A0A096NAG6_PAPAN Loading...

Olfactory receptor

Odorant receptor.

AlphaFold DB (G7PQW9), UniProt , Accession A0A096NAG6, Species PAPAN (Papio anubis, Olive baboon), Gene OR52N4, Length 321 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
1M32.9Very low52.8Low240 Ų240135 Ų135100%1.18271%0.71SS**  088.90-156.1175.8-166.200106.6
2L36Very low55.6Low181 Ų181131.7 Ų131.795%0.94872%0.716SS**  trans-89.9111.9179.2-82.7162.6000107.7L4L2-L4 PolarHBondContact O-N 2.83Å
3T35.8Very low58.2Low129 Ų129124.4 Ų124.479%0.79168%0.681SS**  trans-65.5109.5174.133.40000109.3N5T3-N5 PolarHBondContact O-N 2.76Å; T3-N5 VanDerWaalsContact O-N 3.08Å
4L42.9Very low60.6Low162 Ų162115.5 Ų115.585%0.84863%0.632SS**  trans-70.299.7170.3-163.381.1000107.7L2 K6L2-L4 PolarHBondContact O-N 2.83Å; L4-K6 PolarHBondContact O-N 3.04Å
5N41.8Very low62.5Low145 Ų145110.7 Ų110.778%0.77561%0.605SS**  trans-60.2101.9166.1-106.6-3.8000107.3T3 T7T3-N5 PolarHBondContact O-N 2.76Å; T3-N5 VanDerWaalsContact O-N 3.08Å; N5-T7 PolarHBondContact O-N 2.92Å
6K43.7Very low64.2Low182 Ų182103.8 Ų103.879%0.79157%0.567SS**  trans-78.970.5177.6-154.8-174.8-167-174.90107.8L4 D8L4-K6 PolarHBondContact O-N 3.04Å; K6-D8 PolarHBondContact O-N 3.41Å
7T56.5Low65.2Low111 Ų111100 Ų10068%0.68155%0.546SS*.  trans-62.9122.2164.5-29.90000105.9N5 L9N5-T7 PolarHBondContact O-N 2.92Å; T7-L9 PolarHBondContact O-N 2.87Å
8D58.7Low66.1Low131 Ų13194.4 Ų94.470%0.70152%0.516SS*.  trans-56.1110.7177.7-78.6-41.7000108.8K6 I10K6-D8 PolarHBondContact O-N 3.41Å; D8-I10 PolarHBondContact O-N 3.25Å
9L71.9Confident66.8Low93 Ų9389.5 Ų89.549%0.48749%0.489SS..  trans-73.431.5178-77.4145.4000111.4T7 P169 Y170 C171T7-L9 PolarHBondContact O-N 2.87Å; L9-P169 HydrophobicContact CB-CB 4.1Å; L9-P169 HydrophobicContact CD1-CB 4.15Å; L9-Y170 WeakPolarHBondContact O-CA 3.5Å; L9-Y170 WeakPolarHBondContact O-CB 3.39Å; L9-Y170 PolarHBondContact O-N 2.98Å; L9-Y170 VanDerWaalsContact O-O 3.09Å; L9-C171 HydrophobicContact CD2-CB 3.79Å
10I78.5Confident67.1Low86 Ų8686.8 Ų86.844%0.44148%0.476SS..  trans-115.1118.4180-56.2176.5000106.7D8 F96D8-I10 PolarHBondContact O-N 3.25Å; I10-F96 HydrophobicContact CG2-CD1 3.77Å; I10-F96 HydrophobicContact CG2-CD2 4.1Å; I10-F96 HydrophobicContact CG2-CE1 3.76Å; I10-F96 HydrophobicContact CG2-CE2 4.14Å; I10-F96 HydrophobicContact CG2-CG 3.93Å; I10-F96 HydrophobicContact CG2-CZ 3.96Å
11P82.1Confident67.2Low25 Ų2586.4 Ų86.416%0.16249%0.492CS..  trans-68.3147.3177.929.2-35.4000109.7S13 F14 F96 Y170 N174P11-S13 VanDerWaalsContact C-N 3.3Å; P11-F14 HydrophobicContact CG-CD1 4.31Å; P11-F14 HydrophobicContact CG-CE1 3.66Å; P11-F14 HydrophobicContact CG-CE2 4.44Å; P11-F14 HydrophobicContact CG-CZ 3.74Å; P11-F96 HydrophobicContact CG-CD2 4Å; P11-F96 WeakPolarHBondContact O-CB 3.4Å; P11-Y170 HydrophobicContact CG-CG 4.46Å; P11-N174 HydrophobicContact CB-CB 4.48Å
12A86.3Confident69.2Low95 Ų9577.4 Ų77.479%0.78545%0.448SS*.SBendtrans-66.4-37172.100000111.5F96A12-F96 PolarHBondContact O-N 3.35Å
13S89.9Confident71.1Confident37 Ų3773.4 Ų73.426%0.25943%0.425SS..EExtended strand (participates in β ladder)trans-148.1159.3-178.660.80000112.5P11 I94 N174P11-S13 VanDerWaalsContact C-N 3.3Å; S13-I94 CarbonylContact C-O 3.59Å; S13-I94 WeakPolarHBondContact CA-O 3.42Å; S13-I94 VanDerWaalsContact CB-O 3.27Å; S13-I94 WeakPolarHBondContact CB-O 3.25Å; S13-N174 WeakPolarHBondContact O-CB 3.46Å; S13-N174 PolarHBondContact O-ND2 3.43Å
14F90.8Very high73Confident0 Ų075 Ų750%043%0.428CS..EExtended strand (participates in β ladder)trans-107.9154166.6-65.3-68.9000111P11 D93 I94 F96 C99 Y170 N174 L176 V186 L189P11-F14 HydrophobicContact CG-CD1 4.31Å; P11-F14 HydrophobicContact CG-CE1 3.66Å; P11-F14 HydrophobicContact CG-CE2 4.44Å; P11-F14 HydrophobicContact CG-CZ 3.74Å; F14-D93 CarbonylContact O-C 3.45Å; F14-D93 WeakPolarHBondContact O-CA 3.1Å; F14-I94 HydrophobicContact CB-CG2 3.9Å; F14-I94 PolarHBondContact N-O 3.49Å; F14-I94 PolarHBondContact O-N 2.93Å; F14-F96 HydrophobicContact CD2-CD2 4.31Å; F14-F96 AromaticContact CE2-CD2 3.32Å; F14-F96 HydrophobicContact CE2-CD2 3.32Å; F14-F96 AromaticContact CE2-CE2 3.84Å; F14-F96 HydrophobicContact CE2-CE2 3.84Å; F14-F96 HydrophobicContact CE2-CG 4.31Å; F14-F96 AromaticContact CZ-CD2 3.61Å; F14-F96 HydrophobicContact CZ-CD2 3.61Å; F14-F96 AromaticContact CZ-CE2 3.82Å; F14-F96 HydrophobicContact CZ-CE2 3.82Å; F14-C99 HydrophobicContact CD2-CB 3.9Å; F14-C99 HydrophobicContact CE2-CB 4.33Å; F14-Y170 HydrophobicContact CE1-CD1 4.28Å; F14-Y170 HydrophobicContact CZ-CD1 4.13Å; F14-Y170 HydrophobicContact CZ-CE1 4.03Å; F14-N174 CarbonylContact C-O 3.51Å; F14-N174 VanDerWaalsContact CA-O 3.29Å; F14-N174 WeakPolarHBondContact CA-O 3.48Å; F14-N174 HydrophobicContact CD1-CB 4.24Å; F14-L176 HydrophobicContact CB-CD1 4.15Å; F14-L176 HydrophobicContact CD1-CD1 3.71Å; F14-L176 HydrophobicContact CE1-CD1 4.28Å; F14-L176 HydrophobicContact CG-CD1 3.99Å; F14-V186 HydrophobicContact CE2-CG1 4.37Å; F14-V186 HydrophobicContact CZ-CG1 4.14Å; F14-L189 HydrophobicContact CD1-CD1 3.98Å; F14-L189 HydrophobicContact CE1-CD1 3.81Å
15I89.6Confident74.7Confident44 Ų4469.8 Ų69.823%0.22640%0.404CS..EExtended strand (participates in β ladder)trans-108.9109.9177.1-55.1178.6000108.1N17 K92 D93 N174 I175 L176I15-N17 PolarHBondContact O-N 3Å; I15-K92 HydrophobicContact CG2-CB 3.71Å; I15-K92 HydrophobicContact CG2-CD 4.25Å; I15-D93 WeakPolarHBondContact CG1-OD1 3.32Å; I15-N174 PolarHBondContact N-O 3.31Å; I15-I175 HydrophobicContact CB-CG1 4.4Å; I15-I175 HydrophobicContact CD1-CG1 4.46Å; I15-L176 PolarHBondContact O-N 3.42Å
16L89.1Confident76.5Confident0 Ų063.1 Ų63.10%037%0.368CS..EExtended strand (participates in β ladder)trans-83.9108.3175.5-67.8170.2000109.8G18 K82 I86 K92 I94 L176 H178L16-G18 PolarHBondContact O-N 3.43Å; L16-K82 HydrophobicContact CD1-CG 3.97Å; L16-I86 HydrophobicContact CB-CD1 3.54Å; L16-I86 HydrophobicContact CD1-CD1 4.06Å; L16-I86 HydrophobicContact CG-CD1 4.46Å; L16-K92 PolarHBondContact N-O 3.27Å; L16-K92 WeakPolarHBondContact O-CB 3.22Å; L16-K92 VanDerWaalsContact O-CG 3.32Å; L16-K92 WeakPolarHBondContact O-CG 3.48Å; L16-I94 HydrophobicContact CD1-CB 4.32Å; L16-I94 HydrophobicContact CD1-CD1 4.38Å; L16-I94 HydrophobicContact CD1-CG2 3.94Å; L16-I94 HydrophobicContact CG-CG2 4.02Å; L16-L176 HydrophobicContact CD2-CB 3.81Å; L16-L176 HydrophobicContact CD2-CD2 3.97Å; L16-H178 WeakPolarHBondContact CB-O 3.46Å
17N82.8Confident78.4Confident39 Ų3958.9 Ų58.921%0.20935%0.353CS..  trans-75.3-7.8-177.1-93.4-0.5000114.3I15 V19 Q26 I175 L176I15-N17 PolarHBondContact O-N 3Å; N17-V19 PolarHBondContact O-N 2.67Å; N17-Q26 PolarHBondContact O-NE2 3Å; N17-I175 HydrophobicContact CB-CG2 4.48Å; N17-I175 VanDerWaalsContact ND2-CG2 3.29Å; N17-I175 WeakPolarHBondContact ND2-CG2 3.38Å; N17-L176 PolarHBondContact N-O 3.43Å
18G81.3Confident79.7Confident0 Ų062.7 Ų62.70%036%0.355CS..  trans75.5-121.9-178.100000111.2L16 P20 H178L16-G18 PolarHBondContact O-N 3.43Å; G18-P20 WeakPolarHBondContact O-CD 3.16Å; G18-H178 PolarHBondContact N-O 3.06Å; G18-H178 VanDerWaalsContact N-O 3.12Å; G18-H178 CarbonylContact O-C 3.53Å
19V78.3Confident80.8Confident1 Ų157.7 Ų57.71%0.00633%0.328CS..SBendtrans-105.8102.9178.2-169.20000109.4N17 L22 Q26 F87 T179 I277 I278N17-V19 PolarHBondContact O-N 2.67Å; V19-L22 HydrophobicContact CB-CB 4.39Å; V19-L22 HydrophobicContact CG1-CB 4.02Å; V19-L22 HydrophobicContact CG1-CD1 3.82Å; V19-L22 HydrophobicContact CG1-CG 4.46Å; V19-L22 PolarHBondContact O-N 3.4Å; V19-Q26 PolarHBondContact O-NE2 3.44Å; V19-Q26 VanDerWaalsContact O-NE2 3.12Å; V19-F87 HydrophobicContact CG2-CE1 4.37Å; V19-F87 HydrophobicContact CG2-CZ 4.2Å; V19-T179 HydrophobicContact CG2-CG2 4.41Å; V19-I277 HydrophobicContact CG2-CG2 4.1Å; V19-I278 HydrophobicContact CG1-CD1 4.32Å; V19-I278 HydrophobicContact CG1-CG1 4.13Å
20P73.4Confident81.5Confident34 Ų3453.3 Ų53.322%0.22131%0.305CS..THydrogen-bonded Turntrans-58.8139.2179.2-2232.5000112G18 L22 P177 S274 I277G18-P20 WeakPolarHBondContact O-CD 3.16Å; P20-L22 PolarHBondContact O-N 3.42Å; P20-P177 HydrophobicContact CG-CB 3.91Å; P20-S274 WeakPolarHBondContact O-CB 3.27Å; P20-I277 HydrophobicContact CG-CD1 3.75Å
21G69.1Low81.9Confident79 Ų7954.6 Ų54.681%0.81431%0.308SS*.THydrogen-bonded Turntrans74.7-1.1178.100000115.1
22L74.9Confident82.2Confident52 Ų5256.4 Ų56.427%0.27232%0.319SS..  trans-122.420.7175.4-77.3169.1000111.8V19 P20 D24 T25 Q26 I29 I278V19-L22 HydrophobicContact CB-CB 4.39Å; V19-L22 HydrophobicContact CG1-CB 4.02Å; V19-L22 HydrophobicContact CG1-CD1 3.82Å; V19-L22 HydrophobicContact CG1-CG 4.46Å; V19-L22 PolarHBondContact O-N 3.4Å; P20-L22 PolarHBondContact O-N 3.42Å; L22-D24 VanDerWaalsContact C-N 3.31Å; L22-D24 PolarHBondContact O-N 2.82Å; L22-T25 WeakPolarHBondContact CB-OG1 3.33Å; L22-T25 WeakPolarHBondContact CD2-OG1 3.4Å; L22-T25 CarbonylContact O-C 3.51Å; L22-T25 WeakPolarHBondContact O-CA 3.32Å; L22-T25 PolarHBondContact O-N 2.97Å; L22-T25 PolarHBondContact O-OG1 3.2Å; L22-Q26 WeakPolarHBondContact O-CG 3.36Å; L22-Q26 PolarHBondContact O-N 3.43Å; L22-I29 HydrophobicContact CB-CD1 4.22Å; L22-I29 HydrophobicContact CD1-CD1 4.26Å; L22-I278 HydrophobicContact CD1-CD1 3.86Å
23E75.6Confident82.3Confident97 Ų9752.5 Ų52.545%0.45329%0.285SS..G310 helixtrans-54.5-44.3-175.3-64179.6161.700112.2T25 Q26E23-T25 PolarHBondContact O-N 2.94Å; E23-Q26 WeakPolarHBondContact O-CB 3.39Å; E23-Q26 PolarHBondContact O-N 3.35Å
24D75.2Confident82.4Confident162 Ų16252.2 Ų52.287%0.86628%0.283SS*.G310 helixtrans-66.5-19.3177.4-59-33.9000113.7L22L22-D24 VanDerWaalsContact C-N 3.31Å; L22-D24 PolarHBondContact O-N 2.82Å
25T79.6Confident82.4Confident53 Ų5355.3 Ų55.333%0.32530%0.304SS..G310 helixtrans-106.9-0.5179.457.90000113.5L22 E23 L27 W28 I29L22-T25 WeakPolarHBondContact CB-OG1 3.33Å; L22-T25 WeakPolarHBondContact CD2-OG1 3.4Å; L22-T25 CarbonylContact O-C 3.51Å; L22-T25 WeakPolarHBondContact O-CA 3.32Å; L22-T25 PolarHBondContact O-N 2.97Å; L22-T25 PolarHBondContact O-OG1 3.2Å; E23-T25 PolarHBondContact O-N 2.94Å; T25-L27 PolarHBondContact O-N 3.21Å; T25-W28 WeakPolarHBondContact O-CB 3.4Å; T25-W28 PolarHBondContact O-N 3.01Å; T25-I29 PolarHBondContact O-N 3.25Å
26Q79.9Confident82.6Confident4 Ų455.1 Ų55.12%0.01930%0.303CS..Hα-helixtrans-58-33.6-179.2-80.2178.8-100111.8N17 V19 L22 E23 W28 I29 S30 F87N17-Q26 PolarHBondContact O-NE2 3Å; V19-Q26 PolarHBondContact O-NE2 3.44Å; V19-Q26 VanDerWaalsContact O-NE2 3.12Å; L22-Q26 WeakPolarHBondContact O-CG 3.36Å; L22-Q26 PolarHBondContact O-N 3.43Å; E23-Q26 WeakPolarHBondContact O-CB 3.39Å; E23-Q26 PolarHBondContact O-N 3.35Å; Q26-W28 PolarHBondContact O-N 3.44Å; Q26-I29 PolarHBondContact O-N 3.31Å; Q26-S30 PolarHBondContact O-N 3.15Å; Q26-F87 HydrophobicContact CB-CB 4.47Å; Q26-F87 HydrophobicContact CB-CD1 3.75Å; Q26-F87 HydrophobicContact CB-CE1 4.31Å; Q26-F87 HydrophobicContact CB-CG 4.28Å; Q26-F87 HydrophobicContact CG-CD1 3.88Å; Q26-F87 HydrophobicContact CG-CE1 3.98Å
27L82.3Confident82.8Confident94 Ų9457.4 Ų57.449%0.49231%0.312SS..Hα-helixtrans-61.8-42.2173.8-170.868.7000111.9T25 S30 F31T25-L27 PolarHBondContact O-N 3.21Å; L27-S30 WeakPolarHBondContact O-CB 3.42Å; L27-S30 PolarHBondContact O-N 2.99Å; L27-S30 PolarHBondContact O-OG 2.98Å; L27-F31 WeakPolarHBondContact O-CD2 3.42Å
28W84.6Confident83.3Confident190 Ų19058.7 Ų58.772%0.7232%0.321SS*.Hα-helixtrans-69.2-36.8177.1-72.4106.5000112.6T25 Q26 S30 F31 P32T25-W28 WeakPolarHBondContact O-CB 3.4Å; T25-W28 PolarHBondContact O-N 3.01Å; Q26-W28 PolarHBondContact O-N 3.44Å; W28-S30 PolarHBondContact O-N 3.29Å; W28-F31 HydrophobicContact CE3-CD2 4.05Å; W28-F31 HydrophobicContact CE3-CE2 4.07Å; W28-F31 HydrophobicContact CZ3-CE2 4.33Å; W28-F31 PolarHBondContact O-N 3.25Å; W28-P32 WeakPolarHBondContact O-CD 3.28Å
29I81.9Confident83.9Confident27 Ų2761.6 Ų61.614%0.13834%0.338CS..Hα-helixtrans-66.7-28.1175.2-63.4167000111.3L22 T25 Q26 F31 P32 F33 F87L22-I29 HydrophobicContact CB-CD1 4.22Å; L22-I29 HydrophobicContact CD1-CD1 4.26Å; T25-I29 PolarHBondContact O-N 3.25Å; Q26-I29 PolarHBondContact O-N 3.31Å; I29-F31 VanDerWaalsContact C-N 3.33Å; I29-F31 PolarHBondContact O-N 3.37Å; I29-P32 WeakPolarHBondContact O-CD 3.34Å; I29-P32 VanDerWaalsContact O-CG 3.23Å; I29-P32 WeakPolarHBondContact O-CG 3.32Å; I29-F33 HydrophobicContact CG2-CD2 3.87Å; I29-F33 HydrophobicContact CG2-CE2 3.57Å; I29-F33 HydrophobicContact CG2-CZ 4.12Å; I29-F33 WeakPolarHBondContact O-CD2 3.43Å; I29-F33 PolarHBondContact O-N 2.89Å; I29-F87 HydrophobicContact CG2-CE2 4.43Å
30S85.6Confident84.7Confident0 Ų061.6 Ų61.60%034%0.339CS..Hα-helixtrans-65-33.1-179.880.30000113.7Q26 L27 W28 F33 C34 W88Q26-S30 PolarHBondContact O-N 3.15Å; L27-S30 WeakPolarHBondContact O-CB 3.42Å; L27-S30 PolarHBondContact O-N 2.99Å; L27-S30 PolarHBondContact O-OG 2.98Å; W28-S30 PolarHBondContact O-N 3.29Å; S30-F33 PolarHBondContact O-N 3.2Å; S30-C34 WeakPolarHBondContact O-CB 3.43Å; S30-C34 PolarHBondContact O-N 3.03Å; S30-W88 PolarHBondContact OG-NE1 3.43Å
31F88Confident85.7Confident114 Ų11462.3 Ų62.350%0.534%0.34SS..Hα-helixtrans-61.2-52.8-179.7-68-68.5000113.5L27 W28 I29 F33 C34 S35L27-F31 WeakPolarHBondContact O-CD2 3.42Å; W28-F31 HydrophobicContact CE3-CD2 4.05Å; W28-F31 HydrophobicContact CE3-CE2 4.07Å; W28-F31 HydrophobicContact CZ3-CE2 4.33Å; W28-F31 PolarHBondContact O-N 3.25Å; I29-F31 VanDerWaalsContact C-N 3.33Å; I29-F31 PolarHBondContact O-N 3.37Å; F31-F33 VanDerWaalsContact C-N 3.3Å; F31-F33 PolarHBondContact O-N 2.98Å; F31-C34 PolarHBondContact O-N 3.14Å; F31-S35 PolarHBondContact O-N 3.49Å; F31-S35 PolarHBondContact O-OG 2.93Å
32P88.9Confident86.9Confident62 Ų6264.1 Ų64.140%0.40333%0.329SS..Hα-helixtrans-64.4-33.9176.422.5-31.6000112.5W28 I29 S35 M36W28-P32 WeakPolarHBondContact O-CD 3.28Å; I29-P32 WeakPolarHBondContact O-CD 3.34Å; I29-P32 VanDerWaalsContact O-CG 3.23Å; I29-P32 WeakPolarHBondContact O-CG 3.32Å; P32-S35 WeakPolarHBondContact CA-OG 3.28Å; P32-S35 PolarHBondContact O-OG 3.31Å; P32-M36 WeakPolarHBondContact O-CB 3.43Å; P32-M36 WeakPolarHBondContact O-CG 3.49Å; P32-M36 PolarHBondContact O-N 2.9Å
33F87.4Confident87.8Confident13 Ų1362.7 Ų62.76%0.05733%0.328CS..Hα-helixtrans-67.6-42.9177.3-82.8-128.5000111.6I29 S30 F31 Y37 L84 F87 N281 L285I29-F33 HydrophobicContact CG2-CD2 3.87Å; I29-F33 HydrophobicContact CG2-CE2 3.57Å; I29-F33 HydrophobicContact CG2-CZ 4.12Å; I29-F33 WeakPolarHBondContact O-CD2 3.43Å; I29-F33 PolarHBondContact O-N 2.89Å; S30-F33 PolarHBondContact O-N 3.2Å; F31-F33 VanDerWaalsContact C-N 3.3Å; F31-F33 PolarHBondContact O-N 2.98Å; F33-Y37 WeakPolarHBondContact O-CB 3.4Å; F33-Y37 PolarHBondContact O-N 3.42Å; F33-L84 HydrophobicContact CB-CD2 4.38Å; F33-F87 HydrophobicContact CD1-CE2 4.31Å; F33-N281 HydrophobicContact CD1-CB 4.47Å; F33-N281 HydrophobicContact CE1-CB 3.31Å; F33-N281 HydrophobicContact CZ-CB 3.53Å; F33-L285 HydrophobicContact CD1-CD1 3.61Å; F33-L285 HydrophobicContact CE1-CD1 3.93Å; F33-L285 HydrophobicContact CG-CD1 4.07Å
34C91.6Very high88.8Confident32 Ų3258.1 Ų58.122%0.21631%0.306CS..Hα-helixtrans-64.5-44.1176.4-1750000111.2S30 F31 Y37 V38 L84 W88S30-C34 WeakPolarHBondContact O-CB 3.43Å; S30-C34 PolarHBondContact O-N 3.03Å; F31-C34 PolarHBondContact O-N 3.14Å; C34-Y37 WeakPolarHBondContact O-CB 3.46Å; C34-Y37 PolarHBondContact O-N 2.93Å; C34-V38 WeakPolarHBondContact O-CG2 3.24Å; C34-V38 PolarHBondContact O-N 3.34Å; C34-L84 HydrophobicContact CB-CD1 4.3Å; C34-L84 HydrophobicContact CB-CD2 4.05Å; C34-W88 HydrophobicContact CB-CH2 4.45Å; C34-W88 HydrophobicContact CB-CZ2 4.11Å
35S92.4Very high89.7Confident64 Ų6453.4 Ų53.445%0.44829%0.285SS..Hα-helixtrans-64.7-44.8178.468.40000112F31 P32 Y37 V38 V39F31-S35 PolarHBondContact O-N 3.49Å; F31-S35 PolarHBondContact O-OG 2.93Å; P32-S35 WeakPolarHBondContact CA-OG 3.28Å; P32-S35 PolarHBondContact O-OG 3.31Å; S35-Y37 VanDerWaalsContact C-N 3.33Å; S35-Y37 PolarHBondContact O-N 3.4Å; S35-V38 PolarHBondContact O-N 3.14Å; S35-V39 VanDerWaalsContact O-CG2 3.31Å; S35-V39 WeakPolarHBondContact O-CG2 3.38Å; S35-V39 PolarHBondContact O-N 3.29Å
36M92.6Very high90.3Very high40 Ų4052.3 Ų52.320%0.19729%0.285CS..Hα-helixtrans-59.4-43.6173.9-73.4-178.478.600111.5P32 V39 A40 L285 L286 T289P32-M36 WeakPolarHBondContact O-CB 3.43Å; P32-M36 WeakPolarHBondContact O-CG 3.49Å; P32-M36 PolarHBondContact O-N 2.9Å; M36-V39 PolarHBondContact O-N 3.4Å; M36-A40 VanDerWaalsContact O-CB 3.31Å; M36-A40 WeakPolarHBondContact O-CB 3.39Å; M36-A40 PolarHBondContact O-N 3.44Å; M36-L285 HydrophobicContact CB-CD2 3.79Å; M36-L285 HydrophobicContact CE-CB 3.79Å; M36-L285 HydrophobicContact SD-CB 4.42Å; M36-L286 HydrophobicContact CE-CB 4.43Å; M36-L286 HydrophobicContact CE-CD1 4.37Å; M36-T289 HydrophobicContact CB-CG2 4.41Å; M36-T289 HydrophobicContact CE-CG2 4.42Å; M36-T289 HydrophobicContact CG-CG2 4.34Å; M36-T289 PolarHBondContact O-OG1 2.84Å
37Y92.8Very high90.9Very high48 Ų4852.5 Ų52.519%0.18829%0.286CS..Hα-helixtrans-59.3-49175.6178.6-110.6000112.2F33 C34 S35 V39 A40 M41 C76 I80F33-Y37 WeakPolarHBondContact O-CB 3.4Å; F33-Y37 PolarHBondContact O-N 3.42Å; C34-Y37 WeakPolarHBondContact O-CB 3.46Å; C34-Y37 PolarHBondContact O-N 2.93Å; S35-Y37 VanDerWaalsContact C-N 3.33Å; S35-Y37 PolarHBondContact O-N 3.4Å; Y37-V39 VanDerWaalsContact C-N 3.33Å; Y37-V39 PolarHBondContact O-N 3.03Å; Y37-A40 PolarHBondContact O-N 2.9Å; Y37-M41 HydrophobicContact CD1-CG 4.28Å; Y37-M41 HydrophobicContact CD2-CG 4.04Å; Y37-M41 HydrophobicContact CD2-SD 4.49Å; Y37-M41 HydrophobicContact CE1-CG 3.91Å; Y37-M41 HydrophobicContact CE2-CG 3.63Å; Y37-M41 HydrophobicContact CE2-SD 3.69Å; Y37-M41 HydrophobicContact CG-CG 4.34Å; Y37-M41 WeakPolarHBondContact O-CB 3.01Å; Y37-M41 VanDerWaalsContact O-CG 3.22Å; Y37-M41 WeakPolarHBondContact O-CG 3.38Å; Y37-M41 PolarHBondContact O-N 3.5Å; Y37-C76 HydrophobicContact CD2-CB 3.94Å; Y37-C76 HydrophobicContact CE2-CB 3.95Å; Y37-I80 HydrophobicContact CD2-CB 3.86Å; Y37-I80 HydrophobicContact CD2-CG1 4.28Å; Y37-I80 HydrophobicContact CD2-CG2 4Å; Y37-I80 HydrophobicContact CE2-CB 4.4Å; Y37-I80 HydrophobicContact CG-CB 4.33Å; Y37-I80 HydrophobicContact CG-CG2 3.96Å
38V94.4Very high91.5Very high66 Ų6650.4 Ų50.440%0.428%0.275SS..Hα-helixtrans-60.3-44178.2170.60000111C34 S35 M41 I42C34-V38 WeakPolarHBondContact O-CG2 3.24Å; C34-V38 PolarHBondContact O-N 3.34Å; S35-V38 PolarHBondContact O-N 3.14Å; V38-M41 PolarHBondContact O-N 3.39Å; V38-I42 HydrophobicContact CG1-CD1 3.57Å; V38-I42 HydrophobicContact CG1-CG1 4.32Å; V38-I42 WeakPolarHBondContact O-CB 3.46Å; V38-I42 VanDerWaalsContact O-CG1 3.27Å; V38-I42 WeakPolarHBondContact O-CG1 3.33Å; V38-I42 PolarHBondContact O-N 3Å
39V94.1Very high91.8Very high61 Ų6147 Ų4737%0.3727%0.265SS..Hα-helixtrans-63.3-44.7176.8172.10000111.3S35 M36 Y37 G43 T289 I293S35-V39 VanDerWaalsContact O-CG2 3.31Å; S35-V39 WeakPolarHBondContact O-CG2 3.38Å; S35-V39 PolarHBondContact O-N 3.29Å; M36-V39 PolarHBondContact O-N 3.4Å; Y37-V39 VanDerWaalsContact C-N 3.33Å; Y37-V39 PolarHBondContact O-N 3.03Å; V39-G43 WeakPolarHBondContact O-CA 3.45Å; V39-G43 PolarHBondContact O-N 3.19Å; V39-T289 HydrophobicContact CB-CG2 4.14Å; V39-T289 HydrophobicContact CG1-CG2 3.76Å; V39-I293 HydrophobicContact CG1-CD1 4.15Å
40A94.2Very high92.1Very high2 Ų246.4 Ų46.42%0.01726%0.262CS..Hα-helixtrans-61.5-44.717700000111.3M36 Y37 N44 P288M36-A40 VanDerWaalsContact O-CB 3.31Å; M36-A40 WeakPolarHBondContact O-CB 3.39Å; M36-A40 PolarHBondContact O-N 3.44Å; Y37-A40 PolarHBondContact O-N 2.9Å; A40-N44 VanDerWaalsContact O-CB 3.27Å; A40-N44 WeakPolarHBondContact O-CB 2.99Å; A40-N44 PolarHBondContact O-N 3.47Å; A40-N44 PolarHBondContact O-ND2 2.97Å; A40-P288 HydrophobicContact CB-CB 3.85Å
41M95.4Very high92.3Very high48 Ų4846.8 Ų46.824%0.23626%0.264CS..Hα-helixtrans-63.7-51.5178.1-68.3-58-67.100111.3Y37 V38 C45 L73Y37-M41 HydrophobicContact CD1-CG 4.28Å; Y37-M41 HydrophobicContact CD2-CG 4.04Å; Y37-M41 HydrophobicContact CD2-SD 4.49Å; Y37-M41 HydrophobicContact CE1-CG 3.91Å; Y37-M41 HydrophobicContact CE2-CG 3.63Å; Y37-M41 HydrophobicContact CE2-SD 3.69Å; Y37-M41 HydrophobicContact CG-CG 4.34Å; Y37-M41 WeakPolarHBondContact O-CB 3.01Å; Y37-M41 VanDerWaalsContact O-CG 3.22Å; Y37-M41 WeakPolarHBondContact O-CG 3.38Å; Y37-M41 PolarHBondContact O-N 3.5Å; V38-M41 PolarHBondContact O-N 3.39Å; M41-C45 WeakPolarHBondContact O-CB 3.3Å; M41-C45 PolarHBondContact O-N 2.98Å; M41-C45 PolarHBondContact O-SG 3.14Å; M41-L73 HydrophobicContact CE-CD2 3.77Å; M41-L73 HydrophobicContact SD-CD2 3.47Å; M41-L73 WeakPolarHBondContact SD-CD2 3.3Å
42I94.3Very high92.4Very high117 Ų11751 Ų5160%0.628%0.277SS*.Hα-helixtrans-63.8-46.5-179.8-67.1171.9000110.7V38 G46V38-I42 HydrophobicContact CG1-CD1 3.57Å; V38-I42 HydrophobicContact CG1-CG1 4.32Å; V38-I42 WeakPolarHBondContact O-CB 3.46Å; V38-I42 VanDerWaalsContact O-CG1 3.27Å; V38-I42 WeakPolarHBondContact O-CG1 3.33Å; V38-I42 PolarHBondContact O-N 3Å; I42-G46 WeakPolarHBondContact O-CA 3.26Å; I42-G46 PolarHBondContact O-N 2.96Å
43G93.4Very high92.2Very high23 Ų2355.6 Ų55.624%0.23729%0.287CS..Hα-helixtrans-63.8-47.6-176.800000112.7V39 L47V39-G43 WeakPolarHBondContact O-CA 3.45Å; V39-G43 PolarHBondContact O-N 3.19Å; G43-L47 WeakPolarHBondContact O-CB 3.45Å; G43-L47 PolarHBondContact O-N 2.62Å
44N95.9Very high92.2Very high1 Ų156.4 Ų56.41%0.00529%0.291CS..Hα-helixtrans-74.9-39.4-178.9-71.9-65.4000112.6A40 G46 L47 L48 S69 L73 P288A40-N44 VanDerWaalsContact O-CB 3.27Å; A40-N44 WeakPolarHBondContact O-CB 2.99Å; A40-N44 PolarHBondContact O-N 3.47Å; A40-N44 PolarHBondContact O-ND2 2.97Å; N44-G46 VanDerWaalsContact C-N 3.33Å; N44-G46 PolarHBondContact O-N 3.22Å; N44-L47 PolarHBondContact O-N 3.34Å; N44-L48 WeakPolarHBondContact O-CG 3.48Å; N44-L48 PolarHBondContact O-N 3.41Å; N44-S69 WeakPolarHBondContact OD1-CA 3.37Å; N44-S69 WeakPolarHBondContact OD1-CB 3.49Å; N44-S69 PolarHBondContact OD1-OG 2.99Å; N44-L73 HydrophobicContact CB-CD1 4.3Å; N44-L73 HydrophobicContact CB-CD2 3.88Å; N44-L73 HydrophobicContact CB-CG 3.81Å; N44-P288 PolarHBondContact ND2-O 2.88Å
45C95.4Very high91.8Very high62 Ų6259.7 Ų59.742%0.41931%0.307SS..Hα-helixtrans-62.2-42.4171.4-72.50000111.5M41 L48 F49M41-C45 WeakPolarHBondContact O-CB 3.3Å; M41-C45 PolarHBondContact O-N 2.98Å; M41-C45 PolarHBondContact O-SG 3.14Å; C45-L48 PolarHBondContact O-N 2.73Å; C45-F49 WeakPolarHBondContact O-CB 3.27Å; C45-F49 PolarHBondContact O-N 3.31Å
46G91.9Very high91.2Very high31 Ų3159.9 Ų59.932%0.3231%0.312SS..Hα-helixtrans-58.1-49.6173.800000111.2I42 N44 L48 F49 L50I42-G46 WeakPolarHBondContact O-CA 3.26Å; I42-G46 PolarHBondContact O-N 2.96Å; N44-G46 VanDerWaalsContact C-N 3.33Å; N44-G46 PolarHBondContact O-N 3.22Å; G46-L48 VanDerWaalsContact C-N 3.35Å; G46-L48 PolarHBondContact O-N 3.19Å; G46-F49 WeakPolarHBondContact O-CB 3.4Å; G46-F49 PolarHBondContact O-N 2.77Å; G46-F49 VanDerWaalsContact O-N 3.14Å; G46-L50 VanDerWaalsContact O-CG 3.28Å; G46-L50 WeakPolarHBondContact O-CG 3.47Å; G46-L50 PolarHBondContact O-N 3.39Å
47L92.4Very high90.7Very high8 Ų858.2 Ų58.24%0.04230%0.304CS..Hα-helixtrans-60.6-42.9179.4-169.960.5000112.3G43 N44 F49 L50 I51 L65 S69 I302G43-L47 WeakPolarHBondContact O-CB 3.45Å; G43-L47 PolarHBondContact O-N 2.62Å; N44-L47 PolarHBondContact O-N 3.34Å; L47-F49 PolarHBondContact O-N 3.01Å; L47-L50 PolarHBondContact O-N 2.88Å; L47-I51 HydrophobicContact CD1-CD1 4.19Å; L47-I51 HydrophobicContact CG-CD1 3.84Å; L47-I51 WeakPolarHBondContact O-CD1 3.41Å; L47-I51 VanDerWaalsContact O-CG1 3.24Å; L47-I51 WeakPolarHBondContact O-CG1 3.03Å; L47-I51 PolarHBondContact O-N 2.88Å; L47-L65 HydrophobicContact CD2-CB 4.09Å; L47-S69 WeakPolarHBondContact CD2-OG 3.3Å; L47-I302 HydrophobicContact CD1-CD1 3.72Å; L47-I302 HydrophobicContact CD1-CG1 4.31Å; L47-I302 HydrophobicContact CD1-CG2 4.23Å
48L94.2Very high90.3Very high49 Ų4959 Ų5926%0.25731%0.309SS..Hα-helixtrans-60.6-43.6174.1-73.2173.2000112.2N44 C45 G46 I51 R52 A66 L73N44-L48 WeakPolarHBondContact O-CG 3.48Å; N44-L48 PolarHBondContact O-N 3.41Å; C45-L48 PolarHBondContact O-N 2.73Å; G46-L48 VanDerWaalsContact C-N 3.35Å; G46-L48 PolarHBondContact O-N 3.19Å; L48-I51 PolarHBondContact O-N 3.46Å; L48-R52 WeakPolarHBondContact O-CB 3.41Å; L48-R52 PolarHBondContact O-N 3.36Å; L48-A66 HydrophobicContact CD2-CB 3.77Å; L48-A66 WeakPolarHBondContact CD2-O 3.16Å; L48-L73 HydrophobicContact CD1-CD1 3.62Å
49F91.3Very high89.9Confident119 Ų11960.8 Ų60.852%0.52231%0.312SS..Hα-helixtrans-61-46.1176.5175.4-96.4000111.6C45 G46 L47 R52 Y53C45-F49 WeakPolarHBondContact O-CB 3.27Å; C45-F49 PolarHBondContact O-N 3.31Å; G46-F49 WeakPolarHBondContact O-CB 3.4Å; G46-F49 PolarHBondContact O-N 2.77Å; G46-F49 VanDerWaalsContact O-N 3.14Å; L47-F49 PolarHBondContact O-N 3.01Å; F49-R52 PolarHBondContact O-N 3.26Å; F49-Y53 WeakPolarHBondContact O-CB 3.14Å; F49-Y53 PolarHBondContact O-N 3.14Å
50L88.9Confident89.4Confident14 Ų1458.5 Ų58.57%0.07330%0.298CS..Hα-helixtrans-60.3-48.6177.8-65.5-179.7000111.8G46 L47 R52 Y53 E54 L57 I302 V306 I309G46-L50 VanDerWaalsContact O-CG 3.28Å; G46-L50 WeakPolarHBondContact O-CG 3.47Å; G46-L50 PolarHBondContact O-N 3.39Å; L47-L50 PolarHBondContact O-N 2.88Å; L50-R52 VanDerWaalsContact C-N 3.25Å; L50-R52 PolarHBondContact O-N 3.39Å; L50-Y53 PolarHBondContact O-N 3.2Å; L50-E54 WeakPolarHBondContact O-CB 3.44Å; L50-E54 PolarHBondContact O-N 2.97Å; L50-L57 HydrophobicContact CB-CD1 4.21Å; L50-I302 HydrophobicContact CD1-CG2 4.09Å; L50-V306 HydrophobicContact CD1-CG2 3.54Å; L50-I309 HydrophobicContact CD2-CD1 3.21Å
51I89.8Confident89.2Confident8 Ų859.2 Ų59.24%0.04130%0.301CS..Hα-helixtrans-63.5-36.1-179.4-65.9163000110.6L47 L48 L57 H58 Y62 L65 A66L47-I51 HydrophobicContact CD1-CD1 4.19Å; L47-I51 HydrophobicContact CG-CD1 3.84Å; L47-I51 WeakPolarHBondContact O-CD1 3.41Å; L47-I51 VanDerWaalsContact O-CG1 3.24Å; L47-I51 WeakPolarHBondContact O-CG1 3.03Å; L47-I51 PolarHBondContact O-N 2.88Å; L48-I51 PolarHBondContact O-N 3.46Å; I51-L57 HydrophobicContact CG1-CD1 4.48Å; I51-H58 PolarHBondContact O-CD2 3.34Å; I51-H58 PolarHBondContact O-NE2 3.16Å; I51-H58 VanDerWaalsContact O-NE2 3.14Å; I51-Y62 WeakPolarHBondContact CD1-O 3.34Å; I51-L65 HydrophobicContact CD1-CB 4.09Å; I51-A66 HydrophobicContact CD1-CB 4.02Å; I51-A66 HydrophobicContact CG2-CB 4.39Å
52R89.3Confident89Confident203 Ų20357.2 Ų57.277%0.76629%0.291SS*.Hα-helixtrans-68.9-38.4177.1174.361.974.377.33.5112.9L48 F49 L50L48-R52 WeakPolarHBondContact O-CB 3.41Å; L48-R52 PolarHBondContact O-N 3.36Å; F49-R52 PolarHBondContact O-N 3.26Å; L50-R52 VanDerWaalsContact C-N 3.25Å; L50-R52 PolarHBondContact O-N 3.39Å
53Y85.4Confident88.9Confident158 Ų15854.9 Ų54.962%0.6228%0.275SS*.Hα-helixtrans-87.8-31.1-171.1-171.7-98.2000113F49 L50F49-Y53 WeakPolarHBondContact O-CB 3.14Å; F49-Y53 PolarHBondContact O-N 3.14Å; L50-Y53 PolarHBondContact O-N 3.2Å
54E86.2Confident89Confident30 Ų3054 Ų5414%0.1427%0.265CS..  trans-101.6105.8-173.7-67.8-71.9-179.500112.9L50 A56 L57 C305 R308L50-E54 WeakPolarHBondContact O-CB 3.44Å; L50-E54 PolarHBondContact O-N 2.97Å; E54-A56 PolarHBondContact O-N 3.46Å; E54-L57 HydrophobicContact CB-CB 4.36Å; E54-L57 HydrophobicContact CB-CD1 3.95Å; E54-L57 HydrophobicContact CB-CG 3.97Å; E54-L57 HydrophobicContact CG-CD1 4.49Å; E54-L57 WeakPolarHBondContact O-CB 3.35Å; E54-L57 PolarHBondContact O-N 3.22Å; E54-C305 WeakPolarHBondContact CG-SG 3.22Å; E54-C305 PolarHBondContact OE1-SG 2.99Å; E54-R308 IonicContact OE1-CZ 3.52Å; E54-R308 IonicContact OE1-NE 3.61Å; E54-R308 IonicContact OE1-NH2 2.69Å; E54-R308 PolarHBondContact OE1-NH2 3.15Å; E54-R308 IonicContact OE2-NH2 2.79Å; E54-R308 PolarHBondContact OE2-NH2 3.07Å
55D83Confident88.9Confident101 Ų10154 Ų5454%0.5427%0.265SS..G310 helixtrans-56.4-29.8176.9-63.5-47.1000113.3L57 H58 K317D55-L57 PolarHBondContact O-N 2.83Å; D55-H58 WeakPolarHBondContact O-CB 3.38Å; D55-H58 PolarHBondContact O-N 3.5Å; D55-H58 IonicContact OD1-CE1 3.33Å; D55-H58 PolarHBondContact OD1-CE1 3.47Å; D55-H58 IonicContact OD1-ND1 2.88Å; D55-H58 PolarHBondContact OD1-ND1 2.9Å; D55-K317 IonicContact OD2-NZ 3.8Å
56A81.3Confident88.9Confident69 Ų6952 Ų5257%0.5725%0.253SS*.G310 helixtrans-63.3-21.7177.100000113.4E54E54-A56 PolarHBondContact O-N 3.46Å
57L81.8Confident89.1Confident4 Ų452.5 Ų52.52%0.02125%0.248CC..G310 helixtrans-91.80.5176.1-61.1179.1000112.6L50 I51 E54 D55 K59 Y62 Q301L50-L57 HydrophobicContact CB-CD1 4.21Å; I51-L57 HydrophobicContact CG1-CD1 4.48Å; E54-L57 HydrophobicContact CB-CB 4.36Å; E54-L57 HydrophobicContact CB-CD1 3.95Å; E54-L57 HydrophobicContact CB-CG 3.97Å; E54-L57 HydrophobicContact CG-CD1 4.49Å; E54-L57 WeakPolarHBondContact O-CB 3.35Å; E54-L57 PolarHBondContact O-N 3.22Å; D55-L57 PolarHBondContact O-N 2.83Å; L57-K59 PolarHBondContact O-N 2.99Å; L57-Y62 HydrophobicContact CB-CD2 4.11Å; L57-Y62 HydrophobicContact CB-CE2 4.49Å; L57-Y62 HydrophobicContact CB-CG 4.12Å; L57-Y62 HydrophobicContact CD2-CD1 4.07Å; L57-Y62 HydrophobicContact CD2-CD2 4.16Å; L57-Y62 HydrophobicContact CD2-CE1 3.68Å; L57-Y62 HydrophobicContact CD2-CE2 3.75Å; L57-Y62 HydrophobicContact CD2-CG 4.31Å; L57-Y62 WeakPolarHBondContact O-CB 3.31Å; L57-Y62 WeakPolarHBondContact O-CD2 3.43Å; L57-Y62 VanDerWaalsContact O-CG 3.24Å; L57-Q301 HydrophobicContact CD2-CB 3.8Å
58H84.3Confident89.3Confident64 Ų6452.2 Ų52.230%0.29625%0.246SC..  trans-76.458.2175.4-68.1150.2000112.7I51 D55I51-H58 PolarHBondContact O-CD2 3.34Å; I51-H58 PolarHBondContact O-NE2 3.16Å; I51-H58 VanDerWaalsContact O-NE2 3.14Å; D55-H58 WeakPolarHBondContact O-CB 3.38Å; D55-H58 PolarHBondContact O-N 3.5Å; D55-H58 IonicContact OD1-CE1 3.33Å; D55-H58 PolarHBondContact OD1-CE1 3.47Å; D55-H58 IonicContact OD1-ND1 2.88Å; D55-H58 PolarHBondContact OD1-ND1 2.9Å
59K84.9Confident89.4Confident105 Ų10550 Ų5046%0.45724%0.235SC..SBendtrans-117.6158.4175.8-55.8-176-179.3-179.70110.5L57 M61 Y62 Y63L57-K59 PolarHBondContact O-N 2.99Å; K59-M61 PolarHBondContact O-N 2.98Å; K59-Y62 HydrophobicContact CB-CD2 3.87Å; K59-Y62 HydrophobicContact CB-CE2 4.25Å; K59-Y62 HydrophobicContact CD-CE2 4.42Å; K59-Y62 HydrophobicContact CG-CD2 4.46Å; K59-Y62 PolarHBondContact O-N 3.32Å; K59-Y63 PolarHBondContact O-N 2.87Å
60P85Confident89.6Confident12 Ų1249.9 Ų49.98%0.07823%0.234CC..Hα-helixtrans-48.2-50.1-174-35.339.3000115.9Y62 Y63 F64 Y134 L138 I143P60-Y62 VanDerWaalsContact C-N 3.25Å; P60-Y62 PolarHBondContact O-N 2.83Å; P60-Y63 PolarHBondContact O-N 2.88Å; P60-Y63 VanDerWaalsContact O-N 3.14Å; P60-F64 VanDerWaalsContact O-CD2 3.28Å; P60-F64 WeakPolarHBondContact O-CD2 3.5Å; P60-F64 PolarHBondContact O-N 3.3Å; P60-Y134 WeakPolarHBondContact CB-OH 3.34Å; P60-Y134 HydrophobicContact CG-CE1 4.18Å; P60-L138 HydrophobicContact CB-CB 4.33Å; P60-L138 HydrophobicContact CB-CD2 4.18Å; P60-L138 HydrophobicContact CG-CB 4.2Å; P60-L138 VanDerWaalsContact CG-O 3.3Å; P60-L138 WeakPolarHBondContact CG-O 3.45Å; P60-I143 HydrophobicContact CB-CD1 3.23Å; P60-I143 HydrophobicContact CB-CG1 4.42Å; P60-I143 HydrophobicContact CG-CD1 3.57Å
61M89.7Confident90Very high18 Ų1849.2 Ų49.29%0.08923%0.231CC..Hα-helixtrans-53.9-39.7178.4-174.1-172.6176.500113.2K59 F64 L65 M120 R124 Y295K59-M61 PolarHBondContact O-N 2.98Å; M61-F64 WeakPolarHBondContact O-CB 3.39Å; M61-F64 PolarHBondContact O-N 2.9Å; M61-L65 WeakPolarHBondContact O-CG 3.28Å; M61-L65 PolarHBondContact O-N 2.9Å; M61-M120 HydrophobicContact CE-CE 4.48Å; M61-R124 PolarHBondContact SD-NH2 2.71Å; M61-Y295 HydrophobicContact CE-CD1 4.18Å; M61-Y295 HydrophobicContact CE-CE1 3.92Å
62Y90.3Very high90.3Very high6 Ų648.9 Ų48.92%0.02423%0.229CC..Hα-helixtrans-77.4-28.7-177.5-61.9-67.6000112.6I51 L57 K59 P60 F64 L65 A66 T299 Q301 I302I51-Y62 WeakPolarHBondContact CD1-O 3.34Å; L57-Y62 HydrophobicContact CB-CD2 4.11Å; L57-Y62 HydrophobicContact CB-CE2 4.49Å; L57-Y62 HydrophobicContact CB-CG 4.12Å; L57-Y62 HydrophobicContact CD2-CD1 4.07Å; L57-Y62 HydrophobicContact CD2-CD2 4.16Å; L57-Y62 HydrophobicContact CD2-CE1 3.68Å; L57-Y62 HydrophobicContact CD2-CE2 3.75Å; L57-Y62 HydrophobicContact CD2-CG 4.31Å; L57-Y62 WeakPolarHBondContact O-CB 3.31Å; L57-Y62 WeakPolarHBondContact O-CD2 3.43Å; L57-Y62 VanDerWaalsContact O-CG 3.24Å; K59-Y62 HydrophobicContact CB-CD2 3.87Å; K59-Y62 HydrophobicContact CB-CE2 4.25Å; K59-Y62 HydrophobicContact CD-CE2 4.42Å; K59-Y62 HydrophobicContact CG-CD2 4.46Å; K59-Y62 PolarHBondContact O-N 3.32Å; P60-Y62 VanDerWaalsContact C-N 3.25Å; P60-Y62 PolarHBondContact O-N 2.83Å; Y62-F64 VanDerWaalsContact C-N 3.3Å; Y62-L65 HydrophobicContact CD1-CD1 3.69Å; Y62-L65 HydrophobicContact CE1-CD1 4.14Å; Y62-L65 WeakPolarHBondContact O-CB 3.39Å; Y62-L65 PolarHBondContact O-N 3.17Å; Y62-A66 PolarHBondContact O-N 3.31Å; Y62-T299 HydrophobicContact CE1-CG2 4.05Å; Y62-T299 WeakPolarHBondContact OH-CG2 3.43Å; Y62-Q301 WeakPolarHBondContact OH-CB 3.36Å; Y62-Q301 PolarHBondContact OH-OE1 3.47Å; Y62-I302 HydrophobicContact CD1-CD1 4.36Å; Y62-I302 HydrophobicContact CE1-CD1 3.9Å; Y62-I302 HydrophobicContact CE1-CG1 3.86Å
63Y92.8Very high90.6Very high68 Ų6840.2 Ų40.227%0.26720%0.198SC..Hα-helixtrans-64-38.9168.7-69.1-59000111.4K59 P60 A66 M67 N140K59-Y63 PolarHBondContact O-N 2.87Å; P60-Y63 PolarHBondContact O-N 2.88Å; P60-Y63 VanDerWaalsContact O-N 3.14Å; Y63-A66 PolarHBondContact O-N 3.44Å; Y63-M67 WeakPolarHBondContact O-CG 3.37Å; Y63-M67 PolarHBondContact O-N 3.37Å; Y63-N140 WeakPolarHBondContact CE2-OD1 3.49Å
64F94.7Very high91.1Very high4 Ų434.1 Ų34.12%0.01818%0.177CC..Hα-helixtrans-64.3-40.4171.4-63.7-53.3000112.1P60 M61 Y62 A66 M67 L68 V116 L119 M120 D123 L138 I143 V146P60-F64 VanDerWaalsContact O-CD2 3.28Å; P60-F64 WeakPolarHBondContact O-CD2 3.5Å; P60-F64 PolarHBondContact O-N 3.3Å; M61-F64 WeakPolarHBondContact O-CB 3.39Å; M61-F64 PolarHBondContact O-N 2.9Å; Y62-F64 VanDerWaalsContact C-N 3.3Å; F64-A66 VanDerWaalsContact C-N 3.32Å; F64-A66 PolarHBondContact O-N 3.23Å; F64-M67 HydrophobicContact CD1-SD 4.29Å; F64-M67 PolarHBondContact O-N 3.47Å; F64-L68 WeakPolarHBondContact O-CB 3.36Å; F64-L68 PolarHBondContact O-N 2.78Å; F64-V116 HydrophobicContact CB-CG1 4.17Å; F64-V116 WeakPolarHBondContact O-CG1 3.49Å; F64-L119 HydrophobicContact CD1-CB 3.94Å; F64-L119 HydrophobicContact CD1-CD1 4.36Å; F64-L119 HydrophobicContact CE1-CB 3.58Å; F64-L119 HydrophobicContact CE1-CD1 3.87Å; F64-L119 HydrophobicContact CE1-CG 4.24Å; F64-L119 HydrophobicContact CZ-CB 3.95Å; F64-M120 HydrophobicContact CB-CG 3.49Å; F64-M120 VanDerWaalsContact CB-CG 3.49Å; F64-M120 HydrophobicContact CB-SD 4.1Å; F64-M120 HydrophobicContact CD2-CG 4.26Å; F64-M120 HydrophobicContact CG-CG 4.01Å; F64-D123 HydrophobicContact CD2-CB 4.3Å; F64-D123 HydrophobicContact CE2-CB 3.96Å; F64-L138 HydrophobicContact CE2-CD2 4.33Å; F64-I143 HydrophobicContact CD1-CG2 4.3Å; F64-I143 HydrophobicContact CE1-CG2 3.74Å; F64-I143 HydrophobicContact CE2-CG2 4.49Å; F64-I143 HydrophobicContact CZ-CB 4.44Å; F64-I143 HydrophobicContact CZ-CG1 4.1Å; F64-I143 HydrophobicContact CZ-CG2 3.86Å; F64-V146 HydrophobicContact CE1-CG2 4.35Å
65L93.9Very high91.3Very high1 Ų132.8 Ų32.81%0.00517%0.171CC..Hα-helixtrans-61.4-38.7173-71.6176.5000112.8L47 I51 M61 Y62 L68 S69 M120 Y295 I302L47-L65 HydrophobicContact CD2-CB 4.09Å; I51-L65 HydrophobicContact CD1-CB 4.09Å; M61-L65 WeakPolarHBondContact O-CG 3.28Å; M61-L65 PolarHBondContact O-N 2.9Å; Y62-L65 HydrophobicContact CD1-CD1 3.69Å; Y62-L65 HydrophobicContact CE1-CD1 4.14Å; Y62-L65 WeakPolarHBondContact O-CB 3.39Å; Y62-L65 PolarHBondContact O-N 3.17Å; L65-L68 PolarHBondContact O-N 3.39Å; L65-S69 WeakPolarHBondContact O-CB 3.25Å; L65-S69 PolarHBondContact O-N 3.49Å; L65-S69 PolarHBondContact O-OG 3.43Å; L65-M120 HydrophobicContact CD2-CE 3.77Å; L65-M120 HydrophobicContact CD2-SD 4.47Å; L65-M120 HydrophobicContact CG-CE 4.3Å; L65-Y295 HydrophobicContact CD1-CD1 4.15Å; L65-Y295 HydrophobicContact CD1-CG 4.23Å; L65-Y295 HydrophobicContact CD2-CD1 3.77Å; L65-Y295 HydrophobicContact CD2-CD2 3.37Å; L65-Y295 HydrophobicContact CD2-CE1 3.68Å; L65-Y295 HydrophobicContact CD2-CE2 3.29Å; L65-Y295 HydrophobicContact CD2-CG 3.65Å; L65-Y295 VanDerWaalsContact CD2-CZ 3.47Å; L65-I302 HydrophobicContact CD1-CD1 4.01Å
66A95.3Very high91.7Very high21 Ų2128 Ų2817%0.17415%0.145CC..Hα-helixtrans-64.8-41.7174.700000111.6L48 I51 Y62 Y63 F64 L68 S69 F70L48-A66 HydrophobicContact CD2-CB 3.77Å; L48-A66 WeakPolarHBondContact CD2-O 3.16Å; I51-A66 HydrophobicContact CD1-CB 4.02Å; I51-A66 HydrophobicContact CG2-CB 4.39Å; Y62-A66 PolarHBondContact O-N 3.31Å; Y63-A66 PolarHBondContact O-N 3.44Å; F64-A66 VanDerWaalsContact C-N 3.32Å; F64-A66 PolarHBondContact O-N 3.23Å; A66-L68 VanDerWaalsContact C-N 3.35Å; A66-S69 PolarHBondContact O-N 2.92Å; A66-F70 WeakPolarHBondContact O-CB 3.37Å; A66-F70 PolarHBondContact O-N 3.29Å
67M96.4Very high92.3Very high41 Ų4127.1 Ų27.120%0.20214%0.135CC..Hα-helixtrans-62.7-41.7174.2-68.5175.9-173.100111.8Y63 F64 T71 M112 V116 I143Y63-M67 WeakPolarHBondContact O-CG 3.37Å; Y63-M67 PolarHBondContact O-N 3.37Å; F64-M67 HydrophobicContact CD1-SD 4.29Å; F64-M67 PolarHBondContact O-N 3.47Å; M67-T71 WeakPolarHBondContact O-CB 3.49Å; M67-T71 PolarHBondContact O-N 2.82Å; M67-T71 PolarHBondContact O-OG1 3.24Å; M67-M112 HydrophobicContact CB-CE 3.99Å; M67-M112 HydrophobicContact CG-CE 4.28Å; M67-M112 HydrophobicContact SD-CE 4.19Å; M67-V116 HydrophobicContact CB-CG2 3.92Å; M67-I143 HydrophobicContact CE-CG2 4.27Å
68L96.3Very high92.7Very high2 Ų228.2 Ų28.21%0.0114%0.143CC..Hα-helixtrans-63.2-50.1176.1-170.360.9000110.7F64 L65 A66 F70 T71 D72 E113 V116 L117 M120 Y295F64-L68 WeakPolarHBondContact O-CB 3.36Å; F64-L68 PolarHBondContact O-N 2.78Å; L65-L68 PolarHBondContact O-N 3.39Å; A66-L68 VanDerWaalsContact C-N 3.35Å; L68-F70 PolarHBondContact O-N 2.83Å; L68-T71 WeakPolarHBondContact O-CA 3.38Å; L68-T71 VanDerWaalsContact O-CB 3.29Å; L68-T71 WeakPolarHBondContact O-CB 3.5Å; L68-T71 PolarHBondContact O-N 3.35Å; L68-D72 WeakPolarHBondContact O-CB 3.31Å; L68-D72 PolarHBondContact O-N 2.97Å; L68-E113 HydrophobicContact CD1-CG 3.84Å; L68-V116 HydrophobicContact CB-CG1 3.93Å; L68-V116 HydrophobicContact CD1-CG1 4.36Å; L68-L117 HydrophobicContact CD2-CD2 4.44Å; L68-M120 HydrophobicContact CD2-SD 4.33Å; L68-Y295 HydrophobicContact CD2-CE2 4.2Å
69S96.7Very high92.9Very high3 Ų325.2 Ų25.22%0.02113%0.129CC..Hα-helixtrans-61.7-39.7177.9-74.70000113.4N44 L47 L65 A66 T71 D72 L73N44-S69 WeakPolarHBondContact OD1-CA 3.37Å; N44-S69 WeakPolarHBondContact OD1-CB 3.49Å; N44-S69 PolarHBondContact OD1-OG 2.99Å; L47-S69 WeakPolarHBondContact CD2-OG 3.3Å; L65-S69 WeakPolarHBondContact O-CB 3.25Å; L65-S69 PolarHBondContact O-N 3.49Å; L65-S69 PolarHBondContact O-OG 3.43Å; A66-S69 PolarHBondContact O-N 2.92Å; S69-T71 VanDerWaalsContact C-N 3.31Å; S69-D72 PolarHBondContact O-N 3.21Å; S69-L73 VanDerWaalsContact O-CG 3.23Å; S69-L73 WeakPolarHBondContact O-CG 3.37Å; S69-L73 PolarHBondContact O-N 3.21Å
70F96.8Very high93.2Very high115 Ų11520.2 Ų20.250%0.50411%0.107SC..Hα-helixtrans-62.8-42173.5177.5-102000111.5A66 L68 L73 V74 F109A66-F70 WeakPolarHBondContact O-CB 3.37Å; A66-F70 PolarHBondContact O-N 3.29Å; L68-F70 PolarHBondContact O-N 2.83Å; F70-L73 PolarHBondContact O-N 2.91Å; F70-V74 HydrophobicContact CE1-CG2 4.08Å; F70-V74 HydrophobicContact CE2-CG2 4.18Å; F70-V74 HydrophobicContact CZ-CG2 3.89Å; F70-V74 WeakPolarHBondContact O-CG2 3.45Å; F70-V74 PolarHBondContact O-N 3.39Å; F70-V74 VanDerWaalsContact O-N 3.14Å; F70-F109 HydrophobicContact CD1-CE1 4.19Å; F70-F109 AromaticContact CE1-CE1 3.83Å; F70-F109 HydrophobicContact CE1-CE1 3.83Å; F70-F109 HydrophobicContact CE1-CZ 4.19Å
71T96.5Very high93.4Very high1 Ų122 Ų221%0.00612%0.119CC..Hα-helixtrans-61.4-47.2177.3-63.20000111.5M67 L68 S69 L73 V74 M75 F109 M112 E113M67-T71 WeakPolarHBondContact O-CB 3.49Å; M67-T71 PolarHBondContact O-N 2.82Å; M67-T71 PolarHBondContact O-OG1 3.24Å; L68-T71 WeakPolarHBondContact O-CA 3.38Å; L68-T71 VanDerWaalsContact O-CB 3.29Å; L68-T71 WeakPolarHBondContact O-CB 3.5Å; L68-T71 PolarHBondContact O-N 3.35Å; S69-T71 VanDerWaalsContact C-N 3.31Å; T71-L73 VanDerWaalsContact C-N 3.35Å; T71-L73 PolarHBondContact O-N 3.46Å; T71-V74 PolarHBondContact O-N 3.41Å; T71-M75 HydrophobicContact CG2-CE 4.49Å; T71-M75 WeakPolarHBondContact O-CB 3.36Å; T71-M75 PolarHBondContact O-N 2.85Å; T71-F109 HydrophobicContact CG2-CB 4.07Å; T71-F109 HydrophobicContact CG2-CD1 3.96Å; T71-F109 WeakPolarHBondContact CG2-O 3.3Å; T71-M112 HydrophobicContact CG2-CB 4.17Å; T71-M112 HydrophobicContact CG2-CG 4.29Å; T71-M112 VanDerWaalsContact OG1-CG 3.24Å; T71-M112 WeakPolarHBondContact OG1-CG 3.36Å; T71-E113 HydrophobicContact CG2-CB 3.8Å
72D95.3Very high93.4Very high1 Ų123.1 Ų23.11%0.00512%0.123CC..Hα-helixtrans-59-43.9178.2-72.2-3.6000111.3L68 S69 M75 C76 P288 N291L68-D72 WeakPolarHBondContact O-CB 3.31Å; L68-D72 PolarHBondContact O-N 2.97Å; S69-D72 PolarHBondContact O-N 3.21Å; D72-M75 PolarHBondContact O-N 3.34Å; D72-C76 WeakPolarHBondContact O-CB 3.28Å; D72-C76 PolarHBondContact O-N 2.95Å; D72-C76 PolarHBondContact O-SG 3.45Å; D72-P288 HydrophobicContact CB-CB 3.77Å; D72-P288 HydrophobicContact CB-CG 3.89Å; D72-P288 WeakPolarHBondContact OD2-CA 3.45Å; D72-N291 PolarHBondContact OD2-ND2 3.14Å
73L96Very high93.3Very high21 Ų2122.8 Ų22.811%0.1112%0.122CC..Hα-helixtrans-63.1-44.9177.5-71.1172.2000112.6M41 N44 L48 S69 F70 T71 S77M41-L73 HydrophobicContact CE-CD2 3.77Å; M41-L73 HydrophobicContact SD-CD2 3.47Å; M41-L73 WeakPolarHBondContact SD-CD2 3.3Å; N44-L73 HydrophobicContact CB-CD1 4.3Å; N44-L73 HydrophobicContact CB-CD2 3.88Å; N44-L73 HydrophobicContact CB-CG 3.81Å; L48-L73 HydrophobicContact CD1-CD1 3.62Å; S69-L73 VanDerWaalsContact O-CG 3.23Å; S69-L73 WeakPolarHBondContact O-CG 3.37Å; S69-L73 PolarHBondContact O-N 3.21Å; F70-L73 PolarHBondContact O-N 2.91Å; T71-L73 VanDerWaalsContact C-N 3.35Å; T71-L73 PolarHBondContact O-N 3.46Å; L73-S77 WeakPolarHBondContact O-CB 3.47Å; L73-S77 PolarHBondContact O-N 3.46Å; L73-S77 PolarHBondContact O-OG 3.16Å
74V95.4Very high93.1Very high30 Ų3020.3 Ų20.318%0.18211%0.113CC..Hα-helixtrans-66.9-44.9179.1176.60000110.5F70 T71 S77 S78 F105 F109F70-V74 HydrophobicContact CE1-CG2 4.08Å; F70-V74 HydrophobicContact CE2-CG2 4.18Å; F70-V74 HydrophobicContact CZ-CG2 3.89Å; F70-V74 WeakPolarHBondContact O-CG2 3.45Å; F70-V74 PolarHBondContact O-N 3.39Å; F70-V74 VanDerWaalsContact O-N 3.14Å; T71-V74 PolarHBondContact O-N 3.41Å; V74-S77 PolarHBondContact O-N 3.45Å; V74-S78 WeakPolarHBondContact O-CB 3.22Å; V74-S78 PolarHBondContact O-N 2.95Å; V74-S78 PolarHBondContact O-OG 2.9Å; V74-F105 HydrophobicContact CG1-CD1 3.84Å; V74-F105 HydrophobicContact CG1-CE1 4.37Å; V74-F109 HydrophobicContact CB-CD1 4.01Å; V74-F109 HydrophobicContact CB-CD2 4.41Å; V74-F109 HydrophobicContact CB-CE1 3.9Å; V74-F109 HydrophobicContact CB-CE2 4.35Å; V74-F109 HydrophobicContact CB-CG 4.24Å; V74-F109 HydrophobicContact CB-CZ 4.08Å; V74-F109 HydrophobicContact CG1-CD1 4.14Å; V74-F109 HydrophobicContact CG1-CD2 3.65Å; V74-F109 HydrophobicContact CG1-CE1 4Å; V74-F109 HydrophobicContact CG1-CE2 3.54Å; V74-F109 HydrophobicContact CG1-CG 3.96Å; V74-F109 HydrophobicContact CG1-CZ 3.69Å; V74-F109 HydrophobicContact CG2-CE1 3.98Å; V74-F109 HydrophobicContact CG2-CZ 4.08Å
75M91.7Very high92.8Very high1 Ų122.1 Ų22.11%0.00513%0.126CC..Hα-helixtrans-61-51.5179.5-170-167.6-6000111.5T71 D72 S77 S78 T79 E113 L284T71-M75 HydrophobicContact CG2-CE 4.49Å; T71-M75 WeakPolarHBondContact O-CB 3.36Å; T71-M75 PolarHBondContact O-N 2.85Å; D72-M75 PolarHBondContact O-N 3.34Å; M75-S77 PolarHBondContact O-N 2.85Å; M75-S78 PolarHBondContact O-N 2.86Å; M75-S78 PolarHBondContact O-OG 3.37Å; M75-T79 PolarHBondContact O-N 3.42Å; M75-T79 PolarHBondContact O-OG1 3.06Å; M75-E113 HydrophobicContact CE-CB 4.23Å; M75-L284 HydrophobicContact CG-CD2 4.24Å; M75-L284 HydrophobicContact SD-CB 4.38Å; M75-L284 HydrophobicContact SD-CD2 3.69Å
76C91.6Very high92.5Very high1 Ų122.1 Ų22.11%0.00713%0.126CC..Hα-helixtrans-60.8-44177.2-76.50000112.1Y37 D72 S78 T79 I80 P81 P288Y37-C76 HydrophobicContact CD2-CB 3.94Å; Y37-C76 HydrophobicContact CE2-CB 3.95Å; D72-C76 WeakPolarHBondContact O-CB 3.28Å; D72-C76 PolarHBondContact O-N 2.95Å; D72-C76 PolarHBondContact O-SG 3.45Å; C76-S78 VanDerWaalsContact C-N 3.29Å; C76-S78 PolarHBondContact O-N 3.39Å; C76-T79 PolarHBondContact O-N 3.44Å; C76-I80 WeakPolarHBondContact O-CB 3.14Å; C76-I80 WeakPolarHBondContact O-CG1 3.48Å; C76-I80 PolarHBondContact O-N 2.87Å; C76-P81 WeakPolarHBondContact O-CD 3.41Å; C76-P288 WeakPolarHBondContact SG-CB 3.39Å; C76-P288 VanDerWaalsContact SG-CG 3.59Å
77S92.4Very high92.1Very high51 Ų5121.3 Ų21.336%0.35712%0.119SC..Hα-helixtrans-68.9-27.4-178.3-58.60000113.1L73 V74 M75 P81L73-S77 WeakPolarHBondContact O-CB 3.47Å; L73-S77 PolarHBondContact O-N 3.46Å; L73-S77 PolarHBondContact O-OG 3.16Å; V74-S77 PolarHBondContact O-N 3.45Å; M75-S77 PolarHBondContact O-N 2.85Å; S77-P81 VanDerWaalsContact O-CD 3.28Å; S77-P81 WeakPolarHBondContact O-CD 3.03Å; S77-P81 WeakPolarHBondContact O-CG 3.27Å
78S91.1Very high91.6Very high26 Ų2624.3 Ų24.318%0.18213%0.128CC..Hα-helixtrans-75-25.7177.570.90000113.6V74 M75 C76 Q102V74-S78 WeakPolarHBondContact O-CB 3.22Å; V74-S78 PolarHBondContact O-N 2.95Å; V74-S78 PolarHBondContact O-OG 2.9Å; M75-S78 PolarHBondContact O-N 2.86Å; M75-S78 PolarHBondContact O-OG 3.37Å; C76-S78 VanDerWaalsContact C-N 3.29Å; C76-S78 PolarHBondContact O-N 3.39Å; S78-Q102 WeakPolarHBondContact O-CG 3.44Å; S78-Q102 PolarHBondContact O-NE2 3.16Å
79T88.9Confident91.2Very high1 Ų130.5 Ų30.51%0.00616%0.155CC..Hα-helixtrans-113.4-47.7-169.553.50000113.4M75 C76 K82 A83 I106 L284M75-T79 PolarHBondContact O-N 3.42Å; M75-T79 PolarHBondContact O-OG1 3.06Å; C76-T79 PolarHBondContact O-N 3.44Å; T79-K82 PolarHBondContact O-N 3.33Å; T79-A83 PolarHBondContact O-N 3.25Å; T79-I106 HydrophobicContact CG2-CD1 3.52Å; T79-I106 HydrophobicContact CG2-CG1 3.45Å; T79-I106 VanDerWaalsContact CG2-CG1 3.45Å; T79-L284 HydrophobicContact CG2-CD1 4.1Å
80I89.8Confident90.6Very high0 Ų036.7 Ų36.70%018%0.183CC..Hα-helixtrans-74.3-40.9-166.6-53.2-51000113.7Y37 C76 K82 A83 L84 L285Y37-I80 HydrophobicContact CD2-CB 3.86Å; Y37-I80 HydrophobicContact CD2-CG1 4.28Å; Y37-I80 HydrophobicContact CD2-CG2 4Å; Y37-I80 HydrophobicContact CE2-CB 4.4Å; Y37-I80 HydrophobicContact CG-CB 4.33Å; Y37-I80 HydrophobicContact CG-CG2 3.96Å; C76-I80 WeakPolarHBondContact O-CB 3.14Å; C76-I80 WeakPolarHBondContact O-CG1 3.48Å; C76-I80 PolarHBondContact O-N 2.87Å; I80-K82 PolarHBondContact O-N 2.94Å; I80-A83 WeakPolarHBondContact O-CB 3.2Å; I80-A83 PolarHBondContact O-N 2.88Å; I80-A83 VanDerWaalsContact O-N 3.11Å; I80-L84 HydrophobicContact CG2-CD1 4.03Å; I80-L84 HydrophobicContact CG2-CG 4.08Å; I80-L84 WeakPolarHBondContact O-CG 3.43Å; I80-L84 PolarHBondContact O-N 2.84Å; I80-L285 HydrophobicContact CD1-CD1 3.45Å; I80-L285 VanDerWaalsContact CD1-CD1 3.45Å; I80-L285 HydrophobicContact CD1-CD2 4.02Å; I80-L285 HydrophobicContact CD1-CG 3.62Å; I80-L285 HydrophobicContact CG1-CD1 4.28Å; I80-L285 HydrophobicContact CG1-CD2 3.91Å; I80-L285 HydrophobicContact CG1-CG 4.03Å
81P90.1Very high90.1Very high50 Ų5036 Ų3633%0.32518%0.184SC..Hα-helixtrans-55.4-41.6174.9-28.537.4000112.4C76 S77 L84 C85C76-P81 WeakPolarHBondContact O-CD 3.41Å; S77-P81 VanDerWaalsContact O-CD 3.28Å; S77-P81 WeakPolarHBondContact O-CD 3.03Å; S77-P81 WeakPolarHBondContact O-CG 3.27Å; P81-L84 PolarHBondContact O-N 2.8Å; P81-C85 PolarHBondContact O-N 3.25Å; P81-C85 PolarHBondContact O-SG 2.73Å
82K90Very high89.8Confident41 Ų4138.2 Ų38.218%0.17819%0.194CC..Hα-helixtrans-66.3-43.2177.3-175.256.8176.1171.90111.8L16 T79 I80 L84 C85 I86 L91 D93L16-K82 HydrophobicContact CD1-CG 3.97Å; T79-K82 PolarHBondContact O-N 3.33Å; I80-K82 PolarHBondContact O-N 2.94Å; K82-L84 VanDerWaalsContact C-N 3.35Å; K82-L84 PolarHBondContact O-N 3.41Å; K82-C85 PolarHBondContact O-N 2.84Å; K82-I86 HydrophobicContact CG-CD1 4.32Å; K82-I86 WeakPolarHBondContact O-CG1 3.38Å; K82-I86 PolarHBondContact O-N 3.38Å; K82-L91 PolarHBondContact NZ-O 3.35Å; K82-D93 PolarHBondContact NZ-O 2.85Å
83A87.9Confident89.6Confident0 Ų043 Ų430%022%0.219CC..Hα-helixtrans-59.4-43.6175.500000112.2T79 I80 I86 F87 T179T79-A83 PolarHBondContact O-N 3.25Å; I80-A83 WeakPolarHBondContact O-CB 3.2Å; I80-A83 PolarHBondContact O-N 2.88Å; I80-A83 VanDerWaalsContact O-N 3.11Å; A83-I86 WeakPolarHBondContact O-CB 3.37Å; A83-I86 PolarHBondContact O-N 3Å; A83-F87 HydrophobicContact CB-CE2 4.39Å; A83-F87 WeakPolarHBondContact O-CD2 3.23Å; A83-F87 VanDerWaalsContact O-CG 3.23Å; A83-F87 WeakPolarHBondContact O-CG 3.19Å; A83-F87 PolarHBondContact O-N 3.05Å; A83-T179 HydrophobicContact CB-CG2 4.36Å
84L88.1Confident89.4Confident15 Ų1542.4 Ų42.48%0.07922%0.216CC..Hα-helixtrans-65.5-40176.5-66.9176.5000112F33 C34 I80 P81 K82 I86 F87 W88F33-L84 HydrophobicContact CB-CD2 4.38Å; C34-L84 HydrophobicContact CB-CD1 4.3Å; C34-L84 HydrophobicContact CB-CD2 4.05Å; I80-L84 HydrophobicContact CG2-CD1 4.03Å; I80-L84 HydrophobicContact CG2-CG 4.08Å; I80-L84 WeakPolarHBondContact O-CG 3.43Å; I80-L84 PolarHBondContact O-N 2.84Å; P81-L84 PolarHBondContact O-N 2.8Å; K82-L84 VanDerWaalsContact C-N 3.35Å; K82-L84 PolarHBondContact O-N 3.41Å; L84-I86 VanDerWaalsContact C-N 3.27Å; L84-I86 PolarHBondContact O-N 3.22Å; L84-F87 PolarHBondContact O-N 3.29Å; L84-F87 VanDerWaalsContact O-N 3.16Å; L84-W88 HydrophobicContact CD2-CZ2 4.2Å; L84-W88 WeakPolarHBondContact O-CB 3.45Å; L84-W88 PolarHBondContact O-N 2.94Å
85C88.5Confident89.3Confident43 Ų4341.9 Ų41.929%0.29122%0.217SC..Hα-helixtrans-61-36.2174.1-72.80000112.8P81 K82 F89 H90 L91P81-C85 PolarHBondContact O-N 3.25Å; P81-C85 PolarHBondContact O-SG 2.73Å; K82-C85 PolarHBondContact O-N 2.84Å; C85-F89 CarbonylContact O-C 3.18Å; C85-F89 PolarHBondContact O-N 3.4Å; C85-F89 VanDerWaalsContact O-N 3.08Å; C85-H90 PolarHBondContact O-N 2.95Å; C85-L91 HydrophobicContact CB-CB 4.37Å; C85-L91 PolarHBondContact O-N 3.5Å
86I87.4Confident89.3Confident0 Ų042.4 Ų42.40%022%0.219CC..Hα-helixtrans-64.5-46.3173.7-66.9162.7000110.2L16 K82 A83 L84 H90 K92L16-I86 HydrophobicContact CB-CD1 3.54Å; L16-I86 HydrophobicContact CD1-CD1 4.06Å; L16-I86 HydrophobicContact CG-CD1 4.46Å; K82-I86 HydrophobicContact CG-CD1 4.32Å; K82-I86 WeakPolarHBondContact O-CG1 3.38Å; K82-I86 PolarHBondContact O-N 3.38Å; A83-I86 WeakPolarHBondContact O-CB 3.37Å; A83-I86 PolarHBondContact O-N 3Å; L84-I86 VanDerWaalsContact C-N 3.27Å; L84-I86 PolarHBondContact O-N 3.22Å; I86-H90 VanDerWaalsContact O-CA 3.28Å; I86-H90 WeakPolarHBondContact O-CA 3.32Å; I86-H90 PolarHBondContact O-N 3Å; I86-K92 HydrophobicContact CG2-CG 4.19Å
87F86.4Confident89.4Confident5 Ų546.7 Ų46.72%0.02224%0.242CC..Hα-helixtrans-74.1-34.5-175-59.1-25.3000114.2V19 Q26 I29 F33 A83 L84 T179V19-F87 HydrophobicContact CG2-CE1 4.37Å; V19-F87 HydrophobicContact CG2-CZ 4.2Å; Q26-F87 HydrophobicContact CB-CB 4.47Å; Q26-F87 HydrophobicContact CB-CD1 3.75Å; Q26-F87 HydrophobicContact CB-CE1 4.31Å; Q26-F87 HydrophobicContact CB-CG 4.28Å; Q26-F87 HydrophobicContact CG-CD1 3.88Å; Q26-F87 HydrophobicContact CG-CE1 3.98Å; I29-F87 HydrophobicContact CG2-CE2 4.43Å; F33-F87 HydrophobicContact CD1-CE2 4.31Å; A83-F87 HydrophobicContact CB-CE2 4.39Å; A83-F87 WeakPolarHBondContact O-CD2 3.23Å; A83-F87 VanDerWaalsContact O-CG 3.23Å; A83-F87 WeakPolarHBondContact O-CG 3.19Å; A83-F87 PolarHBondContact O-N 3.05Å; L84-F87 PolarHBondContact O-N 3.29Å; L84-F87 VanDerWaalsContact O-N 3.16Å; F87-T179 HydrophobicContact CE1-CG2 4Å; F87-T179 HydrophobicContact CZ-CG2 3.63Å
88W87.7Confident89.4Confident104 Ų10450 Ų5039%0.39425%0.252SS..Hα-helixtrans-95.1-35.7-175.3-66.2-9.8000113.9S30 C34 L84S30-W88 PolarHBondContact OG-NE1 3.43Å; C34-W88 HydrophobicContact CB-CH2 4.45Å; C34-W88 HydrophobicContact CB-CZ2 4.11Å; L84-W88 HydrophobicContact CD2-CZ2 4.2Å; L84-W88 WeakPolarHBondContact O-CB 3.45Å; L84-W88 PolarHBondContact O-N 2.94Å
89F86.6Confident89.6Confident132 Ų13248.8 Ų48.858%0.57924%0.243SC*.Hα-helixtrans-120.61.4-170.9-53.9-64.3000113.1C85 L91C85-F89 CarbonylContact O-C 3.18Å; C85-F89 PolarHBondContact O-N 3.4Å; C85-F89 VanDerWaalsContact O-N 3.08Å; F89-L91 HydrophobicContact CB-CD1 3.9Å; F89-L91 HydrophobicContact CB-CG 3.78Å; F89-L91 PolarHBondContact O-N 3.47Å; F89-L91 VanDerWaalsContact O-N 3.11Å
90H84.2Confident89.9Confident133 Ų13349.3 Ų49.362%0.61625%0.246SC*.  trans54.526.4-174.8-55.4-63.4000113.8C85 I86 K92C85-H90 PolarHBondContact O-N 2.95Å; I86-H90 VanDerWaalsContact O-CA 3.28Å; I86-H90 WeakPolarHBondContact O-CA 3.32Å; I86-H90 PolarHBondContact O-N 3Å; H90-K92 VanDerWaalsContact C-N 3.31Å; H90-K92 PolarHBondContact O-N 3.09Å
91L87.1Confident90.1Very high100 Ų10053 Ų5352%0.52427%0.268SS..  trans-80.976.8179-66.8175.8000110.7K82 C85 F89K82-L91 PolarHBondContact NZ-O 3.35Å; C85-L91 HydrophobicContact CB-CB 4.37Å; C85-L91 PolarHBondContact O-N 3.5Å; F89-L91 HydrophobicContact CB-CD1 3.9Å; F89-L91 HydrophobicContact CB-CG 3.78Å; F89-L91 PolarHBondContact O-N 3.47Å; F89-L91 VanDerWaalsContact O-N 3.11Å
92K89.3Confident90.4Very high47 Ų4751.3 Ų51.320%0.20426%0.256CS..  trans-80.4-23.1-173.2-62.7-175.3-178-1750114.4I15 L16 I86 H90I15-K92 HydrophobicContact CG2-CB 3.71Å; I15-K92 HydrophobicContact CG2-CD 4.25Å; L16-K92 PolarHBondContact N-O 3.27Å; L16-K92 WeakPolarHBondContact O-CB 3.22Å; L16-K92 VanDerWaalsContact O-CG 3.32Å; L16-K92 WeakPolarHBondContact O-CG 3.48Å; I86-K92 HydrophobicContact CG2-CG 4.19Å; H90-K92 VanDerWaalsContact C-N 3.31Å; H90-K92 PolarHBondContact O-N 3.09Å
93D91.1Very high90.6Very high101 Ų10149.4 Ų49.454%0.5425%0.248SC..EExtended strand (participates in β ladder)trans-72.3134.8-175.1-65-42.2000112.7F14 I15 K82F14-D93 CarbonylContact O-C 3.45Å; F14-D93 WeakPolarHBondContact O-CA 3.1Å; I15-D93 WeakPolarHBondContact CG1-OD1 3.32Å; K82-D93 PolarHBondContact NZ-O 2.85Å
94I92.7Very high90.9Very high9 Ų951.7 Ų51.75%0.04626%0.258CS..EExtended strand (participates in β ladder)trans-132.9135.6170.9-172.6166.4000109S13 F14 L16 E98 C99S13-I94 CarbonylContact C-O 3.59Å; S13-I94 WeakPolarHBondContact CA-O 3.42Å; S13-I94 VanDerWaalsContact CB-O 3.27Å; S13-I94 WeakPolarHBondContact CB-O 3.25Å; F14-I94 HydrophobicContact CB-CG2 3.9Å; F14-I94 PolarHBondContact N-O 3.49Å; F14-I94 PolarHBondContact O-N 2.93Å; L16-I94 HydrophobicContact CD1-CB 4.32Å; L16-I94 HydrophobicContact CD1-CD1 4.38Å; L16-I94 HydrophobicContact CD1-CG2 3.94Å; L16-I94 HydrophobicContact CG-CG2 4.02Å; I94-E98 HydrophobicContact CD1-CB 4.33Å; I94-E98 HydrophobicContact CG1-CB 3.78Å; I94-C99 HydrophobicContact CD1-CB 4.28Å; I94-C99 HydrophobicContact CG1-CB 4.33Å; I94-C99 HydrophobicContact CG2-CB 4.21Å
95G93.6Very high91.3Very high20 Ų2054.8 Ų54.821%0.20627%0.271CS..EExtended strand (participates in β ladder)trans-60.8150.3176.700000111.5D97 E98 C99G95-D97 PolarHBondContact O-N 2.94Å; G95-E98 PolarHBondContact N-OE2 3.16Å; G95-E98 WeakPolarHBondContact O-CB 3.41Å; G95-E98 PolarHBondContact O-N 3.4Å; G95-C99 WeakPolarHBondContact O-CB 3.45Å; G95-C99 PolarHBondContact O-N 3.16Å
96F91.2Very high91.5Very high11 Ų1153 Ų535%0.04826%0.259CS..Hα-helixtrans-57.6-48.8178.8177.4-97.5000112.6I10 P11 A12 F14 C99 L100 K166 Y170I10-F96 HydrophobicContact CG2-CD1 3.77Å; I10-F96 HydrophobicContact CG2-CD2 4.1Å; I10-F96 HydrophobicContact CG2-CE1 3.76Å; I10-F96 HydrophobicContact CG2-CE2 4.14Å; I10-F96 HydrophobicContact CG2-CG 3.93Å; I10-F96 HydrophobicContact CG2-CZ 3.96Å; P11-F96 HydrophobicContact CG-CD2 4Å; P11-F96 WeakPolarHBondContact O-CB 3.4Å; A12-F96 PolarHBondContact O-N 3.35Å; F14-F96 HydrophobicContact CD2-CD2 4.31Å; F14-F96 AromaticContact CE2-CD2 3.32Å; F14-F96 HydrophobicContact CE2-CD2 3.32Å; F14-F96 AromaticContact CE2-CE2 3.84Å; F14-F96 HydrophobicContact CE2-CE2 3.84Å; F14-F96 HydrophobicContact CE2-CG 4.31Å; F14-F96 AromaticContact CZ-CD2 3.61Å; F14-F96 HydrophobicContact CZ-CD2 3.61Å; F14-F96 AromaticContact CZ-CE2 3.82Å; F14-F96 HydrophobicContact CZ-CE2 3.82Å; F96-C99 WeakPolarHBondContact O-CB 3.24Å; F96-C99 PolarHBondContact O-N 3.44Å; F96-L100 HydrophobicContact CD1-CD1 4.1Å; F96-L100 HydrophobicContact CE1-CD1 3.54Å; F96-L100 HydrophobicContact CE1-CG 4.38Å; F96-L100 HydrophobicContact CZ-CD1 3.9Å; F96-L100 HydrophobicContact CZ-CG 4.48Å; F96-L100 WeakPolarHBondContact O-CG 3.28Å; F96-L100 PolarHBondContact O-N 2.93Å; F96-L100 VanDerWaalsContact O-N 3.16Å; F96-K166 HydrophobicContact CE1-CG 4.07Å; F96-K166 HydrophobicContact CZ-CG 4.45Å; F96-Y170 AromaticContact CE2-CD2 3.97Å; F96-Y170 HydrophobicContact CE2-CD2 3.97Å; F96-Y170 AromaticContact CE2-CE2 3.51Å; F96-Y170 HydrophobicContact CE2-CE2 3.51Å; F96-Y170 AromaticContact CE2-CZ 3.92Å; F96-Y170 HydrophobicContact CZ-CD2 4.43Å; F96-Y170 AromaticContact CZ-CE2 3.78Å; F96-Y170 HydrophobicContact CZ-CE2 3.78Å
97D93.3Very high91.8Very high91 Ų9155 Ų5549%0.48727%0.268SS..Hα-helixtrans-68.6-35.4177.8-73.5-47.1000112G95 C99 L100 V101 K166G95-D97 PolarHBondContact O-N 2.94Å; D97-C99 VanDerWaalsContact C-N 3.3Å; D97-C99 PolarHBondContact O-N 3.38Å; D97-L100 PolarHBondContact O-N 3.4Å; D97-V101 VanDerWaalsContact O-CG2 3.3Å; D97-V101 WeakPolarHBondContact O-CG2 3.46Å; D97-V101 PolarHBondContact O-N 3.21Å; D97-K166 IonicContact OD1-NZ 3.4Å; D97-K166 PolarHBondContact OD1-NZ 3.21Å
98E93.3Very high92.2Very high121 Ų12154.9 Ų54.957%0.56527%0.267SS*.Hα-helixtrans-60.7-40.8173.8-64.2175.817300111.6I94 G95 V101 Q102I94-E98 HydrophobicContact CD1-CB 4.33Å; I94-E98 HydrophobicContact CG1-CB 3.78Å; G95-E98 PolarHBondContact N-OE2 3.16Å; G95-E98 WeakPolarHBondContact O-CB 3.41Å; G95-E98 PolarHBondContact O-N 3.4Å; E98-V101 PolarHBondContact O-N 3.41Å; E98-Q102 WeakPolarHBondContact O-CB 3.27Å; E98-Q102 PolarHBondContact O-N 3.2Å
99C94.3Very high92.6Very high0 Ų050.5 Ų50.50%025%0.251CS..Hα-helixtrans-63.1-42.3176.4-175.90000111.9F14 I94 G95 F96 D97 Q102 M103 C181F14-C99 HydrophobicContact CD2-CB 3.9Å; F14-C99 HydrophobicContact CE2-CB 4.33Å; I94-C99 HydrophobicContact CD1-CB 4.28Å; I94-C99 HydrophobicContact CG1-CB 4.33Å; I94-C99 HydrophobicContact CG2-CB 4.21Å; G95-C99 WeakPolarHBondContact O-CB 3.45Å; G95-C99 PolarHBondContact O-N 3.16Å; F96-C99 WeakPolarHBondContact O-CB 3.24Å; F96-C99 PolarHBondContact O-N 3.44Å; D97-C99 VanDerWaalsContact C-N 3.3Å; D97-C99 PolarHBondContact O-N 3.38Å; C99-Q102 PolarHBondContact O-N 3.08Å; C99-M103 WeakPolarHBondContact O-CB 3.37Å; C99-M103 PolarHBondContact O-N 3.28Å; C99-C181 WeakPolarHBondContact CA-SG 3.16Å; C99-C181 HydrophobicContact CB-CB 4.08Å; C99-C181 WeakPolarHBondContact CB-SG 3.37Å; C99-C181 WeakPolarHBondContact O-CB 3.33Å; C99-C181 WeakPolarHBondContact SG-CB 3.29Å; C99-C181 CovalentContact SG-SG 2.02Å; C99-C181 PolarHBondContact SG-SG 2.85Å
100L94.5Very high92.9Very high13 Ų1345.4 Ų45.47%0.06823%0.231CC..Hα-helixtrans-67-38.8175.6-66179.1000112.2F96 D97 M103 F104 T165 K166F96-L100 HydrophobicContact CD1-CD1 4.1Å; F96-L100 HydrophobicContact CE1-CD1 3.54Å; F96-L100 HydrophobicContact CE1-CG 4.38Å; F96-L100 HydrophobicContact CZ-CD1 3.9Å; F96-L100 HydrophobicContact CZ-CG 4.48Å; F96-L100 WeakPolarHBondContact O-CG 3.28Å; F96-L100 PolarHBondContact O-N 2.93Å; F96-L100 VanDerWaalsContact O-N 3.16Å; D97-L100 PolarHBondContact O-N 3.4Å; L100-M103 PolarHBondContact O-N 3.02Å; L100-F104 WeakPolarHBondContact O-CB 3.34Å; L100-F104 PolarHBondContact O-N 2.65Å; L100-T165 HydrophobicContact CD2-CG2 3.93Å; L100-K166 HydrophobicContact CD1-CB 3.73Å; L100-K166 HydrophobicContact CD1-CD 3.85Å; L100-K166 HydrophobicContact CD1-CG 3.78Å
101V95.3Very high93.4Very high77 Ų7739.3 Ų39.347%0.46720%0.204SC..Hα-helixtrans-64.9-46.2174.6170.80000110.4D97 E98 M103 F104 F105D97-V101 VanDerWaalsContact O-CG2 3.3Å; D97-V101 WeakPolarHBondContact O-CG2 3.46Å; D97-V101 PolarHBondContact O-N 3.21Å; E98-V101 PolarHBondContact O-N 3.41Å; V101-M103 VanDerWaalsContact C-N 3.32Å; V101-M103 PolarHBondContact O-N 3.45Å; V101-F104 WeakPolarHBondContact O-CB 3.39Å; V101-F104 PolarHBondContact O-N 2.84Å; V101-F105 HydrophobicContact CG1-CD2 3.68Å; V101-F105 HydrophobicContact CG1-CE2 3.57Å; V101-F105 VanDerWaalsContact O-CD2 3.24Å; V101-F105 WeakPolarHBondContact O-CD2 3.37Å; V101-F105 PolarHBondContact O-N 2.91Å
102Q95.3Very high93.9Very high15 Ų1535.1 Ų35.17%0.0718%0.182CC..Hα-helixtrans-57.6-46.8175.5-172.3-175.156.900110.8S78 E98 C99 F104 F105 I106S78-Q102 WeakPolarHBondContact O-CG 3.44Å; S78-Q102 PolarHBondContact O-NE2 3.16Å; E98-Q102 WeakPolarHBondContact O-CB 3.27Å; E98-Q102 PolarHBondContact O-N 3.2Å; C99-Q102 PolarHBondContact O-N 3.08Å; Q102-F104 PolarHBondContact O-N 3.39Å; Q102-F105 PolarHBondContact O-N 2.9Å; Q102-I106 HydrophobicContact CG-CD1 3.88Å; Q102-I106 WeakPolarHBondContact O-CD1 3.28Å; Q102-I106 VanDerWaalsContact O-CG1 3.24Å; Q102-I106 WeakPolarHBondContact O-CG1 3.49Å; Q102-I106 PolarHBondContact O-N 3.27Å
103M94.6Very high94.2Very high0 Ų033.1 Ų33.10%017%0.173CC..Hα-helixtrans-59.6-43.4176.6-174.6-172.3-59.200112.3C99 L100 V101 I106 H107 F161 T165 C181 H183 V186C99-M103 WeakPolarHBondContact O-CB 3.37Å; C99-M103 PolarHBondContact O-N 3.28Å; L100-M103 PolarHBondContact O-N 3.02Å; V101-M103 VanDerWaalsContact C-N 3.32Å; V101-M103 PolarHBondContact O-N 3.45Å; M103-I106 PolarHBondContact O-N 3Å; M103-H107 PolarHBondContact O-N 3.14Å; M103-H107 VanDerWaalsContact O-N 3.08Å; M103-H107 PolarHBondContact O-ND1 3.29Å; M103-F161 HydrophobicContact CG-CE1 4.31Å; M103-F161 HydrophobicContact SD-CD1 4.47Å; M103-F161 HydrophobicContact SD-CE1 3.98Å; M103-T165 HydrophobicContact CE-CG2 4.32Å; M103-T165 HydrophobicContact SD-CG2 4.45Å; M103-C181 HydrophobicContact CB-CB 4.44Å; M103-H183 HydrophobicContact CE-CB 4.4Å; M103-H183 HydrophobicContact CG-CB 4.46Å; M103-H183 HydrophobicContact SD-CB 3.86Å; M103-V186 HydrophobicContact CE-CB 3.8Å; M103-V186 HydrophobicContact CE-CG1 4.28Å; M103-V186 HydrophobicContact CE-CG2 3.54Å
104F95.6Very high94.4Very high49 Ų4928.9 Ų28.922%0.21515%0.152CC..Hα-helixtrans-56.5-53.2175.8178.7-96.2000111.1L100 V101 Q102 I106 H107 T108 V155 I158 I159 T162L100-F104 WeakPolarHBondContact O-CB 3.34Å; L100-F104 PolarHBondContact O-N 2.65Å; V101-F104 WeakPolarHBondContact O-CB 3.39Å; V101-F104 PolarHBondContact O-N 2.84Å; Q102-F104 PolarHBondContact O-N 3.39Å; F104-I106 PolarHBondContact O-N 3.48Å; F104-H107 PolarHBondContact O-N 3.38Å; F104-T108 VanDerWaalsContact O-CB 3.32Å; F104-T108 WeakPolarHBondContact O-CB 3.38Å; F104-T108 PolarHBondContact O-N 3.17Å; F104-T108 PolarHBondContact O-OG1 2.76Å; F104-T108 VanDerWaalsContact O-OG1 3.13Å; F104-V155 HydrophobicContact CZ-CG1 4.22Å; F104-V155 HydrophobicContact CZ-CG2 4.3Å; F104-I158 HydrophobicContact CD2-CB 4.38Å; F104-I158 HydrophobicContact CD2-CG2 3.65Å; F104-I158 HydrophobicContact CE2-CB 4.32Å; F104-I158 HydrophobicContact CE2-CG2 4.09Å; F104-I158 HydrophobicContact CG-CG2 4.39Å; F104-I159 HydrophobicContact CE2-CG1 3.88Å; F104-T162 HydrophobicContact CB-CG2 3.97Å; F104-T162 HydrophobicContact CD2-CG2 4.17Å
105F95.6Very high94.6Very high79 Ų7928.5 Ų28.535%0.34615%0.15SC..Hα-helixtrans-59.6-47.7-180-83-73.6000111.8V74 V101 Q102 H107 F109V74-F105 HydrophobicContact CG1-CD1 3.84Å; V74-F105 HydrophobicContact CG1-CE1 4.37Å; V101-F105 HydrophobicContact CG1-CD2 3.68Å; V101-F105 HydrophobicContact CG1-CE2 3.57Å; V101-F105 VanDerWaalsContact O-CD2 3.24Å; V101-F105 WeakPolarHBondContact O-CD2 3.37Å; V101-F105 PolarHBondContact O-N 2.91Å; Q102-F105 PolarHBondContact O-N 2.9Å; F105-H107 PolarHBondContact O-N 3.07Å; F105-F109 AromaticContact CD1-CD2 3.9Å; F105-F109 HydrophobicContact CD1-CD2 3.9Å; F105-F109 AromaticContact CD1-CE2 3.56Å; F105-F109 HydrophobicContact CD1-CE2 3.56Å; F105-F109 AromaticContact CE1-CE2 3.99Å; F105-F109 HydrophobicContact CE1-CE2 3.99Å; F105-F109 WeakPolarHBondContact O-CB 3.28Å; F105-F109 VanDerWaalsContact O-CD2 3.29Å; F105-F109 WeakPolarHBondContact O-CD2 3.5Å; F105-F109 PolarHBondContact O-N 2.82Å
106I93Very high94.8Very high7 Ų727.5 Ų27.54%0.03614%0.14CC..Hα-helixtrans-54.7-55.8178.6-67.4162.6000110.4T79 Q102 M103 F104 F109 T110 Y180 L284T79-I106 HydrophobicContact CG2-CD1 3.52Å; T79-I106 HydrophobicContact CG2-CG1 3.45Å; T79-I106 VanDerWaalsContact CG2-CG1 3.45Å; Q102-I106 HydrophobicContact CG-CD1 3.88Å; Q102-I106 WeakPolarHBondContact O-CD1 3.28Å; Q102-I106 VanDerWaalsContact O-CG1 3.24Å; Q102-I106 WeakPolarHBondContact O-CG1 3.49Å; Q102-I106 PolarHBondContact O-N 3.27Å; M103-I106 PolarHBondContact O-N 3Å; F104-I106 PolarHBondContact O-N 3.48Å; I106-F109 PolarHBondContact O-N 3.36Å; I106-T110 VanDerWaalsContact O-CB 3.27Å; I106-T110 WeakPolarHBondContact O-CB 3.36Å; I106-T110 PolarHBondContact O-N 2.94Å; I106-T110 PolarHBondContact O-OG1 3.39Å; I106-Y180 HydrophobicContact CD1-CD2 3.52Å; I106-Y180 HydrophobicContact CD1-CE2 4.23Å; I106-Y180 HydrophobicContact CD1-CG 4.11Å; I106-L284 HydrophobicContact CG2-CD2 4.35Å
107H93.2Very high95.1Very high42 Ų4227 Ų2719%0.19414%0.138CC..Hα-helixtrans-72-37.1-171.8-67.475.2000112.7M103 F104 F105 G111 I158 F161M103-H107 PolarHBondContact O-N 3.14Å; M103-H107 VanDerWaalsContact O-N 3.08Å; M103-H107 PolarHBondContact O-ND1 3.29Å; F104-H107 PolarHBondContact O-N 3.38Å; F105-H107 PolarHBondContact O-N 3.07Å; H107-G111 PolarHBondContact O-N 3.34Å; H107-I158 HydrophobicContact CB-CD1 3.6Å; H107-I158 HydrophobicContact CB-CG1 4Å; H107-I158 HydrophobicContact CB-CG2 4.05Å; H107-F161 AromaticContact CD2-CE1 3.86Å; H107-F161 AromaticContact CD2-CZ 3.6Å; H107-F161 AromaticContact NE2-CE1 3.86Å; H107-F161 AromaticContact NE2-CZ 3.58Å
108T95.7Very high95.3Very high1 Ų123.3 Ų23.31%0.00612%0.118CC..Hα-helixtrans-64.4-45.1176-66.20000111.1F104 G111 M112 F151 V155F104-T108 VanDerWaalsContact O-CB 3.32Å; F104-T108 WeakPolarHBondContact O-CB 3.38Å; F104-T108 PolarHBondContact O-N 3.17Å; F104-T108 PolarHBondContact O-OG1 2.76Å; F104-T108 VanDerWaalsContact O-OG1 3.13Å; T108-G111 PolarHBondContact O-N 3.42Å; T108-M112 PolarHBondContact O-N 2.88Å; T108-F151 HydrophobicContact CG2-CE2 4.26Å; T108-V155 HydrophobicContact CG2-CG2 3.83Å
109F95.6Very high95.5Very high12 Ų1218.2 Ų18.25%0.0539%0.094CC..Hα-helixtrans-78.9-30.2-176.9-78.5-87.3000113F70 T71 V74 F105 I106 G111 M112 E113 F151F70-F109 HydrophobicContact CD1-CE1 4.19Å; F70-F109 AromaticContact CE1-CE1 3.83Å; F70-F109 HydrophobicContact CE1-CE1 3.83Å; F70-F109 HydrophobicContact CE1-CZ 4.19Å; T71-F109 HydrophobicContact CG2-CB 4.07Å; T71-F109 HydrophobicContact CG2-CD1 3.96Å; T71-F109 WeakPolarHBondContact CG2-O 3.3Å; V74-F109 HydrophobicContact CB-CD1 4.01Å; V74-F109 HydrophobicContact CB-CD2 4.41Å; V74-F109 HydrophobicContact CB-CE1 3.9Å; V74-F109 HydrophobicContact CB-CE2 4.35Å; V74-F109 HydrophobicContact CB-CG 4.24Å; V74-F109 HydrophobicContact CB-CZ 4.08Å; V74-F109 HydrophobicContact CG1-CD1 4.14Å; V74-F109 HydrophobicContact CG1-CD2 3.65Å; V74-F109 HydrophobicContact CG1-CE1 4Å; V74-F109 HydrophobicContact CG1-CE2 3.54Å; V74-F109 HydrophobicContact CG1-CG 3.96Å; V74-F109 HydrophobicContact CG1-CZ 3.69Å; V74-F109 HydrophobicContact CG2-CE1 3.98Å; V74-F109 HydrophobicContact CG2-CZ 4.08Å; F105-F109 AromaticContact CD1-CD2 3.9Å; F105-F109 HydrophobicContact CD1-CD2 3.9Å; F105-F109 AromaticContact CD1-CE2 3.56Å; F105-F109 HydrophobicContact CD1-CE2 3.56Å; F105-F109 AromaticContact CE1-CE2 3.99Å; F105-F109 HydrophobicContact CE1-CE2 3.99Å; F105-F109 WeakPolarHBondContact O-CB 3.28Å; F105-F109 VanDerWaalsContact O-CD2 3.29Å; F105-F109 WeakPolarHBondContact O-CD2 3.5Å; F105-F109 PolarHBondContact O-N 2.82Å; I106-F109 PolarHBondContact O-N 3.36Å; F109-G111 VanDerWaalsContact C-N 3.3Å; F109-G111 PolarHBondContact O-N 3.41Å; F109-M112 WeakPolarHBondContact O-CB 3.4Å; F109-M112 PolarHBondContact O-N 3.32Å; F109-E113 WeakPolarHBondContact O-CB 3.48Å; F109-E113 PolarHBondContact O-N 3.12Å; F109-F151 HydrophobicContact CE2-CE2 4.47Å; F109-F151 HydrophobicContact CZ-CE2 4.06Å
110T93.2Very high95.5Very high26 Ų2618.3 Ų18.316%0.169%0.094CC..Hα-helixtrans-59.2-41.9164.3-69.60000111.6I106 E113 S114 Y283I106-T110 VanDerWaalsContact O-CB 3.27Å; I106-T110 WeakPolarHBondContact O-CB 3.36Å; I106-T110 PolarHBondContact O-N 2.94Å; I106-T110 PolarHBondContact O-OG1 3.39Å; T110-E113 PolarHBondContact O-N 3.01Å; T110-S114 PolarHBondContact O-N 2.93Å; T110-S114 VanDerWaalsContact O-N 3.07Å; T110-Y283 WeakPolarHBondContact CG2-OH 3.13Å
111G94.8Very high95.6Very high5 Ų517.7 Ų17.75%0.0529%0.091CC..Hα-helixtrans-65.3-38.3174.300000113H107 T108 F109 G115H107-G111 PolarHBondContact O-N 3.34Å; T108-G111 PolarHBondContact O-N 3.42Å; F109-G111 VanDerWaalsContact C-N 3.3Å; F109-G111 PolarHBondContact O-N 3.41Å; G111-G115 PolarHBondContact O-N 3.26Å
112M96.5Very high95.6Very high12 Ų1217 Ų176%0.0599%0.085CC..Hα-helixtrans-63.8-45.6173.5-176.764.5-177.500111.6M67 T71 T108 F109 G115 V116 T150 F151M67-M112 HydrophobicContact CB-CE 3.99Å; M67-M112 HydrophobicContact CG-CE 4.28Å; M67-M112 HydrophobicContact SD-CE 4.19Å; T71-M112 HydrophobicContact CG2-CB 4.17Å; T71-M112 HydrophobicContact CG2-CG 4.29Å; T71-M112 VanDerWaalsContact OG1-CG 3.24Å; T71-M112 WeakPolarHBondContact OG1-CG 3.36Å; T108-M112 PolarHBondContact O-N 2.88Å; F109-M112 WeakPolarHBondContact O-CB 3.4Å; F109-M112 PolarHBondContact O-N 3.32Å; M112-G115 PolarHBondContact O-N 2.91Å; M112-V116 HydrophobicContact CE-CG2 3.58Å; M112-V116 HydrophobicContact CG-CG2 4.29Å; M112-V116 WeakPolarHBondContact O-CB 3.47Å; M112-V116 VanDerWaalsContact O-CG2 3.28Å; M112-V116 WeakPolarHBondContact O-CG2 3.41Å; M112-V116 PolarHBondContact O-N 3.12Å; M112-V116 HydrophobicContact SD-CG2 4.17Å; M112-T150 HydrophobicContact SD-CG2 3.73Å; M112-F151 HydrophobicContact SD-CB 3.94Å
113E95.8Very high95.6Very high4 Ų416.4 Ų16.42%0.0198%0.082CC..Hα-helixtrans-56.6-54.5178.1-178-171.3-147.400110.6L68 T71 M75 F109 T110 G115 V116 L117 P287L68-E113 HydrophobicContact CD1-CG 3.84Å; T71-E113 HydrophobicContact CG2-CB 3.8Å; M75-E113 HydrophobicContact CE-CB 4.23Å; F109-E113 WeakPolarHBondContact O-CB 3.48Å; F109-E113 PolarHBondContact O-N 3.12Å; T110-E113 PolarHBondContact O-N 3.01Å; E113-G115 VanDerWaalsContact C-N 3.31Å; E113-G115 PolarHBondContact O-N 3.36Å; E113-V116 PolarHBondContact O-N 2.64Å; E113-V116 VanDerWaalsContact O-N 3.16Å; E113-L117 WeakPolarHBondContact O-CG 3.31Å; E113-L117 PolarHBondContact O-N 3.13Å; E113-P287 WeakPolarHBondContact OE1-CB 3.2Å
114S96.1Very high95.6Very high13 Ų1318 Ų189%0.0919%0.088CC..Hα-helixtrans-55.5-45.2175.9176.40000111.9T110 V116 L117 M118 D212 Y254T110-S114 PolarHBondContact O-N 2.93Å; T110-S114 VanDerWaalsContact O-N 3.07Å; S114-V116 PolarHBondContact O-N 3.45Å; S114-L117 PolarHBondContact O-N 3.28Å; S114-M118 PolarHBondContact O-N 3.04Å; S114-D212 VanDerWaalsContact C-OD2 3.31Å; S114-D212 WeakPolarHBondContact CB-OD2 3.37Å; S114-D212 VanDerWaalsContact OG-CB 3.27Å; S114-D212 WeakPolarHBondContact OG-CB 3.46Å; S114-D212 PolarHBondContact OG-OD2 2.98Å; S114-Y254 PolarHBondContact OG-OH 2.9Å
115G97.2Very high95.5Very high0 Ų018.2 Ų18.20%09%0.088CC..Hα-helixtrans-67.4-35178.800000113.4G111 M112 E113 M118 L119 D212G111-G115 PolarHBondContact O-N 3.26Å; M112-G115 PolarHBondContact O-N 2.91Å; E113-G115 VanDerWaalsContact C-N 3.31Å; E113-G115 PolarHBondContact O-N 3.36Å; G115-M118 WeakPolarHBondContact O-CB 3.43Å; G115-M118 PolarHBondContact O-N 3Å; G115-L119 VanDerWaalsContact O-CG 3.26Å; G115-L119 WeakPolarHBondContact O-CG 3.24Å; G115-L119 PolarHBondContact O-N 3.37Å; G115-D212 PolarHBondContact N-OD2 2.84Å
116V97.1Very high95.5Very high0 Ų015 Ų150%08%0.075CC..Hα-helixtrans-68.2-42.8174.2172.50000110.6F64 M67 L68 M112 E113 S114 M118 L119 M120F64-V116 HydrophobicContact CB-CG1 4.17Å; F64-V116 WeakPolarHBondContact O-CG1 3.49Å; M67-V116 HydrophobicContact CB-CG2 3.92Å; L68-V116 HydrophobicContact CB-CG1 3.93Å; L68-V116 HydrophobicContact CD1-CG1 4.36Å; M112-V116 HydrophobicContact CE-CG2 3.58Å; M112-V116 HydrophobicContact CG-CG2 4.29Å; M112-V116 WeakPolarHBondContact O-CB 3.47Å; M112-V116 VanDerWaalsContact O-CG2 3.28Å; M112-V116 WeakPolarHBondContact O-CG2 3.41Å; M112-V116 PolarHBondContact O-N 3.12Å; M112-V116 HydrophobicContact SD-CG2 4.17Å; E113-V116 PolarHBondContact O-N 2.64Å; E113-V116 VanDerWaalsContact O-N 3.16Å; S114-V116 PolarHBondContact O-N 3.45Å; V116-M118 VanDerWaalsContact C-N 3.28Å; V116-M118 PolarHBondContact O-N 2.87Å; V116-L119 PolarHBondContact O-N 2.9Å; V116-L119 VanDerWaalsContact O-N 3.12Å; V116-M120 HydrophobicContact CG1-CG 4.31Å; V116-M120 HydrophobicContact CG1-SD 4.09Å; V116-M120 WeakPolarHBondContact O-CB 3.28Å; V116-M120 VanDerWaalsContact O-CG 3.27Å; V116-M120 WeakPolarHBondContact O-CG 3.22Å; V116-M120 PolarHBondContact O-N 3.45Å
117L96.8Very high95.4Very high1 Ų116.3 Ų16.31%0.0059%0.086CC..Hα-helixtrans-59.3-40.3173.2-67173.9000111.5L68 E113 S114 M120 A121 I216 H246 A249 Y254L68-L117 HydrophobicContact CD2-CD2 4.44Å; E113-L117 WeakPolarHBondContact O-CG 3.31Å; E113-L117 PolarHBondContact O-N 3.13Å; S114-L117 PolarHBondContact O-N 3.28Å; L117-M120 PolarHBondContact O-N 3.35Å; L117-A121 PolarHBondContact O-N 2.96Å; L117-I216 HydrophobicContact CB-CD1 4.31Å; L117-H246 PolarHBondContact O-CE1 3.06Å; L117-H246 PolarHBondContact O-NE2 3.5Å; L117-H246 VanDerWaalsContact O-NE2 3.08Å; L117-A249 HydrophobicContact CD2-CB 4.04Å; L117-Y254 HydrophobicContact CD1-CE2 4.11Å
118M97.6Very high95.3Very high13 Ų1316 Ų166%0.0649%0.085CC..Hα-helixtrans-60.8-47.3172177.6-167.467.700112.1S114 G115 V116 M120 A121 L122 F211 D212 C215 I216S114-M118 PolarHBondContact O-N 3.04Å; G115-M118 WeakPolarHBondContact O-CB 3.43Å; G115-M118 PolarHBondContact O-N 3Å; V116-M118 VanDerWaalsContact C-N 3.28Å; V116-M118 PolarHBondContact O-N 2.87Å; M118-M120 VanDerWaalsContact C-N 3.29Å; M118-M120 PolarHBondContact O-N 2.86Å; M118-A121 WeakPolarHBondContact O-CB 3.48Å; M118-A121 PolarHBondContact O-N 2.92Å; M118-A121 VanDerWaalsContact O-N 3.13Å; M118-L122 PolarHBondContact O-N 3.3Å; M118-F211 HydrophobicContact CE-CE1 4.28Å; M118-F211 HydrophobicContact SD-CD1 3.98Å; M118-F211 HydrophobicContact SD-CE1 3.71Å; M118-D212 HydrophobicContact CB-CB 4.08Å; M118-D212 HydrophobicContact SD-CB 4.28Å; M118-C215 HydrophobicContact CG-CB 3.58Å; M118-C215 HydrophobicContact SD-CB 3.6Å; M118-I216 HydrophobicContact CB-CD1 4.35Å; M118-I216 HydrophobicContact CB-CG1 4.12Å
119L96.9Very high95.1Very high13 Ų1317.1 Ų17.17%0.0689%0.093CC..Hα-helixtrans-63.5-35.8178.3-69.9170.9000112.1F64 G115 V116 L122 D123 V146F64-L119 HydrophobicContact CD1-CB 3.94Å; F64-L119 HydrophobicContact CD1-CD1 4.36Å; F64-L119 HydrophobicContact CE1-CB 3.58Å; F64-L119 HydrophobicContact CE1-CD1 3.87Å; F64-L119 HydrophobicContact CE1-CG 4.24Å; F64-L119 HydrophobicContact CZ-CB 3.95Å; G115-L119 VanDerWaalsContact O-CG 3.26Å; G115-L119 WeakPolarHBondContact O-CG 3.24Å; G115-L119 PolarHBondContact O-N 3.37Å; V116-L119 PolarHBondContact O-N 2.9Å; V116-L119 VanDerWaalsContact O-N 3.12Å; L119-L122 HydrophobicContact CD2-CD1 4.36Å; L119-L122 PolarHBondContact O-N 3.3Å; L119-D123 PolarHBondContact O-N 2.93Å; L119-V146 HydrophobicContact CD1-CB 4.4Å; L119-V146 HydrophobicContact CD1-CG2 4.03Å; L119-V146 HydrophobicContact CD2-CB 3.91Å; L119-V146 HydrophobicContact CD2-CG2 3.74Å
120M96.1Very high94.9Very high2 Ų222 Ų221%0.0111%0.112CC..Hα-helixtrans-66.6-36.6172.9-70.2-179.372.900112M61 F64 L65 L68 V116 L117 M118 L122 D123 R124 H246 Y295M61-M120 HydrophobicContact CE-CE 4.48Å; F64-M120 HydrophobicContact CB-CG 3.49Å; F64-M120 VanDerWaalsContact CB-CG 3.49Å; F64-M120 HydrophobicContact CB-SD 4.1Å; F64-M120 HydrophobicContact CD2-CG 4.26Å; F64-M120 HydrophobicContact CG-CG 4.01Å; L65-M120 HydrophobicContact CD2-CE 3.77Å; L65-M120 HydrophobicContact CD2-SD 4.47Å; L65-M120 HydrophobicContact CG-CE 4.3Å; L68-M120 HydrophobicContact CD2-SD 4.33Å; V116-M120 HydrophobicContact CG1-CG 4.31Å; V116-M120 HydrophobicContact CG1-SD 4.09Å; V116-M120 WeakPolarHBondContact O-CB 3.28Å; V116-M120 VanDerWaalsContact O-CG 3.27Å; V116-M120 WeakPolarHBondContact O-CG 3.22Å; V116-M120 PolarHBondContact O-N 3.45Å; L117-M120 PolarHBondContact O-N 3.35Å; M118-M120 VanDerWaalsContact C-N 3.29Å; M118-M120 PolarHBondContact O-N 2.86Å; M120-L122 VanDerWaalsContact C-N 3.34Å; M120-D123 WeakPolarHBondContact O-CB 3.35Å; M120-D123 PolarHBondContact O-N 3.45Å; M120-R124 WeakPolarHBondContact O-CG 3.35Å; M120-R124 PolarHBondContact O-N 3.38Å; M120-H246 WeakPolarHBondContact CB-NE2 3.44Å; M120-Y295 HydrophobicContact CE-CE1 3.99Å; M120-Y295 WeakPolarHBondContact CE-OH 3.49Å
121A96.3Very high94.7Very high0 Ų024.9 Ų24.90%013%0.131CC..Hα-helixtrans-63.4-42.6172.900000111.2L117 M118 R124 Y125 I216 Y220 H246L117-A121 PolarHBondContact O-N 2.96Å; M118-A121 WeakPolarHBondContact O-CB 3.48Å; M118-A121 PolarHBondContact O-N 2.92Å; M118-A121 VanDerWaalsContact O-N 3.13Å; A121-R124 PolarHBondContact O-N 2.97Å; A121-Y125 WeakPolarHBondContact O-CB 3.35Å; A121-Y125 PolarHBondContact O-N 3.12Å; A121-I216 HydrophobicContact CB-CB 4.33Å; A121-I216 HydrophobicContact CB-CG1 3.95Å; A121-I216 HydrophobicContact CB-CG2 4.4Å; A121-Y220 HydrophobicContact CB-CD2 4.26Å; A121-Y220 HydrophobicContact CB-CE2 3.93Å; A121-H246 PolarHBondContact N-CE1 2.88Å
122L95.4Very high94.5Very high64 Ų6432.6 Ų32.634%0.33517%0.171SC..Hα-helixtrans-63.5-41.1175.2-69.8171.5000111.6M118 L119 M120 Y125 V126M118-L122 PolarHBondContact O-N 3.3Å; L119-L122 HydrophobicContact CD2-CD1 4.36Å; L119-L122 PolarHBondContact O-N 3.3Å; M120-L122 VanDerWaalsContact C-N 3.34Å; L122-Y125 PolarHBondContact O-N 3.11Å; L122-V126 WeakPolarHBondContact O-CG2 3.31Å; L122-V126 PolarHBondContact O-N 3.36Å
123D94.7Very high94.2Very high1 Ų140.2 Ų40.21%0.00520%0.199CC..Hα-helixtrans-57.9-49.5173.4167.684.7000112.1F64 L119 M120 Y125 V126 A127 Y134 L138F64-D123 HydrophobicContact CD2-CB 4.3Å; F64-D123 HydrophobicContact CE2-CB 3.96Å; L119-D123 PolarHBondContact O-N 2.93Å; M120-D123 WeakPolarHBondContact O-CB 3.35Å; M120-D123 PolarHBondContact O-N 3.45Å; D123-Y125 VanDerWaalsContact C-N 3.3Å; D123-Y125 PolarHBondContact O-N 3.36Å; D123-V126 PolarHBondContact O-N 2.82Å; D123-A127 VanDerWaalsContact O-CB 3.25Å; D123-A127 WeakPolarHBondContact O-CB 3.3Å; D123-A127 PolarHBondContact O-N 2.83Å; D123-Y134 WeakPolarHBondContact OD1-CE2 3.28Å; D123-Y134 PolarHBondContact OD1-OH 3.42Å; D123-L138 HydrophobicContact CB-CD2 3.51Å; D123-L138 WeakPolarHBondContact OD1-CD2 3.18Å
124R94.2Very high94Very high35 Ų3542.4 Ų42.413%0.13221%0.207CC..Hα-helixtrans-60.8-40.9176.2-66.3-59.395.1169.71.7111.7M61 M120 A121 A127 I128 I223 T242M61-R124 PolarHBondContact SD-NH2 2.71Å; M120-R124 WeakPolarHBondContact O-CG 3.35Å; M120-R124 PolarHBondContact O-N 3.38Å; A121-R124 PolarHBondContact O-N 2.97Å; R124-A127 PolarHBondContact O-N 2.9Å; R124-I128 WeakPolarHBondContact O-CB 3.33Å; R124-I128 WeakPolarHBondContact O-CG1 3.26Å; R124-I128 PolarHBondContact O-N 3.29Å; R124-I223 HydrophobicContact CB-CD1 3.95Å; R124-T242 PolarHBondContact NH1-O 2.8Å
125Y94.5Very high93.5Very high52 Ų5245.9 Ų45.920%0.20423%0.232CC..Hα-helixtrans-62-50.4178.2165.7-111.2000111.6A121 L122 D123 A127 I128 C129 Y130 M222 I223A121-Y125 WeakPolarHBondContact O-CB 3.35Å; A121-Y125 PolarHBondContact O-N 3.12Å; L122-Y125 PolarHBondContact O-N 3.11Å; D123-Y125 VanDerWaalsContact C-N 3.3Å; D123-Y125 PolarHBondContact O-N 3.36Å; Y125-A127 VanDerWaalsContact C-N 3.34Å; Y125-A127 PolarHBondContact O-N 3.13Å; Y125-I128 PolarHBondContact O-N 2.89Å; Y125-C129 HydrophobicContact CD2-CB 4.01Å; Y125-C129 WeakPolarHBondContact CD2-SG 3.11Å; Y125-C129 HydrophobicContact CE2-CB 3.77Å; Y125-C129 VanDerWaalsContact CE2-SG 3.53Å; Y125-C129 VanDerWaalsContact O-CB 3.24Å; Y125-C129 WeakPolarHBondContact O-CB 3.25Å; Y125-C129 PolarHBondContact O-N 3.39Å; Y125-Y130 HydrophobicContact CE1-CE2 4.07Å; Y125-Y130 HydrophobicContact CE2-CE2 4.4Å; Y125-Y130 AromaticContact CZ-CE2 3.72Å; Y125-Y130 WeakPolarHBondContact OH-CE2 3.39Å; Y125-M222 HydrophobicContact CD2-CB 3.83Å; Y125-M222 HydrophobicContact CE2-CB 3.47Å; Y125-M222 VanDerWaalsContact CE2-CB 3.47Å; Y125-M222 HydrophobicContact CE2-CG 4.11Å; Y125-I223 HydrophobicContact CD2-CG1 4.39Å
126V94.1Very high93.1Very high13 Ų1351.3 Ų51.38%0.07927%0.265CS..Hα-helixtrans-66.2-38.6179.6-179.70000110.9L122 D123 I128 Y130 Y134 I137 L138L122-V126 WeakPolarHBondContact O-CG2 3.31Å; L122-V126 PolarHBondContact O-N 3.36Å; D123-V126 PolarHBondContact O-N 2.82Å; V126-I128 VanDerWaalsContact C-N 3.33Å; V126-I128 PolarHBondContact O-N 2.95Å; V126-Y130 CarbonylContact O-C 3.56Å; V126-Y130 WeakPolarHBondContact O-CA 3.48Å; V126-Y130 PolarHBondContact O-N 3.32Å; V126-Y134 HydrophobicContact CB-CD2 4.41Å; V126-Y134 HydrophobicContact CG1-CD2 4.08Å; V126-I137 HydrophobicContact CG1-CB 4.13Å; V126-I137 HydrophobicContact CG1-CD1 3.89Å; V126-I137 HydrophobicContact CG1-CG2 4.24Å; V126-I137 HydrophobicContact CG2-CG2 4.4Å; V126-L138 HydrophobicContact CB-CD1 3.94Å; V126-L138 HydrophobicContact CG1-CD1 4Å; V126-L138 HydrophobicContact CG2-CD1 3.9Å
127A91.9Very high92.7Very high33 Ų3354.8 Ų54.827%0.27328%0.283SS..Hα-helixtrans-62.2-37.7178.300000113.2D123 R124 Y125 Y134D123-A127 VanDerWaalsContact O-CB 3.25Å; D123-A127 WeakPolarHBondContact O-CB 3.3Å; D123-A127 PolarHBondContact O-N 2.83Å; R124-A127 PolarHBondContact O-N 2.9Å; Y125-A127 VanDerWaalsContact C-N 3.34Å; Y125-A127 PolarHBondContact O-N 3.13Å; A127-Y134 HydrophobicContact CB-CD2 3.84Å; A127-Y134 HydrophobicContact CB-CE2 3.76Å
128I91Very high92.3Very high35 Ų3555.7 Ų55.718%0.17929%0.287CS..Hα-helixtrans-89-45.6-177.2-65.4171.6000111.5R124 Y125 V126 I223 V226R124-I128 WeakPolarHBondContact O-CB 3.33Å; R124-I128 WeakPolarHBondContact O-CG1 3.26Å; R124-I128 PolarHBondContact O-N 3.29Å; Y125-I128 PolarHBondContact O-N 2.89Å; V126-I128 VanDerWaalsContact C-N 3.33Å; V126-I128 PolarHBondContact O-N 2.95Å; I128-I223 HydrophobicContact CD1-CG1 4.42Å; I128-I223 HydrophobicContact CD1-CG2 3.73Å; I128-I223 HydrophobicContact CG2-CG2 4.49Å; I128-V226 HydrophobicContact CG2-CG1 4.18Å
129C91.1Very high92Very high26 Ų2656.6 Ų56.618%0.17630%0.297CS..Hα-helixtrans-85.6-25-173-59.40000113.1Y125 V226Y125-C129 HydrophobicContact CD2-CB 4.01Å; Y125-C129 WeakPolarHBondContact CD2-SG 3.11Å; Y125-C129 HydrophobicContact CE2-CB 3.77Å; Y125-C129 VanDerWaalsContact CE2-SG 3.53Å; Y125-C129 VanDerWaalsContact O-CB 3.24Å; Y125-C129 WeakPolarHBondContact O-CB 3.25Å; Y125-C129 PolarHBondContact O-N 3.39Å; C129-V226 HydrophobicContact CB-CG2 4.39Å; C129-V226 VanDerWaalsContact SG-CG2 3.6Å
130Y91.7Very high91.6Very high113 Ų11359.6 Ų59.644%0.44331%0.313SS..  trans-136.655.4-178.2-57.4-76000113.1Y125 V126 L132 R133 Y134Y125-Y130 HydrophobicContact CE1-CE2 4.07Å; Y125-Y130 HydrophobicContact CE2-CE2 4.4Å; Y125-Y130 AromaticContact CZ-CE2 3.72Å; Y125-Y130 WeakPolarHBondContact OH-CE2 3.39Å; V126-Y130 CarbonylContact O-C 3.56Å; V126-Y130 WeakPolarHBondContact O-CA 3.48Å; V126-Y130 PolarHBondContact O-N 3.32Å; Y130-L132 VanDerWaalsContact C-N 3.27Å; Y130-L132 PolarHBondContact O-N 3.48Å; Y130-L132 VanDerWaalsContact O-N 3.15Å; Y130-R133 PolarHBondContact O-N 2.94Å; Y130-Y134 PolarHBondContact O-N 2.94Å
131P88.4Confident91.3Very high87 Ų8763.6 Ų63.657%0.56534%0.339SS*.G310 helixtrans-57.3-36.7-172.622.7-34000113.5R133 Y134P131-R133 VanDerWaalsContact C-N 3.27Å; P131-R133 PolarHBondContact O-N 3.45Å; P131-Y134 WeakPolarHBondContact O-CB 3.35Å; P131-Y134 PolarHBondContact O-N 3.38Å
132L91.4Very high91.2Very high167 Ų16766.5 Ų66.587%0.87436%0.356SS*.G310 helixtrans-68.8-21.9179.8-64.6176.9000114.1Y130Y130-L132 VanDerWaalsContact C-N 3.27Å; Y130-L132 PolarHBondContact O-N 3.48Å; Y130-L132 VanDerWaalsContact O-N 3.15Å
133R90.8Very high91.1Very high173 Ų17363.6 Ų63.665%0.65334%0.341SS*.G310 helixtrans-107.10.5-178.8-62.1-175.4179.1-165.7-0.7112.7Y130 P131 S135 T136 I137Y130-R133 PolarHBondContact O-N 2.94Å; P131-R133 VanDerWaalsContact C-N 3.27Å; P131-R133 PolarHBondContact O-N 3.45Å; R133-S135 PolarHBondContact O-N 2.79Å; R133-T136 PolarHBondContact O-N 3.47Å; R133-T136 VanDerWaalsContact O-N 3.16Å; R133-I137 HydrophobicContact CB-CD1 3.64Å; R133-I137 HydrophobicContact CB-CG1 4.13Å; R133-I137 VanDerWaalsContact O-CG1 3.3Å; R133-I137 WeakPolarHBondContact O-CG1 3.35Å; R133-I137 PolarHBondContact O-N 3.33Å
134Y90.1Very high91Very high50 Ų5066.3 Ų66.320%0.19636%0.364CS..Hα-helixtrans-55.8-48.5-173.2176.9-101.8000112.8P60 D123 V126 A127 Y130 P131 T136 I137 L138P60-Y134 WeakPolarHBondContact CB-OH 3.34Å; P60-Y134 HydrophobicContact CG-CE1 4.18Å; D123-Y134 WeakPolarHBondContact OD1-CE2 3.28Å; D123-Y134 PolarHBondContact OD1-OH 3.42Å; V126-Y134 HydrophobicContact CB-CD2 4.41Å; V126-Y134 HydrophobicContact CG1-CD2 4.08Å; A127-Y134 HydrophobicContact CB-CD2 3.84Å; A127-Y134 HydrophobicContact CB-CE2 3.76Å; Y130-Y134 PolarHBondContact O-N 2.94Å; P131-Y134 WeakPolarHBondContact O-CB 3.35Å; P131-Y134 PolarHBondContact O-N 3.38Å; Y134-T136 VanDerWaalsContact C-N 3.29Å; Y134-T136 PolarHBondContact O-N 3.21Å; Y134-I137 PolarHBondContact O-N 3.01Å; Y134-L138 HydrophobicContact CE2-CB 4.28Å; Y134-L138 HydrophobicContact CE2-CD2 3.95Å; Y134-L138 PolarHBondContact O-N 3.49Å
135S86.3Confident91.1Very high86 Ų8671.9 Ų71.960%0.60139%0.389SS*.Hα-helixtrans-65.5-29.3-17949.90000113.7R133R133-S135 PolarHBondContact O-N 2.79Å
136T88.7Confident91.2Very high113 Ų11371.8 Ų71.869%0.69339%0.394SS*.Hα-helixtrans-81-39.9178.3-48.70000111.7R133 Y134R133-T136 PolarHBondContact O-N 3.47Å; R133-T136 VanDerWaalsContact O-N 3.16Å; Y134-T136 VanDerWaalsContact C-N 3.29Å; Y134-T136 PolarHBondContact O-N 3.21Å
137I87.8Confident91.2Very high74 Ų7471.3 Ų71.338%0.37939%0.391SS..Hα-helixtrans-77.4-45.6-177.6-59.1169.5000110.4V126 R133 Y134V126-I137 HydrophobicContact CG1-CB 4.13Å; V126-I137 HydrophobicContact CG1-CD1 3.89Å; V126-I137 HydrophobicContact CG1-CG2 4.24Å; V126-I137 HydrophobicContact CG2-CG2 4.4Å; R133-I137 HydrophobicContact CB-CD1 3.64Å; R133-I137 HydrophobicContact CB-CG1 4.13Å; R133-I137 VanDerWaalsContact O-CG1 3.3Å; R133-I137 WeakPolarHBondContact O-CG1 3.35Å; R133-I137 PolarHBondContact O-N 3.33Å; Y134-I137 PolarHBondContact O-N 3.01Å
138L89.9Confident91.5Very high20 Ų2074.6 Ų74.611%0.10540%0.404CS..THydrogen-bonded Turntrans-10354.9179.9-9076.2000111.5P60 F64 D123 V126 Y134P60-L138 HydrophobicContact CB-CB 4.33Å; P60-L138 HydrophobicContact CB-CD2 4.18Å; P60-L138 HydrophobicContact CG-CB 4.2Å; P60-L138 VanDerWaalsContact CG-O 3.3Å; P60-L138 WeakPolarHBondContact CG-O 3.45Å; F64-L138 HydrophobicContact CE2-CD2 4.33Å; D123-L138 HydrophobicContact CB-CD2 3.51Å; D123-L138 WeakPolarHBondContact OD1-CD2 3.18Å; V126-L138 HydrophobicContact CB-CD1 3.94Å; V126-L138 HydrophobicContact CG1-CD1 4Å; V126-L138 HydrophobicContact CG2-CD1 3.9Å; Y134-L138 HydrophobicContact CE2-CB 4.28Å; Y134-L138 HydrophobicContact CE2-CD2 3.95Å; Y134-L138 PolarHBondContact O-N 3.49Å
139A90.1Very high91.8Very high32 Ų3275.6 Ų75.626%0.26442%0.418SS..  trans-72.4149.6170.500000111.3P141 V142 I143A139-P141 VanDerWaalsContact C-CD 3.42Å; A139-P141 VanDerWaalsContact C-N 3.32Å; A139-P141 VanDerWaalsContact O-N 3.17Å; A139-V142 HydrophobicContact CB-CG2 4.34Å; A139-V142 WeakPolarHBondContact O-CA 3.47Å; A139-V142 WeakPolarHBondContact O-CB 3.38Å; A139-V142 PolarHBondContact O-N 3.5Å; A139-I143 PolarHBondContact O-N 3.47Å; A139-I143 VanDerWaalsContact O-N 3.14Å
140N88.8Confident92Very high76 Ų7674.9 Ų74.941%0.40641%0.413SS..Hα-helixtrans-50.8-41.1-179.3-64.1-9.7000114.4Y63 V142 I143 A144Y63-N140 WeakPolarHBondContact CE2-OD1 3.49Å; N140-V142 VanDerWaalsContact C-N 3.3Å; N140-V142 PolarHBondContact O-N 3.32Å; N140-I143 PolarHBondContact O-N 2.71Å; N140-A144 PolarHBondContact O-N 3.06Å
141P91Very high92.3Very high85 Ų8573 Ų7355%0.55241%0.406SS*.Hα-helixtrans-64.2-33.2175.9-22.534.6000113.4A139 K145A139-P141 VanDerWaalsContact C-CD 3.42Å; A139-P141 VanDerWaalsContact C-N 3.32Å; A139-P141 VanDerWaalsContact O-N 3.17Å; P141-K145 WeakPolarHBondContact O-CB 3.35Å; P141-K145 VanDerWaalsContact O-CG 3.26Å; P141-K145 WeakPolarHBondContact O-CG 3.41Å; P141-K145 PolarHBondContact O-N 2.91Å; P141-K145 VanDerWaalsContact O-N 3.07Å
142V93.6Very high92.7Very high61 Ų6172.6 Ų72.637%0.3740%0.4SS..Hα-helixtrans-66.5-45176.2178.60000109.3A139 N140 A144 K145 V146A139-V142 HydrophobicContact CB-CG2 4.34Å; A139-V142 WeakPolarHBondContact O-CA 3.47Å; A139-V142 WeakPolarHBondContact O-CB 3.38Å; A139-V142 PolarHBondContact O-N 3.5Å; N140-V142 VanDerWaalsContact C-N 3.3Å; N140-V142 PolarHBondContact O-N 3.32Å; V142-A144 PolarHBondContact O-N 3.43Å; V142-K145 WeakPolarHBondContact O-CB 3.42Å; V142-K145 PolarHBondContact O-N 3Å; V142-K145 VanDerWaalsContact O-N 3.16Å; V142-V146 HydrophobicContact CG1-CG1 4.27Å; V142-V146 WeakPolarHBondContact O-CG1 3.37Å; V142-V146 WeakPolarHBondContact O-CG2 3.42Å; V142-V146 PolarHBondContact O-N 3.4Å
143I93.3Very high92.9Very high3 Ų367.3 Ų67.32%0.01537%0.368CS..Hα-helixtrans-60.1-46.2178.9-61.8170.9000111.3P60 F64 M67 A139 N140 K145 V146 G147P60-I143 HydrophobicContact CB-CD1 3.23Å; P60-I143 HydrophobicContact CB-CG1 4.42Å; P60-I143 HydrophobicContact CG-CD1 3.57Å; F64-I143 HydrophobicContact CD1-CG2 4.3Å; F64-I143 HydrophobicContact CE1-CG2 3.74Å; F64-I143 HydrophobicContact CE2-CG2 4.49Å; F64-I143 HydrophobicContact CZ-CB 4.44Å; F64-I143 HydrophobicContact CZ-CG1 4.1Å; F64-I143 HydrophobicContact CZ-CG2 3.86Å; M67-I143 HydrophobicContact CE-CG2 4.27Å; A139-I143 PolarHBondContact O-N 3.47Å; A139-I143 VanDerWaalsContact O-N 3.14Å; N140-I143 PolarHBondContact O-N 2.71Å; I143-K145 VanDerWaalsContact C-N 3.33Å; I143-K145 PolarHBondContact O-N 3.48Å; I143-V146 WeakPolarHBondContact O-CG2 3.34Å; I143-V146 PolarHBondContact O-N 3.18Å; I143-G147 PolarHBondContact O-N 3.3Å
144A92.7Very high93.1Very high58 Ų5859.1 Ų59.148%0.47934%0.337SS..Hα-helixtrans-60.1-44.1175.900000111.5N140 V142 L148N140-A144 PolarHBondContact O-N 3.06Å; V142-A144 PolarHBondContact O-N 3.43Å; A144-L148 VanDerWaalsContact O-CB 3.3Å; A144-L148 WeakPolarHBondContact O-CB 3.45Å; A144-L148 PolarHBondContact O-N 2.89Å
145K95.6Very high93.4Very high153 Ų15358 Ų5867%0.66534%0.336SS*.Hα-helixtrans-64.2-47.7178-74.7175.3-176.9-176.50112.6P141 V142 I143 L148 A149P141-K145 WeakPolarHBondContact O-CB 3.35Å; P141-K145 VanDerWaalsContact O-CG 3.26Å; P141-K145 WeakPolarHBondContact O-CG 3.41Å; P141-K145 PolarHBondContact O-N 2.91Å; P141-K145 VanDerWaalsContact O-N 3.07Å; V142-K145 WeakPolarHBondContact O-CB 3.42Å; V142-K145 PolarHBondContact O-N 3Å; V142-K145 VanDerWaalsContact O-N 3.16Å; I143-K145 VanDerWaalsContact C-N 3.33Å; I143-K145 PolarHBondContact O-N 3.48Å; K145-L148 PolarHBondContact O-N 3.36Å; K145-A149 VanDerWaalsContact O-CB 3.3Å; K145-A149 WeakPolarHBondContact O-CB 3.12Å; K145-A149 PolarHBondContact O-N 3.45Å
146V96.3Very high93.9Very high49 Ų4959.5 Ų59.530%0.29734%0.336SS..Hα-helixtrans-69.9-36.7-179.4-59.80000111.5F64 L119 V142 I143 A149 T150F64-V146 HydrophobicContact CE1-CG2 4.35Å; L119-V146 HydrophobicContact CD1-CB 4.4Å; L119-V146 HydrophobicContact CD1-CG2 4.03Å; L119-V146 HydrophobicContact CD2-CB 3.91Å; L119-V146 HydrophobicContact CD2-CG2 3.74Å; V142-V146 HydrophobicContact CG1-CG1 4.27Å; V142-V146 WeakPolarHBondContact O-CG1 3.37Å; V142-V146 WeakPolarHBondContact O-CG2 3.42Å; V142-V146 PolarHBondContact O-N 3.4Å; I143-V146 WeakPolarHBondContact O-CG2 3.34Å; I143-V146 PolarHBondContact O-N 3.18Å; V146-A149 PolarHBondContact O-N 2.91Å; V146-T150 WeakPolarHBondContact O-CB 3.23Å; V146-T150 PolarHBondContact O-N 3.15Å; V146-T150 PolarHBondContact O-OG1 3.41Å
147G95.6Very high94.2Very high3 Ų355.9 Ų55.93%0.03131%0.313CS..Hα-helixtrans-62.3-45.6173.200000112.1I143 T150 F151I143-G147 PolarHBondContact O-N 3.3Å; G147-T150 PolarHBondContact O-N 3.11Å; G147-F151 PolarHBondContact O-N 3.36Å
148L96.8Very high94.5Very high102 Ų10252.5 Ų52.553%0.53430%0.295SS..Hα-helixtrans-63.6-42.9174.618061.7000111.7A144 K145 T150 F151 L152A144-L148 VanDerWaalsContact O-CB 3.3Å; A144-L148 WeakPolarHBondContact O-CB 3.45Å; A144-L148 PolarHBondContact O-N 2.89Å; K145-L148 PolarHBondContact O-N 3.36Å; L148-T150 VanDerWaalsContact C-N 3.33Å; L148-T150 PolarHBondContact O-N 2.84Å; L148-F151 PolarHBondContact O-N 3.31Å; L148-L152 HydrophobicContact CD1-CD1 4.15Å; L148-L152 HydrophobicContact CD1-CG 4.08Å; L148-L152 HydrophobicContact CG-CD1 3.93Å; L148-L152 HydrophobicContact CG-CG 4.29Å; L148-L152 WeakPolarHBondContact O-CB 3.44Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.3Å; L148-L152 PolarHBondContact O-N 3.46Å
149A97.4Very high94.8Very high57 Ų5755.7 Ų55.747%0.47131%0.311SS..Hα-helixtrans-61.6-41177.400000111.9K145 V146 L152 R153K145-A149 VanDerWaalsContact O-CB 3.3Å; K145-A149 WeakPolarHBondContact O-CB 3.12Å; K145-A149 PolarHBondContact O-N 3.45Å; V146-A149 PolarHBondContact O-N 2.91Å; A149-L152 PolarHBondContact O-N 2.98Å; A149-R153 VanDerWaalsContact O-CB 3.28Å; A149-R153 WeakPolarHBondContact O-CB 3.5Å; A149-R153 PolarHBondContact O-N 3.08Å
150T96.8Very high94.9Very high11 Ų1156.3 Ų56.37%0.06731%0.313CS..Hα-helixtrans-61.5-46174.5-64.10000111.6M112 V146 G147 L148 R153 G154M112-T150 HydrophobicContact SD-CG2 3.73Å; V146-T150 WeakPolarHBondContact O-CB 3.23Å; V146-T150 PolarHBondContact O-N 3.15Å; V146-T150 PolarHBondContact O-OG1 3.41Å; G147-T150 PolarHBondContact O-N 3.11Å; L148-T150 VanDerWaalsContact C-N 3.33Å; L148-T150 PolarHBondContact O-N 2.84Å; T150-R153 PolarHBondContact O-N 2.88Å; T150-G154 PolarHBondContact O-N 2.87Å; T150-G154 VanDerWaalsContact O-N 3.14Å
151F96.6Very high94.8Very high72 Ų7253 Ų5332%0.31630%0.295SS..Hα-helixtrans-61.8-48.7176.4176.6-104.9000112T108 F109 M112 G147 L148 R153 G154 V155T108-F151 HydrophobicContact CG2-CE2 4.26Å; F109-F151 HydrophobicContact CE2-CE2 4.47Å; F109-F151 HydrophobicContact CZ-CE2 4.06Å; M112-F151 HydrophobicContact SD-CB 3.94Å; G147-F151 PolarHBondContact O-N 3.36Å; L148-F151 PolarHBondContact O-N 3.31Å; F151-R153 VanDerWaalsContact C-N 3.34Å; F151-R153 PolarHBondContact O-N 2.87Å; F151-G154 PolarHBondContact O-N 3.46Å; F151-G154 VanDerWaalsContact O-N 3.12Å; F151-V155 HydrophobicContact CD1-CG2 4.32Å; F151-V155 HydrophobicContact CE1-CG2 3.84Å; F151-V155 HydrophobicContact CE2-CG2 4.11Å; F151-V155 HydrophobicContact CZ-CG2 3.72Å; F151-V155 PolarHBondContact O-N 3.49Å
152L97.3Very high94.9Very high80 Ų8050 Ų5042%0.41928%0.275SS..Hα-helixtrans-62.7-39.1179-70.8176.2000112.1L148 A149 G154 V155 L156L148-L152 HydrophobicContact CD1-CD1 4.15Å; L148-L152 HydrophobicContact CD1-CG 4.08Å; L148-L152 HydrophobicContact CG-CD1 3.93Å; L148-L152 HydrophobicContact CG-CG 4.29Å; L148-L152 WeakPolarHBondContact O-CB 3.44Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.3Å; L148-L152 PolarHBondContact O-N 3.46Å; A149-L152 PolarHBondContact O-N 2.98Å; L152-G154 VanDerWaalsContact C-N 3.31Å; L152-G154 PolarHBondContact O-N 2.81Å; L152-V155 PolarHBondContact O-N 3.35Å; L152-L156 VanDerWaalsContact O-CB 3.31Å; L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 WeakPolarHBondContact O-CG 3.26Å; L152-L156 PolarHBondContact O-N 3.2Å
153R96.3Very high94.9Very high56 Ų5652.1 Ų52.121%0.21128%0.279CS..Hα-helixtrans-55.7-46.9172.2170-176.1169.7-138.121.9111A149 T150 F151 L157 L207 I208 F211 D212A149-R153 VanDerWaalsContact O-CB 3.28Å; A149-R153 WeakPolarHBondContact O-CB 3.5Å; A149-R153 PolarHBondContact O-N 3.08Å; T150-R153 PolarHBondContact O-N 2.88Å; F151-R153 VanDerWaalsContact C-N 3.34Å; F151-R153 PolarHBondContact O-N 2.87Å; R153-L157 HydrophobicContact CG-CD1 3.95Å; R153-L157 WeakPolarHBondContact O-CB 3.24Å; R153-L157 VanDerWaalsContact O-CG 3.3Å; R153-L157 WeakPolarHBondContact O-CG 3.29Å; R153-L157 PolarHBondContact O-N 3.43Å; R153-L157 VanDerWaalsContact O-N 3.13Å; R153-L207 PolarHBondContact NH2-O 3.23Å; R153-I208 VanDerWaalsContact NH2-CA 3.29Å; R153-I208 PolarHBondContact NH2-O 2.91Å; R153-F211 VanDerWaalsContact NH2-CD1 3.32Å; R153-D212 IonicContact CZ-OD1 3.42Å; R153-D212 IonicContact NH1-OD1 2.67Å; R153-D212 PolarHBondContact NH1-OD1 3.43Å; R153-D212 IonicContact NH1-OD2 3Å; R153-D212 IonicContact NH2-OD1 3.54Å; R153-D212 PolarHBondContact NH2-OD1 2.9Å
154G94.5Very high94.9Very high1 Ų154.2 Ų54.21%0.0129%0.29CS..Hα-helixtrans-59.9-49.9175.900000112.2T150 F151 L152 L156 L157 I158T150-G154 PolarHBondContact O-N 2.87Å; T150-G154 VanDerWaalsContact O-N 3.14Å; F151-G154 PolarHBondContact O-N 3.46Å; F151-G154 VanDerWaalsContact O-N 3.12Å; L152-G154 VanDerWaalsContact C-N 3.31Å; L152-G154 PolarHBondContact O-N 2.81Å; G154-L156 PolarHBondContact O-N 3.29Å; G154-L157 PolarHBondContact O-N 3.16Å; G154-I158 WeakPolarHBondContact O-CB 3.32Å; G154-I158 WeakPolarHBondContact O-CG1 3.49Å; G154-I158 PolarHBondContact O-N 2.8Å
155V96.1Very high94.8Very high26 Ų2651.5 Ų51.516%0.15827%0.268CS..Hα-helixtrans-59.6-50.6178.8171.10000111.7F104 T108 F151 L152 L157 I158 I159F104-V155 HydrophobicContact CZ-CG1 4.22Å; F104-V155 HydrophobicContact CZ-CG2 4.3Å; T108-V155 HydrophobicContact CG2-CG2 3.83Å; F151-V155 HydrophobicContact CD1-CG2 4.32Å; F151-V155 HydrophobicContact CE1-CG2 3.84Å; F151-V155 HydrophobicContact CE2-CG2 4.11Å; F151-V155 HydrophobicContact CZ-CG2 3.72Å; F151-V155 PolarHBondContact O-N 3.49Å; L152-V155 PolarHBondContact O-N 3.35Å; V155-L157 VanDerWaalsContact C-N 3.31Å; V155-L157 PolarHBondContact O-N 3.23Å; V155-I158 PolarHBondContact O-N 2.95Å; V155-I159 HydrophobicContact CG1-CD1 3.66Å; V155-I159 HydrophobicContact CG1-CG1 4.24Å; V155-I159 VanDerWaalsContact O-CG1 3.31Å; V155-I159 WeakPolarHBondContact O-CG1 3.31Å; V155-I159 PolarHBondContact O-N 2.98Å
156L96.6Very high94.7Very high118 Ų11848.4 Ų48.462%0.61825%0.254SS*.Hα-helixtrans-63.9-34.5-175.5-70.3171.9000112.9L152 G154 P160L152-L156 VanDerWaalsContact O-CB 3.31Å; L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 WeakPolarHBondContact O-CG 3.26Å; L152-L156 PolarHBondContact O-N 3.2Å; G154-L156 PolarHBondContact O-N 3.29Å; L156-P160 WeakPolarHBondContact O-CD 3.31Å
157L94.8Very high94.4Very high37 Ų3754.8 Ų54.819%0.19427%0.273CS..Hα-helixtrans-81.3-26.8178.1-67.6176.3000112.9R153 G154 V155 Y200 V204 I208R153-L157 HydrophobicContact CG-CD1 3.95Å; R153-L157 WeakPolarHBondContact O-CB 3.24Å; R153-L157 VanDerWaalsContact O-CG 3.3Å; R153-L157 WeakPolarHBondContact O-CG 3.29Å; R153-L157 PolarHBondContact O-N 3.43Å; R153-L157 VanDerWaalsContact O-N 3.13Å; G154-L157 PolarHBondContact O-N 3.16Å; V155-L157 VanDerWaalsContact C-N 3.31Å; V155-L157 PolarHBondContact O-N 3.23Å; L157-Y200 WeakPolarHBondContact O-CE1 3.25Å; L157-Y200 PolarHBondContact O-OH 3.07Å; L157-V204 HydrophobicContact CB-CG1 4.31Å; L157-V204 HydrophobicContact CB-CG2 4.29Å; L157-I208 HydrophobicContact CB-CD1 4.3Å; L157-I208 HydrophobicContact CD1-CD1 3.85Å; L157-I208 HydrophobicContact CD1-CG1 3.65Å
158I95.2Very high94.2Very high3 Ų355.3 Ų55.32%0.01528%0.275CS..Hα-helixtrans-90.9-22.3-178.3-60.3-56.5000113.1F104 H107 G154 V155 F161 T162 V204F104-I158 HydrophobicContact CD2-CB 4.38Å; F104-I158 HydrophobicContact CD2-CG2 3.65Å; F104-I158 HydrophobicContact CE2-CB 4.32Å; F104-I158 HydrophobicContact CE2-CG2 4.09Å; F104-I158 HydrophobicContact CG-CG2 4.39Å; H107-I158 HydrophobicContact CB-CD1 3.6Å; H107-I158 HydrophobicContact CB-CG1 4Å; H107-I158 HydrophobicContact CB-CG2 4.05Å; G154-I158 WeakPolarHBondContact O-CB 3.32Å; G154-I158 WeakPolarHBondContact O-CG1 3.49Å; G154-I158 PolarHBondContact O-N 2.8Å; V155-I158 PolarHBondContact O-N 2.95Å; I158-F161 WeakPolarHBondContact O-CB 3.4Å; I158-F161 PolarHBondContact O-N 3.42Å; I158-T162 HydrophobicContact CG2-CG2 4.05Å; I158-T162 PolarHBondContact O-N 3.39Å; I158-T162 PolarHBondContact O-OG1 3.47Å; I158-T162 VanDerWaalsContact O-OG1 3.09Å; I158-V204 HydrophobicContact CD1-CG1 3.72Å
159I94.5Very high93.9Very high86 Ų8652.6 Ų52.644%0.44126%0.263SS..Hα-helixtrans-57.4-52.5173.4-73.3168.1000111.8F104 V155 F161 T162 F163F104-I159 HydrophobicContact CE2-CG1 3.88Å; V155-I159 HydrophobicContact CG1-CD1 3.66Å; V155-I159 HydrophobicContact CG1-CG1 4.24Å; V155-I159 VanDerWaalsContact O-CG1 3.31Å; V155-I159 WeakPolarHBondContact O-CG1 3.31Å; V155-I159 PolarHBondContact O-N 2.98Å; I159-F161 VanDerWaalsContact C-N 3.29Å; I159-F161 PolarHBondContact O-N 2.96Å; I159-T162 PolarHBondContact O-N 2.93Å; I159-T162 PolarHBondContact O-OG1 2.86Å; I159-F163 WeakPolarHBondContact O-CB 3.27Å; I159-F163 PolarHBondContact O-N 3.35Å
160P93.1Very high93.6Very high46 Ų4650.3 Ų50.330%0.29924%0.243SC..Hα-helixtrans-66-34179.5-20.433.5000112.2L156 F163 L164 Y200L156-P160 WeakPolarHBondContact O-CD 3.31Å; P160-F163 PolarHBondContact O-N 3.42Å; P160-L164 WeakPolarHBondContact O-CB 3.34Å; P160-L164 WeakPolarHBondContact O-CG 3.16Å; P160-L164 PolarHBondContact O-N 3.38Å; P160-Y200 HydrophobicContact CB-CE1 4.03Å; P160-Y200 WeakPolarHBondContact CB-OH 3.15Å; P160-Y200 WeakPolarHBondContact CG-OH 3.37Å
161F87.6Confident93.1Very high6 Ų653.1 Ų53.13%0.02626%0.262CS..Hα-helixtrans-57.4-49.9176.7-178.3-87.9000112M103 H107 I158 I159 T165 H183 Y200M103-F161 HydrophobicContact CG-CE1 4.31Å; M103-F161 HydrophobicContact SD-CD1 4.47Å; M103-F161 HydrophobicContact SD-CE1 3.98Å; H107-F161 AromaticContact CD2-CE1 3.86Å; H107-F161 AromaticContact CD2-CZ 3.6Å; H107-F161 AromaticContact NE2-CE1 3.86Å; H107-F161 AromaticContact NE2-CZ 3.58Å; I158-F161 WeakPolarHBondContact O-CB 3.4Å; I158-F161 PolarHBondContact O-N 3.42Å; I159-F161 VanDerWaalsContact C-N 3.29Å; I159-F161 PolarHBondContact O-N 2.96Å; F161-T165 PolarHBondContact O-N 2.92Å; F161-T165 PolarHBondContact O-OG1 3.47Å; F161-T165 VanDerWaalsContact O-OG1 3.07Å; F161-H183 AromaticContact CD1-CD2 3.75Å; F161-H183 AromaticContact CD2-CE1 3.89Å; F161-H183 AromaticContact CD2-NE2 3.94Å; F161-H183 HydrophobicContact CE1-CB 3.49Å; F161-H183 VanDerWaalsContact CE1-CB 3.49Å; F161-H183 AromaticContact CE1-CD2 3.19Å; F161-H183 WeakPolarHBondContact CE1-CD2 3.19Å; F161-H183 AromaticContact CE1-CG 3.26Å; F161-H183 AromaticContact CE1-ND1 3.86Å; F161-H183 AromaticContact CE1-NE2 3.78Å; F161-H183 HydrophobicContact CE2-CB 4.4Å; F161-H183 AromaticContact CE2-CD2 3.88Å; F161-H183 AromaticContact CE2-CE1 3.3Å; F161-H183 WeakPolarHBondContact CE2-CE1 3.3Å; F161-H183 AromaticContact CE2-CG 3.69Å; F161-H183 AromaticContact CE2-ND1 3.35Å; F161-H183 VanDerWaalsContact CE2-ND1 3.35Å; F161-H183 WeakPolarHBondContact CE2-ND1 3.31Å; F161-H183 AromaticContact CE2-NE2 3.67Å; F161-H183 HydrophobicContact CZ-CB 3.3Å; F161-H183 AromaticContact CZ-CD2 3.3Å; F161-H183 WeakPolarHBondContact CZ-CD2 3.41Å; F161-H183 AromaticContact CZ-CE1 3.46Å; F161-H183 VanDerWaalsContact CZ-CE1 3.46Å; F161-H183 WeakPolarHBondContact CZ-CE1 3.39Å; F161-H183 AromaticContact CZ-CG 2.95Å; F161-H183 AromaticContact CZ-ND1 3.09Å; F161-H183 WeakPolarHBondContact CZ-ND1 3.42Å; F161-H183 AromaticContact CZ-NE2 3.62Å; F161-Y200 HydrophobicContact CB-CD1 4.05Å; F161-Y200 HydrophobicContact CB-CE1 3.83Å; F161-Y200 HydrophobicContact CD2-CD1 4.16Å
162T92.5Very high92.5Very high21 Ų2157.5 Ų57.513%0.12928%0.276CS..Hα-helixtrans-70.5-36.9178.852.90000112.1F104 I158 I159 T165 K166F104-T162 HydrophobicContact CB-CG2 3.97Å; F104-T162 HydrophobicContact CD2-CG2 4.17Å; I158-T162 HydrophobicContact CG2-CG2 4.05Å; I158-T162 PolarHBondContact O-N 3.39Å; I158-T162 PolarHBondContact O-OG1 3.47Å; I158-T162 VanDerWaalsContact O-OG1 3.09Å; I159-T162 PolarHBondContact O-N 2.93Å; I159-T162 PolarHBondContact O-OG1 2.86Å; T162-T165 PolarHBondContact O-N 3.29Å; T162-K166 WeakPolarHBondContact O-CB 3.18Å; T162-K166 PolarHBondContact O-N 3.47Å
163F93.6Very high92Very high106 Ų10655.9 Ų55.947%0.46528%0.278SS..Hα-helixtrans-65.2-42.9175.5-177.4-99.2000112.8I159 P160 T165 K166 R167I159-F163 WeakPolarHBondContact O-CB 3.27Å; I159-F163 PolarHBondContact O-N 3.35Å; P160-F163 PolarHBondContact O-N 3.42Å; F163-T165 VanDerWaalsContact C-N 3.26Å; F163-T165 PolarHBondContact O-N 3.37Å; F163-K166 WeakPolarHBondContact O-CB 3.44Å; F163-K166 PolarHBondContact O-N 3Å; F163-R167 HydrophobicContact CD1-CG 4.21Å; F163-R167 HydrophobicContact CE1-CG 3.93Å; F163-R167 HydrophobicContact CZ-CG 4.16Å; F163-R167 VanDerWaalsContact O-CG 3.32Å; F163-R167 WeakPolarHBondContact O-CG 3.42Å; F163-R167 PolarHBondContact O-N 3.19Å; F163-R167 VanDerWaalsContact O-N 3.09Å
164L92.8Very high91.6Very high48 Ų4855.5 Ų55.525%0.25128%0.281SS..Hα-helixtrans-60.8-39.2175.8-73.7170.3000111.1P160 R167 V196 N197 Y200P160-L164 WeakPolarHBondContact O-CB 3.34Å; P160-L164 WeakPolarHBondContact O-CG 3.16Å; P160-L164 PolarHBondContact O-N 3.38Å; L164-R167 PolarHBondContact O-N 3.04Å; L164-V196 HydrophobicContact CD1-CG1 4.33Å; L164-V196 HydrophobicContact CD2-CG1 4.26Å; L164-N197 WeakPolarHBondContact CB-OD1 3.44Å; L164-N197 PolarHBondContact O-OD1 3.11Å; L164-Y200 HydrophobicContact CD1-CD1 4.08Å; L164-Y200 HydrophobicContact CD1-CD2 4.45Å; L164-Y200 HydrophobicContact CD1-CG 3.92Å
165T91.5Very high91.2Very high0 Ų059.6 Ų59.60%030%0.302CS..Hα-helixtrans-66.2-43.2174.7-59.60000111.4L100 M103 F161 T162 F163 R167 L168 Y170 H183 V186 N197L100-T165 HydrophobicContact CD2-CG2 3.93Å; M103-T165 HydrophobicContact CE-CG2 4.32Å; M103-T165 HydrophobicContact SD-CG2 4.45Å; F161-T165 PolarHBondContact O-N 2.92Å; F161-T165 PolarHBondContact O-OG1 3.47Å; F161-T165 VanDerWaalsContact O-OG1 3.07Å; T162-T165 PolarHBondContact O-N 3.29Å; F163-T165 VanDerWaalsContact C-N 3.26Å; F163-T165 PolarHBondContact O-N 3.37Å; T165-R167 PolarHBondContact O-N 3.11Å; T165-L168 WeakPolarHBondContact O-CB 3.33Å; T165-L168 PolarHBondContact O-N 3.29Å; T165-Y170 VanDerWaalsContact CG2-OH 3.31Å; T165-Y170 WeakPolarHBondContact CG2-OH 3.42Å; T165-Y170 PolarHBondContact O-OH 3.06Å; T165-H183 PolarHBondContact OG1-CD2 2.77Å; T165-H183 PolarHBondContact OG1-NE2 2.57Å; T165-V186 HydrophobicContact CG2-CB 4.41Å; T165-V186 HydrophobicContact CG2-CG1 3.72Å; T165-N197 PolarHBondContact N-OD1 3.17Å
166K92.4Very high90.8Very high88 Ų8858.4 Ų58.438%0.38329%0.294SS..Hα-helixtrans-58.9-32.6177.1-173.3163.8-167.1156.90113.2F96 D97 L100 T162 F163 L168F96-K166 HydrophobicContact CE1-CG 4.07Å; F96-K166 HydrophobicContact CZ-CG 4.45Å; D97-K166 IonicContact OD1-NZ 3.4Å; D97-K166 PolarHBondContact OD1-NZ 3.21Å; L100-K166 HydrophobicContact CD1-CB 3.73Å; L100-K166 HydrophobicContact CD1-CD 3.85Å; L100-K166 HydrophobicContact CD1-CG 3.78Å; T162-K166 WeakPolarHBondContact O-CB 3.18Å; T162-K166 PolarHBondContact O-N 3.47Å; F163-K166 WeakPolarHBondContact O-CB 3.44Å; F163-K166 PolarHBondContact O-N 3Å; K166-L168 VanDerWaalsContact C-N 3.33Å
167R91.4Very high90.1Very high184 Ų18455.6 Ų55.669%0.69428%0.283SS*.THydrogen-bonded Turntrans-80.2-8.6-177-71.4-69.5-163.2177.35.8114.4F163 L164 T165F163-R167 HydrophobicContact CD1-CG 4.21Å; F163-R167 HydrophobicContact CE1-CG 3.93Å; F163-R167 HydrophobicContact CZ-CG 4.16Å; F163-R167 VanDerWaalsContact O-CG 3.32Å; F163-R167 WeakPolarHBondContact O-CG 3.42Å; F163-R167 PolarHBondContact O-N 3.19Å; F163-R167 VanDerWaalsContact O-N 3.09Å; L164-R167 PolarHBondContact O-N 3.04Å; T165-R167 PolarHBondContact O-N 3.11Å
168L90.6Very high89.6Confident13 Ų1355.1 Ų55.17%0.06828%0.28CS..SBendtrans-70.8143-179.1-73.2171.5000111.8T165 K166 Y170 A187 V194T165-L168 WeakPolarHBondContact O-CB 3.33Å; T165-L168 PolarHBondContact O-N 3.29Å; K166-L168 VanDerWaalsContact C-N 3.33Å; L168-Y170 HydrophobicContact CB-CE2 4.02Å; L168-Y170 WeakPolarHBondContact O-CD2 3.4Å; L168-Y170 WeakPolarHBondContact O-CE2 3.07Å; L168-A187 HydrophobicContact CD1-CB 3.86Å; L168-V194 HydrophobicContact CD1-CG1 4.42Å
169P90.6Very high89.1Confident45 Ų4555 Ų5529%0.29228%0.279SS..PPolyproline II helixtrans-82.6116.6171.331.3-31.2000110.3L9 S190 C191L9-P169 HydrophobicContact CB-CB 4.1Å; L9-P169 HydrophobicContact CD1-CB 4.15Å; P169-S190 CarbonylContact O-C 3.5Å; P169-S190 WeakPolarHBondContact O-CA 3.21Å; P169-S190 WeakPolarHBondContact O-CB 3.32Å; P169-C191 PolarHBondContact O-N 3.29Å
170Y90.1Very high88.8Confident10 Ų1051.6 Ų51.64%0.03926%0.261CS..BIsolated β-bridgetrans-93.8122.7-179.1-64-88.9000110.4L9 P11 F14 F96 T165 L168 V186 L189L9-Y170 WeakPolarHBondContact O-CA 3.5Å; L9-Y170 WeakPolarHBondContact O-CB 3.39Å; L9-Y170 PolarHBondContact O-N 2.98Å; L9-Y170 VanDerWaalsContact O-O 3.09Å; P11-Y170 HydrophobicContact CG-CG 4.46Å; F14-Y170 HydrophobicContact CE1-CD1 4.28Å; F14-Y170 HydrophobicContact CZ-CD1 4.13Å; F14-Y170 HydrophobicContact CZ-CE1 4.03Å; F96-Y170 AromaticContact CE2-CD2 3.97Å; F96-Y170 HydrophobicContact CE2-CD2 3.97Å; F96-Y170 AromaticContact CE2-CE2 3.51Å; F96-Y170 HydrophobicContact CE2-CE2 3.51Å; F96-Y170 AromaticContact CE2-CZ 3.92Å; F96-Y170 HydrophobicContact CZ-CD2 4.43Å; F96-Y170 AromaticContact CZ-CE2 3.78Å; F96-Y170 HydrophobicContact CZ-CE2 3.78Å; T165-Y170 VanDerWaalsContact CG2-OH 3.31Å; T165-Y170 WeakPolarHBondContact CG2-OH 3.42Å; T165-Y170 PolarHBondContact O-OH 3.06Å; L168-Y170 HydrophobicContact CB-CE2 4.02Å; L168-Y170 WeakPolarHBondContact O-CD2 3.4Å; L168-Y170 WeakPolarHBondContact O-CE2 3.07Å; Y170-V186 HydrophobicContact CE1-CG1 3.75Å; Y170-V186 WeakPolarHBondContact CE1-O 3.45Å; Y170-V186 WeakPolarHBondContact OH-CG1 3.48Å; Y170-L189 HydrophobicContact CD1-CB 4.04Å
171C87.4Confident88.6Confident69 Ų6949.4 Ų49.447%0.46625%0.247SC..  trans-147.1-3.2179.8690000114.4L9 G173 L189 C191L9-C171 HydrophobicContact CD2-CB 3.79Å; C171-G173 VanDerWaalsContact C-N 3.26Å; C171-G173 PolarHBondContact O-N 3.14Å; C171-L189 PolarHBondContact N-O 3.48Å; C171-C191 HydrophobicContact CB-CB 4.43Å; C171-C191 WeakPolarHBondContact CB-SG 3.33Å; C171-C191 WeakPolarHBondContact SG-CB 3.27Å; C171-C191 CovalentContact SG-SG 2.03Å; C171-C191 PolarHBondContact SG-SG 3.29Å
172R84.4Confident88.7Confident165 Ų16550.9 Ų50.962%0.62326%0.255SS*.SBendtrans-94.835.6-178.8-57.6178.2171.9168.3-2.7112.3L189 S190R172-L189 VanDerWaalsContact CB-O 3.29Å; R172-L189 WeakPolarHBondContact CB-O 3.45Å; R172-L189 PolarHBondContact N-O 3.37Å; R172-L189 VanDerWaalsContact N-O 3.12Å; R172-S190 PolarHBondContact NE-O 3.5Å; R172-S190 PolarHBondContact NH1-O 3.12Å
173G85.7Confident88.5Confident45 Ų4550.2 Ų50.246%0.46425%0.25SS..  trans85.1-168.8-174.800000113.7C171C171-G173 VanDerWaalsContact C-N 3.26Å; C171-G173 PolarHBondContact O-N 3.14Å
174N87.7Confident88.2Confident49 Ų4947.8 Ų47.826%0.26224%0.241SC..SBendtrans-131.513.4-173.867.7-20.6000113.6P11 S13 F14 I15P11-N174 HydrophobicContact CB-CB 4.48Å; S13-N174 WeakPolarHBondContact O-CB 3.46Å; S13-N174 PolarHBondContact O-ND2 3.43Å; F14-N174 CarbonylContact C-O 3.51Å; F14-N174 VanDerWaalsContact CA-O 3.29Å; F14-N174 WeakPolarHBondContact CA-O 3.48Å; F14-N174 HydrophobicContact CD1-CB 4.24Å; I15-N174 PolarHBondContact N-O 3.31Å
175I86.9Confident88Confident87 Ų8746.4 Ų46.445%0.44624%0.236SC..EExtended strand (participates in β ladder)trans-92.8124.4-176.6-57.9175.4000110I15 N17I15-I175 HydrophobicContact CB-CG1 4.4Å; I15-I175 HydrophobicContact CD1-CG1 4.46Å; N17-I175 HydrophobicContact CB-CG2 4.48Å; N17-I175 VanDerWaalsContact ND2-CG2 3.29Å; N17-I175 WeakPolarHBondContact ND2-CG2 3.38Å
176L86.5Confident87.9Confident0 Ų046.4 Ų46.40%024%0.236CC..EExtended strand (participates in β ladder)trans-106.2122.9172.8-99.677.1000110.1F14 I15 L16 N17 H178 V186 L189F14-L176 HydrophobicContact CB-CD1 4.15Å; F14-L176 HydrophobicContact CD1-CD1 3.71Å; F14-L176 HydrophobicContact CE1-CD1 4.28Å; F14-L176 HydrophobicContact CG-CD1 3.99Å; I15-L176 PolarHBondContact O-N 3.42Å; L16-L176 HydrophobicContact CD2-CB 3.81Å; L16-L176 HydrophobicContact CD2-CD2 3.97Å; N17-L176 PolarHBondContact N-O 3.43Å; L176-H178 PolarHBondContact O-N 2.79Å; L176-V186 HydrophobicContact CD1-CG2 4.43Å; L176-V186 HydrophobicContact CD2-CG2 3.64Å; L176-L189 HydrophobicContact CD1-CD1 3.41Å; L176-L189 VanDerWaalsContact CD1-CD1 3.41Å; L176-L189 HydrophobicContact CD1-CG 4.45Å
177P83.3Confident87.8Confident60 Ų6042.3 Ų42.339%0.3922%0.218SC..SBendtrans-80.251.9175.735.4-36.1000111.2P20 I277P20-P177 HydrophobicContact CG-CB 3.91Å; P177-I277 WeakPolarHBondContact O-CD1 3.41Å; P177-I277 WeakPolarHBondContact O-CG1 3.16Å
178H84.4Confident87.6Confident27 Ų2738.1 Ų38.113%0.12521%0.205CC..SBendtrans-144.8165.9179.2-74.4-88.8000111L16 G18 L176 Y180 S185L16-H178 WeakPolarHBondContact CB-O 3.46Å; G18-H178 PolarHBondContact N-O 3.06Å; G18-H178 VanDerWaalsContact N-O 3.12Å; G18-H178 CarbonylContact O-C 3.53Å; L176-H178 PolarHBondContact O-N 2.79Å; H178-Y180 VanDerWaalsContact CB-O 3.25Å; H178-Y180 WeakPolarHBondContact CB-O 3.11Å; H178-S185 PolarHBondContact CD2-OG 2.73Å; H178-S185 PolarHBondContact NE2-OG 2.96Å
179T84.1Confident87.5Confident0 Ų038.6 Ų38.60%021%0.207CC..SBendtrans-85.7-11.6171.550.30000113.2V19 A83 F87 I277 N281V19-T179 HydrophobicContact CG2-CG2 4.41Å; A83-T179 HydrophobicContact CB-CG2 4.36Å; F87-T179 HydrophobicContact CE1-CG2 4Å; F87-T179 HydrophobicContact CZ-CG2 3.63Å; T179-I277 HydrophobicContact CG2-CG2 4.43Å; T179-N281 VanDerWaalsContact OG1-CG 3.24Å; T179-N281 PolarHBondContact OG1-ND2 2.85Å; T179-N281 PolarHBondContact OG1-OD1 3.47Å
180Y88.2Confident87.5Confident15 Ų1536.4 Ų36.46%0.05919%0.193CC..SBendtrans-146.9169.1-179.467.9-92.9000110.7I106 H178 D182 A280 L284I106-Y180 HydrophobicContact CD1-CD2 3.52Å; I106-Y180 HydrophobicContact CD1-CE2 4.23Å; I106-Y180 HydrophobicContact CD1-CG 4.11Å; H178-Y180 VanDerWaalsContact CB-O 3.25Å; H178-Y180 WeakPolarHBondContact CB-O 3.11Å; Y180-D182 HydrophobicContact CD2-CB 4.44Å; Y180-D182 HydrophobicContact CE2-CB 3.82Å; Y180-D182 PolarHBondContact O-N 3.34Å; Y180-A280 HydrophobicContact CE1-CB 4.3Å; Y180-L284 HydrophobicContact CD1-CD1 4.1Å; Y180-L284 HydrophobicContact CE1-CD1 3.79Å
181C90Very high87.5Confident0 Ų038.8 Ų38.80%021%0.211CC..  trans-77.986.1178.5-73.30000113.4C99 M103 V186C99-C181 WeakPolarHBondContact CA-SG 3.16Å; C99-C181 HydrophobicContact CB-CB 4.08Å; C99-C181 WeakPolarHBondContact CB-SG 3.37Å; C99-C181 WeakPolarHBondContact O-CB 3.33Å; C99-C181 WeakPolarHBondContact SG-CB 3.29Å; C99-C181 CovalentContact SG-SG 2.02Å; C99-C181 PolarHBondContact SG-SG 2.85Å; M103-C181 HydrophobicContact CB-CB 4.44Å; C181-V186 HydrophobicContact CB-CG2 4.46Å
182D89.1Confident87.6Confident36 Ų3636.7 Ų36.719%0.19320%0.2CC..  trans-73.9138.9169.7177.975.7000112Y180 M184 S185 V186Y180-D182 HydrophobicContact CD2-CB 4.44Å; Y180-D182 HydrophobicContact CE2-CB 3.82Å; Y180-D182 PolarHBondContact O-N 3.34Å; D182-M184 PolarHBondContact OD2-N 2.97Å; D182-S185 PolarHBondContact O-N 3.37Å; D182-S185 PolarHBondContact OD2-N 3.13Å; D182-S185 PolarHBondContact OD2-OG 3.42Å; D182-V186 VanDerWaalsContact O-CG2 3.31Å; D182-V186 WeakPolarHBondContact O-CG2 3.39Å; D182-V186 PolarHBondContact O-N 2.94Å
183H88.8Confident87.7Confident8 Ų833.9 Ų33.94%0.03720%0.198CC..Hα-helixtrans-59.7-52.3-176170.5-119.7000114.1M103 F161 T165 S185 V186 A187 N197M103-H183 HydrophobicContact CE-CB 4.4Å; M103-H183 HydrophobicContact CG-CB 4.46Å; M103-H183 HydrophobicContact SD-CB 3.86Å; F161-H183 AromaticContact CD1-CD2 3.75Å; F161-H183 AromaticContact CD2-CE1 3.89Å; F161-H183 AromaticContact CD2-NE2 3.94Å; F161-H183 HydrophobicContact CE1-CB 3.49Å; F161-H183 VanDerWaalsContact CE1-CB 3.49Å; F161-H183 AromaticContact CE1-CD2 3.19Å; F161-H183 WeakPolarHBondContact CE1-CD2 3.19Å; F161-H183 AromaticContact CE1-CG 3.26Å; F161-H183 AromaticContact CE1-ND1 3.86Å; F161-H183 AromaticContact CE1-NE2 3.78Å; F161-H183 HydrophobicContact CE2-CB 4.4Å; F161-H183 AromaticContact CE2-CD2 3.88Å; F161-H183 AromaticContact CE2-CE1 3.3Å; F161-H183 WeakPolarHBondContact CE2-CE1 3.3Å; F161-H183 AromaticContact CE2-CG 3.69Å; F161-H183 AromaticContact CE2-ND1 3.35Å; F161-H183 VanDerWaalsContact CE2-ND1 3.35Å; F161-H183 WeakPolarHBondContact CE2-ND1 3.31Å; F161-H183 AromaticContact CE2-NE2 3.67Å; F161-H183 HydrophobicContact CZ-CB 3.3Å; F161-H183 AromaticContact CZ-CD2 3.3Å; F161-H183 WeakPolarHBondContact CZ-CD2 3.41Å; F161-H183 AromaticContact CZ-CE1 3.46Å; F161-H183 VanDerWaalsContact CZ-CE1 3.46Å; F161-H183 WeakPolarHBondContact CZ-CE1 3.39Å; F161-H183 AromaticContact CZ-CG 2.95Å; F161-H183 AromaticContact CZ-ND1 3.09Å; F161-H183 WeakPolarHBondContact CZ-ND1 3.42Å; F161-H183 AromaticContact CZ-NE2 3.62Å; T165-H183 PolarHBondContact OG1-CD2 2.77Å; T165-H183 PolarHBondContact OG1-NE2 2.57Å; H183-S185 VanDerWaalsContact C-N 3.31Å; H183-V186 PolarHBondContact O-N 3.49Å; H183-A187 WeakPolarHBondContact O-CB 3.33Å; H183-A187 PolarHBondContact O-N 3.08Å; H183-N197 PolarHBondContact CE1-O 2.88Å
184M86.8Confident87.9Confident54 Ų5433.9 Ų33.927%0.26619%0.189SC..Hα-helixtrans-71.7-33.2-176.4-81.2-68.8106.100110.9D182 A187 K188 N197 A198D182-M184 PolarHBondContact OD2-N 2.97Å; M184-A187 HydrophobicContact CE-CB 4.16Å; M184-A187 PolarHBondContact O-N 3.32Å; M184-K188 WeakPolarHBondContact O-CB 3.24Å; M184-K188 WeakPolarHBondContact O-CG 3.2Å; M184-K188 PolarHBondContact O-N 3.29Å; M184-N197 HydrophobicContact CE-CB 4.3Å; M184-A198 HydrophobicContact CE-CB 4.27Å; M184-A198 HydrophobicContact SD-CB 4.23Å
185S87.2Confident88.1Confident20 Ų2038.5 Ų38.514%0.1421%0.206CC..Hα-helixtrans-66.6-40.1175.3-64.60000112.6H178 D182 H183H178-S185 PolarHBondContact CD2-OG 2.73Å; H178-S185 PolarHBondContact NE2-OG 2.96Å; D182-S185 PolarHBondContact O-N 3.37Å; D182-S185 PolarHBondContact OD2-N 3.13Å; D182-S185 PolarHBondContact OD2-OG 3.42Å; H183-S185 VanDerWaalsContact C-N 3.31Å
186V89.8Confident88.3Confident0 Ų038.4 Ų38.40%021%0.21CC..Hα-helixtrans-63.9-52.2170.31740000110.3F14 M103 T165 Y170 L176 C181 D182 H183 K188 L189F14-V186 HydrophobicContact CE2-CG1 4.37Å; F14-V186 HydrophobicContact CZ-CG1 4.14Å; M103-V186 HydrophobicContact CE-CB 3.8Å; M103-V186 HydrophobicContact CE-CG1 4.28Å; M103-V186 HydrophobicContact CE-CG2 3.54Å; T165-V186 HydrophobicContact CG2-CB 4.41Å; T165-V186 HydrophobicContact CG2-CG1 3.72Å; Y170-V186 HydrophobicContact CE1-CG1 3.75Å; Y170-V186 WeakPolarHBondContact CE1-O 3.45Å; Y170-V186 WeakPolarHBondContact OH-CG1 3.48Å; L176-V186 HydrophobicContact CD1-CG2 4.43Å; L176-V186 HydrophobicContact CD2-CG2 3.64Å; C181-V186 HydrophobicContact CB-CG2 4.46Å; D182-V186 VanDerWaalsContact O-CG2 3.31Å; D182-V186 WeakPolarHBondContact O-CG2 3.39Å; D182-V186 PolarHBondContact O-N 2.94Å; H183-V186 PolarHBondContact O-N 3.49Å; V186-K188 VanDerWaalsContact C-N 3.29Å; V186-K188 PolarHBondContact O-N 3.39Å; V186-L189 WeakPolarHBondContact O-CB 3.36Å; V186-L189 PolarHBondContact O-N 2.88Å; V186-L189 VanDerWaalsContact O-N 3.12Å
187A90.2Very high88.5Confident1 Ų138.8 Ų38.81%0.00821%0.212CC..Hα-helixtrans-59.5-36.7-174.500000113.2L168 H183 M184 L189 S190 V194L168-A187 HydrophobicContact CD1-CB 3.86Å; H183-A187 WeakPolarHBondContact O-CB 3.33Å; H183-A187 PolarHBondContact O-N 3.08Å; M184-A187 HydrophobicContact CE-CB 4.16Å; M184-A187 PolarHBondContact O-N 3.32Å; A187-L189 PolarHBondContact O-N 3.16Å; A187-S190 WeakPolarHBondContact O-CB 3.37Å; A187-S190 PolarHBondContact O-N 2.83Å; A187-S190 PolarHBondContact O-OG 3.48Å; A187-V194 HydrophobicContact CB-CG1 4.37Å; A187-V194 VanDerWaalsContact O-CG1 3.22Å; A187-V194 WeakPolarHBondContact O-CG1 3.46Å
188K88.5Confident88.8Confident96 Ų9637.8 Ų37.842%0.41721%0.209SC..Hα-helixtrans-64.1-20.4179.6-78.9174.8-178.3-1790114.2M184 V186 S190M184-K188 WeakPolarHBondContact O-CB 3.24Å; M184-K188 WeakPolarHBondContact O-CG 3.2Å; M184-K188 PolarHBondContact O-N 3.29Å; V186-K188 VanDerWaalsContact C-N 3.29Å; V186-K188 PolarHBondContact O-N 3.39Å; K188-S190 PolarHBondContact O-N 3.35Å
189L88.6Confident89.2Confident23 Ų2341.8 Ų41.812%0.1223%0.23CC..THydrogen-bonded Turntrans-73.5-12.4173.4-68.4-175.2000113.6F14 Y170 C171 R172 L176 V186 A187F14-L189 HydrophobicContact CD1-CD1 3.98Å; F14-L189 HydrophobicContact CE1-CD1 3.81Å; Y170-L189 HydrophobicContact CD1-CB 4.04Å; C171-L189 PolarHBondContact N-O 3.48Å; R172-L189 VanDerWaalsContact CB-O 3.29Å; R172-L189 WeakPolarHBondContact CB-O 3.45Å; R172-L189 PolarHBondContact N-O 3.37Å; R172-L189 VanDerWaalsContact N-O 3.12Å; L176-L189 HydrophobicContact CD1-CD1 3.41Å; L176-L189 VanDerWaalsContact CD1-CD1 3.41Å; L176-L189 HydrophobicContact CD1-CG 4.45Å; V186-L189 WeakPolarHBondContact O-CB 3.36Å; V186-L189 PolarHBondContact O-N 2.88Å; V186-L189 VanDerWaalsContact O-N 3.12Å; A187-L189 PolarHBondContact O-N 3.16Å
190S90.8Very high89.6Confident0 Ų044.7 Ų44.70%024%0.241CC..BIsolated β-bridgetrans-74.2149.2176.174.90000112.6P169 R172 A187 K188 G192 V194P169-S190 CarbonylContact O-C 3.5Å; P169-S190 WeakPolarHBondContact O-CA 3.21Å; P169-S190 WeakPolarHBondContact O-CB 3.32Å; R172-S190 PolarHBondContact NE-O 3.5Å; R172-S190 PolarHBondContact NH1-O 3.12Å; A187-S190 WeakPolarHBondContact O-CB 3.37Å; A187-S190 PolarHBondContact O-N 2.83Å; A187-S190 PolarHBondContact O-OG 3.48Å; K188-S190 PolarHBondContact O-N 3.35Å; S190-G192 VanDerWaalsContact C-N 3.31Å; S190-V194 WeakPolarHBondContact OG-CG1 3.27Å
191C90Very high89.7Confident60 Ų6044.5 Ų44.541%0.40524%0.244SC..SBendtrans-84.6-9.4164170000112.7P169 C171P169-C191 PolarHBondContact O-N 3.29Å; C171-C191 HydrophobicContact CB-CB 4.43Å; C171-C191 WeakPolarHBondContact CB-SG 3.33Å; C171-C191 WeakPolarHBondContact SG-CB 3.27Å; C171-C191 CovalentContact SG-SG 2.03Å; C171-C191 PolarHBondContact SG-SG 3.29Å
192G87.6Confident89.7Confident24 Ų2449.1 Ų49.125%0.24727%0.268CS..SBendtrans-73.6173.2-178.200000113.1S190 V194S190-G192 VanDerWaalsContact C-N 3.31Å; G192-V194 PolarHBondContact O-N 3.27Å; G192-V194 VanDerWaalsContact O-N 3.15Å
193N87.9Confident89.9Confident107 Ų10751.9 Ų51.957%0.57228%0.281SS*.  trans-74.7104.2173-175.6-2.3000110.5K195N193-K195 VanDerWaalsContact C-N 3.28Å; N193-K195 PolarHBondContact O-N 3.43Å; N193-K195 WeakPolarHBondContact OD1-CB 3.3Å; N193-K195 WeakPolarHBondContact OD1-CG 3.3Å; N193-K195 PolarHBondContact OD1-N 3.26Å
194V90.5Very high90.1Very high45 Ų4552 Ų5227%0.27328%0.282SS..THydrogen-bonded Turntrans-78.5-4.1179-62.10000114.3L168 A187 S190 G192 V196 N197 A198L168-V194 HydrophobicContact CD1-CG1 4.42Å; A187-V194 HydrophobicContact CB-CG1 4.37Å; A187-V194 VanDerWaalsContact O-CG1 3.22Å; A187-V194 WeakPolarHBondContact O-CG1 3.46Å; S190-V194 WeakPolarHBondContact OG-CG1 3.27Å; G192-V194 PolarHBondContact O-N 3.27Å; G192-V194 VanDerWaalsContact O-N 3.15Å; V194-V196 VanDerWaalsContact C-N 3.29Å; V194-V196 PolarHBondContact O-N 2.97Å; V194-N197 WeakPolarHBondContact O-CB 3.43Å; V194-N197 PolarHBondContact O-N 3.04Å; V194-N197 VanDerWaalsContact O-N 3.09Å; V194-A198 PolarHBondContact O-N 3.47Å
195K90.4Very high90.3Very high145 Ų14552.2 Ų52.263%0.6329%0.293SS*.Hα-helixtrans-56.5-40.8-175.2-72.1179-178.2-1760112.9N193 A198 I199N193-K195 VanDerWaalsContact C-N 3.28Å; N193-K195 PolarHBondContact O-N 3.43Å; N193-K195 WeakPolarHBondContact OD1-CB 3.3Å; N193-K195 WeakPolarHBondContact OD1-CG 3.3Å; N193-K195 PolarHBondContact OD1-N 3.26Å; K195-A198 PolarHBondContact O-N 2.81Å; K195-I199 WeakPolarHBondContact O-CB 3.37Å; K195-I199 VanDerWaalsContact O-CG1 3.25Å; K195-I199 WeakPolarHBondContact O-CG1 3.35Å; K195-I199 PolarHBondContact O-N 3.24Å
196V91Very high90.5Very high86 Ų8656 Ų5652%0.52131%0.311SS..Hα-helixtrans-63.8-43.7179177.60000111L164 V194 I199 Y200L164-V196 HydrophobicContact CD1-CG1 4.33Å; L164-V196 HydrophobicContact CD2-CG1 4.26Å; V194-V196 VanDerWaalsContact C-N 3.29Å; V194-V196 PolarHBondContact O-N 2.97Å; V196-I199 PolarHBondContact O-N 3.4Å; V196-Y200 VanDerWaalsContact O-CB 3.24Å; V196-Y200 WeakPolarHBondContact O-CB 3.38Å; V196-Y200 PolarHBondContact O-N 3.32Å
197N91.8Very high90.6Very high7 Ų760.1 Ų60.14%0.03733%0.332CS..Hα-helixtrans-63-43.4176.4-69.2-89.1000111.2L164 T165 H183 M184 V194 G201L164-N197 WeakPolarHBondContact CB-OD1 3.44Å; L164-N197 PolarHBondContact O-OD1 3.11Å; T165-N197 PolarHBondContact N-OD1 3.17Å; H183-N197 PolarHBondContact CE1-O 2.88Å; M184-N197 HydrophobicContact CE-CB 4.3Å; V194-N197 WeakPolarHBondContact O-CB 3.43Å; V194-N197 PolarHBondContact O-N 3.04Å; V194-N197 VanDerWaalsContact O-N 3.09Å; N197-G201 PolarHBondContact O-N 2.66Å
198A89.7Confident90.8Very high40 Ų4060.6 Ų60.633%0.33134%0.335SS..Hα-helixtrans-64.4-47177.800000112.3M184 V194 K195 G201 L202M184-A198 HydrophobicContact CE-CB 4.27Å; M184-A198 HydrophobicContact SD-CB 4.23Å; V194-A198 PolarHBondContact O-N 3.47Å; K195-A198 PolarHBondContact O-N 2.81Å; A198-G201 PolarHBondContact O-N 2.82Å; A198-L202 WeakPolarHBondContact O-CB 3.44Å; A198-L202 PolarHBondContact O-N 2.92Å
199I91.4Very high90.9Very high110 Ų11056.9 Ų56.956%0.56432%0.324SS*.Hα-helixtrans-63.5-47.8177.9-68.6165.3000110.3K195 V196 G201 L202 M203K195-I199 WeakPolarHBondContact O-CB 3.37Å; K195-I199 VanDerWaalsContact O-CG1 3.25Å; K195-I199 WeakPolarHBondContact O-CG1 3.35Å; K195-I199 PolarHBondContact O-N 3.24Å; V196-I199 PolarHBondContact O-N 3.4Å; I199-G201 PolarHBondContact O-N 3.29Å; I199-L202 PolarHBondContact O-N 3.05Å; I199-M203 HydrophobicContact CG2-CG 4.42Å; I199-M203 WeakPolarHBondContact O-CB 3.34Å; I199-M203 VanDerWaalsContact O-CG 3.31Å; I199-M203 WeakPolarHBondContact O-CG 3.1Å; I199-M203 PolarHBondContact O-N 2.93Å
200Y92.5Very high91.1Very high61 Ų6157.4 Ų57.424%0.23933%0.334CS..Hα-helixtrans-63.4-43.5179.7-169.7-96.1000111.3L157 P160 F161 L164 V196 L202 M203 V204L157-Y200 WeakPolarHBondContact O-CE1 3.25Å; L157-Y200 PolarHBondContact O-OH 3.07Å; P160-Y200 HydrophobicContact CB-CE1 4.03Å; P160-Y200 WeakPolarHBondContact CB-OH 3.15Å; P160-Y200 WeakPolarHBondContact CG-OH 3.37Å; F161-Y200 HydrophobicContact CB-CD1 4.05Å; F161-Y200 HydrophobicContact CB-CE1 3.83Å; F161-Y200 HydrophobicContact CD2-CD1 4.16Å; L164-Y200 HydrophobicContact CD1-CD1 4.08Å; L164-Y200 HydrophobicContact CD1-CD2 4.45Å; L164-Y200 HydrophobicContact CD1-CG 3.92Å; V196-Y200 VanDerWaalsContact O-CB 3.24Å; V196-Y200 WeakPolarHBondContact O-CB 3.38Å; V196-Y200 PolarHBondContact O-N 3.32Å; Y200-L202 PolarHBondContact O-N 3.02Å; Y200-M203 WeakPolarHBondContact O-CB 3.45Å; Y200-M203 PolarHBondContact O-N 2.87Å; Y200-V204 HydrophobicContact CD1-CG2 3.91Å; Y200-V204 HydrophobicContact CE1-CG2 3.5Å; Y200-V204 VanDerWaalsContact CE1-CG2 3.5Å; Y200-V204 WeakPolarHBondContact O-CG2 3.4Å; Y200-V204 PolarHBondContact O-N 2.96Å
201G90.8Very high91.3Very high12 Ų1262.3 Ų62.312%0.12436%0.356CS..Hα-helixtrans-60.9-41.7176.100000113.2N197 A198 I199 V204 A205N197-G201 PolarHBondContact O-N 2.66Å; A198-G201 PolarHBondContact O-N 2.82Å; I199-G201 PolarHBondContact O-N 3.29Å; G201-V204 PolarHBondContact O-N 3.29Å; G201-A205 WeakPolarHBondContact O-CB 3.46Å; G201-A205 PolarHBondContact O-N 3.32Å
202L90.1Very high91.7Very high96 Ų9659.4 Ų59.450%0.50334%0.336SS..Hα-helixtrans-64.2-42.8173.3-179.263.1000111.8A198 I199 Y200 V204 A205 L206A198-L202 WeakPolarHBondContact O-CB 3.44Å; A198-L202 PolarHBondContact O-N 2.92Å; I199-L202 PolarHBondContact O-N 3.05Å; Y200-L202 PolarHBondContact O-N 3.02Å; L202-V204 VanDerWaalsContact C-N 3.35Å; L202-V204 PolarHBondContact O-N 3.27Å; L202-A205 PolarHBondContact O-N 2.82Å; L202-L206 HydrophobicContact CD1-CD1 4.38Å; L202-L206 HydrophobicContact CD1-CG 4.35Å; L202-L206 HydrophobicContact CG-CD1 4.14Å; L202-L206 WeakPolarHBondContact O-CG 3.23Å; L202-L206 PolarHBondContact O-N 3.32Å
203M92.6Very high92Very high95 Ų9560.7 Ų60.747%0.46834%0.337SS..Hα-helixtrans-59.3-45.2176-76.6-63.6-61.900111.5I199 Y200 L206 L207I199-M203 HydrophobicContact CG2-CG 4.42Å; I199-M203 WeakPolarHBondContact O-CB 3.34Å; I199-M203 VanDerWaalsContact O-CG 3.31Å; I199-M203 WeakPolarHBondContact O-CG 3.1Å; I199-M203 PolarHBondContact O-N 2.93Å; Y200-M203 WeakPolarHBondContact O-CB 3.45Å; Y200-M203 PolarHBondContact O-N 2.87Å; M203-L206 PolarHBondContact O-N 3.44Å; M203-L207 HydrophobicContact CE-CD1 4.44Å; M203-L207 VanDerWaalsContact O-CB 3.28Å; M203-L207 WeakPolarHBondContact O-CB 3.5Å; M203-L207 VanDerWaalsContact O-CG 3.22Å; M203-L207 WeakPolarHBondContact O-CG 3.34Å; M203-L207 PolarHBondContact O-N 3.46Å
204V93.1Very high92.4Very high9 Ų960.6 Ų60.66%0.05534%0.336CS..Hα-helixtrans-62-45.1175.6171.80000111L157 I158 Y200 G201 L202 L206 L207 I208L157-V204 HydrophobicContact CB-CG1 4.31Å; L157-V204 HydrophobicContact CB-CG2 4.29Å; I158-V204 HydrophobicContact CD1-CG1 3.72Å; Y200-V204 HydrophobicContact CD1-CG2 3.91Å; Y200-V204 HydrophobicContact CE1-CG2 3.5Å; Y200-V204 VanDerWaalsContact CE1-CG2 3.5Å; Y200-V204 WeakPolarHBondContact O-CG2 3.4Å; Y200-V204 PolarHBondContact O-N 2.96Å; G201-V204 PolarHBondContact O-N 3.29Å; L202-V204 VanDerWaalsContact C-N 3.35Å; L202-V204 PolarHBondContact O-N 3.27Å; V204-L206 VanDerWaalsContact C-N 3.32Å; V204-L206 PolarHBondContact O-N 3.42Å; V204-L207 PolarHBondContact O-N 2.88Å; V204-I208 HydrophobicContact CG1-CD1 3.74Å; V204-I208 HydrophobicContact CG1-CG1 4.31Å; V204-I208 WeakPolarHBondContact O-CB 3.23Å; V204-I208 WeakPolarHBondContact O-CG1 3.43Å; V204-I208 PolarHBondContact O-N 3Å
205A90.9Very high92.8Very high59 Ų5959.9 Ų59.949%0.48833%0.332SS..Hα-helixtrans-60.7-39.917800000112.6G201 L202 G209 G210G201-A205 WeakPolarHBondContact O-CB 3.46Å; G201-A205 PolarHBondContact O-N 3.32Å; L202-A205 PolarHBondContact O-N 2.82Å; A205-G209 WeakPolarHBondContact O-CA 3.34Å; A205-G209 PolarHBondContact O-N 3.16Å; A205-G210 PolarHBondContact O-N 3.32Å
206L91.7Very high93.1Very high100 Ų10053.5 Ų53.552%0.52431%0.305SS..Iπ-helixtrans-71.6-44.8176.3-70.2173000112.3L202 M203 V204 I208 G210 F211L202-L206 HydrophobicContact CD1-CD1 4.38Å; L202-L206 HydrophobicContact CD1-CG 4.35Å; L202-L206 HydrophobicContact CG-CD1 4.14Å; L202-L206 WeakPolarHBondContact O-CG 3.23Å; L202-L206 PolarHBondContact O-N 3.32Å; M203-L206 PolarHBondContact O-N 3.44Å; V204-L206 VanDerWaalsContact C-N 3.32Å; V204-L206 PolarHBondContact O-N 3.42Å; L206-I208 VanDerWaalsContact C-N 3.31Å; L206-I208 PolarHBondContact O-N 3.44Å; L206-G210 CarbonylContact O-C 3.59Å; L206-G210 WeakPolarHBondContact O-CA 3.28Å; L206-G210 PolarHBondContact O-N 2.98Å; L206-G210 VanDerWaalsContact O-N 3.12Å; L206-F211 PolarHBondContact O-N 3.47Å; L206-F211 VanDerWaalsContact O-N 3.1Å
207L93.3Very high93.3Very high87 Ų8753 Ų5346%0.45530%0.302SS..Iπ-helixtrans-66.6-33179.8-74.4174.9000112.4R153 M203 V204 F211R153-L207 PolarHBondContact NH2-O 3.23Å; M203-L207 HydrophobicContact CE-CD1 4.44Å; M203-L207 VanDerWaalsContact O-CB 3.28Å; M203-L207 WeakPolarHBondContact O-CB 3.5Å; M203-L207 VanDerWaalsContact O-CG 3.22Å; M203-L207 WeakPolarHBondContact O-CG 3.34Å; M203-L207 PolarHBondContact O-N 3.46Å; V204-L207 PolarHBondContact O-N 2.88Å; L207-F211 VanDerWaalsContact O-CB 3.28Å; L207-F211 WeakPolarHBondContact O-CB 3.28Å
208I93.4Very high93.6Very high11 Ų1156.1 Ų56.16%0.05632%0.321CS..Iπ-helixtrans-88.3-78.5176-59.3-179.3000110.1R153 L157 V204 L206 G210 F211 D212R153-I208 VanDerWaalsContact NH2-CA 3.29Å; R153-I208 PolarHBondContact NH2-O 2.91Å; L157-I208 HydrophobicContact CB-CD1 4.3Å; L157-I208 HydrophobicContact CD1-CD1 3.85Å; L157-I208 HydrophobicContact CD1-CG1 3.65Å; V204-I208 HydrophobicContact CG1-CD1 3.74Å; V204-I208 HydrophobicContact CG1-CG1 4.31Å; V204-I208 WeakPolarHBondContact O-CB 3.23Å; V204-I208 WeakPolarHBondContact O-CG1 3.43Å; V204-I208 PolarHBondContact O-N 3Å; L206-I208 VanDerWaalsContact C-N 3.31Å; L206-I208 PolarHBondContact O-N 3.44Å; I208-G210 PolarHBondContact O-N 2.9Å; I208-F211 PolarHBondContact O-N 3.44Å; I208-D212 WeakPolarHBondContact O-CB 3.18Å; I208-D212 PolarHBondContact O-N 3.25Å
209G91.1Very high93.9Very high18 Ų1854.5 Ų54.519%0.18631%0.308CS..Iπ-helixtrans-64.3-43.3-172.800000113.3A205 F211 D212 I213A205-G209 WeakPolarHBondContact O-CA 3.34Å; A205-G209 PolarHBondContact O-N 3.16Å; G209-F211 PolarHBondContact O-N 3.01Å; G209-D212 PolarHBondContact O-N 3.19Å; G209-I213 WeakPolarHBondContact O-CB 3.5Å; G209-I213 WeakPolarHBondContact O-CD1 3.27Å; G209-I213 WeakPolarHBondContact O-CG1 3.44Å; G209-I213 PolarHBondContact O-N 3.4Å
210G92.3Very high94.1Very high33 Ų3350.6 Ų50.634%0.3429%0.286SS..Iπ-helixtrans-61.6-46.1179.400000112.9A205 L206 I208 L214A205-G210 PolarHBondContact O-N 3.32Å; L206-G210 CarbonylContact O-C 3.59Å; L206-G210 WeakPolarHBondContact O-CA 3.28Å; L206-G210 PolarHBondContact O-N 2.98Å; L206-G210 VanDerWaalsContact O-N 3.12Å; I208-G210 PolarHBondContact O-N 2.9Å; G210-L214 WeakPolarHBondContact O-CB 3.35Å; G210-L214 PolarHBondContact O-N 2.65Å; G210-L214 VanDerWaalsContact O-N 3.07Å
211F95.6Very high94.2Very high103 Ų10350.4 Ų50.445%0.45229%0.291SS..Hα-helixtrans-62.5-46.7175.1177.3-97.7000112.1M118 R153 L206 L207 I208 G209 I213 L214 C215M118-F211 HydrophobicContact CE-CE1 4.28Å; M118-F211 HydrophobicContact SD-CD1 3.98Å; M118-F211 HydrophobicContact SD-CE1 3.71Å; R153-F211 VanDerWaalsContact NH2-CD1 3.32Å; L206-F211 PolarHBondContact O-N 3.47Å; L206-F211 VanDerWaalsContact O-N 3.1Å; L207-F211 VanDerWaalsContact O-CB 3.28Å; L207-F211 WeakPolarHBondContact O-CB 3.28Å; I208-F211 PolarHBondContact O-N 3.44Å; G209-F211 PolarHBondContact O-N 3.01Å; F211-I213 PolarHBondContact O-N 3.13Å; F211-L214 WeakPolarHBondContact O-CB 3.46Å; F211-L214 PolarHBondContact O-N 2.81Å; F211-C215 PolarHBondContact O-N 3.08Å
212D97.1Very high94.4Very high0 Ų053 Ų530%030%0.301CS..Hα-helixtrans-63-45.5-177.8-63.9-5.6000111.2S114 G115 M118 R153 I208 G209 L214 C215 I216S114-D212 VanDerWaalsContact C-OD2 3.31Å; S114-D212 WeakPolarHBondContact CB-OD2 3.37Å; S114-D212 VanDerWaalsContact OG-CB 3.27Å; S114-D212 WeakPolarHBondContact OG-CB 3.46Å; S114-D212 PolarHBondContact OG-OD2 2.98Å; G115-D212 PolarHBondContact N-OD2 2.84Å; M118-D212 HydrophobicContact CB-CB 4.08Å; M118-D212 HydrophobicContact SD-CB 4.28Å; R153-D212 IonicContact CZ-OD1 3.42Å; R153-D212 IonicContact NH1-OD1 2.67Å; R153-D212 PolarHBondContact NH1-OD1 3.43Å; R153-D212 IonicContact NH1-OD2 3Å; R153-D212 IonicContact NH2-OD1 3.54Å; R153-D212 PolarHBondContact NH2-OD1 2.9Å; I208-D212 WeakPolarHBondContact O-CB 3.18Å; I208-D212 PolarHBondContact O-N 3.25Å; G209-D212 PolarHBondContact O-N 3.19Å; D212-L214 VanDerWaalsContact C-N 3.32Å; D212-L214 PolarHBondContact O-N 3.41Å; D212-C215 PolarHBondContact O-N 2.92Å; D212-I216 VanDerWaalsContact O-CG1 3.25Å; D212-I216 WeakPolarHBondContact O-CG1 3.37Å; D212-I216 PolarHBondContact O-N 2.95Å
213I95.4Very high94.6Very high50 Ų5048.8 Ų48.826%0.25628%0.279SS..Hα-helixtrans-60.8-41.4176.2-68.2164.6000110.9G209 F211 I216 T217 Y254 F258G209-I213 WeakPolarHBondContact O-CB 3.5Å; G209-I213 WeakPolarHBondContact O-CD1 3.27Å; G209-I213 WeakPolarHBondContact O-CG1 3.44Å; G209-I213 PolarHBondContact O-N 3.4Å; F211-I213 PolarHBondContact O-N 3.13Å; I213-I216 PolarHBondContact O-N 3.25Å; I213-T217 VanDerWaalsContact O-CB 3.3Å; I213-T217 WeakPolarHBondContact O-CB 3.29Å; I213-T217 PolarHBondContact O-N 3.25Å; I213-T217 PolarHBondContact O-OG1 3.05Å; I213-Y254 HydrophobicContact CD1-CD1 3.77Å; I213-Y254 HydrophobicContact CD1-CE1 3.53Å; I213-Y254 HydrophobicContact CG1-CD1 3.85Å; I213-Y254 HydrophobicContact CG1-CE1 3.29Å; I213-F258 HydrophobicContact CD1-CE2 4.42Å; I213-F258 HydrophobicContact CD1-CZ 3.89Å
214L96.7Very high94.6Very high106 Ų10647.7 Ų47.756%0.55528%0.275SS*.Hα-helixtrans-61.2-48.3176.9178.264.8000110.9G210 F211 D212 I216 T217 V218G210-L214 WeakPolarHBondContact O-CB 3.35Å; G210-L214 PolarHBondContact O-N 2.65Å; G210-L214 VanDerWaalsContact O-N 3.07Å; F211-L214 WeakPolarHBondContact O-CB 3.46Å; F211-L214 PolarHBondContact O-N 2.81Å; D212-L214 VanDerWaalsContact C-N 3.32Å; D212-L214 PolarHBondContact O-N 3.41Å; L214-I216 PolarHBondContact O-N 3.41Å; L214-T217 PolarHBondContact O-N 3.41Å; L214-V218 HydrophobicContact CD1-CG2 4.34Å; L214-V218 WeakPolarHBondContact O-CG2 3.19Å; L214-V218 PolarHBondContact O-N 2.9Å
215C97.3Very high94.5Very high29 Ų2954.9 Ų54.920%0.19630%0.301CS..Hα-helixtrans-62.4-41.5177.7-74.40000112.5M118 F211 D212 S219M118-C215 HydrophobicContact CG-CB 3.58Å; M118-C215 HydrophobicContact SD-CB 3.6Å; F211-C215 PolarHBondContact O-N 3.08Å; D212-C215 PolarHBondContact O-N 2.92Å; C215-S219 VanDerWaalsContact O-CB 3.31Å; C215-S219 WeakPolarHBondContact O-CB 3.33Å; C215-S219 PolarHBondContact O-N 2.93Å; C215-S219 PolarHBondContact O-OG 3.48Å
216I97.3Very high94.5Very high11 Ų1154.3 Ų54.36%0.05629%0.291CS..Hα-helixtrans-59.7-49.1173.7-69.7166.6000110L117 M118 A121 D212 I213 L214 V218 S219 Y220 I250 Y254L117-I216 HydrophobicContact CB-CD1 4.31Å; M118-I216 HydrophobicContact CB-CD1 4.35Å; M118-I216 HydrophobicContact CB-CG1 4.12Å; A121-I216 HydrophobicContact CB-CB 4.33Å; A121-I216 HydrophobicContact CB-CG1 3.95Å; A121-I216 HydrophobicContact CB-CG2 4.4Å; D212-I216 VanDerWaalsContact O-CG1 3.25Å; D212-I216 WeakPolarHBondContact O-CG1 3.37Å; D212-I216 PolarHBondContact O-N 2.95Å; I213-I216 PolarHBondContact O-N 3.25Å; L214-I216 PolarHBondContact O-N 3.41Å; I216-V218 PolarHBondContact O-N 2.88Å; I216-S219 PolarHBondContact O-N 2.86Å; I216-Y220 HydrophobicContact CG2-CD2 3.9Å; I216-Y220 HydrophobicContact CG2-CE2 4.26Å; I216-Y220 WeakPolarHBondContact O-CD2 3.39Å; I216-Y220 PolarHBondContact O-N 3.46Å; I216-I250 HydrophobicContact CG2-CD1 3.78Å; I216-Y254 HydrophobicContact CD1-CE2 3.89Å
217T96.1Very high94.4Very high75 Ų7549.7 Ų49.746%0.4627%0.267SS..Hα-helixtrans-61.3-46.2-177.9-59.10000111.5I213 L214 T221I213-T217 VanDerWaalsContact O-CB 3.3Å; I213-T217 WeakPolarHBondContact O-CB 3.29Å; I213-T217 PolarHBondContact O-N 3.25Å; I213-T217 PolarHBondContact O-OG1 3.05Å; L214-T217 PolarHBondContact O-N 3.41Å; T217-T221 VanDerWaalsContact O-CB 3.3Å; T217-T221 WeakPolarHBondContact O-CB 2.98Å; T217-T221 PolarHBondContact O-N 3.48Å; T217-T221 PolarHBondContact O-OG1 2.74Å
218V97.5Very high94.2Very high73 Ų7351.8 Ų51.844%0.44228%0.277SS..Hα-helixtrans-62-46.2176.4171.80000110.7L214 I216 Y220 T221 M222L214-V218 HydrophobicContact CD1-CG2 4.34Å; L214-V218 WeakPolarHBondContact O-CG2 3.19Å; L214-V218 PolarHBondContact O-N 2.9Å; I216-V218 PolarHBondContact O-N 2.88Å; V218-Y220 PolarHBondContact O-N 3.25Å; V218-T221 PolarHBondContact O-N 3.3Å; V218-M222 WeakPolarHBondContact O-CG 2.98Å; V218-M222 PolarHBondContact O-N 2.69Å
219S96.9Very high93.9Very high6 Ų655.6 Ų55.64%0.04231%0.305CS..Hα-helixtrans-58.3-50.1179.6-60.70000111.6C215 I216 M222 I223C215-S219 VanDerWaalsContact O-CB 3.31Å; C215-S219 WeakPolarHBondContact O-CB 3.33Å; C215-S219 PolarHBondContact O-N 2.93Å; C215-S219 PolarHBondContact O-OG 3.48Å; I216-S219 PolarHBondContact O-N 2.86Å; S219-M222 PolarHBondContact O-N 2.72Å; S219-I223 VanDerWaalsContact O-CG1 3.27Å; S219-I223 WeakPolarHBondContact O-CG1 2.96Å; S219-I223 PolarHBondContact O-N 2.9Å
220Y95Very high93.8Very high29 Ų2957.7 Ų57.711%0.11431%0.312CS..Hα-helixtrans-69.6-33.4179.2-87.3-81.5000113.3A121 I216 V218 M222 I223 L224 C243 H246 I247 I250A121-Y220 HydrophobicContact CB-CD2 4.26Å; A121-Y220 HydrophobicContact CB-CE2 3.93Å; I216-Y220 HydrophobicContact CG2-CD2 3.9Å; I216-Y220 HydrophobicContact CG2-CE2 4.26Å; I216-Y220 WeakPolarHBondContact O-CD2 3.39Å; I216-Y220 PolarHBondContact O-N 3.46Å; V218-Y220 PolarHBondContact O-N 3.25Å; Y220-M222 VanDerWaalsContact C-N 3.32Å; Y220-M222 PolarHBondContact O-N 3.09Å; Y220-I223 HydrophobicContact CD1-CD1 4.22Å; Y220-I223 HydrophobicContact CE1-CD1 4.37Å; Y220-I223 HydrophobicContact CG-CD1 4.48Å; Y220-I223 PolarHBondContact O-N 3.31Å; Y220-L224 WeakPolarHBondContact O-CB 3.48Å; Y220-L224 WeakPolarHBondContact O-CG 3.34Å; Y220-L224 PolarHBondContact O-N 3.2Å; Y220-C243 HydrophobicContact CE1-CB 4.09Å; Y220-H246 AromaticContact CE2-ND1 3.82Å; Y220-H246 AromaticContact CZ-ND1 3.76Å; Y220-H246 PolarHBondContact OH-ND1 2.02Å; Y220-I247 HydrophobicContact CD1-CD1 4.42Å; Y220-I247 HydrophobicContact CD1-CG1 4.37Å; Y220-I247 HydrophobicContact CE1-CD1 3.78Å; Y220-I247 HydrophobicContact CE1-CG1 3.53Å; Y220-I250 HydrophobicContact CD2-CD1 4.39Å; Y220-I250 HydrophobicContact CE2-CD1 3.61Å
221T94.8Very high93.3Very high57 Ų5762.2 Ų62.235%0.3534%0.338SS..Hα-helixtrans-60.9-43.7172.6-60.40000110.8T217 V218 L224 R225T217-T221 VanDerWaalsContact O-CB 3.3Å; T217-T221 WeakPolarHBondContact O-CB 2.98Å; T217-T221 PolarHBondContact O-N 3.48Å; T217-T221 PolarHBondContact O-OG1 2.74Å; V218-T221 PolarHBondContact O-N 3.3Å; T221-L224 PolarHBondContact O-N 3.45Å; T221-R225 WeakPolarHBondContact O-CG 3.33Å; T221-R225 PolarHBondContact O-N 3.46Å
222M94.6Very high93Very high67 Ų6759.6 Ų59.633%0.3333%0.332SS..Hα-helixtrans-69.3-40.2177.5-65.3-61.4179.100112.4Y125 V218 S219 Y220 L224 R225 V226Y125-M222 HydrophobicContact CD2-CB 3.83Å; Y125-M222 HydrophobicContact CE2-CB 3.47Å; Y125-M222 VanDerWaalsContact CE2-CB 3.47Å; Y125-M222 HydrophobicContact CE2-CG 4.11Å; V218-M222 WeakPolarHBondContact O-CG 2.98Å; V218-M222 PolarHBondContact O-N 2.69Å; S219-M222 PolarHBondContact O-N 2.72Å; Y220-M222 VanDerWaalsContact C-N 3.32Å; Y220-M222 PolarHBondContact O-N 3.09Å; M222-L224 VanDerWaalsContact C-N 3.32Å; M222-L224 PolarHBondContact O-N 3.46Å; M222-R225 PolarHBondContact O-N 2.94Å; M222-V226 PolarHBondContact O-N 3.02Å; M222-V226 VanDerWaalsContact O-N 3.11Å
223I93.6Very high92.4Very high6 Ų662.3 Ų62.33%0.03136%0.355CS..Hα-helixtrans-56.8-49.2172.6-69.1164000109.9R124 Y125 I128 S219 Y220 R225 V226 V227R124-I223 HydrophobicContact CB-CD1 3.95Å; Y125-I223 HydrophobicContact CD2-CG1 4.39Å; I128-I223 HydrophobicContact CD1-CG1 4.42Å; I128-I223 HydrophobicContact CD1-CG2 3.73Å; I128-I223 HydrophobicContact CG2-CG2 4.49Å; S219-I223 VanDerWaalsContact O-CG1 3.27Å; S219-I223 WeakPolarHBondContact O-CG1 2.96Å; S219-I223 PolarHBondContact O-N 2.9Å; Y220-I223 HydrophobicContact CD1-CD1 4.22Å; Y220-I223 HydrophobicContact CE1-CD1 4.37Å; Y220-I223 HydrophobicContact CG-CD1 4.48Å; Y220-I223 PolarHBondContact O-N 3.31Å; I223-R225 VanDerWaalsContact C-N 3.32Å; I223-R225 PolarHBondContact O-N 3.23Å; I223-V226 PolarHBondContact O-N 2.86Å; I223-V227 HydrophobicContact CG2-CG2 4.08Å; I223-V227 VanDerWaalsContact O-CG2 3.28Å; I223-V227 WeakPolarHBondContact O-CG2 3.37Å; I223-V227 PolarHBondContact O-N 2.98Å
224L92.1Very high91.9Very high73 Ų7366.2 Ų66.238%0.38238%0.377SS..Hα-helixtrans-59.5-42.2179.9-74.3170.3000111.9Y220 T221 M222 V226 V227 I228 F240Y220-L224 WeakPolarHBondContact O-CB 3.48Å; Y220-L224 WeakPolarHBondContact O-CG 3.34Å; Y220-L224 PolarHBondContact O-N 3.2Å; T221-L224 PolarHBondContact O-N 3.45Å; M222-L224 VanDerWaalsContact C-N 3.32Å; M222-L224 PolarHBondContact O-N 3.46Å; L224-V226 PolarHBondContact O-N 3.01Å; L224-V227 PolarHBondContact O-N 3.23Å; L224-I228 WeakPolarHBondContact O-CB 3.15Å; L224-I228 WeakPolarHBondContact O-CD1 3.33Å; L224-I228 VanDerWaalsContact O-CG1 3.23Å; L224-I228 WeakPolarHBondContact O-CG1 3.48Å; L224-I228 PolarHBondContact O-N 3.07Å; L224-F240 HydrophobicContact CD2-CE1 3.71Å; L224-F240 HydrophobicContact CD2-CZ 3.74Å
225R92.3Very high91.2Very high159 Ų15963 Ų6360%0.637%0.365SS*.Hα-helixtrans-57.8-47.2175.3-74176.1-178.5-175.3-0.7112.1T221 M222 I223 S229T221-R225 WeakPolarHBondContact O-CG 3.33Å; T221-R225 PolarHBondContact O-N 3.46Å; M222-R225 PolarHBondContact O-N 2.94Å; I223-R225 VanDerWaalsContact C-N 3.32Å; I223-R225 PolarHBondContact O-N 3.23Å; R225-S229 PolarHBondContact O-N 2.84Å
226V90.3Very high90.7Very high48 Ų4866.5 Ų66.529%0.29137%0.374SS..Hα-helixtrans-65-45.31781730000110.8I128 C129 M222 I223 L224 I228 S229 L230I128-V226 HydrophobicContact CG2-CG1 4.18Å; C129-V226 HydrophobicContact CB-CG2 4.39Å; C129-V226 VanDerWaalsContact SG-CG2 3.6Å; M222-V226 PolarHBondContact O-N 3.02Å; M222-V226 VanDerWaalsContact O-N 3.11Å; I223-V226 PolarHBondContact O-N 2.86Å; L224-V226 PolarHBondContact O-N 3.01Å; V226-I228 PolarHBondContact O-N 3.05Å; V226-S229 PolarHBondContact O-N 2.7Å; V226-S229 VanDerWaalsContact O-N 3.12Å; V226-S229 PolarHBondContact O-OG 2.88Å; V226-L230 PolarHBondContact O-N 3.37Å
227V88.9Confident90.1Very high2 Ų271.1 Ų71.11%0.01240%0.396CS..Hα-helixtrans-62.2-41.6-179.8174.10000111.7I223 L224 S229 L230 R236 A239 F240I223-V227 HydrophobicContact CG2-CG2 4.08Å; I223-V227 VanDerWaalsContact O-CG2 3.28Å; I223-V227 WeakPolarHBondContact O-CG2 3.37Å; I223-V227 PolarHBondContact O-N 2.98Å; L224-V227 PolarHBondContact O-N 3.23Å; V227-S229 VanDerWaalsContact C-N 3.25Å; V227-S229 PolarHBondContact O-N 2.91Å; V227-L230 WeakPolarHBondContact O-CB 3.36Å; V227-L230 PolarHBondContact O-N 3.22Å; V227-R236 HydrophobicContact CG1-CB 4.13Å; V227-R236 HydrophobicContact CG1-CG 3.99Å; V227-R236 VanDerWaalsContact O-CG 3.28Å; V227-R236 WeakPolarHBondContact O-CG 3.48Å; V227-A239 HydrophobicContact CG1-CB 4.41Å; V227-A239 HydrophobicContact CG2-CB 3.61Å; V227-F240 HydrophobicContact CG1-CD2 4.02Å; V227-F240 HydrophobicContact CG1-CE2 3.52Å; V227-F240 HydrophobicContact CG1-CZ 4.02Å
228I89.1Confident89.5Confident131 Ų13175 Ų7567%0.67241%0.406SS*.Hα-helixtrans-65.3-30.8177.5-68.2165.4000111.5L224 V226 L230L224-I228 WeakPolarHBondContact O-CB 3.15Å; L224-I228 WeakPolarHBondContact O-CD1 3.33Å; L224-I228 VanDerWaalsContact O-CG1 3.23Å; L224-I228 WeakPolarHBondContact O-CG1 3.48Å; L224-I228 PolarHBondContact O-N 3.07Å; V226-I228 PolarHBondContact O-N 3.05Å; I228-L230 VanDerWaalsContact C-N 3.25Å; I228-L230 PolarHBondContact O-N 3.29Å
229S88.4Confident88.8Confident92 Ų9272.1 Ų72.164%0.64339%0.39SS*.Hα-helixtrans-73.7-11.2176.573.90000114.7R225 V226 V227 S231R225-S229 PolarHBondContact O-N 2.84Å; V226-S229 PolarHBondContact O-N 2.7Å; V226-S229 VanDerWaalsContact O-N 3.12Å; V226-S229 PolarHBondContact O-OG 2.88Å; V227-S229 VanDerWaalsContact C-N 3.25Å; V227-S229 PolarHBondContact O-N 2.91Å; S229-S231 PolarHBondContact O-N 2.96Å
230L87.8Confident88.2Confident62 Ų6275.7 Ų75.733%0.32541%0.405SS..  trans-73.1126.9178-65.1172.4000110.9V226 V227 I228 S232 A235 R236V226-L230 PolarHBondContact O-N 3.37Å; V227-L230 WeakPolarHBondContact O-CB 3.36Å; V227-L230 PolarHBondContact O-N 3.22Å; I228-L230 VanDerWaalsContact C-N 3.25Å; I228-L230 PolarHBondContact O-N 3.29Å; L230-S232 PolarHBondContact O-N 3.41Å; L230-A235 HydrophobicContact CB-CB 4.49Å; L230-A235 HydrophobicContact CD1-CB 4.11Å; L230-R236 HydrophobicContact CB-CG 3.94Å; L230-R236 HydrophobicContact CD1-CG 4.47Å
231S82.1Confident87.7Confident127 Ų12778.7 Ų78.789%0.88842%0.423SS*.SBendtrans-69-29.4-179.955.70000113.8S229S229-S231 PolarHBondContact O-N 2.96Å
232S89.3Confident87.1Confident48 Ų4878.9 Ų78.934%0.33642%0.424SS..  trans-91.1132-177.2169.60000112.6L230 D234 A235 R236L230-S232 PolarHBondContact O-N 3.41Å; S232-D234 VanDerWaalsContact C-N 3.32Å; S232-D234 PolarHBondContact OG-N 2.94Å; S232-A235 PolarHBondContact O-N 3.2Å; S232-A235 PolarHBondContact OG-N 3.11Å; S232-R236 WeakPolarHBondContact O-CG 3.46Å; S232-R236 PolarHBondContact O-N 3.06Å; S232-R236 VanDerWaalsContact O-N 3.16Å; S232-R236 PolarHBondContact O-NE 3.48Å
233A85.2Confident86.9Confident58 Ų5875.8 Ų75.848%0.47941%0.409SS..Hα-helixtrans-62.2-38.3171.500000112.2R236 Q237A233-R236 WeakPolarHBondContact O-CB 3.15Å; A233-R236 PolarHBondContact O-N 2.96Å; A233-Q237 PolarHBondContact O-N 2.82Å
234D85.8Confident86.7Confident132 Ų13277.6 Ų77.671%0.70642%0.421SS*.Hα-helixtrans-67.1-39.4178.6-60.7-35.1000111.8S232 R236 Q237 K238S232-D234 VanDerWaalsContact C-N 3.32Å; S232-D234 PolarHBondContact OG-N 2.94Å; D234-R236 VanDerWaalsContact C-N 3.32Å; D234-R236 PolarHBondContact O-N 3.19Å; D234-Q237 PolarHBondContact O-N 3.32Å; D234-K238 VanDerWaalsContact O-CB 3.31Å; D234-K238 WeakPolarHBondContact O-CB 3.46Å; D234-K238 PolarHBondContact O-N 3.05Å
235A81.8Confident86.6Confident38 Ų3874.4 Ų74.431%0.31440%0.404SS..Hα-helixtrans-63.5-40.4175.400000111.4L230 S232 A239L230-A235 HydrophobicContact CB-CB 4.49Å; L230-A235 HydrophobicContact CD1-CB 4.11Å; S232-A235 PolarHBondContact O-N 3.2Å; S232-A235 PolarHBondContact OG-N 3.11Å; A235-A239 PolarHBondContact O-N 2.75Å; A235-A239 VanDerWaalsContact O-N 3.08Å
236R85.4Confident86.7Confident102 Ų10266.9 Ų66.939%0.38538%0.376SS..Hα-helixtrans-62.9-49.4174-71.6179.2-75.2162.5-3.1111.8V227 L230 S232 A233 D234 K238 A239 F240V227-R236 HydrophobicContact CG1-CB 4.13Å; V227-R236 HydrophobicContact CG1-CG 3.99Å; V227-R236 VanDerWaalsContact O-CG 3.28Å; V227-R236 WeakPolarHBondContact O-CG 3.48Å; L230-R236 HydrophobicContact CB-CG 3.94Å; L230-R236 HydrophobicContact CD1-CG 4.47Å; S232-R236 WeakPolarHBondContact O-CG 3.46Å; S232-R236 PolarHBondContact O-N 3.06Å; S232-R236 VanDerWaalsContact O-N 3.16Å; S232-R236 PolarHBondContact O-NE 3.48Å; A233-R236 WeakPolarHBondContact O-CB 3.15Å; A233-R236 PolarHBondContact O-N 2.96Å; D234-R236 VanDerWaalsContact C-N 3.32Å; D234-R236 PolarHBondContact O-N 3.19Å; R236-K238 VanDerWaalsContact C-N 3.3Å; R236-K238 PolarHBondContact O-N 3.25Å; R236-A239 PolarHBondContact O-N 2.77Å; R236-F240 VanDerWaalsContact O-CD2 3.32Å; R236-F240 WeakPolarHBondContact O-CD2 3.36Å; R236-F240 PolarHBondContact O-N 2.88Å
237Q84.9Confident86.9Confident109 Ų10967.7 Ų67.751%0.50938%0.378SS..Hα-helixtrans-61.1-41.1179.5-172.4614000111.7A233 D234 F240 N241A233-Q237 PolarHBondContact O-N 2.82Å; D234-Q237 PolarHBondContact O-N 3.32Å; Q237-F240 PolarHBondContact O-N 3.24Å; Q237-N241 PolarHBondContact NE2-OD1 3.2Å; Q237-N241 WeakPolarHBondContact O-CB 3.09Å; Q237-N241 PolarHBondContact O-N 3.35Å; Q237-N241 PolarHBondContact O-ND2 3.49Å
238K84.8Confident87.1Confident156 Ų15669.6 Ų69.668%0.67839%0.391SS*.Hα-helixtrans-61.3-45.2176.3-172175.2-177.9178.60111.5D234 R236 N241 T242D234-K238 VanDerWaalsContact O-CB 3.31Å; D234-K238 WeakPolarHBondContact O-CB 3.46Å; D234-K238 PolarHBondContact O-N 3.05Å; R236-K238 VanDerWaalsContact C-N 3.3Å; R236-K238 PolarHBondContact O-N 3.25Å; K238-N241 PolarHBondContact O-N 3Å; K238-T242 WeakPolarHBondContact O-CG2 3.3Å; K238-T242 PolarHBondContact O-N 2.84Å; K238-T242 VanDerWaalsContact O-N 3.16Å
239A82.9Confident87.2Confident13 Ų1363.3 Ų63.311%0.10736%0.359CS..Hα-helixtrans-61.4-46.7177.100000111.9V227 A235 R236 N241 T242 C243V227-A239 HydrophobicContact CG1-CB 4.41Å; V227-A239 HydrophobicContact CG2-CB 3.61Å; A235-A239 PolarHBondContact O-N 2.75Å; A235-A239 VanDerWaalsContact O-N 3.08Å; R236-A239 PolarHBondContact O-N 2.77Å; A239-N241 PolarHBondContact O-N 3.06Å; A239-T242 PolarHBondContact O-N 2.88Å; A239-T242 VanDerWaalsContact O-N 3.16Å; A239-T242 PolarHBondContact O-OG1 2.89Å; A239-C243 PolarHBondContact O-N 3.26Å
240F83.6Confident87.5Confident81 Ų8160.2 Ų60.236%0.35534%0.335SS..Hα-helixtrans-61-44.4176.5-81.6-65.7000112.6L224 V227 R236 Q237 T242 C243 T244L224-F240 HydrophobicContact CD2-CE1 3.71Å; L224-F240 HydrophobicContact CD2-CZ 3.74Å; V227-F240 HydrophobicContact CG1-CD2 4.02Å; V227-F240 HydrophobicContact CG1-CE2 3.52Å; V227-F240 HydrophobicContact CG1-CZ 4.02Å; R236-F240 VanDerWaalsContact O-CD2 3.32Å; R236-F240 WeakPolarHBondContact O-CD2 3.36Å; R236-F240 PolarHBondContact O-N 2.88Å; Q237-F240 PolarHBondContact O-N 3.24Å; F240-T242 PolarHBondContact O-N 3.33Å; F240-C243 CarbonylContact O-C 3.41Å; F240-C243 PolarHBondContact O-N 3.42Å; F240-T244 PolarHBondContact O-N 3.47Å; F240-T244 PolarHBondContact O-OG1 3.18Å
241N84.8Confident87.7Confident92 Ų9260.7 Ų60.749%0.49234%0.34SS..Hα-helixtrans-58.1-32.7177.6-74.5-9.6000112.3Q237 K238 A239 C243Q237-N241 PolarHBondContact NE2-OD1 3.2Å; Q237-N241 WeakPolarHBondContact O-CB 3.09Å; Q237-N241 PolarHBondContact O-N 3.35Å; Q237-N241 PolarHBondContact O-ND2 3.49Å; K238-N241 PolarHBondContact O-N 3Å; A239-N241 PolarHBondContact O-N 3.06Å; N241-C243 VanDerWaalsContact C-N 3.3Å; N241-C243 PolarHBondContact O-N 2.98Å
242T82.3Confident88.2Confident61 Ų6157.2 Ų57.237%0.37431%0.309SS..Hα-helixtrans-73.5-20.2176.262.40000114.3R124 K238 A239 F240R124-T242 PolarHBondContact NH1-O 2.8Å; K238-T242 WeakPolarHBondContact O-CG2 3.3Å; K238-T242 PolarHBondContact O-N 2.84Å; K238-T242 VanDerWaalsContact O-N 3.16Å; A239-T242 PolarHBondContact O-N 2.88Å; A239-T242 VanDerWaalsContact O-N 3.16Å; A239-T242 PolarHBondContact O-OG1 2.89Å; F240-T242 PolarHBondContact O-N 3.33Å
243C89.1Confident88.2Confident2 Ų255.2 Ų55.21%0.01430%0.295CS..Hα-helixtrans-100.4-19.7-179.9-730000113.1Y220 A239 F240 N241 A245 H246 I247Y220-C243 HydrophobicContact CE1-CB 4.09Å; A239-C243 PolarHBondContact O-N 3.26Å; F240-C243 CarbonylContact O-C 3.41Å; F240-C243 PolarHBondContact O-N 3.42Å; N241-C243 VanDerWaalsContact C-N 3.3Å; N241-C243 PolarHBondContact O-N 2.98Å; C243-A245 VanDerWaalsContact C-N 3.33Å; C243-A245 PolarHBondContact O-N 3.25Å; C243-H246 PolarHBondContact O-N 3.44Å; C243-H246 VanDerWaalsContact O-N 3.09Å; C243-I247 HydrophobicContact CB-CD1 3.99Å; C243-I247 HydrophobicContact CB-CG1 4.47Å; C243-I247 WeakPolarHBondContact O-CG1 3.35Å; C243-I247 PolarHBondContact O-N 3.36Å
244T89.7Confident88.4Confident44 Ų4453.8 Ų53.827%0.2728%0.277SS..Hα-helixtrans-53.5-47.1-173.2-54.40000112.5F240 H246 I247 C248F240-T244 PolarHBondContact O-N 3.47Å; F240-T244 PolarHBondContact O-OG1 3.18Å; T244-H246 VanDerWaalsContact C-N 3.29Å; T244-H246 PolarHBondContact O-N 2.82Å; T244-I247 PolarHBondContact O-N 2.89Å; T244-C248 WeakPolarHBondContact O-CB 3.19Å; T244-C248 PolarHBondContact O-N 3.2Å; T244-C248 PolarHBondContact O-SG 3.07Å
245A91.3Very high88.4Confident5 Ų551.5 Ų51.54%0.04127%0.268CS..Hα-helixtrans-59.1-43.4-17900000111.9C243 C248 A249 V294 Y295 K298C243-A245 VanDerWaalsContact C-N 3.33Å; C243-A245 PolarHBondContact O-N 3.25Å; A245-C248 PolarHBondContact O-N 3.33Å; A245-A249 PolarHBondContact O-N 3.2Å; A245-V294 HydrophobicContact CB-CG1 3.91Å; A245-V294 WeakPolarHBondContact O-CG1 3.08Å; A245-Y295 HydrophobicContact CB-CD1 3.74Å; A245-Y295 HydrophobicContact CB-CE1 3.68Å; A245-K298 HydrophobicContact CB-CB 4.01Å
246H93.9Very high88.5Confident2 Ų250.2 Ų50.21%0.00926%0.257CS..Hα-helixtrans-72.6-39179.7-173.3-135.9000112.5L117 M120 A121 Y220 C243 T244 C248 A249 I250L117-H246 PolarHBondContact O-CE1 3.06Å; L117-H246 PolarHBondContact O-NE2 3.5Å; L117-H246 VanDerWaalsContact O-NE2 3.08Å; M120-H246 WeakPolarHBondContact CB-NE2 3.44Å; A121-H246 PolarHBondContact N-CE1 2.88Å; Y220-H246 AromaticContact CE2-ND1 3.82Å; Y220-H246 AromaticContact CZ-ND1 3.76Å; Y220-H246 PolarHBondContact OH-ND1 2.02Å; C243-H246 PolarHBondContact O-N 3.44Å; C243-H246 VanDerWaalsContact O-N 3.09Å; T244-H246 VanDerWaalsContact C-N 3.29Å; T244-H246 PolarHBondContact O-N 2.82Å; H246-C248 VanDerWaalsContact C-N 3.31Å; H246-C248 PolarHBondContact O-N 3.41Å; H246-A249 WeakPolarHBondContact O-CB 3.47Å; H246-A249 PolarHBondContact O-N 2.96Å; H246-I250 WeakPolarHBondContact O-CG1 3.3Å; H246-I250 PolarHBondContact O-N 2.92Å
247I93.3Very high88.3Confident65 Ų6546.7 Ų46.733%0.33325%0.249SC..Hα-helixtrans-59.8-43.8173.3-68.3167.6000110.3Y220 C243 T244 A249 I250 V251Y220-I247 HydrophobicContact CD1-CD1 4.42Å; Y220-I247 HydrophobicContact CD1-CG1 4.37Å; Y220-I247 HydrophobicContact CE1-CD1 3.78Å; Y220-I247 HydrophobicContact CE1-CG1 3.53Å; C243-I247 HydrophobicContact CB-CD1 3.99Å; C243-I247 HydrophobicContact CB-CG1 4.47Å; C243-I247 WeakPolarHBondContact O-CG1 3.35Å; C243-I247 PolarHBondContact O-N 3.36Å; T244-I247 PolarHBondContact O-N 2.89Å; I247-A249 PolarHBondContact O-N 3.25Å; I247-I250 PolarHBondContact O-N 3.36Å; I247-V251 HydrophobicContact CG2-CG2 4.44Å; I247-V251 WeakPolarHBondContact O-CG2 3.19Å; I247-V251 PolarHBondContact O-N 2.85Å
248C93.1Very high88.2Confident41 Ų4145.8 Ų45.828%0.27724%0.244SC..Hα-helixtrans-60.1-44.3175-70.60000111.8T244 A245 H246 I250 V251 F252 V294T244-C248 WeakPolarHBondContact O-CB 3.19Å; T244-C248 PolarHBondContact O-N 3.2Å; T244-C248 PolarHBondContact O-SG 3.07Å; A245-C248 PolarHBondContact O-N 3.33Å; H246-C248 VanDerWaalsContact C-N 3.31Å; H246-C248 PolarHBondContact O-N 3.41Å; C248-I250 PolarHBondContact O-N 3.18Å; C248-V251 PolarHBondContact O-N 3.35Å; C248-F252 HydrophobicContact CB-CD2 4.47Å; C248-F252 HydrophobicContact CB-CE2 4.2Å; C248-F252 WeakPolarHBondContact O-CD2 3.22Å; C248-F252 WeakPolarHBondContact O-CG 3.38Å; C248-F252 PolarHBondContact O-N 3.21Å; C248-V294 HydrophobicContact CB-CG1 3.83Å; C248-V294 HydrophobicContact CB-CG2 4.21Å
249A93.1Very high88Confident0 Ų043.3 Ų43.30%023%0.233CC..Hα-helixtrans-60.7-44176.200000112.1L117 A245 H246 I247 V251 F252 S253 N291 Y295L117-A249 HydrophobicContact CD2-CB 4.04Å; A245-A249 PolarHBondContact O-N 3.2Å; H246-A249 WeakPolarHBondContact O-CB 3.47Å; H246-A249 PolarHBondContact O-N 2.96Å; I247-A249 PolarHBondContact O-N 3.25Å; A249-V251 PolarHBondContact O-N 3.36Å; A249-F252 PolarHBondContact O-N 3.4Å; A249-S253 WeakPolarHBondContact O-CB 3.19Å; A249-S253 PolarHBondContact O-N 3.1Å; A249-S253 PolarHBondContact O-OG 3.12Å; A249-N291 WeakPolarHBondContact CB-OD1 3.31Å; A249-Y295 HydrophobicContact CB-CE2 4.34Å
250I93.9Very high87.6Confident27 Ų2744.4 Ų44.414%0.13824%0.24CC..Hα-helixtrans-58.6-47.7174.5-69.8163.7000110.5I216 Y220 H246 I247 C248 S253 Y254I216-I250 HydrophobicContact CG2-CD1 3.78Å; Y220-I250 HydrophobicContact CD2-CD1 4.39Å; Y220-I250 HydrophobicContact CE2-CD1 3.61Å; H246-I250 WeakPolarHBondContact O-CG1 3.3Å; H246-I250 PolarHBondContact O-N 2.92Å; I247-I250 PolarHBondContact O-N 3.36Å; C248-I250 PolarHBondContact O-N 3.18Å; I250-S253 PolarHBondContact O-N 3.2Å; I250-Y254 HydrophobicContact CB-CD2 4.48Å; I250-Y254 HydrophobicContact CG2-CD2 3.75Å; I250-Y254 HydrophobicContact CG2-CE2 4.25Å; I250-Y254 WeakPolarHBondContact O-CD2 3.39Å; I250-Y254 PolarHBondContact O-N 3.09Å
251V92.6Very high87.2Confident71 Ų7146.3 Ų46.343%0.4325%0.248SC..Hα-helixtrans-62.1-47.91801700000111I247 C248 A249 S253 T255I247-V251 HydrophobicContact CG2-CG2 4.44Å; I247-V251 WeakPolarHBondContact O-CG2 3.19Å; I247-V251 PolarHBondContact O-N 2.85Å; C248-V251 PolarHBondContact O-N 3.35Å; A249-V251 PolarHBondContact O-N 3.36Å; V251-S253 PolarHBondContact O-N 2.96Å; V251-T255 WeakPolarHBondContact O-CB 3.32Å; V251-T255 PolarHBondContact O-N 2.88Å; V251-T255 PolarHBondContact O-OG1 2.85Å; V251-T255 VanDerWaalsContact O-OG1 3.05Å
252F91.9Very high86.8Confident55 Ų5547.1 Ų47.124%0.24125%0.248CC..Hα-helixtrans-63.2-30.4178.8-68.7-46.9000113.2C248 A249 P256 L286 M290 V294C248-F252 HydrophobicContact CB-CD2 4.47Å; C248-F252 HydrophobicContact CB-CE2 4.2Å; C248-F252 WeakPolarHBondContact O-CD2 3.22Å; C248-F252 WeakPolarHBondContact O-CG 3.38Å; C248-F252 PolarHBondContact O-N 3.21Å; A249-F252 PolarHBondContact O-N 3.4Å; F252-P256 WeakPolarHBondContact O-CD 3.46Å; F252-P256 WeakPolarHBondContact O-CG 3.36Å; F252-L286 HydrophobicContact CB-CD2 4.41Å; F252-L286 HydrophobicContact CB-CG 4.39Å; F252-L286 HydrophobicContact CD1-CD2 3.99Å; F252-L286 HydrophobicContact CD1-CG 4.27Å; F252-M290 HydrophobicContact CD1-CG 4.47Å; F252-M290 HydrophobicContact CD2-CB 3.59Å; F252-M290 HydrophobicContact CD2-CG 4.16Å; F252-M290 HydrophobicContact CE1-CE 4.24Å; F252-M290 HydrophobicContact CE2-CB 3.87Å; F252-M290 HydrophobicContact CE2-CE 3.74Å; F252-M290 HydrophobicContact CE2-CG 4.23Å; F252-M290 HydrophobicContact CG-CB 4.07Å; F252-M290 HydrophobicContact CG-CG 4.3Å; F252-M290 HydrophobicContact CZ-CE 3.55Å; F252-M290 HydrophobicContact CZ-CG 4.43Å; F252-V294 HydrophobicContact CD2-CG2 4.35Å; F252-V294 HydrophobicContact CE2-CG2 3.79Å
253S89.3Confident86.3Confident5 Ų544.5 Ų44.54%0.03523%0.232CC..Hα-helixtrans-81.3-50.1179.7-49.50000112.8A249 I250 V251A249-S253 WeakPolarHBondContact O-CB 3.19Å; A249-S253 PolarHBondContact O-N 3.1Å; A249-S253 PolarHBondContact O-OG 3.12Å; I250-S253 PolarHBondContact O-N 3.2Å; V251-S253 PolarHBondContact O-N 2.96Å
254Y88.5Confident85.3Confident28 Ų2848.8 Ų48.811%0.1125%0.252CS..Hα-helixtrans-86.2-28.4-172.1-72.7-77.2000113.8S114 L117 I213 I216 I250 A257 F258S114-Y254 PolarHBondContact OG-OH 2.9Å; L117-Y254 HydrophobicContact CD1-CE2 4.11Å; I213-Y254 HydrophobicContact CD1-CD1 3.77Å; I213-Y254 HydrophobicContact CD1-CE1 3.53Å; I213-Y254 HydrophobicContact CG1-CD1 3.85Å; I213-Y254 HydrophobicContact CG1-CE1 3.29Å; I216-Y254 HydrophobicContact CD1-CE2 3.89Å; I250-Y254 HydrophobicContact CB-CD2 4.48Å; I250-Y254 HydrophobicContact CG2-CD2 3.75Å; I250-Y254 HydrophobicContact CG2-CE2 4.25Å; I250-Y254 WeakPolarHBondContact O-CD2 3.39Å; I250-Y254 PolarHBondContact O-N 3.09Å; Y254-A257 WeakPolarHBondContact O-CB 3.43Å; Y254-A257 PolarHBondContact O-N 3.12Å; Y254-F258 HydrophobicContact CD1-CE2 4.35Å; Y254-F258 WeakPolarHBondContact O-CD2 3.42Å; Y254-F258 PolarHBondContact O-N 2.8Å
255T87.2Confident84.4Confident84 Ų8454.3 Ų54.352%0.51527%0.268SS..Hα-helixtrans-60.9-49.6-179.6-66.60000112.5V251 A257 F258 F259V251-T255 WeakPolarHBondContact O-CB 3.32Å; V251-T255 PolarHBondContact O-N 2.88Å; V251-T255 PolarHBondContact O-OG1 2.85Å; V251-T255 VanDerWaalsContact O-OG1 3.05Å; T255-A257 VanDerWaalsContact C-N 3.3Å; T255-A257 PolarHBondContact O-N 3.3Å; T255-F258 PolarHBondContact O-N 2.9Å; T255-F259 WeakPolarHBondContact O-CB 3.28Å; T255-F259 PolarHBondContact O-N 3.3Å
256P82.8Confident83.5Confident11 Ų1161.2 Ų61.27%0.07130%0.297CS..Hα-helixtrans-63.9-35.4175.6-21.634.5000112.7F252 F259 S260 Y283 L286F252-P256 WeakPolarHBondContact O-CD 3.46Å; F252-P256 WeakPolarHBondContact O-CG 3.36Å; P256-F259 PolarHBondContact O-N 3.12Å; P256-S260 WeakPolarHBondContact O-CB 3.29Å; P256-S260 PolarHBondContact O-N 3.43Å; P256-Y283 HydrophobicContact CB-CD2 4.18Å; P256-Y283 HydrophobicContact CB-CG 4.45Å; P256-L286 HydrophobicContact CG-CD2 3.97Å
257A81.9Confident82.2Confident28 Ų2861.5 Ų61.523%0.23130%0.3CS..Hα-helixtrans-63.2-49.2177.900000111.9Y254 T255 S260 F261 Y283Y254-A257 WeakPolarHBondContact O-CB 3.43Å; Y254-A257 PolarHBondContact O-N 3.12Å; T255-A257 VanDerWaalsContact C-N 3.3Å; T255-A257 PolarHBondContact O-N 3.3Å; A257-S260 PolarHBondContact O-N 3Å; A257-F261 PolarHBondContact O-N 3.44Å; A257-Y283 HydrophobicContact CB-CD2 3.86Å; A257-Y283 HydrophobicContact CB-CE2 3.58Å
258F82.1Confident81Confident91 Ų9163.7 Ų63.740%0.39931%0.309SS..Hα-helixtrans-62.9-43.4175.6-80.4-62.2000111.2I213 Y254 T255 S260 F261 F262I213-F258 HydrophobicContact CD1-CE2 4.42Å; I213-F258 HydrophobicContact CD1-CZ 3.89Å; Y254-F258 HydrophobicContact CD1-CE2 4.35Å; Y254-F258 WeakPolarHBondContact O-CD2 3.42Å; Y254-F258 PolarHBondContact O-N 2.8Å; T255-F258 PolarHBondContact O-N 2.9Å; F258-S260 VanDerWaalsContact C-N 3.34Å; F258-S260 PolarHBondContact O-N 3.25Å; F258-F261 PolarHBondContact O-N 3.37Å; F258-F262 HydrophobicContact CB-CD2 4.17Å; F258-F262 HydrophobicContact CB-CE2 4.2Å; F258-F262 HydrophobicContact CD1-CD2 4.5Å; F258-F262 AromaticContact CD1-CE2 3.85Å; F258-F262 HydrophobicContact CD1-CE2 3.85Å; F258-F262 HydrophobicContact CG-CE2 4.4Å; F258-F262 WeakPolarHBondContact O-CB 3.37Å; F258-F262 WeakPolarHBondContact O-CD2 3.22Å; F258-F262 PolarHBondContact O-N 3.3Å
259F80.8Confident79.9Confident103 Ų10370.4 Ų70.445%0.45234%0.336SS..Hα-helixtrans-58.7-46.7176.3-175-82.4000111.4T255 P256 F261 F262 S263 V279T255-F259 WeakPolarHBondContact O-CB 3.28Å; T255-F259 PolarHBondContact O-N 3.3Å; P256-F259 PolarHBondContact O-N 3.12Å; F259-F261 VanDerWaalsContact C-N 3.34Å; F259-F261 PolarHBondContact O-N 3.46Å; F259-F262 PolarHBondContact O-N 2.96Å; F259-S263 WeakPolarHBondContact O-CB 3.44Å; F259-S263 PolarHBondContact O-N 3.36Å; F259-S263 PolarHBondContact O-OG 2.79Å; F259-V279 HydrophobicContact CB-CG1 4.49Å; F259-V279 HydrophobicContact CD1-CB 4.16Å; F259-V279 HydrophobicContact CD1-CG1 3.53Å; F259-V279 HydrophobicContact CD1-CG2 3.94Å; F259-V279 HydrophobicContact CE1-CB 4.35Å; F259-V279 HydrophobicContact CE1-CG1 4.2Å; F259-V279 HydrophobicContact CE1-CG2 3.75Å; F259-V279 HydrophobicContact CG-CG1 4.37Å
260S74.6Confident79Confident36 Ų3676.2 Ų76.225%0.25237%0.372SS..Hα-helixtrans-57.6-47176.3-175.60000111.5P256 A257 F258 S263 H264P256-S260 WeakPolarHBondContact O-CB 3.29Å; P256-S260 PolarHBondContact O-N 3.43Å; A257-S260 PolarHBondContact O-N 3Å; F258-S260 VanDerWaalsContact C-N 3.34Å; F258-S260 PolarHBondContact O-N 3.25Å; S260-S263 WeakPolarHBondContact CA-OG 3.43Å; S260-S263 PolarHBondContact O-OG 2.89Å; S260-H264 WeakPolarHBondContact O-CB 3.29Å; S260-H264 PolarHBondContact O-N 2.9Å
261F75.3Confident78.1Confident121 Ų12177.1 Ų77.153%0.53138%0.376SS..Hα-helixtrans-62.8-51.1178.9-178-95.8000113.1A257 F258 F259 H264 R265A257-F261 PolarHBondContact O-N 3.44Å; F258-F261 PolarHBondContact O-N 3.37Å; F259-F261 VanDerWaalsContact C-N 3.34Å; F259-F261 PolarHBondContact O-N 3.46Å; F261-H264 PolarHBondContact O-N 2.8Å; F261-R265 VanDerWaalsContact O-CB 3.31Å; F261-R265 WeakPolarHBondContact O-CB 3.46Å; F261-R265 PolarHBondContact O-N 3.47Å
262F75.8Confident77.5Confident109 Ų10977 Ų7748%0.47838%0.377SS..Hα-helixtrans-66.9-40.6-179.3-76.4-66.9000111.8F258 F259 R265 F266F258-F262 HydrophobicContact CB-CD2 4.17Å; F258-F262 HydrophobicContact CB-CE2 4.2Å; F258-F262 HydrophobicContact CD1-CD2 4.5Å; F258-F262 AromaticContact CD1-CE2 3.85Å; F258-F262 HydrophobicContact CD1-CE2 3.85Å; F258-F262 HydrophobicContact CG-CE2 4.4Å; F258-F262 WeakPolarHBondContact O-CB 3.37Å; F258-F262 WeakPolarHBondContact O-CD2 3.22Å; F258-F262 PolarHBondContact O-N 3.3Å; F259-F262 PolarHBondContact O-N 2.96Å; F262-R265 PolarHBondContact O-N 2.78Å; F262-F266 HydrophobicContact CB-CD2 4.46Å; F262-F266 AromaticContact CD1-CD2 3.76Å; F262-F266 HydrophobicContact CD1-CD2 3.76Å; F262-F266 AromaticContact CD1-CE2 3.59Å; F262-F266 HydrophobicContact CD1-CE2 3.59Å; F262-F266 HydrophobicContact CE1-CE2 4.04Å; F262-F266 WeakPolarHBondContact O-CB 3.32Å; F262-F266 WeakPolarHBondContact O-CD2 3.36Å; F262-F266 PolarHBondContact O-N 3.2Å
263S72Confident76.8Confident6 Ų678.5 Ų78.54%0.04239%0.392CS..Hα-helixtrans-62.8-46.6177.466.60000110.8F259 S260 R265 G267 E268 H276F259-S263 WeakPolarHBondContact O-CB 3.44Å; F259-S263 PolarHBondContact O-N 3.36Å; F259-S263 PolarHBondContact O-OG 2.79Å; S260-S263 WeakPolarHBondContact CA-OG 3.43Å; S260-S263 PolarHBondContact O-OG 2.89Å; S263-R265 VanDerWaalsContact C-N 3.32Å; S263-R265 PolarHBondContact O-N 2.95Å; S263-G267 CarbonylContact O-C 3.26Å; S263-G267 VanDerWaalsContact O-C 3.26Å; S263-G267 WeakPolarHBondContact O-CA 3.5Å; S263-G267 PolarHBondContact O-N 3.15Å; S263-E268 PolarHBondContact O-N 3.44Å; S263-H276 WeakPolarHBondContact CB-CE1 3.27Å; S263-H276 PolarHBondContact O-CE1 3.24Å; S263-H276 PolarHBondContact OG-CE1 2.98Å; S263-H276 PolarHBondContact OG-ND1 3.03Å
264H68.9Low76.2Confident93 Ų9379.2 Ų79.243%0.43140%0.397SS..Hα-helixtrans-67.2-32177.6-174-62.6000112S260 F261S260-H264 WeakPolarHBondContact O-CB 3.29Å; S260-H264 PolarHBondContact O-N 2.9Å; F261-H264 PolarHBondContact O-N 2.8Å
265R70.9Confident75.7Confident160 Ų16080.4 Ų80.460%0.60441%0.409SS*.Hα-helixtrans-83.1-35-176.1-177.260.4-176.395.8-4.4114.5F261 F262 S263F261-R265 VanDerWaalsContact O-CB 3.31Å; F261-R265 WeakPolarHBondContact O-CB 3.46Å; F261-R265 PolarHBondContact O-N 3.47Å; F262-R265 PolarHBondContact O-N 2.78Å; S263-R265 VanDerWaalsContact C-N 3.32Å; S263-R265 PolarHBondContact O-N 2.95Å
266F72.4Confident75.2Confident150 Ų15077.9 Ų77.966%0.65839%0.391SS*.Hα-helixtrans-120.7-18.3-171.7-61.3-77.5000113.5F262F262-F266 HydrophobicContact CB-CD2 4.46Å; F262-F266 AromaticContact CD1-CD2 3.76Å; F262-F266 HydrophobicContact CD1-CD2 3.76Å; F262-F266 AromaticContact CD1-CE2 3.59Å; F262-F266 HydrophobicContact CD1-CE2 3.59Å; F262-F266 HydrophobicContact CE1-CE2 4.04Å; F262-F266 WeakPolarHBondContact O-CB 3.32Å; F262-F266 WeakPolarHBondContact O-CD2 3.36Å; F262-F266 PolarHBondContact O-N 3.2Å
267G64.9Low75.1Confident7 Ų777.5 Ų77.57%0.07239%0.389CS..  trans-1118.8-175.900000114.6S263 H269 T270 I271S263-G267 CarbonylContact O-C 3.26Å; S263-G267 VanDerWaalsContact O-C 3.26Å; S263-G267 WeakPolarHBondContact O-CA 3.5Å; S263-G267 PolarHBondContact O-N 3.15Å; G267-H269 PolarHBondContact O-N 2.86Å; G267-T270 PolarHBondContact O-N 2.88Å; G267-I271 PolarHBondContact O-N 3.33Å
268E68.5Low75Confident112 Ų11278.3 Ų78.352%0.52339%0.389SS..THydrogen-bonded Turntrans-53.2-30.5-175-171.5171.8-172.200113.5S263S263-E268 PolarHBondContact O-N 3.44Å
269H70.4Confident75Confident182 Ų18275.2 Ų75.284%0.84338%0.377SS*.THydrogen-bonded Turntrans-100.2-8.7178.2-59.7-55.2000114.4G267G267-H269 PolarHBondContact O-N 2.86Å
270T73.9Confident75Confident122 Ų12270.6 Ų70.675%0.74836%0.358SS*.THydrogen-bonded Turntrans-110.1-29.8-173.4-48.20000112.2G267G267-T270 PolarHBondContact O-N 2.88Å
271I75.9Confident75.5Confident45 Ų4568.9 Ų68.923%0.23135%0.346CS..SBendtrans-103.2127.8-175.6-62.8173.1000108.8G267 C275G267-I271 PolarHBondContact O-N 3.33Å; I271-C275 HydrophobicContact CG2-CB 3.57Å
272P79.6Confident75.9Confident69 Ų6966 Ų6645%0.44834%0.336SS..  trans-58.1143.9177.2-26.334.8000112.6S274 C275P272-S274 PolarHBondContact O-N 3.45Å; P272-S274 VanDerWaalsContact O-N 3.13Å; P272-C275 WeakPolarHBondContact O-CB 3.46Å; P272-C275 PolarHBondContact O-N 3.45Å
273P76.9Confident76.3Confident86 Ų8663 Ų6356%0.55832%0.321SS*.Hα-helixtrans-53.2-35.2176.1-28.535.5000113.8C275 H276 I277P273-C275 VanDerWaalsContact C-N 3.31Å; P273-C275 PolarHBondContact O-N 2.96Å; P273-H276 PolarHBondContact O-N 3.4Å; P273-I277 VanDerWaalsContact O-CD1 3.31Å; P273-I277 WeakPolarHBondContact O-CD1 3.47Å; P273-I277 WeakPolarHBondContact O-CG1 3.25Å; P273-I277 PolarHBondContact O-N 2.86Å
274S77.6Confident76.9Confident21 Ų2162.8 Ų62.815%0.14732%0.32CS..Hα-helixtrans-57.9-40.1175.349.50000113P20 P272 I277 I278P20-S274 WeakPolarHBondContact O-CB 3.27Å; P272-S274 PolarHBondContact O-N 3.45Å; P272-S274 VanDerWaalsContact O-N 3.13Å; S274-I277 PolarHBondContact O-N 2.92Å; S274-I278 VanDerWaalsContact O-CG1 3.29Å; S274-I278 WeakPolarHBondContact O-CG1 3.29Å; S274-I278 PolarHBondContact O-N 3.31Å
275C77.1Confident77.9Confident52 Ų5258.4 Ų58.435%0.35130%0.299SS..Hα-helixtrans-66.1-42.7177.9-67.20000111.8I271 P272 P273 I277 I278 V279I271-C275 HydrophobicContact CG2-CB 3.57Å; P272-C275 WeakPolarHBondContact O-CB 3.46Å; P272-C275 PolarHBondContact O-N 3.45Å; P273-C275 VanDerWaalsContact C-N 3.31Å; P273-C275 PolarHBondContact O-N 2.96Å; C275-I277 VanDerWaalsContact C-N 3.27Å; C275-I277 PolarHBondContact O-N 3.41Å; C275-I278 PolarHBondContact O-N 2.89Å; C275-V279 WeakPolarHBondContact O-CB 3.43Å; C275-V279 VanDerWaalsContact O-CG2 3.29Å; C275-V279 WeakPolarHBondContact O-CG2 3.11Å; C275-V279 PolarHBondContact O-N 3.24Å
276H77.8Confident78.8Confident31 Ų3152.7 Ų52.714%0.14428%0.28CS..Hα-helixtrans-59.5-40.4176.6-68.7-68000111.8S263 P273 A280S263-H276 WeakPolarHBondContact CB-CE1 3.27Å; S263-H276 PolarHBondContact O-CE1 3.24Å; S263-H276 PolarHBondContact OG-CE1 2.98Å; S263-H276 PolarHBondContact OG-ND1 3.03Å; P273-H276 PolarHBondContact O-N 3.4Å; H276-A280 VanDerWaalsContact O-CB 3.27Å; H276-A280 WeakPolarHBondContact O-CB 3.49Å; H276-A280 PolarHBondContact O-N 3.19Å
277I79.4Confident79.7Confident4 Ų445.5 Ų45.52%0.02125%0.249CC..Hα-helixtrans-74.6-42.1-177.7-63.2154.7000111V19 P20 P177 T179 P273 S274 C275 V279 A280 N281V19-I277 HydrophobicContact CG2-CG2 4.1Å; P20-I277 HydrophobicContact CG-CD1 3.75Å; P177-I277 WeakPolarHBondContact O-CD1 3.41Å; P177-I277 WeakPolarHBondContact O-CG1 3.16Å; T179-I277 HydrophobicContact CG2-CG2 4.43Å; P273-I277 VanDerWaalsContact O-CD1 3.31Å; P273-I277 WeakPolarHBondContact O-CD1 3.47Å; P273-I277 WeakPolarHBondContact O-CG1 3.25Å; P273-I277 PolarHBondContact O-N 2.86Å; S274-I277 PolarHBondContact O-N 2.92Å; C275-I277 VanDerWaalsContact C-N 3.27Å; C275-I277 PolarHBondContact O-N 3.41Å; I277-V279 VanDerWaalsContact C-N 3.3Å; I277-V279 PolarHBondContact O-N 3.43Å; I277-A280 PolarHBondContact O-N 2.94Å; I277-N281 PolarHBondContact O-N 3.44Å; I277-N281 PolarHBondContact O-ND2 3.49Å
278I80.4Confident81Confident45 Ų4545.2 Ų45.223%0.23125%0.246CC..Hα-helixtrans-58.9-46.3174.4-70.8168.1000109.8V19 L22 S274 C275 A280 N281 I282V19-I278 HydrophobicContact CG1-CD1 4.32Å; V19-I278 HydrophobicContact CG1-CG1 4.13Å; L22-I278 HydrophobicContact CD1-CD1 3.86Å; S274-I278 VanDerWaalsContact O-CG1 3.29Å; S274-I278 WeakPolarHBondContact O-CG1 3.29Å; S274-I278 PolarHBondContact O-N 3.31Å; C275-I278 PolarHBondContact O-N 2.89Å; I278-A280 PolarHBondContact O-N 2.7Å; I278-N281 PolarHBondContact O-N 3.23Å; I278-I282 HydrophobicContact CG2-CD1 3.72Å; I278-I282 HydrophobicContact CG2-CG1 4.35Å; I278-I282 WeakPolarHBondContact O-CG1 3.39Å; I278-I282 PolarHBondContact O-N 3.48Å
279V82.2Confident82.2Confident26 Ų2640.3 Ų40.316%0.15822%0.224CC..Hα-helixtrans-66.4-38.2178.3175.10000111.8F259 C275 I277 N281 I282 Y283F259-V279 HydrophobicContact CB-CG1 4.49Å; F259-V279 HydrophobicContact CD1-CB 4.16Å; F259-V279 HydrophobicContact CD1-CG1 3.53Å; F259-V279 HydrophobicContact CD1-CG2 3.94Å; F259-V279 HydrophobicContact CE1-CB 4.35Å; F259-V279 HydrophobicContact CE1-CG1 4.2Å; F259-V279 HydrophobicContact CE1-CG2 3.75Å; F259-V279 HydrophobicContact CG-CG1 4.37Å; C275-V279 WeakPolarHBondContact O-CB 3.43Å; C275-V279 VanDerWaalsContact O-CG2 3.29Å; C275-V279 WeakPolarHBondContact O-CG2 3.11Å; C275-V279 PolarHBondContact O-N 3.24Å; I277-V279 VanDerWaalsContact C-N 3.3Å; I277-V279 PolarHBondContact O-N 3.43Å; V279-N281 VanDerWaalsContact C-N 3.25Å; V279-N281 PolarHBondContact O-N 3.35Å; V279-I282 PolarHBondContact O-N 2.96Å; V279-Y283 VanDerWaalsContact O-CB 3.29Å; V279-Y283 WeakPolarHBondContact O-CB 3.41Å; V279-Y283 PolarHBondContact O-N 3.41Å
280A81.4Confident83.2Confident5 Ų534 Ų344%0.04120%0.195CC..Hα-helixtrans-60.3-35.3174.200000112.5Y180 H276 I277 I278 Y283 L284Y180-A280 HydrophobicContact CE1-CB 4.3Å; H276-A280 VanDerWaalsContact O-CB 3.27Å; H276-A280 WeakPolarHBondContact O-CB 3.49Å; H276-A280 PolarHBondContact O-N 3.19Å; I277-A280 PolarHBondContact O-N 2.94Å; I278-A280 PolarHBondContact O-N 2.7Å; A280-Y283 WeakPolarHBondContact O-CB 3.36Å; A280-L284 WeakPolarHBondContact O-CG 3.31Å
281N84.2Confident84.1Confident1 Ų128.3 Ų28.31%0.00516%0.16CC..Hα-helixtrans-76.4-41.1174-74.7-89.9000112.5F33 T179 I277 I278 V279 Y283 L284 L285F33-N281 HydrophobicContact CD1-CB 4.47Å; F33-N281 HydrophobicContact CE1-CB 3.31Å; F33-N281 HydrophobicContact CZ-CB 3.53Å; T179-N281 VanDerWaalsContact OG1-CG 3.24Å; T179-N281 PolarHBondContact OG1-ND2 2.85Å; T179-N281 PolarHBondContact OG1-OD1 3.47Å; I277-N281 PolarHBondContact O-N 3.44Å; I277-N281 PolarHBondContact O-ND2 3.49Å; I278-N281 PolarHBondContact O-N 3.23Å; V279-N281 VanDerWaalsContact C-N 3.25Å; V279-N281 PolarHBondContact O-N 3.35Å; N281-Y283 PolarHBondContact O-N 3.23Å; N281-L284 PolarHBondContact O-N 3.12Å; N281-L285 WeakPolarHBondContact O-CB 3.49Å; N281-L285 PolarHBondContact O-N 3.41Å
282I84.7Confident84.7Confident61 Ų6126.8 Ų26.831%0.31315%0.153SC..Hα-helixtrans-58.8-39.9174.6-70.9170.3000110.1I278 V279 L284 L285 L286I278-I282 HydrophobicContact CG2-CD1 3.72Å; I278-I282 HydrophobicContact CG2-CG1 4.35Å; I278-I282 WeakPolarHBondContact O-CG1 3.39Å; I278-I282 PolarHBondContact O-N 3.48Å; V279-I282 PolarHBondContact O-N 2.96Å; I282-L284 VanDerWaalsContact C-N 3.25Å; I282-L284 PolarHBondContact O-N 3.44Å; I282-L285 PolarHBondContact O-N 3.33Å; I282-L286 HydrophobicContact CG2-CB 4.04Å; I282-L286 HydrophobicContact CG2-CD2 4.25Å; I282-L286 WeakPolarHBondContact O-CB 3.31Å; I282-L286 PolarHBondContact O-N 3.47Å
283Y83.6Confident85.1Confident45 Ų4527.1 Ų27.118%0.17615%0.15CC..Hα-helixtrans-54.5-40.9174.4163.1-116.3000112.6T110 P256 A257 V279 A280 N281 P287T110-Y283 WeakPolarHBondContact CG2-OH 3.13Å; P256-Y283 HydrophobicContact CB-CD2 4.18Å; P256-Y283 HydrophobicContact CB-CG 4.45Å; A257-Y283 HydrophobicContact CB-CD2 3.86Å; A257-Y283 HydrophobicContact CB-CE2 3.58Å; V279-Y283 VanDerWaalsContact O-CB 3.29Å; V279-Y283 WeakPolarHBondContact O-CB 3.41Å; V279-Y283 PolarHBondContact O-N 3.41Å; A280-Y283 WeakPolarHBondContact O-CB 3.36Å; N281-Y283 PolarHBondContact O-N 3.23Å; Y283-P287 WeakPolarHBondContact O-CD 3.15Å
284L84.8Confident85.8Confident2 Ų223.7 Ų23.71%0.0113%0.128CC..Hα-helixtrans-83.2-23.7-179.8-62.7172.7000113.9M75 T79 I106 Y180 A280 N281 I282 P288M75-L284 HydrophobicContact CG-CD2 4.24Å; M75-L284 HydrophobicContact SD-CB 4.38Å; M75-L284 HydrophobicContact SD-CD2 3.69Å; T79-L284 HydrophobicContact CG2-CD1 4.1Å; I106-L284 HydrophobicContact CG2-CD2 4.35Å; Y180-L284 HydrophobicContact CD1-CD1 4.1Å; Y180-L284 HydrophobicContact CE1-CD1 3.79Å; A280-L284 WeakPolarHBondContact O-CG 3.31Å; N281-L284 PolarHBondContact O-N 3.12Å; I282-L284 VanDerWaalsContact C-N 3.25Å; I282-L284 PolarHBondContact O-N 3.44Å; L284-P288 WeakPolarHBondContact O-CD 3.24Å; L284-P288 WeakPolarHBondContact O-CG 3.36Å
285L88.9Confident86.3Confident1 Ų122.8 Ų22.81%0.00512%0.121CC..Hα-helixtrans-99.9-34.9-174-91.3151.7000113.8F33 M36 I80 N281 I282 T289F33-L285 HydrophobicContact CD1-CD1 3.61Å; F33-L285 HydrophobicContact CE1-CD1 3.93Å; F33-L285 HydrophobicContact CG-CD1 4.07Å; M36-L285 HydrophobicContact CB-CD2 3.79Å; M36-L285 HydrophobicContact CE-CB 3.79Å; M36-L285 HydrophobicContact SD-CB 4.42Å; I80-L285 HydrophobicContact CD1-CD1 3.45Å; I80-L285 VanDerWaalsContact CD1-CD1 3.45Å; I80-L285 HydrophobicContact CD1-CD2 4.02Å; I80-L285 HydrophobicContact CD1-CG 3.62Å; I80-L285 HydrophobicContact CG1-CD1 4.28Å; I80-L285 HydrophobicContact CG1-CD2 3.91Å; I80-L285 HydrophobicContact CG1-CG 4.03Å; N281-L285 WeakPolarHBondContact O-CB 3.49Å; N281-L285 PolarHBondContact O-N 3.41Å; I282-L285 PolarHBondContact O-N 3.33Å; L285-T289 WeakPolarHBondContact O-CB 3.31Å; L285-T289 PolarHBondContact O-N 3.48Å; L285-T289 VanDerWaalsContact O-N 3.12Å; L285-T289 PolarHBondContact O-OG1 3.24Å
286L91.3Very high86.6Confident39 Ų3921.3 Ų21.320%0.20412%0.115CC..Hα-helixtrans-64-47.8-172.7-176.769.3000111.7M36 F252 P256 I282 T289 M290M36-L286 HydrophobicContact CE-CB 4.43Å; M36-L286 HydrophobicContact CE-CD1 4.37Å; F252-L286 HydrophobicContact CB-CD2 4.41Å; F252-L286 HydrophobicContact CB-CG 4.39Å; F252-L286 HydrophobicContact CD1-CD2 3.99Å; F252-L286 HydrophobicContact CD1-CG 4.27Å; P256-L286 HydrophobicContact CG-CD2 3.97Å; I282-L286 HydrophobicContact CG2-CB 4.04Å; I282-L286 HydrophobicContact CG2-CD2 4.25Å; I282-L286 WeakPolarHBondContact O-CB 3.31Å; I282-L286 PolarHBondContact O-N 3.47Å; L286-T289 PolarHBondContact O-N 3.19Å; L286-M290 HydrophobicContact CD1-CG 3.59Å; L286-M290 HydrophobicContact CD1-SD 4.49Å; L286-M290 HydrophobicContact CG-CG 4.12Å; L286-M290 VanDerWaalsContact O-CB 3.3Å; L286-M290 WeakPolarHBondContact O-CB 3.44Å; L286-M290 VanDerWaalsContact O-CG 3.25Å; L286-M290 WeakPolarHBondContact O-CG 3.47Å; L286-M290 PolarHBondContact O-N 3.36Å
287P90.8Very high87Confident0 Ų024 Ų240%013%0.133CC..Hα-helixtrans-63.8-50.5179.2-15.228.7000112.4E113 Y283 T289 M290 N291E113-P287 WeakPolarHBondContact OE1-CB 3.2Å; Y283-P287 WeakPolarHBondContact O-CD 3.15Å; P287-T289 PolarHBondContact O-N 2.88Å; P287-T289 VanDerWaalsContact O-N 3.11Å; P287-M290 PolarHBondContact O-N 3.39Å; P287-M290 VanDerWaalsContact O-N 3.13Å; P287-N291 VanDerWaalsContact O-CB 3.22Å; P287-N291 WeakPolarHBondContact O-CB 3.49Å; P287-N291 PolarHBondContact O-N 2.96Å; P287-N291 PolarHBondContact O-ND2 3.13Å; P287-N291 PolarHBondContact O-OD1 3.39Å
288P91.9Very high87.2Confident0 Ų029.8 Ų29.80%016%0.158CC..Hα-helixtrans-54.7-33.7176.3-33.541.4000114.9A40 N44 D72 C76 L284 P292A40-P288 HydrophobicContact CB-CB 3.85Å; N44-P288 PolarHBondContact ND2-O 2.88Å; D72-P288 HydrophobicContact CB-CB 3.77Å; D72-P288 HydrophobicContact CB-CG 3.89Å; D72-P288 WeakPolarHBondContact OD2-CA 3.45Å; C76-P288 WeakPolarHBondContact SG-CB 3.39Å; C76-P288 VanDerWaalsContact SG-CG 3.59Å; L284-P288 WeakPolarHBondContact O-CD 3.24Å; L284-P288 WeakPolarHBondContact O-CG 3.36Å; P288-P292 WeakPolarHBondContact O-CD 3.44Å; P288-P292 WeakPolarHBondContact O-CG 3.47Å
289T92.6Very high87.3Confident10 Ų1028.3 Ų28.36%0.06115%0.151CC..Hα-helixtrans-77.2-45.5178.8-540000111.4M36 V39 L285 L286 P287 I293M36-T289 HydrophobicContact CB-CG2 4.41Å; M36-T289 HydrophobicContact CE-CG2 4.42Å; M36-T289 HydrophobicContact CG-CG2 4.34Å; M36-T289 PolarHBondContact O-OG1 2.84Å; V39-T289 HydrophobicContact CB-CG2 4.14Å; V39-T289 HydrophobicContact CG1-CG2 3.76Å; L285-T289 WeakPolarHBondContact O-CB 3.31Å; L285-T289 PolarHBondContact O-N 3.48Å; L285-T289 VanDerWaalsContact O-N 3.12Å; L285-T289 PolarHBondContact O-OG1 3.24Å; L286-T289 PolarHBondContact O-N 3.19Å; P287-T289 PolarHBondContact O-N 2.88Å; P287-T289 VanDerWaalsContact O-N 3.11Å; T289-I293 WeakPolarHBondContact O-CD1 3.39Å; T289-I293 WeakPolarHBondContact O-CG1 3.41Å
290M92.6Very high87.2Confident50 Ų5033.3 Ų33.325%0.24617%0.171CC..Hα-helixtrans-83.3-32.2-171.4-65.8-57.9-69.500113.1F252 L286 P287 I293 V294F252-M290 HydrophobicContact CD1-CG 4.47Å; F252-M290 HydrophobicContact CD2-CB 3.59Å; F252-M290 HydrophobicContact CD2-CG 4.16Å; F252-M290 HydrophobicContact CE1-CE 4.24Å; F252-M290 HydrophobicContact CE2-CB 3.87Å; F252-M290 HydrophobicContact CE2-CE 3.74Å; F252-M290 HydrophobicContact CE2-CG 4.23Å; F252-M290 HydrophobicContact CG-CB 4.07Å; F252-M290 HydrophobicContact CG-CG 4.3Å; F252-M290 HydrophobicContact CZ-CE 3.55Å; F252-M290 HydrophobicContact CZ-CG 4.43Å; L286-M290 HydrophobicContact CD1-CG 3.59Å; L286-M290 HydrophobicContact CD1-SD 4.49Å; L286-M290 HydrophobicContact CG-CG 4.12Å; L286-M290 VanDerWaalsContact O-CB 3.3Å; L286-M290 WeakPolarHBondContact O-CB 3.44Å; L286-M290 VanDerWaalsContact O-CG 3.25Å; L286-M290 WeakPolarHBondContact O-CG 3.47Å; L286-M290 PolarHBondContact O-N 3.36Å; P287-M290 PolarHBondContact O-N 3.39Å; P287-M290 VanDerWaalsContact O-N 3.13Å; M290-I293 PolarHBondContact O-N 3.27Å; M290-I293 HydrophobicContact SD-CD1 4.33Å; M290-V294 WeakPolarHBondContact O-CB 3.39Å; M290-V294 VanDerWaalsContact O-CG2 3.26Å; M290-V294 WeakPolarHBondContact O-CG2 3.41Å; M290-V294 PolarHBondContact O-N 3.05Å
291N91.6Very high87.1Confident1 Ų137.4 Ų37.41%0.00519%0.189CC..Hα-helixtrans-49.7-60.4178.7-74.3-19000112.1D72 A249 P287 I293 V294 Y295D72-N291 PolarHBondContact OD2-ND2 3.14Å; A249-N291 WeakPolarHBondContact CB-OD1 3.31Å; P287-N291 VanDerWaalsContact O-CB 3.22Å; P287-N291 WeakPolarHBondContact O-CB 3.49Å; P287-N291 PolarHBondContact O-N 2.96Å; P287-N291 PolarHBondContact O-ND2 3.13Å; P287-N291 PolarHBondContact O-OD1 3.39Å; N291-I293 VanDerWaalsContact C-N 3.29Å; N291-I293 PolarHBondContact O-N 3.36Å; N291-V294 PolarHBondContact O-N 2.75Å; N291-Y295 HydrophobicContact CB-CD2 4.41Å; N291-Y295 HydrophobicContact CB-CE2 4.35Å; N291-Y295 WeakPolarHBondContact O-CD2 3.29Å; N291-Y295 PolarHBondContact O-N 2.95Å
292P88.4Confident86.8Confident13 Ų1337.6 Ų37.68%0.08419%0.19CC..Hα-helixtrans-62.9-33.5-178.424.6-34.5000112.9P288 G296P288-P292 WeakPolarHBondContact O-CD 3.44Å; P288-P292 WeakPolarHBondContact O-CG 3.47Å; P292-G296 WeakPolarHBondContact O-CA 3.39Å; P292-G296 PolarHBondContact O-N 3.44Å
293I89.9Confident86.7Confident77 Ų7740 Ų4040%0.39520%0.195SC..Hα-helixtrans-65.8-49.7176.6-61.2172.1000110.2V39 T289 M290 N291 G296 V297V39-I293 HydrophobicContact CG1-CD1 4.15Å; T289-I293 WeakPolarHBondContact O-CD1 3.39Å; T289-I293 WeakPolarHBondContact O-CG1 3.41Å; M290-I293 PolarHBondContact O-N 3.27Å; M290-I293 HydrophobicContact SD-CD1 4.33Å; N291-I293 VanDerWaalsContact C-N 3.29Å; N291-I293 PolarHBondContact O-N 3.36Å; I293-G296 PolarHBondContact O-N 3.33Å; I293-V297 HydrophobicContact CG2-CG2 4.41Å; I293-V297 WeakPolarHBondContact O-CB 2.95Å; I293-V297 VanDerWaalsContact O-CG2 3.28Å; I293-V297 WeakPolarHBondContact O-CG2 3.29Å; I293-V297 PolarHBondContact O-N 2.97Å
294V90.9Very high86.7Confident14 Ų1441 Ų419%0.08520%0.204CC..Hα-helixtrans-61.7-49.5-179.4169.70000110.4A245 C248 F252 M290 N291 V297 K298A245-V294 HydrophobicContact CB-CG1 3.91Å; A245-V294 WeakPolarHBondContact O-CG1 3.08Å; C248-V294 HydrophobicContact CB-CG1 3.83Å; C248-V294 HydrophobicContact CB-CG2 4.21Å; F252-V294 HydrophobicContact CD2-CG2 4.35Å; F252-V294 HydrophobicContact CE2-CG2 3.79Å; M290-V294 WeakPolarHBondContact O-CB 3.39Å; M290-V294 VanDerWaalsContact O-CG2 3.26Å; M290-V294 WeakPolarHBondContact O-CG2 3.41Å; M290-V294 PolarHBondContact O-N 3.05Å; N291-V294 PolarHBondContact O-N 2.75Å; V294-V297 PolarHBondContact O-N 3.47Å; V294-K298 HydrophobicContact CG1-CG 4.49Å; V294-K298 WeakPolarHBondContact O-CB 3.45Å; V294-K298 WeakPolarHBondContact O-CG 3.21Å; V294-K298 PolarHBondContact O-N 3Å
295Y86.8Confident86.4Confident1 Ų141 Ų410%0.00420%0.204CC..Hα-helixtrans-66.9-39.6178.6-69.1-64.2000111.7M61 L65 L68 M120 A245 A249 N291 V297 T299M61-Y295 HydrophobicContact CE-CD1 4.18Å; M61-Y295 HydrophobicContact CE-CE1 3.92Å; L65-Y295 HydrophobicContact CD1-CD1 4.15Å; L65-Y295 HydrophobicContact CD1-CG 4.23Å; L65-Y295 HydrophobicContact CD2-CD1 3.77Å; L65-Y295 HydrophobicContact CD2-CD2 3.37Å; L65-Y295 HydrophobicContact CD2-CE1 3.68Å; L65-Y295 HydrophobicContact CD2-CE2 3.29Å; L65-Y295 HydrophobicContact CD2-CG 3.65Å; L65-Y295 VanDerWaalsContact CD2-CZ 3.47Å; L68-Y295 HydrophobicContact CD2-CE2 4.2Å; M120-Y295 HydrophobicContact CE-CE1 3.99Å; M120-Y295 WeakPolarHBondContact CE-OH 3.49Å; A245-Y295 HydrophobicContact CB-CD1 3.74Å; A245-Y295 HydrophobicContact CB-CE1 3.68Å; A249-Y295 HydrophobicContact CB-CE2 4.34Å; N291-Y295 HydrophobicContact CB-CD2 4.41Å; N291-Y295 HydrophobicContact CB-CE2 4.35Å; N291-Y295 WeakPolarHBondContact O-CD2 3.29Å; N291-Y295 PolarHBondContact O-N 2.95Å; Y295-V297 PolarHBondContact O-N 3.29Å; Y295-T299 WeakPolarHBondContact O-CA 3.31Å; Y295-T299 WeakPolarHBondContact O-CB 3.45Å; Y295-T299 PolarHBondContact O-N 2.84Å; Y295-T299 PolarHBondContact O-OG1 3.48Å
296G84.3Confident86Confident21 Ų2143.6 Ų43.622%0.21622%0.219CC..Hα-helixtrans-62.2-41.2175.700000113.7P292 I293 R303P292-G296 WeakPolarHBondContact O-CA 3.39Å; P292-G296 PolarHBondContact O-N 3.44Å; I293-G296 PolarHBondContact O-N 3.33Å; G296-R303 WeakPolarHBondContact O-CB 3.44Å
297V85.3Confident85.5Confident88 Ų8846.2 Ų46.253%0.53323%0.233SC..Hα-helixtrans-79.2-41-179.2172.80000112I293 V294 Y295I293-V297 HydrophobicContact CG2-CG2 4.41Å; I293-V297 WeakPolarHBondContact O-CB 2.95Å; I293-V297 VanDerWaalsContact O-CG2 3.28Å; I293-V297 WeakPolarHBondContact O-CG2 3.29Å; I293-V297 PolarHBondContact O-N 2.97Å; V294-V297 PolarHBondContact O-N 3.47Å; Y295-V297 PolarHBondContact O-N 3.29Å
298K85.3Confident85.1Confident125 Ų12550.6 Ų50.654%0.54325%0.249SC..Hα-helixtrans-92.9-22.3-171.4-62.4-65-175.7178.90113.7A245 V294A245-K298 HydrophobicContact CB-CB 4.01Å; V294-K298 HydrophobicContact CG1-CG 4.49Å; V294-K298 WeakPolarHBondContact O-CB 3.45Å; V294-K298 WeakPolarHBondContact O-CG 3.21Å; V294-K298 PolarHBondContact O-N 3Å
299T81Confident84.4Confident14 Ų1454.2 Ų54.29%0.08627%0.268CS..  trans-96.6104.4179.1-53.80000110.3Y62 Y295 Q301 I302 R303Y62-T299 HydrophobicContact CE1-CG2 4.05Å; Y62-T299 WeakPolarHBondContact OH-CG2 3.43Å; Y295-T299 WeakPolarHBondContact O-CA 3.31Å; Y295-T299 WeakPolarHBondContact O-CB 3.45Å; Y295-T299 PolarHBondContact O-N 2.84Å; Y295-T299 PolarHBondContact O-OG1 3.48Å; T299-Q301 VanDerWaalsContact C-N 3.29Å; T299-Q301 PolarHBondContact O-N 2.88Å; T299-I302 HydrophobicContact CG2-CB 4.41Å; T299-I302 HydrophobicContact CG2-CD1 3.96Å; T299-I302 HydrophobicContact CG2-CG1 3.91Å; T299-I302 PolarHBondContact O-N 3.41Å; T299-R303 PolarHBondContact O-N 3.12Å
300K81.2Confident83.9Confident132 Ų13260.5 Ų60.557%0.57430%0.3SS*.Hα-helixtrans-50.7-44.4-178.4-178176.3176.8-176.70113I302 R303 D304K300-I302 VanDerWaalsContact C-N 3.34Å; K300-I302 PolarHBondContact O-N 3.06Å; K300-R303 PolarHBondContact O-N 3.12Å; K300-D304 WeakPolarHBondContact CE-OD2 3.14Å; K300-D304 VanDerWaalsContact CG-OD2 3.27Å; K300-D304 WeakPolarHBondContact CG-OD2 3.13Å; K300-D304 WeakPolarHBondContact O-CB 3.18Å; K300-D304 PolarHBondContact O-N 3.22Å
301Q77.9Confident83.2Confident91 Ų9162 Ų6243%0.42532%0.315SS..Hα-helixtrans-63.1-37.8-180-66.5116.5-32.400113.3L57 Y62 T299 C305L57-Q301 HydrophobicContact CD2-CB 3.8Å; Y62-Q301 WeakPolarHBondContact OH-CB 3.36Å; Y62-Q301 PolarHBondContact OH-OE1 3.47Å; T299-Q301 VanDerWaalsContact C-N 3.29Å; T299-Q301 PolarHBondContact O-N 2.88Å; Q301-C305 VanDerWaalsContact O-CB 3.32Å; Q301-C305 WeakPolarHBondContact O-CB 3.32Å; Q301-C305 PolarHBondContact O-N 2.94Å; Q301-C305 VanDerWaalsContact O-N 3.15Å
302I78.3Confident81.8Confident4 Ų464.6 Ų64.62%0.02134%0.343CS..Hα-helixtrans-68.4-48.1176.5-64173.1000108.9L47 L50 Y62 L65 T299 K300 D304 C305 V306L47-I302 HydrophobicContact CD1-CD1 3.72Å; L47-I302 HydrophobicContact CD1-CG1 4.31Å; L47-I302 HydrophobicContact CD1-CG2 4.23Å; L50-I302 HydrophobicContact CD1-CG2 4.09Å; Y62-I302 HydrophobicContact CD1-CD1 4.36Å; Y62-I302 HydrophobicContact CE1-CD1 3.9Å; Y62-I302 HydrophobicContact CE1-CG1 3.86Å; L65-I302 HydrophobicContact CD1-CD1 4.01Å; T299-I302 HydrophobicContact CG2-CB 4.41Å; T299-I302 HydrophobicContact CG2-CD1 3.96Å; T299-I302 HydrophobicContact CG2-CG1 3.91Å; T299-I302 PolarHBondContact O-N 3.41Å; K300-I302 VanDerWaalsContact C-N 3.34Å; K300-I302 PolarHBondContact O-N 3.06Å; I302-D304 PolarHBondContact O-N 2.97Å; I302-C305 PolarHBondContact O-N 2.83Å; I302-V306 HydrophobicContact CG2-CG2 4.3Å; I302-V306 WeakPolarHBondContact O-CG2 3.25Å; I302-V306 PolarHBondContact O-N 2.73Å
303R83.4Confident80.2Confident113 Ų11367 Ų6743%0.42636%0.36SS..Hα-helixtrans-56.5-49.1178.6-169.8-178.964.8-169.53.3112.4G296 T299 K300 C305 V306 I307G296-R303 WeakPolarHBondContact O-CB 3.44Å; T299-R303 PolarHBondContact O-N 3.12Å; K300-R303 PolarHBondContact O-N 3.12Å; R303-C305 VanDerWaalsContact C-N 3.3Å; R303-C305 PolarHBondContact O-N 3.25Å; R303-V306 PolarHBondContact O-N 3.09Å; R303-I307 HydrophobicContact CG-CD1 3.95Å; R303-I307 VanDerWaalsContact O-CG1 3.28Å; R303-I307 WeakPolarHBondContact O-CG1 3.44Å; R303-I307 PolarHBondContact O-N 3.23Å
304D82.4Confident78.1Confident65 Ų6572.8 Ų72.835%0.34838%0.382SS..Hα-helixtrans-65.8-36.5-177.3-64.7-5.3000110.6K300 I302 R308K300-D304 WeakPolarHBondContact CE-OD2 3.14Å; K300-D304 VanDerWaalsContact CG-OD2 3.27Å; K300-D304 WeakPolarHBondContact CG-OD2 3.13Å; K300-D304 WeakPolarHBondContact O-CB 3.18Å; K300-D304 PolarHBondContact O-N 3.22Å; I302-D304 PolarHBondContact O-N 2.97Å; D304-R308 WeakPolarHBondContact O-CB 3.09Å; D304-R308 PolarHBondContact O-N 3.34Å
305C78.8Confident75.9Confident3 Ų378 Ų782%0.0241%0.41CS..Hα-helixtrans-66.7-45.8173.71790000112.7E54 Q301 I302 R303 I307 R308 I309E54-C305 WeakPolarHBondContact CG-SG 3.22Å; E54-C305 PolarHBondContact OE1-SG 2.99Å; Q301-C305 VanDerWaalsContact O-CB 3.32Å; Q301-C305 WeakPolarHBondContact O-CB 3.32Å; Q301-C305 PolarHBondContact O-N 2.94Å; Q301-C305 VanDerWaalsContact O-N 3.15Å; I302-C305 PolarHBondContact O-N 2.83Å; R303-C305 VanDerWaalsContact C-N 3.3Å; R303-C305 PolarHBondContact O-N 3.25Å; C305-I307 VanDerWaalsContact C-N 3.33Å; C305-I307 PolarHBondContact O-N 2.94Å; C305-R308 PolarHBondContact O-N 2.93Å; C305-I309 WeakPolarHBondContact O-CG1 3.07Å; C305-I309 PolarHBondContact O-N 3.4Å
306V80.8Confident73.8Confident54 Ų5482.2 Ų82.233%0.32744%0.444SS..Hα-helixtrans-58.7-46.5175.8170.40000110.6L50 I302 R303 R308 I309 L310L50-V306 HydrophobicContact CD1-CG2 3.54Å; I302-V306 HydrophobicContact CG2-CG2 4.3Å; I302-V306 WeakPolarHBondContact O-CG2 3.25Å; I302-V306 PolarHBondContact O-N 2.73Å; R303-V306 PolarHBondContact O-N 3.09Å; V306-R308 VanDerWaalsContact C-N 3.33Å; V306-R308 PolarHBondContact O-N 2.93Å; V306-I309 PolarHBondContact O-N 3Å; V306-L310 HydrophobicContact CG1-CD1 3.74Å; V306-L310 HydrophobicContact CG1-CG 4.27Å; V306-L310 WeakPolarHBondContact O-CB 2.83Å; V306-L310 VanDerWaalsContact O-CG 3.32Å; V306-L310 WeakPolarHBondContact O-CG 3.16Å; V306-L310 PolarHBondContact O-N 2.87Å
307I82Confident71.6Confident94 Ų9490.1 Ų90.148%0.48247%0.473SS..Hα-helixtrans-59.5-45.3177.5-69.4168.1000110.4R303 C305 I309 L310 S311R303-I307 HydrophobicContact CG-CD1 3.95Å; R303-I307 VanDerWaalsContact O-CG1 3.28Å; R303-I307 WeakPolarHBondContact O-CG1 3.44Å; R303-I307 PolarHBondContact O-N 3.23Å; C305-I307 VanDerWaalsContact C-N 3.33Å; C305-I307 PolarHBondContact O-N 2.94Å; I307-I309 VanDerWaalsContact C-N 3.34Å; I307-I309 PolarHBondContact O-N 2.94Å; I307-L310 PolarHBondContact O-N 2.84Å; I307-S311 VanDerWaalsContact O-CB 3.25Å; I307-S311 WeakPolarHBondContact O-CB 3.19Å; I307-S311 PolarHBondContact O-N 3.33Å; I307-S311 PolarHBondContact O-OG 2.9Å
308R81.6Confident69.2Low93 Ų9390.1 Ų90.135%0.35148%0.477SS..Hα-helixtrans-60.9-40.4179.2179.6173.756.3-138.7-0.5113E54 D304 C305 V306 S311 S313E54-R308 IonicContact OE1-CZ 3.52Å; E54-R308 IonicContact OE1-NE 3.61Å; E54-R308 IonicContact OE1-NH2 2.69Å; E54-R308 PolarHBondContact OE1-NH2 3.15Å; E54-R308 IonicContact OE2-NH2 2.79Å; E54-R308 PolarHBondContact OE2-NH2 3.07Å; D304-R308 WeakPolarHBondContact O-CB 3.09Å; D304-R308 PolarHBondContact O-N 3.34Å; C305-R308 PolarHBondContact O-N 2.93Å; V306-R308 VanDerWaalsContact C-N 3.33Å; V306-R308 PolarHBondContact O-N 2.93Å; R308-S311 PolarHBondContact O-OG 3.02Å; R308-S313 PolarHBondContact O-N 3.34Å
309I78Confident67Low76 Ų7694.6 Ų94.639%0.3949%0.492SS..Hα-helixtrans-70.4-44.2178.4-70165.2000110.5L50 C305 V306 I307 G312L50-I309 HydrophobicContact CD2-CD1 3.21Å; C305-I309 WeakPolarHBondContact O-CG1 3.07Å; C305-I309 PolarHBondContact O-N 3.4Å; V306-I309 PolarHBondContact O-N 3Å; I307-I309 VanDerWaalsContact C-N 3.34Å; I307-I309 PolarHBondContact O-N 2.94Å; I309-G312 PolarHBondContact O-N 2.81Å
310L80.9Confident64.7Low141 Ų14198.2 Ų98.274%0.73852%0.518SS*.Hα-helixtrans-68.9-32.8178.8-70.1178.2000113V306 I307 G312V306-L310 HydrophobicContact CG1-CD1 3.74Å; V306-L310 HydrophobicContact CG1-CG 4.27Å; V306-L310 WeakPolarHBondContact O-CB 2.83Å; V306-L310 VanDerWaalsContact O-CG 3.32Å; V306-L310 WeakPolarHBondContact O-CG 3.16Å; V306-L310 PolarHBondContact O-N 2.87Å; I307-L310 PolarHBondContact O-N 2.84Å; L310-G312 PolarHBondContact O-N 3.42Å
311S79.4Confident62.6Low81 Ų81105 Ų10557%0.56656%0.555SS**THydrogen-bonded Turntrans-78.2-1.2177.567.20000113.5I307 R308 S313I307-S311 VanDerWaalsContact O-CB 3.25Å; I307-S311 WeakPolarHBondContact O-CB 3.19Å; I307-S311 PolarHBondContact O-N 3.33Å; I307-S311 PolarHBondContact O-OG 2.9Å; R308-S311 PolarHBondContact O-OG 3.02Å; S311-S313 PolarHBondContact O-N 3.38Å
312G61.6Low61.8Low57 Ų57105.7 Ų105.759%0.58856%0.561SS**THydrogen-bonded Turntrans66.221.4175.400000114.1I309 L310 K314I309-G312 PolarHBondContact O-N 2.81Å; L310-G312 PolarHBondContact O-N 3.42Å; G312-K314 PolarHBondContact O-N 3.43Å
313S54.3Low60.9Low63 Ų63111.1 Ų111.144%0.44159%0.59SS.*  trans-70.682.7174.7-162.20000109.1R308 S311 D315R308-S313 PolarHBondContact O-N 3.34Å; S311-S313 PolarHBondContact O-N 3.38Å; S313-D315 PolarHBondContact O-N 2.03Å
314K45.3Very low59.7Low199 Ų199110.9 Ų110.987%0.86560%0.599SS**  trans-61.585158.3-81179.7173.1176.10107.3G312 A316G312-K314 PolarHBondContact O-N 3.43Å; K314-A316 VanDerWaalsContact C-N 3.27Å; K314-A316 PolarHBondContact O-N 3.08Å
315D46.1Very low58.4Low124 Ų124113.6 Ų113.666%0.66361%0.613SS**  trans-71.499.9153.7-73.5-33.3000106.2S313 K317S313-D315 PolarHBondContact O-N 2.03Å; D315-K317 PolarHBondContact O-N 3.15Å
316A42.2Very low57.1Low88 Ų88120.6 Ų120.673%0.72765%0.651SS**  trans-49.4104.6163.100000108K314 S318K314-A316 VanDerWaalsContact C-N 3.27Å; K314-A316 PolarHBondContact O-N 3.08Å; A316-S318 PolarHBondContact O-N 3.24Å
317K37.1Very low55.5Low188 Ų188125 Ų12582%0.81767%0.672SS**  trans-70.275.9156.4-87.5-176.2175.8177.70107.3D55 D315D55-K317 IonicContact OD2-NZ 3.8Å; D315-K317 PolarHBondContact O-N 3.15Å
318S35.8Very low53.6Low88 Ų88127.2 Ų127.262%0.61569%0.686SS**  trans-81.7102.5154.5172.20000107.2A316A316-S318 PolarHBondContact O-N 3.24Å
319Y38.1Very low51.5Low219 Ų219129.8 Ų129.886%0.85971%0.711SS**  trans-160.297.7145-92.5-75.7000103.8
320S34Very low49.3Very low90 Ų90134.3 Ų134.363%0.62974%0.738SS**  58.1101.362.284.70000113.1
321M36.3Very low46.4Very low274 Ų274133.7 Ų133.7100%1.3574%0.738SS**  trans72.90162.4-135.7167.9-169.200118.4

Retrieved 321 of 321 residues in 113.1 ms (Link to these results)

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