Z4YLZ2_MOUSE Loading...

Transient receptor potential cation channel, subfamily V, member 1

AlphaFold DB , UniProt , Accession Z4YLZ2, Species MOUSE (Mus musculus, Mouse), Gene Trpv1, Length 474 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
1M79.9Confident87.4Confident163 Ų16369.3 Ų69.380%0.80334%0.343SS*.  0-66.70-151.9-179.3-174.500115.5N3 E4 I5M1-N3 PolarHBondContact O-N 3.04Å; M1-E4 WeakPolarHBondContact CA-OE2 3.31Å; M1-E4 PolarHBondContact N-OE1 2.89Å; M1-E4 PolarHBondContact N-OE2 3.02Å; M1-E4 PolarHBondContact O-N 2.89Å; M1-I5 HydrophobicContact CE-CD1 4.47Å; M1-I5 HydrophobicContact CG-CD1 4.24Å; M1-I5 WeakPolarHBondContact O-CG1 3.5Å; M1-I5 PolarHBondContact O-N 3.03Å; M1-I5 VanDerWaalsContact O-N 3.14Å
2Y88.4Confident87.5Confident79 Ų7973.6 Ų73.631%0.3137%0.367SS..Hα-helixtrans-60.3-48.1-175.2-172.6-97.9000113.3I5 L6 I45Y2-I5 PolarHBondContact O-N 3.13Å; Y2-L6 HydrophobicContact CD1-CD1 3.82Å; Y2-L6 HydrophobicContact CE1-CD1 3.4Å; Y2-L6 VanDerWaalsContact CE1-CD1 3.4Å; Y2-L6 HydrophobicContact CE1-CG 4.32Å; Y2-L6 PolarHBondContact O-N 2.8Å; Y2-I45 HydrophobicContact CE1-CD1 4.24Å; Y2-I45 HydrophobicContact CE1-CG1 3.96Å
3N86.7Confident87.3Confident26 Ų2677.2 Ų77.214%0.13938%0.382CS..Hα-helixtrans-65.9-37.5176.9-765.6000112.9M1 I5 L6 I7 Y44 R48M1-N3 PolarHBondContact O-N 3.04Å; N3-I5 VanDerWaalsContact C-N 3.31Å; N3-I5 PolarHBondContact O-N 3.47Å; N3-L6 PolarHBondContact O-N 3.09Å; N3-I7 WeakPolarHBondContact O-CB 2.89Å; N3-I7 VanDerWaalsContact O-CG1 3.24Å; N3-I7 WeakPolarHBondContact O-CG1 3.32Å; N3-I7 PolarHBondContact O-N 2.89Å; N3-Y44 VanDerWaalsContact CG-OH 3.24Å; N3-Y44 PolarHBondContact ND2-OH 3.36Å; N3-Y44 VanDerWaalsContact OD1-CE1 3.32Å; N3-Y44 WeakPolarHBondContact OD1-CE1 3.24Å; N3-R48 WeakPolarHBondContact OD1-CD 3.23Å
4E88.9Confident86.9Confident119 Ų11976.1 Ų76.156%0.55638%0.384SS*.Hα-helixtrans-59.2-43.1177.3-71.3148-139.800111.4M1 L6 I7 L8M1-E4 WeakPolarHBondContact CA-OE2 3.31Å; M1-E4 PolarHBondContact N-OE1 2.89Å; M1-E4 PolarHBondContact N-OE2 3.02Å; M1-E4 PolarHBondContact O-N 2.89Å; E4-L6 VanDerWaalsContact C-N 3.34Å; E4-L6 PolarHBondContact O-N 3.39Å; E4-I7 PolarHBondContact O-N 2.9Å; E4-L8 WeakPolarHBondContact O-CB 3.5Å; E4-L8 PolarHBondContact O-N 3.32Å
5I90.5Very high86.3Confident96 Ų9678.3 Ų78.349%0.49240%0.402SS..Hα-helixtrans-64.5-40.6177.2-65.4167.9000110.9M1 Y2 N3 G9M1-I5 HydrophobicContact CE-CD1 4.47Å; M1-I5 HydrophobicContact CG-CD1 4.24Å; M1-I5 WeakPolarHBondContact O-CG1 3.5Å; M1-I5 PolarHBondContact O-N 3.03Å; M1-I5 VanDerWaalsContact O-N 3.14Å; Y2-I5 PolarHBondContact O-N 3.13Å; N3-I5 VanDerWaalsContact C-N 3.31Å; N3-I5 PolarHBondContact O-N 3.47Å; I5-G9 PolarHBondContact O-N 3.3Å
6L89.8Confident86.1Confident10 Ų1078.7 Ų78.75%0.05241%0.405CS..Hα-helixtrans-65.4-42.5176.7-78.2172.3000112.3Y2 N3 E4 G9 A10 L18 E19 L58Y2-L6 HydrophobicContact CD1-CD1 3.82Å; Y2-L6 HydrophobicContact CE1-CD1 3.4Å; Y2-L6 VanDerWaalsContact CE1-CD1 3.4Å; Y2-L6 HydrophobicContact CE1-CG 4.32Å; Y2-L6 PolarHBondContact O-N 2.8Å; N3-L6 PolarHBondContact O-N 3.09Å; E4-L6 VanDerWaalsContact C-N 3.34Å; E4-L6 PolarHBondContact O-N 3.39Å; L6-G9 PolarHBondContact O-N 3.32Å; L6-A10 WeakPolarHBondContact O-CB 3.43Å; L6-A10 PolarHBondContact O-N 2.89Å; L6-L18 HydrophobicContact CD2-CB 4.03Å; L6-L18 HydrophobicContact CD2-CD1 4.27Å; L6-E19 WeakPolarHBondContact CD1-OE1 3.23Å; L6-E19 HydrophobicContact CD2-CG 3.99Å; L6-L58 HydrophobicContact CB-CD1 4.39Å
7I88.7Confident86Confident27 Ų2780.9 Ų80.914%0.13841%0.411CS..Hα-helixtrans-65.8-46.7178-67.9165.1000110.2N3 E4 G9 A10 K11 I50 C55N3-I7 WeakPolarHBondContact O-CB 2.89Å; N3-I7 VanDerWaalsContact O-CG1 3.24Å; N3-I7 WeakPolarHBondContact O-CG1 3.32Å; N3-I7 PolarHBondContact O-N 2.89Å; E4-I7 PolarHBondContact O-N 2.9Å; I7-G9 VanDerWaalsContact C-N 3.32Å; I7-G9 PolarHBondContact O-N 2.8Å; I7-A10 PolarHBondContact O-N 3.07Å; I7-K11 HydrophobicContact CG2-CD 4.08Å; I7-K11 WeakPolarHBondContact O-CB 3.43Å; I7-K11 WeakPolarHBondContact O-CG 3.49Å; I7-K11 PolarHBondContact O-N 3.12Å; I7-I50 HydrophobicContact CG1-CD1 4.35Å; I7-C55 HydrophobicContact CG1-CB 4.46Å
8L89.4Confident86.1Confident104 Ų10479.8 Ų79.855%0.54541%0.406SS..Hα-helixtrans-59-43.8173.3-91.6152.6000111.6E4 A10 K11 L12E4-L8 WeakPolarHBondContact O-CB 3.5Å; E4-L8 PolarHBondContact O-N 3.32Å; L8-A10 PolarHBondContact O-N 2.92Å; L8-K11 PolarHBondContact O-N 3.34Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 VanDerWaalsContact O-CG 3.32Å; L8-L12 WeakPolarHBondContact O-CG 3.42Å; L8-L12 PolarHBondContact O-N 3.11Å
9G87.4Confident86.1Confident15 Ų1577.1 Ų77.116%0.15539%0.392CS..Hα-helixtrans-60.2-44.6177.500000112.6I5 L6 I7 L12 H13I5-G9 PolarHBondContact O-N 3.3Å; L6-G9 PolarHBondContact O-N 3.32Å; I7-G9 VanDerWaalsContact C-N 3.32Å; I7-G9 PolarHBondContact O-N 2.8Å; G9-L12 PolarHBondContact O-N 3.22Å; G9-H13 CarbonylContact O-C 3.53Å; G9-H13 WeakPolarHBondContact O-CA 3.45Å; G9-H13 PolarHBondContact O-N 3.36Å
10A85.9Confident86.1Confident13 Ų1379.1 Ų79.111%0.10740%0.399CS..Hα-helixtrans-68.6-33.9176.500000113L6 I7 L8 P14 L58L6-A10 WeakPolarHBondContact O-CB 3.43Å; L6-A10 PolarHBondContact O-N 2.89Å; I7-A10 PolarHBondContact O-N 3.07Å; L8-A10 PolarHBondContact O-N 2.92Å; A10-P14 WeakPolarHBondContact O-CA 3.32Å; A10-L58 HydrophobicContact CB-CD1 3.84Å
11K85.6Confident86.2Confident110 Ų11080 Ų8048%0.47841%0.405SS..Hα-helixtrans-69.6-38.4175.1-73.4176.4-177.61720112.4I7 L8 E52I7-K11 HydrophobicContact CG2-CD 4.08Å; I7-K11 WeakPolarHBondContact O-CB 3.43Å; I7-K11 WeakPolarHBondContact O-CG 3.49Å; I7-K11 PolarHBondContact O-N 3.12Å; L8-K11 PolarHBondContact O-N 3.34Å; K11-E52 IonicContact NZ-OE2 2.79Å; K11-E52 PolarHBondContact NZ-OE2 3.44Å
12L88.4Confident86.7Confident121 Ų12176.4 Ų76.463%0.63439%0.392SS*.Hα-helixtrans-80.8-42.9179.9-69.5168.8000112.7L8 G9L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 VanDerWaalsContact O-CG 3.32Å; L8-L12 WeakPolarHBondContact O-CG 3.42Å; L8-L12 PolarHBondContact O-N 3.11Å; G9-L12 PolarHBondContact O-N 3.22Å
13H85.9Confident86.9Confident120 Ų12075.6 Ų75.656%0.55639%0.393SS*.  trans-136.782.8-175.8-67.2-57.5000110.8G9 T15 L16G9-H13 CarbonylContact O-C 3.53Å; G9-H13 WeakPolarHBondContact O-CA 3.45Å; G9-H13 PolarHBondContact O-N 3.36Å; H13-T15 VanDerWaalsContact C-N 3.25Å; H13-T15 PolarHBondContact O-N 2.67Å; H13-L16 HydrophobicContact CB-CB 4.08Å; H13-L16 PolarHBondContact O-N 2.74Å
14P80.8Confident87Confident63 Ų6385 Ų8541%0.40943%0.433SS..THydrogen-bonded Turntrans-63.8-28.6-173.1-17.628.1000114A10 P425A10-P14 WeakPolarHBondContact O-CA 3.32Å; P14-P425 HydrophobicContact CB-CB 3.64Å; P14-P425 HydrophobicContact CB-CG 4.25Å
15T78.3Confident86.7Confident108 Ų10887.5 Ų87.566%0.66344%0.442SS*.THydrogen-bonded Turntrans-80.2-17.1-178.257.10000113.2H13H13-T15 VanDerWaalsContact C-N 3.25Å; H13-T15 PolarHBondContact O-N 2.67Å
16L83.6Confident86.5Confident85 Ų8584.3 Ų84.345%0.44543%0.433SS..  trans-92.7107.5-174.6-174.268.7000111H13 L18H13-L16 HydrophobicContact CB-CB 4.08Å; H13-L16 PolarHBondContact O-N 2.74Å; L16-L18 HydrophobicContact CD2-CD2 3.98Å; L16-L18 HydrophobicContact CG-CD2 4.44Å; L16-L18 PolarHBondContact O-N 3.22Å; L16-L18 VanDerWaalsContact O-N 3.11Å
17K84.6Confident86.4Confident117 Ų11785 Ų8551%0.50944%0.437SS..  trans-81.191.4174.2-63.9-175.5-175.6-176.70111.6E19 E20K17-E19 PolarHBondContact O-N 3.25Å; K17-E19 VanDerWaalsContact O-N 3.13Å; K17-E20 HydrophobicContact CB-CB 4.27Å; K17-E20 HydrophobicContact CB-CG 4.08Å; K17-E20 HydrophobicContact CD-CG 4.21Å; K17-E20 WeakPolarHBondContact CD-OE1 3.2Å; K17-E20 WeakPolarHBondContact CD-OE2 3.41Å; K17-E20 IonicContact NZ-OE1 3.55Å; K17-E20 PolarHBondContact NZ-OE1 2.99Å; K17-E20 PolarHBondContact O-N 2.91Å; K17-E20 VanDerWaalsContact O-N 3.12Å
18L87.8Confident86.4Confident60 Ų6084.7 Ų84.731%0.31444%0.436SS..G310 helixtrans-55.4-30.8-178.2-70.5170000114.2L6 L16 L21L6-L18 HydrophobicContact CD2-CB 4.03Å; L6-L18 HydrophobicContact CD2-CD1 4.27Å; L16-L18 HydrophobicContact CD2-CD2 3.98Å; L16-L18 HydrophobicContact CG-CD2 4.44Å; L16-L18 PolarHBondContact O-N 3.22Å; L16-L18 VanDerWaalsContact O-N 3.11Å; L18-L21 HydrophobicContact CD2-CD1 4.14Å
19E86.1Confident86.5Confident29 Ų2981.8 Ų81.814%0.13642%0.423CS..G310 helixtrans-77.4-21.3-178.7-62.2-160.4156.900114.6L6 K17 L21 P29 R48 R60L6-E19 WeakPolarHBondContact CD1-OE1 3.23Å; L6-E19 HydrophobicContact CD2-CG 3.99Å; K17-E19 PolarHBondContact O-N 3.25Å; K17-E19 VanDerWaalsContact O-N 3.13Å; E19-L21 VanDerWaalsContact C-N 3.27Å; E19-P29 WeakPolarHBondContact O-CD 3.42Å; E19-R48 IonicContact OE1-CZ 3.56Å; E19-R48 IonicContact OE1-NH1 3.12Å; E19-R48 PolarHBondContact OE1-NH1 2.9Å; E19-R48 IonicContact OE1-NH2 3.9Å; E19-R48 PolarHBondContact OE1-NH2 2.96Å; E19-R48 IonicContact OE2-NH2 3.4Å; E19-R48 PolarHBondContact OE2-NH2 3.42Å; E19-R60 IonicContact OE2-CZ 3.17Å; E19-R60 IonicContact OE2-NE 3.82Å; E19-R60 PolarHBondContact OE2-NE 2.88Å; E19-R60 IonicContact OE2-NH2 2.8Å; E19-R60 PolarHBondContact OE2-NH2 2.79Å
20E85.7Confident86.7Confident117 Ų11781.2 Ų81.255%0.54742%0.417SS..G310 helixtrans-82.7-11.2178.4-66-178.6-17500111.4K17 T22K17-E20 HydrophobicContact CB-CB 4.27Å; K17-E20 HydrophobicContact CB-CG 4.08Å; K17-E20 HydrophobicContact CD-CG 4.21Å; K17-E20 WeakPolarHBondContact CD-OE1 3.2Å; K17-E20 WeakPolarHBondContact CD-OE2 3.41Å; K17-E20 IonicContact NZ-OE1 3.55Å; K17-E20 PolarHBondContact NZ-OE1 2.99Å; K17-E20 PolarHBondContact O-N 2.91Å; K17-E20 VanDerWaalsContact O-N 3.12Å; E20-T22 PolarHBondContact O-N 2.89Å
21L88.9Confident86.8Confident98 Ų9880.7 Ų80.751%0.51341%0.412SS..  trans-67.9125.8177.3-63.7177000111.1L18 E19L18-L21 HydrophobicContact CD2-CD1 4.14Å; E19-L21 VanDerWaalsContact C-N 3.27Å
22T89.8Confident87Confident88 Ų8879.2 Ų79.254%0.5441%0.409SS..  trans-100.4146.8-179.858.90000112.3E20 L27 T28E20-T22 PolarHBondContact O-N 2.89Å; T22-L27 WeakPolarHBondContact CA-O 3.14Å; T22-T28 HydrophobicContact CG2-CG2 4.03Å
23N91.7Very high87.1Confident61 Ų6173.8 Ų73.833%0.32638%0.382SS..  trans-73.6179.2169.671.210.4000112.3K25 G26 L27N23-K25 PolarHBondContact O-N 3.47Å; N23-K25 VanDerWaalsContact OD1-CA 3.29Å; N23-K25 WeakPolarHBondContact OD1-CA 3.49Å; N23-K25 WeakPolarHBondContact OD1-CB 3.19Å; N23-K25 PolarHBondContact OD1-N 3Å; N23-G26 PolarHBondContact O-N 2.96Å; N23-G26 PolarHBondContact OD1-N 3.22Å; N23-G26 VanDerWaalsContact OD1-N 3.09Å; N23-L27 PolarHBondContact N-O 3.15Å; N23-L27 PolarHBondContact OD1-N 3.42Å
24K89.4Confident87.2Confident223 Ų22368.1 Ų68.197%0.9736%0.356SS*.THydrogen-bonded Turntrans-58.2-19.5175.8-65.7-175.1179.9-179.30114.4
25K83Confident87.4Confident172 Ų17266.7 Ų66.775%0.74835%0.347SS*.THydrogen-bonded Turntrans-91.63175.5-61.5-176.6177.3-178.20112.6N23 L27N23-K25 PolarHBondContact O-N 3.47Å; N23-K25 VanDerWaalsContact OD1-CA 3.29Å; N23-K25 WeakPolarHBondContact OD1-CA 3.49Å; N23-K25 WeakPolarHBondContact OD1-CB 3.19Å; N23-K25 PolarHBondContact OD1-N 3Å; K25-L27 HydrophobicContact CB-CD1 4.32Å; K25-L27 HydrophobicContact CB-CG 4.29Å
26G85.4Confident87.8Confident30 Ų3064.2 Ų64.231%0.30933%0.334SS..SBendtrans71.126.1-177.600000114.1N23 N86N23-G26 PolarHBondContact O-N 2.96Å; N23-G26 PolarHBondContact OD1-N 3.22Å; N23-G26 VanDerWaalsContact OD1-N 3.09Å; G26-N86 PolarHBondContact O-ND2 3.21Å
27L87.1Confident88Confident25 Ų2561 Ų6113%0.13132%0.321CS..  trans-103.3130.8177.8-57.9172.2000110.4T22 N23 K25 A31 L32 V91T22-L27 WeakPolarHBondContact CA-O 3.14Å; N23-L27 PolarHBondContact N-O 3.15Å; N23-L27 PolarHBondContact OD1-N 3.42Å; K25-L27 HydrophobicContact CB-CD1 4.32Å; K25-L27 HydrophobicContact CB-CG 4.29Å; L27-A31 HydrophobicContact CB-CB 4.2Å; L27-A31 HydrophobicContact CD2-CB 4.01Å; L27-L32 HydrophobicContact CD1-CD1 4.34Å; L27-V91 HydrophobicContact CD2-CG2 4.22Å
28T90.4Very high88.2Confident19 Ų1961.6 Ų61.612%0.11732%0.324CS..  trans-72.7165.8167.760.90000110.7T22 L30 A31 L32T22-T28 HydrophobicContact CG2-CG2 4.03Å; T28-L30 PolarHBondContact O-N 3.33Å; T28-A31 PolarHBondContact O-N 3.35Å; T28-A31 VanDerWaalsContact O-N 3.14Å; T28-A31 PolarHBondContact OG1-N 3.32Å; T28-L32 WeakPolarHBondContact O-CB 3.2Å; T28-L32 PolarHBondContact O-N 3.33Å
29P91.1Very high88.3Confident44 Ų4461 Ų6129%0.28632%0.321SS..Hα-helixtrans-54.9-36.3175.7-27.136.4000113.1E19 L32 A33E19-P29 WeakPolarHBondContact O-CD 3.42Å; P29-L32 PolarHBondContact O-N 3.42Å; P29-A33 WeakPolarHBondContact O-CB 3.23Å; P29-A33 PolarHBondContact O-N 3.33Å
30L90.8Very high88.5Confident3 Ų362.4 Ų62.42%0.01634%0.343CS..Hα-helixtrans-67.9-48.3176-177.269.5000112T28 L32 A33 A34 L42 I45 L46 C79 I80 V88T28-L30 PolarHBondContact O-N 3.33Å; L30-L32 VanDerWaalsContact C-N 3.25Å; L30-L32 PolarHBondContact O-N 3.02Å; L30-A33 PolarHBondContact O-N 2.7Å; L30-A34 PolarHBondContact O-N 3.04Å; L30-L42 HydrophobicContact CD1-CD1 3.69Å; L30-L42 HydrophobicContact CG-CD1 4.47Å; L30-I45 HydrophobicContact CD1-CB 3.99Å; L30-I45 HydrophobicContact CD1-CD1 4.47Å; L30-I45 HydrophobicContact CD1-CG2 3.73Å; L30-L46 HydrophobicContact CD1-CD2 4.2Å; L30-L46 HydrophobicContact CD1-CG 4.24Å; L30-L46 HydrophobicContact CD2-CD2 4.43Å; L30-C79 HydrophobicContact CD2-CB 4.36Å; L30-I80 HydrophobicContact CD2-CG1 4.27Å; L30-V88 HydrophobicContact CB-CG2 4.45Å; L30-V88 HydrophobicContact CD2-CG2 3.57Å; L30-V88 HydrophobicContact CG-CG2 3.56Å
31A88.5Confident88.7Confident1 Ų160.3 Ų60.31%0.00834%0.338CS..Hα-helixtrans-64.1-32.7176.200000111.8L27 T28 A34 S35 V91L27-A31 HydrophobicContact CB-CB 4.2Å; L27-A31 HydrophobicContact CD2-CB 4.01Å; T28-A31 PolarHBondContact O-N 3.35Å; T28-A31 VanDerWaalsContact O-N 3.14Å; T28-A31 PolarHBondContact OG1-N 3.32Å; A31-A34 WeakPolarHBondContact O-CB 3.2Å; A31-A34 PolarHBondContact O-N 3.21Å; A31-S35 WeakPolarHBondContact O-CB 3.38Å; A31-S35 PolarHBondContact O-N 3.25Å; A31-S35 PolarHBondContact O-OG 3.17Å; A31-V91 HydrophobicContact CB-CG2 4.46Å
32L89.9Confident88.8Confident79 Ų7955.6 Ų55.641%0.41431%0.313SS..Hα-helixtrans-67.8-44.6175-174.665.7000111.6L27 T28 P29 L30 A34 S35 S36L27-L32 HydrophobicContact CD1-CD1 4.34Å; T28-L32 WeakPolarHBondContact O-CB 3.2Å; T28-L32 PolarHBondContact O-N 3.33Å; P29-L32 PolarHBondContact O-N 3.42Å; L30-L32 VanDerWaalsContact C-N 3.25Å; L30-L32 PolarHBondContact O-N 3.02Å; L32-A34 VanDerWaalsContact C-N 3.26Å; L32-A34 PolarHBondContact O-N 3.17Å; L32-S35 WeakPolarHBondContact CA-OG 3.28Å; L32-S35 PolarHBondContact O-N 3.25Å; L32-S35 PolarHBondContact O-OG 2.8Å; L32-S36 VanDerWaalsContact O-CB 3.31Å; L32-S36 WeakPolarHBondContact O-CB 3.24Å; L32-S36 PolarHBondContact O-N 2.96Å; L32-S36 PolarHBondContact O-OG 3.02Å
33A89.6Confident88.9Confident7 Ų752.3 Ų52.36%0.05830%0.295CS..Hα-helixtrans-59.1-40.7175.300000111.5P29 L30 S36 K38 V41 L42P29-A33 WeakPolarHBondContact O-CB 3.23Å; P29-A33 PolarHBondContact O-N 3.33Å; L30-A33 PolarHBondContact O-N 2.7Å; A33-S36 PolarHBondContact O-OG 2.86Å; A33-K38 PolarHBondContact O-N 2.99Å; A33-V41 HydrophobicContact CB-CB 4.42Å; A33-V41 HydrophobicContact CB-CG1 4.1Å; A33-L42 HydrophobicContact CB-CB 4.49Å
34A88.1Confident88.9Confident2 Ų255 Ų552%0.01730%0.301CS..Hα-helixtrans-62.6-50.7172.700000112.6L30 A31 L32 S36 G37 L42 V88 V91 I92L30-A34 PolarHBondContact O-N 3.04Å; A31-A34 WeakPolarHBondContact O-CB 3.2Å; A31-A34 PolarHBondContact O-N 3.21Å; L32-A34 VanDerWaalsContact C-N 3.26Å; L32-A34 PolarHBondContact O-N 3.17Å; A34-S36 PolarHBondContact O-N 2.69Å; A34-G37 PolarHBondContact O-N 3.02Å; A34-L42 HydrophobicContact CB-CD1 4.29Å; A34-V88 HydrophobicContact CB-CG1 4Å; A34-V91 HydrophobicContact CB-CG1 4.15Å; A34-I92 HydrophobicContact CB-CD1 4.21Å; A34-I92 HydrophobicContact CB-CG1 3.74Å
35S86.6Confident89Confident32 Ų3244.5 Ų44.522%0.22426%0.256CS..Hα-helixtrans-64.4-26.7-179.270.90000113.9A31 L32A31-S35 WeakPolarHBondContact O-CB 3.38Å; A31-S35 PolarHBondContact O-N 3.25Å; A31-S35 PolarHBondContact O-OG 3.17Å; L32-S35 WeakPolarHBondContact CA-OG 3.28Å; L32-S35 PolarHBondContact O-N 3.25Å; L32-S35 PolarHBondContact O-OG 2.8Å
36S86.8Confident89.4Confident56 Ų5636.5 Ų36.539%0.39222%0.221SC..THydrogen-bonded Turntrans-93.71.6-173.258.70000114.6L32 A33 A34L32-S36 VanDerWaalsContact O-CB 3.31Å; L32-S36 WeakPolarHBondContact O-CB 3.24Å; L32-S36 PolarHBondContact O-N 2.96Å; L32-S36 PolarHBondContact O-OG 3.02Å; A33-S36 PolarHBondContact O-OG 2.86Å; A34-S36 PolarHBondContact O-N 2.69Å
37G86.1Confident89.7Confident17 Ų1739.1 Ų39.118%0.17523%0.225CC..THydrogen-bonded Turntrans84.74.9177.600000114.7A34 I39 M105A34-G37 PolarHBondContact O-N 3.02Å; G37-I39 PolarHBondContact O-N 3.37Å; G37-M105 WeakPolarHBondContact O-CE 3.31Å
38K89.7Confident89.9Confident130 Ų13038.2 Ų38.257%0.56522%0.22SC*.  trans-91.780.8-168.1-59-61.2-179.3-178.10112.8A33 G40 V41 L42A33-K38 PolarHBondContact O-N 2.99Å; K38-G40 PolarHBondContact O-N 3.38Å; K38-V41 HydrophobicContact CB-CB 4.35Å; K38-V41 HydrophobicContact CB-CG2 4.37Å; K38-V41 PolarHBondContact O-N 2.8Å; K38-L42 WeakPolarHBondContact O-CB 3.29Å; K38-L42 PolarHBondContact O-N 3.29Å
39I89.5Confident89.8Confident48 Ų4840.2 Ų40.225%0.24623%0.228CC..Hα-helixtrans-55.7-46.5-177.7-60.5164.3000112.5G37 V41 L42 A43 N101 D104 M105 V108G37-I39 PolarHBondContact O-N 3.37Å; I39-V41 VanDerWaalsContact C-N 3.35Å; I39-V41 PolarHBondContact O-N 2.82Å; I39-L42 WeakPolarHBondContact O-CB 3.32Å; I39-L42 PolarHBondContact O-N 3.14Å; I39-A43 WeakPolarHBondContact O-CB 3.38Å; I39-A43 PolarHBondContact O-N 3.36Å; I39-N101 HydrophobicContact CD1-CB 3.8Å; I39-D104 HydrophobicContact CD1-CB 3.93Å; I39-M105 HydrophobicContact CD1-CG 4.43Å; I39-M105 HydrophobicContact CG1-CE 4.12Å; I39-M105 HydrophobicContact CG1-CG 3.6Å; I39-V108 HydrophobicContact CG2-CG2 4Å
40G89.6Confident89.5Confident58 Ų5838.8 Ų38.860%0.59822%0.218SC*.Hα-helixtrans-60.6-42.4-176.600000113K38 Y44K38-G40 PolarHBondContact O-N 3.38Å; G40-Y44 WeakPolarHBondContact O-CB 3.09Å; G40-Y44 PolarHBondContact O-N 3.4Å
41V91.2Very high89Confident73 Ų7345.6 Ų45.644%0.44225%0.249SC..Hα-helixtrans-69.4-42.3176.9-1790000110.7A33 K38 I39 Y44 I45A33-V41 HydrophobicContact CB-CB 4.42Å; A33-V41 HydrophobicContact CB-CG1 4.1Å; K38-V41 HydrophobicContact CB-CB 4.35Å; K38-V41 HydrophobicContact CB-CG2 4.37Å; K38-V41 PolarHBondContact O-N 2.8Å; I39-V41 VanDerWaalsContact C-N 3.35Å; I39-V41 PolarHBondContact O-N 2.82Å; V41-Y44 PolarHBondContact O-N 3.41Å; V41-I45 HydrophobicContact CG1-CD1 3.85Å; V41-I45 HydrophobicContact CG1-CG1 4.42Å; V41-I45 VanDerWaalsContact O-CG1 3.31Å; V41-I45 WeakPolarHBondContact O-CG1 3Å; V41-I45 PolarHBondContact O-N 3Å
42L91.2Very high88.6Confident0 Ų049.5 Ų49.50%027%0.267CS..Hα-helixtrans-59-51.6177.1179.467.3000111.4L30 A33 A34 K38 I39 Y44 I45 L46 V88 I92 M105L30-L42 HydrophobicContact CD1-CD1 3.69Å; L30-L42 HydrophobicContact CG-CD1 4.47Å; A33-L42 HydrophobicContact CB-CB 4.49Å; A34-L42 HydrophobicContact CB-CD1 4.29Å; K38-L42 WeakPolarHBondContact O-CB 3.29Å; K38-L42 PolarHBondContact O-N 3.29Å; I39-L42 WeakPolarHBondContact O-CB 3.32Å; I39-L42 PolarHBondContact O-N 3.14Å; L42-Y44 VanDerWaalsContact C-N 3.34Å; L42-Y44 PolarHBondContact O-N 2.91Å; L42-I45 PolarHBondContact O-N 2.65Å; L42-L46 HydrophobicContact CD1-CD1 4.06Å; L42-L46 HydrophobicContact CD1-CG 4.48Å; L42-L46 HydrophobicContact CG-CD1 3.97Å; L42-L46 WeakPolarHBondContact O-CB 3.5Å; L42-L46 VanDerWaalsContact O-CG 3.27Å; L42-L46 WeakPolarHBondContact O-CG 3.47Å; L42-L46 PolarHBondContact O-N 3.12Å; L42-V88 HydrophobicContact CD1-CG1 4.26Å; L42-I92 HydrophobicContact CD2-CD1 4.1Å; L42-M105 HydrophobicContact CD2-CB 4.05Å; L42-M105 HydrophobicContact CD2-CG 4.13Å; L42-M105 HydrophobicContact CD2-SD 4.37Å
43A91.4Very high87.9Confident18 Ų1851 Ų5115%0.14928%0.282CS..Hα-helixtrans-62-42.6178.500000111.5I39 I45 L46 Q47 V108I39-A43 WeakPolarHBondContact O-CB 3.38Å; I39-A43 PolarHBondContact O-N 3.36Å; A43-I45 PolarHBondContact O-N 2.99Å; A43-L46 PolarHBondContact O-N 3.02Å; A43-Q47 WeakPolarHBondContact O-CB 3.35Å; A43-Q47 WeakPolarHBondContact O-CG 3.5Å; A43-Q47 PolarHBondContact O-N 3.15Å; A43-V108 HydrophobicContact CB-CG1 3.67Å; A43-V108 HydrophobicContact CB-CG2 4.26Å
44Y91.8Very high87.3Confident119 Ų11957.6 Ų57.647%0.46731%0.311SS..Hα-helixtrans-61.3-43.8178.2-174.7-100.2000112.8N3 G40 V41 L42 R48N3-Y44 VanDerWaalsContact CG-OH 3.24Å; N3-Y44 PolarHBondContact ND2-OH 3.36Å; N3-Y44 VanDerWaalsContact OD1-CE1 3.32Å; N3-Y44 WeakPolarHBondContact OD1-CE1 3.24Å; G40-Y44 WeakPolarHBondContact O-CB 3.09Å; G40-Y44 PolarHBondContact O-N 3.4Å; V41-Y44 PolarHBondContact O-N 3.41Å; L42-Y44 VanDerWaalsContact C-N 3.34Å; L42-Y44 PolarHBondContact O-N 2.91Å; Y44-R48 WeakPolarHBondContact O-CB 3.31Å; Y44-R48 PolarHBondContact O-N 2.98Å
45I92.2Very high87Confident2 Ų257.6 Ų57.61%0.0131%0.312CS..Hα-helixtrans-66.5-44.8177.3-63.4167.6000110.3Y2 L30 V41 L42 A43 Q47 R48 R60Y2-I45 HydrophobicContact CE1-CD1 4.24Å; Y2-I45 HydrophobicContact CE1-CG1 3.96Å; L30-I45 HydrophobicContact CD1-CB 3.99Å; L30-I45 HydrophobicContact CD1-CD1 4.47Å; L30-I45 HydrophobicContact CD1-CG2 3.73Å; V41-I45 HydrophobicContact CG1-CD1 3.85Å; V41-I45 HydrophobicContact CG1-CG1 4.42Å; V41-I45 VanDerWaalsContact O-CG1 3.31Å; V41-I45 WeakPolarHBondContact O-CG1 3Å; V41-I45 PolarHBondContact O-N 3Å; L42-I45 PolarHBondContact O-N 2.65Å; A43-I45 PolarHBondContact O-N 2.99Å; I45-Q47 PolarHBondContact O-N 3.21Å; I45-R48 WeakPolarHBondContact O-CB 3.44Å; I45-R48 PolarHBondContact O-N 3.34Å; I45-R60 WeakPolarHBondContact O-CD 3.39Å
46L91.3Very high86.8Confident4 Ų460 Ų602%0.02132%0.316CS..Hα-helixtrans-64.7-38.3-178.4-71.5172.2000113.4L30 L42 A43 I80 V108 L111L30-L46 HydrophobicContact CD1-CD2 4.2Å; L30-L46 HydrophobicContact CD1-CG 4.24Å; L30-L46 HydrophobicContact CD2-CD2 4.43Å; L42-L46 HydrophobicContact CD1-CD1 4.06Å; L42-L46 HydrophobicContact CD1-CG 4.48Å; L42-L46 HydrophobicContact CG-CD1 3.97Å; L42-L46 WeakPolarHBondContact O-CB 3.5Å; L42-L46 VanDerWaalsContact O-CG 3.27Å; L42-L46 WeakPolarHBondContact O-CG 3.47Å; L42-L46 PolarHBondContact O-N 3.12Å; A43-L46 PolarHBondContact O-N 3.02Å; L46-I80 HydrophobicContact CD2-CD1 3.32Å; L46-I80 HydrophobicContact CD2-CG1 4.06Å; L46-V108 HydrophobicContact CD1-CG1 4.13Å; L46-L111 HydrophobicContact CD1-CD1 4.23Å; L46-L111 HydrophobicContact CD1-CG 4.29Å
47Q90.6Very high86.6Confident84 Ų8458.8 Ų58.839%0.39330%0.304SS..THydrogen-bonded Turntrans-96.513-176.5-61.1178.9-11.600112.8A43 I45 E49 Y75 E109A43-Q47 WeakPolarHBondContact O-CB 3.35Å; A43-Q47 WeakPolarHBondContact O-CG 3.5Å; A43-Q47 PolarHBondContact O-N 3.15Å; I45-Q47 PolarHBondContact O-N 3.21Å; Q47-E49 PolarHBondContact O-N 3.15Å; Q47-Y75 HydrophobicContact CG-CE1 4.22Å; Q47-E109 PolarHBondContact NE2-O 3Å
48R91.1Very high86.6Confident6 Ų659.4 Ų59.42%0.02330%0.303CS..  trans-68.1125-175.9-175.5175.664.1-138.5-4.7112N3 E19 Y44 I45 I50 L58 R60 K61N3-R48 WeakPolarHBondContact OD1-CD 3.23Å; E19-R48 IonicContact OE1-CZ 3.56Å; E19-R48 IonicContact OE1-NH1 3.12Å; E19-R48 PolarHBondContact OE1-NH1 2.9Å; E19-R48 IonicContact OE1-NH2 3.9Å; E19-R48 PolarHBondContact OE1-NH2 2.96Å; E19-R48 IonicContact OE2-NH2 3.4Å; E19-R48 PolarHBondContact OE2-NH2 3.42Å; Y44-R48 WeakPolarHBondContact O-CB 3.31Å; Y44-R48 PolarHBondContact O-N 2.98Å; I45-R48 WeakPolarHBondContact O-CB 3.44Å; I45-R48 PolarHBondContact O-N 3.34Å; R48-I50 HydrophobicContact CG-CG1 4.08Å; R48-L58 PolarHBondContact NE-O 2.82Å; R48-L58 VanDerWaalsContact NE-O 3.14Å; R48-L58 PolarHBondContact NH2-O 3.45Å; R48-R60 PolarHBondContact O-N 3.27Å; R48-K61 PolarHBondContact O-N 3.03Å
49E88.4Confident86.6Confident62 Ų6253.3 Ų53.329%0.2928%0.277SS..  trans-122.2126.8169.1-171168.8-171.400108.8Q47 T63Q47-E49 PolarHBondContact O-N 3.15Å; E49-T63 PolarHBondContact OE1-OG1 2.9Å
50I86Confident86.6Confident13 Ų1351.8 Ų51.87%0.06727%0.268CS..  trans-114.5121.6176.9-59.1-175.3000108.2I7 R48 E52 C55 L58 S59I7-I50 HydrophobicContact CG1-CD1 4.35Å; R48-I50 HydrophobicContact CG-CG1 4.08Å; I50-E52 HydrophobicContact CG2-CB 4.16Å; I50-C55 HydrophobicContact CG2-CB 4.08Å; I50-L58 HydrophobicContact CD1-CB 3.89Å; I50-L58 HydrophobicContact CD1-CD1 4.44Å; I50-S59 PolarHBondContact N-OG 2.91Å; I50-S59 PolarHBondContact O-OG 3.35Å
51H79.3Confident86.7Confident147 Ų14750.4 Ų50.468%0.68125%0.245SC*.  trans-82.4-20.3-177.6-61-62.7000113.9
52E80.7Confident86.6Confident82 Ų8247.1 Ų47.138%0.38323%0.225SC..  trans-63.8122.4176.6-73.9-177.7-157.200110.6K11 I50 E54 C55 R56K11-E52 IonicContact NZ-OE2 2.79Å; K11-E52 PolarHBondContact NZ-OE2 3.44Å; I50-E52 HydrophobicContact CG2-CB 4.16Å; E52-E54 PolarHBondContact O-N 3.2Å; E52-C55 HydrophobicContact CB-CB 4.35Å; E52-C55 CarbonylContact O-C 3.53Å; E52-C55 PolarHBondContact O-N 3.06Å; E52-C55 VanDerWaalsContact O-N 3.15Å; E52-R56 PolarHBondContact O-N 2.64Å
53P75.3Confident86.3Confident112 Ų11247.6 Ų47.673%0.72723%0.228SC*.G310 helixtrans-63.8-38-172.423.5-32.9000113C55 R56P53-C55 VanDerWaalsContact C-N 3.26Å; P53-C55 PolarHBondContact O-N 2.93Å; P53-R56 WeakPolarHBondContact O-CB 3.48Å; P53-R56 PolarHBondContact O-N 3.38Å
54E77.3Confident85.9Confident144 Ų14447.3 Ų47.367%0.67322%0.223SC*.G310 helixtrans-62.2-34.3177.8-61.7177.6177.900112.2E52 H57E52-E54 PolarHBondContact O-N 3.2Å; E54-H57 PolarHBondContact O-CE1 3.34Å; E54-H57 PolarHBondContact O-ND1 3.5Å; E54-H57 VanDerWaalsContact O-ND1 3.11Å
55C81.4Confident85.5Confident3 Ų343.3 Ų43.32%0.0221%0.208CC..G310 helixtrans-103.88.8-177-67.30000113.1I7 I50 E52 P53 H57 L58I7-C55 HydrophobicContact CG1-CB 4.46Å; I50-C55 HydrophobicContact CG2-CB 4.08Å; E52-C55 HydrophobicContact CB-CB 4.35Å; E52-C55 CarbonylContact O-C 3.53Å; E52-C55 PolarHBondContact O-N 3.06Å; E52-C55 VanDerWaalsContact O-N 3.15Å; P53-C55 VanDerWaalsContact C-N 3.26Å; P53-C55 PolarHBondContact O-N 2.93Å; C55-H57 PolarHBondContact O-N 2.91Å; C55-L58 HydrophobicContact CB-CD1 4.17Å; C55-L58 WeakPolarHBondContact O-CB 3.15Å; C55-L58 PolarHBondContact O-N 3.25Å
56R82.3Confident85Confident83 Ų8344.3 Ų44.331%0.31322%0.216SC..G310 helixtrans-61.4-31.1-176.1-172.4170.9177.2145.13.5112.4E52 P53 L58 S59 F62 G450E52-R56 PolarHBondContact O-N 2.64Å; P53-R56 WeakPolarHBondContact O-CB 3.48Å; P53-R56 PolarHBondContact O-N 3.38Å; R56-L58 PolarHBondContact O-N 3.35Å; R56-L58 VanDerWaalsContact O-N 3.15Å; R56-S59 VanDerWaalsContact O-CB 3.29Å; R56-S59 WeakPolarHBondContact O-CB 3.19Å; R56-S59 PolarHBondContact O-N 3.11Å; R56-S59 PolarHBondContact O-OG 3.11Å; R56-S59 VanDerWaalsContact O-OG 3.12Å; R56-F62 HydrophobicContact CG-CE1 4.4Å; R56-G450 PolarHBondContact NH2-O 3.4Å
57H82.8Confident84.5Confident30 Ų3052.3 Ų52.314%0.13925%0.247CC..G310 helixtrans-59.5-20.3174.170.2-84.3000113.1E54 C55 S59 P425 R432E54-H57 PolarHBondContact O-CE1 3.34Å; E54-H57 PolarHBondContact O-ND1 3.5Å; E54-H57 VanDerWaalsContact O-ND1 3.11Å; C55-H57 PolarHBondContact O-N 2.91Å; H57-S59 VanDerWaalsContact C-N 3.31Å; H57-P425 VanDerWaalsContact CE1-CG 3.49Å; H57-P425 WeakPolarHBondContact CE1-CG 3.29Å; H57-R432 PolarHBondContact O-NH1 2.94Å; H57-R432 PolarHBondContact O-NH2 3.29Å
58L86.6Confident84.1Confident30 Ų3049.9 Ų49.916%0.15725%0.245CC..G310 helixtrans-82-9.4176.2-59.6172.7000113.2L6 A10 R48 I50 C55 R56L6-L58 HydrophobicContact CB-CD1 4.39Å; A10-L58 HydrophobicContact CB-CD1 3.84Å; R48-L58 PolarHBondContact NE-O 2.82Å; R48-L58 VanDerWaalsContact NE-O 3.14Å; R48-L58 PolarHBondContact NH2-O 3.45Å; I50-L58 HydrophobicContact CD1-CB 3.89Å; I50-L58 HydrophobicContact CD1-CD1 4.44Å; C55-L58 HydrophobicContact CB-CD1 4.17Å; C55-L58 WeakPolarHBondContact O-CB 3.15Å; C55-L58 PolarHBondContact O-N 3.25Å; R56-L58 PolarHBondContact O-N 3.35Å; R56-L58 VanDerWaalsContact O-N 3.15Å
59S89Confident83.8Confident2 Ų250.9 Ų50.91%0.01425%0.252CS..  trans-67.7149.4178.5-55.70000110.9I50 R56 H57 F62I50-S59 PolarHBondContact N-OG 2.91Å; I50-S59 PolarHBondContact O-OG 3.35Å; R56-S59 VanDerWaalsContact O-CB 3.29Å; R56-S59 WeakPolarHBondContact O-CB 3.19Å; R56-S59 PolarHBondContact O-N 3.11Å; R56-S59 PolarHBondContact O-OG 3.11Å; R56-S59 VanDerWaalsContact O-OG 3.12Å; H57-S59 VanDerWaalsContact C-N 3.31Å; S59-F62 VanDerWaalsContact O-CE2 3.24Å; S59-F62 WeakPolarHBondContact O-CE2 3.28Å; S59-F62 WeakPolarHBondContact O-CZ 3.24Å
60R90.1Very high83.6Confident15 Ų1550.2 Ų50.26%0.05725%0.252CS..SBendtrans-114.7-26.1175.4-75.7178.1173.4-108.74.1112E19 I45 R48 Y75 D76 S78E19-R60 IonicContact OE2-CZ 3.17Å; E19-R60 IonicContact OE2-NE 3.82Å; E19-R60 PolarHBondContact OE2-NE 2.88Å; E19-R60 IonicContact OE2-NH2 2.8Å; E19-R60 PolarHBondContact OE2-NH2 2.79Å; I45-R60 WeakPolarHBondContact O-CD 3.39Å; R48-R60 PolarHBondContact O-N 3.27Å; R60-Y75 CarbonylContact O-C 3.54Å; R60-Y75 WeakPolarHBondContact O-CA 3.4Å; R60-D76 HydrophobicContact CB-CB 4.4Å; R60-D76 HydrophobicContact CG-CB 4.41Å; R60-D76 PolarHBondContact O-N 2.97Å; R60-S78 PolarHBondContact NH1-O 2.85Å
61K91.1Very high83.5Confident29 Ų2950.2 Ų50.213%0.12625%0.252CS..EExtended strand (participates in β ladder)trans-101.7132167.7-179.2172.8176.9146.10108.7R48 S73 L74 Y75 E439R48-K61 PolarHBondContact O-N 3.03Å; K61-S73 WeakPolarHBondContact CE-OG 3.15Å; K61-S73 PolarHBondContact NZ-OG 2.89Å; K61-L74 CarbonylContact C-O 3.49Å; K61-L74 WeakPolarHBondContact CA-O 3.23Å; K61-Y75 HydrophobicContact CB-CD1 4.37Å; K61-Y75 HydrophobicContact CB-CE1 4.1Å; K61-Y75 HydrophobicContact CD-CE1 4.05Å; K61-Y75 HydrophobicContact CG-CE1 4.11Å; K61-Y75 PolarHBondContact NZ-OH 2.81Å; K61-Y75 VanDerWaalsContact NZ-OH 3.11Å; K61-E439 IonicContact NZ-OE1 3.79Å; K61-E439 PolarHBondContact NZ-OE1 3.41Å; K61-E439 IonicContact NZ-OE2 2.58Å; K61-E439 PolarHBondContact NZ-OE2 3.37Å
62F88.3Confident83.9Confident5 Ų543.2 Ų43.22%0.02222%0.219CC..EExtended strand (participates in β ladder)trans-130.6132.5175-58.4-89.7000109.8R56 S59 E64 S73 L74 V421 I452R56-F62 HydrophobicContact CG-CE1 4.4Å; S59-F62 VanDerWaalsContact O-CE2 3.24Å; S59-F62 WeakPolarHBondContact O-CE2 3.28Å; S59-F62 WeakPolarHBondContact O-CZ 3.24Å; F62-E64 PolarHBondContact O-N 2.83Å; F62-S73 CarbonylContact O-C 3.59Å; F62-S73 WeakPolarHBondContact O-CA 3.31Å; F62-L74 HydrophobicContact CB-CB 4.31Å; F62-L74 PolarHBondContact N-O 3.44Å; F62-L74 PolarHBondContact O-N 3.31Å; F62-V421 HydrophobicContact CB-CG1 4.32Å; F62-V421 HydrophobicContact CD1-CG1 3.32Å; F62-V421 HydrophobicContact CD2-CG1 3.53Å; F62-V421 HydrophobicContact CE1-CG1 3.26Å; F62-V421 HydrophobicContact CE2-CG1 3.5Å; F62-V421 HydrophobicContact CG-CG1 3.44Å; F62-V421 VanDerWaalsContact CG-CG1 3.44Å; F62-V421 HydrophobicContact CZ-CB 4.44Å; F62-V421 HydrophobicContact CZ-CG1 3.35Å; F62-I452 HydrophobicContact CB-CD1 3.61Å; F62-I452 HydrophobicContact CG-CD1 4.36Å
63T86.2Confident84.4Confident9 Ų939.4 Ų39.46%0.05520%0.202CC..EExtended strand (participates in β ladder)trans-80.9110.917544.30000109.4E49 G450 I452E49-T63 PolarHBondContact OE1-OG1 2.9Å; T63-G450 VanDerWaalsContact OG1-C 3.32Å; T63-G450 PolarHBondContact OG1-O 3.46Å; T63-I452 WeakPolarHBondContact O-CG1 3.32Å; T63-I452 PolarHBondContact O-N 2.9Å
64E83.2Confident85.1Confident12 Ų1234.3 Ų34.36%0.05617%0.169CC..EExtended strand (participates in β ladder)trans-73.4-57.2-179.6-169.5178.9-164.800110.2F62 S72 L74 R436 I452 N453F62-E64 PolarHBondContact O-N 2.83Å; E64-S72 PolarHBondContact N-O 3.19Å; E64-S72 PolarHBondContact OE2-OG 3.28Å; E64-L74 HydrophobicContact CB-CD1 3.91Å; E64-L74 HydrophobicContact CB-CG 4.02Å; E64-L74 HydrophobicContact CG-CD1 3.99Å; E64-L74 HydrophobicContact CG-CG 4.48Å; E64-R436 VanDerWaalsContact CD-NH2 3.28Å; E64-R436 IonicContact OE1-CZ 2.88Å; E64-R436 IonicContact OE1-NE 3.06Å; E64-R436 IonicContact OE1-NH2 2.67Å; E64-R436 PolarHBondContact OE1-NH2 3.04Å; E64-R436 IonicContact OE2-CZ 3.79Å; E64-R436 IonicContact OE2-NE 3.87Å; E64-R436 PolarHBondContact OE2-NE 3.12Å; E64-R436 IonicContact OE2-NH2 3.11Å; E64-R436 PolarHBondContact OE2-NH2 3.25Å; E64-R436 VanDerWaalsContact OE2-NH2 3.11Å; E64-I452 PolarHBondContact O-N 3.09Å; E64-N453 WeakPolarHBondContact O-CA 3.32Å; E64-N453 PolarHBondContact O-N 3.27Å; E64-N453 VanDerWaalsContact O-O 3.11Å
65W82.9Confident85.8Confident35 Ų3527.6 Ų27.613%0.13314%0.137CC..EExtended strand (participates in β ladder)trans-148.5155.2175.854.9-97.7000109.3V70 S72 N453 P456W65-V70 HydrophobicContact CH2-CG1 3.76Å; W65-V70 HydrophobicContact CZ3-CB 4.3Å; W65-V70 HydrophobicContact CZ3-CG1 3.81Å; W65-S72 PolarHBondContact O-N 3.28Å; W65-N453 WeakPolarHBondContact CA-O 3.32Å; W65-N453 VanDerWaalsContact CB-O 3.32Å; W65-N453 WeakPolarHBondContact CB-O 3.47Å; W65-P456 HydrophobicContact CD2-CB 4.01Å; W65-P456 HydrophobicContact CE3-CB 4.31Å; W65-P456 HydrophobicContact CG-CB 4.4Å; W65-P456 HydrophobicContact CZ2-CB 4.33Å
66A81.3Confident86.3Confident23 Ų2327.8 Ų27.819%0.1914%0.138CC..EExtended strand (participates in β ladder)trans-137120.9177.900000109.1H71 N448 I451A66-H71 WeakPolarHBondContact CB-ND1 3.17Å; A66-N448 HydrophobicContact CB-CB 4.11Å; A66-N448 VanDerWaalsContact CB-ND2 3.31Å; A66-N448 WeakPolarHBondContact CB-ND2 3.3Å; A66-I451 HydrophobicContact CB-CD1 4.46Å
67Y81.6Confident86.6Confident172 Ų17223.8 Ų23.868%0.67512%0.123SC*.EExtended strand (participates in β ladder)trans-124.297.5176.5-169-94.4000110V70Y67-V70 PolarHBondContact N-O 3.02Å; Y67-V70 PolarHBondContact O-N 3.42Å
68G82.3Confident86.7Confident33 Ų3324.2 Ų24.234%0.3413%0.129SC..THydrogen-bonded Turntrans55.1-123.1-174.700000110.7V70 H71G68-V70 VanDerWaalsContact C-N 3.29Å; G68-V70 PolarHBondContact O-N 3.32Å; G68-H71 PolarHBondContact O-CE1 3.31Å
69P83.9Confident86.5Confident28 Ų2824 Ų2418%0.18213%0.13CC..THydrogen-bonded Turntrans-77.6-8-179.933.3-36.3000114.3V440 N441 W442 W445P69-V440 CarbonylContact O-C 3.59Å; P69-V440 WeakPolarHBondContact O-CA 3.29Å; P69-N441 WeakPolarHBondContact CA-O 3.39Å; P69-N441 WeakPolarHBondContact CB-O 3.43Å; P69-N441 PolarHBondContact O-N 2.89Å; P69-W442 HydrophobicContact CB-CD2 4.02Å; P69-W442 HydrophobicContact CB-CE3 3.83Å; P69-W442 HydrophobicContact CB-CZ3 4.15Å; P69-W442 HydrophobicContact CG-CD2 4.38Å; P69-W442 HydrophobicContact CG-CE3 3.92Å; P69-W442 HydrophobicContact CG-CH2 3.92Å; P69-W442 HydrophobicContact CG-CZ2 4.37Å; P69-W442 HydrophobicContact CG-CZ3 3.69Å; P69-W445 HydrophobicContact CB-CB 4.5Å
70V84Confident86.3Confident48 Ų4823.9 Ų23.929%0.29113%0.129SC..EExtended strand (participates in β ladder)trans-98.7126-178.4-172.80000109.3W65 Y67 G68 V440W65-V70 HydrophobicContact CH2-CG1 3.76Å; W65-V70 HydrophobicContact CZ3-CB 4.3Å; W65-V70 HydrophobicContact CZ3-CG1 3.81Å; Y67-V70 PolarHBondContact N-O 3.02Å; Y67-V70 PolarHBondContact O-N 3.42Å; G68-V70 VanDerWaalsContact C-N 3.29Å; G68-V70 PolarHBondContact O-N 3.32Å; V70-V440 HydrophobicContact CG2-CG2 4.32Å
71H84.6Confident85.9Confident12 Ų1223.2 Ų23.26%0.05613%0.127CC..EExtended strand (participates in β ladder)trans-131132.5-180-49.3-50.6000110.2A66 G68 E439 N448A66-H71 WeakPolarHBondContact CB-ND1 3.17Å; G68-H71 PolarHBondContact O-CE1 3.31Å; H71-E439 PolarHBondContact N-O 3.33Å; H71-E439 PolarHBondContact O-N 3.22Å; H71-N448 PolarHBondContact CE1-ND2 3.47Å; H71-N448 PolarHBondContact ND1-ND2 3.34Å; H71-N448 PolarHBondContact NE2-ND2 3.47Å
72S87.5Confident85.2Confident0 Ų022 Ų220%012%0.122CC..EExtended strand (participates in β ladder)trans-95.7121.4168.9172.10000109.1E64 W65 R436E64-S72 PolarHBondContact N-O 3.19Å; E64-S72 PolarHBondContact OE2-OG 3.28Å; W65-S72 PolarHBondContact O-N 3.28Å; S72-R436 WeakPolarHBondContact OG-CD 3.39Å; S72-R436 VanDerWaalsContact OG-CG 3.23Å; S72-R436 WeakPolarHBondContact OG-CG 3.36Å
73S89.9Confident84.4Confident2 Ų224.1 Ų24.11%0.01414%0.137CC..EExtended strand (participates in β ladder)trans-111.5133.1176.7-63.30000110.7K61 F62 R436 V437K61-S73 WeakPolarHBondContact CE-OG 3.15Å; K61-S73 PolarHBondContact NZ-OG 2.89Å; F62-S73 CarbonylContact O-C 3.59Å; F62-S73 WeakPolarHBondContact O-CA 3.31Å; S73-R436 CarbonylContact O-C 3.6Å; S73-V437 PolarHBondContact N-O 3.06Å; S73-V437 PolarHBondContact O-N 3.14Å
74L91Very high84Confident6 Ų626.8 Ų26.83%0.03115%0.149CC..EExtended strand (participates in β ladder)trans-98.6123.4173.5-68.1169.6000109.5K61 F62 E64 L419 C434 R436 I452K61-L74 CarbonylContact C-O 3.49Å; K61-L74 WeakPolarHBondContact CA-O 3.23Å; F62-L74 HydrophobicContact CB-CB 4.31Å; F62-L74 PolarHBondContact N-O 3.44Å; F62-L74 PolarHBondContact O-N 3.31Å; E64-L74 HydrophobicContact CB-CD1 3.91Å; E64-L74 HydrophobicContact CB-CG 4.02Å; E64-L74 HydrophobicContact CG-CD1 3.99Å; E64-L74 HydrophobicContact CG-CG 4.48Å; L74-L419 HydrophobicContact CD1-CD1 3.74Å; L74-L419 HydrophobicContact CD2-CD1 3.63Å; L74-L419 HydrophobicContact CG-CD1 4.34Å; L74-C434 HydrophobicContact CB-CB 4.13Å; L74-C434 HydrophobicContact CD2-CB 4.12Å; L74-R436 HydrophobicContact CD2-CB 3.88Å; L74-R436 HydrophobicContact CD2-CG 4.25Å; L74-I452 HydrophobicContact CD1-CD1 4.36Å
75Y92.1Very high83.4Confident2 Ų235.7 Ų35.71%0.00819%0.187CC..EExtended strand (participates in β ladder)trans-106.8128.7177-73.6-88.5000111.3Q47 R60 K61 L77 P110 C434 F435 V437 E439Q47-Y75 HydrophobicContact CG-CE1 4.22Å; R60-Y75 CarbonylContact O-C 3.54Å; R60-Y75 WeakPolarHBondContact O-CA 3.4Å; K61-Y75 HydrophobicContact CB-CD1 4.37Å; K61-Y75 HydrophobicContact CB-CE1 4.1Å; K61-Y75 HydrophobicContact CD-CE1 4.05Å; K61-Y75 HydrophobicContact CG-CE1 4.11Å; K61-Y75 PolarHBondContact NZ-OH 2.81Å; K61-Y75 VanDerWaalsContact NZ-OH 3.11Å; Y75-L77 PolarHBondContact O-N 2.95Å; Y75-P110 HydrophobicContact CD1-CB 3.99Å; Y75-P110 HydrophobicContact CD1-CG 3.86Å; Y75-P110 HydrophobicContact CD2-CB 3.98Å; Y75-P110 HydrophobicContact CG-CB 3.65Å; Y75-P110 HydrophobicContact CG-CG 3.91Å; Y75-C434 CarbonylContact O-C 3.6Å; Y75-C434 VanDerWaalsContact O-CA 3.23Å; Y75-C434 WeakPolarHBondContact O-CA 3.42Å; Y75-F435 PolarHBondContact N-O 3.49Å; Y75-F435 PolarHBondContact O-N 3.32Å; Y75-V437 HydrophobicContact CD2-CB 4.08Å; Y75-V437 HydrophobicContact CD2-CG2 3.67Å; Y75-V437 HydrophobicContact CE2-CB 3.94Å; Y75-V437 HydrophobicContact CE2-CG2 3.91Å; Y75-E439 PolarHBondContact OH-OE1 2.97Å
76D91.1Very high83Confident7 Ų737.9 Ų37.94%0.03720%0.201CC..EExtended strand (participates in β ladder)trans-67.1124.3173.6-171.8-1.5000111.2R60 S78 I80 R432R60-D76 HydrophobicContact CB-CB 4.4Å; R60-D76 HydrophobicContact CG-CB 4.41Å; R60-D76 PolarHBondContact O-N 2.97Å; D76-S78 VanDerWaalsContact OD1-CB 3.28Å; D76-S78 WeakPolarHBondContact OD1-CB 3.36Å; D76-S78 PolarHBondContact OD1-N 3.33Å; D76-S78 PolarHBondContact OD1-OG 3.01Å; D76-I80 VanDerWaalsContact O-CD1 3.29Å; D76-I80 WeakPolarHBondContact O-CD1 3.38Å; D76-R432 VanDerWaalsContact OD2-CD 3.32Å; D76-R432 WeakPolarHBondContact OD2-CD 3.39Å; D76-R432 IonicContact OD2-CZ 3.15Å; D76-R432 IonicContact OD2-NE 3.48Å; D76-R432 IonicContact OD2-NH1 2.69Å; D76-R432 PolarHBondContact OD2-NH1 2.87Å
77L88.6Confident83.2Confident0 Ų036.9 Ų36.90%019%0.193CC..  trans-88.7-0.1-180-67.4179.5000114Y75 C79 I80 D81 L114 S415 W433 F435Y75-L77 PolarHBondContact O-N 2.95Å; L77-C79 PolarHBondContact O-N 3.34Å; L77-I80 WeakPolarHBondContact O-CB 3.25Å; L77-I80 PolarHBondContact O-N 3.44Å; L77-D81 PolarHBondContact O-N 2.96Å; L77-L114 HydrophobicContact CD1-CD1 4.48Å; L77-L114 HydrophobicContact CD2-CD1 4.05Å; L77-L114 HydrophobicContact CD2-CD2 3.8Å; L77-S415 WeakPolarHBondContact CD1-O 3.29Å; L77-W433 WeakPolarHBondContact CB-O 3.39Å; L77-W433 PolarHBondContact N-O 2.91Å; L77-F435 HydrophobicContact CD1-CB 3.99Å; L77-F435 HydrophobicContact CD2-CB 3.79Å; L77-F435 HydrophobicContact CG-CB 3.91Å
78S85.9Confident83.4Confident38 Ų3828.7 Ų28.727%0.26616%0.161SC..THydrogen-bonded Turntrans-58.4129.4179.6-55.40000111.3R60 D76 I80R60-S78 PolarHBondContact NH1-O 2.85Å; D76-S78 VanDerWaalsContact OD1-CB 3.28Å; D76-S78 WeakPolarHBondContact OD1-CB 3.36Å; D76-S78 PolarHBondContact OD1-N 3.33Å; D76-S78 PolarHBondContact OD1-OG 3.01Å; S78-I80 PolarHBondContact O-N 3.49Å
79C81.1Confident83.6Confident26 Ų2627.1 Ų27.118%0.17615%0.145CC..THydrogen-bonded Turntrans66.9-1.5-172.8-50.30000116.4L30 L77 E84 S87 V88L30-C79 HydrophobicContact CD2-CB 4.36Å; L77-C79 PolarHBondContact O-N 3.34Å; C79-E84 WeakPolarHBondContact CA-OE2 3.45Å; C79-E84 PolarHBondContact N-OE1 3.29Å; C79-E84 PolarHBondContact N-OE2 2.79Å; C79-S87 WeakPolarHBondContact O-CA 3.35Å; C79-V88 VanDerWaalsContact O-CG2 3.31Å; C79-V88 WeakPolarHBondContact O-CG2 3.4Å; C79-V88 PolarHBondContact O-N 2.74Å
80I85.3Confident83.7Confident0 Ų027.1 Ų27.10%014%0.142CC..THydrogen-bonded Turntrans-95.8-44.7-178-58174.7000111.8L30 L46 D76 L77 S78 L89 P110 L111 L114L30-I80 HydrophobicContact CD2-CG1 4.27Å; L46-I80 HydrophobicContact CD2-CD1 3.32Å; L46-I80 HydrophobicContact CD2-CG1 4.06Å; D76-I80 VanDerWaalsContact O-CD1 3.29Å; D76-I80 WeakPolarHBondContact O-CD1 3.38Å; L77-I80 WeakPolarHBondContact O-CB 3.25Å; L77-I80 PolarHBondContact O-N 3.44Å; S78-I80 PolarHBondContact O-N 3.49Å; I80-L89 HydrophobicContact CG2-CD1 4.46Å; I80-L89 HydrophobicContact CG2-CG 4.31Å; I80-L89 WeakPolarHBondContact O-CG 3.49Å; I80-P110 HydrophobicContact CD1-CG 4.39Å; I80-L111 HydrophobicContact CG2-CD2 3.42Å; I80-L111 VanDerWaalsContact CG2-CD2 3.42Å; I80-L114 HydrophobicContact CG2-CD2 4.06Å
81D81.9Confident83.7Confident1 Ų125.5 Ų25.51%0.00513%0.132CC..SBendtrans-80.2153.4-171.2-169.532.4000113.6L77 C83 E84 S87 K118 R414L77-D81 PolarHBondContact O-N 2.96Å; D81-C83 PolarHBondContact O-N 3Å; D81-C83 PolarHBondContact OD2-SG 3.44Å; D81-C83 VanDerWaalsContact OD2-SG 3.41Å; D81-E84 PolarHBondContact O-N 3.16Å; D81-S87 WeakPolarHBondContact O-CB 3.08Å; D81-K118 WeakPolarHBondContact OD1-CE 3.36Å; D81-K118 IonicContact OD1-NZ 3.51Å; D81-K118 PolarHBondContact OD1-NZ 2.7Å; D81-R414 IonicContact OD2-NE 2.97Å
82T75.9Confident83.8Confident3 Ų325 Ų252%0.01813%0.13CC..THydrogen-bonded Turntrans-70.4-1.4-175.254.90000115.2E90 L399 E402 R410T82-E90 HydrophobicContact CG2-CG 4.47Å; T82-L399 HydrophobicContact CG2-CD2 3.15Å; T82-E402 VanDerWaalsContact CB-OE2 3.3Å; T82-E402 WeakPolarHBondContact CB-OE2 3.43Å; T82-E402 WeakPolarHBondContact CG2-OE2 3.26Å; T82-E402 PolarHBondContact OG1-OE2 3.12Å; T82-R410 PolarHBondContact O-NH1 3.5Å
83C73.1Confident83.3Confident50 Ų5025.4 Ų25.434%0.33813%0.133SC..THydrogen-bonded Turntrans-70.3-25.9170.9-66.60000111.8D81D81-C83 PolarHBondContact O-N 3Å; D81-C83 PolarHBondContact OD2-SG 3.44Å; D81-C83 VanDerWaalsContact OD2-SG 3.41Å
84E75.8Confident82.7Confident65 Ų6528.1 Ų28.130%0.30414%0.144SC..SBendtrans-96.1148.9-179.8-66.4177.7-148.700111.6C79 D81C79-E84 WeakPolarHBondContact CA-OE2 3.45Å; C79-E84 PolarHBondContact N-OE1 3.29Å; C79-E84 PolarHBondContact N-OE2 2.79Å; D81-E84 PolarHBondContact O-N 3.16Å
85K71.2Confident81.5Confident199 Ų19929.1 Ų29.187%0.86515%0.151SC*.THydrogen-bonded Turntrans-72.9138.2175.2-65.1-179.4-179176.70109.3S87K85-S87 VanDerWaalsContact C-N 3.29Å; K85-S87 PolarHBondContact O-N 3.4Å
86N75.5Confident79.7Confident81 Ų8131.8 Ų31.843%0.43317%0.17SC..THydrogen-bonded Turntrans58.738.4-177.2-60.3-14.3000113.2G26G26-N86 PolarHBondContact O-ND2 3.21Å
87S84.8Confident77.9Confident1 Ų134.1 Ų34.11%0.00719%0.187CC..  trans-58.8151.6177.467.50000111.9C79 D81 K85 L89 E90 V91C79-S87 WeakPolarHBondContact O-CA 3.35Å; D81-S87 WeakPolarHBondContact O-CB 3.08Å; K85-S87 VanDerWaalsContact C-N 3.29Å; K85-S87 PolarHBondContact O-N 3.4Å; S87-L89 PolarHBondContact O-N 2.95Å; S87-E90 PolarHBondContact O-N 2.78Å; S87-E90 WeakPolarHBondContact OG-CB 3.3Å; S87-E90 VanDerWaalsContact OG-CG 3.22Å; S87-E90 WeakPolarHBondContact OG-CG 3.27Å; S87-E90 PolarHBondContact OG-N 3.47Å; S87-V91 WeakPolarHBondContact O-CG2 3.27Å; S87-V91 PolarHBondContact O-N 3.06Å
88V86.5Confident76.4Confident0 Ų041.7 Ų41.70%022%0.222CC..Hα-helixtrans-55.5-39.7178.4171.50000111.6L30 A34 L42 C79 V91 I92L30-V88 HydrophobicContact CB-CG2 4.45Å; L30-V88 HydrophobicContact CD2-CG2 3.57Å; L30-V88 HydrophobicContact CG-CG2 3.56Å; A34-V88 HydrophobicContact CB-CG1 4Å; L42-V88 HydrophobicContact CD1-CG1 4.26Å; C79-V88 VanDerWaalsContact O-CG2 3.31Å; C79-V88 WeakPolarHBondContact O-CG2 3.4Å; C79-V88 PolarHBondContact O-N 2.74Å; V88-V91 PolarHBondContact O-N 3.38Å; V88-I92 HydrophobicContact CG1-CD1 3.59Å; V88-I92 HydrophobicContact CG1-CG1 4.22Å; V88-I92 VanDerWaalsContact O-CG1 3.25Å; V88-I92 WeakPolarHBondContact O-CG1 3.43Å; V88-I92 PolarHBondContact O-N 3.4Å
89L86.7Confident75.4Confident1 Ų140.9 Ų40.91%0.00522%0.216CC..Hα-helixtrans-63.8-43.5176.8-75.2172.7000112.4I80 S87 V91 I92 A93 L106 L111 L114 L115 L399I80-L89 HydrophobicContact CG2-CD1 4.46Å; I80-L89 HydrophobicContact CG2-CG 4.31Å; I80-L89 WeakPolarHBondContact O-CG 3.49Å; S87-L89 PolarHBondContact O-N 2.95Å; L89-V91 VanDerWaalsContact C-N 3.35Å; L89-I92 PolarHBondContact O-N 3.42Å; L89-A93 WeakPolarHBondContact O-CB 3.38Å; L89-A93 PolarHBondContact O-N 2.87Å; L89-L106 HydrophobicContact CD2-CD2 4.22Å; L89-L111 HydrophobicContact CD2-CD2 3.92Å; L89-L111 HydrophobicContact CG-CD2 4.3Å; L89-L114 HydrophobicContact CD1-CD2 4.07Å; L89-L115 HydrophobicContact CD2-CD1 4.24Å; L89-L115 HydrophobicContact CD2-CD2 4.2Å; L89-L115 HydrophobicContact CD2-CG 4.28Å; L89-L399 HydrophobicContact CB-CD1 4.35Å; L89-L399 HydrophobicContact CB-CD2 3.98Å; L89-L399 HydrophobicContact CD1-CD2 4.49Å; L89-L399 WeakPolarHBondContact O-CD1 3.41Å
90E84.6Confident74.6Confident27 Ų2744.3 Ų44.313%0.12624%0.237CC..Hα-helixtrans-64.6-41.3174.9-72.5-176.8158.600111.3T82 S87 A93 Y94 K403T82-E90 HydrophobicContact CG2-CG 4.47Å; S87-E90 PolarHBondContact O-N 2.78Å; S87-E90 WeakPolarHBondContact OG-CB 3.3Å; S87-E90 VanDerWaalsContact OG-CG 3.22Å; S87-E90 WeakPolarHBondContact OG-CG 3.27Å; S87-E90 PolarHBondContact OG-N 3.47Å; E90-A93 PolarHBondContact O-N 3.44Å; E90-Y94 HydrophobicContact CB-CD2 3.97Å; E90-Y94 HydrophobicContact CB-CE2 4.1Å; E90-Y94 HydrophobicContact CG-CD2 4.43Å; E90-Y94 HydrophobicContact CG-CE2 4.06Å; E90-Y94 VanDerWaalsContact O-CB 3.3Å; E90-Y94 WeakPolarHBondContact O-CB 3.38Å; E90-Y94 WeakPolarHBondContact O-CD2 3.43Å; E90-Y94 PolarHBondContact O-N 2.89Å; E90-K403 WeakPolarHBondContact OE1-CE 3.29Å; E90-K403 IonicContact OE1-NZ 3.9Å; E90-K403 PolarHBondContact OE1-NZ 3.34Å
91V85Confident74.3Confident14 Ų1447.9 Ų47.99%0.08526%0.257CS..Hα-helixtrans-64.3-45.6177.4174.30000110.3L27 A31 A34 S87 V88 L89 A93 Y94 S95L27-V91 HydrophobicContact CD2-CG2 4.22Å; A31-V91 HydrophobicContact CB-CG2 4.46Å; A34-V91 HydrophobicContact CB-CG1 4.15Å; S87-V91 WeakPolarHBondContact O-CG2 3.27Å; S87-V91 PolarHBondContact O-N 3.06Å; V88-V91 PolarHBondContact O-N 3.38Å; L89-V91 VanDerWaalsContact C-N 3.35Å; V91-A93 VanDerWaalsContact C-N 3.34Å; V91-A93 PolarHBondContact O-N 2.86Å; V91-Y94 PolarHBondContact O-N 3.46Å; V91-S95 WeakPolarHBondContact CG1-OG 3.22Å; V91-S95 WeakPolarHBondContact O-CA 3.36Å; V91-S95 WeakPolarHBondContact O-CB 3.21Å; V91-S95 PolarHBondContact O-N 2.7Å; V91-S95 PolarHBondContact O-OG 3.05Å
92I85.5Confident74.2Confident3 Ų348.5 Ų48.52%0.01526%0.259CS..Hα-helixtrans-67-36.7178.4-64.6168.4000111.6A34 L42 V88 L89 R102 M105 L106 L111A34-I92 HydrophobicContact CB-CD1 4.21Å; A34-I92 HydrophobicContact CB-CG1 3.74Å; L42-I92 HydrophobicContact CD2-CD1 4.1Å; V88-I92 HydrophobicContact CG1-CD1 3.59Å; V88-I92 HydrophobicContact CG1-CG1 4.22Å; V88-I92 VanDerWaalsContact O-CG1 3.25Å; V88-I92 WeakPolarHBondContact O-CG1 3.43Å; V88-I92 PolarHBondContact O-N 3.4Å; L89-I92 PolarHBondContact O-N 3.42Å; I92-R102 PolarHBondContact O-NE 2.86Å; I92-M105 HydrophobicContact CD1-CB 4.29Å; I92-M105 HydrophobicContact CG1-SD 4.31Å; I92-M105 HydrophobicContact CG2-CB 4.32Å; I92-M105 HydrophobicContact CG2-SD 4.47Å; I92-L106 HydrophobicContact CB-CD2 4.31Å; I92-L106 HydrophobicContact CD1-CD2 4.34Å; I92-L106 HydrophobicContact CG2-CD1 4.47Å; I92-L106 HydrophobicContact CG2-CD2 3.68Å; I92-L106 HydrophobicContact CG2-CG 3.84Å; I92-L111 HydrophobicContact CD1-CD1 3.83Å
93A78.6Confident74.6Confident7 Ų749.9 Ų49.96%0.05827%0.265CS..Hα-helixtrans-75.1-31.7-179.200000113.5L89 E90 V91 R102 I396 L399L89-A93 WeakPolarHBondContact O-CB 3.38Å; L89-A93 PolarHBondContact O-N 2.87Å; E90-A93 PolarHBondContact O-N 3.44Å; V91-A93 VanDerWaalsContact C-N 3.34Å; V91-A93 PolarHBondContact O-N 2.86Å; A93-R102 PolarHBondContact O-NH2 2.99Å; A93-I396 HydrophobicContact CB-CG1 4.17Å; A93-L399 HydrophobicContact CB-CD1 3.27Å
94Y76.2Confident75.1Confident60 Ų6049.9 Ų49.924%0.23526%0.262CS..Hα-helixtrans-120-9-171.4-50.5-47.4000115E90 V91 S96 L399 D400 K403E90-Y94 HydrophobicContact CB-CD2 3.97Å; E90-Y94 HydrophobicContact CB-CE2 4.1Å; E90-Y94 HydrophobicContact CG-CD2 4.43Å; E90-Y94 HydrophobicContact CG-CE2 4.06Å; E90-Y94 VanDerWaalsContact O-CB 3.3Å; E90-Y94 WeakPolarHBondContact O-CB 3.38Å; E90-Y94 WeakPolarHBondContact O-CD2 3.43Å; E90-Y94 PolarHBondContact O-N 2.89Å; V91-Y94 PolarHBondContact O-N 3.46Å; Y94-S96 PolarHBondContact O-N 2.69Å; Y94-L399 WeakPolarHBondContact OH-CB 3.35Å; Y94-D400 PolarHBondContact OH-OD1 3.31Å; Y94-K403 HydrophobicContact CE2-CD 4.4Å
95S66.2Low75.6Confident26 Ų2646.9 Ų46.918%0.18225%0.248CC..SBendtrans-59.3134.8169.7-66.40000108.6V91V91-S95 WeakPolarHBondContact CG1-OG 3.22Å; V91-S95 WeakPolarHBondContact O-CA 3.36Å; V91-S95 WeakPolarHBondContact O-CB 3.21Å; V91-S95 PolarHBondContact O-N 2.7Å; V91-S95 PolarHBondContact O-OG 3.05Å
96S55.1Low76.3Confident58 Ų5837.7 Ų37.741%0.40621%0.208SC..  trans-42.8153.8-173.839.50000113.6Y94 E98Y94-S96 PolarHBondContact O-N 2.69Å; S96-E98 PolarHBondContact O-N 2.96Å; S96-E98 PolarHBondContact OG-OE2 3.35Å
97S52.3Low76.8Confident57 Ų5736.3 Ų36.340%0.39920%0.2SC..THydrogen-bonded Turntrans-55.115173.460.50000115.8
98E56.8Low77Confident159 Ų15937.1 Ų37.174%0.74321%0.205SC*.THydrogen-bonded Turntrans-85.5-15.7179.5-68.1177.8160.200112.4S96 P100S96-E98 PolarHBondContact O-N 2.96Å; S96-E98 PolarHBondContact OG-OE2 3.35Å; E98-P100 WeakPolarHBondContact O-CD 3.43Å
99T64.3Low77.1Confident21 Ų2139.7 Ų39.713%0.12922%0.217CC..  trans-106102.6179.1560000111.8N101T99-N101 VanDerWaalsContact C-N 3.28Å; T99-N101 PolarHBondContact O-N 3.42Å
100P65.5Low77.2Confident97 Ų9739.7 Ų39.763%0.6322%0.217SC*.THydrogen-bonded Turntrans-64.4-31.4-177.522.5-31.3000113E98 R102 H103E98-P100 WeakPolarHBondContact O-CD 3.43Å; P100-R102 VanDerWaalsContact C-N 3.33Å; P100-R102 PolarHBondContact O-N 2.96Å; P100-H103 PolarHBondContact O-CE1 3.3Å; P100-H103 PolarHBondContact O-ND1 2.92Å; P100-H103 VanDerWaalsContact O-ND1 3.13Å
101N79.3Confident77.5Confident76 Ų7638.4 Ų38.441%0.40621%0.211SC..THydrogen-bonded Turntrans-90.916.6-170.3-54.2-6.7000114.2I39 T99 H103 D104 M105I39-N101 HydrophobicContact CD1-CB 3.8Å; T99-N101 VanDerWaalsContact C-N 3.28Å; T99-N101 PolarHBondContact O-N 3.42Å; N101-H103 VanDerWaalsContact C-N 3.27Å; N101-H103 PolarHBondContact O-N 3.46Å; N101-D104 PolarHBondContact O-N 3.25Å; N101-M105 PolarHBondContact O-N 3.5Å
102R79.9Confident77.8Confident14 Ų1439.6 Ų39.65%0.05322%0.217CC..Hα-helixtrans-62.9-30.4-177.560.8180-78.8-162.1-7.8114.1I92 A93 P100 D104 M105 D202 L392I92-R102 PolarHBondContact O-NE 2.86Å; A93-R102 PolarHBondContact O-NH2 2.99Å; P100-R102 VanDerWaalsContact C-N 3.33Å; P100-R102 PolarHBondContact O-N 2.96Å; R102-D104 VanDerWaalsContact C-N 3.28Å; R102-D104 PolarHBondContact O-N 3.44Å; R102-M105 WeakPolarHBondContact O-CB 3.13Å; R102-M105 PolarHBondContact O-N 2.57Å; R102-D202 IonicContact CZ-OD2 3.94Å; R102-D202 IonicContact NH1-OD1 2.9Å; R102-D202 IonicContact NH1-OD2 3.54Å; R102-D202 PolarHBondContact NH1-OD2 3.22Å; R102-L392 HydrophobicContact CG-CD2 3.99Å
103H82.9Confident78Confident31 Ų3145.5 Ų45.514%0.14424%0.239CC..Hα-helixtrans-69.9-29.6178.752.2-86.3000111.6P100 N101 N388 L392P100-H103 PolarHBondContact O-CE1 3.3Å; P100-H103 PolarHBondContact O-ND1 2.92Å; P100-H103 VanDerWaalsContact O-ND1 3.13Å; N101-H103 VanDerWaalsContact C-N 3.27Å; N101-H103 PolarHBondContact O-N 3.46Å; H103-N388 HydrophobicContact CB-CB 4.14Å; H103-L392 HydrophobicContact CB-CB 4.21Å; H103-L392 HydrophobicContact CB-CD2 4.04Å
104D85.1Confident78.6Confident51 Ų5145.2 Ų45.227%0.27324%0.237SC..Hα-helixtrans-78.6-29.4176.4-61.4-30.4000112.3I39 N101 R102 L106 L107 N388I39-D104 HydrophobicContact CD1-CB 3.93Å; N101-D104 PolarHBondContact O-N 3.25Å; R102-D104 VanDerWaalsContact C-N 3.28Å; R102-D104 PolarHBondContact O-N 3.44Å; D104-L106 PolarHBondContact O-N 3.07Å; D104-L107 WeakPolarHBondContact O-CB 3.06Å; D104-L107 PolarHBondContact O-N 2.77Å; D104-N388 PolarHBondContact OD1-ND2 3.02Å
105M86.6Confident79.3Confident1 Ų143 Ų431%0.00523%0.229CC..Hα-helixtrans-58.3-36.8174.5-69177.8164.800113.1G37 I39 L42 I92 N101 R102 L107 V108G37-M105 WeakPolarHBondContact O-CE 3.31Å; I39-M105 HydrophobicContact CD1-CG 4.43Å; I39-M105 HydrophobicContact CG1-CE 4.12Å; I39-M105 HydrophobicContact CG1-CG 3.6Å; L42-M105 HydrophobicContact CD2-CB 4.05Å; L42-M105 HydrophobicContact CD2-CG 4.13Å; L42-M105 HydrophobicContact CD2-SD 4.37Å; I92-M105 HydrophobicContact CD1-CB 4.29Å; I92-M105 HydrophobicContact CG1-SD 4.31Å; I92-M105 HydrophobicContact CG2-CB 4.32Å; I92-M105 HydrophobicContact CG2-SD 4.47Å; N101-M105 PolarHBondContact O-N 3.5Å; R102-M105 WeakPolarHBondContact O-CB 3.13Å; R102-M105 PolarHBondContact O-N 2.57Å; M105-L107 PolarHBondContact O-N 2.71Å; M105-V108 WeakPolarHBondContact O-CB 3.48Å; M105-V108 WeakPolarHBondContact O-CG2 3.5Å; M105-V108 PolarHBondContact O-N 3.38Å
106L85.6Confident80.5Confident7 Ų745.3 Ų45.34%0.03724%0.237CC..THydrogen-bonded Turntrans-72.7-12.6-179.8-67.9179.8000113.2L89 I92 D104 V108 N112 L115 L392 A395L89-L106 HydrophobicContact CD2-CD2 4.22Å; I92-L106 HydrophobicContact CB-CD2 4.31Å; I92-L106 HydrophobicContact CD1-CD2 4.34Å; I92-L106 HydrophobicContact CG2-CD1 4.47Å; I92-L106 HydrophobicContact CG2-CD2 3.68Å; I92-L106 HydrophobicContact CG2-CG 3.84Å; D104-L106 PolarHBondContact O-N 3.07Å; L106-V108 VanDerWaalsContact C-N 3.32Å; L106-N112 WeakPolarHBondContact O-CA 3.47Å; L106-N112 WeakPolarHBondContact O-CB 3.21Å; L106-N112 PolarHBondContact O-N 2.9Å; L106-L115 HydrophobicContact CD2-CD1 4.1Å; L106-L392 HydrophobicContact CD1-CB 4.07Å; L106-L392 HydrophobicContact CD1-CD1 3.34Å; L106-L392 HydrophobicContact CD1-CG 4.32Å; L106-L392 HydrophobicContact CG-CD1 4.44Å; L106-A395 HydrophobicContact CD1-CB 3.68Å
107L85.6Confident82.2Confident51 Ų5144.3 Ų44.327%0.26723%0.227SC..THydrogen-bonded Turntrans-79.6-19.4175.2-58.6177000112.5D104 M105 E109 K391D104-L107 WeakPolarHBondContact O-CB 3.06Å; D104-L107 PolarHBondContact O-N 2.77Å; M105-L107 PolarHBondContact O-N 2.71Å; L107-E109 PolarHBondContact O-N 3.4Å; L107-K391 HydrophobicContact CD2-CD 3.51Å
108V88.9Confident84Confident18 Ų1841.7 Ų41.711%0.10921%0.208CC..SBendtrans-63132.9178.8179.60000109.8I39 A43 L46 M105 L106 L111 N112I39-V108 HydrophobicContact CG2-CG2 4Å; A43-V108 HydrophobicContact CB-CG1 3.67Å; A43-V108 HydrophobicContact CB-CG2 4.26Å; L46-V108 HydrophobicContact CD1-CG1 4.13Å; M105-V108 WeakPolarHBondContact O-CB 3.48Å; M105-V108 WeakPolarHBondContact O-CG2 3.5Å; M105-V108 PolarHBondContact O-N 3.38Å; L106-V108 VanDerWaalsContact C-N 3.32Å; V108-L111 WeakPolarHBondContact O-CB 3.24Å; V108-L111 PolarHBondContact O-N 2.9Å; V108-N112 PolarHBondContact O-N 2.72Å
109E87.7Confident85.6Confident54 Ų5434.7 Ų34.725%0.25218%0.175SC..THydrogen-bonded Turntrans-73.8131.9171.2-64.9-176.715300109.4Q47 L107Q47-E109 PolarHBondContact NE2-O 3Å; L107-E109 PolarHBondContact O-N 3.4Å
110P90.3Very high86.9Confident1 Ų137.4 Ų37.41%0.00619%0.189CC..THydrogen-bonded Turncis-93.6-4.918.535.3-37.9000116.4Y75 I80 N112 R113 L114Y75-P110 HydrophobicContact CD1-CB 3.99Å; Y75-P110 HydrophobicContact CD1-CG 3.86Å; Y75-P110 HydrophobicContact CD2-CB 3.98Å; Y75-P110 HydrophobicContact CG-CB 3.65Å; Y75-P110 HydrophobicContact CG-CG 3.91Å; I80-P110 HydrophobicContact CD1-CG 4.39Å; P110-N112 PolarHBondContact O-N 2.93Å; P110-R113 PolarHBondContact O-N 2.99Å; P110-L114 WeakPolarHBondContact O-CB 2.88Å; P110-L114 PolarHBondContact O-N 2.87Å
111L90.3Very high87.9Confident0 Ų038.6 Ų38.60%018%0.181CC..Hα-helixtrans-58.7-44.6-168.4-58.1176.2000112.9L46 I80 L89 I92 V108 R113 L114 L115L46-L111 HydrophobicContact CD1-CD1 4.23Å; L46-L111 HydrophobicContact CD1-CG 4.29Å; I80-L111 HydrophobicContact CG2-CD2 3.42Å; I80-L111 VanDerWaalsContact CG2-CD2 3.42Å; L89-L111 HydrophobicContact CD2-CD2 3.92Å; L89-L111 HydrophobicContact CG-CD2 4.3Å; I92-L111 HydrophobicContact CD1-CD1 3.83Å; V108-L111 WeakPolarHBondContact O-CB 3.24Å; V108-L111 PolarHBondContact O-N 2.9Å; L111-R113 PolarHBondContact O-N 3.31Å; L111-L114 PolarHBondContact O-N 3.18Å; L111-L115 WeakPolarHBondContact O-CB 3.35Å; L111-L115 WeakPolarHBondContact O-CG 3.32Å; L111-L115 PolarHBondContact O-N 3.3Å
112N90.7Very high88.2Confident40 Ų4035.4 Ų35.421%0.21416%0.163CC..Hα-helixtrans-59.9-44.4-180-179.140.6000112.1L106 V108 P110 Q116 K391L106-N112 WeakPolarHBondContact O-CA 3.47Å; L106-N112 WeakPolarHBondContact O-CB 3.21Å; L106-N112 PolarHBondContact O-N 2.9Å; V108-N112 PolarHBondContact O-N 2.72Å; P110-N112 PolarHBondContact O-N 2.93Å; N112-Q116 WeakPolarHBondContact O-CB 3.42Å; N112-Q116 PolarHBondContact O-N 3.21Å; N112-K391 PolarHBondContact OD1-NZ 3.49Å
113R90.8Very high88.6Confident127 Ų12734.8 Ų34.848%0.47916%0.161SC..Hα-helixtrans-73.2-38.5179.6-69.6-71.2-170160.75.4111.8P110 L111 Q116 D117 F435 V437P110-R113 PolarHBondContact O-N 2.99Å; L111-R113 PolarHBondContact O-N 3.31Å; R113-Q116 PolarHBondContact O-N 2.89Å; R113-D117 PolarHBondContact O-N 2.88Å; R113-F435 HydrophobicContact CB-CE1 3.85Å; R113-V437 HydrophobicContact CB-CG2 4.34Å; R113-V437 HydrophobicContact CG-CG1 4.06Å
114L91.1Very high89Confident0 Ų037.3 Ų37.30%017%0.172CC..Hα-helixtrans-61.1-46.3176.2-17965.2000111.8L77 I80 L89 P110 L111 Q116 D117 K118 F435L77-L114 HydrophobicContact CD1-CD1 4.48Å; L77-L114 HydrophobicContact CD2-CD1 4.05Å; L77-L114 HydrophobicContact CD2-CD2 3.8Å; I80-L114 HydrophobicContact CG2-CD2 4.06Å; L89-L114 HydrophobicContact CD1-CD2 4.07Å; P110-L114 WeakPolarHBondContact O-CB 2.88Å; P110-L114 PolarHBondContact O-N 2.87Å; L111-L114 PolarHBondContact O-N 3.18Å; L114-Q116 VanDerWaalsContact C-N 3.32Å; L114-Q116 PolarHBondContact O-N 2.9Å; L114-D117 PolarHBondContact O-N 3.06Å; L114-K118 WeakPolarHBondContact O-CG 3.33Å; L114-K118 PolarHBondContact O-N 3.14Å; L114-F435 HydrophobicContact CB-CE1 4.42Å; L114-F435 HydrophobicContact CD1-CD2 3.93Å; L114-F435 HydrophobicContact CD1-CE2 4.11Å; L114-F435 HydrophobicContact CD1-CG 4.21Å
115L90.9Very high89.2Confident15 Ų1544 Ų448%0.07919%0.193CC..Hα-helixtrans-66-34.9177.2-72.6169.5000112.2L89 L106 L111 W119 A395 I398L89-L115 HydrophobicContact CD2-CD1 4.24Å; L89-L115 HydrophobicContact CD2-CD2 4.2Å; L89-L115 HydrophobicContact CD2-CG 4.28Å; L106-L115 HydrophobicContact CD2-CD1 4.1Å; L111-L115 WeakPolarHBondContact O-CB 3.35Å; L111-L115 WeakPolarHBondContact O-CG 3.32Å; L111-L115 PolarHBondContact O-N 3.3Å; L115-W119 WeakPolarHBondContact O-CB 3.45Å; L115-W119 PolarHBondContact O-N 2.67Å; L115-A395 HydrophobicContact CD1-CB 3.63Å; L115-A395 HydrophobicContact CD2-CB 4.09Å; L115-A395 HydrophobicContact CG-CB 4.49Å; L115-I398 HydrophobicContact CB-CD1 4.29Å; L115-I398 HydrophobicContact CD2-CD1 4.07Å; L115-I398 HydrophobicContact CD2-CG2 4.35Å; L115-I398 WeakPolarHBondContact O-CD1 3.23Å
116Q90.8Very high89.4Confident73 Ų7346.3 Ų46.334%0.34121%0.205SC..Hα-helixtrans-65.8-45.8174.9-173.166.630.700111.5N112 R113 L114 W119 D120 R394N112-Q116 WeakPolarHBondContact O-CB 3.42Å; N112-Q116 PolarHBondContact O-N 3.21Å; R113-Q116 PolarHBondContact O-N 2.89Å; L114-Q116 VanDerWaalsContact C-N 3.32Å; L114-Q116 PolarHBondContact O-N 2.9Å; Q116-W119 PolarHBondContact O-N 3.34Å; Q116-D120 PolarHBondContact NE2-OD2 3.13Å; Q116-D120 PolarHBondContact O-N 3.47Å; Q116-R394 VanDerWaalsContact CD-NH2 3.26Å
117D90.3Very high89.7Confident38 Ų3846.3 Ų46.320%0.20320%0.204CC..Hα-helixtrans-59.3-47.4175.8173.967.4000111.7R113 L114 W119 D120 R121 S415 F435R113-D117 PolarHBondContact O-N 2.88Å; L114-D117 PolarHBondContact O-N 3.06Å; D117-W119 VanDerWaalsContact C-N 3.28Å; D117-W119 PolarHBondContact O-N 3.23Å; D117-D120 PolarHBondContact O-N 3.12Å; D117-R121 WeakPolarHBondContact O-CB 3.46Å; D117-R121 PolarHBondContact O-N 3.37Å; D117-R121 IonicContact OD1-CZ 3.74Å; D117-R121 IonicContact OD1-NE 2.86Å; D117-R121 IonicContact OD1-NH2 3.25Å; D117-R121 PolarHBondContact OD1-NH2 2.83Å; D117-R121 IonicContact OD2-CZ 3.02Å; D117-R121 IonicContact OD2-NE 3.04Å; D117-R121 IonicContact OD2-NH2 2.7Å; D117-R121 PolarHBondContact OD2-NH2 3.45Å; D117-R121 VanDerWaalsContact OD2-NH2 3.17Å; D117-S415 PolarHBondContact OD2-OG 2.75Å; D117-F435 HydrophobicContact CB-CE2 3.96Å; D117-F435 HydrophobicContact CB-CZ 3.88Å
118K90.8Very high89.9Confident2 Ų246.9 Ų46.91%0.00920%0.203CC..Hα-helixtrans-57.4-42.8176.4-74.4-179.6166.3-149.10112.1D81 L114 F122 V123 I398 E402 S415D81-K118 WeakPolarHBondContact OD1-CE 3.36Å; D81-K118 IonicContact OD1-NZ 3.51Å; D81-K118 PolarHBondContact OD1-NZ 2.7Å; L114-K118 WeakPolarHBondContact O-CG 3.33Å; L114-K118 PolarHBondContact O-N 3.14Å; K118-F122 HydrophobicContact CB-CE1 3.83Å; K118-F122 HydrophobicContact CB-CZ 4.4Å; K118-F122 HydrophobicContact CG-CE1 4.12Å; K118-F122 WeakPolarHBondContact O-CD1 3.48Å; K118-F122 VanDerWaalsContact O-CE1 3.31Å; K118-F122 WeakPolarHBondContact O-CE1 3.46Å; K118-F122 PolarHBondContact O-N 2.86Å; K118-V123 PolarHBondContact O-N 3.3Å; K118-I398 HydrophobicContact CB-CG2 4.13Å; K118-I398 HydrophobicContact CD-CG2 4.22Å; K118-E402 VanDerWaalsContact CD-OE1 3.23Å; K118-E402 WeakPolarHBondContact CD-OE1 3.42Å; K118-E402 VanDerWaalsContact CE-OE1 3.27Å; K118-E402 WeakPolarHBondContact CE-OE1 3.48Å; K118-E402 VanDerWaalsContact NZ-CD 3.34Å; K118-E402 IonicContact NZ-OE1 2.9Å; K118-E402 PolarHBondContact NZ-OE1 3.38Å; K118-E402 IonicContact NZ-OE2 3.16Å; K118-E402 PolarHBondContact NZ-OE2 2.67Å; K118-E402 VanDerWaalsContact NZ-OE2 3.07Å; K118-S415 WeakPolarHBondContact CG-OG 2.85Å
119W90.9Very high90.1Very high11 Ų1152.4 Ų52.44%0.04223%0.226CC..Iπ-helixtrans-63.1-52.5178.4-179.3-93.9000112.5L115 Q116 D117 R121 V123 K124 F127 G251 R394 I398L115-W119 WeakPolarHBondContact O-CB 3.45Å; L115-W119 PolarHBondContact O-N 2.67Å; Q116-W119 PolarHBondContact O-N 3.34Å; D117-W119 VanDerWaalsContact C-N 3.28Å; D117-W119 PolarHBondContact O-N 3.23Å; W119-R121 VanDerWaalsContact C-N 3.32Å; W119-R121 PolarHBondContact O-N 3.35Å; W119-V123 HydrophobicContact CE3-CB 3.92Å; W119-V123 HydrophobicContact CE3-CG1 3.6Å; W119-V123 HydrophobicContact CZ3-CB 4.41Å; W119-V123 HydrophobicContact CZ3-CG1 3.63Å; W119-V123 PolarHBondContact O-N 3.43Å; W119-K124 HydrophobicContact CD2-CB 4.47Å; W119-K124 HydrophobicContact CG-CB 4.48Å; W119-K124 WeakPolarHBondContact O-CB 3.43Å; W119-K124 PolarHBondContact O-N 2.8Å; W119-F127 HydrophobicContact CH2-CB 4.31Å; W119-F127 HydrophobicContact CH2-CD1 4.17Å; W119-F127 HydrophobicContact CH2-CD2 4.32Å; W119-F127 HydrophobicContact CH2-CG 4.01Å; W119-G251 WeakPolarHBondContact CZ2-O 3.47Å; W119-R394 HydrophobicContact CD2-CG 4.31Å; W119-R394 HydrophobicContact CE3-CG 3.86Å; W119-R394 VanDerWaalsContact CG-NE 3.3Å; W119-R394 HydrophobicContact CZ3-CG 4.03Å; W119-I398 HydrophobicContact CB-CD1 4.14Å; W119-I398 HydrophobicContact CE3-CD1 4.16Å; W119-I398 HydrophobicContact CE3-CG1 3.82Å
120D90.2Very high90.3Very high78 Ų7853 Ų5342%0.41723%0.231SC..Iπ-helixtrans-69.7-31.6-174-70.5-32.9000112.1Q116 D117Q116-D120 PolarHBondContact NE2-OD2 3.13Å; Q116-D120 PolarHBondContact O-N 3.47Å; D117-D120 PolarHBondContact O-N 3.12Å
121R87.3Confident90.4Very high123 Ų12355.7 Ų55.746%0.46424%0.243SC..Iπ-helixtrans-72.5-50-178.8-170.5176.2-62.3-172.32.1113.3D117 W119D117-R121 WeakPolarHBondContact O-CB 3.46Å; D117-R121 PolarHBondContact O-N 3.37Å; D117-R121 IonicContact OD1-CZ 3.74Å; D117-R121 IonicContact OD1-NE 2.86Å; D117-R121 IonicContact OD1-NH2 3.25Å; D117-R121 PolarHBondContact OD1-NH2 2.83Å; D117-R121 IonicContact OD2-CZ 3.02Å; D117-R121 IonicContact OD2-NE 3.04Å; D117-R121 IonicContact OD2-NH2 2.7Å; D117-R121 PolarHBondContact OD2-NH2 3.45Å; D117-R121 VanDerWaalsContact OD2-NH2 3.17Å; W119-R121 VanDerWaalsContact C-N 3.32Å; W119-R121 PolarHBondContact O-N 3.35Å
122F85.8Confident90.6Very high9 Ų961.5 Ų61.54%0.03927%0.269CS..Iπ-helixtrans-136.5-44.7-171.774.1-86.3000114.7K118 K124 R125 I126 E402 F405 F413K118-F122 HydrophobicContact CB-CE1 3.83Å; K118-F122 HydrophobicContact CB-CZ 4.4Å; K118-F122 HydrophobicContact CG-CE1 4.12Å; K118-F122 WeakPolarHBondContact O-CD1 3.48Å; K118-F122 VanDerWaalsContact O-CE1 3.31Å; K118-F122 WeakPolarHBondContact O-CE1 3.46Å; K118-F122 PolarHBondContact O-N 2.86Å; F122-K124 VanDerWaalsContact C-N 3.3Å; F122-K124 PolarHBondContact O-N 3.42Å; F122-R125 PolarHBondContact O-N 2.86Å; F122-I126 HydrophobicContact CD2-CD1 4.28Å; F122-I126 PolarHBondContact O-N 2.79Å; F122-E402 HydrophobicContact CE2-CG 4.04Å; F122-E402 HydrophobicContact CZ-CG 3.67Å; F122-E402 WeakPolarHBondContact CZ-OE1 3.02Å; F122-F405 HydrophobicContact CD2-CE2 4.3Å; F122-F405 HydrophobicContact CE2-CE2 4.03Å; F122-F413 HydrophobicContact CB-CD1 4.29Å; F122-F413 HydrophobicContact CB-CE1 4.45Å; F122-F413 HydrophobicContact CG-CD1 4.44Å
123V89.1Confident90.8Very high0 Ų063 Ų630%028%0.279CS..Iπ-helixtrans-62.5-40.3-170.6-176.70000111.1K118 W119 R125 I126 F127 I398 T401K118-V123 PolarHBondContact O-N 3.3Å; W119-V123 HydrophobicContact CE3-CB 3.92Å; W119-V123 HydrophobicContact CE3-CG1 3.6Å; W119-V123 HydrophobicContact CZ3-CB 4.41Å; W119-V123 HydrophobicContact CZ3-CG1 3.63Å; W119-V123 PolarHBondContact O-N 3.43Å; V123-R125 VanDerWaalsContact C-N 3.3Å; V123-R125 PolarHBondContact O-N 2.93Å; V123-I126 PolarHBondContact O-N 3.33Å; V123-F127 WeakPolarHBondContact O-CB 3.48Å; V123-F127 PolarHBondContact O-N 3.39Å; V123-I398 HydrophobicContact CB-CG1 4.38Å; V123-I398 HydrophobicContact CG1-CG1 4.15Å; V123-I398 HydrophobicContact CG2-CB 4.33Å; V123-I398 HydrophobicContact CG2-CG1 4.06Å; V123-I398 HydrophobicContact CG2-CG2 4.06Å; V123-T401 HydrophobicContact CG1-CG2 4.48Å
124K90.3Very high91Very high85 Ų8557.1 Ų57.137%0.3726%0.256SS..Hα-helixtrans-54-45.5179.3-176.7178.1-179.3-179.80112.2W119 F122 Y128W119-K124 HydrophobicContact CD2-CB 4.47Å; W119-K124 HydrophobicContact CG-CB 4.48Å; W119-K124 WeakPolarHBondContact O-CB 3.43Å; W119-K124 PolarHBondContact O-N 2.8Å; F122-K124 VanDerWaalsContact C-N 3.3Å; F122-K124 PolarHBondContact O-N 3.42Å; K124-Y128 HydrophobicContact CD-CE2 4.18Å; K124-Y128 HydrophobicContact CG-CD2 3.86Å; K124-Y128 HydrophobicContact CG-CE2 3.42Å; K124-Y128 VanDerWaalsContact CG-CE2 3.42Å; K124-Y128 WeakPolarHBondContact O-CD2 3.49Å; K124-Y128 PolarHBondContact O-N 3.41Å; K124-Y128 VanDerWaalsContact O-N 3.12Å
125R90.3Very high91.2Very high192 Ų19258.1 Ų58.173%0.72526%0.263SS*.Hα-helixtrans-66.8-44.8-178.9-64.9-178.9-176.1178.50.8111.6F122 V123 Y128 F129F122-R125 PolarHBondContact O-N 2.86Å; V123-R125 VanDerWaalsContact C-N 3.3Å; V123-R125 PolarHBondContact O-N 2.93Å; R125-Y128 PolarHBondContact O-N 3.42Å; R125-F129 WeakPolarHBondContact O-CB 3.48Å; R125-F129 PolarHBondContact O-N 3.18Å
126I89.9Confident91.4Very high48 Ų4861 Ų6125%0.24628%0.278CS..Hα-helixtrans-69.9-38.2-178.3-62.3176.4000110.7F122 V123 F129 N130 T401 F405F122-I126 HydrophobicContact CD2-CD1 4.28Å; F122-I126 PolarHBondContact O-N 2.79Å; V123-I126 PolarHBondContact O-N 3.33Å; I126-F129 PolarHBondContact O-N 3.39Å; I126-N130 WeakPolarHBondContact O-CB 3.45Å; I126-N130 VanDerWaalsContact O-CG 3.24Å; I126-N130 PolarHBondContact O-N 3.23Å; I126-N130 PolarHBondContact O-ND2 2.99Å; I126-T401 HydrophobicContact CG2-CG2 4.13Å; I126-F405 HydrophobicContact CD1-CE1 3.97Å; I126-F405 HydrophobicContact CD1-CE2 4.26Å; I126-F405 HydrophobicContact CD1-CZ 3.34Å; I126-F405 HydrophobicContact CG2-CZ 4.38Å
127F91.1Very high91.6Very high7 Ų758.4 Ų58.43%0.03127%0.266CS..Hα-helixtrans-62.3-45.5176.1-172.4-91.4000111.9W119 V123 N130 F131 Y247 Y248 T397W119-F127 HydrophobicContact CH2-CB 4.31Å; W119-F127 HydrophobicContact CH2-CD1 4.17Å; W119-F127 HydrophobicContact CH2-CD2 4.32Å; W119-F127 HydrophobicContact CH2-CG 4.01Å; V123-F127 WeakPolarHBondContact O-CB 3.48Å; V123-F127 PolarHBondContact O-N 3.39Å; F127-N130 PolarHBondContact O-N 2.95Å; F127-F131 WeakPolarHBondContact O-CB 3.4Å; F127-F131 PolarHBondContact O-N 3.24Å; F127-Y247 HydrophobicContact CE2-CE1 4.18Å; F127-Y248 HydrophobicContact CE1-CD1 4.06Å; F127-Y248 WeakPolarHBondContact CE1-O 3.36Å; F127-Y248 HydrophobicContact CE2-CD1 4.24Å; F127-Y248 AromaticContact CZ-CD1 3.84Å; F127-Y248 HydrophobicContact CZ-CD1 3.84Å; F127-T397 HydrophobicContact CD2-CG2 3.87Å; F127-T397 HydrophobicContact CE2-CG2 3.79Å
128Y91.2Very high91.9Very high63 Ų6356.6 Ų56.625%0.24726%0.256CS..Hα-helixtrans-68-35175.5-71.6-52.8000113.2K124 R125 F131 F132 F252K124-Y128 HydrophobicContact CD-CE2 4.18Å; K124-Y128 HydrophobicContact CG-CD2 3.86Å; K124-Y128 HydrophobicContact CG-CE2 3.42Å; K124-Y128 VanDerWaalsContact CG-CE2 3.42Å; K124-Y128 WeakPolarHBondContact O-CD2 3.49Å; K124-Y128 PolarHBondContact O-N 3.41Å; K124-Y128 VanDerWaalsContact O-N 3.12Å; R125-Y128 PolarHBondContact O-N 3.42Å; Y128-F131 WeakPolarHBondContact O-CB 3.46Å; Y128-F131 PolarHBondContact O-N 2.95Å; Y128-F132 PolarHBondContact O-N 3.28Å; Y128-F252 HydrophobicContact CD1-CZ 4.4Å; Y128-F252 AromaticContact CE1-CE1 3.79Å; Y128-F252 HydrophobicContact CE1-CE1 3.79Å; Y128-F252 AromaticContact CE1-CE2 3.84Å; Y128-F252 HydrophobicContact CE1-CE2 3.84Å; Y128-F252 AromaticContact CE1-CZ 3.38Å; Y128-F252 HydrophobicContact CE1-CZ 3.38Å; Y128-F252 AromaticContact CZ-CE1 3.79Å; Y128-F252 AromaticContact CZ-CZ 3.9Å; Y128-F252 WeakPolarHBondContact OH-CD1 3.49Å; Y128-F252 WeakPolarHBondContact OH-CE1 3.09Å
129F92.7Very high92.1Very high134 Ų13460.7 Ų60.759%0.58828%0.277SS*.Hα-helixtrans-62.7-47.2172.5-179.9-99.3000111.4R125 I126 F131 F132 V133R125-F129 WeakPolarHBondContact O-CB 3.48Å; R125-F129 PolarHBondContact O-N 3.18Å; I126-F129 PolarHBondContact O-N 3.39Å; F129-F131 VanDerWaalsContact C-N 3.31Å; F129-F131 PolarHBondContact O-N 3.12Å; F129-F132 PolarHBondContact O-N 3.19Å; F129-V133 HydrophobicContact CD1-CG2 4.25Å; F129-V133 HydrophobicContact CE1-CG2 3.83Å; F129-V133 HydrophobicContact CE2-CG2 4.33Å; F129-V133 HydrophobicContact CZ-CG2 3.87Å; F129-V133 WeakPolarHBondContact O-CG2 3.37Å; F129-V133 PolarHBondContact O-N 3.39Å
130N91.4Very high92.3Very high66 Ų6662.7 Ų62.735%0.35329%0.288SS..Hα-helixtrans-60.9-39.9175.6-71.5-18.6000111.9I126 F127 V133 Y134 Y248I126-N130 WeakPolarHBondContact O-CB 3.45Å; I126-N130 VanDerWaalsContact O-CG 3.24Å; I126-N130 PolarHBondContact O-N 3.23Å; I126-N130 PolarHBondContact O-ND2 2.99Å; F127-N130 PolarHBondContact O-N 2.95Å; N130-V133 PolarHBondContact O-N 2.97Å; N130-Y134 WeakPolarHBondContact O-CB 3.24Å; N130-Y134 PolarHBondContact O-N 3.11Å; N130-Y248 HydrophobicContact CB-CE1 4.32Å
131F93.1Very high92.5Very high58 Ų5859 Ų5925%0.25427%0.268SS..Hα-helixtrans-59-48.3173.5172.9-120.8000111.6F127 Y128 F129 V133 Y134 C135 M245 Y248F127-F131 WeakPolarHBondContact O-CB 3.4Å; F127-F131 PolarHBondContact O-N 3.24Å; Y128-F131 WeakPolarHBondContact O-CB 3.46Å; Y128-F131 PolarHBondContact O-N 2.95Å; F129-F131 VanDerWaalsContact C-N 3.31Å; F129-F131 PolarHBondContact O-N 3.12Å; F131-V133 PolarHBondContact O-N 3.04Å; F131-Y134 PolarHBondContact O-N 3.01Å; F131-C135 WeakPolarHBondContact CE2-SG 3.35Å; F131-C135 VanDerWaalsContact CZ-SG 3.54Å; F131-C135 PolarHBondContact O-N 3.47Å; F131-C135 PolarHBondContact O-SG 3.29Å; F131-M245 HydrophobicContact CE2-CE 3.84Å; F131-M245 HydrophobicContact CE2-CG 4.16Å; F131-M245 HydrophobicContact CZ-CE 3.9Å; F131-Y248 HydrophobicContact CB-CD1 3.61Å; F131-Y248 HydrophobicContact CB-CE1 4.09Å; F131-Y248 HydrophobicContact CB-CG 4Å; F131-Y248 AromaticContact CD2-CD1 3.97Å; F131-Y248 HydrophobicContact CD2-CD1 3.97Å; F131-Y248 AromaticContact CD2-CD2 3.8Å; F131-Y248 HydrophobicContact CD2-CD2 3.8Å; F131-Y248 AromaticContact CD2-CG 3.4Å; F131-Y248 HydrophobicContact CD2-CG 3.4Å; F131-Y248 VanDerWaalsContact CD2-CG 3.4Å; F131-Y248 HydrophobicContact CE2-CG 4.27Å; F131-Y248 HydrophobicContact CG-CD1 4.23Å; F131-Y248 HydrophobicContact CG-CG 4.11Å
132F94.6Very high92.9Very high123 Ų12355.2 Ų55.254%0.53926%0.259SS..Hα-helixtrans-61.3-45.4178.8179.6-104.5000112.1Y128 F129 Y134 C135 L136Y128-F132 PolarHBondContact O-N 3.28Å; F129-F132 PolarHBondContact O-N 3.19Å; F132-Y134 VanDerWaalsContact C-N 3.31Å; F132-Y134 PolarHBondContact O-N 3.43Å; F132-C135 WeakPolarHBondContact O-CB 3.25Å; F132-C135 PolarHBondContact O-N 3.21Å; F132-L136 HydrophobicContact CD1-CD1 3.96Å; F132-L136 HydrophobicContact CE1-CD1 3.41Å; F132-L136 VanDerWaalsContact CE1-CD1 3.41Å; F132-L136 HydrophobicContact CE1-CG 4.14Å; F132-L136 HydrophobicContact CZ-CD1 3.77Å; F132-L136 HydrophobicContact CZ-CD2 4.31Å; F132-L136 HydrophobicContact CZ-CG 4.13Å; F132-L136 WeakPolarHBondContact O-CG 3.49Å; F132-L136 PolarHBondContact O-N 2.99Å
133V94.6Very high93.2Very high70 Ų7057.8 Ų57.842%0.42428%0.275SS..Hα-helixtrans-60.6-41.4175.7173.30000111.2F129 N130 F131 L136 Y137F129-V133 HydrophobicContact CD1-CG2 4.25Å; F129-V133 HydrophobicContact CE1-CG2 3.83Å; F129-V133 HydrophobicContact CE2-CG2 4.33Å; F129-V133 HydrophobicContact CZ-CG2 3.87Å; F129-V133 WeakPolarHBondContact O-CG2 3.37Å; F129-V133 PolarHBondContact O-N 3.39Å; N130-V133 PolarHBondContact O-N 2.97Å; F131-V133 PolarHBondContact O-N 3.04Å; V133-L136 PolarHBondContact O-N 2.94Å; V133-Y137 PolarHBondContact O-N 3.37Å
134Y94.5Very high93.3Very high4 Ų458 Ų582%0.01628%0.277CS..Hα-helixtrans-66.1-39.7176.6-172.8-107.1000112.8N130 F131 F132 L136 Y137 M138 F181 F209 G241 N244 M245 Y248N130-Y134 WeakPolarHBondContact O-CB 3.24Å; N130-Y134 PolarHBondContact O-N 3.11Å; F131-Y134 PolarHBondContact O-N 3.01Å; F132-Y134 VanDerWaalsContact C-N 3.31Å; F132-Y134 PolarHBondContact O-N 3.43Å; Y134-L136 VanDerWaalsContact C-N 3.34Å; Y134-Y137 HydrophobicContact CD2-CD1 4.12Å; Y134-Y137 AromaticContact CE2-CD1 3.95Å; Y134-Y137 HydrophobicContact CE2-CD1 3.95Å; Y134-Y137 HydrophobicContact CE2-CE1 4.27Å; Y134-Y137 WeakPolarHBondContact O-CB 3.47Å; Y134-Y137 PolarHBondContact O-N 3.23Å; Y134-M138 HydrophobicContact CD1-CG 4.18Å; Y134-M138 HydrophobicContact CE1-CG 3.73Å; Y134-M138 HydrophobicContact CE1-SD 4.43Å; Y134-M138 HydrophobicContact CE2-CG 4.35Å; Y134-M138 HydrophobicContact CE2-SD 4.47Å; Y134-M138 WeakPolarHBondContact O-CG 3.46Å; Y134-M138 PolarHBondContact O-N 3.49Å; Y134-F181 HydrophobicContact CD2-CE2 4.16Å; Y134-F181 AromaticContact CD2-CZ 3.7Å; Y134-F181 HydrophobicContact CD2-CZ 3.7Å; Y134-F181 AromaticContact CE2-CE2 4Å; Y134-F181 HydrophobicContact CE2-CE2 4Å; Y134-F181 AromaticContact CE2-CZ 3.84Å; Y134-F181 HydrophobicContact CE2-CZ 3.84Å; Y134-F209 HydrophobicContact CD2-CE1 4.46Å; Y134-F209 HydrophobicContact CE1-CE1 4.37Å; Y134-F209 HydrophobicContact CE2-CD1 4.46Å; Y134-F209 AromaticContact CE2-CE1 3.74Å; Y134-F209 HydrophobicContact CE2-CE1 3.74Å; Y134-F209 AromaticContact CZ-CE1 3.68Å; Y134-G241 WeakPolarHBondContact OH-CA 3.43Å; Y134-G241 PolarHBondContact OH-O 3.49Å; Y134-N244 WeakPolarHBondContact OH-CB 3.35Å; Y134-M245 HydrophobicContact CE1-CB 4.47Å; Y134-Y248 HydrophobicContact CD1-CD2 4.01Å; Y134-Y248 AromaticContact CD1-CE2 3.44Å; Y134-Y248 HydrophobicContact CD1-CE2 3.44Å; Y134-Y248 VanDerWaalsContact CD1-CE2 3.44Å; Y134-Y248 HydrophobicContact CD2-CE2 4.44Å; Y134-Y248 HydrophobicContact CE1-CE2 4.14Å; Y134-Y248 AromaticContact CG-CE2 3.6Å; Y134-Y248 HydrophobicContact CG-CE2 3.6Å
135C95.5Very high93.4Very high21 Ų2155.2 Ų55.214%0.14227%0.27CS..Hα-helixtrans-60.1-46.2174.2-65.40000111F131 F132 Y137 M138 I139 M245F131-C135 WeakPolarHBondContact CE2-SG 3.35Å; F131-C135 VanDerWaalsContact CZ-SG 3.54Å; F131-C135 PolarHBondContact O-N 3.47Å; F131-C135 PolarHBondContact O-SG 3.29Å; F132-C135 WeakPolarHBondContact O-CB 3.25Å; F132-C135 PolarHBondContact O-N 3.21Å; C135-Y137 PolarHBondContact O-N 2.92Å; C135-M138 PolarHBondContact O-N 3.44Å; C135-I139 VanDerWaalsContact O-CG1 3.29Å; C135-I139 WeakPolarHBondContact O-CG1 3.34Å; C135-I139 PolarHBondContact O-N 3.37Å; C135-M245 WeakPolarHBondContact SG-CE 3.39Å
136L95.5Very high93.4Very high76 Ų7654.7 Ų54.740%0.39827%0.27SS..Hα-helixtrans-60.4-45175.7-70.5178.6000111.6F132 V133 Y134 M138 I139 I140F132-L136 HydrophobicContact CD1-CD1 3.96Å; F132-L136 HydrophobicContact CE1-CD1 3.41Å; F132-L136 VanDerWaalsContact CE1-CD1 3.41Å; F132-L136 HydrophobicContact CE1-CG 4.14Å; F132-L136 HydrophobicContact CZ-CD1 3.77Å; F132-L136 HydrophobicContact CZ-CD2 4.31Å; F132-L136 HydrophobicContact CZ-CG 4.13Å; F132-L136 WeakPolarHBondContact O-CG 3.49Å; F132-L136 PolarHBondContact O-N 2.99Å; V133-L136 PolarHBondContact O-N 2.94Å; Y134-L136 VanDerWaalsContact C-N 3.34Å; L136-M138 VanDerWaalsContact C-N 3.32Å; L136-M138 PolarHBondContact O-N 2.94Å; L136-I139 PolarHBondContact O-N 3.29Å; L136-I140 VanDerWaalsContact O-CG1 3.24Å; L136-I140 WeakPolarHBondContact O-CG1 3.44Å; L136-I140 PolarHBondContact O-N 3.4Å
137Y95.3Very high93.3Very high18 Ų1859.7 Ų59.77%0.07129%0.286CS..Hα-helixtrans-55.5-46.4174.3165.9-95.4000111.8V133 Y134 C135 I140 F141 F181V133-Y137 PolarHBondContact O-N 3.37Å; Y134-Y137 HydrophobicContact CD2-CD1 4.12Å; Y134-Y137 AromaticContact CE2-CD1 3.95Å; Y134-Y137 HydrophobicContact CE2-CD1 3.95Å; Y134-Y137 HydrophobicContact CE2-CE1 4.27Å; Y134-Y137 WeakPolarHBondContact O-CB 3.47Å; Y134-Y137 PolarHBondContact O-N 3.23Å; C135-Y137 PolarHBondContact O-N 2.92Å; Y137-I140 PolarHBondContact O-N 2.96Å; Y137-F141 WeakPolarHBondContact O-CB 3.41Å; Y137-F141 PolarHBondContact O-N 3.37Å; Y137-F181 HydrophobicContact CD1-CE2 4.34Å; Y137-F181 HydrophobicContact CE1-CE2 4.19Å
138M95.9Very high93Very high1 Ų161.7 Ų61.71%0.00529%0.294CS..Hα-helixtrans-67.8-37.6179.5-73.2-55.8-54.600113.1Y134 C135 L136 F141 T142 L238 G241 W242Y134-M138 HydrophobicContact CD1-CG 4.18Å; Y134-M138 HydrophobicContact CE1-CG 3.73Å; Y134-M138 HydrophobicContact CE1-SD 4.43Å; Y134-M138 HydrophobicContact CE2-CG 4.35Å; Y134-M138 HydrophobicContact CE2-SD 4.47Å; Y134-M138 WeakPolarHBondContact O-CG 3.46Å; Y134-M138 PolarHBondContact O-N 3.49Å; C135-M138 PolarHBondContact O-N 3.44Å; L136-M138 VanDerWaalsContact C-N 3.32Å; L136-M138 PolarHBondContact O-N 2.94Å; M138-F141 HydrophobicContact CE-CD1 4.39Å; M138-F141 PolarHBondContact O-N 2.89Å; M138-T142 WeakPolarHBondContact O-CB 3.45Å; M138-T142 PolarHBondContact O-N 2.92Å; M138-T142 PolarHBondContact O-OG1 2.89Å; M138-L238 HydrophobicContact CE-CD1 4.01Å; M138-G241 VanDerWaalsContact CE-C 3.4Å; M138-W242 HydrophobicContact CB-CZ2 4.33Å; M138-W242 HydrophobicContact CE-CB 4.42Å; M138-W242 HydrophobicContact CE-CD2 4.07Å; M138-W242 HydrophobicContact CE-CG 3.77Å; M138-W242 VanDerWaalsContact CE-N 3.35Å
139I95.6Very high92.5Very high87 Ų8760.3 Ų60.345%0.44629%0.292SS..Hα-helixtrans-63.3-46.5174.8-69.1164.6000110C135 L136 T142 T143C135-I139 VanDerWaalsContact O-CG1 3.29Å; C135-I139 WeakPolarHBondContact O-CG1 3.34Å; C135-I139 PolarHBondContact O-N 3.37Å; L136-I139 PolarHBondContact O-N 3.29Å; I139-T142 PolarHBondContact O-N 3.32Å; I139-T143 WeakPolarHBondContact O-CB 3.27Å; I139-T143 PolarHBondContact O-N 3.22Å; I139-T143 PolarHBondContact O-OG1 3.39Å
140I94.7Very high91.8Very high53 Ų5360 Ų6027%0.27230%0.302SS..Hα-helixtrans-63.8-43.9178.5-65.5167.7000110.6L136 Y137 T142 T143 A144 L173L136-I140 VanDerWaalsContact O-CG1 3.24Å; L136-I140 WeakPolarHBondContact O-CG1 3.44Å; L136-I140 PolarHBondContact O-N 3.4Å; Y137-I140 PolarHBondContact O-N 2.96Å; I140-T142 PolarHBondContact O-N 3.41Å; I140-T143 PolarHBondContact O-N 2.9Å; I140-A144 WeakPolarHBondContact O-CB 3.27Å; I140-A144 PolarHBondContact O-N 3.05Å; I140-L173 HydrophobicContact CD1-CD2 3.45Å; I140-L173 VanDerWaalsContact CD1-CD2 3.45Å; I140-L173 HydrophobicContact CG2-CD2 4.23Å
141F95.1Very high90.9Very high1 Ų165.2 Ų65.20%0.00432%0.324CS..Hα-helixtrans-63.8-40.8177.9-177.1-143.3000112.1Y137 M138 A144 A145 S174 M216 M234 L238Y137-F141 WeakPolarHBondContact O-CB 3.41Å; Y137-F141 PolarHBondContact O-N 3.37Å; M138-F141 HydrophobicContact CE-CD1 4.39Å; M138-F141 PolarHBondContact O-N 2.89Å; F141-A144 PolarHBondContact O-N 2.98Å; F141-A145 WeakPolarHBondContact O-CB 3.44Å; F141-A145 PolarHBondContact O-N 2.92Å; F141-S174 WeakPolarHBondContact CA-OG 3.41Å; F141-M216 HydrophobicContact CD2-CE 4.24Å; F141-M216 HydrophobicContact CE2-CE 3.71Å; F141-M216 HydrophobicContact CE2-SD 3.6Å; F141-M216 HydrophobicContact CZ-CE 4.34Å; F141-M216 HydrophobicContact CZ-SD 3.62Å; F141-M234 HydrophobicContact CD2-CE 4.3Å; F141-M234 HydrophobicContact CE2-CE 3.71Å; F141-M234 HydrophobicContact CE2-CG 4.04Å; F141-M234 HydrophobicContact CZ-CG 4.07Å; F141-L238 HydrophobicContact CD1-CB 4.45Å; F141-L238 HydrophobicContact CD1-CD1 3.51Å; F141-L238 HydrophobicContact CE1-CB 3.84Å; F141-L238 HydrophobicContact CE1-CD1 3.78Å; F141-L238 HydrophobicContact CE1-CG 4.45Å; F141-L238 HydrophobicContact CG-CD1 4.13Å; F141-L238 HydrophobicContact CZ-CB 4.29Å
142T95.1Very high89.9Confident44 Ų4464.6 Ų64.627%0.2733%0.333SS..Hα-helixtrans-64.2-42.9174.6-54.10000111.4M138 I139 I140 A145 Y146 W242M138-T142 WeakPolarHBondContact O-CB 3.45Å; M138-T142 PolarHBondContact O-N 2.92Å; M138-T142 PolarHBondContact O-OG1 2.89Å; I139-T142 PolarHBondContact O-N 3.32Å; I140-T142 PolarHBondContact O-N 3.41Å; T142-A145 PolarHBondContact O-N 3.33Å; T142-Y146 WeakPolarHBondContact O-CB 3.48Å; T142-Y146 PolarHBondContact O-N 3.46Å; T142-W242 WeakPolarHBondContact OG1-CZ2 3.16Å; T142-W242 PolarHBondContact OG1-NE1 2.79Å
143T92.5Very high89Confident62 Ų6264.1 Ų64.138%0.3834%0.336SS..Hα-helixtrans-62.9-43.5177.6-56.40000111.1I139 I140 Y146 Y147I139-T143 WeakPolarHBondContact O-CB 3.27Å; I139-T143 PolarHBondContact O-N 3.22Å; I139-T143 PolarHBondContact O-OG1 3.39Å; I140-T143 PolarHBondContact O-N 2.9Å; T143-Y146 PolarHBondContact O-N 2.79Å; T143-Y147 HydrophobicContact CG2-CD2 3.56Å; T143-Y147 HydrophobicContact CG2-CE2 3.63Å; T143-Y147 VanDerWaalsContact O-CD2 3.28Å; T143-Y147 WeakPolarHBondContact O-CD2 3.45Å; T143-Y147 PolarHBondContact O-N 2.98Å
144A90.6Very high88.3Confident5 Ų560.8 Ų60.84%0.04132%0.316CS..Hα-helixtrans-64.4-38.9175.500000112.3I140 F141 E171I140-A144 WeakPolarHBondContact O-CB 3.27Å; I140-A144 PolarHBondContact O-N 3.05Å; F141-A144 PolarHBondContact O-N 2.98Å; A144-E171 HydrophobicContact CB-CG 4.21Å
145A91.2Very high87.7Confident27 Ų2763.6 Ų63.622%0.22333%0.334CS..Hα-helixtrans-65.5-39.9175.100000112.7F141 T142 R148 M234 L238F141-A145 WeakPolarHBondContact O-CB 3.44Å; F141-A145 PolarHBondContact O-N 2.92Å; T142-A145 PolarHBondContact O-N 3.33Å; A145-R148 VanDerWaalsContact O-CB 3.32Å; A145-R148 WeakPolarHBondContact O-CB 3.16Å; A145-M234 VanDerWaalsContact CA-CE 3.48Å; A145-M234 HydrophobicContact CB-CE 3.57Å; A145-M234 HydrophobicContact CB-SD 4.47Å; A145-L238 HydrophobicContact CB-CD2 4.07Å
146Y90.9Very high87Confident181 Ų18164.5 Ų64.571%0.7134%0.335SS*.Hα-helixtrans-72.8-46.1-176.8-177.7-100.6000112.7T142 T143 R148T142-Y146 WeakPolarHBondContact O-CB 3.48Å; T142-Y146 PolarHBondContact O-N 3.46Å; T143-Y146 PolarHBondContact O-N 2.79Å; Y146-R148 PolarHBondContact O-N 2.87Å
147Y87.8Confident86.1Confident152 Ų15270 Ų7060%0.59636%0.356SS*.THydrogen-bonded Turntrans-82.215.6180-68.6-63.9000114.1T143 R167T143-Y147 HydrophobicContact CG2-CD2 3.56Å; T143-Y147 HydrophobicContact CG2-CE2 3.63Å; T143-Y147 VanDerWaalsContact O-CD2 3.28Å; T143-Y147 WeakPolarHBondContact O-CD2 3.45Å; T143-Y147 PolarHBondContact O-N 2.98Å; Y147-R167 VanDerWaalsContact O-CD 3.27Å; Y147-R167 WeakPolarHBondContact O-CD 3.19Å
148R84.3Confident85.1Confident49 Ų4972.6 Ų72.619%0.18537%0.37CS..  trans-66.6133.1178.5179.5179.2162.6-101.1-17.2110.5A145 Y146 V150 Y156 Y230A145-R148 VanDerWaalsContact O-CB 3.32Å; A145-R148 WeakPolarHBondContact O-CB 3.16Å; Y146-R148 PolarHBondContact O-N 2.87Å; R148-V150 PolarHBondContact O-N 2.9Å; R148-Y156 PolarHBondContact NH2-OH 3.46Å; R148-Y230 VanDerWaalsContact CZ-OH 3.25Å; R148-Y230 PolarHBondContact NE-OH 2.81Å; R148-Y230 VanDerWaalsContact NH2-CZ 3.27Å; R148-Y230 PolarHBondContact NH2-OH 3.39Å
149P82.6Confident84Confident34 Ų3477.7 Ų77.722%0.22140%0.398CS..  trans-67.4131.6174.627.7-33.6000110.8Y156P149-Y156 HydrophobicContact CB-CD1 4.29Å; P149-Y156 HydrophobicContact CB-CE1 4.37Å; P149-Y156 HydrophobicContact CB-CG 4.43Å; P149-Y156 HydrophobicContact CG-CD1 3.83Å; P149-Y156 HydrophobicContact CG-CD2 3.43Å; P149-Y156 VanDerWaalsContact CG-CD2 3.43Å; P149-Y156 HydrophobicContact CG-CE1 4.04Å; P149-Y156 HydrophobicContact CG-CE2 3.65Å; P149-Y156 HydrophobicContact CG-CG 3.52Å; P149-Y156 PolarHBondContact O-OH 3.19Å
150V76.9Confident83.2Confident129 Ų12979.9 Ų79.978%0.78241%0.411SS*.  trans-86.3-30.8-177.4-178.20000111.4R148R148-V150 PolarHBondContact O-N 2.9Å
151E72.6Confident82.7Confident175 Ų17581.1 Ų81.182%0.81842%0.42SS*.SBendtrans-91.9131.4-174.1-61.5-173176.700112.2Y156E151-Y156 WeakPolarHBondContact O-CE1 3.42Å
152G71.6Confident82.2Confident44 Ų4486 Ų8645%0.45445%0.451SS..SBendtrans108.7-179176.100000115.4
153L75.7Confident81.7Confident113 Ų11386.2 Ų86.259%0.59246%0.461SS*.PPolyproline II helixtrans-99.2136.5172-80.3151.1000108.9
154P81.1Confident81.2Confident1 Ų184.4 Ų84.41%0.00645%0.449CS..SBendtrans-65.7151.717030.2-34.2000109.9Y156 Y223 H226 Y230P154-Y156 HydrophobicContact CB-CE2 4.35Å; P154-Y223 HydrophobicContact CB-CD2 3.59Å; P154-Y223 HydrophobicContact CB-CE2 3.6Å; P154-Y223 HydrophobicContact CB-CG 4.22Å; P154-H226 PolarHBondContact O-ND1 3Å; P154-Y230 HydrophobicContact CB-CE1 4.04Å; P154-Y230 HydrophobicContact CG-CD1 4.24Å; P154-Y230 HydrophobicContact CG-CE1 3.73Å
155P81.1Confident81.1Confident63 Ų6389.8 Ų89.841%0.40947%0.469SS..SBendcis-74.9143.6-8.231.8-32.4000111.8Y223 H226P155-Y223 WeakPolarHBondContact CA-OH 3.39Å; P155-Y223 HydrophobicContact CB-CD1 4.49Å; P155-Y223 HydrophobicContact CB-CE1 3.57Å; P155-H226 WeakPolarHBondContact CD-CE1 3.49Å; P155-H226 WeakPolarHBondContact CD-ND1 3.46Å
156Y80.4Confident80.9Confident40 Ų4095.8 Ų95.816%0.15749%0.49CS..PPolyproline II helixtrans-80.4139.5-178.1-55.3-80.1000110.9R148 P149 E151 P154 L158 Y223 Y230R148-Y156 PolarHBondContact NH2-OH 3.46Å; P149-Y156 HydrophobicContact CB-CD1 4.29Å; P149-Y156 HydrophobicContact CB-CE1 4.37Å; P149-Y156 HydrophobicContact CB-CG 4.43Å; P149-Y156 HydrophobicContact CG-CD1 3.83Å; P149-Y156 HydrophobicContact CG-CD2 3.43Å; P149-Y156 VanDerWaalsContact CG-CD2 3.43Å; P149-Y156 HydrophobicContact CG-CE1 4.04Å; P149-Y156 HydrophobicContact CG-CE2 3.65Å; P149-Y156 HydrophobicContact CG-CG 3.52Å; P149-Y156 PolarHBondContact O-OH 3.19Å; E151-Y156 WeakPolarHBondContact O-CE1 3.42Å; P154-Y156 HydrophobicContact CB-CE2 4.35Å; Y156-L158 PolarHBondContact O-N 3.28Å; Y156-Y223 HydrophobicContact CD2-CE2 4.23Å; Y156-Y223 HydrophobicContact CE2-CE2 4.22Å; Y156-Y223 PolarHBondContact N-OH 3.13Å; Y156-Y230 WeakPolarHBondContact CE2-OH 3.45Å; Y156-Y230 PolarHBondContact OH-OH 3.45Å
157K76.8Confident80.7Confident190 Ų19088.8 Ų88.883%0.82646%0.463SS*.PPolyproline II helixtrans-65.5134.3174.2-68.7-176.2178.7-179.70109.5N159K157-N159 PolarHBondContact O-N 2.7Å
158L75.1Confident80.8Confident73 Ų7383.7 Ų83.738%0.38245%0.447SS..  trans-74110.7174.3-16579.4000108.5Y156 D164 Y165 V168Y156-L158 PolarHBondContact O-N 3.28Å; L158-D164 HydrophobicContact CD1-CB 3.91Å; L158-Y165 HydrophobicContact CD2-CD1 4.33Å; L158-Y165 HydrophobicContact CD2-CE1 3.8Å; L158-V168 HydrophobicContact CD1-CG2 3.65Å
159N72.8Confident81.1Confident109 Ų10985.5 Ų85.558%0.58346%0.464SS*.  trans-77.3132.9161.2-63.9-22000105.6K157 T161 D164K157-N159 PolarHBondContact O-N 2.7Å; N159-T161 PolarHBondContact O-N 3.49Å; N159-D164 WeakPolarHBondContact O-CB 3.36Å; N159-D164 VanDerWaalsContact O-OD2 3.09Å
160N78.1Confident81.5Confident133 Ų13384.4 Ų84.471%0.71146%0.459SS*.SBendtrans-71.244.7-173.6-67.2-30.4000113Y165N160-Y165 PolarHBondContact OD1-OH 3.47Å
161T85.3Confident82.1Confident78 Ų7880.6 Ų80.648%0.47943%0.432SS..  trans-92142.4179.1-36.60000109.3N159 G163 D164 Y165N159-T161 PolarHBondContact O-N 3.49Å; T161-G163 PolarHBondContact O-N 2.71Å; T161-G163 VanDerWaalsContact O-N 3.16Å; T161-D164 WeakPolarHBondContact CB-OD2 3.34Å; T161-D164 PolarHBondContact O-N 2.97Å; T161-D164 PolarHBondContact OG1-OD2 3.39Å; T161-Y165 VanDerWaalsContact O-CD2 3.28Å; T161-Y165 WeakPolarHBondContact O-CD2 3.47Å; T161-Y165 PolarHBondContact O-N 3.29Å
162V84.4Confident83.1Confident105 Ų10577.5 Ų77.564%0.63642%0.42SS*.Hα-helixtrans-52.6-39.6177.4179.80000112D164 Y165 F166V162-D164 PolarHBondContact O-N 3.49Å; V162-Y165 PolarHBondContact O-N 3.24Å; V162-F166 HydrophobicContact CG1-CD2 3.86Å; V162-F166 HydrophobicContact CG1-CE2 3.61Å; V162-F166 VanDerWaalsContact O-CD2 3.24Å; V162-F166 WeakPolarHBondContact O-CD2 3.1Å; V162-F166 PolarHBondContact O-N 2.9Å
163G83.6Confident84.2Confident48 Ų4879.3 Ų79.350%0.49542%0.419SS..Hα-helixtrans-64.7-35.3177.600000114.4T161 F166 R167T161-G163 PolarHBondContact O-N 2.71Å; T161-G163 VanDerWaalsContact O-N 3.16Å; G163-F166 PolarHBondContact O-N 3.32Å; G163-R167 PolarHBondContact O-N 2.98Å
164D83.3Confident85.1Confident24 Ų2474 Ų7413%0.12839%0.391CS..Hα-helixtrans-70.4-36.3178.3-73.8-52.6000111.4L158 N159 T161 V162 R167 V168L158-D164 HydrophobicContact CD1-CB 3.91Å; N159-D164 WeakPolarHBondContact O-CB 3.36Å; N159-D164 VanDerWaalsContact O-OD2 3.09Å; T161-D164 WeakPolarHBondContact CB-OD2 3.34Å; T161-D164 PolarHBondContact O-N 2.97Å; T161-D164 PolarHBondContact OG1-OD2 3.39Å; V162-D164 PolarHBondContact O-N 3.49Å; D164-R167 PolarHBondContact O-N 3.45Å; D164-R167 IonicContact OD1-CZ 3.71Å; D164-R167 IonicContact OD1-NH1 3.86Å; D164-R167 PolarHBondContact OD1-NH1 3.2Å; D164-R167 IonicContact OD1-NH2 2.75Å; D164-R167 PolarHBondContact OD1-NH2 2.86Å; D164-V168 WeakPolarHBondContact O-CG2 3.47Å; D164-V168 PolarHBondContact O-N 3.43Å
165Y87.4Confident85.7Confident117 Ų11776.1 Ų76.146%0.45940%0.404SS..Hα-helixtrans-63.4-43.1172.6-73.4-71.7000112.3L158 N160 T161 V162 T169L158-Y165 HydrophobicContact CD2-CD1 4.33Å; L158-Y165 HydrophobicContact CD2-CE1 3.8Å; N160-Y165 PolarHBondContact OD1-OH 3.47Å; T161-Y165 VanDerWaalsContact O-CD2 3.28Å; T161-Y165 WeakPolarHBondContact O-CD2 3.47Å; T161-Y165 PolarHBondContact O-N 3.29Å; V162-Y165 PolarHBondContact O-N 3.24Å; Y165-T169 WeakPolarHBondContact O-CB 3.25Å; Y165-T169 PolarHBondContact O-N 3.47Å; Y165-T169 PolarHBondContact O-OG1 3.27Å
166F87.4Confident86.4Confident153 Ų15375.9 Ų75.967%0.67140%0.404SS*.Hα-helixtrans-63.2-42.1175.5-82.9-68.3000112.1V162 G163 T169 G170V162-F166 HydrophobicContact CG1-CD2 3.86Å; V162-F166 HydrophobicContact CG1-CE2 3.61Å; V162-F166 VanDerWaalsContact O-CD2 3.24Å; V162-F166 WeakPolarHBondContact O-CD2 3.1Å; V162-F166 PolarHBondContact O-N 2.9Å; G163-F166 PolarHBondContact O-N 3.32Å; F166-T169 PolarHBondContact O-N 3.38Å; F166-G170 PolarHBondContact O-N 3.48Å
167R87.2Confident87Confident35 Ų3574.5 Ų74.513%0.13240%0.402CS..Hα-helixtrans-59.9-52.8175.9-175.7-175.770.1-130-11.7111.5Y147 G163 D164 T169 G170 E171Y147-R167 VanDerWaalsContact O-CD 3.27Å; Y147-R167 WeakPolarHBondContact O-CD 3.19Å; G163-R167 PolarHBondContact O-N 2.98Å; D164-R167 PolarHBondContact O-N 3.45Å; D164-R167 IonicContact OD1-CZ 3.71Å; D164-R167 IonicContact OD1-NH1 3.86Å; D164-R167 PolarHBondContact OD1-NH1 3.2Å; D164-R167 IonicContact OD1-NH2 2.75Å; D164-R167 PolarHBondContact OD1-NH2 2.86Å; R167-T169 VanDerWaalsContact C-N 3.27Å; R167-T169 PolarHBondContact O-N 2.98Å; R167-G170 CarbonylContact O-C 3.47Å; R167-G170 WeakPolarHBondContact O-CA 3.45Å; R167-G170 PolarHBondContact O-N 2.89Å; R167-E171 IonicContact NE-OE1 3.07Å; R167-E171 WeakPolarHBondContact O-CG 3.47Å; R167-E171 PolarHBondContact O-N 3.04Å
168V88.2Confident87.8Confident44 Ų4465.5 Ų65.527%0.26736%0.363SS..Hα-helixtrans-62.2-37.9-178.8170.80000111.3L158 D164 G170 E171 I172L158-V168 HydrophobicContact CD1-CG2 3.65Å; D164-V168 WeakPolarHBondContact O-CG2 3.47Å; D164-V168 PolarHBondContact O-N 3.43Å; V168-G170 VanDerWaalsContact C-N 3.33Å; V168-G170 PolarHBondContact O-N 3.35Å; V168-E171 PolarHBondContact O-N 2.86Å; V168-I172 HydrophobicContact CG1-CD1 3.8Å; V168-I172 HydrophobicContact CG1-CG1 4.34Å; V168-I172 VanDerWaalsContact O-CG1 3.27Å; V168-I172 WeakPolarHBondContact O-CG1 3.48Å; V168-I172 PolarHBondContact O-N 3.43Å
169T91.1Very high88.8Confident88 Ų8864.4 Ų64.454%0.5436%0.36SS..Hα-helixtrans-60.8-43.8173.6-55.70000111.2Y165 F166 R167 I172 L173Y165-T169 WeakPolarHBondContact O-CB 3.25Å; Y165-T169 PolarHBondContact O-N 3.47Å; Y165-T169 PolarHBondContact O-OG1 3.27Å; F166-T169 PolarHBondContact O-N 3.38Å; R167-T169 VanDerWaalsContact C-N 3.27Å; R167-T169 PolarHBondContact O-N 2.98Å; T169-I172 PolarHBondContact O-N 3.21Å; T169-L173 WeakPolarHBondContact O-CB 3.31Å; T169-L173 PolarHBondContact O-N 2.9Å
170G91.3Very high89.8Confident10 Ų1065.6 Ų65.610%0.10336%0.357CS..Hα-helixtrans-64.2-38.9175.200000113.5F166 R167 V168 L173 S174F166-G170 PolarHBondContact O-N 3.48Å; R167-G170 CarbonylContact O-C 3.47Å; R167-G170 WeakPolarHBondContact O-CA 3.45Å; R167-G170 PolarHBondContact O-N 2.89Å; V168-G170 VanDerWaalsContact C-N 3.33Å; V168-G170 PolarHBondContact O-N 3.35Å; G170-L173 PolarHBondContact O-N 2.88Å; G170-S174 WeakPolarHBondContact O-CB 3.32Å; G170-S174 PolarHBondContact O-N 3.39Å; G170-S174 PolarHBondContact O-OG 3.42Å
171E90.9Very high90.5Very high50 Ų5060.1 Ų60.123%0.23433%0.327CS..Hα-helixtrans-64.1-48174.6-71.8174.1-17600111.3A144 R167 V168 L173 S174 V175A144-E171 HydrophobicContact CB-CG 4.21Å; R167-E171 IonicContact NE-OE1 3.07Å; R167-E171 WeakPolarHBondContact O-CG 3.47Å; R167-E171 PolarHBondContact O-N 3.04Å; V168-E171 PolarHBondContact O-N 2.86Å; E171-L173 VanDerWaalsContact C-N 3.33Å; E171-L173 PolarHBondContact O-N 3Å; E171-S174 PolarHBondContact O-N 3.41Å; E171-V175 WeakPolarHBondContact O-CG2 3.37Å; E171-V175 PolarHBondContact O-N 3.43Å
172I92.6Very high90.9Very high109 Ų10958.8 Ų58.856%0.55931%0.314SS*.Hα-helixtrans-59.3-45.9176.8-68.4165.7000110.4V168 T169 S174 V175 S176V168-I172 HydrophobicContact CG1-CD1 3.8Å; V168-I172 HydrophobicContact CG1-CG1 4.34Å; V168-I172 VanDerWaalsContact O-CG1 3.27Å; V168-I172 WeakPolarHBondContact O-CG1 3.48Å; V168-I172 PolarHBondContact O-N 3.43Å; T169-I172 PolarHBondContact O-N 3.21Å; I172-S174 VanDerWaalsContact C-N 3.33Å; I172-S174 PolarHBondContact O-N 2.98Å; I172-V175 PolarHBondContact O-N 2.95Å; I172-S176 WeakPolarHBondContact O-CB 3.05Å; I172-S176 PolarHBondContact O-N 3.15Å; I172-S176 PolarHBondContact O-OG 3.24Å
173L94.3Very high91.2Very high82 Ų8260.1 Ų60.143%0.42931%0.312SS..Hα-helixtrans-63.5-40.7178.5-170.762.6000111.4I140 T169 G170 E171 S176 G177I140-L173 HydrophobicContact CD1-CD2 3.45Å; I140-L173 VanDerWaalsContact CD1-CD2 3.45Å; I140-L173 HydrophobicContact CG2-CD2 4.23Å; T169-L173 WeakPolarHBondContact O-CB 3.31Å; T169-L173 PolarHBondContact O-N 2.9Å; G170-L173 PolarHBondContact O-N 2.88Å; E171-L173 VanDerWaalsContact C-N 3.33Å; E171-L173 PolarHBondContact O-N 3Å; L173-S176 WeakPolarHBondContact CA-OG 3.35Å; L173-S176 PolarHBondContact O-N 2.9Å; L173-S176 PolarHBondContact O-OG 3.45Å; L173-G177 PolarHBondContact O-N 3.4Å
174S94.2Very high91.4Very high1 Ų161.4 Ų61.41%0.00730%0.302CS..Hα-helixtrans-63.7-43.5176.9-57.50000111.8F141 G170 E171 I172 G177 G178F141-S174 WeakPolarHBondContact CA-OG 3.41Å; G170-S174 WeakPolarHBondContact O-CB 3.32Å; G170-S174 PolarHBondContact O-N 3.39Å; G170-S174 PolarHBondContact O-OG 3.42Å; E171-S174 PolarHBondContact O-N 3.41Å; I172-S174 VanDerWaalsContact C-N 3.33Å; I172-S174 PolarHBondContact O-N 2.98Å; S174-G177 PolarHBondContact O-N 3.12Å; S174-G178 PolarHBondContact O-N 2.96Å
175V94.9Very high91.6Very high46 Ų4660.5 Ų60.528%0.27930%0.298SS..Hα-helixtrans-65-43175.71740000110.9E171 I172 G177 G178 V179 M216 V220E171-V175 WeakPolarHBondContact O-CG2 3.37Å; E171-V175 PolarHBondContact O-N 3.43Å; I172-V175 PolarHBondContact O-N 2.95Å; V175-G177 VanDerWaalsContact C-N 3.31Å; V175-G177 PolarHBondContact O-N 2.58Å; V175-G178 PolarHBondContact O-N 3.48Å; V175-G178 VanDerWaalsContact O-N 3.15Å; V175-V179 HydrophobicContact CG1-CG2 4.36Å; V175-V179 WeakPolarHBondContact O-CG2 3.43Å; V175-V179 PolarHBondContact O-N 3.34Å; V175-M216 HydrophobicContact CG2-CE 3.91Å; V175-V220 HydrophobicContact CB-CG2 4.48Å; V175-V220 HydrophobicContact CG1-CG2 4.1Å; V175-V220 HydrophobicContact CG2-CG2 3.58Å
176S94.8Very high91.6Very high58 Ų5857.6 Ų57.641%0.40629%0.29SS..Hα-helixtrans-60.6-40.1177.977.10000112.2I172 L173 V179 Y180I172-S176 WeakPolarHBondContact O-CB 3.05Å; I172-S176 PolarHBondContact O-N 3.15Å; I172-S176 PolarHBondContact O-OG 3.24Å; L173-S176 WeakPolarHBondContact CA-OG 3.35Å; L173-S176 PolarHBondContact O-N 2.9Å; L173-S176 PolarHBondContact O-OG 3.45Å; S176-V179 PolarHBondContact O-N 2.93Å; S176-Y180 WeakPolarHBondContact O-CB 3.33Å; S176-Y180 PolarHBondContact O-N 3.4Å
177G93.3Very high91.5Very high12 Ų1255.4 Ų55.412%0.12428%0.282CS..Hα-helixtrans-65.1-43.2173.300000112.3L173 S174 V175 V179 Y180 F181L173-G177 PolarHBondContact O-N 3.4Å; S174-G177 PolarHBondContact O-N 3.12Å; V175-G177 VanDerWaalsContact C-N 3.31Å; V175-G177 PolarHBondContact O-N 2.58Å; G177-V179 PolarHBondContact O-N 2.69Å; G177-Y180 WeakPolarHBondContact O-CB 3.43Å; G177-Y180 PolarHBondContact O-N 3.07Å; G177-F181 WeakPolarHBondContact O-CD2 3.34Å; G177-F181 PolarHBondContact O-N 2.83Å
178G94Very high91.2Very high0 Ų054.8 Ų54.80%028%0.28CS..Hα-helixtrans-58.3-44.6174.100000112.9S174 V175 F181 F182 S213S174-G178 PolarHBondContact O-N 2.96Å; V175-G178 PolarHBondContact O-N 3.48Å; V175-G178 VanDerWaalsContact O-N 3.15Å; G178-F181 PolarHBondContact O-N 3.32Å; G178-F182 WeakPolarHBondContact O-CB 3.41Å; G178-F182 PolarHBondContact O-N 3.18Å; G178-S213 WeakPolarHBondContact O-CB 3.41Å
179V95.5Very high90.9Very high51 Ų5155.3 Ų55.331%0.30928%0.278SS..Hα-helixtrans-63.6-43175.7172.40000111.3V175 S176 G177 F182 F183 L217V175-V179 HydrophobicContact CG1-CG2 4.36Å; V175-V179 WeakPolarHBondContact O-CG2 3.43Å; V175-V179 PolarHBondContact O-N 3.34Å; S176-V179 PolarHBondContact O-N 2.93Å; G177-V179 PolarHBondContact O-N 2.69Å; V179-F182 WeakPolarHBondContact O-CB 3.5Å; V179-F182 PolarHBondContact O-N 2.86Å; V179-F183 HydrophobicContact CG1-CD2 3.58Å; V179-F183 HydrophobicContact CG1-CE2 3.35Å; V179-F183 WeakPolarHBondContact O-CD2 3.33Å; V179-F183 PolarHBondContact O-N 3.24Å; V179-L217 HydrophobicContact CG2-CD2 3.9Å
180Y93.4Very high90.3Very high133 Ų13357 Ų5752%0.52228%0.284SS..Hα-helixtrans-59-48.4175.3169.8-97.5000112.1S176 G177 F182 F183 R184S176-Y180 WeakPolarHBondContact O-CB 3.33Å; S176-Y180 PolarHBondContact O-N 3.4Å; G177-Y180 WeakPolarHBondContact O-CB 3.43Å; G177-Y180 PolarHBondContact O-N 3.07Å; Y180-F182 VanDerWaalsContact C-N 3.29Å; Y180-F182 PolarHBondContact O-N 3.4Å; Y180-F183 PolarHBondContact O-N 3.3Å; Y180-R184 WeakPolarHBondContact O-CB 3.36Å; Y180-R184 PolarHBondContact O-N 3.41Å
181F93.1Very high89.4Confident19 Ų1962.7 Ų62.78%0.08331%0.307CS..Hα-helixtrans-64.3-34.8177.5-73.9-58.4000112.4Y134 Y137 G177 G178 G185 F209Y134-F181 HydrophobicContact CD2-CE2 4.16Å; Y134-F181 AromaticContact CD2-CZ 3.7Å; Y134-F181 HydrophobicContact CD2-CZ 3.7Å; Y134-F181 AromaticContact CE2-CE2 4Å; Y134-F181 HydrophobicContact CE2-CE2 4Å; Y134-F181 AromaticContact CE2-CZ 3.84Å; Y134-F181 HydrophobicContact CE2-CZ 3.84Å; Y137-F181 HydrophobicContact CD1-CE2 4.34Å; Y137-F181 HydrophobicContact CE1-CE2 4.19Å; G177-F181 WeakPolarHBondContact O-CD2 3.34Å; G177-F181 PolarHBondContact O-N 2.83Å; G178-F181 PolarHBondContact O-N 3.32Å; F181-G185 PolarHBondContact O-N 2.85Å; F181-F209 HydrophobicContact CD1-CD1 4.47Å; F181-F209 HydrophobicContact CE1-CD1 4.45Å
182F93.9Very high88.3Confident50 Ų5063.3 Ų63.322%0.21931%0.307CS..Hα-helixtrans-64.6-49.2175.8-175.7-107.5000112.1G178 V179 Y180 G185 I186 F210 S213 L217G178-F182 WeakPolarHBondContact O-CB 3.41Å; G178-F182 PolarHBondContact O-N 3.18Å; V179-F182 WeakPolarHBondContact O-CB 3.5Å; V179-F182 PolarHBondContact O-N 2.86Å; Y180-F182 VanDerWaalsContact C-N 3.29Å; Y180-F182 PolarHBondContact O-N 3.4Å; F182-G185 PolarHBondContact O-N 2.92Å; F182-I186 HydrophobicContact CD1-CD1 3.68Å; F182-I186 HydrophobicContact CE1-CD1 3.25Å; F182-I186 HydrophobicContact CE1-CG1 4.36Å; F182-I186 HydrophobicContact CE2-CD1 4.31Å; F182-I186 HydrophobicContact CG-CD1 4.39Å; F182-I186 HydrophobicContact CZ-CD1 3.61Å; F182-I186 HydrophobicContact CZ-CG1 4.42Å; F182-I186 WeakPolarHBondContact O-CG1 3.28Å; F182-I186 PolarHBondContact O-N 3.46Å; F182-F210 HydrophobicContact CD2-CD2 4.25Å; F182-F210 AromaticContact CD2-CE2 3.63Å; F182-F210 HydrophobicContact CD2-CE2 3.63Å; F182-F210 HydrophobicContact CD2-CZ 4.33Å; F182-F210 AromaticContact CE2-CE2 3.64Å; F182-F210 HydrophobicContact CE2-CE2 3.64Å; F182-F210 AromaticContact CE2-CZ 3.93Å; F182-F210 HydrophobicContact CE2-CZ 3.93Å; F182-S213 WeakPolarHBondContact CA-OG 3.33Å; F182-L217 HydrophobicContact CB-CD1 3.89Å; F182-L217 HydrophobicContact CD1-CD1 3.78Å; F182-L217 HydrophobicContact CD2-CD1 3.55Å; F182-L217 HydrophobicContact CE1-CD1 4.11Å; F182-L217 HydrophobicContact CE2-CD1 3.92Å; F182-L217 HydrophobicContact CG-CD1 3.46Å; F182-L217 VanDerWaalsContact CG-CD1 3.46Å; F182-L217 HydrophobicContact CZ-CD1 4.18Å
183F91.3Very high86.9Confident132 Ų13268.6 Ų68.658%0.57932%0.321SS*.Hα-helixtrans-64.3-40.9176.4-77.3-62.5000112.4V179 Y180 G185 I186 Q187V179-F183 HydrophobicContact CG1-CD2 3.58Å; V179-F183 HydrophobicContact CG1-CE2 3.35Å; V179-F183 WeakPolarHBondContact O-CD2 3.33Å; V179-F183 PolarHBondContact O-N 3.24Å; Y180-F183 PolarHBondContact O-N 3.3Å; F183-G185 VanDerWaalsContact C-N 3.31Å; F183-G185 PolarHBondContact O-N 3.32Å; F183-I186 PolarHBondContact O-N 3.27Å; F183-Q187 WeakPolarHBondContact O-CB 3.37Å; F183-Q187 PolarHBondContact O-N 2.96Å
184R87.3Confident85.4Confident75 Ų7566.2 Ų66.228%0.28331%0.31SS..Hα-helixtrans-59-44.3173.3178.8-178.6156.3-178.7-7.4111Y180 Q187 Y188 E206Y180-R184 WeakPolarHBondContact O-CB 3.36Å; Y180-R184 PolarHBondContact O-N 3.41Å; R184-Q187 PolarHBondContact O-N 2.99Å; R184-Y188 WeakPolarHBondContact O-CB 3.29Å; R184-Y188 PolarHBondContact O-N 3.4Å; R184-E206 IonicContact NE-OE2 3.96Å; R184-E206 IonicContact NH2-OE1 2.99Å; R184-E206 PolarHBondContact NH2-OE1 3.46Å; R184-E206 VanDerWaalsContact NH2-OE1 3.12Å; R184-E206 IonicContact NH2-OE2 3.85Å; R184-E206 PolarHBondContact NH2-OE2 3.23Å
185G87.6Confident83.8Confident5 Ų569.2 Ų69.25%0.05233%0.331CS..Hα-helixtrans-61.9-46176.200000112.4F181 F182 F183 Q187 Y188 F189F181-G185 PolarHBondContact O-N 2.85Å; F182-G185 PolarHBondContact O-N 2.92Å; F183-G185 VanDerWaalsContact C-N 3.31Å; F183-G185 PolarHBondContact O-N 3.32Å; G185-Q187 PolarHBondContact O-N 2.88Å; G185-Y188 WeakPolarHBondContact O-CB 3.39Å; G185-Y188 PolarHBondContact O-N 2.85Å; G185-F189 WeakPolarHBondContact O-CD2 3.1Å; G185-F189 PolarHBondContact O-N 3.39Å
186I87.5Confident81.9Confident56 Ų5673.5 Ų73.529%0.28735%0.351SS..Hα-helixtrans-59.8-47.6175.3-70.6170.8000111.1F182 F183 Y188 F189 L190 F210F182-I186 HydrophobicContact CD1-CD1 3.68Å; F182-I186 HydrophobicContact CE1-CD1 3.25Å; F182-I186 HydrophobicContact CE1-CG1 4.36Å; F182-I186 HydrophobicContact CE2-CD1 4.31Å; F182-I186 HydrophobicContact CG-CD1 4.39Å; F182-I186 HydrophobicContact CZ-CD1 3.61Å; F182-I186 HydrophobicContact CZ-CG1 4.42Å; F182-I186 WeakPolarHBondContact O-CG1 3.28Å; F182-I186 PolarHBondContact O-N 3.46Å; F183-I186 PolarHBondContact O-N 3.27Å; I186-Y188 VanDerWaalsContact C-N 3.25Å; I186-Y188 PolarHBondContact O-N 3.25Å; I186-F189 PolarHBondContact O-N 2.9Å; I186-L190 HydrophobicContact CG2-CD1 3.61Å; I186-L190 HydrophobicContact CG2-CG 4.11Å; I186-L190 WeakPolarHBondContact O-CB 3.28Å; I186-L190 WeakPolarHBondContact O-CG 3.37Å; I186-L190 PolarHBondContact O-N 2.93Å; I186-F210 HydrophobicContact CG1-CE2 4.21Å
187Q85.3Confident80.3Confident107 Ų10778.7 Ų78.750%0.537%0.367SS..Hα-helixtrans-58.4-41.5177.7-178.2179.9-23.300111.1F183 R184 G185 L190 Q191F183-Q187 WeakPolarHBondContact O-CB 3.37Å; F183-Q187 PolarHBondContact O-N 2.96Å; R184-Q187 PolarHBondContact O-N 2.99Å; G185-Q187 PolarHBondContact O-N 2.88Å; Q187-L190 PolarHBondContact O-N 3.21Å; Q187-Q191 HydrophobicContact CG-CG 4.39Å; Q187-Q191 VanDerWaalsContact NE2-NE2 3.19Å; Q187-Q191 WeakPolarHBondContact O-CB 3.29Å; Q187-Q191 VanDerWaalsContact O-CG 3.28Å; Q187-Q191 WeakPolarHBondContact O-CG 3.5Å; Q187-Q191 PolarHBondContact O-N 3.35Å
188Y80.8Confident78.8Confident23 Ų2379 Ų799%0.0937%0.367CS..Hα-helixtrans-60.4-48.9175.7176.8-91.4000112.2R184 G185 I186 R192 S203 E206R184-Y188 WeakPolarHBondContact O-CB 3.29Å; R184-Y188 PolarHBondContact O-N 3.4Å; G185-Y188 WeakPolarHBondContact O-CB 3.39Å; G185-Y188 PolarHBondContact O-N 2.85Å; I186-Y188 VanDerWaalsContact C-N 3.25Å; I186-Y188 PolarHBondContact O-N 3.25Å; Y188-R192 VanDerWaalsContact CE2-NH1 3.35Å; Y188-R192 PolarHBondContact O-N 3.06Å; Y188-R192 VanDerWaalsContact O-N 3.15Å; Y188-R192 PolarHBondContact OH-NH1 3.28Å; Y188-S203 WeakPolarHBondContact OH-CB 3.38Å; Y188-S203 PolarHBondContact OH-OG 3.14Å; Y188-E206 HydrophobicContact CD1-CB 4.33Å; Y188-E206 HydrophobicContact CD2-CG 4.37Å; Y188-E206 HydrophobicContact CE1-CB 3.99Å; Y188-E206 HydrophobicContact CE1-CG 4.41Å; Y188-E206 HydrophobicContact CE2-CB 4.37Å; Y188-E206 HydrophobicContact CE2-CG 3.9Å
189F81.3Confident77.2Confident54 Ų5479.8 Ų79.824%0.23737%0.371CS..Hα-helixtrans-65.4-40.2178.1-72.9-65.9000112.8G185 I186 R193 P194 L199 I207 F210G185-F189 WeakPolarHBondContact O-CD2 3.1Å; G185-F189 PolarHBondContact O-N 3.39Å; I186-F189 PolarHBondContact O-N 2.9Å; F189-R193 WeakPolarHBondContact O-CA 3.35Å; F189-R193 PolarHBondContact O-N 3.38Å; F189-P194 HydrophobicContact CD1-CG 4.31Å; F189-L199 HydrophobicContact CD1-CD2 4.36Å; F189-L199 HydrophobicContact CE1-CD1 3.98Å; F189-L199 HydrophobicContact CE1-CD2 3.76Å; F189-I207 HydrophobicContact CZ-CG1 4.35Å; F189-F210 HydrophobicContact CE2-CB 4.07Å; F189-F210 AromaticContact CE2-CD1 3.72Å; F189-F210 HydrophobicContact CE2-CD1 3.72Å; F189-F210 HydrophobicContact CE2-CD2 4.05Å; F189-F210 HydrophobicContact CE2-CE1 4.13Å; F189-F210 HydrophobicContact CE2-CE2 4.42Å; F189-F210 AromaticContact CE2-CG 3.67Å; F189-F210 HydrophobicContact CE2-CG 3.67Å; F189-F210 HydrophobicContact CE2-CZ 4.45Å; F189-F210 HydrophobicContact CZ-CD1 4.3Å; F189-F210 HydrophobicContact CZ-CG 4.47Å
190L78.9Confident75.5Confident125 Ų12583.5 Ų83.565%0.65438%0.383SS*.Hα-helixtrans-65.9-42.3178.8-74.5173.5000112.2I186 Q187I186-L190 HydrophobicContact CG2-CD1 3.61Å; I186-L190 HydrophobicContact CG2-CG 4.11Å; I186-L190 WeakPolarHBondContact O-CB 3.28Å; I186-L190 WeakPolarHBondContact O-CG 3.37Å; I186-L190 PolarHBondContact O-N 2.93Å; Q187-L190 PolarHBondContact O-N 3.21Å
191Q71.9Confident74.1Confident129 Ų12981.9 Ų81.960%0.60339%0.387SS*.Hα-helixtrans-71.7-35.1-179-73.9-175.63.400112.9Q187Q187-Q191 HydrophobicContact CG-CG 4.39Å; Q187-Q191 VanDerWaalsContact NE2-NE2 3.19Å; Q187-Q191 WeakPolarHBondContact O-CB 3.29Å; Q187-Q191 VanDerWaalsContact O-CG 3.28Å; Q187-Q191 WeakPolarHBondContact O-CG 3.5Å; Q187-Q191 PolarHBondContact O-N 3.35Å
192R67.6Low72.8Confident62 Ų6283.6 Ų83.623%0.23440%0.397CS..Hα-helixtrans-96.1-22.9-174.7-77.9-173.4-177.2179.712.2115Y188 P194 D400Y188-R192 VanDerWaalsContact CE2-NH1 3.35Å; Y188-R192 PolarHBondContact O-N 3.06Å; Y188-R192 VanDerWaalsContact O-N 3.15Å; Y188-R192 PolarHBondContact OH-NH1 3.28Å; R192-P194 VanDerWaalsContact C-CD 3.4Å; R192-P194 HydrophobicContact CB-CB 4.47Å; R192-P194 HydrophobicContact CB-CG 4.35Å; R192-P194 VanDerWaalsContact O-N 3.1Å; R192-D400 IonicContact CZ-OD1 3.61Å; R192-D400 IonicContact CZ-OD2 2.73Å; R192-D400 IonicContact NH2-OD1 2.93Å; R192-D400 PolarHBondContact NH2-OD1 3.38Å; R192-D400 IonicContact NH2-OD2 3.85Å; R192-D400 PolarHBondContact NH2-OD2 3.13Å
193R64.9Low71.7Confident221 Ų22181.7 Ų81.783%0.83439%0.39SS*.  trans29.756.7-165.8-74.4-148.7-175.2-170.33.8112.8F189F189-R193 WeakPolarHBondContact O-CA 3.35Å; F189-R193 PolarHBondContact O-N 3.38Å
194P63.1Low71.1Confident31 Ų3179.4 Ų79.420%0.20138%0.378CS..  trans-71.8146.9-168.530-34.4000111.1F189 R192 L199F189-P194 HydrophobicContact CD1-CG 4.31Å; R192-P194 VanDerWaalsContact C-CD 3.4Å; R192-P194 HydrophobicContact CB-CB 4.47Å; R192-P194 HydrophobicContact CB-CG 4.35Å; R192-P194 VanDerWaalsContact O-N 3.1Å; P194-L199 HydrophobicContact CB-CD1 4.49Å; P194-L199 HydrophobicContact CB-CD2 3.82Å; P194-L199 HydrophobicContact CB-CG 3.76Å; P194-L199 HydrophobicContact CG-CD1 3.86Å; P194-L199 HydrophobicContact CG-CD2 3.26Å; P194-L199 HydrophobicContact CG-CG 3.48Å; P194-L199 VanDerWaalsContact CG-CG 3.48Å
195S59.4Low70.8Confident65 Ų6576.4 Ų76.446%0.45537%0.369SS..  trans-70.4147.817268.60000110K197 S198 L199S195-K197 PolarHBondContact O-N 2.8Å; S195-K197 VanDerWaalsContact O-N 3.11Å; S195-S198 PolarHBondContact N-OG 2.97Å; S195-S198 PolarHBondContact O-N 3.2Å; S195-S198 PolarHBondContact O-OG 3.47Å; S195-S198 PolarHBondContact OG-OG 3.23Å; S195-L199 PolarHBondContact O-N 3.5Å
196L55.9Low70.6Confident135 Ų13576.8 Ų76.871%0.70737%0.369SS*.Hα-helixtrans-54-36.2-176.4-70.2173.6000113.2L199 F200L196-L199 WeakPolarHBondContact O-CB 3.42Å; L196-L199 PolarHBondContact O-N 3.41Å; L196-F200 WeakPolarHBondContact O-CD2 3.32Å; L196-F200 PolarHBondContact O-N 3.48Å
197K60.6Low70.6Confident168 Ų16875.5 Ų75.573%0.7336%0.363SS*.Hα-helixtrans-68-41.4177.4-67.1-174.5179-178.90112.7S195 L199 V201S195-K197 PolarHBondContact O-N 2.8Å; S195-K197 VanDerWaalsContact O-N 3.11Å; K197-L199 VanDerWaalsContact C-N 3.29Å; K197-L199 PolarHBondContact O-N 3.14Å; K197-V201 PolarHBondContact O-N 2.97Å
198S62.5Low70.8Confident18 Ų1871.8 Ų71.813%0.12635%0.346CS..Hα-helixtrans-68.4-30.3177.568.30000112.7S195 D202S195-S198 PolarHBondContact N-OG 2.97Å; S195-S198 PolarHBondContact O-N 3.2Å; S195-S198 PolarHBondContact O-OG 3.47Å; S195-S198 PolarHBondContact OG-OG 3.23Å; S198-D202 PolarHBondContact O-N 2.88Å; S198-D202 VanDerWaalsContact O-N 3.08Å
199L59.4Low71.3Confident17 Ų1771.1 Ų71.19%0.08934%0.344CS..Hα-helixtrans-63.9-48.9176.8-87.1-179.3000112.6F189 P194 S195 L196 K197 S203 Y204 I207F189-L199 HydrophobicContact CD1-CD2 4.36Å; F189-L199 HydrophobicContact CE1-CD1 3.98Å; F189-L199 HydrophobicContact CE1-CD2 3.76Å; P194-L199 HydrophobicContact CB-CD1 4.49Å; P194-L199 HydrophobicContact CB-CD2 3.82Å; P194-L199 HydrophobicContact CB-CG 3.76Å; P194-L199 HydrophobicContact CG-CD1 3.86Å; P194-L199 HydrophobicContact CG-CD2 3.26Å; P194-L199 HydrophobicContact CG-CG 3.48Å; P194-L199 VanDerWaalsContact CG-CG 3.48Å; S195-L199 PolarHBondContact O-N 3.5Å; L196-L199 WeakPolarHBondContact O-CB 3.42Å; L196-L199 PolarHBondContact O-N 3.41Å; K197-L199 VanDerWaalsContact C-N 3.29Å; K197-L199 PolarHBondContact O-N 3.14Å; L199-S203 CarbonylContact O-C 3.27Å; L199-S203 VanDerWaalsContact O-C 3.27Å; L199-S203 WeakPolarHBondContact O-CA 3.47Å; L199-S203 PolarHBondContact O-N 2.97Å; L199-Y204 PolarHBondContact O-N 2.91Å; L199-I207 HydrophobicContact CB-CD1 3.78Å; L199-I207 HydrophobicContact CD2-CD1 4.11Å; L199-I207 HydrophobicContact CD2-CG1 4.28Å; L199-I207 HydrophobicContact CG-CD1 4.41Å; L199-I207 WeakPolarHBondContact O-CD1 3.39Å
200F60.7Low71.9Confident128 Ų12870.7 Ų70.756%0.56134%0.342SS*.Hα-helixtrans-71.9-31.6-176.9-85.5-78000113.9L196L196-F200 WeakPolarHBondContact O-CD2 3.32Å; L196-F200 PolarHBondContact O-N 3.48Å
201V63.5Low72.5Confident99 Ų9966.8 Ų66.860%0.632%0.323SS*.Hα-helixtrans-92.6-41.9-174.3-179.80000112.7K197K197-V201 PolarHBondContact O-N 2.97Å
202D64.8Low73.6Confident56 Ų5660.6 Ų60.630%0.29929%0.294SS..Hα-helixtrans-104.6-20.5-172.3-66.9-26.1000113.4R102 S198R102-D202 IonicContact CZ-OD2 3.94Å; R102-D202 IonicContact NH1-OD1 2.9Å; R102-D202 IonicContact NH1-OD2 3.54Å; R102-D202 PolarHBondContact NH1-OD2 3.22Å; S198-D202 PolarHBondContact O-N 2.88Å; S198-D202 VanDerWaalsContact O-N 3.08Å
203S71Confident75Confident10 Ų1057.7 Ų57.77%0.0728%0.283CS..  trans-127.317.6-167.8-57.30000114.8Y188 L199 S205 E206 I207Y188-S203 WeakPolarHBondContact OH-CB 3.38Å; Y188-S203 PolarHBondContact OH-OG 3.14Å; L199-S203 CarbonylContact O-C 3.27Å; L199-S203 VanDerWaalsContact O-C 3.27Å; L199-S203 WeakPolarHBondContact O-CA 3.47Å; L199-S203 PolarHBondContact O-N 2.97Å; S203-S205 VanDerWaalsContact C-N 3.26Å; S203-S205 PolarHBondContact O-N 3.09Å; S203-E206 PolarHBondContact O-N 2.9Å; S203-E206 VanDerWaalsContact O-N 3.1Å; S203-I207 PolarHBondContact O-N 2.94Å
204Y78.6Confident76.4Confident83 Ų8351 Ų5133%0.32526%0.264SS..Hα-helixtrans-55.8-38.2-175.4172.9-108.4000113.4L199 E206 I207 L208L199-Y204 PolarHBondContact O-N 2.91Å; Y204-E206 VanDerWaalsContact C-N 3.35Å; Y204-E206 PolarHBondContact O-N 3.05Å; Y204-I207 WeakPolarHBondContact O-CB 3.45Å; Y204-I207 PolarHBondContact O-N 2.86Å; Y204-I207 VanDerWaalsContact O-N 3.17Å; Y204-L208 HydrophobicContact CD1-CD1 3.86Å; Y204-L208 HydrophobicContact CD1-CG 4.16Å; Y204-L208 HydrophobicContact CD2-CG 4.35Å; Y204-L208 HydrophobicContact CE1-CD1 3.18Å; Y204-L208 HydrophobicContact CE1-CD2 4.27Å; Y204-L208 HydrophobicContact CE1-CG 3.67Å; Y204-L208 HydrophobicContact CE2-CD1 4.3Å; Y204-L208 HydrophobicContact CE2-CD2 3.91Å; Y204-L208 HydrophobicContact CE2-CG 3.86Å; Y204-L208 HydrophobicContact CG-CG 4.49Å; Y204-L208 VanDerWaalsContact CZ-CD1 3.45Å; Y204-L208 VanDerWaalsContact CZ-CG 3.5Å; Y204-L208 PolarHBondContact O-N 2.88Å; Y204-L208 WeakPolarHBondContact OH-CD2 3.4Å
205S81.6Confident77.9Confident13 Ų1352.9 Ų52.99%0.09127%0.269CS..Hα-helixtrans-60.9-40.2178.354.90000113.2S203 I207 L208 F209 R250S203-S205 VanDerWaalsContact C-N 3.26Å; S203-S205 PolarHBondContact O-N 3.09Å; S205-I207 VanDerWaalsContact C-N 3.34Å; S205-L208 PolarHBondContact O-N 3.12Å; S205-F209 WeakPolarHBondContact O-CD2 3.37Å; S205-F209 PolarHBondContact O-N 3.31Å; S205-F209 VanDerWaalsContact O-N 3.09Å; S205-R250 PolarHBondContact OG-NH1 2.86Å
206E84.2Confident79.6Confident13 Ų1350.4 Ų50.46%0.06125%0.25CC..Hα-helixtrans-70-34177.6-65.4-67152.200111.1R184 Y188 S203 Y204 F209 F210R184-E206 IonicContact NE-OE2 3.96Å; R184-E206 IonicContact NH2-OE1 2.99Å; R184-E206 PolarHBondContact NH2-OE1 3.46Å; R184-E206 VanDerWaalsContact NH2-OE1 3.12Å; R184-E206 IonicContact NH2-OE2 3.85Å; R184-E206 PolarHBondContact NH2-OE2 3.23Å; Y188-E206 HydrophobicContact CD1-CB 4.33Å; Y188-E206 HydrophobicContact CD2-CG 4.37Å; Y188-E206 HydrophobicContact CE1-CB 3.99Å; Y188-E206 HydrophobicContact CE1-CG 4.41Å; Y188-E206 HydrophobicContact CE2-CB 4.37Å; Y188-E206 HydrophobicContact CE2-CG 3.9Å; S203-E206 PolarHBondContact O-N 2.9Å; S203-E206 VanDerWaalsContact O-N 3.1Å; Y204-E206 VanDerWaalsContact C-N 3.35Å; Y204-E206 PolarHBondContact O-N 3.05Å; E206-F209 PolarHBondContact O-N 3.42Å; E206-F210 WeakPolarHBondContact O-CB 3.48Å; E206-F210 PolarHBondContact O-N 3.35Å
207I86.8Confident81.5Confident29 Ų2945.9 Ų45.915%0.14923%0.226CC..Hα-helixtrans-64.2-43.2172.4-59.5170.6000110.2F189 L199 S203 Y204 S205 F209 F210 V211F189-I207 HydrophobicContact CZ-CG1 4.35Å; L199-I207 HydrophobicContact CB-CD1 3.78Å; L199-I207 HydrophobicContact CD2-CD1 4.11Å; L199-I207 HydrophobicContact CD2-CG1 4.28Å; L199-I207 HydrophobicContact CG-CD1 4.41Å; L199-I207 WeakPolarHBondContact O-CD1 3.39Å; S203-I207 PolarHBondContact O-N 2.94Å; Y204-I207 WeakPolarHBondContact O-CB 3.45Å; Y204-I207 PolarHBondContact O-N 2.86Å; Y204-I207 VanDerWaalsContact O-N 3.17Å; S205-I207 VanDerWaalsContact C-N 3.34Å; I207-F209 PolarHBondContact O-N 3.11Å; I207-F210 WeakPolarHBondContact O-CB 3.36Å; I207-F210 PolarHBondContact O-N 2.88Å; I207-F210 VanDerWaalsContact O-N 3.17Å; I207-V211 HydrophobicContact CG2-CG2 4.01Å; I207-V211 WeakPolarHBondContact O-CB 3.34Å; I207-V211 VanDerWaalsContact O-CG2 3.27Å; I207-V211 WeakPolarHBondContact O-CG2 3.42Å; I207-V211 PolarHBondContact O-N 3.04Å
208L89.4Confident83.1Confident29 Ų2940.8 Ų40.815%0.15221%0.209CC..Hα-helixtrans-62.7-40.1177.9-76.8-176.5000113Y204 S205 F210 V211 Q212 N244Y204-L208 HydrophobicContact CD1-CD1 3.86Å; Y204-L208 HydrophobicContact CD1-CG 4.16Å; Y204-L208 HydrophobicContact CD2-CG 4.35Å; Y204-L208 HydrophobicContact CE1-CD1 3.18Å; Y204-L208 HydrophobicContact CE1-CD2 4.27Å; Y204-L208 HydrophobicContact CE1-CG 3.67Å; Y204-L208 HydrophobicContact CE2-CD1 4.3Å; Y204-L208 HydrophobicContact CE2-CD2 3.91Å; Y204-L208 HydrophobicContact CE2-CG 3.86Å; Y204-L208 HydrophobicContact CG-CG 4.49Å; Y204-L208 VanDerWaalsContact CZ-CD1 3.45Å; Y204-L208 VanDerWaalsContact CZ-CG 3.5Å; Y204-L208 PolarHBondContact O-N 2.88Å; Y204-L208 WeakPolarHBondContact OH-CD2 3.4Å; S205-L208 PolarHBondContact O-N 3.12Å; L208-F210 VanDerWaalsContact C-N 3.34Å; L208-V211 PolarHBondContact O-N 3.22Å; L208-Q212 VanDerWaalsContact O-CB 3.25Å; L208-Q212 WeakPolarHBondContact O-CB 3.42Å; L208-Q212 PolarHBondContact O-N 3.34Å; L208-N244 WeakPolarHBondContact CB-OD1 3.42Å; L208-N244 PolarHBondContact O-ND2 3.45Å
209F91.9Very high84.6Confident8 Ų840.3 Ų40.34%0.03521%0.206CC..Hα-helixtrans-62.9-41.7172.4-78.7-69.4000111.6Y134 F181 S205 E206 I207 Q212 S213 N244 Y247 Y248Y134-F209 HydrophobicContact CD2-CE1 4.46Å; Y134-F209 HydrophobicContact CE1-CE1 4.37Å; Y134-F209 HydrophobicContact CE2-CD1 4.46Å; Y134-F209 AromaticContact CE2-CE1 3.74Å; Y134-F209 HydrophobicContact CE2-CE1 3.74Å; Y134-F209 AromaticContact CZ-CE1 3.68Å; F181-F209 HydrophobicContact CD1-CD1 4.47Å; F181-F209 HydrophobicContact CE1-CD1 4.45Å; S205-F209 WeakPolarHBondContact O-CD2 3.37Å; S205-F209 PolarHBondContact O-N 3.31Å; S205-F209 VanDerWaalsContact O-N 3.09Å; E206-F209 PolarHBondContact O-N 3.42Å; I207-F209 PolarHBondContact O-N 3.11Å; F209-Q212 PolarHBondContact O-N 3.13Å; F209-S213 PolarHBondContact O-N 2.98Å; F209-N244 HydrophobicContact CD1-CB 4.15Å; F209-N244 HydrophobicContact CE1-CB 3.66Å; F209-N244 HydrophobicContact CE2-CB 4.5Å; F209-N244 HydrophobicContact CZ-CB 3.84Å; F209-Y247 HydrophobicContact CE2-CD1 4.02Å; F209-Y247 HydrophobicContact CE2-CD2 4.39Å; F209-Y247 AromaticContact CE2-CG 3.87Å; F209-Y247 HydrophobicContact CE2-CG 3.87Å; F209-Y247 HydrophobicContact CZ-CD1 4.25Å; F209-Y247 HydrophobicContact CZ-CG 4.34Å; F209-Y248 HydrophobicContact CZ-CE2 4.28Å
210F92.6Very high86.2Confident45 Ų4541 Ų4120%0.19721%0.211CC..Hα-helixtrans-64.6-46176.7-178.9-107.9000112.2F182 I186 F189 E206 I207 L208 Q212 S213 L214F182-F210 HydrophobicContact CD2-CD2 4.25Å; F182-F210 AromaticContact CD2-CE2 3.63Å; F182-F210 HydrophobicContact CD2-CE2 3.63Å; F182-F210 HydrophobicContact CD2-CZ 4.33Å; F182-F210 AromaticContact CE2-CE2 3.64Å; F182-F210 HydrophobicContact CE2-CE2 3.64Å; F182-F210 AromaticContact CE2-CZ 3.93Å; F182-F210 HydrophobicContact CE2-CZ 3.93Å; I186-F210 HydrophobicContact CG1-CE2 4.21Å; F189-F210 HydrophobicContact CE2-CB 4.07Å; F189-F210 AromaticContact CE2-CD1 3.72Å; F189-F210 HydrophobicContact CE2-CD1 3.72Å; F189-F210 HydrophobicContact CE2-CD2 4.05Å; F189-F210 HydrophobicContact CE2-CE1 4.13Å; F189-F210 HydrophobicContact CE2-CE2 4.42Å; F189-F210 AromaticContact CE2-CG 3.67Å; F189-F210 HydrophobicContact CE2-CG 3.67Å; F189-F210 HydrophobicContact CE2-CZ 4.45Å; F189-F210 HydrophobicContact CZ-CD1 4.3Å; F189-F210 HydrophobicContact CZ-CG 4.47Å; E206-F210 WeakPolarHBondContact O-CB 3.48Å; E206-F210 PolarHBondContact O-N 3.35Å; I207-F210 WeakPolarHBondContact O-CB 3.36Å; I207-F210 PolarHBondContact O-N 2.88Å; I207-F210 VanDerWaalsContact O-N 3.17Å; L208-F210 VanDerWaalsContact C-N 3.34Å; F210-Q212 PolarHBondContact O-N 2.86Å; F210-S213 PolarHBondContact O-N 2.87Å; F210-S213 PolarHBondContact O-OG 2.88Å; F210-L214 PolarHBondContact O-N 3.38Å
211V93.1Very high87.8Confident43 Ų4339.3 Ų39.326%0.26121%0.21SC..Hα-helixtrans-63.2-43177.8172.20000110.7I207 L208 S213 L214 F215 M240I207-V211 HydrophobicContact CG2-CG2 4.01Å; I207-V211 WeakPolarHBondContact O-CB 3.34Å; I207-V211 VanDerWaalsContact O-CG2 3.27Å; I207-V211 WeakPolarHBondContact O-CG2 3.42Å; I207-V211 PolarHBondContact O-N 3.04Å; L208-V211 PolarHBondContact O-N 3.22Å; V211-S213 VanDerWaalsContact C-N 3.3Å; V211-S213 PolarHBondContact O-N 3.47Å; V211-L214 WeakPolarHBondContact O-CB 3.47Å; V211-L214 PolarHBondContact O-N 2.92Å; V211-L214 VanDerWaalsContact O-N 3.17Å; V211-F215 HydrophobicContact CG1-CD2 3.71Å; V211-F215 HydrophobicContact CG1-CE2 3.5Å; V211-F215 VanDerWaalsContact O-CD2 3.24Å; V211-F215 WeakPolarHBondContact O-CD2 3.27Å; V211-F215 PolarHBondContact O-N 3.46Å; V211-M240 HydrophobicContact CG1-SD 3.79Å
212Q95.3Very high89.2Confident0 Ų036.4 Ų36.40%019%0.192CC..Hα-helixtrans-57.6-43.6173.9178.5-86.1-40.900111.9L208 F209 F210 F215 M216 S237 M240L208-Q212 VanDerWaalsContact O-CB 3.25Å; L208-Q212 WeakPolarHBondContact O-CB 3.42Å; L208-Q212 PolarHBondContact O-N 3.34Å; F209-Q212 PolarHBondContact O-N 3.13Å; F210-Q212 PolarHBondContact O-N 2.86Å; Q212-F215 PolarHBondContact O-N 3.41Å; Q212-M216 PolarHBondContact O-N 2.72Å; Q212-M216 VanDerWaalsContact O-N 3.09Å; Q212-S237 WeakPolarHBondContact CG-O 2.97Å; Q212-S237 PolarHBondContact NE2-OG 3.26Å; Q212-S237 PolarHBondContact O-OG 3.36Å; Q212-M240 HydrophobicContact CB-CB 4.09Å; Q212-M240 HydrophobicContact CG-CB 4.23Å
213S95Very high90.4Very high0 Ų035.8 Ų35.80%019%0.185CC..Hα-helixtrans-65.8-37.4176.776.30000112.6G178 F182 F209 F210 V211 M216 L217G178-S213 WeakPolarHBondContact O-CB 3.41Å; F182-S213 WeakPolarHBondContact CA-OG 3.33Å; F209-S213 PolarHBondContact O-N 2.98Å; F210-S213 PolarHBondContact O-N 2.87Å; F210-S213 PolarHBondContact O-OG 2.88Å; V211-S213 VanDerWaalsContact C-N 3.3Å; V211-S213 PolarHBondContact O-N 3.47Å; S213-M216 WeakPolarHBondContact O-CB 3.36Å; S213-M216 PolarHBondContact O-N 3.36Å; S213-L217 WeakPolarHBondContact O-CG 3.4Å; S213-L217 PolarHBondContact O-N 2.86Å
214L95.3Very high91.3Very high81 Ų8142.1 Ų42.142%0.42421%0.212SC..Hα-helixtrans-63.5-46.8176.4-17965.4000111.4F210 V211 M216 L217 V218F210-L214 PolarHBondContact O-N 3.38Å; V211-L214 WeakPolarHBondContact O-CB 3.47Å; V211-L214 PolarHBondContact O-N 2.92Å; V211-L214 VanDerWaalsContact O-N 3.17Å; L214-M216 VanDerWaalsContact C-N 3.28Å; L214-M216 PolarHBondContact O-N 3.27Å; L214-L217 PolarHBondContact O-N 3.39Å; L214-V218 WeakPolarHBondContact O-CG2 3.45Å; L214-V218 PolarHBondContact O-N 2.69Å
215F95.6Very high91.8Very high71 Ų7141.2 Ų41.231%0.31122%0.218SC..Hα-helixtrans-60.7-37.9174.6-79.8-71.3000111.9V211 Q212 V218 S219 S233 F236 M240V211-F215 HydrophobicContact CG1-CD2 3.71Å; V211-F215 HydrophobicContact CG1-CE2 3.5Å; V211-F215 VanDerWaalsContact O-CD2 3.24Å; V211-F215 WeakPolarHBondContact O-CD2 3.27Å; V211-F215 PolarHBondContact O-N 3.46Å; Q212-F215 PolarHBondContact O-N 3.41Å; F215-V218 PolarHBondContact O-N 3.23Å; F215-S219 PolarHBondContact O-N 3.44Å; F215-S233 PolarHBondContact O-OG 2.93Å; F215-F236 HydrophobicContact CD1-CB 4.38Å; F215-M240 HydrophobicContact CB-CE 4.5Å; F215-M240 HydrophobicContact CD2-CE 3.17Å; F215-M240 HydrophobicContact CD2-SD 4.02Å; F215-M240 HydrophobicContact CE2-CE 3.39Å; F215-M240 HydrophobicContact CE2-SD 4.11Å; F215-M240 HydrophobicContact CG-CE 3.9Å; F215-M240 HydrophobicContact CZ-CE 4.26Å
216M94.9Very high92.1Very high12 Ų1245.9 Ų45.96%0.05924%0.238CC..Hα-helixtrans-62.6-45.2174.9-171.561.1179.200111.8F141 V175 Q212 S213 L214 S219 V220F141-M216 HydrophobicContact CD2-CE 4.24Å; F141-M216 HydrophobicContact CE2-CE 3.71Å; F141-M216 HydrophobicContact CE2-SD 3.6Å; F141-M216 HydrophobicContact CZ-CE 4.34Å; F141-M216 HydrophobicContact CZ-SD 3.62Å; V175-M216 HydrophobicContact CG2-CE 3.91Å; Q212-M216 PolarHBondContact O-N 2.72Å; Q212-M216 VanDerWaalsContact O-N 3.09Å; S213-M216 WeakPolarHBondContact O-CB 3.36Å; S213-M216 PolarHBondContact O-N 3.36Å; L214-M216 VanDerWaalsContact C-N 3.28Å; L214-M216 PolarHBondContact O-N 3.27Å; M216-S219 WeakPolarHBondContact O-CB 3.37Å; M216-S219 PolarHBondContact O-N 2.94Å; M216-V220 WeakPolarHBondContact O-CG2 3.19Å; M216-V220 PolarHBondContact O-N 3.31Å; M216-V220 VanDerWaalsContact O-N 3.09Å
217L94.8Very high92.3Very high41 Ų4151.6 Ų51.622%0.21526%0.259CS..Hα-helixtrans-65.3-40.6177.7-68.7176.6000112.4V179 F182 S213 L214 S219 V220 V221V179-L217 HydrophobicContact CG2-CD2 3.9Å; F182-L217 HydrophobicContact CB-CD1 3.89Å; F182-L217 HydrophobicContact CD1-CD1 3.78Å; F182-L217 HydrophobicContact CD2-CD1 3.55Å; F182-L217 HydrophobicContact CE1-CD1 4.11Å; F182-L217 HydrophobicContact CE2-CD1 3.92Å; F182-L217 HydrophobicContact CG-CD1 3.46Å; F182-L217 VanDerWaalsContact CG-CD1 3.46Å; F182-L217 HydrophobicContact CZ-CD1 4.18Å; S213-L217 WeakPolarHBondContact O-CG 3.4Å; S213-L217 PolarHBondContact O-N 2.86Å; L214-L217 PolarHBondContact O-N 3.39Å; L217-S219 VanDerWaalsContact C-N 3.28Å; L217-S219 PolarHBondContact O-N 2.86Å; L217-V220 WeakPolarHBondContact O-CB 3.38Å; L217-V220 PolarHBondContact O-N 3.48Å; L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 2.91Å
218V95.3Very high92.3Very high61 Ų6156.8 Ų56.837%0.3728%0.28SS..Hα-helixtrans-60.3-41174170.60000110.5L214 F215 V220 V221 L222L214-V218 WeakPolarHBondContact O-CG2 3.45Å; L214-V218 PolarHBondContact O-N 2.69Å; F215-V218 PolarHBondContact O-N 3.23Å; V218-V220 VanDerWaalsContact C-N 3.34Å; V218-V220 PolarHBondContact O-N 3.27Å; V218-V221 PolarHBondContact O-N 2.84Å; V218-L222 HydrophobicContact CG1-CD1 3.84Å; V218-L222 HydrophobicContact CG1-CG 4.29Å; V218-L222 WeakPolarHBondContact O-CB 3.48Å; V218-L222 VanDerWaalsContact O-CG 3.29Å; V218-L222 WeakPolarHBondContact O-CG 3.49Å; V218-L222 PolarHBondContact O-N 3.42Å
219S93.4Very high92.3Very high7 Ų760.3 Ų60.35%0.04930%0.296CS..Hα-helixtrans-59.3-44174.5-170.20000111.9F215 M216 L217 V221 L222 Y223 Y230F215-S219 PolarHBondContact O-N 3.44Å; M216-S219 WeakPolarHBondContact O-CB 3.37Å; M216-S219 PolarHBondContact O-N 2.94Å; L217-S219 VanDerWaalsContact C-N 3.28Å; L217-S219 PolarHBondContact O-N 2.86Å; S219-V221 PolarHBondContact O-N 3.27Å; S219-L222 PolarHBondContact O-N 3.37Å; S219-Y223 WeakPolarHBondContact O-CB 3.18Å; S219-Y223 PolarHBondContact O-N 3.07Å; S219-Y230 WeakPolarHBondContact O-CB 3.4Å; S219-Y230 PolarHBondContact OG-O 3.05Å
220V93.2Very high92.3Very high32 Ų3260.3 Ų60.319%0.19430%0.296CS..Hα-helixtrans-61.7-45.2176.4175.80000111.7V175 M216 L217 V218 L222 Y223 F224V175-V220 HydrophobicContact CB-CG2 4.48Å; V175-V220 HydrophobicContact CG1-CG2 4.1Å; V175-V220 HydrophobicContact CG2-CG2 3.58Å; M216-V220 WeakPolarHBondContact O-CG2 3.19Å; M216-V220 PolarHBondContact O-N 3.31Å; M216-V220 VanDerWaalsContact O-N 3.09Å; L217-V220 WeakPolarHBondContact O-CB 3.38Å; L217-V220 PolarHBondContact O-N 3.48Å; V218-V220 VanDerWaalsContact C-N 3.34Å; V218-V220 PolarHBondContact O-N 3.27Å; V220-L222 VanDerWaalsContact C-N 3.34Å; V220-L222 PolarHBondContact O-N 2.93Å; V220-Y223 WeakPolarHBondContact O-CB 3.45Å; V220-Y223 PolarHBondContact O-N 2.87Å; V220-F224 HydrophobicContact CG1-CD2 3.77Å; V220-F224 HydrophobicContact CG1-CE2 3.48Å; V220-F224 VanDerWaalsContact CG1-CE2 3.48Å; V220-F224 WeakPolarHBondContact O-CD2 3.41Å; V220-F224 PolarHBondContact O-N 3.29Å; V220-F224 VanDerWaalsContact O-N 3.1Å
221V94Very high92.2Very high92 Ų9260.1 Ų60.156%0.55830%0.298SS*.Hα-helixtrans-62.1-42.2177.7173.70000111.4L217 V218 S219 Y223 F224 S225L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 2.91Å; V218-V221 PolarHBondContact O-N 2.84Å; S219-V221 PolarHBondContact O-N 3.27Å; V221-Y223 VanDerWaalsContact C-N 3.34Å; V221-F224 PolarHBondContact O-N 3.48Å; V221-S225 WeakPolarHBondContact O-CB 3.12Å; V221-S225 PolarHBondContact O-N 3.38Å; V221-S225 PolarHBondContact O-OG 3Å
222L92.2Very high92.2Very high39 Ų3960.7 Ų60.720%0.20431%0.308CS..Hα-helixtrans-68.3-34177.8-71173.1000112.4V218 S219 V220 S225 H226 R227 E229V218-L222 HydrophobicContact CG1-CD1 3.84Å; V218-L222 HydrophobicContact CG1-CG 4.29Å; V218-L222 WeakPolarHBondContact O-CB 3.48Å; V218-L222 VanDerWaalsContact O-CG 3.29Å; V218-L222 WeakPolarHBondContact O-CG 3.49Å; V218-L222 PolarHBondContact O-N 3.42Å; S219-L222 PolarHBondContact O-N 3.37Å; V220-L222 VanDerWaalsContact C-N 3.34Å; V220-L222 PolarHBondContact O-N 2.93Å; L222-S225 PolarHBondContact O-N 2.82Å; L222-H226 PolarHBondContact O-N 3.49Å; L222-R227 HydrophobicContact CD2-CB 4.36Å; L222-R227 HydrophobicContact CD2-CG 4.46Å; L222-R227 PolarHBondContact O-N 2.75Å; L222-E229 HydrophobicContact CD1-CB 4.44Å
223Y90.2Very high92.1Very high43 Ų4361.2 Ų61.217%0.16931%0.311CS..Hα-helixtrans-62-47.2174.4-177.6-91.8000111.2P154 P155 Y156 S219 V220 V221 S225 H226 Y230P154-Y223 HydrophobicContact CB-CD2 3.59Å; P154-Y223 HydrophobicContact CB-CE2 3.6Å; P154-Y223 HydrophobicContact CB-CG 4.22Å; P155-Y223 WeakPolarHBondContact CA-OH 3.39Å; P155-Y223 HydrophobicContact CB-CD1 4.49Å; P155-Y223 HydrophobicContact CB-CE1 3.57Å; Y156-Y223 HydrophobicContact CD2-CE2 4.23Å; Y156-Y223 HydrophobicContact CE2-CE2 4.22Å; Y156-Y223 PolarHBondContact N-OH 3.13Å; S219-Y223 WeakPolarHBondContact O-CB 3.18Å; S219-Y223 PolarHBondContact O-N 3.07Å; V220-Y223 WeakPolarHBondContact O-CB 3.45Å; V220-Y223 PolarHBondContact O-N 2.87Å; V221-Y223 VanDerWaalsContact C-N 3.34Å; Y223-S225 VanDerWaalsContact C-N 3.28Å; Y223-S225 PolarHBondContact O-N 3.03Å; Y223-H226 PolarHBondContact O-N 2.92Å; Y223-Y230 AromaticContact CD2-CD2 3.99Å; Y223-Y230 HydrophobicContact CD2-CD2 3.99Å; Y223-Y230 HydrophobicContact CD2-CE1 4.27Å; Y223-Y230 AromaticContact CD2-CE2 3.6Å; Y223-Y230 HydrophobicContact CD2-CE2 3.6Å; Y223-Y230 HydrophobicContact CD2-CG 4.45Å; Y223-Y230 AromaticContact CD2-CZ 3.68Å; Y223-Y230 HydrophobicContact CE2-CE2 4.24Å
224F90.4Very high92Very high142 Ų14262.3 Ų62.362%0.62332%0.317SS*.Hα-helixtrans-69.4-24.6175.3-72.1-64000113.3V220 V221 H226V220-F224 HydrophobicContact CG1-CD2 3.77Å; V220-F224 HydrophobicContact CG1-CE2 3.48Å; V220-F224 VanDerWaalsContact CG1-CE2 3.48Å; V220-F224 WeakPolarHBondContact O-CD2 3.41Å; V220-F224 PolarHBondContact O-N 3.29Å; V220-F224 VanDerWaalsContact O-N 3.1Å; V221-F224 PolarHBondContact O-N 3.48Å; F224-H226 PolarHBondContact O-N 2.98Å
225S89.2Confident92Very high65 Ų6562.6 Ų62.646%0.45532%0.321SS..THydrogen-bonded Turntrans-79.98.4174.9-56.70000113.9V221 L222 Y223 R227V221-S225 WeakPolarHBondContact O-CB 3.12Å; V221-S225 PolarHBondContact O-N 3.38Å; V221-S225 PolarHBondContact O-OG 3Å; L222-S225 PolarHBondContact O-N 2.82Å; Y223-S225 VanDerWaalsContact C-N 3.28Å; Y223-S225 PolarHBondContact O-N 3.03Å; S225-R227 PolarHBondContact O-N 2.75Å; S225-R227 VanDerWaalsContact O-N 3.12Å
226H87.4Confident92Very high111 Ų11165 Ų6551%0.51433%0.332SS..THydrogen-bonded Turntrans58.221.6-178.2-56.3-81.9000114.6P154 P155 L222 Y223 F224P154-H226 PolarHBondContact O-ND1 3Å; P155-H226 WeakPolarHBondContact CD-CE1 3.49Å; P155-H226 WeakPolarHBondContact CD-ND1 3.46Å; L222-H226 PolarHBondContact O-N 3.49Å; Y223-H226 PolarHBondContact O-N 2.92Å; F224-H226 PolarHBondContact O-N 2.98Å
227R88.7Confident92Very high132 Ų13264.5 Ų64.550%0.49833%0.33SS..  trans-92.9135.1-179-62-65.1-70.2-170.7-3.3110L222 S225 E229 Y230L222-R227 HydrophobicContact CD2-CB 4.36Å; L222-R227 HydrophobicContact CD2-CG 4.46Å; L222-R227 PolarHBondContact O-N 2.75Å; S225-R227 PolarHBondContact O-N 2.75Å; S225-R227 VanDerWaalsContact O-N 3.12Å; R227-E229 IonicContact CZ-OE1 3.52Å; R227-E229 IonicContact NE-OE1 3.43Å; R227-E229 IonicContact NH2-OE1 2.72Å; R227-E229 PolarHBondContact NH2-OE1 3.41Å; R227-E229 PolarHBondContact O-N 3.44Å; R227-Y230 WeakPolarHBondContact O-CD1 3.35Å
228K87.3Confident92Very high138 Ų13864 Ų6460%0.633%0.327SS*.THydrogen-bonded Turntrans-70.5-10.5174.2-65.4-177179.3-179.40113.8Y230 V231K228-Y230 VanDerWaalsContact C-N 3.26Å; K228-Y230 PolarHBondContact O-N 3.45Å; K228-V231 VanDerWaalsContact O-CG2 3.3Å; K228-V231 WeakPolarHBondContact O-CG2 3.47Å
229E88.8Confident92.1Very high103 Ų10363.7 Ų63.748%0.48133%0.331SS..THydrogen-bonded Turntrans-70.9-17-177.4-68.5162.4-152.200113.9L222 R227 V231 A232L222-E229 HydrophobicContact CD1-CB 4.44Å; R227-E229 IonicContact CZ-OE1 3.52Å; R227-E229 IonicContact NE-OE1 3.43Å; R227-E229 IonicContact NH2-OE1 2.72Å; R227-E229 PolarHBondContact NH2-OE1 3.41Å; R227-E229 PolarHBondContact O-N 3.44Å; E229-V231 PolarHBondContact O-N 3.17Å; E229-A232 PolarHBondContact O-N 3.22Å
230Y91.3Very high92Very high9 Ų965 Ų654%0.03534%0.337CS..Hα-helixtrans-55-27.1178.478.9-78000113.5R148 P154 Y156 S219 Y223 R227 K228 S233 M234R148-Y230 VanDerWaalsContact CZ-OH 3.25Å; R148-Y230 PolarHBondContact NE-OH 2.81Å; R148-Y230 VanDerWaalsContact NH2-CZ 3.27Å; R148-Y230 PolarHBondContact NH2-OH 3.39Å; P154-Y230 HydrophobicContact CB-CE1 4.04Å; P154-Y230 HydrophobicContact CG-CD1 4.24Å; P154-Y230 HydrophobicContact CG-CE1 3.73Å; Y156-Y230 WeakPolarHBondContact CE2-OH 3.45Å; Y156-Y230 PolarHBondContact OH-OH 3.45Å; S219-Y230 WeakPolarHBondContact O-CB 3.4Å; S219-Y230 PolarHBondContact OG-O 3.05Å; Y223-Y230 AromaticContact CD2-CD2 3.99Å; Y223-Y230 HydrophobicContact CD2-CD2 3.99Å; Y223-Y230 HydrophobicContact CD2-CE1 4.27Å; Y223-Y230 AromaticContact CD2-CE2 3.6Å; Y223-Y230 HydrophobicContact CD2-CE2 3.6Å; Y223-Y230 HydrophobicContact CD2-CG 4.45Å; Y223-Y230 AromaticContact CD2-CZ 3.68Å; Y223-Y230 HydrophobicContact CE2-CE2 4.24Å; R227-Y230 WeakPolarHBondContact O-CD1 3.35Å; K228-Y230 VanDerWaalsContact C-N 3.26Å; K228-Y230 PolarHBondContact O-N 3.45Å; Y230-S233 PolarHBondContact O-N 3.04Å; Y230-M234 WeakPolarHBondContact O-CB 3.4Å; Y230-M234 PolarHBondContact O-N 3.23Å
231V91.5Very high92.1Very high40 Ų4063.5 Ų63.524%0.24233%0.328CS..Hα-helixtrans-63.9-43.7179.3-1720000111.3K228 E229 S233 M234 V235K228-V231 VanDerWaalsContact O-CG2 3.3Å; K228-V231 WeakPolarHBondContact O-CG2 3.47Å; E229-V231 PolarHBondContact O-N 3.17Å; V231-S233 VanDerWaalsContact C-N 3.32Å; V231-S233 PolarHBondContact O-N 3.09Å; V231-M234 WeakPolarHBondContact O-CB 3.35Å; V231-M234 PolarHBondContact O-N 2.65Å; V231-V235 HydrophobicContact CG1-CG2 4.43Å; V231-V235 VanDerWaalsContact O-CG2 3.3Å; V231-V235 WeakPolarHBondContact O-CG2 3.16Å; V231-V235 PolarHBondContact O-N 3.47Å
232A92.3Very high92.2Very high56 Ų5664.2 Ų64.246%0.46332%0.32SS..Hα-helixtrans-61.2-47.5178.500000109.8E229 M234 V235 F236E229-A232 PolarHBondContact O-N 3.22Å; A232-M234 VanDerWaalsContact C-N 3.33Å; A232-M234 PolarHBondContact O-N 3.24Å; A232-V235 PolarHBondContact O-N 2.7Å; A232-F236 WeakPolarHBondContact O-CD2 3.48Å; A232-F236 PolarHBondContact O-N 2.96Å
233S93.4Very high92.1Very high11 Ų1166 Ų668%0.07733%0.333CS..Hα-helixtrans-61.4-40.3176.7-1630000112.6F215 Y230 V231 F236 S237F215-S233 PolarHBondContact O-OG 2.93Å; Y230-S233 PolarHBondContact O-N 3.04Å; V231-S233 VanDerWaalsContact C-N 3.32Å; V231-S233 PolarHBondContact O-N 3.09Å; S233-F236 PolarHBondContact O-N 2.77Å; S233-S237 PolarHBondContact O-N 2.75Å
234M93.8Very high92.2Very high23 Ų2364.2 Ų64.211%0.11333%0.327CS..Hα-helixtrans-62.1-46.2175.8-170.8-174.9-175.700112.1F141 A145 Y230 V231 A232 S237 L238F141-M234 HydrophobicContact CD2-CE 4.3Å; F141-M234 HydrophobicContact CE2-CE 3.71Å; F141-M234 HydrophobicContact CE2-CG 4.04Å; F141-M234 HydrophobicContact CZ-CG 4.07Å; A145-M234 VanDerWaalsContact CA-CE 3.48Å; A145-M234 HydrophobicContact CB-CE 3.57Å; A145-M234 HydrophobicContact CB-SD 4.47Å; Y230-M234 WeakPolarHBondContact O-CB 3.4Å; Y230-M234 PolarHBondContact O-N 3.23Å; V231-M234 WeakPolarHBondContact O-CB 3.35Å; V231-M234 PolarHBondContact O-N 2.65Å; A232-M234 VanDerWaalsContact C-N 3.33Å; A232-M234 PolarHBondContact O-N 3.24Å; M234-S237 WeakPolarHBondContact O-CB 3.02Å; M234-S237 PolarHBondContact O-N 2.97Å; M234-L238 WeakPolarHBondContact O-CB 3.17Å; M234-L238 PolarHBondContact O-N 3.5Å
235V95Very high92.2Very high86 Ų8660.2 Ų60.252%0.52131%0.311SS..Hα-helixtrans-63.8-41.7179.2171.40000110.8V231 A232 L238 A239V231-V235 HydrophobicContact CG1-CG2 4.43Å; V231-V235 VanDerWaalsContact O-CG2 3.3Å; V231-V235 WeakPolarHBondContact O-CG2 3.16Å; V231-V235 PolarHBondContact O-N 3.47Å; A232-V235 PolarHBondContact O-N 2.7Å; V235-L238 PolarHBondContact O-N 2.87Å; V235-A239 WeakPolarHBondContact O-CB 3.48Å; V235-A239 PolarHBondContact O-N 2.89Å
236F94.8Very high92.2Very high123 Ų12362.5 Ų62.554%0.53932%0.317SS..Hα-helixtrans-60.5-45.5172.9-79.3-62.2000111.7F215 A232 S233 L238 A239 M240F215-F236 HydrophobicContact CD1-CB 4.38Å; A232-F236 WeakPolarHBondContact O-CD2 3.48Å; A232-F236 PolarHBondContact O-N 2.96Å; S233-F236 PolarHBondContact O-N 2.77Å; F236-L238 VanDerWaalsContact C-N 3.3Å; F236-L238 PolarHBondContact O-N 2.57Å; F236-A239 PolarHBondContact O-N 3.39Å; F236-M240 VanDerWaalsContact C-CE 3.48Å; F236-M240 HydrophobicContact CB-CE 3.78Å; F236-M240 WeakPolarHBondContact O-CB 3.37Å; F236-M240 WeakPolarHBondContact O-CE 3.3Å; F236-M240 PolarHBondContact O-N 3.46Å
237S95.4Very high92.2Very high0 Ų058.4 Ų58.40%030%0.297CS..Hα-helixtrans-59.9-40.2175.3-170.10000112.1Q212 S233 M234 G241Q212-S237 WeakPolarHBondContact CG-O 2.97Å; Q212-S237 PolarHBondContact NE2-OG 3.26Å; Q212-S237 PolarHBondContact O-OG 3.36Å; S233-S237 PolarHBondContact O-N 2.75Å; M234-S237 WeakPolarHBondContact O-CB 3.02Å; M234-S237 PolarHBondContact O-N 2.97Å; S237-G241 PolarHBondContact O-N 3.43Å
238L95.6Very high92.2Very high31 Ų3152.9 Ų52.916%0.16228%0.276CS..Hα-helixtrans-65.7-47.8178.3-175.766.8000112.2M138 F141 A145 M234 V235 F236 M240 G241 W242M138-L238 HydrophobicContact CE-CD1 4.01Å; F141-L238 HydrophobicContact CD1-CB 4.45Å; F141-L238 HydrophobicContact CD1-CD1 3.51Å; F141-L238 HydrophobicContact CE1-CB 3.84Å; F141-L238 HydrophobicContact CE1-CD1 3.78Å; F141-L238 HydrophobicContact CE1-CG 4.45Å; F141-L238 HydrophobicContact CG-CD1 4.13Å; F141-L238 HydrophobicContact CZ-CB 4.29Å; A145-L238 HydrophobicContact CB-CD2 4.07Å; M234-L238 WeakPolarHBondContact O-CB 3.17Å; M234-L238 PolarHBondContact O-N 3.5Å; V235-L238 PolarHBondContact O-N 2.87Å; F236-L238 VanDerWaalsContact C-N 3.3Å; F236-L238 PolarHBondContact O-N 2.57Å; L238-M240 PolarHBondContact O-N 2.9Å; L238-G241 PolarHBondContact O-N 3.46Å; L238-W242 PolarHBondContact O-N 3.23Å
239A95.5Very high92.3Very high55 Ų5547.8 Ų47.846%0.45526%0.257SS..Hα-helixtrans-61.7-43.8177.700000111.7V235 F236 W242 T243V235-A239 WeakPolarHBondContact O-CB 3.48Å; V235-A239 PolarHBondContact O-N 2.89Å; F236-A239 PolarHBondContact O-N 3.39Å; A239-W242 PolarHBondContact O-N 3.3Å; A239-T243 PolarHBondContact O-N 2.98Å; A239-T243 PolarHBondContact O-OG1 3.31Å
240M93.1Very high92.2Very high35 Ų3544 Ų4417%0.17224%0.239CC..Hα-helixtrans-63.8-39.5172.9-82.4177.5-85.900112.3V211 Q212 F215 F236 L238 W242 T243 N244V211-M240 HydrophobicContact CG1-SD 3.79Å; Q212-M240 HydrophobicContact CB-CB 4.09Å; Q212-M240 HydrophobicContact CG-CB 4.23Å; F215-M240 HydrophobicContact CB-CE 4.5Å; F215-M240 HydrophobicContact CD2-CE 3.17Å; F215-M240 HydrophobicContact CD2-SD 4.02Å; F215-M240 HydrophobicContact CE2-CE 3.39Å; F215-M240 HydrophobicContact CE2-SD 4.11Å; F215-M240 HydrophobicContact CG-CE 3.9Å; F215-M240 HydrophobicContact CZ-CE 4.26Å; F236-M240 VanDerWaalsContact C-CE 3.48Å; F236-M240 HydrophobicContact CB-CE 3.78Å; F236-M240 WeakPolarHBondContact O-CB 3.37Å; F236-M240 WeakPolarHBondContact O-CE 3.3Å; F236-M240 PolarHBondContact O-N 3.46Å; L238-M240 PolarHBondContact O-N 2.9Å; M240-W242 PolarHBondContact O-N 3.43Å; M240-T243 WeakPolarHBondContact O-CB 3.48Å; M240-T243 PolarHBondContact O-N 3.19Å; M240-N244 WeakPolarHBondContact O-CB 3.31Å; M240-N244 PolarHBondContact O-N 2.78Å; M240-N244 PolarHBondContact O-ND2 2.96Å; M240-N244 PolarHBondContact O-OD1 2.74Å
241G94.4Very high91.9Very high0 Ų043.9 Ų43.90%024%0.24CC..Hα-helixtrans-60.6-44.817700000113Y134 M138 S237 L238 T243 N244 M245Y134-G241 WeakPolarHBondContact OH-CA 3.43Å; Y134-G241 PolarHBondContact OH-O 3.49Å; M138-G241 VanDerWaalsContact CE-C 3.4Å; S237-G241 PolarHBondContact O-N 3.43Å; L238-G241 PolarHBondContact O-N 3.46Å; G241-T243 VanDerWaalsContact C-N 3.33Å; G241-T243 PolarHBondContact O-N 2.99Å; G241-N244 WeakPolarHBondContact O-CB 3.17Å; G241-N244 PolarHBondContact O-N 3.26Å; G241-M245 PolarHBondContact O-N 3.26Å
242W95.1Very high91.7Very high106 Ų10646.6 Ų46.640%0.40225%0.248SC..Hα-helixtrans-66-37.5174.9-80.1107.6000112.2M138 T142 L238 A239 M240 N244 M245M138-W242 HydrophobicContact CB-CZ2 4.33Å; M138-W242 HydrophobicContact CE-CB 4.42Å; M138-W242 HydrophobicContact CE-CD2 4.07Å; M138-W242 HydrophobicContact CE-CG 3.77Å; M138-W242 VanDerWaalsContact CE-N 3.35Å; T142-W242 WeakPolarHBondContact OG1-CZ2 3.16Å; T142-W242 PolarHBondContact OG1-NE1 2.79Å; L238-W242 PolarHBondContact O-N 3.23Å; A239-W242 PolarHBondContact O-N 3.3Å; M240-W242 PolarHBondContact O-N 3.43Å; W242-N244 VanDerWaalsContact C-N 3.31Å; W242-N244 PolarHBondContact O-N 3.1Å; W242-M245 HydrophobicContact CE3-SD 3.93Å; W242-M245 HydrophobicContact CZ3-SD 3.8Å; W242-M245 WeakPolarHBondContact O-CB 3.18Å; W242-M245 PolarHBondContact O-N 3.27Å
243T91.3Very high91.4Very high78 Ų7849.1 Ų49.148%0.47925%0.251SS..Hα-helixtrans-63.7-39.3174.5-53.70000111.2A239 M240 G241 M245 L246A239-T243 PolarHBondContact O-N 2.98Å; A239-T243 PolarHBondContact O-OG1 3.31Å; M240-T243 WeakPolarHBondContact O-CB 3.48Å; M240-T243 PolarHBondContact O-N 3.19Å; G241-T243 VanDerWaalsContact C-N 3.33Å; G241-T243 PolarHBondContact O-N 2.99Å; T243-M245 PolarHBondContact O-N 2.96Å; T243-L246 VanDerWaalsContact O-CB 3.27Å; T243-L246 WeakPolarHBondContact O-CB 3.47Å; T243-L246 WeakPolarHBondContact O-CG 3.4Å; T243-L246 PolarHBondContact O-N 2.82Å
244N91.6Very high91Very high5 Ų555.9 Ų55.93%0.02728%0.281CS..Hα-helixtrans-65-17.5177.1-71.6-13.3000113.3Y134 L208 F209 M240 G241 W242 L246 Y247Y134-N244 WeakPolarHBondContact OH-CB 3.35Å; L208-N244 WeakPolarHBondContact CB-OD1 3.42Å; L208-N244 PolarHBondContact O-ND2 3.45Å; F209-N244 HydrophobicContact CD1-CB 4.15Å; F209-N244 HydrophobicContact CE1-CB 3.66Å; F209-N244 HydrophobicContact CE2-CB 4.5Å; F209-N244 HydrophobicContact CZ-CB 3.84Å; M240-N244 WeakPolarHBondContact O-CB 3.31Å; M240-N244 PolarHBondContact O-N 2.78Å; M240-N244 PolarHBondContact O-ND2 2.96Å; M240-N244 PolarHBondContact O-OD1 2.74Å; G241-N244 WeakPolarHBondContact O-CB 3.17Å; G241-N244 PolarHBondContact O-N 3.26Å; W242-N244 VanDerWaalsContact C-N 3.31Å; W242-N244 PolarHBondContact O-N 3.1Å; N244-L246 PolarHBondContact O-N 3.35Å; N244-Y247 WeakPolarHBondContact O-CB 3.42Å; N244-Y247 PolarHBondContact O-N 3.35Å
245M90.8Very high90.7Very high58 Ų5860.1 Ų60.129%0.28630%0.302SS..G310 helixtrans-58.5-29.6170.9-162.1-173.7-17100111.9F131 Y134 C135 G241 W242 T243 Y247 Y248F131-M245 HydrophobicContact CE2-CE 3.84Å; F131-M245 HydrophobicContact CE2-CG 4.16Å; F131-M245 HydrophobicContact CZ-CE 3.9Å; Y134-M245 HydrophobicContact CE1-CB 4.47Å; C135-M245 WeakPolarHBondContact SG-CE 3.39Å; G241-M245 PolarHBondContact O-N 3.26Å; W242-M245 HydrophobicContact CE3-SD 3.93Å; W242-M245 HydrophobicContact CZ3-SD 3.8Å; W242-M245 WeakPolarHBondContact O-CB 3.18Å; W242-M245 PolarHBondContact O-N 3.27Å; T243-M245 PolarHBondContact O-N 2.96Å; M245-Y247 PolarHBondContact O-N 3.15Å; M245-Y247 VanDerWaalsContact O-N 3.16Å; M245-Y248 PolarHBondContact O-N 2.62Å
246L88.3Confident90.3Very high113 Ų11356 Ų5659%0.59228%0.277SS*.G310 helixtrans-59.5-25.2176.1-65.2176.1000112.7T243 N244 Y248 T249T243-L246 VanDerWaalsContact O-CB 3.27Å; T243-L246 WeakPolarHBondContact O-CB 3.47Å; T243-L246 WeakPolarHBondContact O-CG 3.4Å; T243-L246 PolarHBondContact O-N 2.82Å; N244-L246 PolarHBondContact O-N 3.35Å; L246-Y248 PolarHBondContact O-N 3.23Å; L246-T249 HydrophobicContact CD2-CG2 4.43Å; L246-T249 WeakPolarHBondContact O-CB 3.32Å; L246-T249 WeakPolarHBondContact O-CG2 3.19Å; L246-T249 PolarHBondContact O-N 3.27Å; L246-T249 VanDerWaalsContact O-N 3.13Å; L246-T249 PolarHBondContact O-OG1 3.46Å
247Y88.3Confident90Very high25 Ų2552 Ų5210%0.09826%0.26CS..G310 helixtrans-55.6-39.4174.2170.7-98.8000112.1F127 F209 N244 M245 T249 R250F127-Y247 HydrophobicContact CE2-CE1 4.18Å; F209-Y247 HydrophobicContact CE2-CD1 4.02Å; F209-Y247 HydrophobicContact CE2-CD2 4.39Å; F209-Y247 AromaticContact CE2-CG 3.87Å; F209-Y247 HydrophobicContact CE2-CG 3.87Å; F209-Y247 HydrophobicContact CZ-CD1 4.25Å; F209-Y247 HydrophobicContact CZ-CG 4.34Å; N244-Y247 WeakPolarHBondContact O-CB 3.42Å; N244-Y247 PolarHBondContact O-N 3.35Å; M245-Y247 PolarHBondContact O-N 3.15Å; M245-Y247 VanDerWaalsContact O-N 3.16Å; Y247-T249 PolarHBondContact O-N 3.03Å; Y247-R250 WeakPolarHBondContact O-CB 3.46Å; Y247-R250 WeakPolarHBondContact O-CG 3.39Å; Y247-R250 PolarHBondContact O-N 3.17Å
248Y89.6Confident89.5Confident15 Ų1558.5 Ų58.56%0.05929%0.286CS..G310 helixtrans-74.5-12.1-176.3-68.2-80.8000113.7F127 N130 F131 Y134 F209 M245 L246 R250 G251F127-Y248 HydrophobicContact CE1-CD1 4.06Å; F127-Y248 WeakPolarHBondContact CE1-O 3.36Å; F127-Y248 HydrophobicContact CE2-CD1 4.24Å; F127-Y248 AromaticContact CZ-CD1 3.84Å; F127-Y248 HydrophobicContact CZ-CD1 3.84Å; N130-Y248 HydrophobicContact CB-CE1 4.32Å; F131-Y248 HydrophobicContact CB-CD1 3.61Å; F131-Y248 HydrophobicContact CB-CE1 4.09Å; F131-Y248 HydrophobicContact CB-CG 4Å; F131-Y248 AromaticContact CD2-CD1 3.97Å; F131-Y248 HydrophobicContact CD2-CD1 3.97Å; F131-Y248 AromaticContact CD2-CD2 3.8Å; F131-Y248 HydrophobicContact CD2-CD2 3.8Å; F131-Y248 AromaticContact CD2-CG 3.4Å; F131-Y248 HydrophobicContact CD2-CG 3.4Å; F131-Y248 VanDerWaalsContact CD2-CG 3.4Å; F131-Y248 HydrophobicContact CE2-CG 4.27Å; F131-Y248 HydrophobicContact CG-CD1 4.23Å; F131-Y248 HydrophobicContact CG-CG 4.11Å; Y134-Y248 HydrophobicContact CD1-CD2 4.01Å; Y134-Y248 AromaticContact CD1-CE2 3.44Å; Y134-Y248 HydrophobicContact CD1-CE2 3.44Å; Y134-Y248 VanDerWaalsContact CD1-CE2 3.44Å; Y134-Y248 HydrophobicContact CD2-CE2 4.44Å; Y134-Y248 HydrophobicContact CE1-CE2 4.14Å; Y134-Y248 AromaticContact CG-CE2 3.6Å; Y134-Y248 HydrophobicContact CG-CE2 3.6Å; F209-Y248 HydrophobicContact CZ-CE2 4.28Å; M245-Y248 PolarHBondContact O-N 2.62Å; L246-Y248 PolarHBondContact O-N 3.23Å; Y248-R250 PolarHBondContact O-N 3.18Å; Y248-G251 PolarHBondContact O-N 2.91Å
249T88.9Confident89.1Confident32 Ų3258.1 Ų58.120%0.19629%0.287CS..G310 helixtrans-63.9-23.1173.6670000112.4L246 Y247 G251 F252 G256 A259L246-T249 HydrophobicContact CD2-CG2 4.43Å; L246-T249 WeakPolarHBondContact O-CB 3.32Å; L246-T249 WeakPolarHBondContact O-CG2 3.19Å; L246-T249 PolarHBondContact O-N 3.27Å; L246-T249 VanDerWaalsContact O-N 3.13Å; L246-T249 PolarHBondContact O-OG1 3.46Å; Y247-T249 PolarHBondContact O-N 3.03Å; T249-G251 PolarHBondContact O-N 3.06Å; T249-G251 VanDerWaalsContact O-N 3.13Å; T249-F252 PolarHBondContact O-N 3.16Å; T249-F252 VanDerWaalsContact O-N 3.11Å; T249-G256 PolarHBondContact O-N 3.32Å; T249-A259 WeakPolarHBondContact OG1-CB 3.37Å
250R85.6Confident88.5Confident24 Ų2455.5 Ų55.59%0.09127%0.266CS..G310 helixtrans-58.2-24.1177.3-67.4176.9172.7173.7-1.5113.9S205 Y247 Y248 F252 E263 W390 Q393S205-R250 PolarHBondContact OG-NH1 2.86Å; Y247-R250 WeakPolarHBondContact O-CB 3.46Å; Y247-R250 WeakPolarHBondContact O-CG 3.39Å; Y247-R250 PolarHBondContact O-N 3.17Å; Y248-R250 PolarHBondContact O-N 3.18Å; R250-F252 VanDerWaalsContact C-N 3.26Å; R250-F252 PolarHBondContact O-N 3.18Å; R250-E263 IonicContact NH2-OE1 2.71Å; R250-E263 IonicContact NH2-OE2 2.77Å; R250-E263 PolarHBondContact NH2-OE2 3.22Å; R250-W390 PolarHBondContact O-NE1 3.06Å; R250-Q393 VanDerWaalsContact NE-OE1 3.09Å
251G86.3Confident88.1Confident6 Ų655.4 Ų55.46%0.06227%0.266CS..G310 helixtrans-69.4-22.2178.300000114.1W119 Y248 T249W119-G251 WeakPolarHBondContact CZ2-O 3.47Å; Y248-G251 PolarHBondContact O-N 2.91Å; T249-G251 PolarHBondContact O-N 3.06Å; T249-G251 VanDerWaalsContact O-N 3.13Å
252F87.3Confident87.6Confident97 Ų9759.5 Ų59.543%0.42529%0.287SS..SBendtrans-97.8136.7174.8-58.9-80.8000110.1Y128 T249 R250 M255 G256Y128-F252 HydrophobicContact CD1-CZ 4.4Å; Y128-F252 AromaticContact CE1-CE1 3.79Å; Y128-F252 HydrophobicContact CE1-CE1 3.79Å; Y128-F252 AromaticContact CE1-CE2 3.84Å; Y128-F252 HydrophobicContact CE1-CE2 3.84Å; Y128-F252 AromaticContact CE1-CZ 3.38Å; Y128-F252 HydrophobicContact CE1-CZ 3.38Å; Y128-F252 AromaticContact CZ-CE1 3.79Å; Y128-F252 AromaticContact CZ-CZ 3.9Å; Y128-F252 WeakPolarHBondContact OH-CD1 3.49Å; Y128-F252 WeakPolarHBondContact OH-CE1 3.09Å; T249-F252 PolarHBondContact O-N 3.16Å; T249-F252 VanDerWaalsContact O-N 3.11Å; R250-F252 VanDerWaalsContact C-N 3.26Å; R250-F252 PolarHBondContact O-N 3.18Å; F252-M255 HydrophobicContact CB-CB 4.17Å; F252-M255 HydrophobicContact CB-CG 4.34Å; F252-G256 WeakPolarHBondContact O-CA 3.46Å; F252-G256 PolarHBondContact O-N 3.28Å
253Q85.8Confident86.9Confident109 Ų10956 Ų5651%0.50928%0.275SS..Hα-helixtrans-62.9-49.3-175.2178.9174.6-16.400113I257 W390Q253-I257 HydrophobicContact CG-CD1 4.14Å; Q253-I257 WeakPolarHBondContact O-CD1 3.37Å; Q253-I257 WeakPolarHBondContact O-CG1 3.32Å; Q253-I257 PolarHBondContact O-N 3.3Å; Q253-W390 HydrophobicContact CB-CH2 3.72Å; Q253-W390 HydrophobicContact CB-CZ2 3.9Å; Q253-W390 HydrophobicContact CB-CZ3 4.45Å; Q253-W390 HydrophobicContact CG-CH2 3.6Å; Q253-W390 HydrophobicContact CG-CZ2 4.16Å; Q253-W390 HydrophobicContact CG-CZ3 3.84Å
254Q85.6Confident86.3Confident153 Ų15355.8 Ų55.872%0.71527%0.267SS*.Hα-helixtrans-67.5-54-178.5-69.2174.8-13.100111.1G256 I257 Y258Q254-G256 VanDerWaalsContact C-N 3.3Å; Q254-G256 PolarHBondContact O-N 3.13Å; Q254-I257 PolarHBondContact O-N 3.26Å; Q254-Y258 WeakPolarHBondContact O-CD2 3.33Å; Q254-Y258 PolarHBondContact O-N 3.3Å
255M87.3Confident85.9Confident112 Ų11257.3 Ų57.355%0.55227%0.274SS*.Hα-helixtrans-62.8-36.8-179-57.5-61.1-97.200112.3F252 Y258 A259F252-M255 HydrophobicContact CB-CB 4.17Å; F252-M255 HydrophobicContact CB-CG 4.34Å; M255-Y258 PolarHBondContact O-N 3.05Å; M255-A259 WeakPolarHBondContact O-CB 3.2Å; M255-A259 PolarHBondContact O-N 2.83Å
256G86.3Confident85.5Confident0 Ų058.3 Ų58.30%028%0.28CS..Hα-helixtrans-63.9-41.1177.400000113T249 F252 Q254 A259 V260T249-G256 PolarHBondContact O-N 3.32Å; F252-G256 WeakPolarHBondContact O-CA 3.46Å; F252-G256 PolarHBondContact O-N 3.28Å; Q254-G256 VanDerWaalsContact C-N 3.3Å; Q254-G256 PolarHBondContact O-N 3.13Å; G256-A259 PolarHBondContact O-N 3.15Å; G256-V260 VanDerWaalsContact O-CG2 3.29Å; G256-V260 WeakPolarHBondContact O-CG2 3.46Å; G256-V260 PolarHBondContact O-N 3.18Å
257I87.3Confident84.9Confident37 Ų3756.5 Ų56.519%0.1927%0.271CS..Hα-helixtrans-62.6-45.7175.4-68165.2000110.4Q253 Q254 A259 V260 M261 S386 K387 W390Q253-I257 HydrophobicContact CG-CD1 4.14Å; Q253-I257 WeakPolarHBondContact O-CD1 3.37Å; Q253-I257 WeakPolarHBondContact O-CG1 3.32Å; Q253-I257 PolarHBondContact O-N 3.3Å; Q254-I257 PolarHBondContact O-N 3.26Å; I257-A259 PolarHBondContact O-N 2.96Å; I257-V260 PolarHBondContact O-N 3.06Å; I257-M261 PolarHBondContact O-N 3.47Å; I257-M261 VanDerWaalsContact O-N 3.11Å; I257-S386 WeakPolarHBondContact CG2-OG 3.38Å; I257-K387 HydrophobicContact CD1-CG 4.5Å; I257-W390 HydrophobicContact CG1-CB 4.17Å; I257-W390 HydrophobicContact CG1-CD2 4.23Å; I257-W390 HydrophobicContact CG1-CE3 4.39Å; I257-W390 HydrophobicContact CG1-CG 4.12Å
258Y86.1Confident84.4Confident137 Ų13759.7 Ų59.754%0.53728%0.282SS..Hα-helixtrans-63.8-39.3176.2-69.6-62.9000112.6Q254 M255 V260 M261 I262Q254-Y258 WeakPolarHBondContact O-CD2 3.33Å; Q254-Y258 PolarHBondContact O-N 3.3Å; M255-Y258 PolarHBondContact O-N 3.05Å; Y258-V260 PolarHBondContact O-N 3.29Å; Y258-M261 HydrophobicContact CD1-CE 3.94Å; Y258-M261 WeakPolarHBondContact O-CB 3.45Å; Y258-M261 PolarHBondContact O-N 3.42Å; Y258-I262 WeakPolarHBondContact O-CG1 3.47Å; Y258-I262 PolarHBondContact O-N 2.78Å
259A85.8Confident84.1Confident23 Ų2359.1 Ų59.119%0.1928%0.28CS..Hα-helixtrans-61.6-43.5177.300000111.9T249 M255 G256 I257 M261 I262 E263T249-A259 WeakPolarHBondContact OG1-CB 3.37Å; M255-A259 WeakPolarHBondContact O-CB 3.2Å; M255-A259 PolarHBondContact O-N 2.83Å; G256-A259 PolarHBondContact O-N 3.15Å; I257-A259 PolarHBondContact O-N 2.96Å; A259-M261 VanDerWaalsContact C-N 3.29Å; A259-M261 PolarHBondContact O-N 3.42Å; A259-I262 PolarHBondContact O-N 3.5Å; A259-E263 WeakPolarHBondContact O-CB 3.32Å; A259-E263 PolarHBondContact O-N 3.03Å
260V84.3Confident83.8Confident1 Ų160.2 Ų60.21%0.00629%0.285CS..Hα-helixtrans-61.8-39.4174.3176.90000111.5G256 I257 Y258 K264 I389 W390G256-V260 VanDerWaalsContact O-CG2 3.29Å; G256-V260 WeakPolarHBondContact O-CG2 3.46Å; G256-V260 PolarHBondContact O-N 3.18Å; I257-V260 PolarHBondContact O-N 3.06Å; Y258-V260 PolarHBondContact O-N 3.29Å; V260-K264 PolarHBondContact O-N 3.24Å; V260-I389 HydrophobicContact CG1-CB 4.04Å; V260-I389 HydrophobicContact CG1-CG2 3.57Å; V260-W390 HydrophobicContact CG2-CB 4.14Å
261M83.8Confident83.6Confident33 Ų3362.5 Ų62.516%0.16330%0.304CS..Hα-helixtrans-64.6-47.7178.5-170.1179.375.700111.4I257 Y258 A259 K264 M265 V379 I382I257-M261 PolarHBondContact O-N 3.47Å; I257-M261 VanDerWaalsContact O-N 3.11Å; Y258-M261 HydrophobicContact CD1-CE 3.94Å; Y258-M261 WeakPolarHBondContact O-CB 3.45Å; Y258-M261 PolarHBondContact O-N 3.42Å; A259-M261 VanDerWaalsContact C-N 3.29Å; A259-M261 PolarHBondContact O-N 3.42Å; M261-K264 PolarHBondContact O-N 3.41Å; M261-M265 VanDerWaalsContact O-CB 3.26Å; M261-M265 WeakPolarHBondContact O-CB 3.46Å; M261-M265 PolarHBondContact O-N 2.86Å; M261-V379 HydrophobicContact CE-CG1 4.47Å; M261-V379 HydrophobicContact CE-CG2 4.3Å; M261-V379 HydrophobicContact CG-CG2 4.4Å; M261-V379 HydrophobicContact SD-CB 4.34Å; M261-V379 HydrophobicContact SD-CG1 3.82Å; M261-V379 HydrophobicContact SD-CG2 4.01Å; M261-I382 HydrophobicContact CG-CG2 4.29Å
262I83.8Confident83.4Confident86 Ų8669.6 Ų69.644%0.44133%0.328SS..Hα-helixtrans-60.8-45.7176.5-67.8168.1000110.6Y258 A259 K264 M265 I266Y258-I262 WeakPolarHBondContact O-CG1 3.47Å; Y258-I262 PolarHBondContact O-N 2.78Å; A259-I262 PolarHBondContact O-N 3.5Å; I262-K264 PolarHBondContact O-N 3.5Å; I262-M265 PolarHBondContact O-N 3.49Å; I262-I266 HydrophobicContact CG2-CD1 3.57Å; I262-I266 HydrophobicContact CG2-CG1 4.25Å; I262-I266 WeakPolarHBondContact O-CB 3.49Å; I262-I266 VanDerWaalsContact O-CG1 3.29Å; I262-I266 WeakPolarHBondContact O-CG1 3.37Å; I262-I266 PolarHBondContact O-N 3.48Å
263E80.9Confident83.3Confident33 Ų3366.7 Ų66.715%0.15432%0.316CS..Hα-helixtrans-55.9-49.8178.4-179.8177.3-178.200111.6R250 A259 L267 Q393R250-E263 IonicContact NH2-OE1 2.71Å; R250-E263 IonicContact NH2-OE2 2.77Å; R250-E263 PolarHBondContact NH2-OE2 3.22Å; A259-E263 WeakPolarHBondContact O-CB 3.32Å; A259-E263 PolarHBondContact O-N 3.03Å; E263-L267 HydrophobicContact CG-CD1 4.35Å; E263-L267 PolarHBondContact O-N 3.25Å; E263-L267 VanDerWaalsContact O-N 3.08Å; E263-Q393 PolarHBondContact OE2-NE2 3.09Å
264K79.3Confident83.3Confident72 Ų7264.9 Ų64.931%0.31331%0.308SS..Hα-helixtrans-68.3-37.6178.5-78.3-163.6167.7-166.70113.1V260 M261 I262 R268 I382 I389V260-K264 PolarHBondContact O-N 3.24Å; M261-K264 PolarHBondContact O-N 3.41Å; I262-K264 PolarHBondContact O-N 3.5Å; K264-R268 VanDerWaalsContact O-CB 3.3Å; K264-R268 WeakPolarHBondContact O-CB 3.21Å; K264-R268 PolarHBondContact O-N 2.82Å; K264-I382 HydrophobicContact CB-CD1 3.73Å; K264-I382 HydrophobicContact CD-CD1 3.9Å; K264-I382 HydrophobicContact CD-CG2 4.39Å; K264-I382 HydrophobicContact CG-CD1 4.49Å; K264-I389 HydrophobicContact CD-CD1 4.33Å
265M82.1Confident83.3Confident37 Ų3764.6 Ų64.618%0.18231%0.305CS..Hα-helixtrans-65.1-42.7178.9-168.9179.478.200111.1M261 I262 D269 L270 M375 V379M261-M265 VanDerWaalsContact O-CB 3.26Å; M261-M265 WeakPolarHBondContact O-CB 3.46Å; M261-M265 PolarHBondContact O-N 2.86Å; I262-M265 PolarHBondContact O-N 3.49Å; M265-D269 WeakPolarHBondContact O-CB 3.21Å; M265-D269 PolarHBondContact O-N 3.3Å; M265-L270 PolarHBondContact O-N 2.84Å; M265-M375 HydrophobicContact CE-CE 3.86Å; M265-M375 HydrophobicContact CE-CG 4.43Å; M265-M375 HydrophobicContact CE-SD 3.73Å; M265-M375 HydrophobicContact CG-CB 4.36Å; M265-M375 HydrophobicContact CG-CE 4.07Å; M265-M375 HydrophobicContact CG-CG 3.73Å; M265-M375 HydrophobicContact CG-SD 4.2Å; M265-M375 HydrophobicContact SD-CB 3.87Å; M265-M375 HydrophobicContact SD-CE 4.22Å; M265-M375 HydrophobicContact SD-CG 3.64Å; M265-M375 HydrophobicContact SD-SD 3.71Å; M265-V379 HydrophobicContact SD-CG2 4.28Å
266I82.6Confident83.3Confident79 Ų7962.1 Ų62.141%0.40530%0.296SS..Iπ-helixtrans-64.5-51.9176.1-68.4171.4000110.5I262 R268 L270 C271I262-I266 HydrophobicContact CG2-CD1 3.57Å; I262-I266 HydrophobicContact CG2-CG1 4.25Å; I262-I266 WeakPolarHBondContact O-CB 3.49Å; I262-I266 VanDerWaalsContact O-CG1 3.29Å; I262-I266 WeakPolarHBondContact O-CG1 3.37Å; I262-I266 PolarHBondContact O-N 3.48Å; I266-R268 PolarHBondContact O-N 3.23Å; I266-L270 HydrophobicContact CG2-CD2 4.03Å; I266-L270 WeakPolarHBondContact O-CB 3.48Å; I266-L270 PolarHBondContact O-N 3.35Å; I266-C271 PolarHBondContact O-N 3.37Å
267L76.4Confident83.3Confident75 Ų7562.8 Ų62.839%0.39330%0.298SS..Iπ-helixtrans-67.6-36.5-174.4-74.4171.9000113.5E263 C271E263-L267 HydrophobicContact CG-CD1 4.35Å; E263-L267 PolarHBondContact O-N 3.25Å; E263-L267 VanDerWaalsContact O-N 3.08Å; L267-C271 WeakPolarHBondContact O-CB 3.46Å; L267-C271 PolarHBondContact O-SG 3.37Å
268R77Confident83.4Confident92 Ų9264.4 Ų64.435%0.34731%0.307SS..Iπ-helixtrans-90.4-48.3-175.4-171.1176.872.3-168.311.3113.1K264 I266 R272 T378K264-R268 VanDerWaalsContact O-CB 3.3Å; K264-R268 WeakPolarHBondContact O-CB 3.21Å; K264-R268 PolarHBondContact O-N 2.82Å; I266-R268 PolarHBondContact O-N 3.23Å; R268-R272 WeakPolarHBondContact O-CD 3.36Å; R268-R272 WeakPolarHBondContact O-CG 3.45Å; R268-T378 VanDerWaalsContact NH2-CB 3.29Å; R268-T378 PolarHBondContact NH2-OG1 3.49Å
269D83.3Confident83.6Confident3 Ų362 Ų622%0.01631%0.307CS..Iπ-helixtrans-97.5-44-166.7-54.6-15.8000110.6M265 C271 R272 F273 T378M265-D269 WeakPolarHBondContact O-CB 3.21Å; M265-D269 PolarHBondContact O-N 3.3Å; D269-C271 PolarHBondContact O-N 3.17Å; D269-R272 PolarHBondContact O-N 2.93Å; D269-F273 PolarHBondContact O-N 3.4Å; D269-T378 PolarHBondContact OD1-OG1 3.09Å; D269-T378 WeakPolarHBondContact OD2-CB 3.28Å; D269-T378 WeakPolarHBondContact OD2-CG2 3.07Å; D269-T378 PolarHBondContact OD2-OG1 3.46Å
270L82.8Confident83.7Confident55 Ų5564.1 Ų64.129%0.28831%0.312SS..Iπ-helixtrans-64.6-38.7176.8-164.276.4000111.4M265 I266 R272 F273 M274 M375M265-L270 PolarHBondContact O-N 2.84Å; I266-L270 HydrophobicContact CG2-CD2 4.03Å; I266-L270 WeakPolarHBondContact O-CB 3.48Å; I266-L270 PolarHBondContact O-N 3.35Å; L270-R272 VanDerWaalsContact C-N 3.35Å; L270-R272 PolarHBondContact O-N 3.32Å; L270-F273 HydrophobicContact CD1-CD1 4.23Å; L270-F273 WeakPolarHBondContact O-CB 3.49Å; L270-F273 PolarHBondContact O-N 3.49Å; L270-M274 HydrophobicContact CG-CG 4.22Å; L270-M274 WeakPolarHBondContact O-CB 3.32Å; L270-M274 WeakPolarHBondContact O-CG 3.16Å; L270-M274 PolarHBondContact O-N 3.19Å; L270-M375 HydrophobicContact CD1-CE 4.27Å
271C81.4Confident84Confident72 Ų7264.4 Ų64.449%0.48631%0.313SS..Hα-helixtrans-61-40.2176.5-69.40000113.1I266 L267 D269 M274 F275I266-C271 PolarHBondContact O-N 3.37Å; L267-C271 WeakPolarHBondContact O-CB 3.46Å; L267-C271 PolarHBondContact O-SG 3.37Å; D269-C271 PolarHBondContact O-N 3.17Å; C271-M274 PolarHBondContact O-N 3.38Å; C271-F275 PolarHBondContact O-N 3.32Å; C271-F275 VanDerWaalsContact O-N 3.09Å
272R83.3Confident84.3Confident155 Ų15568.9 Ų68.959%0.58533%0.332SS*.Hα-helixtrans-67.5-42.9176.5-70.6174.1-178.5-179.9-1.1111.2R268 D269 L270 F275 V276R268-R272 WeakPolarHBondContact O-CD 3.36Å; R268-R272 WeakPolarHBondContact O-CG 3.45Å; D269-R272 PolarHBondContact O-N 2.93Å; L270-R272 VanDerWaalsContact C-N 3.35Å; L270-R272 PolarHBondContact O-N 3.32Å; R272-F275 PolarHBondContact O-N 3.21Å; R272-V276 PolarHBondContact O-N 2.76Å
273F84.7Confident84.7Confident36 Ų3666.6 Ų66.616%0.15833%0.329CS..Hα-helixtrans-60.7-47.3174.1169.1-91.4000111.9D269 L270 F275 V276 Y277 L367 L371D269-F273 PolarHBondContact O-N 3.4Å; L270-F273 HydrophobicContact CD1-CD1 4.23Å; L270-F273 WeakPolarHBondContact O-CB 3.49Å; L270-F273 PolarHBondContact O-N 3.49Å; F273-F275 VanDerWaalsContact C-N 3.26Å; F273-F275 PolarHBondContact O-N 3.19Å; F273-V276 PolarHBondContact O-N 3.16Å; F273-Y277 VanDerWaalsContact O-CB 3.29Å; F273-Y277 WeakPolarHBondContact O-CB 3.46Å; F273-Y277 PolarHBondContact O-N 3.21Å; F273-L367 HydrophobicContact CD2-CB 4.36Å; F273-L367 HydrophobicContact CE2-CB 3.59Å; F273-L367 WeakPolarHBondContact CE2-O 3.41Å; F273-L367 HydrophobicContact CZ-CB 4.34Å; F273-L371 HydrophobicContact CB-CD1 3.73Å; F273-L371 HydrophobicContact CD1-CD1 4.42Å; F273-L371 HydrophobicContact CD1-CD2 4.44Å; F273-L371 HydrophobicContact CD2-CB 3.85Å; F273-L371 HydrophobicContact CD2-CD1 3.84Å; F273-L371 HydrophobicContact CD2-CD2 4.12Å; F273-L371 HydrophobicContact CD2-CG 4.16Å; F273-L371 HydrophobicContact CE1-CD2 4.4Å; F273-L371 HydrophobicContact CE2-CB 4.02Å; F273-L371 HydrophobicContact CE2-CD2 4.01Å; F273-L371 HydrophobicContact CE2-CG 4.43Å; F273-L371 HydrophobicContact CG-CD1 3.75Å; F273-L371 HydrophobicContact CG-CD2 4.32Å; F273-L371 HydrophobicContact CG-CG 4.45Å; F273-L371 HydrophobicContact CZ-CD2 4.18Å
274M84.6Confident85Confident72 Ų7266.7 Ų66.736%0.35533%0.329SS..Hα-helixtrans-60-37.3179-75.5-56.8-60.300111.6L270 C271 Y277 L278L270-M274 HydrophobicContact CG-CG 4.22Å; L270-M274 WeakPolarHBondContact O-CB 3.32Å; L270-M274 WeakPolarHBondContact O-CG 3.16Å; L270-M274 PolarHBondContact O-N 3.19Å; C271-M274 PolarHBondContact O-N 3.38Å; M274-Y277 HydrophobicContact CE-CD1 4.16Å; M274-Y277 PolarHBondContact O-N 2.86Å; M274-Y277 HydrophobicContact SD-CD1 4.4Å; M274-L278 WeakPolarHBondContact O-CB 3.39Å; M274-L278 WeakPolarHBondContact O-CG 3.25Å; M274-L278 PolarHBondContact O-N 3.47Å
275F87.1Confident85.4Confident146 Ų14663.3 Ų63.364%0.6432%0.315SS*.Hα-helixtrans-61.8-51.2174.9178-98.7000112C271 R272 F273 Y277 L278 V279C271-F275 PolarHBondContact O-N 3.32Å; C271-F275 VanDerWaalsContact O-N 3.09Å; R272-F275 PolarHBondContact O-N 3.21Å; F273-F275 VanDerWaalsContact C-N 3.26Å; F273-F275 PolarHBondContact O-N 3.19Å; F275-Y277 VanDerWaalsContact C-N 3.34Å; F275-Y277 PolarHBondContact O-N 3.09Å; F275-L278 PolarHBondContact O-N 3.44Å; F275-V279 HydrophobicContact CE1-CG2 4.39Å; F275-V279 HydrophobicContact CZ-CG2 4.35Å; F275-V279 WeakPolarHBondContact O-CG2 3.5Å; F275-V279 PolarHBondContact O-N 2.94Å
276V86.6Confident85.8Confident60 Ų6064.6 Ų64.636%0.36433%0.325SS..Hα-helixtrans-60.2-47.3177.3178.20000110.1R272 F273 L278 V279 F280 L367R272-V276 PolarHBondContact O-N 2.76Å; F273-V276 PolarHBondContact O-N 3.16Å; V276-L278 PolarHBondContact O-N 3.09Å; V276-V279 WeakPolarHBondContact O-CB 3.43Å; V276-V279 PolarHBondContact O-N 3.03Å; V276-F280 HydrophobicContact CG1-CD2 3.83Å; V276-F280 HydrophobicContact CG1-CE2 3.67Å; V276-F280 VanDerWaalsContact O-CD2 3.28Å; V276-F280 WeakPolarHBondContact O-CD2 3.32Å; V276-F280 PolarHBondContact O-N 3.3Å; V276-F280 VanDerWaalsContact O-N 3.16Å; V276-L367 HydrophobicContact CG1-CD2 3.72Å
277Y87.4Confident86Confident14 Ų1462.6 Ų62.66%0.05532%0.32CS..Hα-helixtrans-56.5-44.6177.9175.7-107.6000112.8F273 M274 F275 V279 F280 L281 F331 T334 L367F273-Y277 VanDerWaalsContact O-CB 3.29Å; F273-Y277 WeakPolarHBondContact O-CB 3.46Å; F273-Y277 PolarHBondContact O-N 3.21Å; M274-Y277 HydrophobicContact CE-CD1 4.16Å; M274-Y277 PolarHBondContact O-N 2.86Å; M274-Y277 HydrophobicContact SD-CD1 4.4Å; F275-Y277 VanDerWaalsContact C-N 3.34Å; F275-Y277 PolarHBondContact O-N 3.09Å; Y277-V279 VanDerWaalsContact C-N 3.35Å; Y277-V279 PolarHBondContact O-N 3.48Å; Y277-F280 PolarHBondContact O-N 3.49Å; Y277-L281 HydrophobicContact CE1-CB 4.49Å; Y277-L281 HydrophobicContact CE1-CD2 4.04Å; Y277-L281 WeakPolarHBondContact O-CB 3.45Å; Y277-L281 PolarHBondContact O-N 2.9Å; Y277-F331 HydrophobicContact CE1-CD2 4.04Å; Y277-F331 HydrophobicContact CE1-CE2 4.28Å; Y277-F331 WeakPolarHBondContact OH-CD2 3.34Å; Y277-T334 HydrophobicContact CE2-CG2 3.98Å; Y277-T334 PolarHBondContact OH-OG1 3.25Å; Y277-L367 HydrophobicContact CD2-CD1 4.12Å
278L88.7Confident86.3Confident72 Ų7259.3 Ų59.338%0.37730%0.303SS..Hα-helixtrans-63.7-38.5178.3-74.2170.8000112M274 F275 V276 F280 L281 F282M274-L278 WeakPolarHBondContact O-CB 3.39Å; M274-L278 WeakPolarHBondContact O-CG 3.25Å; M274-L278 PolarHBondContact O-N 3.47Å; F275-L278 PolarHBondContact O-N 3.44Å; V276-L278 PolarHBondContact O-N 3.09Å; L278-F280 VanDerWaalsContact C-N 3.35Å; L278-F280 PolarHBondContact O-N 2.89Å; L278-L281 HydrophobicContact CD2-CD2 4.38Å; L278-L281 PolarHBondContact O-N 3.38Å; L278-F282 HydrophobicContact CB-CD2 4.44Å; L278-F282 HydrophobicContact CD2-CE2 4.3Å; L278-F282 WeakPolarHBondContact O-CB 3.42Å; L278-F282 WeakPolarHBondContact O-CD2 3.27Å; L278-F282 PolarHBondContact O-N 3.49Å
279V90.1Very high86.5Confident86 Ų8655.3 Ų55.352%0.52129%0.289SS..Hα-helixtrans-60.7-45.7175.2173.70000110.8F275 V276 Y277 G283F275-V279 HydrophobicContact CE1-CG2 4.39Å; F275-V279 HydrophobicContact CZ-CG2 4.35Å; F275-V279 WeakPolarHBondContact O-CG2 3.5Å; F275-V279 PolarHBondContact O-N 2.94Å; V276-V279 WeakPolarHBondContact O-CB 3.43Å; V276-V279 PolarHBondContact O-N 3.03Å; Y277-V279 VanDerWaalsContact C-N 3.35Å; Y277-V279 PolarHBondContact O-N 3.48Å; V279-G283 PolarHBondContact O-N 3.19Å
280F88.6Confident86.5Confident68 Ų6859.7 Ų59.730%0.29832%0.316SS..Hα-helixtrans-63.8-47.1174.8-80.8-81.5000111.8V276 Y277 L278 F282 G283 F284 L367V276-F280 HydrophobicContact CG1-CD2 3.83Å; V276-F280 HydrophobicContact CG1-CE2 3.67Å; V276-F280 VanDerWaalsContact O-CD2 3.28Å; V276-F280 WeakPolarHBondContact O-CD2 3.32Å; V276-F280 PolarHBondContact O-N 3.3Å; V276-F280 VanDerWaalsContact O-N 3.16Å; Y277-F280 PolarHBondContact O-N 3.49Å; L278-F280 VanDerWaalsContact C-N 3.35Å; L278-F280 PolarHBondContact O-N 2.89Å; F280-F282 PolarHBondContact O-N 3.17Å; F280-G283 PolarHBondContact O-N 3.27Å; F280-F284 HydrophobicContact CD1-CD2 4.26Å; F280-F284 AromaticContact CD1-CE2 3.83Å; F280-F284 HydrophobicContact CD1-CE2 3.83Å; F280-F284 HydrophobicContact CE1-CE2 4.44Å; F280-F284 WeakPolarHBondContact O-CB 3.17Å; F280-F284 VanDerWaalsContact O-CD2 3.31Å; F280-F284 WeakPolarHBondContact O-CD2 3.36Å; F280-F284 PolarHBondContact O-N 3.01Å; F280-L367 HydrophobicContact CD2-CD1 4.34Å; F280-L367 HydrophobicContact CD2-CD2 4.41Å; F280-L367 HydrophobicContact CE2-CD2 4.3Å
281L89.3Confident86.3Confident7 Ų759 Ų594%0.03731%0.313CS..Hα-helixtrans-58.3-49.9-179.9-178.365.8000111.1Y277 L278 S285 C327 L330 F331 Y359Y277-L281 HydrophobicContact CE1-CB 4.49Å; Y277-L281 HydrophobicContact CE1-CD2 4.04Å; Y277-L281 WeakPolarHBondContact O-CB 3.45Å; Y277-L281 PolarHBondContact O-N 2.9Å; L278-L281 HydrophobicContact CD2-CD2 4.38Å; L278-L281 PolarHBondContact O-N 3.38Å; L281-S285 WeakPolarHBondContact O-CB 3.24Å; L281-S285 PolarHBondContact O-N 3.1Å; L281-S285 PolarHBondContact O-OG 3.2Å; L281-C327 VanDerWaalsContact CD2-SG 3.58Å; L281-L330 HydrophobicContact CD1-CB 3.87Å; L281-F331 HydrophobicContact CD1-CB 4.41Å; L281-Y359 VanDerWaalsContact CD1-OH 3.3Å; L281-Y359 WeakPolarHBondContact CD1-OH 3.4Å
282F90.4Very high85.8Confident126 Ų12656.1 Ų56.155%0.55329%0.292SS*.Hα-helixtrans-64.4-45.6178.7-82.6-68.9000112.2L278 F280 S285 T286L278-F282 HydrophobicContact CB-CD2 4.44Å; L278-F282 HydrophobicContact CD2-CE2 4.3Å; L278-F282 WeakPolarHBondContact O-CB 3.42Å; L278-F282 WeakPolarHBondContact O-CD2 3.27Å; L278-F282 PolarHBondContact O-N 3.49Å; F280-F282 PolarHBondContact O-N 3.17Å; F282-S285 PolarHBondContact O-N 2.82Å; F282-T286 WeakPolarHBondContact O-CG2 3.48Å; F282-T286 PolarHBondContact O-N 3.24Å; F282-T286 PolarHBondContact O-OG1 2.73Å
283G91.3Very high84.8Confident38 Ų3855 Ų5539%0.39229%0.293SS..Hα-helixtrans-63.5-43.6-178.700000113.5V279 F280 T286 A287V279-G283 PolarHBondContact O-N 3.19Å; F280-G283 PolarHBondContact O-N 3.27Å; G283-T286 PolarHBondContact O-OG1 3.32Å; G283-A287 PolarHBondContact O-N 3.49Å
284F88.7Confident83.4Confident35 Ų3559.7 Ų59.715%0.15432%0.32CS..Hα-helixtrans-72.5-35.1175.7-81-94.7000112F280 T286 A287 V288 L330 L355 Y359 L362F280-F284 HydrophobicContact CD1-CD2 4.26Å; F280-F284 AromaticContact CD1-CE2 3.83Å; F280-F284 HydrophobicContact CD1-CE2 3.83Å; F280-F284 HydrophobicContact CE1-CE2 4.44Å; F280-F284 WeakPolarHBondContact O-CB 3.17Å; F280-F284 VanDerWaalsContact O-CD2 3.31Å; F280-F284 WeakPolarHBondContact O-CD2 3.36Å; F280-F284 PolarHBondContact O-N 3.01Å; F284-T286 PolarHBondContact O-N 3.22Å; F284-A287 PolarHBondContact O-N 3.34Å; F284-V288 WeakPolarHBondContact O-CB 3.29Å; F284-V288 VanDerWaalsContact O-CG2 3.29Å; F284-V288 WeakPolarHBondContact O-CG2 3.36Å; F284-V288 PolarHBondContact O-N 3.26Å; F284-L330 HydrophobicContact CB-CD1 4.4Å; F284-L355 HydrophobicContact CD1-CD1 3.84Å; F284-L355 HydrophobicContact CD1-CG 4.08Å; F284-L355 HydrophobicContact CE1-CD1 3.75Å; F284-L355 HydrophobicContact CE1-CG 4.34Å; F284-Y359 HydrophobicContact CB-CD2 3.75Å; F284-Y359 HydrophobicContact CB-CE2 4.19Å; F284-Y359 HydrophobicContact CB-CG 4.45Å; F284-Y359 AromaticContact CD1-CD2 3.99Å; F284-Y359 HydrophobicContact CD1-CD2 3.99Å; F284-Y359 HydrophobicContact CD1-CG 4.24Å; F284-Y359 AromaticContact CD2-CD2 3.93Å; F284-Y359 HydrophobicContact CD2-CD2 3.93Å; F284-Y359 AromaticContact CG-CD2 3.61Å; F284-Y359 HydrophobicContact CG-CD2 3.61Å; F284-Y359 HydrophobicContact CG-CE2 4.42Å; F284-Y359 HydrophobicContact CG-CG 4.29Å; F284-L362 HydrophobicContact CE2-CD1 4.39Å; F284-L362 HydrophobicContact CZ-CD1 3.84Å
285S88.2Confident81.9Confident2 Ų259.8 Ų59.81%0.01434%0.34CS..Hα-helixtrans-60.3-45.4173.4-60.40000111.6L281 F282 A287 V288 V289 C327 L330L281-S285 WeakPolarHBondContact O-CB 3.24Å; L281-S285 PolarHBondContact O-N 3.1Å; L281-S285 PolarHBondContact O-OG 3.2Å; F282-S285 PolarHBondContact O-N 2.82Å; S285-A287 PolarHBondContact O-N 2.88Å; S285-V288 PolarHBondContact O-N 3.43Å; S285-V289 WeakPolarHBondContact O-CG2 3.41Å; S285-V289 PolarHBondContact O-N 3.01Å; S285-C327 VanDerWaalsContact OG-CA 3.31Å; S285-C327 WeakPolarHBondContact OG-CA 3.4Å; S285-L330 WeakPolarHBondContact OG-CD1 3.45Å
286T88.4Confident80.1Confident64 Ų6461.8 Ų61.839%0.39335%0.348SS..Hα-helixtrans-62.9-42.1177.548.20000111.9F282 G283 F284 V288 V289 T290 L323F282-T286 WeakPolarHBondContact O-CG2 3.48Å; F282-T286 PolarHBondContact O-N 3.24Å; F282-T286 PolarHBondContact O-OG1 2.73Å; G283-T286 PolarHBondContact O-OG1 3.32Å; F284-T286 PolarHBondContact O-N 3.22Å; T286-V288 PolarHBondContact O-N 2.95Å; T286-V289 PolarHBondContact O-N 2.9Å; T286-T290 WeakPolarHBondContact O-CG2 3.44Å; T286-T290 PolarHBondContact O-N 3.2Å; T286-T290 PolarHBondContact O-OG1 3.39Å; T286-T290 VanDerWaalsContact O-OG1 3.14Å; T286-L323 HydrophobicContact CG2-CD2 3.79Å
287A88Confident78.1Confident37 Ų3766.2 Ų66.231%0.30637%0.37SS..Hα-helixtrans-65.4-38.9178.500000112.5G283 F284 S285 T290 L291 L355G283-A287 PolarHBondContact O-N 3.49Å; F284-A287 PolarHBondContact O-N 3.34Å; S285-A287 PolarHBondContact O-N 2.88Å; A287-T290 WeakPolarHBondContact CA-OG1 3.44Å; A287-T290 PolarHBondContact O-OG1 2.78Å; A287-L291 PolarHBondContact O-N 3.17Å; A287-L355 HydrophobicContact CB-CD2 3.85Å
288V83.1Confident75.9Confident5 Ų573.6 Ų73.63%0.0341%0.41CS..Hα-helixtrans-67.9-45.5175.21720000110.7F284 S285 T286 T290 L291 I292 T326 L330 F352 L355F284-V288 WeakPolarHBondContact O-CB 3.29Å; F284-V288 VanDerWaalsContact O-CG2 3.29Å; F284-V288 WeakPolarHBondContact O-CG2 3.36Å; F284-V288 PolarHBondContact O-N 3.26Å; S285-V288 PolarHBondContact O-N 3.43Å; T286-V288 PolarHBondContact O-N 2.95Å; V288-T290 VanDerWaalsContact C-N 3.35Å; V288-T290 PolarHBondContact O-N 3.39Å; V288-L291 WeakPolarHBondContact O-CB 3.07Å; V288-L291 PolarHBondContact O-N 2.96Å; V288-I292 HydrophobicContact CG1-CD1 3.57Å; V288-I292 HydrophobicContact CG1-CG1 4.4Å; V288-I292 VanDerWaalsContact O-CD1 3.3Å; V288-I292 WeakPolarHBondContact O-CD1 3.29Å; V288-I292 VanDerWaalsContact O-CG1 3.27Å; V288-I292 WeakPolarHBondContact O-CG1 3.27Å; V288-I292 PolarHBondContact O-N 3.42Å; V288-I292 VanDerWaalsContact O-N 3.14Å; V288-T326 HydrophobicContact CB-CG2 3.83Å; V288-T326 HydrophobicContact CG1-CG2 3.5Å; V288-T326 VanDerWaalsContact CG1-CG2 3.5Å; V288-L330 HydrophobicContact CG2-CD1 4.28Å; V288-F352 HydrophobicContact CG1-CD2 4.26Å; V288-F352 HydrophobicContact CG1-CE2 3.71Å; V288-L355 HydrophobicContact CG2-CD2 3.63Å; V288-L355 HydrophobicContact CG2-CG 4.46Å
289V81.5Confident73.7Confident9 Ų975.6 Ų75.66%0.05543%0.43CS..Hα-helixtrans-60.1-42.1176.9171.60000112.4S285 T286 L291 I292 E293 L323 T326S285-V289 WeakPolarHBondContact O-CG2 3.41Å; S285-V289 PolarHBondContact O-N 3.01Å; T286-V289 PolarHBondContact O-N 2.9Å; V289-L291 PolarHBondContact O-N 3.17Å; V289-I292 WeakPolarHBondContact O-CB 3.35Å; V289-I292 PolarHBondContact O-N 2.91Å; V289-E293 PolarHBondContact O-N 3.39Å; V289-E293 VanDerWaalsContact O-N 3.12Å; V289-L323 HydrophobicContact CB-CD2 3.72Å; V289-L323 HydrophobicContact CG1-CD2 3.92Å; V289-L323 HydrophobicContact CG1-CG 4.34Å; V289-L323 HydrophobicContact CG2-CD2 3.71Å; V289-L323 HydrophobicContact CG2-CG 4.41Å; V289-T326 VanDerWaalsContact CG2-CB 3.45Å; V289-T326 HydrophobicContact CG2-CG2 3.75Å; V289-T326 VanDerWaalsContact CG2-OG1 3.23Å; V289-T326 WeakPolarHBondContact CG2-OG1 3.41Å
290T82.1Confident71.4Confident95 Ų9578.4 Ų78.458%0.58344%0.441SS*.Hα-helixtrans-63-27.2176.349.60000113.2T286 A287 V288T286-T290 WeakPolarHBondContact O-CG2 3.44Å; T286-T290 PolarHBondContact O-N 3.2Å; T286-T290 PolarHBondContact O-OG1 3.39Å; T286-T290 VanDerWaalsContact O-OG1 3.14Å; A287-T290 WeakPolarHBondContact CA-OG1 3.44Å; A287-T290 PolarHBondContact O-OG1 2.78Å; V288-T290 VanDerWaalsContact C-N 3.35Å; V288-T290 PolarHBondContact O-N 3.39Å
291L78Confident69.3Low41 Ų4181.3 Ų81.322%0.21547%0.467CS..Hα-helixtrans-79.2-23.7176-162.567.8000112.4A287 V288 V289 F348 V351 F352A287-L291 PolarHBondContact O-N 3.17Å; V288-L291 WeakPolarHBondContact O-CB 3.07Å; V288-L291 PolarHBondContact O-N 2.96Å; V289-L291 PolarHBondContact O-N 3.17Å; L291-F348 HydrophobicContact CD1-CB 3.81Å; L291-F348 HydrophobicContact CD1-CD2 4.17Å; L291-F348 HydrophobicContact CD1-CG 4.34Å; L291-F348 HydrophobicContact CG-CB 4.45Å; L291-V351 HydrophobicContact CD1-CG1 4.39Å; L291-V351 HydrophobicContact CD2-CB 4.35Å; L291-V351 HydrophobicContact CD2-CG1 4.29Å; L291-F352 HydrophobicContact CD2-CB 3.59Å; L291-F352 HydrophobicContact CD2-CD2 4.21Å; L291-F352 HydrophobicContact CD2-CG 4.41Å
292I71.3Confident66.8Low11 Ų1187.1 Ų87.16%0.05650%0.503CS..Hα-helixtrans-84.3-21.1178.6-64.2154.8000111.5V288 V289 D294 T326 F342 Y346V288-I292 HydrophobicContact CG1-CD1 3.57Å; V288-I292 HydrophobicContact CG1-CG1 4.4Å; V288-I292 VanDerWaalsContact O-CD1 3.3Å; V288-I292 WeakPolarHBondContact O-CD1 3.29Å; V288-I292 VanDerWaalsContact O-CG1 3.27Å; V288-I292 WeakPolarHBondContact O-CG1 3.27Å; V288-I292 PolarHBondContact O-N 3.42Å; V288-I292 VanDerWaalsContact O-N 3.14Å; V289-I292 WeakPolarHBondContact O-CB 3.35Å; V289-I292 PolarHBondContact O-N 2.91Å; I292-D294 PolarHBondContact O-N 2.7Å; I292-T326 HydrophobicContact CD1-CG2 4.44Å; I292-F342 HydrophobicContact CD1-CE1 3.42Å; I292-F342 VanDerWaalsContact CD1-CE1 3.42Å; I292-F342 HydrophobicContact CD1-CZ 3.37Å; I292-F342 HydrophobicContact CG1-CE1 3.71Å; I292-F342 HydrophobicContact CG1-CZ 3.78Å; I292-F342 HydrophobicContact CG2-CZ 4.19Å; I292-Y346 HydrophobicContact CB-CE1 4.48Å; I292-Y346 HydrophobicContact CG1-CE1 4.24Å; I292-Y346 HydrophobicContact CG2-CE1 4.09Å
293E62Low64.5Low130 Ų13089.5 Ų89.561%0.60752%0.516SS*.  trans-74.514.5-165.5-137.3172.7-16700116.2V289V289-E293 PolarHBondContact O-N 3.39Å; V289-E293 VanDerWaalsContact O-N 3.12Å
294D56.9Low61.7Low135 Ų13593.2 Ų93.272%0.72254%0.536SS*.  trans-120.1126.7174.6-124.1-19.5000112.4I292I292-D294 PolarHBondContact O-N 2.7Å
295G52.9Low59.5Low74 Ų7496.5 Ų96.576%0.76356%0.561SS**SBendtrans147.34.2-178.700000115.9
296K49.4Very low57.6Low188 Ų188102.2 Ų102.282%0.81760%0.597SS**SBendtrans-14768.5169.3-157175.3-172.1173.90112.6
297N43.4Very low55.1Low154 Ų154107.2 Ų107.282%0.82462%0.616SS**SBendtrans-154.840.3160.6-92.5-22.1000113.4
298N42.8Very low52.8Low169 Ų169115.2 Ų115.290%0.90464%0.644SS**  trans-13860.3160.9-84.7-27.8000110.8
299S42.5Very low50.3Low113 Ų113121.6 Ų121.679%0.7969%0.687SS**  trans-105.398.2148.858.80000107.1
300L40.7Very low48.1Very low145 Ų145133.2 Ų133.276%0.75973%0.73SS**  trans-36.6140.6165.6-73.6145.1000111.1V302L300-V302 VanDerWaalsContact C-N 3.31Å; L300-V302 HydrophobicContact CB-CG2 4.31Å; L300-V302 PolarHBondContact O-N 3.48Å
301P43.7Very low45.7Very low130 Ų130132.2 Ų132.284%0.84474%0.739SS**  trans-75.390.2169.131.2-28.4000107.8
302V38.1Very low43.7Very low129 Ų129136.2 Ų136.278%0.78277%0.77SS**  trans-99.7117.8163.8178.30000107.4L300L300-V302 VanDerWaalsContact C-N 3.31Å; L300-V302 HydrophobicContact CB-CG2 4.31Å; L300-V302 PolarHBondContact O-N 3.48Å
303E41.3Very low42Very low175 Ų175139.9 Ų139.982%0.81880%0.802SS**  trans-61.9146.4-179.9-66.1178.7137.600112.9
304S32.1Very low40.7Very low116 Ų116139.9 Ų139.981%0.81182%0.815SS**  trans85.6158155.176.70000120.4
305P44.2Very low39.7Very low105 Ų105144.2 Ų144.268%0.68282%0.821SS**  -123.2-178.4-53.539.2-24.6000111.9
306P46.3Very low38.8Very low121 Ų121145.9 Ų145.979%0.78682%0.818SS**  trans-90.1116.2-15834.3-29.7000113.5
307H36.3Very low38.5Very low169 Ų169140.3 Ų140.378%0.78281%0.814SS**  trans-131.4111167.6-82.9-72.6000113.4
308K40.6Very low38.5Very low206 Ų206137.9 Ų137.990%0.89680%0.802SS**  trans15.2105.6150-70.8174.2176.1172.20117.3
309C30Very low38.8Very low139 Ų139134.4 Ų134.494%0.93979%0.791SS**  trans-98.4116.6154.3-73.40000110.1
310R36.3Very low39.2Very low253 Ų253133.9 Ų133.996%0.95577%0.772SS**  trans-111120.8172.6-171.1-176.9-167.8-175.73.3106.6
311G31Very low40.1Very low74 Ų74130.9 Ų130.976%0.76376%0.756SS**SBendtrans116.3112.1161.900000116.6
312S35.3Very low41.6Very low124 Ų124127.1 Ų127.187%0.86773%0.733SS**SBendtrans62.9119.5150.9-156.10000120.3
313A36.2Very low43.7Very low89 Ų89125.6 Ų125.674%0.73672%0.72SS**  trans71.950.4158.900000118.6R315A313-R315 PolarHBondContact O-N 3.25Å; A313-R315 VanDerWaalsContact O-N 3.09Å
314C34.7Very low45.7Very low129 Ų129125.4 Ų125.487%0.87271%0.713SS**  trans-74.683.4144.1-62.20000108.1
315R35.2Very low48Very low226 Ų226120.8 Ų120.885%0.85368%0.681SS**  trans-57126.1151.3-79.4-176.7179.7-179.40104.9A313 G317A313-R315 PolarHBondContact O-N 3.25Å; A313-R315 VanDerWaalsContact O-N 3.09Å; R315-G317 PolarHBondContact O-N 3.17Å
316P35.7Very low49.9Very low109 Ų109115.9 Ų115.971%0.70865%0.649SS**  trans-59.3111167.325.1-28.5000105N318P316-N318 PolarHBondContact O-N 3.12Å
317G41.2Very low51.8Low71 Ų71111.1 Ų111.173%0.73262%0.618SS**  trans-59.399.1164.900000104.9R315 S319R315-G317 PolarHBondContact O-N 3.17Å; G317-S319 PolarHBondContact O-N 2.94Å
318N44Very low54.1Low104 Ų104106.4 Ų106.456%0.55660%0.599SS**  trans-52.7112.1172-88.61.6000105.3P316 Y320P316-N318 PolarHBondContact O-N 3.12Å; N318-Y320 HydrophobicContact CB-CD2 4.06Å; N318-Y320 HydrophobicContact CB-CE1 4.48Å; N318-Y320 HydrophobicContact CB-CE2 3.69Å; N318-Y320 WeakPolarHBondContact O-CD2 3.33Å; N318-Y320 PolarHBondContact O-N 3.46Å
319S48.5Very low56.1Low96 Ų9698.3 Ų98.367%0.67156%0.564SS**  trans-67.290.4172.7-170.50000106G317 N321G317-S319 PolarHBondContact O-N 2.94Å; S319-N321 PolarHBondContact O-N 2.73Å
320Y52.8Low58.7Low102 Ų10292 Ų9240%0.452%0.521SS..  trans-68.17.7178-73.7-81.3000112.9N318 S322 S325 E329 F342N318-Y320 HydrophobicContact CB-CD2 4.06Å; N318-Y320 HydrophobicContact CB-CE1 4.48Å; N318-Y320 HydrophobicContact CB-CE2 3.69Å; N318-Y320 WeakPolarHBondContact O-CD2 3.33Å; N318-Y320 PolarHBondContact O-N 3.46Å; Y320-S322 PolarHBondContact O-N 3.22Å; Y320-S325 PolarHBondContact O-OG 3.18Å; Y320-E329 VanDerWaalsContact CD1-OE1 3.23Å; Y320-E329 WeakPolarHBondContact CD1-OE1 3.3Å; Y320-E329 VanDerWaalsContact CE1-OE1 3.26Å; Y320-E329 WeakPolarHBondContact CE1-OE1 3.08Å; Y320-F342 HydrophobicContact CD2-CE2 4.46Å; Y320-F342 HydrophobicContact CG-CE2 4.02Å
321N59.4Low61.1Low81 Ų8183.9 Ų83.943%0.43349%0.493SS..  trans-79.126.2-173.5-59.714.9000113.4S319S319-N321 PolarHBondContact O-N 2.73Å
322S73.7Confident63.6Low51 Ų5185.3 Ų85.336%0.35748%0.478SS..SBendtrans-106.4136.7175.280.40000110.3Y320 Y324 S325 T326Y320-S322 PolarHBondContact O-N 3.22Å; S322-Y324 PolarHBondContact O-N 3.48Å; S322-S325 PolarHBondContact N-OG 3.11Å; S322-S325 PolarHBondContact O-N 2.84Å; S322-S325 PolarHBondContact O-OG 3.38Å; S322-S325 PolarHBondContact OG-N 3.34Å; S322-S325 VanDerWaalsContact OG-N 3.13Å; S322-S325 PolarHBondContact OG-OG 3.42Å; S322-T326 PolarHBondContact O-N 3.25Å
323L82.3Confident65.8Low97 Ų9781.2 Ų81.251%0.50845%0.445SS..Hα-helixtrans-50.9-31.6172.4-71.8168.3000112.5T286 V289 C327T286-L323 HydrophobicContact CG2-CD2 3.79Å; V289-L323 HydrophobicContact CB-CD2 3.72Å; V289-L323 HydrophobicContact CG1-CD2 3.92Å; V289-L323 HydrophobicContact CG1-CG 4.34Å; V289-L323 HydrophobicContact CG2-CD2 3.71Å; V289-L323 HydrophobicContact CG2-CG 4.41Å; L323-C327 WeakPolarHBondContact O-CB 3.46Å; L323-C327 PolarHBondContact O-N 3.2Å
324Y83.4Confident68Low171 Ų17179 Ų7967%0.67142%0.422SS*.Hα-helixtrans-68.1-45.5177.5178.9-106.3000113.1S322 C327 L328S322-Y324 PolarHBondContact O-N 3.48Å; Y324-C327 PolarHBondContact O-N 3.07Å; Y324-L328 HydrophobicContact CD1-CD1 4.06Å; Y324-L328 HydrophobicContact CE1-CD1 3.43Å; Y324-L328 VanDerWaalsContact CE1-CD1 3.43Å; Y324-L328 HydrophobicContact CE1-CG 4.31Å; Y324-L328 HydrophobicContact CE2-CD1 4.16Å; Y324-L328 HydrophobicContact CE2-CG 4.26Å; Y324-L328 WeakPolarHBondContact O-CG 3.3Å; Y324-L328 PolarHBondContact O-N 2.93Å
325S80.9Confident70.2Confident20 Ų2078.6 Ų78.614%0.1441%0.41CS..Hα-helixtrans-64.5-45.3179.241.60000111.7Y320 S322 C327 L328 E329Y320-S325 PolarHBondContact O-OG 3.18Å; S322-S325 PolarHBondContact N-OG 3.11Å; S322-S325 PolarHBondContact O-N 2.84Å; S322-S325 PolarHBondContact O-OG 3.38Å; S322-S325 PolarHBondContact OG-N 3.34Å; S322-S325 VanDerWaalsContact OG-N 3.13Å; S322-S325 PolarHBondContact OG-OG 3.42Å; S325-C327 PolarHBondContact O-N 3.35Å; S325-L328 PolarHBondContact O-N 3.21Å; S325-E329 WeakPolarHBondContact O-CG 3.43Å; S325-E329 PolarHBondContact O-N 3.43Å
326T83.4Confident72.2Confident2 Ų271.1 Ų71.11%0.01240%0.403CS..Hα-helixtrans-66-38.2177.4-56.20000112.2V288 V289 I292 S322 L328 E329 L330V288-T326 HydrophobicContact CB-CG2 3.83Å; V288-T326 HydrophobicContact CG1-CG2 3.5Å; V288-T326 VanDerWaalsContact CG1-CG2 3.5Å; V289-T326 VanDerWaalsContact CG2-CB 3.45Å; V289-T326 HydrophobicContact CG2-CG2 3.75Å; V289-T326 VanDerWaalsContact CG2-OG1 3.23Å; V289-T326 WeakPolarHBondContact CG2-OG1 3.41Å; I292-T326 HydrophobicContact CD1-CG2 4.44Å; S322-T326 PolarHBondContact O-N 3.25Å; T326-L328 VanDerWaalsContact C-N 3.35Å; T326-L328 PolarHBondContact O-N 3.39Å; T326-E329 PolarHBondContact O-N 3.47Å; T326-L330 HydrophobicContact CG2-CD1 4.26Å; T326-L330 WeakPolarHBondContact O-CB 3.11Å; T326-L330 WeakPolarHBondContact O-CG 3.43Å; T326-L330 PolarHBondContact O-N 2.99Å
327C87.4Confident74.1Confident20 Ų2072.7 Ų72.714%0.13540%0.403CS..Hα-helixtrans-61.8-42173.8-179.10000112L281 S285 L323 Y324 S325 F331L281-C327 VanDerWaalsContact CD2-SG 3.58Å; S285-C327 VanDerWaalsContact OG-CA 3.31Å; S285-C327 WeakPolarHBondContact OG-CA 3.4Å; L323-C327 WeakPolarHBondContact O-CB 3.46Å; L323-C327 PolarHBondContact O-N 3.2Å; Y324-C327 PolarHBondContact O-N 3.07Å; S325-C327 PolarHBondContact O-N 3.35Å; C327-F331 VanDerWaalsContact O-CB 3.26Å; C327-F331 WeakPolarHBondContact O-CB 3.36Å; C327-F331 PolarHBondContact O-N 2.98Å
328L84.5Confident75.5Confident70 Ų7070.3 Ų70.337%0.36638%0.378SS..Hα-helixtrans-66.2-38.6175-74.3179.5000112.8Y324 S325 T326 F331 K332Y324-L328 HydrophobicContact CD1-CD1 4.06Å; Y324-L328 HydrophobicContact CE1-CD1 3.43Å; Y324-L328 VanDerWaalsContact CE1-CD1 3.43Å; Y324-L328 HydrophobicContact CE1-CG 4.31Å; Y324-L328 HydrophobicContact CE2-CD1 4.16Å; Y324-L328 HydrophobicContact CE2-CG 4.26Å; Y324-L328 WeakPolarHBondContact O-CG 3.3Å; Y324-L328 PolarHBondContact O-N 2.93Å; S325-L328 PolarHBondContact O-N 3.21Å; T326-L328 VanDerWaalsContact C-N 3.35Å; T326-L328 PolarHBondContact O-N 3.39Å; L328-F331 PolarHBondContact O-N 2.73Å; L328-K332 VanDerWaalsContact O-CG 3.29Å; L328-K332 WeakPolarHBondContact O-CG 3.41Å; L328-K332 PolarHBondContact O-N 3.42Å
329E81.2Confident76.6Confident37 Ų3771.1 Ų71.117%0.17338%0.382CS..Hα-helixtrans-67.2-47.1177.3-75.1173.1-175.700111.6Y320 S325 T326 F331 K332 F333Y320-E329 VanDerWaalsContact CD1-OE1 3.23Å; Y320-E329 WeakPolarHBondContact CD1-OE1 3.3Å; Y320-E329 VanDerWaalsContact CE1-OE1 3.26Å; Y320-E329 WeakPolarHBondContact CE1-OE1 3.08Å; S325-E329 WeakPolarHBondContact O-CG 3.43Å; S325-E329 PolarHBondContact O-N 3.43Å; T326-E329 PolarHBondContact O-N 3.47Å; E329-F331 VanDerWaalsContact C-N 3.29Å; E329-F331 PolarHBondContact O-N 2.92Å; E329-K332 WeakPolarHBondContact O-CA 3.38Å; E329-K332 WeakPolarHBondContact O-CB 3.48Å; E329-K332 PolarHBondContact O-N 2.81Å; E329-K332 VanDerWaalsContact O-N 3.08Å; E329-F333 WeakPolarHBondContact O-CD2 3.25Å; E329-F333 PolarHBondContact O-N 3.13Å
330L85.3Confident77.4Confident5 Ų571.6 Ų71.63%0.02638%0.377CS..Hα-helixtrans-60.4-39.6173.8-72.8175.2000111.7L281 F284 S285 V288 T326 K332 F333 T334 L356 Y359L281-L330 HydrophobicContact CD1-CB 3.87Å; F284-L330 HydrophobicContact CB-CD1 4.4Å; S285-L330 WeakPolarHBondContact OG-CD1 3.45Å; V288-L330 HydrophobicContact CG2-CD1 4.28Å; T326-L330 HydrophobicContact CG2-CD1 4.26Å; T326-L330 WeakPolarHBondContact O-CB 3.11Å; T326-L330 WeakPolarHBondContact O-CG 3.43Å; T326-L330 PolarHBondContact O-N 2.99Å; L330-K332 PolarHBondContact O-N 3.07Å; L330-F333 WeakPolarHBondContact O-CB 3.38Å; L330-F333 PolarHBondContact O-N 3.07Å; L330-T334 WeakPolarHBondContact O-CG2 3.11Å; L330-T334 PolarHBondContact O-N 2.89Å; L330-L356 HydrophobicContact CD2-CD1 3.82Å; L330-Y359 HydrophobicContact CB-CE1 4.17Å; L330-Y359 HydrophobicContact CD2-CD1 4.06Å; L330-Y359 HydrophobicContact CD2-CE1 4.03Å
331F86.1Confident77.7Confident84 Ų8474.8 Ų74.837%0.36840%0.395SS..Hα-helixtrans-60.5-44.9172.1179.1-97.5000111.9Y277 L281 C327 L328 E329 F333 T334 I335Y277-F331 HydrophobicContact CE1-CD2 4.04Å; Y277-F331 HydrophobicContact CE1-CE2 4.28Å; Y277-F331 WeakPolarHBondContact OH-CD2 3.34Å; L281-F331 HydrophobicContact CD1-CB 4.41Å; C327-F331 VanDerWaalsContact O-CB 3.26Å; C327-F331 WeakPolarHBondContact O-CB 3.36Å; C327-F331 PolarHBondContact O-N 2.98Å; L328-F331 PolarHBondContact O-N 2.73Å; E329-F331 VanDerWaalsContact C-N 3.29Å; E329-F331 PolarHBondContact O-N 2.92Å; F331-F333 VanDerWaalsContact C-N 3.3Å; F331-F333 PolarHBondContact O-N 3.3Å; F331-T334 PolarHBondContact O-N 3.42Å; F331-T334 VanDerWaalsContact O-N 3.17Å; F331-T334 PolarHBondContact O-OG1 2.9Å; F331-I335 HydrophobicContact CD1-CD1 4.03Å; F331-I335 HydrophobicContact CE1-CD1 3.35Å; F331-I335 HydrophobicContact CE2-CD1 4.33Å; F331-I335 HydrophobicContact CZ-CD1 3.53Å; F331-I335 HydrophobicContact CZ-CG1 4.5Å; F331-I335 PolarHBondContact O-N 2.87Å
332K84.9Confident77.6Confident103 Ų10372.4 Ų72.445%0.44838%0.381SS..Hα-helixtrans-60.2-39.5173.9-72.2170.9-176.6179.90111.9L328 E329 L330 T334 I335 G336 M337 G338L328-K332 VanDerWaalsContact O-CG 3.29Å; L328-K332 WeakPolarHBondContact O-CG 3.41Å; L328-K332 PolarHBondContact O-N 3.42Å; E329-K332 WeakPolarHBondContact O-CA 3.38Å; E329-K332 WeakPolarHBondContact O-CB 3.48Å; E329-K332 PolarHBondContact O-N 2.81Å; E329-K332 VanDerWaalsContact O-N 3.08Å; L330-K332 PolarHBondContact O-N 3.07Å; K332-T334 VanDerWaalsContact C-N 3.33Å; K332-T334 PolarHBondContact O-N 2.97Å; K332-I335 PolarHBondContact O-N 3.31Å; K332-G336 PolarHBondContact O-N 3.05Å; K332-G336 VanDerWaalsContact O-N 3.16Å; K332-M337 CarbonylContact O-C 3.59Å; K332-M337 PolarHBondContact O-N 2.97Å; K332-G338 PolarHBondContact O-N 3.43Å
333F81.6Confident76.9Confident39 Ų3970.6 Ų70.617%0.17137%0.368CS..Hα-helixtrans-59.5-41.3174.5-84.4-69.5000112.3E329 L330 F331 I335 G336 G338 D339 L340 L356E329-F333 WeakPolarHBondContact O-CD2 3.25Å; E329-F333 PolarHBondContact O-N 3.13Å; L330-F333 WeakPolarHBondContact O-CB 3.38Å; L330-F333 PolarHBondContact O-N 3.07Å; F331-F333 VanDerWaalsContact C-N 3.3Å; F331-F333 PolarHBondContact O-N 3.3Å; F333-I335 VanDerWaalsContact C-N 3.29Å; F333-I335 PolarHBondContact O-N 3.04Å; F333-G336 PolarHBondContact O-N 3.47Å; F333-G338 VanDerWaalsContact CE1-C 3.41Å; F333-G338 WeakPolarHBondContact CE1-O 3.29Å; F333-D339 WeakPolarHBondContact CZ-O 3.48Å; F333-L340 HydrophobicContact CE1-CD2 3.88Å; F333-L340 HydrophobicContact CE1-CG 4.07Å; F333-L340 HydrophobicContact CZ-CD2 3.97Å; F333-L340 HydrophobicContact CZ-CG 4.31Å; F333-L356 HydrophobicContact CD2-CD1 4.38Å; F333-L356 HydrophobicContact CG-CD1 4.48Å
334T81.1Confident75.7Confident43 Ų4373.4 Ų73.426%0.26438%0.378SS..Hα-helixtrans-65.9-28.9178.760.80000114.4Y277 L330 F331 K332 G336 Y359Y277-T334 HydrophobicContact CE2-CG2 3.98Å; Y277-T334 PolarHBondContact OH-OG1 3.25Å; L330-T334 WeakPolarHBondContact O-CG2 3.11Å; L330-T334 PolarHBondContact O-N 2.89Å; F331-T334 PolarHBondContact O-N 3.42Å; F331-T334 VanDerWaalsContact O-N 3.17Å; F331-T334 PolarHBondContact O-OG1 2.9Å; K332-T334 VanDerWaalsContact C-N 3.33Å; K332-T334 PolarHBondContact O-N 2.97Å; T334-G336 VanDerWaalsContact C-N 3.32Å; T334-Y359 HydrophobicContact CG2-CE1 3.47Å; T334-Y359 VanDerWaalsContact CG2-CE1 3.47Å; T334-Y359 VanDerWaalsContact CG2-CZ 3.44Å; T334-Y359 WeakPolarHBondContact CG2-OH 3.36Å
335I81.8Confident74.3Confident119 Ų11972.2 Ų72.261%0.6138%0.384SS*.Hα-helixtrans-80.7-18.1175.2-64.1172.6000111.1F331 K332 F333F331-I335 HydrophobicContact CD1-CD1 4.03Å; F331-I335 HydrophobicContact CE1-CD1 3.35Å; F331-I335 HydrophobicContact CE2-CD1 4.33Å; F331-I335 HydrophobicContact CZ-CD1 3.53Å; F331-I335 HydrophobicContact CZ-CG1 4.5Å; F331-I335 PolarHBondContact O-N 2.87Å; K332-I335 PolarHBondContact O-N 3.31Å; F333-I335 VanDerWaalsContact C-N 3.29Å; F333-I335 PolarHBondContact O-N 3.04Å
336G76.3Confident73.6Confident69 Ų6973.9 Ų73.971%0.71139%0.387SS*.THydrogen-bonded Turntrans9315.6-175.200000114.4K332 F333 T334K332-G336 PolarHBondContact O-N 3.05Å; K332-G336 VanDerWaalsContact O-N 3.16Å; F333-G336 PolarHBondContact O-N 3.47Å; T334-G336 VanDerWaalsContact C-N 3.32Å
337M76.5Confident72.7Confident143 Ų14380.1 Ų80.170%0.70442%0.421SS*.  trans-108.414.9177.8-160.5-171.3172.300112.4K332K332-M337 CarbonylContact O-C 3.59Å; K332-M337 PolarHBondContact O-N 2.97Å
338G69.7Low72.1Confident20 Ų2085.5 Ų85.521%0.20644%0.442CS..  trans-83.9125.7-179.300000111.6K332 F333K332-G338 PolarHBondContact O-N 3.43Å; F333-G338 VanDerWaalsContact CE1-C 3.41Å; F333-G338 WeakPolarHBondContact CE1-O 3.29Å
339D68.4Low71.6Confident121 Ų12187 Ų8765%0.64745%0.445SS*.  trans-89.7129.6174.9-68.2-34.8000110.4F333 E341F333-D339 WeakPolarHBondContact CZ-O 3.48Å; D339-E341 PolarHBondContact O-N 3.31Å
340L64.9Low71.5Confident107 Ų10788.5 Ų88.556%0.5647%0.465SS*.G310 helixtrans-75.82.9177.6-70.5164.6000113.2F333 F342 T343 L356F333-L340 HydrophobicContact CE1-CD2 3.88Å; F333-L340 HydrophobicContact CE1-CG 4.07Å; F333-L340 HydrophobicContact CZ-CD2 3.97Å; F333-L340 HydrophobicContact CZ-CG 4.31Å; L340-F342 PolarHBondContact O-N 3.23Å; L340-T343 WeakPolarHBondContact O-CB 3.26Å; L340-T343 PolarHBondContact O-N 3.08Å; L340-T343 PolarHBondContact O-OG1 3.32Å; L340-L356 HydrophobicContact CD2-CD2 3.65Å
341E59.1Low71.4Confident168 Ų16892 Ų9279%0.78549%0.486SS*.G310 helixtrans-60.7-15.5180-69.5-169.4167.700113.4D339 T343D339-E341 PolarHBondContact O-N 3.31Å; E341-T343 PolarHBondContact O-N 3.41Å
342F57.2Low71.2Confident31 Ų3188.5 Ų88.514%0.13647%0.471CS..G310 helixtrans-64.2-22.8171.5-168.4-105.3000112.7I292 Y320 L340 E344 Y346 F352I292-F342 HydrophobicContact CD1-CE1 3.42Å; I292-F342 VanDerWaalsContact CD1-CE1 3.42Å; I292-F342 HydrophobicContact CD1-CZ 3.37Å; I292-F342 HydrophobicContact CG1-CE1 3.71Å; I292-F342 HydrophobicContact CG1-CZ 3.78Å; I292-F342 HydrophobicContact CG2-CZ 4.19Å; Y320-F342 HydrophobicContact CD2-CE2 4.46Å; Y320-F342 HydrophobicContact CG-CE2 4.02Å; L340-F342 PolarHBondContact O-N 3.23Å; F342-E344 PolarHBondContact O-N 3.02Å; F342-Y346 AromaticContact CD1-CE2 3.6Å; F342-Y346 HydrophobicContact CD1-CE2 3.6Å; F342-Y346 AromaticContact CD1-CZ 3.87Å; F342-Y346 WeakPolarHBondContact CD1-OH 3.43Å; F342-Y346 WeakPolarHBondContact CD2-OH 3.25Å; F342-Y346 AromaticContact CE1-CE2 3.54Å; F342-Y346 HydrophobicContact CE1-CE2 3.54Å; F342-Y346 AromaticContact CE1-CZ 3.45Å; F342-Y346 VanDerWaalsContact CE1-CZ 3.45Å; F342-Y346 WeakPolarHBondContact CE1-OH 3.24Å; F342-Y346 WeakPolarHBondContact CE2-OH 3.19Å; F342-Y346 HydrophobicContact CG-CE2 4.33Å; F342-Y346 HydrophobicContact CZ-CE2 4.25Å; F342-Y346 AromaticContact CZ-CZ 3.68Å; F342-Y346 WeakPolarHBondContact CZ-OH 3.25Å; F342-Y346 WeakPolarHBondContact O-CE2 3.19Å; F342-Y346 PolarHBondContact O-OH 3.34Å; F342-F352 HydrophobicContact CD1-CE2 4.27Å; F342-F352 HydrophobicContact CD1-CZ 4.02Å; F342-F352 HydrophobicContact CE1-CE2 4.32Å
343T58.1Low71.1Confident13 Ų1387.6 Ų87.68%0.0847%0.47CS..G310 helixtrans-84.17.9-162.7-32.20000115.9L340 E341 K349 F352 I353L340-T343 WeakPolarHBondContact O-CB 3.26Å; L340-T343 PolarHBondContact O-N 3.08Å; L340-T343 PolarHBondContact O-OG1 3.32Å; E341-T343 PolarHBondContact O-N 3.41Å; T343-K349 HydrophobicContact CG2-CG 4.36Å; T343-F352 HydrophobicContact CG2-CD1 3.61Å; T343-F352 HydrophobicContact CG2-CE1 3.63Å; T343-I353 HydrophobicContact CG2-CG1 4.4Å
344E57.1Low71.3Confident157 Ų15791.2 Ų91.273%0.73449%0.49SS*.G310 helixtrans-88.7-15.9-168.8-68.5-164.9157.700115.5F342F342-E344 PolarHBondContact O-N 3.02Å
345N55.8Low71.6Confident146 Ų14691.2 Ų91.278%0.78149%0.488SS*.SBendtrans-129.545.4-169.8-67.5-36000115.7
346Y66.2Low71.7Confident54 Ų5486.4 Ų86.421%0.21246%0.463CS..  trans-126139.8-179.1-55.5-57.1000115.3I292 F342 F348I292-Y346 HydrophobicContact CB-CE1 4.48Å; I292-Y346 HydrophobicContact CG1-CE1 4.24Å; I292-Y346 HydrophobicContact CG2-CE1 4.09Å; F342-Y346 AromaticContact CD1-CE2 3.6Å; F342-Y346 HydrophobicContact CD1-CE2 3.6Å; F342-Y346 AromaticContact CD1-CZ 3.87Å; F342-Y346 WeakPolarHBondContact CD1-OH 3.43Å; F342-Y346 WeakPolarHBondContact CD2-OH 3.25Å; F342-Y346 AromaticContact CE1-CE2 3.54Å; F342-Y346 HydrophobicContact CE1-CE2 3.54Å; F342-Y346 AromaticContact CE1-CZ 3.45Å; F342-Y346 VanDerWaalsContact CE1-CZ 3.45Å; F342-Y346 WeakPolarHBondContact CE1-OH 3.24Å; F342-Y346 WeakPolarHBondContact CE2-OH 3.19Å; F342-Y346 HydrophobicContact CG-CE2 4.33Å; F342-Y346 HydrophobicContact CZ-CE2 4.25Å; F342-Y346 AromaticContact CZ-CZ 3.68Å; F342-Y346 WeakPolarHBondContact CZ-OH 3.25Å; F342-Y346 WeakPolarHBondContact O-CE2 3.19Å; F342-Y346 PolarHBondContact O-OH 3.34Å; Y346-F348 VanDerWaalsContact C-N 3.32Å; Y346-F348 PolarHBondContact O-N 3.36Å
347D63.8Low72.1Confident134 Ų13488.1 Ų88.172%0.71746%0.455SS*.THydrogen-bonded Turntrans-63.4-34.8-179.2-65.4-30.9000112.8
348F73.8Confident72.7Confident133 Ų13383 Ų8358%0.58344%0.436SS*.THydrogen-bonded Turntrans-112.350.2-178.7-60.2-69.7000113L291 Y346 A350 V351 F352L291-F348 HydrophobicContact CD1-CB 3.81Å; L291-F348 HydrophobicContact CD1-CD2 4.17Å; L291-F348 HydrophobicContact CD1-CG 4.34Å; L291-F348 HydrophobicContact CG-CB 4.45Å; Y346-F348 VanDerWaalsContact C-N 3.32Å; Y346-F348 PolarHBondContact O-N 3.36Å; F348-A350 PolarHBondContact O-N 3.07Å; F348-A350 VanDerWaalsContact O-N 3.16Å; F348-V351 HydrophobicContact CB-CB 4.28Å; F348-V351 HydrophobicContact CB-CG2 4.31Å; F348-V351 PolarHBondContact O-N 3.46Å; F348-V351 VanDerWaalsContact O-N 3.08Å; F348-F352 PolarHBondContact O-N 3Å; F348-F352 VanDerWaalsContact O-N 3.15Å
349K74.8Confident73.5Confident100 Ų10082.1 Ų82.144%0.43543%0.427SS..Hα-helixtrans-51.7-38.6-178.8-173.3169.9-176.11670114.2T343 F352 I353T343-K349 HydrophobicContact CG2-CG 4.36Å; K349-F352 PolarHBondContact O-N 3.44Å; K349-I353 HydrophobicContact CG-CD1 3.95Å; K349-I353 WeakPolarHBondContact O-CG1 3.06Å; K349-I353 PolarHBondContact O-N 3.11Å; K349-I353 VanDerWaalsContact O-N 3.08Å
350A79.4Confident74.3Confident70 Ų7079.4 Ų79.458%0.57941%0.414SS*.Hα-helixtrans-65.3-42.8179.300000112.5F348 F352 I353 I354F348-A350 PolarHBondContact O-N 3.07Å; F348-A350 VanDerWaalsContact O-N 3.16Å; A350-F352 VanDerWaalsContact C-N 3.34Å; A350-I353 PolarHBondContact O-N 2.91Å; A350-I354 WeakPolarHBondContact O-CD1 3.3Å; A350-I354 VanDerWaalsContact O-CG1 3.27Å; A350-I354 WeakPolarHBondContact O-CG1 3.2Å; A350-I354 PolarHBondContact O-N 3.17Å; A350-I354 VanDerWaalsContact O-N 3.08Å
351V83.1Confident75.3Confident79 Ų7978.1 Ų78.148%0.47941%0.407SS..Hα-helixtrans-66.6-40.3179.1-179.50000110.4L291 F348 I354 L355L291-V351 HydrophobicContact CD1-CG1 4.39Å; L291-V351 HydrophobicContact CD2-CB 4.35Å; L291-V351 HydrophobicContact CD2-CG1 4.29Å; F348-V351 HydrophobicContact CB-CB 4.28Å; F348-V351 HydrophobicContact CB-CG2 4.31Å; F348-V351 PolarHBondContact O-N 3.46Å; F348-V351 VanDerWaalsContact O-N 3.08Å; V351-I354 PolarHBondContact O-N 3.48Å; V351-L355 WeakPolarHBondContact O-CB 3.38Å; V351-L355 PolarHBondContact O-N 2.81Å
352F82Confident76.4Confident10 Ų1072.8 Ų72.84%0.04438%0.384CS..Hα-helixtrans-59.3-49.7175.3179.3-95.7000112.1V288 L291 F342 T343 F348 K349 A350 I354 L355 L356V288-F352 HydrophobicContact CG1-CD2 4.26Å; V288-F352 HydrophobicContact CG1-CE2 3.71Å; L291-F352 HydrophobicContact CD2-CB 3.59Å; L291-F352 HydrophobicContact CD2-CD2 4.21Å; L291-F352 HydrophobicContact CD2-CG 4.41Å; F342-F352 HydrophobicContact CD1-CE2 4.27Å; F342-F352 HydrophobicContact CD1-CZ 4.02Å; F342-F352 HydrophobicContact CE1-CE2 4.32Å; T343-F352 HydrophobicContact CG2-CD1 3.61Å; T343-F352 HydrophobicContact CG2-CE1 3.63Å; F348-F352 PolarHBondContact O-N 3Å; F348-F352 VanDerWaalsContact O-N 3.15Å; K349-F352 PolarHBondContact O-N 3.44Å; A350-F352 VanDerWaalsContact C-N 3.34Å; F352-I354 VanDerWaalsContact C-N 3.34Å; F352-I354 PolarHBondContact O-N 3.16Å; F352-L355 PolarHBondContact O-N 3.13Å; F352-L356 HydrophobicContact CE1-CD2 4.34Å; F352-L356 WeakPolarHBondContact O-CB 3.33Å; F352-L356 PolarHBondContact O-N 2.85Å
353I82.3Confident77.6Confident84 Ų8472 Ų7243%0.43138%0.381SS..Hα-helixtrans-62.8-41.7-179.4-68.3168.6000110.9T343 K349 A350 L356 L357T343-I353 HydrophobicContact CG2-CG1 4.4Å; K349-I353 HydrophobicContact CG-CD1 3.95Å; K349-I353 WeakPolarHBondContact O-CG1 3.06Å; K349-I353 PolarHBondContact O-N 3.11Å; K349-I353 VanDerWaalsContact O-N 3.08Å; A350-I353 PolarHBondContact O-N 2.91Å; I353-L356 PolarHBondContact O-N 2.9Å; I353-L357 VanDerWaalsContact O-CB 3.3Å; I353-L357 WeakPolarHBondContact O-CB 3.27Å; I353-L357 PolarHBondContact O-N 3.26Å
354I86.6Confident78.6Confident115 Ų11578.7 Ų78.759%0.5941%0.406SS*.Hα-helixtrans-64.4-43.7177.7-68166000110.8A350 V351 F352 L357 A358A350-I354 WeakPolarHBondContact O-CD1 3.3Å; A350-I354 VanDerWaalsContact O-CG1 3.27Å; A350-I354 WeakPolarHBondContact O-CG1 3.2Å; A350-I354 PolarHBondContact O-N 3.17Å; A350-I354 VanDerWaalsContact O-N 3.08Å; V351-I354 PolarHBondContact O-N 3.48Å; F352-I354 VanDerWaalsContact C-N 3.34Å; F352-I354 PolarHBondContact O-N 3.16Å; I354-L357 PolarHBondContact O-N 3.43Å; I354-A358 WeakPolarHBondContact O-CB 3.5Å; I354-A358 PolarHBondContact O-N 3.06Å
355L86.8Confident79.6Confident42 Ų4275.4 Ų75.422%0.2239%0.393CS..Hα-helixtrans-64.5-41.9178.8-172.569.8000111.7F284 A287 V288 V351 F352 A358 Y359F284-L355 HydrophobicContact CD1-CD1 3.84Å; F284-L355 HydrophobicContact CD1-CG 4.08Å; F284-L355 HydrophobicContact CE1-CD1 3.75Å; F284-L355 HydrophobicContact CE1-CG 4.34Å; A287-L355 HydrophobicContact CB-CD2 3.85Å; V288-L355 HydrophobicContact CG2-CD2 3.63Å; V288-L355 HydrophobicContact CG2-CG 4.46Å; V351-L355 WeakPolarHBondContact O-CB 3.38Å; V351-L355 PolarHBondContact O-N 2.81Å; F352-L355 PolarHBondContact O-N 3.13Å; L355-A358 PolarHBondContact O-N 3.21Å; L355-Y359 WeakPolarHBondContact O-CB 3.21Å; L355-Y359 PolarHBondContact O-N 3.08Å
356L83.7Confident80.3Confident18 Ų1873 Ų739%0.09438%0.379CS..Hα-helixtrans-65.5-43.6176.1-172.671.5000111.5L330 F333 L340 F352 I353 Y359 V360L330-L356 HydrophobicContact CD2-CD1 3.82Å; F333-L356 HydrophobicContact CD2-CD1 4.38Å; F333-L356 HydrophobicContact CG-CD1 4.48Å; L340-L356 HydrophobicContact CD2-CD2 3.65Å; F352-L356 HydrophobicContact CE1-CD2 4.34Å; F352-L356 WeakPolarHBondContact O-CB 3.33Å; F352-L356 PolarHBondContact O-N 2.85Å; I353-L356 PolarHBondContact O-N 2.9Å; L356-Y359 WeakPolarHBondContact O-CB 3.34Å; L356-Y359 PolarHBondContact O-N 2.72Å; L356-V360 WeakPolarHBondContact O-CG2 3.5Å; L356-V360 PolarHBondContact O-N 3.47Å
357L85.5Confident80.8Confident105 Ų10571.2 Ų71.255%0.5537%0.373SS..Hα-helixtrans-62.7-44.7176.3-170.1107.5000111.2I353 I354 Y359 V360 I361I353-L357 VanDerWaalsContact O-CB 3.3Å; I353-L357 WeakPolarHBondContact O-CB 3.27Å; I353-L357 PolarHBondContact O-N 3.26Å; I354-L357 PolarHBondContact O-N 3.43Å; L357-Y359 VanDerWaalsContact C-N 3.33Å; L357-Y359 PolarHBondContact O-N 2.93Å; L357-V360 PolarHBondContact O-N 3.41Å; L357-I361 HydrophobicContact CD2-CD1 3.71Å; L357-I361 HydrophobicContact CG-CD1 3.91Å; L357-I361 WeakPolarHBondContact O-CB 3.24Å; L357-I361 VanDerWaalsContact O-CG1 3.29Å; L357-I361 WeakPolarHBondContact O-CG1 3.35Å; L357-I361 PolarHBondContact O-N 3.41Å
358A87.8Confident81.4Confident36 Ų3667.7 Ų67.730%0.29835%0.354SS..Hα-helixtrans-60.5-43.4175.400000111.4I354 L355 I361 L362I354-A358 WeakPolarHBondContact O-CB 3.5Å; I354-A358 PolarHBondContact O-N 3.06Å; L355-A358 PolarHBondContact O-N 3.21Å; A358-I361 PolarHBondContact O-N 3.43Å; A358-L362 VanDerWaalsContact O-CB 3.29Å; A358-L362 WeakPolarHBondContact O-CB 3.26Å; A358-L362 WeakPolarHBondContact O-CG 3.48Å; A358-L362 PolarHBondContact O-N 3.35Å
359Y88Confident81.7Confident2 Ų265.7 Ų65.71%0.00835%0.35CS..Hα-helixtrans-59-49.5175174.1-109.2000112.2L281 F284 L330 T334 L355 L356 L357 I361 L362 T363L281-Y359 VanDerWaalsContact CD1-OH 3.3Å; L281-Y359 WeakPolarHBondContact CD1-OH 3.4Å; F284-Y359 HydrophobicContact CB-CD2 3.75Å; F284-Y359 HydrophobicContact CB-CE2 4.19Å; F284-Y359 HydrophobicContact CB-CG 4.45Å; F284-Y359 AromaticContact CD1-CD2 3.99Å; F284-Y359 HydrophobicContact CD1-CD2 3.99Å; F284-Y359 HydrophobicContact CD1-CG 4.24Å; F284-Y359 AromaticContact CD2-CD2 3.93Å; F284-Y359 HydrophobicContact CD2-CD2 3.93Å; F284-Y359 AromaticContact CG-CD2 3.61Å; F284-Y359 HydrophobicContact CG-CD2 3.61Å; F284-Y359 HydrophobicContact CG-CE2 4.42Å; F284-Y359 HydrophobicContact CG-CG 4.29Å; L330-Y359 HydrophobicContact CB-CE1 4.17Å; L330-Y359 HydrophobicContact CD2-CD1 4.06Å; L330-Y359 HydrophobicContact CD2-CE1 4.03Å; T334-Y359 HydrophobicContact CG2-CE1 3.47Å; T334-Y359 VanDerWaalsContact CG2-CE1 3.47Å; T334-Y359 VanDerWaalsContact CG2-CZ 3.44Å; T334-Y359 WeakPolarHBondContact CG2-OH 3.36Å; L355-Y359 WeakPolarHBondContact O-CB 3.21Å; L355-Y359 PolarHBondContact O-N 3.08Å; L356-Y359 WeakPolarHBondContact O-CB 3.34Å; L356-Y359 PolarHBondContact O-N 2.72Å; L357-Y359 VanDerWaalsContact C-N 3.33Å; L357-Y359 PolarHBondContact O-N 2.93Å; Y359-I361 PolarHBondContact O-N 3.12Å; Y359-L362 PolarHBondContact O-N 2.84Å; Y359-T363 HydrophobicContact CD2-CG2 3.75Å; Y359-T363 HydrophobicContact CE2-CG2 3.47Å; Y359-T363 VanDerWaalsContact CE2-CG2 3.47Å; Y359-T363 HydrophobicContact CG-CG2 4.41Å; Y359-T363 WeakPolarHBondContact O-CB 3.44Å; Y359-T363 WeakPolarHBondContact O-CG2 3.3Å; Y359-T363 PolarHBondContact O-N 3.25Å; Y359-T363 PolarHBondContact O-OG1 3.38Å
360V84.9Confident81.9Confident64 Ų6466.6 Ų66.639%0.38836%0.357SS..Hα-helixtrans-63-44.4179.7172.30000111L356 L357 T363 Y364L356-V360 WeakPolarHBondContact O-CG2 3.5Å; L356-V360 PolarHBondContact O-N 3.47Å; L357-V360 PolarHBondContact O-N 3.41Å; V360-T363 PolarHBondContact O-OG1 3.48Å; V360-Y364 WeakPolarHBondContact O-CB 3.29Å; V360-Y364 PolarHBondContact O-N 3.32Å
361I85.6Confident82Confident80 Ų8064.2 Ų64.241%0.4133%0.334SS..Hα-helixtrans-62.9-49.5177.9-70.9171.1000110.9L357 A358 Y359 I365L357-I361 HydrophobicContact CD2-CD1 3.71Å; L357-I361 HydrophobicContact CG-CD1 3.91Å; L357-I361 WeakPolarHBondContact O-CB 3.24Å; L357-I361 VanDerWaalsContact O-CG1 3.29Å; L357-I361 WeakPolarHBondContact O-CG1 3.35Å; L357-I361 PolarHBondContact O-N 3.41Å; A358-I361 PolarHBondContact O-N 3.43Å; Y359-I361 PolarHBondContact O-N 3.12Å; I361-I365 HydrophobicContact CG2-CD1 3.95Å; I361-I365 HydrophobicContact CG2-CG1 4.45Å; I361-I365 WeakPolarHBondContact O-CA 3.5Å; I361-I365 WeakPolarHBondContact O-CB 3.29Å; I361-I365 WeakPolarHBondContact O-CG1 3.39Å; I361-I365 PolarHBondContact O-N 3.42Å
362L82.5Confident81.9Confident56 Ų5665.9 Ų65.929%0.29334%0.339SS..Iπ-helixtrans-65.2-44-178.1-69.4171000111.5F284 A358 Y359 L366F284-L362 HydrophobicContact CE2-CD1 4.39Å; F284-L362 HydrophobicContact CZ-CD1 3.84Å; A358-L362 VanDerWaalsContact O-CB 3.29Å; A358-L362 WeakPolarHBondContact O-CB 3.26Å; A358-L362 WeakPolarHBondContact O-CG 3.48Å; A358-L362 PolarHBondContact O-N 3.35Å; Y359-L362 PolarHBondContact O-N 2.84Å; L362-L366 HydrophobicContact CD2-CD1 3.45Å; L362-L366 VanDerWaalsContact CD2-CD1 3.45Å; L362-L366 HydrophobicContact CD2-CG 4.46Å; L362-L366 VanDerWaalsContact O-CB 3.26Å; L362-L366 WeakPolarHBondContact O-CB 3.5Å; L362-L366 PolarHBondContact O-N 2.99Å; L362-L366 VanDerWaalsContact O-N 3.16Å
363T81.9Confident81.8Confident14 Ų1468 Ų689%0.08636%0.359CS..Iπ-helixtrans-71.5-44.2-179.754.50000112.4Y359 V360 L367Y359-T363 HydrophobicContact CD2-CG2 3.75Å; Y359-T363 HydrophobicContact CE2-CG2 3.47Å; Y359-T363 VanDerWaalsContact CE2-CG2 3.47Å; Y359-T363 HydrophobicContact CG-CG2 4.41Å; Y359-T363 WeakPolarHBondContact O-CB 3.44Å; Y359-T363 WeakPolarHBondContact O-CG2 3.3Å; Y359-T363 PolarHBondContact O-N 3.25Å; Y359-T363 PolarHBondContact O-OG1 3.38Å; V360-T363 PolarHBondContact O-OG1 3.48Å; T363-L367 HydrophobicContact CG2-CD1 4.06Å; T363-L367 VanDerWaalsContact O-CB 3.23Å; T363-L367 WeakPolarHBondContact O-CB 3.34Å; T363-L367 PolarHBondContact O-N 2.8Å
364Y79.4Confident81.6Confident154 Ų15467.4 Ų67.460%0.60436%0.356SS*.Iπ-helixtrans-77.3-44.9-177.1-163.4-98.5000112.3V360 L368V360-Y364 WeakPolarHBondContact O-CB 3.29Å; V360-Y364 PolarHBondContact O-N 3.32Å; Y364-L368 HydrophobicContact CD1-CD1 4.3Å; Y364-L368 HydrophobicContact CD2-CD1 3.37Å; Y364-L368 HydrophobicContact CE1-CD1 4.31Å; Y364-L368 HydrophobicContact CE2-CD1 3.38Å; Y364-L368 HydrophobicContact CG-CD1 3.86Å; Y364-L368 VanDerWaalsContact O-CB 3.26Å; Y364-L368 WeakPolarHBondContact O-CB 3.45Å; Y364-L368 WeakPolarHBondContact O-CD1 3.26Å
365I77.2Confident81.3Confident87 Ų8763.7 Ų63.745%0.44634%0.337SS..Iπ-helixtrans-82.2-44.6-175.1-55.5-172.5000111.8I361 N369I361-I365 HydrophobicContact CG2-CD1 3.95Å; I361-I365 HydrophobicContact CG2-CG1 4.45Å; I361-I365 WeakPolarHBondContact O-CA 3.5Å; I361-I365 WeakPolarHBondContact O-CB 3.29Å; I361-I365 WeakPolarHBondContact O-CG1 3.39Å; I361-I365 PolarHBondContact O-N 3.42Å; I365-N369 VanDerWaalsContact O-CB 3.28Å; I365-N369 WeakPolarHBondContact O-CB 3.31Å; I365-N369 VanDerWaalsContact O-CG 3.25Å; I365-N369 PolarHBondContact O-ND2 3.48Å
366L71.8Confident81.1Confident95 Ų9563.3 Ų63.350%0.49734%0.343SS..Iπ-helixtrans-83.2-45.6-175.6-58.7175.1000111.6L362 M370L362-L366 HydrophobicContact CD2-CD1 3.45Å; L362-L366 VanDerWaalsContact CD2-CD1 3.45Å; L362-L366 HydrophobicContact CD2-CG 4.46Å; L362-L366 VanDerWaalsContact O-CB 3.26Å; L362-L366 WeakPolarHBondContact O-CB 3.5Å; L362-L366 PolarHBondContact O-N 2.99Å; L362-L366 VanDerWaalsContact O-N 3.16Å; L366-M370 WeakPolarHBondContact O-CB 3.35Å; L366-M370 WeakPolarHBondContact O-CG 3.26Å; L366-M370 PolarHBondContact O-N 3.02Å; L366-M370 VanDerWaalsContact O-N 3.12Å
367L75.5Confident81Confident17 Ų1769.2 Ų69.29%0.08937%0.37CS..Iπ-helixtrans-77.3-38.6-172-51.7176.8000112.4F273 V276 Y277 F280 T363 L371F273-L367 HydrophobicContact CD2-CB 4.36Å; F273-L367 HydrophobicContact CE2-CB 3.59Å; F273-L367 WeakPolarHBondContact CE2-O 3.41Å; F273-L367 HydrophobicContact CZ-CB 4.34Å; V276-L367 HydrophobicContact CG1-CD2 3.72Å; Y277-L367 HydrophobicContact CD2-CD1 4.12Å; F280-L367 HydrophobicContact CD2-CD1 4.34Å; F280-L367 HydrophobicContact CD2-CD2 4.41Å; F280-L367 HydrophobicContact CE2-CD2 4.3Å; T363-L367 HydrophobicContact CG2-CD1 4.06Å; T363-L367 VanDerWaalsContact O-CB 3.23Å; T363-L367 WeakPolarHBondContact O-CB 3.34Å; T363-L367 PolarHBondContact O-N 2.8Å; L367-L371 VanDerWaalsContact O-CB 3.29Å; L367-L371 WeakPolarHBondContact O-CB 3.29Å; L367-L371 PolarHBondContact O-N 3.17Å
368L76.6Confident80.7Confident60 Ų6064.6 Ų64.631%0.31435%0.346SS..Hα-helixtrans-67.4-42.5175.9-67.9173.7000112.1Y364 M370 L371 I372Y364-L368 HydrophobicContact CD1-CD1 4.3Å; Y364-L368 HydrophobicContact CD2-CD1 3.37Å; Y364-L368 HydrophobicContact CE1-CD1 4.31Å; Y364-L368 HydrophobicContact CE2-CD1 3.38Å; Y364-L368 HydrophobicContact CG-CD1 3.86Å; Y364-L368 VanDerWaalsContact O-CB 3.26Å; Y364-L368 WeakPolarHBondContact O-CB 3.45Å; Y364-L368 WeakPolarHBondContact O-CD1 3.26Å; L368-M370 VanDerWaalsContact C-N 3.33Å; L368-M370 PolarHBondContact O-N 3.16Å; L368-L371 PolarHBondContact O-N 2.84Å; L368-I372 WeakPolarHBondContact O-CB 3.17Å; L368-I372 VanDerWaalsContact O-CG1 3.24Å; L368-I372 WeakPolarHBondContact O-CG1 3.34Å; L368-I372 PolarHBondContact O-N 3.33Å
369N79.4Confident80.4Confident92 Ų9265 Ų6549%0.49234%0.344SS..Hα-helixtrans-65.2-38.3179.1-73.7-28.6000111.9I365 A373I365-N369 VanDerWaalsContact O-CB 3.28Å; I365-N369 WeakPolarHBondContact O-CB 3.31Å; I365-N369 VanDerWaalsContact O-CG 3.25Å; I365-N369 PolarHBondContact O-ND2 3.48Å; N369-A373 WeakPolarHBondContact O-CB 3.09Å; N369-A373 PolarHBondContact O-N 3.48Å
370M79.1Confident80Confident118 Ų11871 Ų7158%0.58138%0.377SS*.Hα-helixtrans-67.2-39.6172.1-72.2-67.5100.300112.4L366 L368 A373 L374L366-M370 WeakPolarHBondContact O-CB 3.35Å; L366-M370 WeakPolarHBondContact O-CG 3.26Å; L366-M370 PolarHBondContact O-N 3.02Å; L366-M370 VanDerWaalsContact O-N 3.12Å; L368-M370 VanDerWaalsContact C-N 3.33Å; L368-M370 PolarHBondContact O-N 3.16Å; M370-A373 PolarHBondContact O-N 3.41Å; M370-L374 WeakPolarHBondContact O-CB 3.21Å; M370-L374 VanDerWaalsContact O-CG 3.3Å; M370-L374 WeakPolarHBondContact O-CG 3.36Å; M370-L374 PolarHBondContact O-N 2.91Å
371L81.6Confident79.7Confident21 Ų2174.5 Ų74.511%0.1139%0.387CS..Hα-helixtrans-62.5-47.5176.8-17563.2000111.6F273 L367 L368 A373 L374 M375F273-L371 HydrophobicContact CB-CD1 3.73Å; F273-L371 HydrophobicContact CD1-CD1 4.42Å; F273-L371 HydrophobicContact CD1-CD2 4.44Å; F273-L371 HydrophobicContact CD2-CB 3.85Å; F273-L371 HydrophobicContact CD2-CD1 3.84Å; F273-L371 HydrophobicContact CD2-CD2 4.12Å; F273-L371 HydrophobicContact CD2-CG 4.16Å; F273-L371 HydrophobicContact CE1-CD2 4.4Å; F273-L371 HydrophobicContact CE2-CB 4.02Å; F273-L371 HydrophobicContact CE2-CD2 4.01Å; F273-L371 HydrophobicContact CE2-CG 4.43Å; F273-L371 HydrophobicContact CG-CD1 3.75Å; F273-L371 HydrophobicContact CG-CD2 4.32Å; F273-L371 HydrophobicContact CG-CG 4.45Å; F273-L371 HydrophobicContact CZ-CD2 4.18Å; L367-L371 VanDerWaalsContact O-CB 3.29Å; L367-L371 WeakPolarHBondContact O-CB 3.29Å; L367-L371 PolarHBondContact O-N 3.17Å; L368-L371 PolarHBondContact O-N 2.84Å; L371-A373 VanDerWaalsContact C-N 3.33Å; L371-A373 PolarHBondContact O-N 2.87Å; L371-L374 PolarHBondContact O-N 2.72Å; L371-M375 HydrophobicContact CD1-CE 3.53Å; L371-M375 HydrophobicContact CD1-CG 4.32Å; L371-M375 HydrophobicContact CD1-SD 4.2Å; L371-M375 HydrophobicContact CD2-CE 4.16Å; L371-M375 HydrophobicContact CG-CE 3.85Å; L371-M375 HydrophobicContact CG-CG 4.46Å; L371-M375 HydrophobicContact CG-SD 4Å; L371-M375 WeakPolarHBondContact O-CB 3.45Å; L371-M375 VanDerWaalsContact O-CG 3.27Å; L371-M375 WeakPolarHBondContact O-CG 3.48Å; L371-M375 PolarHBondContact O-N 2.58Å
372I81.6Confident79.3Confident113 Ų11370.7 Ų70.758%0.57937%0.367SS*.Hα-helixtrans-62.7-42.4178.9-66.1164.4000110.3L368 M375 G376L368-I372 WeakPolarHBondContact O-CB 3.17Å; L368-I372 VanDerWaalsContact O-CG1 3.24Å; L368-I372 WeakPolarHBondContact O-CG1 3.34Å; L368-I372 PolarHBondContact O-N 3.33Å; I372-M375 PolarHBondContact O-N 3.13Å; I372-G376 PolarHBondContact O-N 3.41Å
373A79.4Confident79.1Confident55 Ų5570.6 Ų70.646%0.45537%0.374SS..Hα-helixtrans-62.2-47.3177.500000112.1N369 M370 L371 G376 E377N369-A373 WeakPolarHBondContact O-CB 3.09Å; N369-A373 PolarHBondContact O-N 3.48Å; M370-A373 PolarHBondContact O-N 3.41Å; L371-A373 VanDerWaalsContact C-N 3.33Å; L371-A373 PolarHBondContact O-N 2.87Å; A373-G376 PolarHBondContact O-N 3.39Å; A373-E377 PolarHBondContact O-N 3.4Å; A373-E377 VanDerWaalsContact O-N 3.13Å
374L79.5Confident78.8Confident72 Ų7278 Ų7838%0.37741%0.408SS..Hα-helixtrans-63.7-44.6177.6-72.7170.1000111.7M370 L371 G376 T378M370-L374 WeakPolarHBondContact O-CB 3.21Å; M370-L374 VanDerWaalsContact O-CG 3.3Å; M370-L374 WeakPolarHBondContact O-CG 3.36Å; M370-L374 PolarHBondContact O-N 2.91Å; L371-L374 PolarHBondContact O-N 2.72Å; L374-G376 VanDerWaalsContact C-N 3.34Å; L374-G376 PolarHBondContact O-N 3.06Å; L374-T378 VanDerWaalsContact O-CB 3.25Å; L374-T378 WeakPolarHBondContact O-CB 3.22Å; L374-T378 PolarHBondContact O-N 3.29Å; L374-T378 PolarHBondContact O-OG1 3.28Å
375M80Confident78.9Confident37 Ų3774.3 Ų74.318%0.18240%0.396CS..Hα-helixtrans-64.4-38.4176.8-72.5-176.2171.700111.9M265 L270 L371 I372 T378 V379M265-M375 HydrophobicContact CE-CE 3.86Å; M265-M375 HydrophobicContact CE-CG 4.43Å; M265-M375 HydrophobicContact CE-SD 3.73Å; M265-M375 HydrophobicContact CG-CB 4.36Å; M265-M375 HydrophobicContact CG-CE 4.07Å; M265-M375 HydrophobicContact CG-CG 3.73Å; M265-M375 HydrophobicContact CG-SD 4.2Å; M265-M375 HydrophobicContact SD-CB 3.87Å; M265-M375 HydrophobicContact SD-CE 4.22Å; M265-M375 HydrophobicContact SD-CG 3.64Å; M265-M375 HydrophobicContact SD-SD 3.71Å; L270-M375 HydrophobicContact CD1-CE 4.27Å; L371-M375 HydrophobicContact CD1-CE 3.53Å; L371-M375 HydrophobicContact CD1-CG 4.32Å; L371-M375 HydrophobicContact CD1-SD 4.2Å; L371-M375 HydrophobicContact CD2-CE 4.16Å; L371-M375 HydrophobicContact CG-CE 3.85Å; L371-M375 HydrophobicContact CG-CG 4.46Å; L371-M375 HydrophobicContact CG-SD 4Å; L371-M375 WeakPolarHBondContact O-CB 3.45Å; L371-M375 VanDerWaalsContact O-CG 3.27Å; L371-M375 WeakPolarHBondContact O-CG 3.48Å; L371-M375 PolarHBondContact O-N 2.58Å; I372-M375 PolarHBondContact O-N 3.13Å; M375-T378 PolarHBondContact O-N 3.03Å; M375-V379 WeakPolarHBondContact O-CB 3.23Å; M375-V379 VanDerWaalsContact O-CG2 3.25Å; M375-V379 WeakPolarHBondContact O-CG2 3.21Å; M375-V379 PolarHBondContact O-N 2.89Å
376G81.6Confident79.2Confident33 Ų3370.2 Ų70.234%0.3438%0.375SS..Hα-helixtrans-63.5-47.1178.600000113.4I372 A373 L374 T378 V379 N380I372-G376 PolarHBondContact O-N 3.41Å; A373-G376 PolarHBondContact O-N 3.39Å; L374-G376 VanDerWaalsContact C-N 3.34Å; L374-G376 PolarHBondContact O-N 3.06Å; G376-T378 VanDerWaalsContact C-N 3.33Å; G376-V379 PolarHBondContact O-N 2.76Å; G376-N380 PolarHBondContact O-N 3.45Å; G376-N380 PolarHBondContact O-ND2 3.29Å
377E81.4Confident79.9Confident142 Ų14270.5 Ų70.566%0.66437%0.373SS*.Hα-helixtrans-64.5-41.2175.7-169.2-176.917100111.1A373 N380 K381A373-E377 PolarHBondContact O-N 3.4Å; A373-E377 VanDerWaalsContact O-N 3.13Å; E377-N380 PolarHBondContact O-N 3.27Å; E377-K381 PolarHBondContact O-N 3.35Å; E377-K381 VanDerWaalsContact O-N 3.12Å
378T80.4Confident80.5Confident9 Ų971.3 Ų71.36%0.05538%0.377CS..Hα-helixtrans-60.9-47.8176.8-70.20000112.6R268 D269 L374 M375 G376 N380 K381 I382R268-T378 VanDerWaalsContact NH2-CB 3.29Å; R268-T378 PolarHBondContact NH2-OG1 3.49Å; D269-T378 PolarHBondContact OD1-OG1 3.09Å; D269-T378 WeakPolarHBondContact OD2-CB 3.28Å; D269-T378 WeakPolarHBondContact OD2-CG2 3.07Å; D269-T378 PolarHBondContact OD2-OG1 3.46Å; L374-T378 VanDerWaalsContact O-CB 3.25Å; L374-T378 WeakPolarHBondContact O-CB 3.22Å; L374-T378 PolarHBondContact O-N 3.29Å; L374-T378 PolarHBondContact O-OG1 3.28Å; M375-T378 PolarHBondContact O-N 3.03Å; G376-T378 VanDerWaalsContact C-N 3.33Å; T378-N380 VanDerWaalsContact C-N 3.35Å; T378-N380 PolarHBondContact O-N 3.35Å; T378-K381 PolarHBondContact O-N 3.45Å; T378-I382 HydrophobicContact CG2-CD1 3.35Å; T378-I382 HydrophobicContact CG2-CG1 3.98Å; T378-I382 WeakPolarHBondContact O-CB 3.37Å; T378-I382 VanDerWaalsContact O-CG1 3.24Å; T378-I382 WeakPolarHBondContact O-CG1 3.32Å; T378-I382 PolarHBondContact O-N 3.44Å
379V81.8Confident80.9Confident43 Ų4369.2 Ų69.226%0.26137%0.366SS..Hα-helixtrans-60.6-45.8-179.4164.80000110.5M261 M265 M375 G376 K381 I382 A383M261-V379 HydrophobicContact CE-CG1 4.47Å; M261-V379 HydrophobicContact CE-CG2 4.3Å; M261-V379 HydrophobicContact CG-CG2 4.4Å; M261-V379 HydrophobicContact SD-CB 4.34Å; M261-V379 HydrophobicContact SD-CG1 3.82Å; M261-V379 HydrophobicContact SD-CG2 4.01Å; M265-V379 HydrophobicContact SD-CG2 4.28Å; M375-V379 WeakPolarHBondContact O-CB 3.23Å; M375-V379 VanDerWaalsContact O-CG2 3.25Å; M375-V379 WeakPolarHBondContact O-CG2 3.21Å; M375-V379 PolarHBondContact O-N 2.89Å; G376-V379 PolarHBondContact O-N 2.76Å; V379-K381 PolarHBondContact O-N 3.16Å; V379-I382 PolarHBondContact O-N 3.05Å; V379-A383 VanDerWaalsContact O-CB 3.25Å; V379-A383 WeakPolarHBondContact O-CB 3.16Å; V379-A383 PolarHBondContact O-N 2.87Å
380N78.8Confident81.3Confident130 Ų13065.1 Ų65.170%0.69534%0.344SS*.Hα-helixtrans-62.2-42.7179.8-73.5-24.5000112.3G376 E377 T378G376-N380 PolarHBondContact O-N 3.45Å; G376-N380 PolarHBondContact O-ND2 3.29Å; E377-N380 PolarHBondContact O-N 3.27Å; T378-N380 VanDerWaalsContact C-N 3.35Å; T378-N380 PolarHBondContact O-N 3.35Å
381K78Confident81.8Confident137 Ų13761.8 Ų61.860%0.59633%0.326SS*.Hα-helixtrans-72.3-41.8178-172.8173.2-178.9172.30112.7E377 T378 V379E377-K381 PolarHBondContact O-N 3.35Å; E377-K381 VanDerWaalsContact O-N 3.12Å; T378-K381 PolarHBondContact O-N 3.45Å; V379-K381 PolarHBondContact O-N 3.16Å
382I78.6Confident82Confident0 Ų061.3 Ų61.30%032%0.323CS..Hα-helixtrans-76.4-26.6-176.4-68.5-173.7000111.7M261 K264 T378 V379 Q384 E385 S386M261-I382 HydrophobicContact CG-CG2 4.29Å; K264-I382 HydrophobicContact CB-CD1 3.73Å; K264-I382 HydrophobicContact CD-CD1 3.9Å; K264-I382 HydrophobicContact CD-CG2 4.39Å; K264-I382 HydrophobicContact CG-CD1 4.49Å; T378-I382 HydrophobicContact CG2-CD1 3.35Å; T378-I382 HydrophobicContact CG2-CG1 3.98Å; T378-I382 WeakPolarHBondContact O-CB 3.37Å; T378-I382 VanDerWaalsContact O-CG1 3.24Å; T378-I382 WeakPolarHBondContact O-CG1 3.32Å; T378-I382 PolarHBondContact O-N 3.44Å; V379-I382 PolarHBondContact O-N 3.05Å; I382-Q384 PolarHBondContact O-N 3.2Å; I382-Q384 VanDerWaalsContact O-N 3.13Å; I382-E385 PolarHBondContact O-N 2.9Å; I382-S386 WeakPolarHBondContact O-CA 2.96Å; I382-S386 WeakPolarHBondContact O-CB 3.3Å; I382-S386 PolarHBondContact O-N 3.38Å; I382-S386 PolarHBondContact O-OG 3.48Å
383A77.4Confident82.3Confident53 Ų5357 Ų5744%0.43830%0.301SS..Hα-helixtrans-52.9-39.7-179.200000112.5V379 S386V379-A383 VanDerWaalsContact O-CB 3.25Å; V379-A383 WeakPolarHBondContact O-CB 3.16Å; V379-A383 PolarHBondContact O-N 2.87Å; A383-S386 PolarHBondContact O-OG 3.43Å
384Q75.5Confident82.7Confident169 Ų16955.5 Ų55.579%0.7928%0.283SS*.Hα-helixtrans-77.6-41.6-178.9-156.6154.8-11.900112.8I382I382-Q384 PolarHBondContact O-N 3.2Å; I382-Q384 VanDerWaalsContact O-N 3.13Å
385E82.3Confident83.1Confident78 Ų7852.1 Ų52.136%0.36427%0.266SS..Hα-helixtrans-72.7-31.6177.1-66.8178.8-175.400112.9I382 K387 N388 I389I382-E385 PolarHBondContact O-N 2.9Å; E385-K387 PolarHBondContact O-N 3.06Å; E385-N388 PolarHBondContact O-N 3.17Å; E385-I389 HydrophobicContact CB-CD1 4Å; E385-I389 WeakPolarHBondContact O-CD1 3.48Å; E385-I389 WeakPolarHBondContact O-CG1 3.39Å; E385-I389 PolarHBondContact O-N 3.4Å
386S83.9Confident83.4Confident0 Ų051.3 Ų51.30%026%0.262CS..Hα-helixtrans-60.2-32.2-173.664.40000112.6I257 I382 A383 I389 W390I257-S386 WeakPolarHBondContact CG2-OG 3.38Å; I382-S386 WeakPolarHBondContact O-CA 2.96Å; I382-S386 WeakPolarHBondContact O-CB 3.3Å; I382-S386 PolarHBondContact O-N 3.38Å; I382-S386 PolarHBondContact O-OG 3.48Å; A383-S386 PolarHBondContact O-OG 3.43Å; S386-I389 PolarHBondContact O-N 2.97Å; S386-W390 WeakPolarHBondContact O-CB 3.48Å; S386-W390 PolarHBondContact O-N 2.9Å
387K86.1Confident83.7Confident102 Ų10250.1 Ų50.144%0.44325%0.248SC..Hα-helixtrans-64.4-41.9174.6-173.6176.2179.4179.20111.7I257 E385 K391I257-K387 HydrophobicContact CD1-CG 4.5Å; E385-K387 PolarHBondContact O-N 3.06Å; K387-K391 WeakPolarHBondContact O-CG 3.48Å; K387-K391 PolarHBondContact O-N 2.66Å
388N86.5Confident84Confident33 Ų3343.4 Ų43.418%0.17622%0.217CC..Hα-helixtrans-71.7-39.8179.6-61.4-6.5000110.4H103 D104 E385 K391 L392H103-N388 HydrophobicContact CB-CB 4.14Å; D104-N388 PolarHBondContact OD1-ND2 3.02Å; E385-N388 PolarHBondContact O-N 3.17Å; N388-K391 WeakPolarHBondContact O-CB 3.23Å; N388-K391 PolarHBondContact O-N 3.46Å; N388-L392 PolarHBondContact O-N 2.95Å
389I85.6Confident84.3Confident17 Ų1743 Ų439%0.08721%0.214CC..Hα-helixtrans-66-41.1175.6-62.8153.3000111V260 K264 E385 S386 K391 L392 Q393V260-I389 HydrophobicContact CG1-CB 4.04Å; V260-I389 HydrophobicContact CG1-CG2 3.57Å; K264-I389 HydrophobicContact CD-CD1 4.33Å; E385-I389 HydrophobicContact CB-CD1 4Å; E385-I389 WeakPolarHBondContact O-CD1 3.48Å; E385-I389 WeakPolarHBondContact O-CG1 3.39Å; E385-I389 PolarHBondContact O-N 3.4Å; S386-I389 PolarHBondContact O-N 2.97Å; I389-K391 VanDerWaalsContact C-N 3.33Å; I389-K391 PolarHBondContact O-N 3.38Å; I389-L392 WeakPolarHBondContact O-CB 3.32Å; I389-L392 PolarHBondContact O-N 3.19Å; I389-L392 VanDerWaalsContact O-N 3.15Å; I389-Q393 HydrophobicContact CG2-CG 4.48Å; I389-Q393 WeakPolarHBondContact O-CG 3.33Å; I389-Q393 PolarHBondContact O-N 2.86Å
390W88.9Confident84.3Confident6 Ų642.6 Ų42.62%0.02321%0.211CC..Hα-helixtrans-60.6-43.3174.1168.572.6000111.2R250 Q253 I257 V260 S386 L392 Q393 R394R250-W390 PolarHBondContact O-NE1 3.06Å; Q253-W390 HydrophobicContact CB-CH2 3.72Å; Q253-W390 HydrophobicContact CB-CZ2 3.9Å; Q253-W390 HydrophobicContact CB-CZ3 4.45Å; Q253-W390 HydrophobicContact CG-CH2 3.6Å; Q253-W390 HydrophobicContact CG-CZ2 4.16Å; Q253-W390 HydrophobicContact CG-CZ3 3.84Å; I257-W390 HydrophobicContact CG1-CB 4.17Å; I257-W390 HydrophobicContact CG1-CD2 4.23Å; I257-W390 HydrophobicContact CG1-CE3 4.39Å; I257-W390 HydrophobicContact CG1-CG 4.12Å; V260-W390 HydrophobicContact CG2-CB 4.14Å; S386-W390 WeakPolarHBondContact O-CB 3.48Å; S386-W390 PolarHBondContact O-N 2.9Å; W390-L392 VanDerWaalsContact C-N 3.3Å; W390-L392 PolarHBondContact O-N 3.5Å; W390-Q393 PolarHBondContact O-N 3.08Å; W390-R394 WeakPolarHBondContact O-CB 3.18Å; W390-R394 PolarHBondContact O-N 2.82Å
391K88.1Confident84.5Confident47 Ų4737.4 Ų37.420%0.20418%0.184CC..Hα-helixtrans-60.2-40.1173.3-77.1-175.9174.1-163.80112.3L107 N112 K387 N388 I389 R394 A395L107-K391 HydrophobicContact CD2-CD 3.51Å; N112-K391 PolarHBondContact OD1-NZ 3.49Å; K387-K391 WeakPolarHBondContact O-CG 3.48Å; K387-K391 PolarHBondContact O-N 2.66Å; N388-K391 WeakPolarHBondContact O-CB 3.23Å; N388-K391 PolarHBondContact O-N 3.46Å; I389-K391 VanDerWaalsContact C-N 3.33Å; I389-K391 PolarHBondContact O-N 3.38Å; K391-R394 PolarHBondContact O-N 2.96Å; K391-A395 WeakPolarHBondContact O-CB 3.01Å; K391-A395 PolarHBondContact O-N 2.92Å
392L87.1Confident84.9Confident11 Ų1131.2 Ų31.26%0.05816%0.157CC..Hα-helixtrans-63.8-47.5174.3174.565.7000112R102 H103 L106 N388 I389 W390 R394 A395 I396R102-L392 HydrophobicContact CG-CD2 3.99Å; H103-L392 HydrophobicContact CB-CB 4.21Å; H103-L392 HydrophobicContact CB-CD2 4.04Å; L106-L392 HydrophobicContact CD1-CB 4.07Å; L106-L392 HydrophobicContact CD1-CD1 3.34Å; L106-L392 HydrophobicContact CD1-CG 4.32Å; L106-L392 HydrophobicContact CG-CD1 4.44Å; N388-L392 PolarHBondContact O-N 2.95Å; I389-L392 WeakPolarHBondContact O-CB 3.32Å; I389-L392 PolarHBondContact O-N 3.19Å; I389-L392 VanDerWaalsContact O-N 3.15Å; W390-L392 VanDerWaalsContact C-N 3.3Å; W390-L392 PolarHBondContact O-N 3.5Å; L392-R394 VanDerWaalsContact C-N 3.28Å; L392-R394 PolarHBondContact O-N 3.3Å; L392-A395 WeakPolarHBondContact O-CB 3.46Å; L392-A395 PolarHBondContact O-N 3.49Å; L392-A395 VanDerWaalsContact O-N 3.13Å; L392-I396 HydrophobicContact CD1-CD1 4.35Å; L392-I396 HydrophobicContact CG-CD1 4.19Å; L392-I396 WeakPolarHBondContact O-CG1 3.48Å; L392-I396 PolarHBondContact O-N 2.86Å
393Q86.6Confident84.9Confident24 Ų2434.4 Ų34.411%0.11217%0.171CC..Hα-helixtrans-60.7-39.3176.3-72.3-174.7-8.500111.7R250 E263 I389 W390 I396 T397R250-Q393 VanDerWaalsContact NE-OE1 3.09Å; E263-Q393 PolarHBondContact OE2-NE2 3.09Å; I389-Q393 HydrophobicContact CG2-CG 4.48Å; I389-Q393 WeakPolarHBondContact O-CG 3.33Å; I389-Q393 PolarHBondContact O-N 2.86Å; W390-Q393 PolarHBondContact O-N 3.08Å; Q393-I396 PolarHBondContact O-N 3.38Å; Q393-T397 PolarHBondContact O-N 3.27Å; Q393-T397 PolarHBondContact O-OG1 2.8Å
394R88.9Confident84.8Confident22 Ų2236.4 Ų36.48%0.08318%0.182CC..Hα-helixtrans-64.8-41.6173.7-176.6170.5163.5-146.9-9.1111.5Q116 W119 W390 K391 L392 T397 I398Q116-R394 VanDerWaalsContact CD-NH2 3.26Å; W119-R394 HydrophobicContact CD2-CG 4.31Å; W119-R394 HydrophobicContact CE3-CG 3.86Å; W119-R394 VanDerWaalsContact CG-NE 3.3Å; W119-R394 HydrophobicContact CZ3-CG 4.03Å; W390-R394 WeakPolarHBondContact O-CB 3.18Å; W390-R394 PolarHBondContact O-N 2.82Å; K391-R394 PolarHBondContact O-N 2.96Å; L392-R394 VanDerWaalsContact C-N 3.28Å; L392-R394 PolarHBondContact O-N 3.3Å; R394-T397 WeakPolarHBondContact O-CB 3.31Å; R394-T397 PolarHBondContact O-N 3.49Å; R394-I398 HydrophobicContact CG-CD1 4.18Å; R394-I398 VanDerWaalsContact O-CG1 3.25Å; R394-I398 WeakPolarHBondContact O-CG1 3.5Å; R394-I398 PolarHBondContact O-N 3.25Å
395A88Confident84.7Confident2 Ų230.7 Ų30.72%0.01715%0.154CC..Hα-helixtrans-60.3-46.3174.300000111.9L106 L115 K391 L392 T397 I398 L399L106-A395 HydrophobicContact CD1-CB 3.68Å; L115-A395 HydrophobicContact CD1-CB 3.63Å; L115-A395 HydrophobicContact CD2-CB 4.09Å; L115-A395 HydrophobicContact CG-CB 4.49Å; K391-A395 WeakPolarHBondContact O-CB 3.01Å; K391-A395 PolarHBondContact O-N 2.92Å; L392-A395 WeakPolarHBondContact O-CB 3.46Å; L392-A395 PolarHBondContact O-N 3.49Å; L392-A395 VanDerWaalsContact O-N 3.13Å; A395-T397 VanDerWaalsContact C-N 3.3Å; A395-T397 PolarHBondContact O-N 3Å; A395-I398 WeakPolarHBondContact O-CB 3.28Å; A395-I398 PolarHBondContact O-N 3.48Å; A395-L399 VanDerWaalsContact O-CG 3.27Å; A395-L399 WeakPolarHBondContact O-CG 3.48Å; A395-L399 PolarHBondContact O-N 3.19Å
396I85.9Confident84Confident20 Ų2033.8 Ų33.810%0.10317%0.172CC..Hα-helixtrans-58.6-44.7175.9-65.3163.8000110.5A93 L392 Q393 I398 L399 D400A93-I396 HydrophobicContact CB-CG1 4.17Å; L392-I396 HydrophobicContact CD1-CD1 4.35Å; L392-I396 HydrophobicContact CG-CD1 4.19Å; L392-I396 WeakPolarHBondContact O-CG1 3.48Å; L392-I396 PolarHBondContact O-N 2.86Å; Q393-I396 PolarHBondContact O-N 3.38Å; I396-I398 VanDerWaalsContact C-N 3.35Å; I396-I398 PolarHBondContact O-N 3.47Å; I396-L399 PolarHBondContact O-N 3.26Å; I396-D400 WeakPolarHBondContact CG2-OD2 3.33Å; I396-D400 WeakPolarHBondContact O-CB 3.45Å; I396-D400 VanDerWaalsContact O-CG 3.26Å; I396-D400 PolarHBondContact O-N 3.33Å
397T87.4Confident83.2Confident7 Ų742.4 Ų42.44%0.04321%0.21CC..Hα-helixtrans-61.5-41.3177.8-54.40000112F127 Q393 R394 A395 D400 T401F127-T397 HydrophobicContact CD2-CG2 3.87Å; F127-T397 HydrophobicContact CE2-CG2 3.79Å; Q393-T397 PolarHBondContact O-N 3.27Å; Q393-T397 PolarHBondContact O-OG1 2.8Å; R394-T397 WeakPolarHBondContact O-CB 3.31Å; R394-T397 PolarHBondContact O-N 3.49Å; A395-T397 VanDerWaalsContact C-N 3.3Å; A395-T397 PolarHBondContact O-N 3Å; T397-D400 PolarHBondContact O-N 3.46Å; T397-T401 WeakPolarHBondContact O-CB 3.36Å; T397-T401 PolarHBondContact O-N 3.04Å; T397-T401 PolarHBondContact O-OG1 2.79Å
398I88.9Confident82.1Confident1 Ų142.7 Ų42.71%0.00522%0.223CC..Hα-helixtrans-59.7-50.7175.1-69.3161.5000109.9L115 K118 W119 V123 R394 A395 I396 D400 T401 E402L115-I398 HydrophobicContact CB-CD1 4.29Å; L115-I398 HydrophobicContact CD2-CD1 4.07Å; L115-I398 HydrophobicContact CD2-CG2 4.35Å; L115-I398 WeakPolarHBondContact O-CD1 3.23Å; K118-I398 HydrophobicContact CB-CG2 4.13Å; K118-I398 HydrophobicContact CD-CG2 4.22Å; W119-I398 HydrophobicContact CB-CD1 4.14Å; W119-I398 HydrophobicContact CE3-CD1 4.16Å; W119-I398 HydrophobicContact CE3-CG1 3.82Å; V123-I398 HydrophobicContact CB-CG1 4.38Å; V123-I398 HydrophobicContact CG1-CG1 4.15Å; V123-I398 HydrophobicContact CG2-CB 4.33Å; V123-I398 HydrophobicContact CG2-CG1 4.06Å; V123-I398 HydrophobicContact CG2-CG2 4.06Å; R394-I398 HydrophobicContact CG-CD1 4.18Å; R394-I398 VanDerWaalsContact O-CG1 3.25Å; R394-I398 WeakPolarHBondContact O-CG1 3.5Å; R394-I398 PolarHBondContact O-N 3.25Å; A395-I398 WeakPolarHBondContact O-CB 3.28Å; A395-I398 PolarHBondContact O-N 3.48Å; I396-I398 VanDerWaalsContact C-N 3.35Å; I396-I398 PolarHBondContact O-N 3.47Å; I398-D400 VanDerWaalsContact C-N 3.35Å; I398-D400 PolarHBondContact O-N 2.81Å; I398-T401 PolarHBondContact O-N 3.03Å; I398-E402 WeakPolarHBondContact O-CG 3.19Å; I398-E402 PolarHBondContact O-N 2.86Å
399L85.6Confident81.2Confident1 Ų145.4 Ų45.41%0.00524%0.236CC..Hα-helixtrans-64.7-38.5-178.1-63.5172.2000112.2T82 L89 A93 Y94 A395 I396 E402 K403T82-L399 HydrophobicContact CG2-CD2 3.15Å; L89-L399 HydrophobicContact CB-CD1 4.35Å; L89-L399 HydrophobicContact CB-CD2 3.98Å; L89-L399 HydrophobicContact CD1-CD2 4.49Å; L89-L399 WeakPolarHBondContact O-CD1 3.41Å; A93-L399 HydrophobicContact CB-CD1 3.27Å; Y94-L399 WeakPolarHBondContact OH-CB 3.35Å; A395-L399 VanDerWaalsContact O-CG 3.27Å; A395-L399 WeakPolarHBondContact O-CG 3.48Å; A395-L399 PolarHBondContact O-N 3.19Å; I396-L399 PolarHBondContact O-N 3.26Å; L399-E402 PolarHBondContact O-N 2.86Å; L399-K403 WeakPolarHBondContact O-CB 2.93Å; L399-K403 WeakPolarHBondContact O-CG 3.4Å; L399-K403 PolarHBondContact O-N 2.9Å
400D81.8Confident80.6Confident35 Ų3547.2 Ų47.219%0.18724%0.242CC..Hα-helixtrans-68.3-38.8177.2-71.6-18.3000111.9Y94 R192 I396 T397 I398 K403 S404Y94-D400 PolarHBondContact OH-OD1 3.31Å; R192-D400 IonicContact CZ-OD1 3.61Å; R192-D400 IonicContact CZ-OD2 2.73Å; R192-D400 IonicContact NH2-OD1 2.93Å; R192-D400 PolarHBondContact NH2-OD1 3.38Å; R192-D400 IonicContact NH2-OD2 3.85Å; R192-D400 PolarHBondContact NH2-OD2 3.13Å; I396-D400 WeakPolarHBondContact CG2-OD2 3.33Å; I396-D400 WeakPolarHBondContact O-CB 3.45Å; I396-D400 VanDerWaalsContact O-CG 3.26Å; I396-D400 PolarHBondContact O-N 3.33Å; T397-D400 PolarHBondContact O-N 3.46Å; I398-D400 VanDerWaalsContact C-N 3.35Å; I398-D400 PolarHBondContact O-N 2.81Å; D400-K403 PolarHBondContact O-N 3.01Å; D400-S404 PolarHBondContact O-N 3.42Å
401T84.4Confident79.8Confident20 Ų2055 Ų5512%0.12328%0.276CS..Hα-helixtrans-63.1-43.5172.6-52.20000110.5V123 I126 T397 I398 K403 S404 F405V123-T401 HydrophobicContact CG1-CG2 4.48Å; I126-T401 HydrophobicContact CG2-CG2 4.13Å; T397-T401 WeakPolarHBondContact O-CB 3.36Å; T397-T401 PolarHBondContact O-N 3.04Å; T397-T401 PolarHBondContact O-OG1 2.79Å; I398-T401 PolarHBondContact O-N 3.03Å; T401-K403 VanDerWaalsContact C-N 3.33Å; T401-K403 PolarHBondContact O-N 2.81Å; T401-S404 PolarHBondContact O-N 2.87Å; T401-F405 HydrophobicContact CG2-CE2 3.82Å; T401-F405 HydrophobicContact CG2-CZ 3.85Å; T401-F405 WeakPolarHBondContact O-CD2 3.44Å; T401-F405 VanDerWaalsContact O-CE2 3.25Å; T401-F405 WeakPolarHBondContact O-CE2 3.39Å; T401-F405 PolarHBondContact O-N 3.19Å
402E84.5Confident79Confident8 Ų856.5 Ų56.54%0.03730%0.297CS..Hα-helixtrans-65.2-32.7176-75-176171.100113.8T82 K118 F122 I398 L399 R410T82-E402 VanDerWaalsContact CB-OE2 3.3Å; T82-E402 WeakPolarHBondContact CB-OE2 3.43Å; T82-E402 WeakPolarHBondContact CG2-OE2 3.26Å; T82-E402 PolarHBondContact OG1-OE2 3.12Å; K118-E402 VanDerWaalsContact CD-OE1 3.23Å; K118-E402 WeakPolarHBondContact CD-OE1 3.42Å; K118-E402 VanDerWaalsContact CE-OE1 3.27Å; K118-E402 WeakPolarHBondContact CE-OE1 3.48Å; K118-E402 VanDerWaalsContact NZ-CD 3.34Å; K118-E402 IonicContact NZ-OE1 2.9Å; K118-E402 PolarHBondContact NZ-OE1 3.38Å; K118-E402 IonicContact NZ-OE2 3.16Å; K118-E402 PolarHBondContact NZ-OE2 2.67Å; K118-E402 VanDerWaalsContact NZ-OE2 3.07Å; F122-E402 HydrophobicContact CE2-CG 4.04Å; F122-E402 HydrophobicContact CZ-CG 3.67Å; F122-E402 WeakPolarHBondContact CZ-OE1 3.02Å; I398-E402 WeakPolarHBondContact O-CG 3.19Å; I398-E402 PolarHBondContact O-N 2.86Å; L399-E402 PolarHBondContact O-N 2.86Å; E402-R410 PolarHBondContact O-NE 3.16Å; E402-R410 PolarHBondContact O-NH2 3.17Å
403K79.3Confident78.3Confident66 Ų6659.3 Ų59.329%0.28731%0.309SS..Hα-helixtrans-72.7-31.2174.7-78.4-176177.5-168.30113.1E90 Y94 L399 D400 T401 F405E90-K403 WeakPolarHBondContact OE1-CE 3.29Å; E90-K403 IonicContact OE1-NZ 3.9Å; E90-K403 PolarHBondContact OE1-NZ 3.34Å; Y94-K403 HydrophobicContact CE2-CD 4.4Å; L399-K403 WeakPolarHBondContact O-CB 2.93Å; L399-K403 WeakPolarHBondContact O-CG 3.4Å; L399-K403 PolarHBondContact O-N 2.9Å; D400-K403 PolarHBondContact O-N 3.01Å; T401-K403 VanDerWaalsContact C-N 3.33Å; T401-K403 PolarHBondContact O-N 2.81Å; K403-F405 VanDerWaalsContact C-N 3.27Å; K403-F405 PolarHBondContact O-N 2.89Å
404S76.1Confident78Confident95 Ų9561.1 Ų61.166%0.66432%0.315SS*.Hα-helixtrans-70.3-21.1176.7-170.10000113.3D400 T401D400-S404 PolarHBondContact O-N 3.42Å; T401-S404 PolarHBondContact O-N 2.87Å
405F73.6Confident77.7Confident49 Ų4960 Ų6022%0.21531%0.311CS..SBendtrans-74.1146.9178.1-66.8-56.8000113.1F122 I126 T401 K403 M409F122-F405 HydrophobicContact CD2-CE2 4.3Å; F122-F405 HydrophobicContact CE2-CE2 4.03Å; I126-F405 HydrophobicContact CD1-CE1 3.97Å; I126-F405 HydrophobicContact CD1-CE2 4.26Å; I126-F405 HydrophobicContact CD1-CZ 3.34Å; I126-F405 HydrophobicContact CG2-CZ 4.38Å; T401-F405 HydrophobicContact CG2-CE2 3.82Å; T401-F405 HydrophobicContact CG2-CZ 3.85Å; T401-F405 WeakPolarHBondContact O-CD2 3.44Å; T401-F405 VanDerWaalsContact O-CE2 3.25Å; T401-F405 WeakPolarHBondContact O-CE2 3.39Å; T401-F405 PolarHBondContact O-N 3.19Å; K403-F405 VanDerWaalsContact C-N 3.27Å; K403-F405 PolarHBondContact O-N 2.89Å; F405-M409 HydrophobicContact CB-CB 4.27Å
406L67.9Low77.5Confident143 Ų14360.8 Ų60.875%0.74932%0.319SS*.  trans-54.8141.1164.7-75.6131.9000110.3C408 M409 R410L406-C408 PolarHBondContact O-N 2.6Å; L406-M409 PolarHBondContact O-N 3.33Å; L406-R410 PolarHBondContact O-N 2.96Å
407K65.9Low77.5Confident182 Ų18266.7 Ų66.779%0.79134%0.344SS*.Hα-helixtrans-52.8-31.4-175.8-69.5179.1180172.60113.9
408C62.4Low77.6Confident107 Ų10770.6 Ų70.672%0.72336%0.364SS*.Hα-helixtrans-70.2-39.3178.2-62.60000112.6L406 R410 K411L406-C408 PolarHBondContact O-N 2.6Å; C408-R410 VanDerWaalsContact C-N 3.28Å; C408-R410 PolarHBondContact O-N 3.37Å; C408-K411 PolarHBondContact O-N 2.88Å
409M68.9Low77.4Confident90 Ų9073 Ų7344%0.44338%0.376SS..Hα-helixtrans-68.1-30.3177.6-62.3-60.8-67.200111.5F405 L406 K411 A412 F413F405-M409 HydrophobicContact CB-CB 4.27Å; L406-M409 PolarHBondContact O-N 3.33Å; M409-K411 VanDerWaalsContact C-N 3.27Å; M409-K411 PolarHBondContact O-N 2.92Å; M409-A412 PolarHBondContact O-N 2.81Å; M409-A412 VanDerWaalsContact O-N 3.15Å; M409-F413 HydrophobicContact CB-CD2 4.48Å; M409-F413 HydrophobicContact CB-CE2 4.35Å; M409-F413 HydrophobicContact CE-CE2 3.72Å; M409-F413 HydrophobicContact CE-CZ 4.14Å; M409-F413 WeakPolarHBondContact O-CD2 3.17Å; M409-F413 PolarHBondContact O-N 3.03Å
410R72.9Confident77.4Confident55 Ų5575.1 Ų75.121%0.20839%0.386CS..Hα-helixtrans-59.9-36.9176.6-167.4-179-65.7179.43.4112.5T82 E402 L406 C408 F413 R414T82-R410 PolarHBondContact O-NH1 3.5Å; E402-R410 PolarHBondContact O-NE 3.16Å; E402-R410 PolarHBondContact O-NH2 3.17Å; L406-R410 PolarHBondContact O-N 2.96Å; C408-R410 VanDerWaalsContact C-N 3.28Å; C408-R410 PolarHBondContact O-N 3.37Å; R410-F413 PolarHBondContact O-N 2.88Å; R410-R414 PolarHBondContact O-N 3.46Å
411K71Confident77.4Confident171 Ų17174.1 Ų74.174%0.74338%0.381SS*.Hα-helixtrans-68.1-34.7177.3-67.8-173.5178.8-176.90112.5C408 M409 F413C408-K411 PolarHBondContact O-N 2.88Å; M409-K411 VanDerWaalsContact C-N 3.27Å; M409-K411 PolarHBondContact O-N 2.92Å; K411-F413 VanDerWaalsContact C-N 3.33Å
412A72.5Confident77.1Confident78 Ų7874.3 Ų74.365%0.64539%0.387SS*.Hα-helixtrans-70.2-30.3178.400000112.5M409M409-A412 PolarHBondContact O-N 2.81Å; M409-A412 VanDerWaalsContact O-N 3.15Å
413F71.5Confident76.8Confident70 Ų7079.5 Ų79.531%0.30741%0.41SS..THydrogen-bonded Turntrans-97.817.7179.5-61.8-61.9000114F122 M409 R410 K411 S415F122-F413 HydrophobicContact CB-CD1 4.29Å; F122-F413 HydrophobicContact CB-CE1 4.45Å; F122-F413 HydrophobicContact CG-CD1 4.44Å; M409-F413 HydrophobicContact CB-CD2 4.48Å; M409-F413 HydrophobicContact CB-CE2 4.35Å; M409-F413 HydrophobicContact CE-CE2 3.72Å; M409-F413 HydrophobicContact CE-CZ 4.14Å; M409-F413 WeakPolarHBondContact O-CD2 3.17Å; M409-F413 PolarHBondContact O-N 3.03Å; R410-F413 PolarHBondContact O-N 2.88Å; K411-F413 VanDerWaalsContact C-N 3.33Å; F413-S415 PolarHBondContact O-N 2.97Å
414R80.3Confident76.6Confident61 Ų6178 Ų7823%0.2341%0.406CS..  trans-64.1128.2176.4-169.4175.9-172.7178.91.5110.4D81 R410 W433D81-R414 IonicContact OD2-NE 2.97Å; R410-R414 PolarHBondContact O-N 3.46Å; R414-W433 VanDerWaalsContact CZ-CD1 3.5Å; R414-W433 VanDerWaalsContact CZ-CG 3.46Å; R414-W433 VanDerWaalsContact NH1-CE2 3.31Å
415S82Confident76.4Confident0 Ų076.2 Ų76.20%039%0.392CS..  trans-79.7153.6172.1-73.30000111L77 D117 K118 F413L77-S415 WeakPolarHBondContact CD1-O 3.29Å; D117-S415 PolarHBondContact OD2-OG 2.75Å; K118-S415 WeakPolarHBondContact CG-OG 2.85Å; F413-S415 PolarHBondContact O-N 2.97Å
416G84.6Confident76.3Confident18 Ų1878.7 Ų78.719%0.18641%0.408CS..SBendtrans93.5170.6-177.700000114.2C434G416-C434 CarbonylContact C-O 3.46Å; G416-C434 WeakPolarHBondContact CA-O 3.09Å
417K86.9Confident76.7Confident144 Ų14474.5 Ų74.563%0.62640%0.399SS*.EExtended strand (participates in β ladder)trans-124.2146.8176.2-67.8-175.5178.8-177.70109.5L419 C434K417-L419 HydrophobicContact CB-CG 4.38Å; K417-L419 PolarHBondContact O-N 3.42Å; K417-C434 PolarHBondContact N-O 3.25Å; K417-C434 PolarHBondContact O-N 2.82Å
418L87.8Confident77.4Confident88 Ų8872.7 Ų72.746%0.46139%0.391SS..EExtended strand (participates in β ladder)trans-76.1117.6171.5-170.174.9000108.6F431 R432 W433L418-F431 HydrophobicContact CD1-CB 4.09Å; L418-F431 HydrophobicContact CD2-CD1 4.41Å; L418-F431 HydrophobicContact CG-CB 4.27Å; L418-F431 HydrophobicContact CG-CD1 4.32Å; L418-R432 WeakPolarHBondContact CA-O 3.42Å; L418-W433 HydrophobicContact CB-CD2 4.41Å; L418-W433 HydrophobicContact CB-CH2 4.37Å; L418-W433 HydrophobicContact CB-CZ2 4.21Å; L418-W433 HydrophobicContact CD1-CD2 4.3Å; L418-W433 HydrophobicContact CD1-CG 4.25Å; L418-W433 HydrophobicContact CD1-CZ2 4.49Å
419L86.4Confident78.4Confident51 Ų5171.5 Ų71.527%0.26738%0.377SS..EExtended strand (participates in β ladder)trans-128.8145.8-178.8-65.6174.9000110.2L74 K417 V421 F431 R432 C434L74-L419 HydrophobicContact CD1-CD1 3.74Å; L74-L419 HydrophobicContact CD2-CD1 3.63Å; L74-L419 HydrophobicContact CG-CD1 4.34Å; K417-L419 HydrophobicContact CB-CG 4.38Å; K417-L419 PolarHBondContact O-N 3.42Å; L419-V421 PolarHBondContact O-N 2.93Å; L419-F431 WeakPolarHBondContact O-CA 3.02Å; L419-R432 PolarHBondContact N-O 3.31Å; L419-R432 PolarHBondContact O-N 3.02Å; L419-C434 HydrophobicContact CD1-CB 4.24Å
420Q85.4Confident79.1Confident47 Ų4767.9 Ų67.922%0.2236%0.36CS..EExtended strand (participates in β ladder)trans-84.5108.7171-172.3-1721.100108.9D429 F431 R464Q420-D429 HydrophobicContact CG-CB 4.25Å; Q420-D429 PolarHBondContact NE2-OD1 3.15Å; Q420-F431 HydrophobicContact CB-CD1 3.98Å; Q420-F431 HydrophobicContact CB-CE1 3.67Å; Q420-F431 HydrophobicContact CB-CZ 4.15Å; Q420-F431 HydrophobicContact CG-CE1 4.3Å; Q420-F431 HydrophobicContact CG-CZ 4.31Å; Q420-R464 PolarHBondContact O-NH2 2.95Å
421V80.4Confident79.8Confident14 Ų1470.5 Ų70.59%0.08537%0.373CS..EExtended strand (participates in β ladder)trans-93.7-26.1-171.8-170.30000112.2F62 L419 D430 R432 I452F62-V421 HydrophobicContact CB-CG1 4.32Å; F62-V421 HydrophobicContact CD1-CG1 3.32Å; F62-V421 HydrophobicContact CD2-CG1 3.53Å; F62-V421 HydrophobicContact CE1-CG1 3.26Å; F62-V421 HydrophobicContact CE2-CG1 3.5Å; F62-V421 HydrophobicContact CG-CG1 3.44Å; F62-V421 VanDerWaalsContact CG-CG1 3.44Å; F62-V421 HydrophobicContact CZ-CB 4.44Å; F62-V421 HydrophobicContact CZ-CG1 3.35Å; L419-V421 PolarHBondContact O-N 2.93Å; V421-D430 PolarHBondContact N-O 3.24Å; V421-R432 HydrophobicContact CG2-CB 4.22Å; V421-I452 HydrophobicContact CG1-CD1 4.48Å
422G79.4Confident80.6Confident23 Ų2364 Ų6424%0.23734%0.344CS..EExtended strand (participates in β ladder)trans177.6-151.8178.700000112.2D430G422-D430 PolarHBondContact O-N 2.89Å
423F77.3Confident81.4Confident118 Ų11864.4 Ų64.452%0.51833%0.329SS..EExtended strand (participates in β ladder)trans-113.4142174.9-60.1-79.3000110K428 D429F423-K428 CarbonylContact C-O 3.52Å; F423-K428 VanDerWaalsContact CA-O 3.31Å; F423-K428 WeakPolarHBondContact CA-O 3.3Å; F423-D429 VanDerWaalsContact CE1-OD1 3.24Å; F423-D429 WeakPolarHBondContact CE1-OD1 3.27Å
424T76.5Confident82.3Confident34 Ų3461.1 Ų61.121%0.20932%0.315CS..  trans-70.6163.9168.2650000110.1D426 G427 K428 D430T424-D426 PolarHBondContact O-N 2.65Å; T424-D426 VanDerWaalsContact O-N 3.07Å; T424-G427 PolarHBondContact O-N 3.04Å; T424-K428 PolarHBondContact N-O 3.45Å; T424-K428 WeakPolarHBondContact OG1-CB 3.46Å; T424-K428 PolarHBondContact OG1-N 3.5Å; T424-K428 PolarHBondContact OG1-O 3.35Å; T424-D430 HydrophobicContact CG2-CB 3.9Å
425P71.1Confident82.8Confident58 Ų5859.1 Ų59.138%0.37731%0.308SS..THydrogen-bonded Turntrans-55.7-25.9174.3-2534.7000113.5P14 H57 G427P14-P425 HydrophobicContact CB-CB 3.64Å; P14-P425 HydrophobicContact CB-CG 4.25Å; H57-P425 VanDerWaalsContact CE1-CG 3.49Å; H57-P425 WeakPolarHBondContact CE1-CG 3.29Å; P425-G427 PolarHBondContact O-N 2.92Å
426D71.3Confident83.2Confident100 Ų10064.1 Ų64.154%0.53533%0.327SS..THydrogen-bonded Turntrans-80.94.8177-53.8-38.9000113.5T424 K428T424-D426 PolarHBondContact O-N 2.65Å; T424-D426 VanDerWaalsContact O-N 3.07Å; D426-K428 VanDerWaalsContact C-N 3.27Å; D426-K428 PolarHBondContact O-N 2.96Å
427G75.4Confident83.5Confident55 Ų5563.5 Ų63.557%0.56732%0.319SS*.SBendtrans73.312.2-178.200000114.8T424 P425T424-G427 PolarHBondContact O-N 3.04Å; P425-G427 PolarHBondContact O-N 2.92Å
428K81.9Confident83.6Confident145 Ų14560.9 Ų60.963%0.6331%0.312SS*.  trans-87.6153.6176-63.6178.9-179.1171.20110.7F423 T424 D426 D430F423-K428 CarbonylContact C-O 3.52Å; F423-K428 VanDerWaalsContact CA-O 3.31Å; F423-K428 WeakPolarHBondContact CA-O 3.3Å; T424-K428 PolarHBondContact N-O 3.45Å; T424-K428 WeakPolarHBondContact OG1-CB 3.46Å; T424-K428 PolarHBondContact OG1-N 3.5Å; T424-K428 PolarHBondContact OG1-O 3.35Å; D426-K428 VanDerWaalsContact C-N 3.27Å; D426-K428 PolarHBondContact O-N 2.96Å; K428-D430 PolarHBondContact O-N 3.44Å
429D83.4Confident83.4Confident81 Ų8158.5 Ų58.543%0.43330%0.299SS..EExtended strand (participates in β ladder)trans-64.1123.9174.7-65.2-30.8000111.1Q420 F423 F431Q420-D429 HydrophobicContact CG-CB 4.25Å; Q420-D429 PolarHBondContact NE2-OD1 3.15Å; F423-D429 VanDerWaalsContact CE1-OD1 3.24Å; F423-D429 WeakPolarHBondContact CE1-OD1 3.27Å; D429-F431 HydrophobicContact CB-CD2 3.9Å; D429-F431 HydrophobicContact CB-CE2 3.42Å; D429-F431 VanDerWaalsContact CB-CE2 3.42Å; D429-F431 HydrophobicContact CB-CZ 4.21Å; D429-F431 PolarHBondContact O-N 3.25Å
430D83.1Confident83.4Confident15 Ų1560.3 Ų60.38%0.0831%0.311CS..EExtended strand (participates in β ladder)trans-89.697.6178.1-169.74.1000110V421 G422 T424 K428 R432V421-D430 PolarHBondContact N-O 3.24Å; G422-D430 PolarHBondContact O-N 2.89Å; T424-D430 HydrophobicContact CG2-CB 3.9Å; K428-D430 PolarHBondContact O-N 3.44Å; D430-R432 WeakPolarHBondContact OD1-CG 3.5Å; D430-R432 IonicContact OD1-CZ 3.23Å; D430-R432 IonicContact OD1-NE 3.12Å; D430-R432 PolarHBondContact OD1-NE 3.16Å; D430-R432 IonicContact OD1-NH2 2.7Å; D430-R432 IonicContact OD2-CZ 3.43Å; D430-R432 VanDerWaalsContact OD2-CZ 3.25Å; D430-R432 IonicContact OD2-NE 2.99Å; D430-R432 PolarHBondContact OD2-NE 3.32Å; D430-R432 IonicContact OD2-NH2 2.67Å; D430-R432 PolarHBondContact OD2-NH2 3.21Å
431F86.9Confident83.1Confident110 Ų11060.5 Ų60.548%0.48231%0.314SS..EExtended strand (participates in β ladder)trans-94.3121.8176.2-73.2-82.8000111.1L418 L419 Q420 D429L418-F431 HydrophobicContact CD1-CB 4.09Å; L418-F431 HydrophobicContact CD2-CD1 4.41Å; L418-F431 HydrophobicContact CG-CB 4.27Å; L418-F431 HydrophobicContact CG-CD1 4.32Å; L419-F431 WeakPolarHBondContact O-CA 3.02Å; Q420-F431 HydrophobicContact CB-CD1 3.98Å; Q420-F431 HydrophobicContact CB-CE1 3.67Å; Q420-F431 HydrophobicContact CB-CZ 4.15Å; Q420-F431 HydrophobicContact CG-CE1 4.3Å; Q420-F431 HydrophobicContact CG-CZ 4.31Å; D429-F431 HydrophobicContact CB-CD2 3.9Å; D429-F431 HydrophobicContact CB-CE2 3.42Å; D429-F431 VanDerWaalsContact CB-CE2 3.42Å; D429-F431 HydrophobicContact CB-CZ 4.21Å; D429-F431 PolarHBondContact O-N 3.25Å
432R88.2Confident83.1Confident35 Ų3569.1 Ų69.113%0.13235%0.345CS..EExtended strand (participates in β ladder)trans-129.7151.9179.8-58.2-165.1-174.8-176.76.8112.3H57 D76 L418 L419 V421 D430 C434H57-R432 PolarHBondContact O-NH1 2.94Å; H57-R432 PolarHBondContact O-NH2 3.29Å; D76-R432 VanDerWaalsContact OD2-CD 3.32Å; D76-R432 WeakPolarHBondContact OD2-CD 3.39Å; D76-R432 IonicContact OD2-CZ 3.15Å; D76-R432 IonicContact OD2-NE 3.48Å; D76-R432 IonicContact OD2-NH1 2.69Å; D76-R432 PolarHBondContact OD2-NH1 2.87Å; L418-R432 WeakPolarHBondContact CA-O 3.42Å; L419-R432 PolarHBondContact N-O 3.31Å; L419-R432 PolarHBondContact O-N 3.02Å; V421-R432 HydrophobicContact CG2-CB 4.22Å; D430-R432 WeakPolarHBondContact OD1-CG 3.5Å; D430-R432 IonicContact OD1-CZ 3.23Å; D430-R432 IonicContact OD1-NE 3.12Å; D430-R432 PolarHBondContact OD1-NE 3.16Å; D430-R432 IonicContact OD1-NH2 2.7Å; D430-R432 IonicContact OD2-CZ 3.43Å; D430-R432 VanDerWaalsContact OD2-CZ 3.25Å; D430-R432 IonicContact OD2-NE 2.99Å; D430-R432 PolarHBondContact OD2-NE 3.32Å; D430-R432 IonicContact OD2-NH2 2.67Å; D430-R432 PolarHBondContact OD2-NH2 3.21Å; R432-C434 PolarHBondContact O-N 2.92Å
433W88.9Confident83Confident85 Ų8573.9 Ų73.932%0.32237%0.37SS..EExtended strand (participates in β ladder)trans-80.3104.6170.5-74.788.8000108.3L77 R414 L418L77-W433 WeakPolarHBondContact CB-O 3.39Å; L77-W433 PolarHBondContact N-O 2.91Å; R414-W433 VanDerWaalsContact CZ-CD1 3.5Å; R414-W433 VanDerWaalsContact CZ-CG 3.46Å; R414-W433 VanDerWaalsContact NH1-CE2 3.31Å; L418-W433 HydrophobicContact CB-CD2 4.41Å; L418-W433 HydrophobicContact CB-CH2 4.37Å; L418-W433 HydrophobicContact CB-CZ2 4.21Å; L418-W433 HydrophobicContact CD1-CD2 4.3Å; L418-W433 HydrophobicContact CD1-CG 4.25Å; L418-W433 HydrophobicContact CD1-CZ2 4.49Å
434C90.6Very high82.5Confident2 Ų271.5 Ų71.51%0.01437%0.365CS..EExtended strand (participates in β ladder)trans-108.2143.4-177.9-65.40000111.1L74 Y75 G416 K417 L419 R432L74-C434 HydrophobicContact CB-CB 4.13Å; L74-C434 HydrophobicContact CD2-CB 4.12Å; Y75-C434 CarbonylContact O-C 3.6Å; Y75-C434 VanDerWaalsContact O-CA 3.23Å; Y75-C434 WeakPolarHBondContact O-CA 3.42Å; G416-C434 CarbonylContact C-O 3.46Å; G416-C434 WeakPolarHBondContact CA-O 3.09Å; K417-C434 PolarHBondContact N-O 3.25Å; K417-C434 PolarHBondContact O-N 2.82Å; L419-C434 HydrophobicContact CD1-CB 4.24Å; R432-C434 PolarHBondContact O-N 2.92Å
435F92.1Very high82Confident19 Ų1976.3 Ų76.38%0.08338%0.379CS..EExtended strand (participates in β ladder)trans-105.1121.6171.4-173-109.2000109.4Y75 L77 R113 L114 D117 V437Y75-F435 PolarHBondContact N-O 3.49Å; Y75-F435 PolarHBondContact O-N 3.32Å; L77-F435 HydrophobicContact CD1-CB 3.99Å; L77-F435 HydrophobicContact CD2-CB 3.79Å; L77-F435 HydrophobicContact CG-CB 3.91Å; R113-F435 HydrophobicContact CB-CE1 3.85Å; L114-F435 HydrophobicContact CB-CE1 4.42Å; L114-F435 HydrophobicContact CD1-CD2 3.93Å; L114-F435 HydrophobicContact CD1-CE2 4.11Å; L114-F435 HydrophobicContact CD1-CG 4.21Å; D117-F435 HydrophobicContact CB-CE2 3.96Å; D117-F435 HydrophobicContact CB-CZ 3.88Å; F435-V437 HydrophobicContact CD1-CG2 3.51Å; F435-V437 HydrophobicContact CE1-CG2 3.63Å
436R90.6Very high81.6Confident105 Ų10579.8 Ų79.840%0.39640%0.395SS..EExtended strand (participates in β ladder)trans-79.5130.4176.8-171.2-176.6-71.5172.5-4.1109.9E64 S72 S73 L74E64-R436 VanDerWaalsContact CD-NH2 3.28Å; E64-R436 IonicContact OE1-CZ 2.88Å; E64-R436 IonicContact OE1-NE 3.06Å; E64-R436 IonicContact OE1-NH2 2.67Å; E64-R436 PolarHBondContact OE1-NH2 3.04Å; E64-R436 IonicContact OE2-CZ 3.79Å; E64-R436 IonicContact OE2-NE 3.87Å; E64-R436 PolarHBondContact OE2-NE 3.12Å; E64-R436 IonicContact OE2-NH2 3.11Å; E64-R436 PolarHBondContact OE2-NH2 3.25Å; E64-R436 VanDerWaalsContact OE2-NH2 3.11Å; S72-R436 WeakPolarHBondContact OG-CD 3.39Å; S72-R436 VanDerWaalsContact OG-CG 3.23Å; S72-R436 WeakPolarHBondContact OG-CG 3.36Å; S73-R436 CarbonylContact O-C 3.6Å; L74-R436 HydrophobicContact CD2-CB 3.88Å; L74-R436 HydrophobicContact CD2-CG 4.25Å
437V90.6Very high81Confident5 Ų579.8 Ų79.83%0.0340%0.399CS..EExtended strand (participates in β ladder)trans-128.2119.7174.1-177.40000107.9S73 Y75 R113 F435 E439S73-V437 PolarHBondContact N-O 3.06Å; S73-V437 PolarHBondContact O-N 3.14Å; Y75-V437 HydrophobicContact CD2-CB 4.08Å; Y75-V437 HydrophobicContact CD2-CG2 3.67Å; Y75-V437 HydrophobicContact CE2-CB 3.94Å; Y75-V437 HydrophobicContact CE2-CG2 3.91Å; R113-V437 HydrophobicContact CB-CG2 4.34Å; R113-V437 HydrophobicContact CG-CG1 4.06Å; F435-V437 HydrophobicContact CD1-CG2 3.51Å; F435-V437 HydrophobicContact CE1-CG2 3.63Å; V437-E439 HydrophobicContact CG1-CG 4.14Å
438D87.4Confident80.2Confident88 Ų8879.7 Ų79.747%0.47139%0.385SS..EExtended strand (participates in β ladder)trans-87.5119.7173.1-55.4-41.9000108.9
439E85.3Confident78.9Confident39 Ų3979.6 Ų79.618%0.18240%0.396CS..EExtended strand (participates in β ladder)trans-110.9142.1179.3-67.6169.9-152.100109K61 H71 Y75 V437K61-E439 IonicContact NZ-OE1 3.79Å; K61-E439 PolarHBondContact NZ-OE1 3.41Å; K61-E439 IonicContact NZ-OE2 2.58Å; K61-E439 PolarHBondContact NZ-OE2 3.37Å; H71-E439 PolarHBondContact N-O 3.33Å; H71-E439 PolarHBondContact O-N 3.22Å; Y75-E439 PolarHBondContact OH-OE1 2.97Å; V437-E439 HydrophobicContact CG1-CG 4.14Å
440V85.1Confident77.6Confident88 Ų8876.1 Ų76.153%0.53338%0.379SS..EExtended strand (participates in β ladder)trans-117.4114.3172.1-1760000107.6P69 V70P69-V440 CarbonylContact O-C 3.59Å; P69-V440 WeakPolarHBondContact O-CA 3.29Å; V70-V440 HydrophobicContact CG2-CG2 4.32Å
441N80.3Confident76.6Confident51 Ų5178.5 Ų78.527%0.27339%0.392SS..  trans-126.4109.1179.3-165.5-22.3000110.9P69 T443 T444P69-N441 WeakPolarHBondContact CA-O 3.39Å; P69-N441 WeakPolarHBondContact CB-O 3.43Å; P69-N441 PolarHBondContact O-N 2.89Å; N441-T443 VanDerWaalsContact C-N 3.34Å; N441-T443 PolarHBondContact OD1-N 3.5Å; N441-T443 PolarHBondContact OD1-OG1 3.37Å; N441-T444 VanDerWaalsContact CG-OG1 3.22Å; N441-T444 PolarHBondContact ND2-OG1 3.19Å; N441-T444 PolarHBondContact OD1-N 3.48Å
442W79.8Confident75.3Confident195 Ų19575.5 Ų75.574%0.73938%0.38SS*.SBendtrans-79-14.6179.2-66.299000113.7P69P69-W442 HydrophobicContact CB-CD2 4.02Å; P69-W442 HydrophobicContact CB-CE3 3.83Å; P69-W442 HydrophobicContact CB-CZ3 4.15Å; P69-W442 HydrophobicContact CG-CD2 4.38Å; P69-W442 HydrophobicContact CG-CE3 3.92Å; P69-W442 HydrophobicContact CG-CH2 3.92Å; P69-W442 HydrophobicContact CG-CZ2 4.37Å; P69-W442 HydrophobicContact CG-CZ3 3.69Å
443T78.3Confident74Confident123 Ų12376.3 Ų76.376%0.75539%0.387SS*.SBendtrans-99-28.7-173.860.90000113.6N441N441-T443 VanDerWaalsContact C-N 3.34Å; N441-T443 PolarHBondContact OD1-N 3.5Å; N441-T443 PolarHBondContact OD1-OG1 3.37Å
444T66.3Low72.6Confident68 Ų6880.9 Ų80.942%0.41741%0.412SS..SBendtrans-119.338.9-175.365.90000113.5N441 N446 T447N441-T444 VanDerWaalsContact CG-OG1 3.22Å; N441-T444 PolarHBondContact ND2-OG1 3.19Å; N441-T444 PolarHBondContact OD1-N 3.48Å; T444-N446 VanDerWaalsContact C-N 3.34Å; T444-N446 PolarHBondContact O-N 3.14Å; T444-T447 PolarHBondContact O-OG1 2.81Å
445W64.9Low71.3Confident136 Ų13685.9 Ų85.952%0.51544%0.438SS..THydrogen-bonded Turntrans-77.3-14-172.865.7-92.8000114.7P69P69-W445 HydrophobicContact CB-CB 4.5Å
446N62.4Low69.8Low131 Ų13188.9 Ų88.970%0.70146%0.46SS*.THydrogen-bonded Turntrans-105.315-167.7-144.813.9000114.9T444T444-N446 VanDerWaalsContact C-N 3.34Å; T444-N446 PolarHBondContact O-N 3.14Å
447T60.2Low67.8Low100 Ų10085.7 Ų85.761%0.61346%0.46SS*.  trans-1167.3-169.246.10000115.6T444 V449T444-T447 PolarHBondContact O-OG1 2.81Å; T447-V449 PolarHBondContact O-N 2.9Å
448N57.6Low65.9Low52 Ų5291.6 Ų91.628%0.27849%0.491SS..  trans-91102.4-167.3-63.5-16.7000112.9A66 H71A66-N448 HydrophobicContact CB-CB 4.11Å; A66-N448 VanDerWaalsContact CB-ND2 3.31Å; A66-N448 WeakPolarHBondContact CB-ND2 3.3Å; H71-N448 PolarHBondContact CE1-ND2 3.47Å; H71-N448 PolarHBondContact ND1-ND2 3.34Å; H71-N448 PolarHBondContact NE2-ND2 3.47Å
449V54.7Low63.9Low143 Ų14391.3 Ų91.387%0.86750%0.495SS*.  trans-107.92.3176.3-152.70000112.1T447T447-V449 PolarHBondContact O-N 2.9Å
450G55.7Low61.7Low8 Ų897.9 Ų97.98%0.08253%0.526CS..  trans-102.213.5-170.700000116.7R56 T63R56-G450 PolarHBondContact NH2-O 3.4Å; T63-G450 VanDerWaalsContact OG1-C 3.32Å; T63-G450 PolarHBondContact OG1-O 3.46Å
451I63.1Low59.3Low66 Ų6697 Ų9734%0.33854%0.535SS..  trans-61.9133.3-166.2-59.8170.2000112.5A66 N453A66-I451 HydrophobicContact CB-CD1 4.46Å; I451-N453 WeakPolarHBondContact CG2-O 3.27Å
452I58.8Low56.9Low47 Ų4799.7 Ų99.724%0.24155%0.553CS.*SBendtrans-84.3-42.1172.8-65.9169.8000111.4F62 T63 E64 L74 V421F62-I452 HydrophobicContact CB-CD1 3.61Å; F62-I452 HydrophobicContact CG-CD1 4.36Å; T63-I452 WeakPolarHBondContact O-CG1 3.32Å; T63-I452 PolarHBondContact O-N 2.9Å; E64-I452 PolarHBondContact O-N 3.09Å; L74-I452 HydrophobicContact CD1-CD1 4.36Å; V421-I452 HydrophobicContact CG1-CD1 4.48Å
453N61.5Low54.7Low52 Ų5299.6 Ų99.628%0.27856%0.558SS.*  trans-127.4126.2179.7-72.9-13.2000109.6E64 W65 I451 D455E64-N453 WeakPolarHBondContact O-CA 3.32Å; E64-N453 PolarHBondContact O-N 3.27Å; E64-N453 VanDerWaalsContact O-O 3.11Å; W65-N453 WeakPolarHBondContact CA-O 3.32Å; W65-N453 VanDerWaalsContact CB-O 3.32Å; W65-N453 WeakPolarHBondContact CB-O 3.47Å; I451-N453 WeakPolarHBondContact CG2-O 3.27Å; N453-D455 PolarHBondContact O-N 2.94Å
454E59.7Low52.9Low180 Ų180100.5 Ų100.584%0.84155%0.547SS*.SBendtrans-66.1-28-179.7-64.3-177.5168.700112.6
455D63.3Low51.1Low107 Ų107103 Ų10357%0.57256%0.562SS**SBendtrans-125.6151.7-177.4-75.9-35.9000113.8N453 G457N453-D455 PolarHBondContact O-N 2.94Å; D455-G457 PolarHBondContact O-N 3.43Å; D455-G457 VanDerWaalsContact O-N 3.12Å
456P59.3Low49.6Very low82 Ų82103 Ų10353%0.53257%0.572SS.*SBendtrans-70.70178.128.9-35.3000114.7W65W65-P456 HydrophobicContact CD2-CB 4.01Å; W65-P456 HydrophobicContact CE3-CB 4.31Å; W65-P456 HydrophobicContact CG-CB 4.4Å; W65-P456 HydrophobicContact CZ2-CB 4.33Å
457G50.1Low47.9Very low38 Ų38101.6 Ų101.639%0.39257%0.573SS.*SBendtrans-76.5145.9179.400000113.5D455 C459D455-G457 PolarHBondContact O-N 3.43Å; D455-G457 VanDerWaalsContact O-N 3.12Å; G457-C459 VanDerWaalsContact C-N 3.29Å; G457-C459 PolarHBondContact O-N 3.08Å
458N50.6Low46.6Very low129 Ų129105.2 Ų105.269%0.6958%0.58SS**  trans-75.281.4173.8-159.841.9000109.3E460N458-E460 PolarHBondContact ND2-OE1 3.42Å; N458-E460 VanDerWaalsContact ND2-OE1 3.13Å; N458-E460 PolarHBondContact O-N 3.42Å
459C44.9Very low45.1Very low83 Ų83108 Ų10856%0.56160%0.603SS**  trans-74.673.9178.1-70.90000110.7G457 G461 V462G457-C459 VanDerWaalsContact C-N 3.29Å; G457-C459 PolarHBondContact O-N 3.08Å; C459-G461 PolarHBondContact O-N 3.08Å; C459-V462 HydrophobicContact CB-CG2 4.47Å
460E39.2Very low44Very low176 Ų176109.1 Ų109.182%0.82260%0.604SS**THydrogen-bonded Turntrans-674172.1-74.2-172.4176.900113.7N458N458-E460 PolarHBondContact ND2-OE1 3.42Å; N458-E460 VanDerWaalsContact ND2-OE1 3.13Å; N458-E460 PolarHBondContact O-N 3.42Å
461G34.5Very low42.6Very low71 Ų71120.4 Ų120.473%0.73264%0.644SS**THydrogen-bonded Turntrans-129.9-5.8-169.100000118.2C459 K463C459-G461 PolarHBondContact O-N 3.08Å; G461-K463 PolarHBondContact O-N 2.88Å
462V30.3Very low41.2Very low107 Ų107122.8 Ų122.865%0.64867%0.666SS**  trans-96.7104.7-176.9-173.70000109.8C459 R464C459-V462 HydrophobicContact CB-CG2 4.47Å; V462-R464 PolarHBondContact O-N 3.46Å; V462-R464 VanDerWaalsContact O-N 3.09Å
463K33.7Very low40Very low192 Ų192123.9 Ų123.984%0.83569%0.689SS**  trans-47.4118.2163.6-81178.9175.4177.30108.4G461 T465G461-K463 PolarHBondContact O-N 2.88Å; K463-T465 PolarHBondContact O-N 3.15Å
464R40.5Very low38.6Very low142 Ų142136.5 Ų136.554%0.53673%0.733SS.*  trans-60.292.2178.7-67172.8174.4178.2-7.4110.4Q420 V462Q420-R464 PolarHBondContact O-NH2 2.95Å; V462-R464 PolarHBondContact O-N 3.46Å; V462-R464 VanDerWaalsContact O-N 3.09Å
465T27.2Very low37.5Very low120 Ų120134.4 Ų134.474%0.73673%0.728SS**  trans-91.898.6158.435.70000108K463 S467K463-T465 PolarHBondContact O-N 3.15Å; T465-S467 PolarHBondContact O-N 3.31Å
466L34Very low36.2Very low138 Ų138135.8 Ų135.872%0.72374%0.736SS**  trans-66.279.6159.5-86.5154.9000108F468L466-F468 HydrophobicContact CD2-CE2 4.03Å; L466-F468 PolarHBondContact O-N 2.79Å
467S26.9Very low34.9Very low101 Ų101138.8 Ų138.871%0.70675%0.747SS**  trans-84.291.8165.755.70000108.3T465 S469T465-S467 PolarHBondContact O-N 3.31Å; S467-S469 PolarHBondContact O-N 2.95Å
468F32.9Very low34Very low175 Ų175144.7 Ų144.777%0.76877%0.768SS**  trans-64.498.2163.4-85.3-86.9000108.7L466 L470L466-F468 HydrophobicContact CD2-CE2 4.03Å; L466-F468 PolarHBondContact O-N 2.79Å; F468-L470 PolarHBondContact O-N 3.47Å
469S26.5Very low33Very low110 Ų110145.7 Ų145.777%0.76977%0.773SS**  trans-81.194.5162.265.30000108.5S467 R471S467-S469 PolarHBondContact O-N 2.95Å; S469-R471 PolarHBondContact O-N 3.16Å
470L31.3Very low32.2Very low168 Ų168149.9 Ų149.988%0.8879%0.787SS**  trans-60.598.9161.1-89.6156.5000108.2F468 S472F468-L470 PolarHBondContact O-N 3.47Å; L470-S472 PolarHBondContact O-N 3.39Å
471R27.2Very low31.7Very low244 Ų244148 Ų14892%0.92179%0.785SS**  trans-81.494165.2-137.4-179.7-167.8-174.33.6107.4S469 G473S469-R471 PolarHBondContact O-N 3.16Å; R471-G473 PolarHBondContact O-N 3.08Å
472S31.8Very low31.5Very low116 Ų116153.9 Ų153.981%0.81179%0.789SS**  trans-67.6109.6162173.50000107.6L470L470-S472 PolarHBondContact O-N 3.39Å
473G35Very low31.6Very low70 Ų70157.8 Ų157.872%0.72280%0.8SS**  trans-90.7117.8167.500000109.1R471R471-G473 PolarHBondContact O-N 3.08Å
474R31.7Very low31.4Very low318 Ų318154.7 Ų154.7100%1.280%0.797SS**  trans-63.70163.1-87.2179.3174.4170.5-2111.7

Retrieved 474 of 474 residues in 95.3 ms (Link to these results)

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