0.73376%0.756SS**  167.294.6124.6-79.8-25.9000107.5I369N367-I369 HydrophobicContact CB-CD1 3.98Å; N367-I369 HydrophobicContact CB-CG1 4.12Å; N367-I369 PolarHBondContact O-N 2.59Å
368L45.8Very low52.8Low191 Ų191139.9 Ų139.9100%177%0.765SS**  trans-7383.9168.4-159.689.9000107.4
369I52Low52Low120 Ų120137 Ų13762%0.61576%0.757SS**  trans-110131.1175.5-72.1175.3000107.5N367N367-I369 HydrophobicContact CB-CD1 3.98Å; N367-I369 HydrophobicContact CB-CG1 4.12Å; N367-I369 PolarHBondContact O-N 2.59Å
370L48Very low51Low148 Ų148137 Ų13778%0.77575%0.753SS**  trans59.9110.5158.7-86.9144.6000118.3
371L43.8Very low50Low171 Ų171140.3 Ų140.390%0.89576%0.761SS**  -168.481.2108.3-99.4148.3000109
372N47.4Very low49Very low148 Ų148141.3 Ų141.379%0.79176%0.761SS**  trans-84.7135.9161.8-102.3-19.7000108.9
373S46.6Very low48.7Very low100 Ų100140.9 Ų140.970%0.69977%0.766SS**  trans59.296.6146.562.10000118.5A375S373-A375 PolarHBondContact O-N 3.33Å; S373-A375 VanDerWaalsContact O-N 3.14Å
374V45.6Very low48.2Very low153 Ų153141.3 Ų141.393%0.92777%0.766SS**  trans-76.580.8139.7-179.60000106.8
375A47.2Very low47.7Very low80 Ų80140.3 Ų140.366%0.66177%0.77SS**  trans-88.8115.3164.400000107.3S373S373-A375 PolarHBondContact O-N 3.33Å; S373-A375 VanDerWaalsContact O-N 3.14Å
376L48.6Very low47.4Very low155 Ų155144.3 Ų144.381%0.81278%0.777SS**  trans-50.9135.9169.1-98106.4000109.6K378L376-K378 PolarHBondContact O-N 2.94Å
377P44.7Very low47.2Very low119 Ų119144.3 Ų144.377%0.77378%0.777SS**  trans-63.3114.617825.7-31.4000108.9S379P377-S379 PolarHBondContact O-N 2.86Å
378K46.2Very low47Very low192 Ų192146.9 Ų146.984%0.83578%0.782SS**  trans-61.9106.6154.9-89.9178.4176.7171.60106.1L376 E380L376-K378 PolarHBondContact O-N 2.94Å; K378-E380 VanDerWaalsContact C-N 3.31Å; K378-E380 PolarHBondContact O-N 3.49Å
379S42.9Very low47Very low100 Ų100144.7 Ų144.770%0.69977%0.771SS**  trans-63.495.6162.4590000108.1P377 F381P377-S379 PolarHBondContact O-N 2.86Å; S379-F381 PolarHBondContact O-N 3.36Å
380E41.2Very low46.8Very low150 Ų150143.8 Ų143.870%0.70178%0.776SS**  trans-71.7105.2163.6-79.1-177.3154.100108.3K378 H382K378-E380 VanDerWaalsContact C-N 3.31Å; K378-E380 PolarHBondContact O-N 3.49Å; E380-H382 VanDerWaalsContact C-N 3.3Å; E380-H382 PolarHBondContact O-N 2.93Å; E380-H382 IonicContact OE2-NE2 3.86Å
381F44Very low46.5Very low198 Ų198146 Ų14687%0.86878%0.779SS**  trans-67.793160.1-93.9-90.9000108.1S379S379-F381 PolarHBondContact O-N 3.36Å
382H42.9Very low46.5Very low142 Ų142143.9 Ų143.966%0.65777%0.773SS**  trans-79.7123.2160-86.2-78.5000109E380 I384E380-H382 VanDerWaalsContact C-N 3.3Å; E380-H382 PolarHBondContact O-N 2.93Å; E380-H382 IonicContact OE2-NE2 3.86Å; H382-I384 PolarHBondContact O-N 3.43Å
383P55.4Low46.4Very low121 Ų121143.5 Ų143.579%0.78678%0.776SS**  trans-67.9117.6165.127.1-29.4000108.5S385P383-S385 PolarHBondContact O-N 3.18Å
384I47.4Very low46.3Very low148 Ų148147.3 Ų147.376%0.75978%0.783SS**  trans-64.8110.6171.7-63.9169.1000107.7H382 Y386H382-I384 PolarHBondContact O-N 3.43Å; I384-Y386 HydrophobicContact CG2-CD2 4.33Å; I384-Y386 PolarHBondContact O-N 3.46Å
385S46.9Very low46.3Very low112 Ų112150.5 Ų150.578%0.78379%0.785SS**  trans-75.9109.6164.146.80000108.7P383 N387P383-S385 PolarHBondContact O-N 3.18Å; S385-N387 PolarHBondContact O-N 3.44Å; S385-N387 VanDerWaalsContact O-N 3.13Å
386Y49.9Very low46Very low211 Ų211156.1 Ų156.183%0.82780%0.795SS**  trans-66.3107.2167.8-100.9-90.9000109.4I384 K388I384-Y386 HydrophobicContact CG2-CD2 4.33Å; I384-Y386 PolarHBondContact O-N 3.46Å; Y386-K388 PolarHBondContact O-N 3.5Å
387N48Very low45.7Very low135 Ų135153 Ų15372%0.72279%0.786SS**  trans-83103.1166.5-171.43.3000108.5S385S385-N387 PolarHBondContact O-N 3.44Å; S385-N387 VanDerWaalsContact O-N 3.13Å
388K53.6Low45.6Very low190 Ų190156.2 Ų156.283%0.82679%0.787SS**  trans-110.593.4173.2-138177.9-173-179.60109.1Y386 S390Y386-K388 PolarHBondContact O-N 3.5Å; K388-S390 PolarHBondContact O-N 3.42Å
389N45.8Very low45.6Very low145 Ų145156 Ų15678%0.77579%0.789SS**  trans-69.3114.3164.9-88.5-25.7000110
390S46.7Very low45.5Very low102 Ų102156.4 Ų156.471%0.71379%0.792SS**  trans-168.698.5147.455.90000112.2K388K388-S390 PolarHBondContact O-N 3.42Å
391K42.8Very low45.6Very low193 Ų193156.8 Ų156.884%0.83980%0.798SS**  trans49.1125.5131.8-74-178.7174.9176.90121.7
392T42.8Very low45.3Very low128 Ų128154.5 Ų154.579%0.78580%0.795SS**  trans65.8119.5141.738.50000117.5
393T45.3Very low45.3Very low139 Ų139157.6 Ų157.685%0.85380%0.801SS**  -155.8161.765.535.20000114.1
394Q44.9Very low44.5Very low180 Ų180158.8 Ų158.884%0.84180%0.8SS**  trans-66.5145.6-168.9-62.5160.2-38.500115.4
395F44.8Very low44.3Very low221 Ų221156.8 Ų156.897%0.96979%0.791SS**  trans-154.9121.3130.2-108.3-80.1000110.7
396K42.2Very low43.9Very low198 Ų198158.9 Ų158.986%0.86179%0.794SS**  trans-76.3167174.1-99.4-177.8175.1175.20110.7
397S40.6Very low43.5Very low89 Ų89160 Ų16062%0.62280%0.796SS**  cis-171.1170.4-6.758.80000110.5
398K43.1Very low43.2Very low186 Ų186162.5 Ų162.581%0.80980%0.804SS**  trans104.698157-67.3174.8-179.7-178.70115.2
399H47.2Very low42.6Very low188 Ų188156.7 Ų156.787%0.8780%0.798SS**  -161.9124.8106.6-107.6-81.4000109.5
400S39.6Very low42.4Very low109 Ų109157.2 Ų157.276%0.76280%0.799SS**  trans-73.1123.9172.5490000110
401L43.3Very low42.1Very low158 Ų158162.6 Ų162.683%0.82781%0.805SS**  trans-142.2107.8156.9-101.5160.4000108.3
402N38.4Very low42Very low149 Ų149160 Ų16080%0.79781%0.809SS**  trans-79.1111.6175.2-165.15.9000107.2
403W41.8Very low41.9Very low208 Ų208157.7 Ų157.779%0.78880%0.799SS**  trans-114.288168.1-105.555000108.3N405W403-N405 HydrophobicContact CE3-CB 4.35Å; W403-N405 VanDerWaalsContact CE3-ND2 3.3Å; W403-N405 WeakPolarHBondContact CZ3-ND2 3.3Å; W403-N405 PolarHBondContact O-N 3.12Å
404N39.9Very low41.8Very low145 Ų145158.4 Ų158.478%0.77579%0.792SS**  trans-84.1101.1164.7-148.99.7000106.1
405N43.7Very low41.5Very low106 Ų106161.5 Ų161.557%0.56780%0.796SS**  trans-127.793.7173.4-110.7-21.8000109.4W403 R407W403-N405 HydrophobicContact CE3-CB 4.35Å; W403-N405 VanDerWaalsContact CE3-ND2 3.3Å; W403-N405 WeakPolarHBondContact CZ3-ND2 3.3Å; W403-N405 PolarHBondContact O-N 3.12Å; N405-R407 PolarHBondContact O-N 3.47Å; N405-R407 VanDerWaalsContact O-N 3.16Å
406N38.2Very low41.5Very low157 Ų157157.3 Ų157.384%0.8478%0.78SS**  trans-55108153.5-96.8-12.9000108.4
407R40.7Very low41.8Very low233 Ų233157.6 Ų157.688%0.87978%0.781SS**  trans-121.798.8154.5-93.6-169.8178.5-168.40.2108.6N405 G409N405-R407 PolarHBondContact O-N 3.47Å; N405-R407 VanDerWaalsContact O-N 3.16Å; R407-G409 PolarHBondContact O-N 3.05Å; R407-G409 VanDerWaalsContact O-N 3.11Å
408Q43Very low42.2Very low189 Ų189159 Ų15988%0.88378%0.782SS**  trans-57.2105.1152.1-75.2172.9-21.500107.5I410Q408-I410 PolarHBondContact O-N 3.17Å
409G39.2Very low42.4Very low67 Ų67159.6 Ų159.669%0.69178%0.78SS**  trans-76.4106163.700000108.1R407 Y411R407-G409 PolarHBondContact O-N 3.05Å; R407-G409 VanDerWaalsContact O-N 3.11Å; G409-Y411 PolarHBondContact O-N 2.88Å
410I42.4Very low42.4Very low157 Ų157160.8 Ų160.881%0.80578%0.783SS**  trans-61.4123.7173.2-67.5170.2000108.7Q408 C412Q408-I410 PolarHBondContact O-N 3.17Å; I410-C412 PolarHBondContact O-N 2.87Å
411Y41.3Very low42.9Very low215 Ų215162.8 Ų162.884%0.84378%0.78SS**  trans-56.8120.6164.4-83.5-100.5000109.8G409 S413G409-Y411 PolarHBondContact O-N 2.88Å; Y411-S413 PolarHBondContact O-N 3.06Å
412C39.5Very low43Very low137 Ų137163.8 Ų163.893%0.92678%0.78SS**  trans-87.193.2153.5-83.70000107.5I410I410-C412 PolarHBondContact O-N 2.87Å
413S40.5Very low43.5Very low81 Ų81160.4 Ų160.457%0.56678%0.781SS**  trans-89.415216194.40000109.8Y411Y411-S413 PolarHBondContact O-N 3.06Å
414Q43.1Very low43.9Very low153 Ų153156.5 Ų156.572%0.71578%0.775SS**  trans56101.5155.3-81.3149-54.900118.5
415R38.3Very low44.1Very low245 Ų245157.2 Ų157.293%0.92577%0.772SS**  trans-107.495.1139.2-150.7176.9-161.7-178.65108
416E45.3Very low44.1Very low133 Ų133159 Ų15962%0.62178%0.781SS**  trans-59.6127.5165.7-73.3177.4159.700109.3
417K48.7Very low44.5Very low204 Ų204156 Ų15689%0.88777%0.773SS**  trans-99.996.4159.5-78.9-176.5176.5-179.90106.5
418N48.1Very low44.6Very low119 Ų119153 Ų15364%0.63677%0.768SS**  trans-82.2121.7169.2-79.3-29.4000110.1
419Y48.1Very low44.4Very low198 Ų198148.8 Ų148.878%0.77676%0.758SS**  trans2.8123.5145.3-64.9-90.3000117.9
420F48.3Very low44.6Very low214 Ų214154.2 Ų154.294%0.93977%0.765SS**  trans-107.3118.6148.7-113.2-86.3000107.8
421H49.4Very low44.4Very low151 Ų151156.7 Ų156.770%0.69977%0.766SS**  trans-114.4134.7173.9-125-51.2000108.4
422H44.7Very low44.4Very low178 Ų178153.8 Ų153.882%0.82477%0.765SS**  trans49.5127.6151.2-89.9-54.6000122
423G50.4Low44.4Very low79 Ų79151.7 Ų151.781%0.81475%0.752SS**  trans178.1105.6153.700000112.4
424D48.9Very low44.4Very low125 Ų125155.2 Ų155.267%0.66876%0.764SS**  trans-69.8148.4-174.1-111.5-8.1000115
425K44.5Very low44.4Very low161 Ų161156.6 Ų156.670%0.777%0.77SS**  trans74.3135.4136.9-69.9171.7-178.3130.60122.9
426N44.2Very low44.5Very low142 Ų142148.6 Ų148.676%0.75976%0.763SS**  trans101.298.4146.6-68-5.4000120.3
427S45.4Very low44.3Very low96 Ų96149.6 Ų149.667%0.67177%0.773SS**  63127.2119.369.40000122.7
428H42.9Very low44.1Very low169 Ų169148.2 Ų148.278%0.78277%0.773SS**  trans89.9114.5142.7-80.1-54.1000120.6
429C39.5Very low43.8Very low100 Ų100150.2 Ų150.268%0.67678%0.779SS**  37.2130.4128-52.90000117.6
430H42.4Very low43.4Very low181 Ų181147.3 Ų147.384%0.83878%0.777SS**  -177151.661.3-132.1-83.1000108.7
431Y39.8Very low43.1Very low210 Ų210144.7 Ų144.782%0.82477%0.767SS**  trans-67.2139.2164.7-99.8-105.2000110.6
432D40.7Very low43Very low154 Ų154148.3 Ų148.382%0.82478%0.777SS**  -173.7153.1118-96.6-27.6000114
433S40Very low43Very low93 Ų93144.5 Ų144.565%0.6577%0.77SS**  trans-70.4155.5-174.867.10000114.2
434L40Very low42.6Very low154 Ų154149.4 Ų149.481%0.80677%0.769SS**  172.6137.4118.8-106.7127.4000113.5
435H42.9Very low42.5Very low183 Ų183151.4 Ų151.485%0.84778%0.78SS**  trans2.1143.1156.6-80.5-79.7000122.5
436G40.6Very low42.3Very low76 Ų76149.8 Ų149.878%0.78478%0.778SS**  trans177101.415000000114.4
437N40.7Very low42.6Very low155 Ų155151.4 Ų151.483%0.82979%0.785SS**  trans-54.7156.8168.3-82.7-32.1000113
438I43.9Very low42.3Very low174 Ų174153.2 Ų153.289%0.89279%0.787SS**  -174.5143.4126.1-89.6149.4000110.8
439Q42.8Very low42.1Very low162 Ų162150.5 Ų150.576%0.75779%0.786SS**  trans-79.8174.3-166.9-61.5165.7-60.600116
440N40.5Very low42.3Very low136 Ų136153.3 Ų153.373%0.72779%0.793SS**  trans107.9143.9145.8-64.2-23.7000115.7
441Q41.9Very low42.2Very low159 Ų159151.7 Ų151.774%0.74379%0.791SS**  cis169.7125.2-14.6-172.6-179.227.700103.5
442Y45.8Very low42.3Very low228 Ų228147.1 Ų147.189%0.89479%0.789SS**  trans-171.195.9160.9-101.1-70.9000110.8
443S44.4Very low42.3Very low98 Ų98144.5 Ų144.569%0.68578%0.783SS**  57.9106.5113.3900000117.3
444K41.9Very low42.2Very low182 Ų182148.1 Ų148.179%0.79179%0.79SS**  88.6113.481.1-137.8-179.8-165.7-179.50113
445N48.3Very low42.3Very low167 Ų167147.3 Ų147.389%0.89380%0.796SS**  trans-165.5124.4138.9-93-14.9000111.2
446N40.5Very low42.2Very low126 Ų126144.7 Ų144.767%0.67479%0.788SS**  trans-74.9157.4-179.2-72.8-8.5000112.7
447I48.9Very low42.1Very low176 Ų176149 Ų14990%0.90379%0.787SS**  trans-155.1118131.5-86.4140.2000106.9
448D39.7Very low42.3Very low134 Ų134149 Ų14972%0.71779%0.786SS**  trans-84.7153.6171.4-73.8-49.3000111.1
449C39.6Very low42.3Very low112 Ų112149 Ų14976%0.75778%0.782SS**  177.7115.2123.5-94.40000113.6
450I43.4Very low42Very low159 Ų159150.6 Ų150.682%0.81579%0.786SS**  92.9121128.7-58.4167.1000120.3
451D40Very low42Very low148 Ų148149.4 Ų149.479%0.79179%0.788SS**  trans-62.2153.1177.6-73.3-55.8000117.6
452S42.1Very low42.1Very low114 Ų114151.9 Ų151.980%0.79780%0.796SS**  -167.797124.924.70000112
453S39.8Very low42.1Very low99 Ų99150 Ų15069%0.69280%0.796SS**  trans27.4120.613463.50000121.6
454Q39.3Very low42.2Very low168 Ų168152.7 Ų152.779%0.78580%0.802SS**  88.1104.8118.5-155168.430.200119.3
455C41.6Very low42.6Very low138 Ų138151 Ų15193%0.93280%0.802SS**  -164.5126.3128-105.40000110.7
456D40.6Very low42.8Very low127 Ų127149 Ų14968%0.67979%0.791SS**  trans-75.8153.8-167.4-82.4-52.1000116.1
457H38.8Very low43.3Very low168 Ų168151 Ų15178%0.77880%0.796SS**  trans40.8120.3142.1-75-79.6000120.4
458I43.9Very low43.3Very low155 Ų155147.7 Ų147.780%0.79578%0.78SS**  177.9126.4115.2-92.7157.3000112.8
459H44.7Very low43.9Very low174 Ų174144.3 Ų144.381%0.80677%0.767SS**  trans76.998.8154.7-89.1-96000123.2
460K36.7Very low44.5Very low194 Ų194144 Ų14484%0.84376%0.757SS**  trans-38.6151.1146.2-80.8169.3169.5171.70114.2
461S40.4Very low44.8Very low111 Ų111138.7 Ų138.778%0.77673%0.734SS**  trans103.886.3166.980.30000115.7
462K44.3Very low45.4Very low212 Ų212136.1 Ų136.192%0.92272%0.72SS**  trans166.879.9150.5-96.8166.2-178.81780108.9
463Q45.4Very low45.7Very low187 Ų187139 Ų13987%0.87471%0.713SS**SBendtrans-140.94.9173.4-116.5172.3-1.100116.7
464N46.1Very low46Very low155 Ų155140.2 Ų140.283%0.82971%0.708SS**SBendtrans-123.132.7-179.6-72.10000114.8
465L51.3Low46.2Very low148 Ų148141.3 Ų141.378%0.77570%0.704SS**SBendtrans-123.13.5177.8-95.1159.9000114.6
466N52.2Low46.5Very low125 Ų125139.9 Ų139.967%0.66868%0.684SS**SBendtrans-103.6-13.4-177.3-102.5-0.3000115.2S469N466-S469 PolarHBondContact O-OG 2.82Å
467E49.7Very low46.7Very low167 Ų167137.2 Ų137.278%0.7867%0.669SS**Hα-helixtrans-81.8-32.3176.4-71.7-172.8151.200112.6S469 L470 S471E467-S469 PolarHBondContact O-N 2.89Å; E467-L470 PolarHBondContact O-N 2.86Å; E467-S471 PolarHBondContact O-N 3.15Å
468D49.9Very low46.8Very low107 Ų107133 Ų13357%0.57266%0.657SS**Hα-helixtrans-72.7-29176.9-76-24.5000113.3L470 S471 I472D468-L470 VanDerWaalsContact C-N 3.34Å; D468-S471 PolarHBondContact O-OG 2.93Å; D468-I472 WeakPolarHBondContact O-CB 3.37Å; D468-I472 WeakPolarHBondContact O-CD1 3.31Å; D468-I472 WeakPolarHBondContact O-CG1 3.32Å; D468-I472 PolarHBondContact O-N 2.98Å; D468-I472 VanDerWaalsContact O-N 3.12Å
469S53Low46.7Very low62 Ų62131.1 Ų131.143%0.43465%0.649SS.*Hα-helixtrans-75.3-25.8175.473.10000112.6N466 E467 R473N466-S469 PolarHBondContact O-OG 2.82Å; E467-S469 PolarHBondContact O-N 2.89Å; S469-R473 WeakPolarHBondContact O-CB 3.42Å; S469-R473 PolarHBondContact O-N 3.09Å
470L52.5Low46.7Very low105 Ų105126.4 Ų126.455%0.5563%0.63SS.*Hα-helixtrans-77.3-40.2172.5-110109.3000111.7E467 D468 R473 E474E467-L470 PolarHBondContact O-N 2.86Å; D468-L470 VanDerWaalsContact C-N 3.34Å; L470-R473 CarbonylContact O-C 3.6Å; L470-R473 WeakPolarHBondContact O-CB 3.46Å; L470-R473 PolarHBondContact O-N 3.01Å; L470-E474 WeakPolarHBondContact O-CG 3.43Å; L470-E474 PolarHBondContact O-N 3.07Å
471S49.6Very low46.7Very low48 Ų48123.9 Ų123.934%0.33663%0.625SS.*Hα-helixtrans-69-33.1178.278.30000112.9E467 D468 R475E467-S471 PolarHBondContact O-N 3.15Å; D468-S471 PolarHBondContact O-OG 2.93Å; S471-R475 WeakPolarHBondContact O-CB 3.49Å; S471-R475 PolarHBondContact O-N 2.94Å
472I51.8Low47Very low95 Ų95124.6 Ų124.649%0.48762%0.617SS.*Hα-helixtrans-68.7-37.8171.2-67.3166.2000110.7D468 R475 E476D468-I472 WeakPolarHBondContact O-CB 3.37Å; D468-I472 WeakPolarHBondContact O-CD1 3.31Å; D468-I472 WeakPolarHBondContact O-CG1 3.32Å; D468-I472 PolarHBondContact O-N 2.98Å; D468-I472 VanDerWaalsContact O-N 3.12Å; I472-R475 PolarHBondContact O-N 3.31Å; I472-E476 PolarHBondContact O-N 2.87Å
473R47.5Very low47.2Very low173 Ų173119.9 Ų119.965%0.65360%0.601SS**Hα-helixtrans-69.1-37.5176.5-153.3176.6-162.3-177.63.4111.4S469 L470 I477S469-R473 WeakPolarHBondContact O-CB 3.42Å; S469-R473 PolarHBondContact O-N 3.09Å; L470-R473 CarbonylContact O-C 3.6Å; L470-R473 WeakPolarHBondContact O-CB 3.46Å; L470-R473 PolarHBondContact O-N 3.01Å; R473-I477 HydrophobicContact CG-CD1 4.16Å; R473-I477 VanDerWaalsContact O-CB 3.28Å; R473-I477 WeakPolarHBondContact O-CB 3.3Å; R473-I477 WeakPolarHBondContact O-CD1 3.44Å; R473-I477 WeakPolarHBondContact O-CG1 3.09Å; R473-I477 PolarHBondContact O-N 2.83Å
474E46Very low47.3Very low125 Ų125116.2 Ų116.258%0.58459%0.586SS**Hα-helixtrans-69.8-35.7173.7-74.7-175.7161.900112.5L470 I477 C478L470-E474 WeakPolarHBondContact O-CG 3.43Å; L470-E474 PolarHBondContact O-N 3.07Å; E474-I477 PolarHBondContact O-N 3.24Å; E474-C478 WeakPolarHBondContact O-CB 3.41Å; E474-C478 PolarHBondContact O-N 2.8Å; E474-C478 PolarHBondContact O-SG 2.71Å
475R45.3Very low47.4Very low191 Ų191113.9 Ų113.972%0.72157%0.572SS**Hα-helixtrans-67.1-45.7171.3-84.7-175.4-173.5176.14.4112.9S471 I472 I477 C478 D479S471-R475 WeakPolarHBondContact O-CB 3.49Å; S471-R475 PolarHBondContact O-N 2.94Å; I472-R475 PolarHBondContact O-N 3.31Å; R475-I477 PolarHBondContact O-N 3.36Å; R475-C478 PolarHBondContact O-N 3.12Å; R475-C478 VanDerWaalsContact O-N 3.12Å; R475-D479 PolarHBondContact O-N 2.99Å
476E46.6Very low47.1Very low109 Ų109111.8 Ų111.851%0.50956%0.559SS.*Hα-helixtrans-63.6-30.7174.7-81.3-175.3158.700112.1I472I472-E476 PolarHBondContact O-N 2.87Å
477I45.4Very low46.8Very low71 Ų71110.9 Ų110.936%0.36455%0.552SS.*Hα-helixtrans-74.6-30.8175.1-70.9164.8000111.7R473 E474 R475R473-I477 HydrophobicContact CG-CD1 4.16Å; R473-I477 VanDerWaalsContact O-CB 3.28Å; R473-I477 WeakPolarHBondContact O-CB 3.3Å; R473-I477 WeakPolarHBondContact O-CD1 3.44Å; R473-I477 WeakPolarHBondContact O-CG1 3.09Å; R473-I477 PolarHBondContact O-N 2.83Å; E474-I477 PolarHBondContact O-N 3.24Å; R475-I477 PolarHBondContact O-N 3.36Å
478C40.9Very low46.6Very low78 Ų78106.9 Ų106.953%0.52754%0.536SS..Hα-helixtrans-77.6-26.5173.3-69.10000113.2E474 R475 D480 L481E474-C478 WeakPolarHBondContact O-CB 3.41Å; E474-C478 PolarHBondContact O-N 2.8Å; E474-C478 PolarHBondContact O-SG 2.71Å; R475-C478 PolarHBondContact O-N 3.12Å; R475-C478 VanDerWaalsContact O-N 3.12Å; C478-D480 VanDerWaalsContact C-N 3.31Å; C478-L481 WeakPolarHBondContact O-CB 3.5Å; C478-L481 PolarHBondContact O-N 3.41Å
479D42.2Very low46.3Very low117 Ų117106.9 Ų106.963%0.62653%0.533SS*.Hα-helixtrans-76.2-18178.1-74.7-26.7000113.5R475R475-D479 PolarHBondContact O-N 2.99Å
480D45Very low45.8Very low74 Ų74110.7 Ų110.740%0.39654%0.541SS..THydrogen-bonded Turntrans-90.32.3171.2-101.8-0.1000112.9R138 C478R138-D480 IonicContact CZ-OD2 3.74Å; R138-D480 IonicContact NH1-OD1 3.36Å; R138-D480 PolarHBondContact NH1-OD1 2.95Å; R138-D480 IonicContact NH1-OD2 3.02Å; R138-D480 PolarHBondContact NH1-OD2 3.14Å; R138-D480 VanDerWaalsContact NH1-OD2 3.12Å; R138-D480 IonicContact NH2-OD2 2.66Å; R138-D480 PolarHBondContact NH2-OD2 3.06Å; C478-D480 VanDerWaalsContact C-N 3.31Å
481L36.4Very low45.2Very low142 Ų142111.2 Ų111.274%0.74354%0.541SS*.  trans-100.20175-89.2160.1000112.9R55 C478R55-L481 PolarHBondContact NH1-O 3.15Å; R55-L481 PolarHBondContact NH1-OXT 3.06Å; C478-L481 WeakPolarHBondContact O-CB 3.5Å; C478-L481 PolarHBondContact O-N 3.41Å

Retrieved 481 of 481 residues in 605.7 ms (Link to these results)

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