A0A087XLF3_POEFO Loading...

Stomatin like 3

AlphaFold DB , UniProt , Accession A0A087XLF3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 288 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
1M35.5Very low37.8Very low237 Ų237147.9 Ų147.9100%1.16777%0.768SS**  087.30-78.3179.4166.200107.7
2A32Very low38.6Very low99 Ų99140 Ų14082%0.81874%0.74SS**  trans-90.3121.5177.900000108.2L4A2-L4 PolarHBondContact O-N 3.46Å
3Y30.9Very low39.2Very low220 Ų220132.6 Ų132.686%0.86370%0.701SS**  trans-67.3116.2176.7-73.9-96000109T5Y3-T5 PolarHBondContact O-N 3.1Å; Y3-T5 VanDerWaalsContact O-N 3.11Å
4L34.1Very low39.8Very low154 Ų154126.1 Ų126.181%0.80668%0.676SS**  trans-70.398.2163.3-71.4168.7000107.2A2 E6A2-L4 PolarHBondContact O-N 3.46Å; L4-E6 PolarHBondContact O-N 3.29Å
5T33.3Very low40.1Very low128 Ų128121.3 Ų121.379%0.78566%0.656SS**  trans-61.1114.3165.638.80000108.8Y3Y3-T5 PolarHBondContact O-N 3.1Å; Y3-T5 VanDerWaalsContact O-N 3.11Å
6E37.8Very low40.7Very low180 Ų180121.5 Ų121.584%0.84165%0.651SS**  trans-53125.5167.5-67.1178.5148.300109.2L4 N8L4-E6 PolarHBondContact O-N 3.29Å; E6-N8 PolarHBondContact O-N 3.34Å
7P43.7Very low41.1Very low98 Ų98115.1 Ų115.164%0.63662%0.617SS**  trans-75.2112.6171.229.2-28000107.5F9P7-F9 PolarHBondContact O-N 3.09Å; P7-F9 VanDerWaalsContact O-N 3.17Å
8N37.6Very low41.4Very low144 Ų144111.3 Ų111.377%0.7760%0.6SS**  trans-45.7123.3161.6-86.7-45.4000108.5E6 N10E6-N8 PolarHBondContact O-N 3.34Å; N8-N10 VanDerWaalsContact C-N 3.26Å; N8-N10 PolarHBondContact O-N 3.44Å
9F44.6Very low41.8Very low88 Ų88111.6 Ų111.639%0.38660%0.6SS.*  trans-62.491.3171.2-174.3-96.4000107.7P7 A14P7-F9 PolarHBondContact O-N 3.09Å; P7-F9 VanDerWaalsContact O-N 3.17Å; F9-A14 HydrophobicContact CE1-CB 4.06Å; F9-A14 HydrophobicContact CZ-CB 4.47Å
10N41.7Very low42.1Very low102 Ų102111 Ų11155%0.54560%0.597SS.*  trans-60.5141.2-177.3-86.1-22.9000109.7N8 A12 D13N8-N10 VanDerWaalsContact C-N 3.26Å; N8-N10 PolarHBondContact O-N 3.44Å; N10-A12 HydrophobicContact CB-CB 4.16Å; N10-A12 PolarHBondContact O-N 3.29Å; N10-D13 VanDerWaalsContact O-CB 3.31Å; N10-D13 WeakPolarHBondContact O-CB 3.14Å; N10-D13 PolarHBondContact O-N 3.19Å
11E44.3Very low42.4Very low177 Ų177106.5 Ų106.583%0.82757%0.572SS**Hα-helixtrans-57.6-19.5172.8-143159.5-171.600112.3S15E11-S15 PolarHBondContact O-N 2.97Å; E11-S15 PolarHBondContact O-OG 3.3Å
12A47.6Very low42.7Very low53 Ų5398.4 Ų98.444%0.43854%0.537SS..Hα-helixtrans-64.3-38.917100000113.9N10 S15 H16N10-A12 HydrophobicContact CB-CB 4.16Å; N10-A12 PolarHBondContact O-N 3.29Å; A12-S15 WeakPolarHBondContact CA-OG 3.33Å; A12-S15 PolarHBondContact O-N 3.31Å; A12-S15 PolarHBondContact O-OG 3.49Å; A12-S15 VanDerWaalsContact O-OG 3.08Å; A12-H16 WeakPolarHBondContact O-CB 3.01Å; A12-H16 PolarHBondContact O-N 3.13Å
13D47Very low43.2Very low44 Ų44100.5 Ų100.524%0.23553%0.534CS..Hα-helixtrans-67.3-44.8-179.2-96.319.7000109.8N10 S15 H16 C17 R130 H132N10-D13 VanDerWaalsContact O-CB 3.31Å; N10-D13 WeakPolarHBondContact O-CB 3.14Å; N10-D13 PolarHBondContact O-N 3.19Å; D13-S15 VanDerWaalsContact C-N 3.33Å; D13-S15 PolarHBondContact O-N 2.96Å; D13-H16 PolarHBondContact O-N 3.48Å; D13-C17 WeakPolarHBondContact O-CB 3.5Å; D13-C17 PolarHBondContact O-N 3.11Å; D13-R130 IonicContact OD2-NH1 3.71Å; D13-R130 IonicContact OD2-NH2 3.18Å; D13-R130 PolarHBondContact OD2-NH2 3.19Å; D13-H132 WeakPolarHBondContact CA-NE2 3.4Å; D13-H132 WeakPolarHBondContact CB-NE2 3.44Å; D13-H132 VanDerWaalsContact CG-CD2 3.47Å; D13-H132 PolarHBondContact O-CE1 3.23Å; D13-H132 PolarHBondContact O-NE2 3.31Å; D13-H132 VanDerWaalsContact O-NE2 3.12Å; D13-H132 IonicContact OD1-NE2 3.75Å; D13-H132 IonicContact OD2-CD2 3.14Å; D13-H132 PolarHBondContact OD2-CD2 3.17Å; D13-H132 VanDerWaalsContact OD2-CD2 3.32Å; D13-H132 IonicContact OD2-NE2 3.37Å; D13-H132 PolarHBondContact OD2-NE2 2.96Å
14A46.7Very low44Very low42 Ų4297.7 Ų97.735%0.34753%0.527SS..Hα-helixtrans-62.7-36.7172.600000112.9F9 T18F9-A14 HydrophobicContact CE1-CB 4.06Å; F9-A14 HydrophobicContact CZ-CB 4.47Å; A14-T18 WeakPolarHBondContact O-CG2 3.31Å; A14-T18 PolarHBondContact O-N 3.06Å; A14-T18 PolarHBondContact O-OG1 2.92Å
15S44.9Very low44.4Very low53 Ų5391.9 Ų91.937%0.37150%0.498SS..Hα-helixtrans-75.7-34.5178.933.70000112.7E11 A12 D13 T18 L19E11-S15 PolarHBondContact O-N 2.97Å; E11-S15 PolarHBondContact O-OG 3.3Å; A12-S15 WeakPolarHBondContact CA-OG 3.33Å; A12-S15 PolarHBondContact O-N 3.31Å; A12-S15 PolarHBondContact O-OG 3.49Å; A12-S15 VanDerWaalsContact O-OG 3.08Å; D13-S15 VanDerWaalsContact C-N 3.33Å; D13-S15 PolarHBondContact O-N 2.96Å; S15-T18 VanDerWaalsContact CA-OG1 3.3Å; S15-T18 WeakPolarHBondContact CA-OG1 3.48Å; S15-T18 PolarHBondContact O-N 3.08Å; S15-T18 PolarHBondContact O-OG1 3.38Å; S15-L19 PolarHBondContact O-N 2.67Å
16H49.9Very low44.8Very low125 Ų12591.4 Ų91.458%0.57949%0.49SS*.Hα-helixtrans-63.6-43169.9-114.7-97.8000112.5A12 D13 T18 L19 N20A12-H16 WeakPolarHBondContact O-CB 3.01Å; A12-H16 PolarHBondContact O-N 3.13Å; D13-H16 PolarHBondContact O-N 3.48Å; H16-T18 VanDerWaalsContact C-N 3.31Å; H16-T18 PolarHBondContact O-N 3.42Å; H16-L19 PolarHBondContact O-N 3.29Å; H16-N20 PolarHBondContact O-N 3.21Å
17C46.3Very low45Very low12 Ų1292.1 Ų92.18%0.08149%0.491CS..Hα-helixtrans-61-39.9172.4171.90000110.8D13 F21 C133D13-C17 WeakPolarHBondContact O-CB 3.5Å; D13-C17 PolarHBondContact O-N 3.11Å; C17-F21 WeakPolarHBondContact O-CB 3.49Å; C17-F21 PolarHBondContact O-N 3.18Å; C17-C133 HydrophobicContact CB-CB 3.81Å; C17-C133 WeakPolarHBondContact CB-SG 3.4Å; C17-C133 VanDerWaalsContact SG-CA 3.53Å; C17-C133 WeakPolarHBondContact SG-CB 3.49Å; C17-C133 CovalentContact SG-SG 2.04Å; C17-C133 PolarHBondContact SG-SG 2.88Å
18T48.1Very low45Very low48 Ų4893.5 Ų93.529%0.29449%0.493SS..Hα-helixtrans-67.9-34.6173.756.80000113.8A14 S15 H16 C22 K80A14-T18 WeakPolarHBondContact O-CG2 3.31Å; A14-T18 PolarHBondContact O-N 3.06Å; A14-T18 PolarHBondContact O-OG1 2.92Å; S15-T18 VanDerWaalsContact CA-OG1 3.3Å; S15-T18 WeakPolarHBondContact CA-OG1 3.48Å; S15-T18 PolarHBondContact O-N 3.08Å; S15-T18 PolarHBondContact O-OG1 3.38Å; H16-T18 VanDerWaalsContact C-N 3.31Å; H16-T18 PolarHBondContact O-N 3.42Å; T18-C22 WeakPolarHBondContact O-CB 3.22Å; T18-C22 PolarHBondContact O-N 3.24Å; T18-K80 HydrophobicContact CG2-CG 4.31Å
19L48.3Very low45.5Very low116 Ų11690.8 Ų90.861%0.60748%0.481SS*.Hα-helixtrans-71.5-48.2-179.9-117.3121.2000112S15 H16 C22 L23S15-L19 PolarHBondContact O-N 2.67Å; H16-L19 PolarHBondContact O-N 3.29Å; L19-C22 PolarHBondContact O-N 3.4Å; L19-L23 PolarHBondContact O-N 2.92Å; L19-L23 VanDerWaalsContact O-N 3.07Å
20N47.4Very low45.8Very low100 Ų10089.9 Ų89.954%0.53550%0.497SS..Hα-helixtrans-66.7-37.4177.3-82-13.8000111.9H16 F24H16-N20 PolarHBondContact O-N 3.21Å; N20-F24 PolarHBondContact O-N 3.48Å
21F48.7Very low46.2Very low17 Ų1795.8 Ų95.88%0.07551%0.511CS..Hα-helixtrans-69.8-37.6173.8-170.6-102.6000112.4C17 L23 F24 T25 I76 I135C17-F21 WeakPolarHBondContact O-CB 3.49Å; C17-F21 PolarHBondContact O-N 3.18Å; F21-L23 VanDerWaalsContact C-N 3.32Å; F21-L23 PolarHBondContact O-N 3.28Å; F21-F24 PolarHBondContact O-N 3.42Å; F21-F24 VanDerWaalsContact O-N 3.16Å; F21-T25 HydrophobicContact CD1-CG2 4.1Å; F21-T25 HydrophobicContact CE1-CG2 3.57Å; F21-T25 HydrophobicContact CE2-CG2 4.07Å; F21-T25 HydrophobicContact CZ-CG2 3.54Å; F21-T25 PolarHBondContact O-N 2.97Å; F21-T25 VanDerWaalsContact O-N 3.1Å; F21-T25 PolarHBondContact O-OG1 3Å; F21-I76 HydrophobicContact CE2-CD1 4.28Å; F21-I76 HydrophobicContact CZ-CD1 3.8Å; F21-I135 HydrophobicContact CD2-CG2 3.95Å; F21-I135 HydrophobicContact CE1-CG2 4.25Å; F21-I135 HydrophobicContact CE2-CB 4.4Å; F21-I135 HydrophobicContact CE2-CG2 3.35Å; F21-I135 HydrophobicContact CZ-CG2 3.53Å
22C41.9Very low46.9Very low66 Ų6690.3 Ų90.345%0.44649%0.488SS..Hα-helixtrans-67.5-31.5178.6-160.30000112.3T18 L19 F24T18-C22 WeakPolarHBondContact O-CB 3.22Å; T18-C22 PolarHBondContact O-N 3.24Å; L19-C22 PolarHBondContact O-N 3.4Å; C22-F24 VanDerWaalsContact C-N 3.31Å
23L42.8Very low47.8Very low143 Ų14390 Ų9075%0.74949%0.49SS*.Hα-helixtrans-65-32.3171.8-93.3162.3000113L19 F21L19-L23 PolarHBondContact O-N 2.92Å; L19-L23 VanDerWaalsContact O-N 3.07Å; F21-L23 VanDerWaalsContact C-N 3.32Å; F21-L23 PolarHBondContact O-N 3.28Å
24F47.3Very low49Very low162 Ų16293.4 Ų93.471%0.71152%0.516SS*.Hα-helixtrans-89.2-21.6-176.9-150.9-100.3000113.5N20 F21 C22N20-F24 PolarHBondContact O-N 3.48Å; F21-F24 PolarHBondContact O-N 3.42Å; F21-F24 VanDerWaalsContact O-N 3.16Å; C22-F24 VanDerWaalsContact C-N 3.31Å
25T42.9Very low50.3Low31 Ų3196.5 Ų96.519%0.1953%0.53CS..SBendtrans-96.6117.3178.958.10000113.2F21F21-T25 HydrophobicContact CD1-CG2 4.1Å; F21-T25 HydrophobicContact CE1-CG2 3.57Å; F21-T25 HydrophobicContact CE2-CG2 4.07Å; F21-T25 HydrophobicContact CZ-CG2 3.54Å; F21-T25 PolarHBondContact O-N 2.97Å; F21-T25 VanDerWaalsContact O-N 3.1Å; F21-T25 PolarHBondContact O-OG1 3Å
26D40.5Very low51.7Low119 Ų11994.5 Ų94.564%0.63652%0.518SS*.  trans-50.1145164.6-169.13.3000111.5N28D26-N28 PolarHBondContact O-N 2.99Å
27K42.9Very low53Low195 Ų19596.3 Ų96.385%0.84852%0.52SS*.THydrogen-bonded Turntrans-62.59.3-170.9-89.6174.2174.7170.60115.4
28N43Very low54.6Low126 Ų126100.7 Ų100.767%0.67454%0.542SS*.THydrogen-bonded Turntrans-112.119.2-166.3-68.9-44.1000115.4D26 G30D26-N28 PolarHBondContact O-N 2.99Å; N28-G30 PolarHBondContact O-N 3.5Å; N28-G30 VanDerWaalsContact O-N 3.07Å
29V48.2Very low56.1Low88 Ų88102.4 Ų102.453%0.53355%0.548SS..THydrogen-bonded Turntrans-8187172.5-172.90000109.1
30G51.4Low57.5Low69 Ų6998.2 Ų98.271%0.71153%0.527SS*.THydrogen-bonded Turntrans-178.3-0.7177.700000120.1N28N28-G30 PolarHBondContact O-N 3.5Å; N28-G30 VanDerWaalsContact O-N 3.07Å
31R49.2Very low59.1Low225 Ų22597.9 Ų97.985%0.84953%0.525SS*.  trans-119.7100.8173.7-106176.2155.2177.7-6.6110.9G33 R75R31-G33 PolarHBondContact O-N 3.17Å; R31-R75 PolarHBondContact O-NH1 2.92Å
32L59.4Low60.7Low63 Ų63101.4 Ų101.433%0.3354%0.543SS..  trans-59.2122.9156.5-91.275.6000106.5V40 L73L32-V40 HydrophobicContact CD2-CG2 4.14Å; L32-L73 HydrophobicContact CD2-CD1 4.45Å
33G66.8Low62.4Low47 Ų4798.8 Ų98.849%0.48553%0.526SS..  trans-62.3165.8172.800000111.2R31 V35 G36 W37R31-G33 PolarHBondContact O-N 3.17Å; G33-V35 PolarHBondContact O-N 3.36Å; G33-V35 VanDerWaalsContact O-N 3.08Å; G33-G36 WeakPolarHBondContact O-CA 3.5Å; G33-G36 PolarHBondContact O-N 3.48Å; G33-W37 PolarHBondContact O-N 2.92Å
34C72.4Confident64.1Low115 Ų11596.7 Ų96.778%0.77752%0.515SS*.Hα-helixtrans-52.5-34.7-179.6-57.50000113W37 L38C34-W37 PolarHBondContact O-N 3.05Å; C34-L38 PolarHBondContact O-N 3.28Å
35V73.9Confident65.8Low107 Ų10794.6 Ų94.665%0.64851%0.51SS*.Hα-helixtrans-66.9-38.4175.2178.70000112.4G33 W37 L38 L39G33-V35 PolarHBondContact O-N 3.36Å; G33-V35 VanDerWaalsContact O-N 3.08Å; V35-W37 VanDerWaalsContact C-N 3.35Å; V35-L38 WeakPolarHBondContact O-CB 3.44Å; V35-L38 PolarHBondContact O-N 2.82Å; V35-L39 PolarHBondContact O-N 2.91Å
36G74.3Confident67.6Low11 Ų1199.4 Ų99.411%0.11353%0.529CS..Hα-helixtrans-64.7-40.4176.500000111.8G33 L39 V40G33-G36 WeakPolarHBondContact O-CA 3.5Å; G33-G36 PolarHBondContact O-N 3.48Å; G36-L39 PolarHBondContact O-N 3.45Å; G36-V40 VanDerWaalsContact O-CG2 3.28Å; G36-V40 WeakPolarHBondContact O-CG2 3.39Å; G36-V40 PolarHBondContact O-N 2.88Å; G36-V40 VanDerWaalsContact O-N 3.09Å
37W78.1Confident69.4Low163 Ų16395 Ų9562%0.61751%0.505SS*.Hα-helixtrans-64.6-41.4173.1-87.584.9000112.5G33 C34 V35 L39 V40 I41G33-W37 PolarHBondContact O-N 2.92Å; C34-W37 PolarHBondContact O-N 3.05Å; V35-W37 VanDerWaalsContact C-N 3.35Å; W37-L39 PolarHBondContact O-N 3.41Å; W37-V40 PolarHBondContact O-N 3.17Å; W37-I41 WeakPolarHBondContact O-CD1 3.37Å; W37-I41 VanDerWaalsContact O-CG1 3.22Å; W37-I41 WeakPolarHBondContact O-CG1 3.46Å; W37-I41 PolarHBondContact O-N 3.34Å
38L79.4Confident71.2Confident104 Ų10489.1 Ų89.155%0.54549%0.493SS..Hα-helixtrans-58-45.9174.8-107.3158.5000112.4C34 V35 V40 I41 I42C34-L38 PolarHBondContact O-N 3.28Å; V35-L38 WeakPolarHBondContact O-CB 3.44Å; V35-L38 PolarHBondContact O-N 2.82Å; L38-V40 PolarHBondContact O-N 3.5Å; L38-I41 PolarHBondContact O-N 2.94Å; L38-I42 HydrophobicContact CD2-CD1 4.45Å; L38-I42 VanDerWaalsContact O-CG1 3.28Å; L38-I42 WeakPolarHBondContact O-CG1 3.5Å; L38-I42 PolarHBondContact O-N 3.08Å
39L78.8Confident73.1Confident83 Ų8389.6 Ų89.644%0.43550%0.495SS..Hα-helixtrans-64.7-38.4176.9-74.4173.6000112.7V35 G36 W37 I42 S43 L73V35-L39 PolarHBondContact O-N 2.91Å; G36-L39 PolarHBondContact O-N 3.45Å; W37-L39 PolarHBondContact O-N 3.41Å; L39-I42 PolarHBondContact O-N 3.46Å; L39-S43 WeakPolarHBondContact O-CB 3.38Å; L39-S43 PolarHBondContact O-N 3.44Å; L39-L73 HydrophobicContact CD1-CD2 4.34Å
40V77.1Confident74.5Confident28 Ų2888 Ų8817%0.1749%0.486CS..Hα-helixtrans-64.5-41.9175.1171.30000110.8L32 G36 W37 L38 S43 L44L32-V40 HydrophobicContact CD2-CG2 4.14Å; G36-V40 VanDerWaalsContact O-CG2 3.28Å; G36-V40 WeakPolarHBondContact O-CG2 3.39Å; G36-V40 PolarHBondContact O-N 2.88Å; G36-V40 VanDerWaalsContact O-N 3.09Å; W37-V40 PolarHBondContact O-N 3.17Å; L38-V40 PolarHBondContact O-N 3.5Å; V40-S43 PolarHBondContact O-N 3.41Å; V40-L44 HydrophobicContact CG1-CD1 4.38Å; V40-L44 WeakPolarHBondContact O-CB 3.39Å; V40-L44 PolarHBondContact O-N 3.07Å
41I81.9Confident75.8Confident94 Ų9491.1 Ų91.148%0.48248%0.48SS..Hα-helixtrans-64.8-42.8177.4-67.7162.1000111W37 L38 L44 L45W37-I41 WeakPolarHBondContact O-CD1 3.37Å; W37-I41 VanDerWaalsContact O-CG1 3.22Å; W37-I41 WeakPolarHBondContact O-CG1 3.46Å; W37-I41 PolarHBondContact O-N 3.34Å; L38-I41 PolarHBondContact O-N 2.94Å; I41-L44 WeakPolarHBondContact O-CB 3.42Å; I41-L44 PolarHBondContact O-N 2.94Å; I41-L45 WeakPolarHBondContact O-CB 3.27Å; I41-L45 PolarHBondContact O-N 3.45Å
42I83.3Confident77.1Confident90 Ų9084.1 Ų84.146%0.46246%0.463SS..Hα-helixtrans-63.6-43.4176.7-68.9164.2000111L38 L39 L44 L45 F46L38-I42 HydrophobicContact CD2-CD1 4.45Å; L38-I42 VanDerWaalsContact O-CG1 3.28Å; L38-I42 WeakPolarHBondContact O-CG1 3.5Å; L38-I42 PolarHBondContact O-N 3.08Å; L39-I42 PolarHBondContact O-N 3.46Å; I42-L44 VanDerWaalsContact C-N 3.35Å; I42-L44 PolarHBondContact O-N 3.49Å; I42-L45 PolarHBondContact O-N 3.32Å; I42-F46 PolarHBondContact O-N 2.93Å
43S77.1Confident77.9Confident12 Ų1287.1 Ų87.18%0.08448%0.479CS..Hα-helixtrans-59.9-44.5174.4172.30000111.5L39 V40 L45 F46 I47 P91L39-S43 WeakPolarHBondContact O-CB 3.38Å; L39-S43 PolarHBondContact O-N 3.44Å; V40-S43 PolarHBondContact O-N 3.41Å; S43-L45 PolarHBondContact O-N 2.91Å; S43-F46 WeakPolarHBondContact O-CB 3.33Å; S43-F46 PolarHBondContact O-N 3.07Å; S43-I47 VanDerWaalsContact O-CG1 3.3Å; S43-I47 WeakPolarHBondContact O-CG1 3.43Å; S43-I47 PolarHBondContact O-N 3.48Å; S43-P91 PolarHBondContact OG-O 3.13Å
44L78.7Confident78.2Confident99 Ų9986 Ų8652%0.51846%0.462SS..Hα-helixtrans-61.5-41.1175.9-109.1156.4000113V40 I41 I42 F46 I47 A48V40-L44 HydrophobicContact CG1-CD1 4.38Å; V40-L44 WeakPolarHBondContact O-CB 3.39Å; V40-L44 PolarHBondContact O-N 3.07Å; I41-L44 WeakPolarHBondContact O-CB 3.42Å; I41-L44 PolarHBondContact O-N 2.94Å; I42-L44 VanDerWaalsContact C-N 3.35Å; I42-L44 PolarHBondContact O-N 3.49Å; L44-F46 VanDerWaalsContact C-N 3.35Å; L44-I47 PolarHBondContact O-N 3.39Å; L44-A48 PolarHBondContact O-N 3.41Å
45L82.9Confident78.1Confident117 Ų11784.4 Ų84.461%0.61345%0.446SS*.Hα-helixtrans-65-39.4176.6-170.4145.8000111.4I41 I42 S43 A48 L49I41-L45 WeakPolarHBondContact O-CB 3.27Å; I41-L45 PolarHBondContact O-N 3.45Å; I42-L45 PolarHBondContact O-N 3.32Å; S43-L45 PolarHBondContact O-N 2.91Å; L45-A48 PolarHBondContact O-N 3.44Å; L45-L49 WeakPolarHBondContact O-CB 3.12Å; L45-L49 PolarHBondContact O-N 3.42Å
46F80.3Confident78Confident133 Ų13388 Ų8858%0.58345%0.453SS*.Hα-helixtrans-63.3-41.7173.4-116.8-86000112.4I42 S43 L44 L49 T50I42-F46 PolarHBondContact O-N 2.93Å; S43-F46 WeakPolarHBondContact O-CB 3.33Å; S43-F46 PolarHBondContact O-N 3.07Å; L44-F46 VanDerWaalsContact C-N 3.35Å; F46-L49 PolarHBondContact O-N 3.15Å; F46-T50 PolarHBondContact O-N 2.87Å; F46-T50 PolarHBondContact O-OG1 3.25Å
47I78.9Confident77.7Confident26 Ų2692.8 Ų92.813%0.13348%0.475CS..Hα-helixtrans-62.5-43.2176.1-68.7162.3000110.6S43 L44 T50 F51 T54 L90 P91S43-I47 VanDerWaalsContact O-CG1 3.3Å; S43-I47 WeakPolarHBondContact O-CG1 3.43Å; S43-I47 PolarHBondContact O-N 3.48Å; L44-I47 PolarHBondContact O-N 3.39Å; I47-T50 PolarHBondContact O-N 3.43Å; I47-T50 PolarHBondContact O-OG1 3.22Å; I47-F51 PolarHBondContact O-N 3.41Å; I47-T54 PolarHBondContact O-OG1 2.94Å; I47-L90 HydrophobicContact CD1-CD2 4.12Å; I47-L90 HydrophobicContact CD1-CG 4.39Å; I47-P91 HydrophobicContact CD1-CG 4.41Å; I47-P91 HydrophobicContact CG1-CG 4.35Å
48A80.4Confident77.2Confident72 Ų7285.1 Ų85.160%0.59545%0.447SS*.Hα-helixtrans-64.9-39.8178.600000112.6L44 L45 T50L44-A48 PolarHBondContact O-N 3.41Å; L45-A48 PolarHBondContact O-N 3.44Å; A48-T50 VanDerWaalsContact C-N 3.32Å; A48-T50 PolarHBondContact O-N 3.37Å
49L82.1Confident77Confident136 Ų13682.9 Ų82.971%0.71244%0.437SS*.Hα-helixtrans-67.3-31.6178.8-169.875.3000113L45 F46L45-L49 WeakPolarHBondContact O-CB 3.12Å; L45-L49 PolarHBondContact O-N 3.42Å; F46-L49 PolarHBondContact O-N 3.15Å
50T78.4Confident76.8Confident55 Ų5583 Ų8334%0.33743%0.434SS..THydrogen-bonded Turntrans-103.512.3-173.553.50000113.4F46 I47 A48 I53 T54F46-T50 PolarHBondContact O-N 2.87Å; F46-T50 PolarHBondContact O-OG1 3.25Å; I47-T50 PolarHBondContact O-N 3.43Å; I47-T50 PolarHBondContact O-OG1 3.22Å; A48-T50 VanDerWaalsContact C-N 3.32Å; A48-T50 PolarHBondContact O-N 3.37Å; T50-I53 PolarHBondContact O-N 3.01Å; T50-I53 VanDerWaalsContact O-N 3.15Å; T50-T54 WeakPolarHBondContact OG1-CG2 3.47Å
51F78Confident76.9Confident134 Ų13487.4 Ų87.459%0.58846%0.455SS*.THydrogen-bonded Turntrans-63.1131.6172.6-170.3-99.3000109.8I47 L55I47-F51 PolarHBondContact O-N 3.41Å; F51-L55 HydrophobicContact CE2-CB 4.3Å; F51-L55 HydrophobicContact CE2-CD1 4.4Å; F51-L55 HydrophobicContact CE2-CD2 4.41Å
52P76.3Confident76.8Confident78 Ų7883.2 Ų83.251%0.50643%0.434SS..THydrogen-bonded Turncis-101.1-0.817.836.8-35.6000116.3T54 L55P52-T54 VanDerWaalsContact C-N 3.33Å; P52-T54 PolarHBondContact O-N 3.09Å; P52-L55 PolarHBondContact O-N 3.26Å
53I77.4Confident76.7Confident126 Ų12684 Ų8465%0.64643%0.434SS*.Hα-helixtrans-66.1-36.2-169.3-59.9170.8000111.6T50 L55T50-I53 PolarHBondContact O-N 3.01Å; T50-I53 VanDerWaalsContact O-N 3.15Å; I53-L55 PolarHBondContact O-N 2.76Å
54T72.7Confident76.8Confident22 Ų2291.1 Ų91.114%0.13547%0.466CS..Hα-helixtrans-69.1-29.3-179.244.80000113.8I47 T50 P52 F56 L57 C58I47-T54 PolarHBondContact O-OG1 2.94Å; T50-T54 WeakPolarHBondContact OG1-CG2 3.47Å; P52-T54 VanDerWaalsContact C-N 3.33Å; P52-T54 PolarHBondContact O-N 3.09Å; T54-F56 VanDerWaalsContact C-N 3.32Å; T54-F56 PolarHBondContact O-N 3.37Å; T54-L57 PolarHBondContact O-N 3.43Å; T54-C58 PolarHBondContact O-N 2.87Å; T54-C58 PolarHBondContact O-SG 3.2Å
55L71.3Confident76.9Confident83 Ų8389.5 Ų89.544%0.43545%0.453SS..Hα-helixtrans-60.3-42.1179.6-169.182.1000111.6F51 P52 I53 L57 V59 F88F51-L55 HydrophobicContact CE2-CB 4.3Å; F51-L55 HydrophobicContact CE2-CD1 4.4Å; F51-L55 HydrophobicContact CE2-CD2 4.41Å; P52-L55 PolarHBondContact O-N 3.26Å; I53-L55 PolarHBondContact O-N 2.76Å; L55-L57 VanDerWaalsContact C-N 3.26Å; L55-L57 PolarHBondContact O-N 3.48Å; L55-V59 WeakPolarHBondContact O-CG2 3.32Å; L55-F88 HydrophobicContact CD1-CE2 4.47Å
56F70.5Confident77Confident181 Ų18185.3 Ų85.379%0.79443%0.431SS*.Hα-helixtrans-67.3-27176.6-81.7-82.6000113T54T54-F56 VanDerWaalsContact C-N 3.32Å; T54-F56 PolarHBondContact O-N 3.37Å
57L68.7Low77.3Confident113 Ų11381 Ų8159%0.59241%0.411SS*.Hα-helixtrans-84.5-31.1-177.3-120.8140.5000112.8T54 L55T54-L57 PolarHBondContact O-N 3.43Å; L55-L57 VanDerWaalsContact C-N 3.26Å; L55-L57 PolarHBondContact O-N 3.48Å
58C67.7Low77.5Confident2 Ų279.9 Ų79.91%0.01441%0.405CS..Hα-helixtrans-76.3-24.1179.9-64.50000113.7T54 K60 F88 V89 P91T54-C58 PolarHBondContact O-N 2.87Å; T54-C58 PolarHBondContact O-SG 3.2Å; C58-K60 PolarHBondContact O-N 2.89Å; C58-F88 HydrophobicContact CB-CD1 4.29Å; C58-F88 HydrophobicContact CB-CD2 3.77Å; C58-F88 HydrophobicContact CB-CE1 3.85Å; C58-F88 HydrophobicContact CB-CE2 3.27Å; C58-F88 HydrophobicContact CB-CG 4.27Å; C58-F88 HydrophobicContact CB-CZ 3.31Å; C58-V89 PolarHBondContact O-N 2.93Å; C58-P91 WeakPolarHBondContact SG-CD 3.49Å
59V74.2Confident77.7Confident57 Ų5776.7 Ų76.735%0.34538%0.378SS..EExtended strand (participates in β ladder)trans-80.8109179172.40000109.1L55 L86L55-V59 WeakPolarHBondContact O-CG2 3.32Å; V59-L86 HydrophobicContact CG1-CD1 3.61Å; V59-L86 HydrophobicContact CG1-CD2 3.64Å; V59-L86 HydrophobicContact CG1-CG 3.67Å; V59-L86 HydrophobicContact CG2-CD2 4.42Å
60K75.3Confident77.8Confident84 Ų8470.7 Ų70.737%0.36535%0.347SS..EExtended strand (participates in β ladder)trans-115.9138.5174.3-67.1-68.8-179.41740110.2C58 F87C58-K60 PolarHBondContact O-N 2.89Å; K60-F87 HydrophobicContact CB-CE1 4.15Å; K60-F87 HydrophobicContact CB-CE2 4.09Å; K60-F87 HydrophobicContact CB-CZ 3.73Å; K60-F87 PolarHBondContact N-O 3.41Å; K60-F87 WeakPolarHBondContact O-CD1 3.34Å; K60-F87 WeakPolarHBondContact O-CE1 3.46Å; K60-F87 PolarHBondContact O-N 3.29Å
61I79.8Confident77.9Confident122 Ų12269.9 Ų69.963%0.62634%0.339SS*.EExtended strand (participates in β ladder)trans-101.3130.1177-62.3157.7000107.8L86 K98I61-L86 HydrophobicContact CD1-CD1 4.43Å; I61-L86 HydrophobicContact CG1-CD1 3.64Å; I61-K98 PolarHBondContact O-NZ 3.03Å
62V78.9Confident77.9Confident5 Ų567.6 Ų67.63%0.0333%0.326CS..EExtended strand (participates in β ladder)trans-113.2136.7170.4156.10000108.4E66 A68 G85 F87 K98V62-E66 HydrophobicContact CG1-CB 3.77Å; V62-E66 VanDerWaalsContact CG1-O 3.26Å; V62-E66 WeakPolarHBondContact CG1-O 3.4Å; V62-A68 HydrophobicContact CG2-CB 4.17Å; V62-G85 PolarHBondContact N-O 3Å; V62-G85 PolarHBondContact O-N 3.27Å; V62-F87 HydrophobicContact CB-CD1 4.3Å; V62-F87 HydrophobicContact CB-CE1 3.52Å; V62-F87 HydrophobicContact CB-CZ 4.29Å; V62-F87 HydrophobicContact CG2-CD1 4.24Å; V62-F87 HydrophobicContact CG2-CE1 3.12Å; V62-F87 HydrophobicContact CG2-CZ 3.38Å; V62-K98 HydrophobicContact CG2-CD 4.22Å; V62-K98 HydrophobicContact CG2-CG 4.43Å
63K81.8Confident77.8Confident108 Ų10867.6 Ų67.647%0.4732%0.322SS..  trans-73.2160.8-178.8-59.4178.7-175.21660110.2Y65 E66K63-Y65 VanDerWaalsContact C-N 3.25Å; K63-Y65 HydrophobicContact CB-CD1 4.01Å; K63-Y65 HydrophobicContact CB-CE1 3.71Å; K63-Y65 HydrophobicContact CB-CE2 4.5Å; K63-Y65 HydrophobicContact CD-CE1 3.62Å; K63-Y65 HydrophobicContact CD-CE2 4.18Å; K63-Y65 WeakPolarHBondContact CD-OH 3.41Å; K63-Y65 HydrophobicContact CG-CE1 4.3Å; K63-Y65 PolarHBondContact NZ-OH 3.32Å; K63-Y65 PolarHBondContact O-N 2.86Å; K63-E66 HydrophobicContact CB-CB 4.44Å; K63-E66 HydrophobicContact CB-CG 4.32Å; K63-E66 PolarHBondContact O-N 3.41Å
64E78.3Confident77.4Confident161 Ų16165 Ų6575%0.75233%0.326SS*.THydrogen-bonded Turntrans-59-36-174.7-167.8163.3-167.900114.3P84E64-P84 HydrophobicContact CB-CB 4.48Å; E64-P84 HydrophobicContact CG-CG 4.39Å
65Y81.5Confident77.5Confident64 Ų6471.2 Ų71.225%0.25135%0.347SS..THydrogen-bonded Turntrans-87.7-4.5-179.559.3-94.4000114.2K63 L101 R102K63-Y65 VanDerWaalsContact C-N 3.25Å; K63-Y65 HydrophobicContact CB-CD1 4.01Å; K63-Y65 HydrophobicContact CB-CE1 3.71Å; K63-Y65 HydrophobicContact CB-CE2 4.5Å; K63-Y65 HydrophobicContact CD-CE1 3.62Å; K63-Y65 HydrophobicContact CD-CE2 4.18Å; K63-Y65 WeakPolarHBondContact CD-OH 3.41Å; K63-Y65 HydrophobicContact CG-CE1 4.3Å; K63-Y65 PolarHBondContact NZ-OH 3.32Å; K63-Y65 PolarHBondContact O-N 2.86Å; Y65-L101 PolarHBondContact O-N 3.4Å; Y65-L101 VanDerWaalsContact O-N 3.15Å; Y65-R102 VanDerWaalsContact CD1-CZ 3.48Å; Y65-R102 VanDerWaalsContact CG-NE 3.29Å
66E84.9Confident77.6Confident29 Ų2969.2 Ų69.214%0.13634%0.336CS..EExtended strand (participates in β ladder)trans-101.2146.7176.8-73.5171.8-169.900109.6V62 K63 K98 V99V62-E66 HydrophobicContact CG1-CB 3.77Å; V62-E66 VanDerWaalsContact CG1-O 3.26Å; V62-E66 WeakPolarHBondContact CG1-O 3.4Å; K63-E66 HydrophobicContact CB-CB 4.44Å; K63-E66 HydrophobicContact CB-CG 4.32Å; K63-E66 PolarHBondContact O-N 3.41Å; E66-K98 IonicContact OE2-NZ 2.7Å; E66-V99 WeakPolarHBondContact CA-O 3.34Å
67R85.9Confident77.1Confident43 Ų4362.3 Ų62.316%0.16231%0.312CS..EExtended strand (participates in β ladder)trans-120.7139.4168-68.2-68.7-171.2-1163.8109.7K82 K98 V99 L101 P134R67-K82 WeakPolarHBondContact CD-O 3.42Å; R67-K98 WeakPolarHBondContact O-CA 3.45Å; R67-V99 PolarHBondContact N-O 3.27Å; R67-V99 PolarHBondContact O-N 2.88Å; R67-L101 HydrophobicContact CG-CD1 3.48Å; R67-L101 VanDerWaalsContact CG-CD1 3.48Å; R67-L101 HydrophobicContact CG-CD2 4.13Å; R67-L101 HydrophobicContact CG-CG 3.9Å; R67-P134 HydrophobicContact CB-CB 4.32Å; R67-P134 HydrophobicContact CB-CG 4.02Å; R67-P134 HydrophobicContact CG-CG 4.39Å
68A84.6Confident76.8Confident2 Ų260.2 Ų60.22%0.01730%0.302CS..EExtended strand (participates in β ladder)trans-100.6125.717500000110.5V62 K82 F87 V97V62-A68 HydrophobicContact CG2-CB 4.17Å; A68-K82 PolarHBondContact O-N 3.23Å; A68-F87 HydrophobicContact CB-CE2 4.27Å; A68-F87 HydrophobicContact CB-CZ 4.18Å; A68-V97 WeakPolarHBondContact CA-O 3.35Å
69V84.4Confident76.5Confident5 Ų566.5 Ų66.53%0.0333%0.325CS..EExtended strand (participates in β ladder)trans-97.5120.9167.2-175.30000107.4F71 F96 V97 P134 I135 V138V69-F71 HydrophobicContact CB-CE2 4.3Å; V69-F71 HydrophobicContact CG1-CE1 4.32Å; V69-F71 HydrophobicContact CG1-CE2 3.83Å; V69-F71 HydrophobicContact CG1-CZ 3.68Å; V69-F96 WeakPolarHBondContact O-CA 3.49Å; V69-V97 PolarHBondContact N-O 2.84Å; V69-V97 PolarHBondContact O-N 3.39Å; V69-P134 HydrophobicContact CG2-CB 4.09Å; V69-I135 HydrophobicContact CG2-CG1 4.44Å; V69-V138 HydrophobicContact CG2-CG2 4.46Å
70I83.1Confident76.2Confident10 Ų1071 Ų715%0.05134%0.34CS..EExtended strand (participates in β ladder)trans-104.4124.3-177.3-58.2169.2000109.2A77 K82 F87 D94 N95 F96I70-A77 HydrophobicContact CG2-CB 4.43Å; I70-A77 PolarHBondContact O-N 2.96Å; I70-K82 HydrophobicContact CD1-CD 3.62Å; I70-K82 HydrophobicContact CD1-CG 4.18Å; I70-F87 HydrophobicContact CD1-CD2 4.23Å; I70-D94 HydrophobicContact CG2-CB 4.17Å; I70-N95 WeakPolarHBondContact CA-O 3.31Å; I70-F96 HydrophobicContact CG1-CB 4.37Å
71F81.6Confident75.9Confident39 Ų3969 Ų6917%0.17134%0.335CS..EExtended strand (participates in β ladder)trans-103118.9172.8-60.3-82.1000108.7V69 R75 I76 D94 N95 V97 V138V69-F71 HydrophobicContact CB-CE2 4.3Å; V69-F71 HydrophobicContact CG1-CE1 4.32Å; V69-F71 HydrophobicContact CG1-CE2 3.83Å; V69-F71 HydrophobicContact CG1-CZ 3.68Å; F71-R75 CarbonylContact C-O 3.53Å; F71-R75 WeakPolarHBondContact CA-O 3.29Å; F71-I76 HydrophobicContact CD1-CG1 4.16Å; F71-I76 HydrophobicContact CE1-CG1 3.85Å; F71-D94 CarbonylContact O-C 3.58Å; F71-D94 WeakPolarHBondContact O-CA 3.37Å; F71-N95 HydrophobicContact CB-CB 4.39Å; F71-N95 PolarHBondContact N-O 3.3Å; F71-N95 PolarHBondContact O-N 3.4Å; F71-V97 HydrophobicContact CD2-CG2 4.32Å; F71-V97 HydrophobicContact CE2-CB 4.35Å; F71-V97 HydrophobicContact CE2-CG2 3.88Å; F71-V138 HydrophobicContact CE2-CG1 3.82Å; F71-V138 HydrophobicContact CZ-CB 4.28Å; F71-V138 HydrophobicContact CZ-CG1 3.53Å
72R76.9Confident75.6Confident85 Ų8566.7 Ų66.732%0.32132%0.321SS..EExtended strand (participates in β ladder)trans-104.1116.5172178.8170-67.1160.92.6108.8G74 R75 A77 D94R72-G74 PolarHBondContact O-N 2.97Å; R72-G74 VanDerWaalsContact O-N 3.16Å; R72-R75 PolarHBondContact N-O 3.46Å; R72-R75 PolarHBondContact O-N 2.89Å; R72-A77 HydrophobicContact CB-CB 3.84Å; R72-D94 WeakPolarHBondContact CG-OD1 3.25Å; R72-D94 IonicContact CZ-OD1 3.86Å; R72-D94 IonicContact CZ-OD2 3.73Å; R72-D94 IonicContact NE-OD1 2.97Å; R72-D94 PolarHBondContact NE-OD1 3.31Å; R72-D94 IonicContact NE-OD2 3.56Å; R72-D94 IonicContact NH2-OD1 3.83Å; R72-D94 IonicContact NH2-OD2 2.98Å; R72-D94 PolarHBondContact NH2-OD2 2.91Å
73L75.2Confident75Confident79 Ų7968.4 Ų68.441%0.41434%0.34SS..THydrogen-bonded Turntrans49.740.3-178.9-58.3173.3000112.9L32 L39 R75 T93L32-L73 HydrophobicContact CD2-CD1 4.45Å; L39-L73 HydrophobicContact CD1-CD2 4.34Å; L73-R75 VanDerWaalsContact C-N 3.28Å; L73-R75 PolarHBondContact O-N 3.49Å; L73-T93 PolarHBondContact N-O 3.4Å; L73-T93 VanDerWaalsContact N-O 3.14Å
74G68.6Low74.5Confident71 Ų7166.3 Ų66.373%0.73234%0.337SS*.THydrogen-bonded Turntrans76.73.7179.700000115.7R72R72-G74 PolarHBondContact O-N 2.97Å; R72-G74 VanDerWaalsContact O-N 3.16Å
75R74.4Confident74.3Confident153 Ų15360.3 Ų60.358%0.57732%0.318SS*.EExtended strand (participates in β ladder)trans-107.7148172.3-63-177.6-179.4177-1.3110.5R31 F71 R72 L73 A77R31-R75 PolarHBondContact O-NH1 2.92Å; F71-R75 CarbonylContact C-O 3.53Å; F71-R75 WeakPolarHBondContact CA-O 3.29Å; R72-R75 PolarHBondContact N-O 3.46Å; R72-R75 PolarHBondContact O-N 2.89Å; L73-R75 VanDerWaalsContact C-N 3.28Å; L73-R75 PolarHBondContact O-N 3.49Å; R75-A77 PolarHBondContact O-N 3.41Å; R75-A77 VanDerWaalsContact O-N 3.14Å
76I73.4Confident73.8Confident40 Ų4063.1 Ų63.121%0.20534%0.337CS..EExtended strand (participates in β ladder)trans-68.1113.3173.7-61.4165.4000107.2F21 F71 D78 I135 A139F21-I76 HydrophobicContact CE2-CD1 4.28Å; F21-I76 HydrophobicContact CZ-CD1 3.8Å; F71-I76 HydrophobicContact CD1-CG1 4.16Å; F71-I76 HydrophobicContact CE1-CG1 3.85Å; I76-D78 VanDerWaalsContact CG2-O 3.29Å; I76-D78 WeakPolarHBondContact CG2-O 3.4Å; I76-I135 HydrophobicContact CD1-CG2 3.87Å; I76-I135 HydrophobicContact CG2-CG2 4.36Å; I76-A139 HydrophobicContact CD1-CB 4.17Å
77A60.8Low73.3Confident36 Ų3662.5 Ų62.530%0.29833%0.334SS..  trans-71-36.4-170.900000112.2I70 R72 R75I70-A77 HydrophobicContact CG2-CB 4.43Å; I70-A77 PolarHBondContact O-N 2.96Å; R72-A77 HydrophobicContact CB-CB 3.84Å; R75-A77 PolarHBondContact O-N 3.41Å; R75-A77 VanDerWaalsContact O-N 3.14Å
78D62.3Low72.6Confident69 Ų6965.1 Ų65.137%0.36935%0.347SS..  trans-126.1134.7-175.1-68.2-43.4000110.6I76 K80 K82I76-D78 VanDerWaalsContact CG2-O 3.29Å; I76-D78 WeakPolarHBondContact CG2-O 3.4Å; D78-K80 WeakPolarHBondContact CB-O 3.46Å; D78-K80 PolarHBondContact O-N 3.36Å; D78-K82 WeakPolarHBondContact OD2-CE 3.38Å; D78-K82 IonicContact OD2-NZ 3.61Å
79R61.8Low72.3Confident134 Ų13465.5 Ų65.551%0.50635%0.349SS..SBendtrans-67.2-13.6175.4-111.4-180178168.7-1.9113.6
80K66.9Low71.7Confident152 Ų15266.6 Ų66.666%0.66135%0.354SS*.SBendtrans-121.8138.7178.5-69.8-175177.3-174.90109.4T18 D78T18-K80 HydrophobicContact CG2-CG 4.31Å; D78-K80 WeakPolarHBondContact CB-O 3.46Å; D78-K80 PolarHBondContact O-N 3.36Å
81P68.9Low70.9Confident41 Ų4168.5 Ų68.527%0.26637%0.367SS..  trans-64.4138173.727-31.1000109.2G83 P134 I135P81-G83 PolarHBondContact O-N 2.7Å; P81-P134 HydrophobicContact CB-CG 3.8Å; P81-P134 HydrophobicContact CG-CG 4.01Å; P81-I135 HydrophobicContact CB-CG1 4.42Å
82K72.9Confident70.3Confident75 Ų7573 Ų7333%0.32640%0.402SS..BIsolated β-bridgetrans-68.8130.8178.4-69.3-157.2-177.8177.50109.5R67 A68 I70 D78 F87R67-K82 WeakPolarHBondContact CD-O 3.42Å; A68-K82 PolarHBondContact O-N 3.23Å; I70-K82 HydrophobicContact CD1-CD 3.62Å; I70-K82 HydrophobicContact CD1-CG 4.18Å; D78-K82 WeakPolarHBondContact OD2-CE 3.38Å; D78-K82 IonicContact OD2-NZ 3.61Å; K82-F87 HydrophobicContact CD-CB 4.35Å
83G67.9Low70.2Confident41 Ų4169.5 Ų69.542%0.42339%0.39SS..  trans-64.4177.3176.800000112.6P81P81-G83 PolarHBondContact O-N 2.7Å
84P71.1Confident70.5Confident64 Ų6466.2 Ų66.242%0.41637%0.373SS..SBendtrans-72.8150-176.230.7-22.2000110.4E64E64-P84 HydrophobicContact CB-CB 4.48Å; E64-P84 HydrophobicContact CG-CG 4.39Å
85G73.4Confident71.1Confident34 Ų3468.6 Ų68.635%0.35137%0.369SS..EExtended strand (participates in β ladder)trans127.9-158.6179.800000114.1V62V62-G85 PolarHBondContact N-O 3Å; V62-G85 PolarHBondContact O-N 3.27Å
86L70.4Confident71.6Confident124 Ų12464.7 Ų64.765%0.64936%0.356SS*.EExtended strand (participates in β ladder)trans-84.9122.2-177.4-142.186.4000109.7V59 I61V59-L86 HydrophobicContact CG1-CD1 3.61Å; V59-L86 HydrophobicContact CG1-CD2 3.64Å; V59-L86 HydrophobicContact CG1-CG 3.67Å; V59-L86 HydrophobicContact CG2-CD2 4.42Å; I61-L86 HydrophobicContact CD1-CD1 4.43Å; I61-L86 HydrophobicContact CG1-CD1 3.64Å
87F74.7Confident72.2Confident16 Ų1665.6 Ų65.67%0.0736%0.364CS..EExtended strand (participates in β ladder)trans-128.4142.4173.158.8-74.2000110K60 V62 A68 I70 K82 V89K60-F87 HydrophobicContact CB-CE1 4.15Å; K60-F87 HydrophobicContact CB-CE2 4.09Å; K60-F87 HydrophobicContact CB-CZ 3.73Å; K60-F87 PolarHBondContact N-O 3.41Å; K60-F87 WeakPolarHBondContact O-CD1 3.34Å; K60-F87 WeakPolarHBondContact O-CE1 3.46Å; K60-F87 PolarHBondContact O-N 3.29Å; V62-F87 HydrophobicContact CB-CD1 4.3Å; V62-F87 HydrophobicContact CB-CE1 3.52Å; V62-F87 HydrophobicContact CB-CZ 4.29Å; V62-F87 HydrophobicContact CG2-CD1 4.24Å; V62-F87 HydrophobicContact CG2-CE1 3.12Å; V62-F87 HydrophobicContact CG2-CZ 3.38Å; A68-F87 HydrophobicContact CB-CE2 4.27Å; A68-F87 HydrophobicContact CB-CZ 4.18Å; I70-F87 HydrophobicContact CD1-CD2 4.23Å; K82-F87 HydrophobicContact CD-CB 4.35Å; F87-V89 HydrophobicContact CD2-CG2 3.41Å; F87-V89 VanDerWaalsContact CD2-CG2 3.41Å; F87-V89 HydrophobicContact CE2-CG2 3.38Å
88F71.8Confident73.5Confident97 Ų9768.2 Ų68.243%0.42537%0.368SS..EExtended strand (participates in β ladder)trans-90.1122.9177.7-157-96.9000108.9L55 C58L55-F88 HydrophobicContact CD1-CE2 4.47Å; C58-F88 HydrophobicContact CB-CD1 4.29Å; C58-F88 HydrophobicContact CB-CD2 3.77Å; C58-F88 HydrophobicContact CB-CE1 3.85Å; C58-F88 HydrophobicContact CB-CE2 3.27Å; C58-F88 HydrophobicContact CB-CG 4.27Å; C58-F88 HydrophobicContact CB-CZ 3.31Å
89V77.4Confident74.7Confident11 Ų1165.5 Ų65.57%0.06735%0.354CS..  trans-113.6127174.7-176.20000107.9C58 F87 P91 D94 F96C58-V89 PolarHBondContact O-N 2.93Å; F87-V89 HydrophobicContact CD2-CG2 3.41Å; F87-V89 VanDerWaalsContact CD2-CG2 3.41Å; F87-V89 HydrophobicContact CE2-CG2 3.38Å; V89-P91 VanDerWaalsContact O-CD 3.32Å; V89-P91 WeakPolarHBondContact O-CD 3.49Å; V89-D94 HydrophobicContact CG1-CB 3.68Å; V89-F96 HydrophobicContact CG1-CD1 4.23Å; V89-F96 HydrophobicContact CG2-CD1 4.35Å
90L73.1Confident76Confident28 Ų2862 Ų6215%0.14735%0.345CS..  trans-74.3119.2175-78.894000109.9I47 C92 D94I47-L90 HydrophobicContact CD1-CD2 4.12Å; I47-L90 HydrophobicContact CD1-CG 4.39Å; L90-C92 PolarHBondContact O-N 2.97Å; L90-D94 PolarHBondContact O-N 3.44Å
91P65Low77.1Confident49 Ų4956 Ų5632%0.31832%0.32SS..THydrogen-bonded Turntrans-60.5137.4172.125.3-32.4000109S43 I47 C58 V89S43-P91 PolarHBondContact OG-O 3.13Å; I47-P91 HydrophobicContact CD1-CG 4.41Å; I47-P91 HydrophobicContact CG1-CG 4.35Å; C58-P91 WeakPolarHBondContact SG-CD 3.49Å; V89-P91 VanDerWaalsContact O-CD 3.32Å; V89-P91 WeakPolarHBondContact O-CD 3.49Å
92C68.9Low78.1Confident133 Ų13360.2 Ų60.290%0.89933%0.331SS*.THydrogen-bonded Turntrans86.7-32-179.5-50.60000117.9L90L90-C92 PolarHBondContact O-N 2.97Å
93T75.7Confident79Confident12 Ų1259.8 Ų59.87%0.07434%0.335CS..THydrogen-bonded Turntrans-105.2-28.9-178.660.70000114.4L73L73-T93 PolarHBondContact N-O 3.4Å; L73-T93 VanDerWaalsContact N-O 3.14Å
94D80.7Confident80.3Confident11 Ų1160.3 Ų60.36%0.05933%0.329CS..EExtended strand (participates in β ladder)trans-110.1120.7-172.5-66.42000109.1I70 F71 R72 V89 L90I70-D94 HydrophobicContact CG2-CB 4.17Å; F71-D94 CarbonylContact O-C 3.58Å; F71-D94 WeakPolarHBondContact O-CA 3.37Å; R72-D94 WeakPolarHBondContact CG-OD1 3.25Å; R72-D94 IonicContact CZ-OD1 3.86Å; R72-D94 IonicContact CZ-OD2 3.73Å; R72-D94 IonicContact NE-OD1 2.97Å; R72-D94 PolarHBondContact NE-OD1 3.31Å; R72-D94 IonicContact NE-OD2 3.56Å; R72-D94 IonicContact NH2-OD1 3.83Å; R72-D94 IonicContact NH2-OD2 2.98Å; R72-D94 PolarHBondContact NH2-OD2 2.91Å; V89-D94 HydrophobicContact CG1-CB 3.68Å; L90-D94 PolarHBondContact O-N 3.44Å
95N82.3Confident81.4Confident120 Ų12060.8 Ų60.864%0.64234%0.335SS*.EExtended strand (participates in β ladder)trans-100.3139.4168.4-76.3-40.2000108.7I70 F71I70-N95 WeakPolarHBondContact CA-O 3.31Å; F71-N95 HydrophobicContact CB-CB 4.39Å; F71-N95 PolarHBondContact N-O 3.3Å; F71-N95 PolarHBondContact O-N 3.4Å
96F83.9Confident82.4Confident72 Ų7260.2 Ų60.232%0.31632%0.323SS..EExtended strand (participates in β ladder)trans-122139.2176.571.7-84.4000110.3V69 I70 V89 K98V69-F96 WeakPolarHBondContact O-CA 3.49Å; I70-F96 HydrophobicContact CG1-CB 4.37Å; V89-F96 HydrophobicContact CG1-CD1 4.23Å; V89-F96 HydrophobicContact CG2-CD1 4.35Å; F96-K98 HydrophobicContact CD2-CG 4.02Å; F96-K98 HydrophobicContact CE2-CD 4.37Å; F96-K98 HydrophobicContact CE2-CG 4.02Å
97V86.1Confident83.6Confident59 Ų5958.5 Ų58.536%0.35831%0.314SS..EExtended strand (participates in β ladder)trans-117.5127.9171.9179.30000107.7A68 V69 F71 V99 V138A68-V97 WeakPolarHBondContact CA-O 3.35Å; V69-V97 PolarHBondContact N-O 2.84Å; V69-V97 PolarHBondContact O-N 3.39Å; F71-V97 HydrophobicContact CD2-CG2 4.32Å; F71-V97 HydrophobicContact CE2-CB 4.35Å; F71-V97 HydrophobicContact CE2-CG2 3.88Å; V97-V99 HydrophobicContact CG1-CG2 4.36Å; V97-V138 HydrophobicContact CB-CG1 4.48Å; V97-V138 HydrophobicContact CG1-CG1 4.4Å; V97-V138 HydrophobicContact CG1-CG2 4.13Å; V97-V138 HydrophobicContact CG2-CG1 4.42Å
98K87.7Confident84.6Confident90 Ų9057.9 Ų57.939%0.39131%0.311SS..EExtended strand (participates in β ladder)trans-92.5132.2175.5-58.1-171.5177.6-164.30109.1I61 V62 E66 R67 F96I61-K98 PolarHBondContact O-NZ 3.03Å; V62-K98 HydrophobicContact CG2-CD 4.22Å; V62-K98 HydrophobicContact CG2-CG 4.43Å; E66-K98 IonicContact OE2-NZ 2.7Å; R67-K98 WeakPolarHBondContact O-CA 3.45Å; F96-K98 HydrophobicContact CD2-CG 4.02Å; F96-K98 HydrophobicContact CE2-CD 4.37Å; F96-K98 HydrophobicContact CE2-CG 4.02Å
99V88.6Confident85.6Confident12 Ų1255.3 Ų55.37%0.07330%0.304CS..EExtended strand (participates in β ladder)trans-123.2129.7178.6-176.10000108.3E66 R67 V97 I131 P134 V138E66-V99 WeakPolarHBondContact CA-O 3.34Å; R67-V99 PolarHBondContact N-O 3.27Å; R67-V99 PolarHBondContact O-N 2.88Å; V97-V99 HydrophobicContact CG1-CG2 4.36Å; V99-I131 HydrophobicContact CG1-CB 4.22Å; V99-I131 HydrophobicContact CG1-CD1 3.4Å; V99-I131 HydrophobicContact CG1-CG1 4.39Å; V99-I131 HydrophobicContact CG1-CG2 3.93Å; V99-P134 HydrophobicContact CB-CB 4Å; V99-P134 HydrophobicContact CG1-CB 4.11Å; V99-P134 HydrophobicContact CG2-CB 4.24Å; V99-V138 HydrophobicContact CG2-CG2 3.62Å
100D89.8Confident86.5Confident60 Ų6058.2 Ų58.232%0.32132%0.324SS..EExtended strand (participates in β ladder)trans-81.8133.4173.6-162.4-21.3000109.4R102D100-R102 VanDerWaalsContact OD1-CB 3.31Å; D100-R102 WeakPolarHBondContact OD1-CB 3.16Å; D100-R102 WeakPolarHBondContact OD1-CD 3.28Å; D100-R102 WeakPolarHBondContact OD1-CG 3.35Å; D100-R102 PolarHBondContact OD1-N 2.98Å
101L88.6Confident87.4Confident26 Ų2658.4 Ų58.414%0.13632%0.323CS..  trans-93.1-6.1178-61.5179.6000113.1Y65 R67 I131 P134Y65-L101 PolarHBondContact O-N 3.4Å; Y65-L101 VanDerWaalsContact O-N 3.15Å; R67-L101 HydrophobicContact CG-CD1 3.48Å; R67-L101 VanDerWaalsContact CG-CD1 3.48Å; R67-L101 HydrophobicContact CG-CD2 4.13Å; R67-L101 HydrophobicContact CG-CG 3.9Å; L101-I131 WeakPolarHBondContact CD2-O 3.49Å; L101-P134 HydrophobicContact CD2-CG 4.44Å
102R90.9Very high88.8Confident131 Ų13164.1 Ų64.149%0.49435%0.346SS..SBendtrans-66.7153.4-178.6-69.2168171.8-177.3-5.1111.8Y65 D100 V104Y65-R102 VanDerWaalsContact CD1-CZ 3.48Å; Y65-R102 VanDerWaalsContact CG-NE 3.29Å; D100-R102 VanDerWaalsContact OD1-CB 3.31Å; D100-R102 WeakPolarHBondContact OD1-CB 3.16Å; D100-R102 WeakPolarHBondContact OD1-CD 3.28Å; D100-R102 WeakPolarHBondContact OD1-CG 3.35Å; D100-R102 PolarHBondContact OD1-N 2.98Å; R102-V104 PolarHBondContact O-N 3.45Å
103T92.2Very high90Very high65 Ų6558.3 Ų58.340%0.39931%0.306SS..  trans-62.6123.4168.5-52.40000109.2F129 E195T103-F129 WeakPolarHBondContact CA-O 3.41Å; T103-E195 WeakPolarHBondContact CG2-OE2 3.49Å; T103-E195 VanDerWaalsContact OG1-CD 3.29Å; T103-E195 PolarHBondContact OG1-OE1 3.45Å; T103-E195 PolarHBondContact OG1-OE2 2.89Å
104V93.3Very high90.9Very high52 Ų5262.4 Ų62.432%0.31533%0.327SS..EExtended strand (participates in β ladder)trans-116.6146174.3-710000108.7R102 F129R102-V104 PolarHBondContact O-N 3.45Å; V104-F129 HydrophobicContact CB-CZ 4.48Å; V104-F129 HydrophobicContact CG2-CD1 4.29Å; V104-F129 HydrophobicContact CG2-CD2 4.14Å; V104-F129 HydrophobicContact CG2-CE1 3.64Å; V104-F129 HydrophobicContact CG2-CE2 3.57Å; V104-F129 HydrophobicContact CG2-CG 4.48Å; V104-F129 HydrophobicContact CG2-CZ 3.28Å; V104-F129 PolarHBondContact N-O 3.22Å; V104-F129 WeakPolarHBondContact O-CD1 3.35Å; V104-F129 PolarHBondContact O-N 2.91Å; V104-F129 VanDerWaalsContact O-N 3.07Å
105S94.2Very high91.6Very high75 Ų7562.1 Ų62.152%0.52433%0.325SS..EExtended strand (participates in β ladder)trans-110.3145.3174.356.10000110.7V127S105-V127 VanDerWaalsContact CA-O 3.31Å; S105-V127 WeakPolarHBondContact CA-O 3.38Å
106F95.3Very high92.2Very high22 Ų2263 Ų6310%0.09632%0.324CS..EExtended strand (participates in β ladder)trans-133.6147162.467.4-107.1000110.3I108 V127 F129 T148 R149 A152F106-I108 HydrophobicContact CE2-CG1 4.09Å; F106-V127 HydrophobicContact CE1-CB 4.19Å; F106-V127 HydrophobicContact CE1-CG1 4.45Å; F106-V127 HydrophobicContact CE2-CB 3.97Å; F106-V127 HydrophobicContact CE2-CG2 3.95Å; F106-V127 HydrophobicContact CZ-CB 3.71Å; F106-V127 HydrophobicContact CZ-CG1 4.16Å; F106-V127 HydrophobicContact CZ-CG2 3.96Å; F106-V127 PolarHBondContact N-O 2.98Å; F106-V127 VanDerWaalsContact N-O 3.15Å; F106-V127 PolarHBondContact O-N 3.03Å; F106-F129 AromaticContact CD1-CD1 3.96Å; F106-F129 HydrophobicContact CD1-CD1 3.96Å; F106-F129 AromaticContact CD1-CE1 3.18Å; F106-F129 HydrophobicContact CD1-CE1 3.18Å; F106-F129 AromaticContact CD1-CZ 3.84Å; F106-F129 HydrophobicContact CD1-CZ 3.84Å; F106-F129 AromaticContact CE1-CD1 3.71Å; F106-F129 HydrophobicContact CE1-CD1 3.71Å; F106-F129 AromaticContact CE1-CE1 3.34Å; F106-F129 HydrophobicContact CE1-CE1 3.34Å; F106-F129 AromaticContact CE1-CZ 4Å; F106-F129 HydrophobicContact CE1-CZ 4Å; F106-F129 HydrophobicContact CG-CE1 4.38Å; F106-T148 HydrophobicContact CE1-CG2 3.91Å; F106-T148 HydrophobicContact CZ-CG2 3.99Å; F106-R149 HydrophobicContact CD2-CB 4.43Å; F106-R149 HydrophobicContact CD2-CG 4.11Å; F106-R149 HydrophobicContact CE2-CB 4.17Å; F106-R149 HydrophobicContact CE2-CG 4.1Å; F106-R149 HydrophobicContact CZ-CB 4.42Å; F106-A152 HydrophobicContact CE2-CB 4.06Å; F106-A152 HydrophobicContact CZ-CB 4.09Å
107D95.2Very high92.7Very high87 Ų8763.2 Ų63.247%0.46533%0.328SS..EExtended strand (participates in β ladder)trans-81.8136.8172.9-54.1-60.8000110.7V126 R149D107-V126 VanDerWaalsContact OD1-CG2 3.3Å; D107-V126 WeakPolarHBondContact OD1-CG2 3.27Å; D107-R149 PolarHBondContact O-NH1 3.39Å; D107-R149 VanDerWaalsContact O-NH1 3.08Å; D107-R149 PolarHBondContact O-NH2 2.94Å
108I95.3Very high93Very high3 Ų364.8 Ų64.82%0.01534%0.341CS..EExtended strand (participates in β ladder)trans-82.1123.7165.4-58166.4000107F106 G125 V127 A152 Q153 L156 M179F106-I108 HydrophobicContact CE2-CG1 4.09Å; I108-G125 PolarHBondContact N-O 3.49Å; I108-V127 HydrophobicContact CD1-CG2 3.78Å; I108-V127 HydrophobicContact CG1-CG2 4.17Å; I108-A152 HydrophobicContact CD1-CB 3.92Å; I108-A152 HydrophobicContact CG1-CB 4.09Å; I108-Q153 HydrophobicContact CG2-CG 3.83Å; I108-L156 HydrophobicContact CD1-CD2 4.47Å; I108-L156 HydrophobicContact CG2-CD2 3.91Å; I108-M179 HydrophobicContact CD1-CE 3.57Å
109P94.4Very high93.2Very high43 Ų4361.7 Ų61.728%0.27933%0.33SS..EExtended strand (participates in β ladder)trans-64.3146.9178.428.4-33.8000110.3Q111P109-Q111 PolarHBondContact O-N 3.02Å; P109-Q111 PolarHBondContact O-NE2 3.28Å
110P94.9Very high93.4Very high73 Ų7365 Ų6547%0.47435%0.351SS..EExtended strand (participates in β ladder)trans-50.9127.9-178-25.131.4000112.3D124P110-D124 HydrophobicContact CB-CB 4.38Å; P110-D124 HydrophobicContact CG-CB 4.08Å
111Q93.7Very high93.6Very high31 Ų3162.3 Ų62.315%0.14534%0.336CS..EExtended strand (participates in β ladder)trans-111.9127.6177.7-63.9-60-58.300109.8P109 I113 S122 V123 L156P109-Q111 PolarHBondContact O-N 3.02Å; P109-Q111 PolarHBondContact O-NE2 3.28Å; Q111-I113 HydrophobicContact CB-CG2 4.21Å; Q111-S122 VanDerWaalsContact O-CA 3.3Å; Q111-S122 WeakPolarHBondContact O-CA 3.42Å; Q111-V123 PolarHBondContact N-O 2.86Å; Q111-V123 PolarHBondContact O-N 3.48Å; Q111-L156 HydrophobicContact CG-CD2 4.38Å
112E93.8Very high93.8Very high169 Ų16962.2 Ų62.279%0.7934%0.338SS*.EExtended strand (participates in β ladder)trans-82121.4167.5-67.6-174.9175.100109.4
113I93.9Very high94Very high12 Ų1256 Ų566%0.06232%0.315CS..EExtended strand (participates in β ladder)trans-137.5155.2-17656.2158.3000110.6Q111 T120 V121 R157 L160Q111-I113 HydrophobicContact CB-CG2 4.21Å; I113-T120 WeakPolarHBondContact O-CA 3.28Å; I113-V121 HydrophobicContact CD1-CG2 4.04Å; I113-V121 HydrophobicContact CG1-CG2 3.74Å; I113-V121 WeakPolarHBondContact CG1-O 3.41Å; I113-V121 PolarHBondContact N-O 3.43Å; I113-V121 PolarHBondContact O-N 3.42Å; I113-R157 HydrophobicContact CG2-CB 4.27Å; I113-R157 HydrophobicContact CG2-CG 3.91Å; I113-L160 HydrophobicContact CD1-CB 3.15Å; I113-L160 HydrophobicContact CD1-CD1 3.37Å; I113-L160 HydrophobicContact CD1-CG 3.88Å
114L94.6Very high94.2Very high98 Ų9853.9 Ų53.951%0.51330%0.301SS..EExtended strand (participates in β ladder)trans-97.2125.1171.6-163.474.4000108.6S118 T120L114-S118 VanDerWaalsContact CD1-C 3.44Å; L114-S118 WeakPolarHBondContact CD1-O 3.3Å; L114-T120 HydrophobicContact CD1-CG2 3.8Å
115T94.8Very high94.2Very high4 Ų451.5 Ų51.53%0.02529%0.287CS..  trans-75.4171.3172.263.10000111D117 S118 V119 V121 L168T115-D117 PolarHBondContact O-N 2.88Å; T115-S118 PolarHBondContact O-N 2.96Å; T115-V119 PolarHBondContact N-O 3.3Å; T115-V119 PolarHBondContact OG1-N 3.37Å; T115-V119 PolarHBondContact OG1-O 2.91Å; T115-V121 HydrophobicContact CG2-CG1 4.33Å; T115-V121 HydrophobicContact CG2-CG2 3.67Å; T115-L168 HydrophobicContact CG2-CD1 3.57Å
116K94.8Very high94.3Very high140 Ų14048.7 Ų48.761%0.60927%0.266SS*.THydrogen-bonded Turntrans-58.2-28175.3179.9171.1166.4-165.80113.4S118 T162 K163 N164K116-S118 PolarHBondContact O-N 2.98Å; K116-T162 WeakPolarHBondContact CD-O 3.43Å; K116-K163 WeakPolarHBondContact CB-O 3.31Å; K116-K163 PolarHBondContact N-O 3.18Å; K116-K163 VanDerWaalsContact N-O 3.11Å; K116-N164 WeakPolarHBondContact CB-OD1 3.34Å; K116-N164 VanDerWaalsContact CD-OD1 3.31Å; K116-N164 WeakPolarHBondContact CD-OD1 3.09Å; K116-N164 WeakPolarHBondContact CG-OD1 3.36Å
117D94.4Very high94.4Very high75 Ų7547.6 Ų47.640%0.40126%0.262SS..THydrogen-bonded Turntrans-83.712.2176.9-55.2-41.9000113.3T115 V119 N164 L165T115-D117 PolarHBondContact O-N 2.88Å; D117-V119 HydrophobicContact CB-CG2 4.38Å; D117-V119 PolarHBondContact O-N 3.02Å; D117-N164 VanDerWaalsContact OD1-CG 3.31Å; D117-N164 PolarHBondContact OD1-ND2 3.49Å; D117-N164 PolarHBondContact OD1-OD1 3.41Å; D117-N164 WeakPolarHBondContact OD2-CA 3.42Å; D117-N164 WeakPolarHBondContact OD2-CB 3.38Å; D117-L165 PolarHBondContact OD2-N 3.38Å
118S92.4Very high94.5Very high92 Ų9246.6 Ų46.664%0.64325%0.252SS*.SBendtrans60.630.2-177.7-540000114.1L114 T115 K116L114-S118 VanDerWaalsContact CD1-C 3.44Å; L114-S118 WeakPolarHBondContact CD1-O 3.3Å; T115-S118 PolarHBondContact O-N 2.96Å; K116-S118 PolarHBondContact O-N 2.98Å
119V92.1Very high94.4Very high26 Ų2646.5 Ų46.516%0.15825%0.251CS..  trans-98.8131.2174.2-179.50000109.9T115 D117 V121 L165 L204 L208T115-V119 PolarHBondContact N-O 3.3Å; T115-V119 PolarHBondContact OG1-N 3.37Å; T115-V119 PolarHBondContact OG1-O 2.91Å; D117-V119 HydrophobicContact CB-CG2 4.38Å; D117-V119 PolarHBondContact O-N 3.02Å; V119-V121 HydrophobicContact CG1-CG1 4.05Å; V119-L165 HydrophobicContact CB-CD2 4.5Å; V119-L165 HydrophobicContact CG1-CD2 4.18Å; V119-L165 HydrophobicContact CG2-CD2 4.29Å; V119-L204 HydrophobicContact CG1-CD2 4.43Å; V119-L208 HydrophobicContact CG1-CD2 3.42Å; V119-L208 VanDerWaalsContact CG1-CD2 3.42Å
120T92.8Very high94.4Very high82 Ų8246.6 Ų46.650%0.50325%0.246SC..EExtended strand (participates in β ladder)trans-78.6122.5172.251.70000109.9I113 L114 P205I113-T120 WeakPolarHBondContact O-CA 3.28Å; L114-T120 HydrophobicContact CD1-CG2 3.8Å; T120-P205 WeakPolarHBondContact O-CD 3.39Å
121V93.9Very high94.2Very high3 Ų343.6 Ų43.62%0.01823%0.226CC..EExtended strand (participates in β ladder)trans-131146.3176.2-63.30000109.9I113 T115 V119 V123 L165 L168 V202 L204I113-V121 HydrophobicContact CD1-CG2 4.04Å; I113-V121 HydrophobicContact CG1-CG2 3.74Å; I113-V121 WeakPolarHBondContact CG1-O 3.41Å; I113-V121 PolarHBondContact N-O 3.43Å; I113-V121 PolarHBondContact O-N 3.42Å; T115-V121 HydrophobicContact CG2-CG1 4.33Å; T115-V121 HydrophobicContact CG2-CG2 3.67Å; V119-V121 HydrophobicContact CG1-CG1 4.05Å; V121-V123 HydrophobicContact CB-CG2 4.44Å; V121-V123 HydrophobicContact CG2-CG2 3.97Å; V121-L165 HydrophobicContact CG1-CD1 3.92Å; V121-L168 HydrophobicContact CG2-CD1 4.15Å; V121-V202 HydrophobicContact CB-CG1 4.3Å; V121-V202 HydrophobicContact CG1-CG1 4.47Å; V121-L204 HydrophobicContact CG1-CD2 3.91Å
122S94.3Very high94Very high24 Ų2443.5 Ų43.517%0.16823%0.225CC..EExtended strand (participates in β ladder)trans-105.5118.6170.9-177.10000108.8Q111 K203Q111-S122 VanDerWaalsContact O-CA 3.3Å; Q111-S122 WeakPolarHBondContact O-CA 3.42Å; S122-K203 PolarHBondContact N-O 3.32Å; S122-K203 PolarHBondContact O-N 3.06Å
123V94.6Very high93.7Very high1 Ų135.7 Ų35.71%0.00619%0.189CC..EExtended strand (participates in β ladder)trans-121.7135-176.8-175.80000110.1Q111 V121 L160 I199 D201 V202Q111-V123 PolarHBondContact N-O 2.86Å; Q111-V123 PolarHBondContact O-N 3.48Å; V121-V123 HydrophobicContact CB-CG2 4.44Å; V121-V123 HydrophobicContact CG2-CG2 3.97Å; V123-L160 HydrophobicContact CB-CD1 3.8Å; V123-L160 HydrophobicContact CG1-CD1 3.82Å; V123-L160 HydrophobicContact CG2-CD1 3.95Å; V123-I199 HydrophobicContact CG1-CG2 3.8Å; V123-D201 WeakPolarHBondContact CA-O 3.41Å; V123-V202 HydrophobicContact CG1-CG2 4.25Å; V123-V202 HydrophobicContact CG2-CB 4.37Å; V123-V202 HydrophobicContact CG2-CG1 4.01Å; V123-V202 HydrophobicContact CG2-CG2 4.02Å
124D94.9Very high93.3Very high20 Ų2035.3 Ų35.311%0.10719%0.187CC..EExtended strand (participates in β ladder)trans-120.3167.3167.164.75.5000111.3P110 K200 D201P110-D124 HydrophobicContact CB-CB 4.38Å; P110-D124 HydrophobicContact CG-CB 4.08Å; D124-K200 PolarHBondContact O-N 3.41Å; D124-K200 WeakPolarHBondContact OD1-CB 3.49Å; D124-D201 PolarHBondContact N-O 3.23Å; D124-D201 WeakPolarHBondContact OD1-CA 3.19Å; D124-D201 WeakPolarHBondContact OD1-CB 3.14Å; D124-D201 PolarHBondContact OD1-N 2.95Å
125G95Very high93Very high2 Ų230.8 Ų30.82%0.02116%0.164CC..EExtended strand (participates in β ladder)trans-167.9172.5-175.800000112.2I108 E198I108-G125 PolarHBondContact N-O 3.49Å; G125-E198 CarbonylContact C-O 3.56Å; G125-E198 WeakPolarHBondContact CA-O 3.31Å
126V96.4Very high92.6Very high15 Ų1531.1 Ų31.19%0.09117%0.166CC..EExtended strand (participates in β ladder)trans-128.5136.8-178.7-172.10000108.8D107 Y128 E198D107-V126 VanDerWaalsContact OD1-CG2 3.3Å; D107-V126 WeakPolarHBondContact OD1-CG2 3.27Å; V126-Y128 HydrophobicContact CB-CE2 4.24Å; V126-Y128 HydrophobicContact CG1-CD2 4.36Å; V126-Y128 HydrophobicContact CG1-CE2 3.9Å; V126-E198 PolarHBondContact N-O 3.43Å; V126-E198 PolarHBondContact O-N 3.47Å
127V96.8Very high92.2Very high0 Ų024.7 Ų24.70%014%0.14CC..EExtended strand (participates in β ladder)trans-112.9129.2175.1-177.50000108.4S105 F106 I108 F129 A152 L183 V194 V197S105-V127 VanDerWaalsContact CA-O 3.31Å; S105-V127 WeakPolarHBondContact CA-O 3.38Å; F106-V127 HydrophobicContact CE1-CB 4.19Å; F106-V127 HydrophobicContact CE1-CG1 4.45Å; F106-V127 HydrophobicContact CE2-CB 3.97Å; F106-V127 HydrophobicContact CE2-CG2 3.95Å; F106-V127 HydrophobicContact CZ-CB 3.71Å; F106-V127 HydrophobicContact CZ-CG1 4.16Å; F106-V127 HydrophobicContact CZ-CG2 3.96Å; F106-V127 PolarHBondContact N-O 2.98Å; F106-V127 VanDerWaalsContact N-O 3.15Å; F106-V127 PolarHBondContact O-N 3.03Å; I108-V127 HydrophobicContact CD1-CG2 3.78Å; I108-V127 HydrophobicContact CG1-CG2 4.17Å; V127-F129 HydrophobicContact CG1-CD1 4.36Å; V127-A152 HydrophobicContact CG2-CB 4.15Å; V127-L183 HydrophobicContact CG2-CD1 4.31Å; V127-V194 HydrophobicContact CG1-CG1 3.93Å; V127-V197 HydrophobicContact CG1-CG2 4.34Å; V127-V197 HydrophobicContact CG2-CG1 4.36Å; V127-V197 HydrophobicContact CG2-CG2 4.36Å
128Y96.1Very high91.9Very high65 Ų6523.2 Ų23.226%0.25513%0.133SC..EExtended strand (participates in β ladder)trans-107.7124171.4-53.5-104.8000108.4V126 E195 R196 E198V126-Y128 HydrophobicContact CB-CE2 4.24Å; V126-Y128 HydrophobicContact CG1-CD2 4.36Å; V126-Y128 HydrophobicContact CG1-CE2 3.9Å; Y128-E195 PolarHBondContact O-N 3.11Å; Y128-R196 HydrophobicContact CD2-CG 3.23Å; Y128-R196 HydrophobicContact CE2-CG 3.91Å; Y128-R196 HydrophobicContact CG-CG 3.78Å; Y128-R196 PolarHBondContact N-O 3.4Å; Y128-R196 PolarHBondContact O-N 3.04Å; Y128-E198 HydrophobicContact CE2-CB 4.45Å; Y128-E198 HydrophobicContact CE2-CG 4.13Å; Y128-E198 WeakPolarHBondContact CE2-OE2 3.47Å; Y128-E198 PolarHBondContact OH-OE2 3.07Å; Y128-E198 VanDerWaalsContact OH-OE2 3.09Å
129F95Very high91.5Very high2 Ų221.1 Ų21.11%0.00912%0.121CC..EExtended strand (participates in β ladder)trans-143.2156.6-178.566.2-73.9000109.2T103 V104 F106 V127 H145 I192 K193 V194T103-F129 WeakPolarHBondContact CA-O 3.41Å; V104-F129 HydrophobicContact CB-CZ 4.48Å; V104-F129 HydrophobicContact CG2-CD1 4.29Å; V104-F129 HydrophobicContact CG2-CD2 4.14Å; V104-F129 HydrophobicContact CG2-CE1 3.64Å; V104-F129 HydrophobicContact CG2-CE2 3.57Å; V104-F129 HydrophobicContact CG2-CG 4.48Å; V104-F129 HydrophobicContact CG2-CZ 3.28Å; V104-F129 PolarHBondContact N-O 3.22Å; V104-F129 WeakPolarHBondContact O-CD1 3.35Å; V104-F129 PolarHBondContact O-N 2.91Å; V104-F129 VanDerWaalsContact O-N 3.07Å; F106-F129 AromaticContact CD1-CD1 3.96Å; F106-F129 HydrophobicContact CD1-CD1 3.96Å; F106-F129 AromaticContact CD1-CE1 3.18Å; F106-F129 HydrophobicContact CD1-CE1 3.18Å; F106-F129 AromaticContact CD1-CZ 3.84Å; F106-F129 HydrophobicContact CD1-CZ 3.84Å; F106-F129 AromaticContact CE1-CD1 3.71Å; F106-F129 HydrophobicContact CE1-CD1 3.71Å; F106-F129 AromaticContact CE1-CE1 3.34Å; F106-F129 HydrophobicContact CE1-CE1 3.34Å; F106-F129 AromaticContact CE1-CZ 4Å; F106-F129 HydrophobicContact CE1-CZ 4Å; F106-F129 HydrophobicContact CG-CE1 4.38Å; V127-F129 HydrophobicContact CG1-CD1 4.36Å; F129-H145 AromaticContact CE2-CE1 3.94Å; F129-H145 AromaticContact CE2-ND1 3.59Å; F129-H145 AromaticContact CZ-CE1 3.98Å; F129-H145 AromaticContact CZ-ND1 3.38Å; F129-H145 WeakPolarHBondContact CZ-ND1 3.44Å; F129-I192 HydrophobicContact CB-CG2 3.83Å; F129-I192 HydrophobicContact CD2-CD1 4.47Å; F129-I192 HydrophobicContact CD2-CG1 4.49Å; F129-I192 HydrophobicContact CD2-CG2 3.58Å; F129-I192 HydrophobicContact CG-CG2 4.04Å; F129-K193 CarbonylContact C-O 3.46Å; F129-K193 VanDerWaalsContact CA-O 3.24Å; F129-K193 WeakPolarHBondContact CA-O 3.3Å; F129-K193 WeakPolarHBondContact CB-O 3.34Å; F129-V194 HydrophobicContact CB-CG2 4.38Å
130R93.4Very high91.2Very high44 Ų4422.9 Ų22.917%0.16613%0.13CC..EExtended strand (participates in β ladder)trans-128.4151.217263.2173.4177.6107.42.6109.9D13 H132 K193 E195D13-R130 IonicContact OD2-NH1 3.71Å; D13-R130 IonicContact OD2-NH2 3.18Å; D13-R130 PolarHBondContact OD2-NH2 3.19Å; R130-H132 PolarHBondContact O-N 3.32Å; R130-K193 HydrophobicContact CG-CB 4.29Å; R130-K193 PolarHBondContact N-O 3.11Å; R130-K193 PolarHBondContact O-N 3.02Å; R130-E195 WeakPolarHBondContact CD-OE1 3.48Å; R130-E195 HydrophobicContact CG-CG 4.26Å; R130-E195 IonicContact NE-OE1 2.56Å; R130-E195 PolarHBondContact NE-OE1 3.46Å
131I91.7Very high91Very high10 Ų1019.9 Ų19.95%0.05111%0.112CC..EExtended strand (participates in β ladder)trans-82.7116.2172.5-61.5171000107.4V99 L101 P134 A137 I192V99-I131 HydrophobicContact CG1-CB 4.22Å; V99-I131 HydrophobicContact CG1-CD1 3.4Å; V99-I131 HydrophobicContact CG1-CG1 4.39Å; V99-I131 HydrophobicContact CG1-CG2 3.93Å; L101-I131 WeakPolarHBondContact CD2-O 3.49Å; I131-P134 HydrophobicContact CG2-CB 4.5Å; I131-A137 HydrophobicContact CG2-CB 3.79Å; I131-I192 HydrophobicContact CG1-CG1 4.31Å
132H87.8Confident90.5Very high29 Ų2925.2 Ų25.213%0.13415%0.149CC..SBendtrans-91.7-39.1177.9170.1-99.6000111.3D13 R130 G191 K193D13-H132 WeakPolarHBondContact CA-NE2 3.4Å; D13-H132 WeakPolarHBondContact CB-NE2 3.44Å; D13-H132 VanDerWaalsContact CG-CD2 3.47Å; D13-H132 PolarHBondContact O-CE1 3.23Å; D13-H132 PolarHBondContact O-NE2 3.31Å; D13-H132 VanDerWaalsContact O-NE2 3.12Å; D13-H132 IonicContact OD1-NE2 3.75Å; D13-H132 IonicContact OD2-CD2 3.14Å; D13-H132 PolarHBondContact OD2-CD2 3.17Å; D13-H132 VanDerWaalsContact OD2-CD2 3.32Å; D13-H132 IonicContact OD2-NE2 3.37Å; D13-H132 PolarHBondContact OD2-NE2 2.96Å; R130-H132 PolarHBondContact O-N 3.32Å; H132-G191 PolarHBondContact N-O 3.2Å; H132-K193 HydrophobicContact CB-CB 4.29Å
133C87.5Confident90.2Very high5 Ų529 Ų293%0.03417%0.167CC..  trans-120.194.3-178.6-163.40000110.6C17 I135 S136 A137 G191C17-C133 HydrophobicContact CB-CB 3.81Å; C17-C133 WeakPolarHBondContact CB-SG 3.4Å; C17-C133 VanDerWaalsContact SG-CA 3.53Å; C17-C133 WeakPolarHBondContact SG-CB 3.49Å; C17-C133 CovalentContact SG-SG 2.04Å; C17-C133 PolarHBondContact SG-SG 2.88Å; C133-I135 VanDerWaalsContact C-N 3.27Å; C133-I135 PolarHBondContact O-N 3.47Å; C133-S136 PolarHBondContact O-N 3.11Å; C133-S136 PolarHBondContact SG-OG 3.41Å; C133-A137 PolarHBondContact O-N 3.04Å; C133-A137 VanDerWaalsContact O-N 3.14Å; C133-G191 PolarHBondContact N-O 3.37Å
134P86.9Confident89.9Confident4 Ų429.5 Ų29.53%0.02617%0.171CC..Hα-helixtrans-67.4-25.5-172.926.5-35.5000113.3R67 V69 P81 V99 L101 I131 V138R67-P134 HydrophobicContact CB-CB 4.32Å; R67-P134 HydrophobicContact CB-CG 4.02Å; R67-P134 HydrophobicContact CG-CG 4.39Å; V69-P134 HydrophobicContact CG2-CB 4.09Å; P81-P134 HydrophobicContact CB-CG 3.8Å; P81-P134 HydrophobicContact CG-CG 4.01Å; V99-P134 HydrophobicContact CB-CB 4Å; V99-P134 HydrophobicContact CG1-CB 4.11Å; V99-P134 HydrophobicContact CG2-CB 4.24Å; L101-P134 HydrophobicContact CD2-CG 4.44Å; I131-P134 HydrophobicContact CG2-CB 4.5Å; P134-V138 WeakPolarHBondContact O-CG2 3.48Å; P134-V138 PolarHBondContact O-N 2.75Å
135I86.8Confident89.7Confident3 Ų333.4 Ų33.42%0.01519%0.189CC..Hα-helixtrans-66.8-51.5176.5-58.8176.7000110F21 V69 I76 P81 C133 A137 V138 A139F21-I135 HydrophobicContact CD2-CG2 3.95Å; F21-I135 HydrophobicContact CE1-CG2 4.25Å; F21-I135 HydrophobicContact CE2-CB 4.4Å; F21-I135 HydrophobicContact CE2-CG2 3.35Å; F21-I135 HydrophobicContact CZ-CG2 3.53Å; V69-I135 HydrophobicContact CG2-CG1 4.44Å; I76-I135 HydrophobicContact CD1-CG2 3.87Å; I76-I135 HydrophobicContact CG2-CG2 4.36Å; P81-I135 HydrophobicContact CB-CG1 4.42Å; C133-I135 VanDerWaalsContact C-N 3.27Å; C133-I135 PolarHBondContact O-N 3.47Å; I135-A137 VanDerWaalsContact C-N 3.31Å; I135-A137 PolarHBondContact O-N 2.83Å; I135-V138 PolarHBondContact O-N 3.19Å; I135-A139 WeakPolarHBondContact O-CB 3.32Å; I135-A139 PolarHBondContact O-N 2.77Å
136S86.3Confident89.5Confident11 Ų1136.6 Ų36.68%0.07721%0.211CC..Hα-helixtrans-62.4-38.1178.7-57.40000112.1C133 V138 A139 N140 W190C133-S136 PolarHBondContact O-N 3.11Å; C133-S136 PolarHBondContact SG-OG 3.41Å; S136-V138 VanDerWaalsContact C-N 3.27Å; S136-V138 PolarHBondContact O-N 2.88Å; S136-A139 PolarHBondContact O-N 3.22Å; S136-N140 VanDerWaalsContact O-CB 3.29Å; S136-N140 WeakPolarHBondContact O-CB 3.27Å; S136-N140 PolarHBondContact O-N 3.1Å; S136-W190 CarbonylContact C-O 3.48Å
137A87.4Confident89.4Confident6 Ų637.6 Ų37.65%0.0522%0.218CC..Hα-helixtrans-62.4-32.2179.800000113.7I131 C133 I135 W190I131-A137 HydrophobicContact CG2-CB 3.79Å; C133-A137 PolarHBondContact O-N 3.04Å; C133-A137 VanDerWaalsContact O-N 3.14Å; I135-A137 VanDerWaalsContact C-N 3.31Å; I135-A137 PolarHBondContact O-N 2.83Å; A137-W190 WeakPolarHBondContact CA-O 3.35Å; A137-W190 WeakPolarHBondContact CB-O 3.27Å; A137-W190 PolarHBondContact N-O 3.12Å; A137-W190 VanDerWaalsContact N-O 3.08Å
138V87.4Confident89.2Confident44 Ų4437.6 Ų37.627%0.26722%0.218SC..Hα-helixtrans-93.1-30.5178.2-174.80000111.9V69 F71 V97 V99 P134 I135 S136V69-V138 HydrophobicContact CG2-CG2 4.46Å; F71-V138 HydrophobicContact CE2-CG1 3.82Å; F71-V138 HydrophobicContact CZ-CB 4.28Å; F71-V138 HydrophobicContact CZ-CG1 3.53Å; V97-V138 HydrophobicContact CB-CG1 4.48Å; V97-V138 HydrophobicContact CG1-CG1 4.4Å; V97-V138 HydrophobicContact CG1-CG2 4.13Å; V97-V138 HydrophobicContact CG2-CG1 4.42Å; V99-V138 HydrophobicContact CG2-CG2 3.62Å; P134-V138 WeakPolarHBondContact O-CG2 3.48Å; P134-V138 PolarHBondContact O-N 2.75Å; I135-V138 PolarHBondContact O-N 3.19Å; S136-V138 VanDerWaalsContact C-N 3.27Å; S136-V138 PolarHBondContact O-N 2.88Å
139A85.7Confident89.1Confident48 Ų4838.8 Ų38.840%0.39722%0.222SC..Hα-helixtrans-84-38.6-175.400000113.6I76 I135 S136I76-A139 HydrophobicContact CD1-CB 4.17Å; I135-A139 WeakPolarHBondContact O-CB 3.32Å; I135-A139 PolarHBondContact O-N 2.77Å; S136-A139 PolarHBondContact O-N 3.22Å
140N85.4Confident89.1Confident63 Ų6343.8 Ų43.834%0.33725%0.248SC..SBendtrans-92.4-20.1-168.3-64.8-13.4000113.3S136 P189S136-N140 VanDerWaalsContact O-CB 3.29Å; S136-N140 WeakPolarHBondContact O-CB 3.27Å; S136-N140 PolarHBondContact O-N 3.1Å; N140-P189 PolarHBondContact ND2-O 3.24Å
141V87.5Confident89.2Confident19 Ų1943.7 Ų43.712%0.11525%0.251CS..  trans-138.5140.4-179.6168.30000110.3N143 A144 S147 W190V141-N143 VanDerWaalsContact CG1-C 3.45Å; V141-A144 HydrophobicContact CG1-CB 4.47Å; V141-S147 WeakPolarHBondContact CG1-OG 3.3Å; V141-W190 HydrophobicContact CG2-CB 4.41Å; V141-W190 HydrophobicContact CG2-CD2 3.73Å; V141-W190 HydrophobicContact CG2-CG 3.58Å; V141-W190 HydrophobicContact CG2-CZ2 4.32Å; V141-W190 VanDerWaalsContact CG2-NE1 3.29Å
142S84.3Confident89.4Confident114 Ų11443.2 Ų43.280%0.79725%0.249SC*.SBendtrans-63.2-49.1176.756.10000112.6
143N88.2Confident89.7Confident104 Ų10443.7 Ų43.756%0.55625%0.251SS*.  trans-135.493.6177.2-73.8-49.7000110.7V141 H145 S146 S147V141-N143 VanDerWaalsContact CG1-C 3.45Å; N143-H145 VanDerWaalsContact C-N 3.33Å; N143-H145 PolarHBondContact O-N 3.26Å; N143-S146 PolarHBondContact O-N 3.19Å; N143-S147 PolarHBondContact O-N 2.82Å; N143-S147 VanDerWaalsContact O-N 3.07Å; N143-S147 PolarHBondContact O-OG 3.39Å
144A88.1Confident90.1Very high11 Ų1146.9 Ų46.99%0.09127%0.27CS..Hα-helixtrans-57.9-44.1-174.200000112.1V141 S146 S147 T148 I192V141-A144 HydrophobicContact CG1-CB 4.47Å; A144-S146 PolarHBondContact O-N 3.09Å; A144-S147 PolarHBondContact O-N 3.21Å; A144-T148 WeakPolarHBondContact O-CB 3.49Å; A144-T148 PolarHBondContact O-N 3.02Å; A144-T148 PolarHBondContact O-OG1 3.3Å; A144-I192 HydrophobicContact CB-CD1 3.81Å
145H90.1Very high90.5Very high103 Ų10347.4 Ų47.448%0.47727%0.273SS..Hα-helixtrans-58.4-46177.7-61.4-61.4000113.8F129 N143 R149F129-H145 AromaticContact CE2-CE1 3.94Å; F129-H145 AromaticContact CE2-ND1 3.59Å; F129-H145 AromaticContact CZ-CE1 3.98Å; F129-H145 AromaticContact CZ-ND1 3.38Å; F129-H145 WeakPolarHBondContact CZ-ND1 3.44Å; N143-H145 VanDerWaalsContact C-N 3.33Å; N143-H145 PolarHBondContact O-N 3.26Å; H145-R149 WeakPolarHBondContact O-CB 3.31Å; H145-R149 PolarHBondContact O-N 3.42Å
146S91.6Very high90.9Very high69 Ų6947.3 Ų47.348%0.48327%0.273SS..Hα-helixtrans-70.1-42.1-178.1-57.70000111.7N143 A144 R149 L150N143-S146 PolarHBondContact O-N 3.19Å; A144-S146 PolarHBondContact O-N 3.09Å; S146-R149 PolarHBondContact O-N 2.72Å; S146-L150 WeakPolarHBondContact O-CG 3.18Å; S146-L150 PolarHBondContact O-N 3.03Å; S146-L150 VanDerWaalsContact O-N 3.11Å
147S93.2Very high91.3Very high35 Ų3552.9 Ų52.925%0.24529%0.292CS..Hα-helixtrans-63.6-44.5176.9-63.80000111.7V141 N143 A144 R149 L150 L151V141-S147 WeakPolarHBondContact CG1-OG 3.3Å; N143-S147 PolarHBondContact O-N 2.82Å; N143-S147 VanDerWaalsContact O-N 3.07Å; N143-S147 PolarHBondContact O-OG 3.39Å; A144-S147 PolarHBondContact O-N 3.21Å; S147-R149 VanDerWaalsContact C-N 3.3Å; S147-R149 PolarHBondContact O-N 3Å; S147-L150 PolarHBondContact O-N 3.05Å; S147-L151 WeakPolarHBondContact O-CB 3.43Å; S147-L151 PolarHBondContact O-N 3.19Å
148T93.1Very high91.6Very high0 Ų057.4 Ų57.40%032%0.316CS..Hα-helixtrans-62.5-36.3175.5-56.70000111.9F106 A144 L151 A152 T187 I192F106-T148 HydrophobicContact CE1-CG2 3.91Å; F106-T148 HydrophobicContact CZ-CG2 3.99Å; A144-T148 WeakPolarHBondContact O-CB 3.49Å; A144-T148 PolarHBondContact O-N 3.02Å; A144-T148 PolarHBondContact O-OG1 3.3Å; T148-L151 PolarHBondContact O-N 2.76Å; T148-A152 VanDerWaalsContact O-CB 3.28Å; T148-A152 WeakPolarHBondContact O-CB 3.14Å; T148-A152 PolarHBondContact O-N 3.27Å; T148-T187 HydrophobicContact CG2-CG2 4.04Å; T148-I192 VanDerWaalsContact OG1-CD1 3.32Å; T148-I192 WeakPolarHBondContact OG1-CD1 3.23Å
149R94.5Very high91.9Very high91 Ų9156.1 Ų56.134%0.34331%0.308SS..Hα-helixtrans-64.3-43.4175.8-169.3-178.4-172.91050.2112.6F106 D107 H145 S146 S147 A152 Q153F106-R149 HydrophobicContact CD2-CB 4.43Å; F106-R149 HydrophobicContact CD2-CG 4.11Å; F106-R149 HydrophobicContact CE2-CB 4.17Å; F106-R149 HydrophobicContact CE2-CG 4.1Å; F106-R149 HydrophobicContact CZ-CB 4.42Å; D107-R149 PolarHBondContact O-NH1 3.39Å; D107-R149 VanDerWaalsContact O-NH1 3.08Å; D107-R149 PolarHBondContact O-NH2 2.94Å; H145-R149 WeakPolarHBondContact O-CB 3.31Å; H145-R149 PolarHBondContact O-N 3.42Å; S146-R149 PolarHBondContact O-N 2.72Å; S147-R149 VanDerWaalsContact C-N 3.3Å; S147-R149 PolarHBondContact O-N 3Å; R149-A152 PolarHBondContact O-N 3.14Å; R149-Q153 WeakPolarHBondContact O-CG 3.04Å; R149-Q153 PolarHBondContact O-N 3.45Å; R149-Q153 VanDerWaalsContact O-N 3.11Å
150L94.6Very high92.3Very high106 Ų10654 Ų5456%0.55529%0.29SS*.Hα-helixtrans-67.2-40.1176.9-69.3171.6000111.7S146 S147 Q153 T154S146-L150 WeakPolarHBondContact O-CG 3.18Å; S146-L150 PolarHBondContact O-N 3.03Å; S146-L150 VanDerWaalsContact O-N 3.11Å; S147-L150 PolarHBondContact O-N 3.05Å; L150-Q153 PolarHBondContact O-N 3.28Å; L150-T154 PolarHBondContact O-N 2.94Å; L150-T154 VanDerWaalsContact O-N 3.11Å; L150-T154 PolarHBondContact O-OG1 3.46Å
151L95Very high92.7Very high43 Ų4352.5 Ų52.523%0.22529%0.289CS..Hα-helixtrans-62.2-47.4174.9-177.264000110.7S147 T148 Q153 T154 T155 L183 A186 T187 W190S147-L151 WeakPolarHBondContact O-CB 3.43Å; S147-L151 PolarHBondContact O-N 3.19Å; T148-L151 PolarHBondContact O-N 2.76Å; L151-Q153 VanDerWaalsContact C-N 3.31Å; L151-Q153 PolarHBondContact O-N 2.93Å; L151-T154 PolarHBondContact O-N 2.97Å; L151-T155 PolarHBondContact O-N 2.81Å; L151-T155 PolarHBondContact O-OG1 3.08Å; L151-T155 VanDerWaalsContact O-OG1 3.04Å; L151-L183 HydrophobicContact CB-CD2 4.48Å; L151-L183 HydrophobicContact CD2-CD2 4.11Å; L151-L183 HydrophobicContact CG-CD2 3.83Å; L151-A186 HydrophobicContact CD1-CB 4.46Å; L151-A186 HydrophobicContact CD2-CB 3.7Å; L151-T187 HydrophobicContact CD2-CG2 3.73Å; L151-W190 HydrophobicContact CB-CH2 4.43Å; L151-W190 HydrophobicContact CD2-CH2 3.85Å; L151-W190 HydrophobicContact CD2-CZ3 3.86Å
152A95.6Very high93Very high0 Ų056 Ų560%031%0.311CS..Hα-helixtrans-56.4-41.917600000112.9F106 I108 V127 T148 R149 T154 L156 M179 L183F106-A152 HydrophobicContact CE2-CB 4.06Å; F106-A152 HydrophobicContact CZ-CB 4.09Å; I108-A152 HydrophobicContact CD1-CB 3.92Å; I108-A152 HydrophobicContact CG1-CB 4.09Å; V127-A152 HydrophobicContact CG2-CB 4.15Å; T148-A152 VanDerWaalsContact O-CB 3.28Å; T148-A152 WeakPolarHBondContact O-CB 3.14Å; T148-A152 PolarHBondContact O-N 3.27Å; R149-A152 PolarHBondContact O-N 3.14Å; A152-T154 VanDerWaalsContact C-N 3.34Å; A152-T154 PolarHBondContact O-N 2.96Å; A152-L156 WeakPolarHBondContact O-CB 3.21Å; A152-L156 PolarHBondContact O-N 3.04Å; A152-M179 HydrophobicContact CB-CE 4.46Å; A152-L183 HydrophobicContact CB-CD1 4.18Å; A152-L183 HydrophobicContact CB-CD2 4.22Å
153Q95.3Very high93.4Very high38 Ų3853.1 Ų53.118%0.17828%0.284CS..Hα-helixtrans-61.4-42.5174.3-72169.5-1.600112.4I108 R149 L150 L151 R157I108-Q153 HydrophobicContact CG2-CG 3.83Å; R149-Q153 WeakPolarHBondContact O-CG 3.04Å; R149-Q153 PolarHBondContact O-N 3.45Å; R149-Q153 VanDerWaalsContact O-N 3.11Å; L150-Q153 PolarHBondContact O-N 3.28Å; L151-Q153 VanDerWaalsContact C-N 3.31Å; L151-Q153 PolarHBondContact O-N 2.93Å; Q153-R157 PolarHBondContact O-N 2.82Å; Q153-R157 VanDerWaalsContact O-N 3.1Å
154T95.3Very high93.8Very high72 Ų7250.2 Ų50.244%0.44227%0.269SS..Hα-helixtrans-70.2-44.4-178.7-52.80000110.9L150 L151 A152 R157 N158L150-T154 PolarHBondContact O-N 2.94Å; L150-T154 VanDerWaalsContact O-N 3.11Å; L150-T154 PolarHBondContact O-OG1 3.46Å; L151-T154 PolarHBondContact O-N 2.97Å; A152-T154 VanDerWaalsContact C-N 3.34Å; A152-T154 PolarHBondContact O-N 2.96Å; T154-R157 PolarHBondContact O-N 2.87Å; T154-N158 PolarHBondContact O-N 3.42Å; T154-N158 PolarHBondContact O-ND2 3.33Å; T154-N158 PolarHBondContact O-OD1 3.27Å
155T95.6Very high94Very high15 Ų1550.4 Ų50.49%0.09227%0.268CS..Hα-helixtrans-63.6-43.7176.3-51.70000111.4L151 R157 N158 V159 M179 A182 L183L151-T155 PolarHBondContact O-N 2.81Å; L151-T155 PolarHBondContact O-OG1 3.08Å; L151-T155 VanDerWaalsContact O-OG1 3.04Å; T155-R157 VanDerWaalsContact C-N 3.31Å; T155-R157 PolarHBondContact O-N 3.41Å; T155-N158 PolarHBondContact O-N 2.93Å; T155-V159 HydrophobicContact CG2-CG2 4.08Å; T155-V159 WeakPolarHBondContact O-CG2 3.21Å; T155-V159 PolarHBondContact O-N 3.03Å; T155-M179 HydrophobicContact CG2-CG 4.18Å; T155-A182 HydrophobicContact CG2-CB 3.79Å; T155-L183 HydrophobicContact CG2-CD2 4.49Å; T155-L183 HydrophobicContact CG2-CG 4.21Å
156L94.8Very high94Very high2 Ų248.6 Ų48.61%0.0127%0.271CS..Hα-helixtrans-55.8-47.8175.2-174.773.3000110.7I108 Q111 A152 N158 L160 M179I108-L156 HydrophobicContact CD1-CD2 4.47Å; I108-L156 HydrophobicContact CG2-CD2 3.91Å; Q111-L156 HydrophobicContact CG-CD2 4.38Å; A152-L156 WeakPolarHBondContact O-CB 3.21Å; A152-L156 PolarHBondContact O-N 3.04Å; L156-N158 PolarHBondContact O-N 3.15Å; L156-L160 HydrophobicContact CD1-CD1 3.6Å; L156-L160 HydrophobicContact CD1-CG 4.17Å; L156-L160 HydrophobicContact CD2-CD1 4.41Å; L156-L160 HydrophobicContact CG-CD1 3.64Å; L156-L160 HydrophobicContact CG-CG 4.4Å; L156-L160 VanDerWaalsContact O-CB 3.26Å; L156-L160 WeakPolarHBondContact O-CB 3.43Å; L156-L160 WeakPolarHBondContact O-CG 3.31Å; L156-L160 PolarHBondContact O-N 3.07Å; L156-M179 HydrophobicContact CB-CE 3.87Å; L156-M179 HydrophobicContact CB-SD 4.13Å; L156-M179 HydrophobicContact CD1-CE 4.02Å; L156-M179 HydrophobicContact CD1-SD 3.54Å; L156-M179 VanDerWaalsContact CD1-SD 3.54Å; L156-M179 HydrophobicContact CG-SD 4.47Å
157R94.5Very high94Very high127 Ų12749 Ų4948%0.47927%0.265SS..Hα-helixtrans-61.5-44.2177.7-177178.2-62.7162.73.5112.3I113 Q153 T154 T155 G161I113-R157 HydrophobicContact CG2-CB 4.27Å; I113-R157 HydrophobicContact CG2-CG 3.91Å; Q153-R157 PolarHBondContact O-N 2.82Å; Q153-R157 VanDerWaalsContact O-N 3.1Å; T154-R157 PolarHBondContact O-N 2.87Å; T155-R157 VanDerWaalsContact C-N 3.31Å; T155-R157 PolarHBondContact O-N 3.41Å; R157-G161 PolarHBondContact O-N 2.9Å
158N94Very high94Very high102 Ų10247.6 Ų47.655%0.54526%0.255SS..Hα-helixtrans-67.5-48.2-177.7-69.1-13.7000111.8T154 T155 L156 G161 T162T154-N158 PolarHBondContact O-N 3.42Å; T154-N158 PolarHBondContact O-ND2 3.33Å; T154-N158 PolarHBondContact O-OD1 3.27Å; T155-N158 PolarHBondContact O-N 2.93Å; L156-N158 PolarHBondContact O-N 3.15Å; N158-G161 PolarHBondContact O-N 3.07Å; N158-T162 PolarHBondContact O-N 2.76Å
159V93.9Very high93.8Very high17 Ų1750.7 Ų50.710%0.10327%0.271CS..Hα-helixtrans-64.4-50.4-179.2174.80000110.1T155 G161 T162 K163 I175T155-V159 HydrophobicContact CG2-CG2 4.08Å; T155-V159 WeakPolarHBondContact O-CG2 3.21Å; T155-V159 PolarHBondContact O-N 3.03Å; V159-G161 VanDerWaalsContact C-N 3.28Å; V159-G161 PolarHBondContact O-N 3.23Å; V159-T162 PolarHBondContact O-N 2.88Å; V159-T162 VanDerWaalsContact O-N 3.08Å; V159-T162 PolarHBondContact O-OG1 3.37Å; V159-K163 WeakPolarHBondContact O-CG 3.35Å; V159-I175 HydrophobicContact CG1-CG2 3.92Å
160L93.3Very high93.6Very high2 Ų251.4 Ų51.41%0.0129%0.29CS..Hα-helixtrans-67.1-28.7-177.7-63.6176.1000112.9I113 V123 L156 T162 K163 L168 I175I113-L160 HydrophobicContact CD1-CB 3.15Å; I113-L160 HydrophobicContact CD1-CD1 3.37Å; I113-L160 HydrophobicContact CD1-CG 3.88Å; V123-L160 HydrophobicContact CB-CD1 3.8Å; V123-L160 HydrophobicContact CG1-CD1 3.82Å; V123-L160 HydrophobicContact CG2-CD1 3.95Å; L156-L160 HydrophobicContact CD1-CD1 3.6Å; L156-L160 HydrophobicContact CD1-CG 4.17Å; L156-L160 HydrophobicContact CD2-CD1 4.41Å; L156-L160 HydrophobicContact CG-CD1 3.64Å; L156-L160 HydrophobicContact CG-CG 4.4Å; L156-L160 VanDerWaalsContact O-CB 3.26Å; L156-L160 WeakPolarHBondContact O-CB 3.43Å; L156-L160 WeakPolarHBondContact O-CG 3.31Å; L156-L160 PolarHBondContact O-N 3.07Å; L160-T162 PolarHBondContact O-N 3.07Å; L160-K163 PolarHBondContact O-N 2.94Å; L160-L168 HydrophobicContact CD2-CD1 4.3Å; L160-L168 HydrophobicContact CD2-CD2 3.29Å; L160-L168 HydrophobicContact CD2-CG 4.42Å; L160-I175 HydrophobicContact CD2-CG2 3.94Å
161G93.6Very high93.5Very high32 Ų3250.1 Ų50.133%0.3328%0.283SS..Hα-helixtrans-65.3-23.9173.400000113.9R157 N158 V159R157-G161 PolarHBondContact O-N 2.9Å; N158-G161 PolarHBondContact O-N 3.07Å; V159-G161 VanDerWaalsContact C-N 3.28Å; V159-G161 PolarHBondContact O-N 3.23Å
162T93.8Very high93.3Very high92 Ų9253 Ų5356%0.56429%0.291SS*.Hα-helixtrans-88.2-10.9176.466.80000113.8K116 N158 V159 L160K116-T162 WeakPolarHBondContact CD-O 3.43Å; N158-T162 PolarHBondContact O-N 2.76Å; V159-T162 PolarHBondContact O-N 2.88Å; V159-T162 VanDerWaalsContact O-N 3.08Å; V159-T162 PolarHBondContact O-OG1 3.37Å; L160-T162 PolarHBondContact O-N 3.07Å
163K94.4Very high93.1Very high55 Ų5559.8 Ų59.824%0.23932%0.323CS..SBendtrans-101.5151-173.5-64.4-70.7178.2174.80112K116 V159 L160 E167 L168 I175K116-K163 WeakPolarHBondContact CB-O 3.31Å; K116-K163 PolarHBondContact N-O 3.18Å; K116-K163 VanDerWaalsContact N-O 3.11Å; V159-K163 WeakPolarHBondContact O-CG 3.35Å; L160-K163 PolarHBondContact O-N 2.94Å; K163-E167 WeakPolarHBondContact CD-OE2 3.13Å; K163-L168 HydrophobicContact CB-CD2 3.75Å; K163-I175 HydrophobicContact CD-CG1 4.47Å; K163-I175 HydrophobicContact CG-CG1 4.38Å
164N95Very high93Very high43 Ų4359.3 Ų59.323%0.2333%0.328CS..  trans-84.6155.8176.9-74.613.4000110.8K116 D117 A166 E167 L168K116-N164 WeakPolarHBondContact CB-OD1 3.34Å; K116-N164 VanDerWaalsContact CD-OD1 3.31Å; K116-N164 WeakPolarHBondContact CD-OD1 3.09Å; K116-N164 WeakPolarHBondContact CG-OD1 3.36Å; D117-N164 VanDerWaalsContact OD1-CG 3.31Å; D117-N164 PolarHBondContact OD1-ND2 3.49Å; D117-N164 PolarHBondContact OD1-OD1 3.41Å; D117-N164 WeakPolarHBondContact OD2-CA 3.42Å; D117-N164 WeakPolarHBondContact OD2-CB 3.38Å; N164-A166 VanDerWaalsContact C-N 3.28Å; N164-A166 PolarHBondContact O-N 3.43Å; N164-E167 HydrophobicContact CB-CG 4.22Å; N164-E167 WeakPolarHBondContact O-CB 3.48Å; N164-E167 PolarHBondContact O-N 2.95Å; N164-E167 VanDerWaalsContact O-N 3.14Å; N164-L168 WeakPolarHBondContact O-CG 3.38Å; N164-L168 PolarHBondContact O-N 2.91Å; N164-L168 VanDerWaalsContact O-N 3.07Å
165L92.3Very high92.9Very high14 Ų1456 Ų567%0.07331%0.308CS..Hα-helixtrans-60-40-179.7173.763000112.1D117 V119 V121 E167 L168 L169 L204 L208 M212D117-L165 PolarHBondContact OD2-N 3.38Å; V119-L165 HydrophobicContact CB-CD2 4.5Å; V119-L165 HydrophobicContact CG1-CD2 4.18Å; V119-L165 HydrophobicContact CG2-CD2 4.29Å; V121-L165 HydrophobicContact CG1-CD1 3.92Å; L165-E167 VanDerWaalsContact C-N 3.29Å; L165-E167 PolarHBondContact O-N 3.39Å; L165-L168 PolarHBondContact O-N 2.89Å; L165-L169 HydrophobicContact CD1-CD1 4.23Å; L165-L169 HydrophobicContact CD1-CG 4.32Å; L165-L169 HydrophobicContact CG-CD1 4.3Å; L165-L169 WeakPolarHBondContact O-CG 3.41Å; L165-L169 PolarHBondContact O-N 2.88Å; L165-L204 HydrophobicContact CD1-CD2 3.76Å; L165-L204 HydrophobicContact CD2-CD2 3.96Å; L165-L208 HydrophobicContact CD2-CD2 4.49Å; L165-M212 HydrophobicContact CD2-CE 3.92Å; L165-M212 HydrophobicContact CD2-SD 3.9Å
166A91.1Very high92.9Very high65 Ų6555.7 Ų55.754%0.53731%0.307SS..Hα-helixtrans-63.1-3717900000112.2N164 L169 S170N164-A166 VanDerWaalsContact C-N 3.28Å; N164-A166 PolarHBondContact O-N 3.43Å; A166-L169 PolarHBondContact O-N 3.37Å; A166-S170 VanDerWaalsContact O-CB 3.32Å; A166-S170 WeakPolarHBondContact O-CB 3.46Å; A166-S170 PolarHBondContact O-N 3.3Å; A166-S170 PolarHBondContact O-OG 3.17Å
167E92.2Very high92.9Very high79 Ų7958.4 Ų58.437%0.36932%0.323SS..Hα-helixtrans-68.1-41.9175.7-65.3177.5179.100110.8K163 N164 L165 L169 S170 D171K163-E167 WeakPolarHBondContact CD-OE2 3.13Å; N164-E167 HydrophobicContact CB-CG 4.22Å; N164-E167 WeakPolarHBondContact O-CB 3.48Å; N164-E167 PolarHBondContact O-N 2.95Å; N164-E167 VanDerWaalsContact O-N 3.14Å; L165-E167 VanDerWaalsContact C-N 3.29Å; L165-E167 PolarHBondContact O-N 3.39Å; E167-L169 PolarHBondContact O-N 3.09Å; E167-S170 PolarHBondContact O-N 3.09Å; E167-D171 CarbonylContact O-C 3.42Å; E167-D171 WeakPolarHBondContact O-CA 3.11Å; E167-D171 PolarHBondContact O-N 2.8Å
168L91.8Very high92.9Very high4 Ų454.6 Ų54.62%0.02132%0.316CS..Hα-helixtrans-59-31.8175.7-61-168.8000113.2T115 V121 L160 K163 N164 L165 R172 I175T115-L168 HydrophobicContact CG2-CD1 3.57Å; V121-L168 HydrophobicContact CG2-CD1 4.15Å; L160-L168 HydrophobicContact CD2-CD1 4.3Å; L160-L168 HydrophobicContact CD2-CD2 3.29Å; L160-L168 HydrophobicContact CD2-CG 4.42Å; K163-L168 HydrophobicContact CB-CD2 3.75Å; N164-L168 WeakPolarHBondContact O-CG 3.38Å; N164-L168 PolarHBondContact O-N 2.91Å; N164-L168 VanDerWaalsContact O-N 3.07Å; L165-L168 PolarHBondContact O-N 2.89Å; L168-R172 VanDerWaalsContact O-CG 3.27Å; L168-R172 WeakPolarHBondContact O-CG 3.38Å; L168-I175 HydrophobicContact CD2-CD1 3.41Å; L168-I175 VanDerWaalsContact CD2-CD1 3.41Å
169L89.2Confident92.9Very high65 Ų6549.9 Ų49.934%0.3429%0.291SS..Hα-helixtrans-87.1-31.8-179.7-65.9176.2000112.9L165 A166 E167 M212L165-L169 HydrophobicContact CD1-CD1 4.23Å; L165-L169 HydrophobicContact CD1-CG 4.32Å; L165-L169 HydrophobicContact CG-CD1 4.3Å; L165-L169 WeakPolarHBondContact O-CG 3.41Å; L165-L169 PolarHBondContact O-N 2.88Å; A166-L169 PolarHBondContact O-N 3.37Å; E167-L169 PolarHBondContact O-N 3.09Å; L169-M212 HydrophobicContact CD1-CE 4.49Å
170S90.3Very high93Very high106 Ų10651.8 Ų51.874%0.74130%0.299SS*.Hα-helixtrans-100.8-38.2-171.6-47.30000113.6A166 E167A166-S170 VanDerWaalsContact O-CB 3.32Å; A166-S170 WeakPolarHBondContact O-CB 3.46Å; A166-S170 PolarHBondContact O-N 3.3Å; A166-S170 PolarHBondContact O-OG 3.17Å; E167-S170 PolarHBondContact O-N 3.09Å
171D92.5Very high93.1Very high79 Ų7957.6 Ų57.642%0.42233%0.326SS..  trans-119.359.5-173-173.122.3000111.7E167 E173 G174 I175E167-D171 CarbonylContact O-C 3.42Å; E167-D171 WeakPolarHBondContact O-CA 3.11Å; E167-D171 PolarHBondContact O-N 2.8Å; D171-E173 VanDerWaalsContact C-N 3.27Å; D171-E173 PolarHBondContact O-N 2.96Å; D171-G174 PolarHBondContact OD1-N 3.31Å; D171-I175 WeakPolarHBondContact O-CD1 3.28Å; D171-I175 WeakPolarHBondContact O-CG1 3.17Å; D171-I175 PolarHBondContact O-N 3.18Å
172R90.8Very high93.2Very high103 Ų10358 Ų5839%0.38933%0.325SS..Hα-helixtrans-66.5-31.7177.9-66.5-179.4-175.8177.71.7112.5L168 S176L168-R172 VanDerWaalsContact O-CG 3.27Å; L168-R172 WeakPolarHBondContact O-CG 3.38Å; R172-S176 WeakPolarHBondContact O-CB 3.43Å; R172-S176 PolarHBondContact O-N 3.34Å; R172-S176 PolarHBondContact O-OG 3.32Å
173E91.5Very high93.3Very high143 Ų14353.6 Ų53.667%0.66830%0.298SS*.Hα-helixtrans-67-48-180-165.168.9-163.900110.6D171 I175 S176 V177D171-E173 VanDerWaalsContact C-N 3.27Å; D171-E173 PolarHBondContact O-N 2.96Å; E173-I175 VanDerWaalsContact C-N 3.28Å; E173-I175 PolarHBondContact O-N 3.48Å; E173-S176 WeakPolarHBondContact O-CB 3.16Å; E173-S176 PolarHBondContact O-N 3.39Å; E173-S176 VanDerWaalsContact O-N 3.09Å; E173-V177 WeakPolarHBondContact O-CG2 3.49Å; E173-V177 PolarHBondContact O-N 3.02Å
174G93.1Very high93.3Very high28 Ų2852.1 Ų52.129%0.28929%0.293SS..Hα-helixtrans-60.3-37.2178.800000113.2D171 S178D171-G174 PolarHBondContact OD1-N 3.31Å; G174-S178 WeakPolarHBondContact O-CB 3.38Å; G174-S178 PolarHBondContact O-N 2.89Å; G174-S178 VanDerWaalsContact O-N 3.09Å
175I94Very high93.3Very high2 Ų257.2 Ų57.21%0.0132%0.316CS..Hα-helixtrans-69.3-40.9175.7-59.3160.9000110.9V159 L160 K163 L168 D171 E173 S178 M179 I199V159-I175 HydrophobicContact CG1-CG2 3.92Å; L160-I175 HydrophobicContact CD2-CG2 3.94Å; K163-I175 HydrophobicContact CD-CG1 4.47Å; K163-I175 HydrophobicContact CG-CG1 4.38Å; L168-I175 HydrophobicContact CD2-CD1 3.41Å; L168-I175 VanDerWaalsContact CD2-CD1 3.41Å; D171-I175 WeakPolarHBondContact O-CD1 3.28Å; D171-I175 WeakPolarHBondContact O-CG1 3.17Å; D171-I175 PolarHBondContact O-N 3.18Å; E173-I175 VanDerWaalsContact C-N 3.28Å; E173-I175 PolarHBondContact O-N 3.48Å; I175-S178 PolarHBondContact O-N 3.3Å; I175-M179 WeakPolarHBondContact O-CB 3.44Å; I175-M179 PolarHBondContact O-N 3.1Å; I175-I199 HydrophobicContact CB-CD1 3.89Å; I175-I199 HydrophobicContact CG2-CD1 3.69Å
176S94.3Very high93.3Very high10 Ų1058.5 Ų58.57%0.0733%0.329CS..Hα-helixtrans-62.6-43.1179.2-62.50000111.6R172 E173 M179 Q180 V197R172-S176 WeakPolarHBondContact O-CB 3.43Å; R172-S176 PolarHBondContact O-N 3.34Å; R172-S176 PolarHBondContact O-OG 3.32Å; E173-S176 WeakPolarHBondContact O-CB 3.16Å; E173-S176 PolarHBondContact O-N 3.39Å; E173-S176 VanDerWaalsContact O-N 3.09Å; S176-M179 PolarHBondContact O-N 3.48Å; S176-Q180 WeakPolarHBondContact O-CB 3.26Å; S176-Q180 PolarHBondContact O-N 3.03Å; S176-V197 VanDerWaalsContact CB-O 3.31Å; S176-V197 WeakPolarHBondContact CB-O 3.33Å
177V94.9Very high93.4Very high59 Ų5955.4 Ų55.436%0.35830%0.303SS..Hα-helixtrans-64.1-481751750000111.2E173 M179 Q180 E181E173-V177 WeakPolarHBondContact O-CG2 3.49Å; E173-V177 PolarHBondContact O-N 3.02Å; V177-M179 VanDerWaalsContact C-N 3.28Å; V177-M179 PolarHBondContact O-N 3.32Å; V177-Q180 WeakPolarHBondContact O-CB 3.42Å; V177-Q180 PolarHBondContact O-N 3.36Å; V177-Q180 VanDerWaalsContact O-N 3.12Å; V177-E181 WeakPolarHBondContact O-CG 3.49Å; V177-E181 PolarHBondContact O-N 3.35Å
178S94.4Very high93.4Very high47 Ų4755.4 Ų55.433%0.32931%0.305SS..Hα-helixtrans-60.8-37.8178.6-179.70000112.4G174 I175 A182G174-S178 WeakPolarHBondContact O-CB 3.38Å; G174-S178 PolarHBondContact O-N 2.89Å; G174-S178 VanDerWaalsContact O-N 3.09Å; I175-S178 PolarHBondContact O-N 3.3Å; S178-A182 WeakPolarHBondContact O-CB 3.43Å; S178-A182 PolarHBondContact O-N 3.45Å
179M95.3Very high93.3Very high2 Ų258.8 Ų58.81%0.0133%0.328CS..Hα-helixtrans-71.7-36.5175.6-176.6170.8166.100112.4I108 A152 T155 L156 I175 S176 V177 L183 V197I108-M179 HydrophobicContact CD1-CE 3.57Å; A152-M179 HydrophobicContact CB-CE 4.46Å; T155-M179 HydrophobicContact CG2-CG 4.18Å; L156-M179 HydrophobicContact CB-CE 3.87Å; L156-M179 HydrophobicContact CB-SD 4.13Å; L156-M179 HydrophobicContact CD1-CE 4.02Å; L156-M179 HydrophobicContact CD1-SD 3.54Å; L156-M179 VanDerWaalsContact CD1-SD 3.54Å; L156-M179 HydrophobicContact CG-SD 4.47Å; I175-M179 WeakPolarHBondContact O-CB 3.44Å; I175-M179 PolarHBondContact O-N 3.1Å; S176-M179 PolarHBondContact O-N 3.48Å; V177-M179 VanDerWaalsContact C-N 3.28Å; V177-M179 PolarHBondContact O-N 3.32Å; M179-L183 HydrophobicContact CE-CD1 3.65Å; M179-L183 HydrophobicContact CG-CD1 3.94Å; M179-L183 HydrophobicContact CG-CG 4.47Å; M179-L183 WeakPolarHBondContact O-CB 3.24Å; M179-L183 WeakPolarHBondContact O-CG 3.36Å; M179-L183 PolarHBondContact O-N 3.24Å; M179-V197 HydrophobicContact CB-CG1 4.47Å; M179-V197 HydrophobicContact CE-CG1 3.92Å; M179-V197 HydrophobicContact CG-CG1 4.07Å; M179-V197 HydrophobicContact CG-CG2 4.44Å; M179-V197 HydrophobicContact SD-CG1 3.74Å
180Q96Very high93.4Very high58 Ų5858.3 Ų58.327%0.27132%0.321SS..Hα-helixtrans-59.9-51.1173.7177.4-172.2-29.100110.6S176 V177 A182 L183 D184 V194 E195 V197S176-Q180 WeakPolarHBondContact O-CB 3.26Å; S176-Q180 PolarHBondContact O-N 3.03Å; V177-Q180 WeakPolarHBondContact O-CB 3.42Å; V177-Q180 PolarHBondContact O-N 3.36Å; V177-Q180 VanDerWaalsContact O-N 3.12Å; Q180-A182 PolarHBondContact O-N 3.11Å; Q180-L183 PolarHBondContact O-N 3.18Å; Q180-D184 VanDerWaalsContact O-CB 3.23Å; Q180-D184 WeakPolarHBondContact O-CB 3.35Å; Q180-D184 PolarHBondContact O-N 3.31Å; Q180-V194 HydrophobicContact CG-CG1 4.24Å; Q180-E195 PolarHBondContact NE2-O 3.33Å; Q180-V197 HydrophobicContact CB-CG2 4.09Å
181E95.4Very high93.3Very high124 Ų12453.5 Ų53.558%0.57929%0.289SS*.Hα-helixtrans-58.1-48.1179.8-70.6175172.700111.6V177 L183 D184 E185V177-E181 WeakPolarHBondContact O-CG 3.49Å; V177-E181 PolarHBondContact O-N 3.35Å; E181-L183 VanDerWaalsContact C-N 3.32Å; E181-L183 PolarHBondContact O-N 2.76Å; E181-D184 PolarHBondContact O-N 3.47Å; E181-E185 PolarHBondContact O-N 3.42Å
182A95.1Very high93.4Very high39 Ų3949.8 Ų49.832%0.32227%0.269SS..Hα-helixtrans-64.5-34.5179.400000113.2T155 S178 Q180 A186T155-A182 HydrophobicContact CG2-CB 3.79Å; S178-A182 WeakPolarHBondContact O-CB 3.43Å; S178-A182 PolarHBondContact O-N 3.45Å; Q180-A182 PolarHBondContact O-N 3.11Å; A182-A186 WeakPolarHBondContact O-CB 3.47Å; A182-A186 PolarHBondContact O-N 2.88Å
183L95.4Very high93.5Very high0 Ų048.4 Ų48.40%027%0.266CS..Hα-helixtrans-77.2-39.4176.5-78.4171.7000112.5V127 L151 A152 T155 M179 Q180 E181 A186 T187 V194 V197V127-L183 HydrophobicContact CG2-CD1 4.31Å; L151-L183 HydrophobicContact CB-CD2 4.48Å; L151-L183 HydrophobicContact CD2-CD2 4.11Å; L151-L183 HydrophobicContact CG-CD2 3.83Å; A152-L183 HydrophobicContact CB-CD1 4.18Å; A152-L183 HydrophobicContact CB-CD2 4.22Å; T155-L183 HydrophobicContact CG2-CD2 4.49Å; T155-L183 HydrophobicContact CG2-CG 4.21Å; M179-L183 HydrophobicContact CE-CD1 3.65Å; M179-L183 HydrophobicContact CG-CD1 3.94Å; M179-L183 HydrophobicContact CG-CG 4.47Å; M179-L183 WeakPolarHBondContact O-CB 3.24Å; M179-L183 WeakPolarHBondContact O-CG 3.36Å; M179-L183 PolarHBondContact O-N 3.24Å; Q180-L183 PolarHBondContact O-N 3.18Å; E181-L183 VanDerWaalsContact C-N 3.32Å; E181-L183 PolarHBondContact O-N 2.76Å; L183-A186 PolarHBondContact O-N 3.08Å; L183-T187 VanDerWaalsContact O-CB 3.31Å; L183-T187 WeakPolarHBondContact O-CB 3.31Å; L183-T187 WeakPolarHBondContact O-CG2 3.5Å; L183-T187 PolarHBondContact O-N 3.47Å; L183-T187 PolarHBondContact O-OG1 3.16Å; L183-V194 HydrophobicContact CB-CG2 4.1Å; L183-V197 HydrophobicContact CD1-CG2 4.04Å
184D95.1Very high93.7Very high24 Ų2441.7 Ų41.713%0.12824%0.235CC..Hα-helixtrans-61.7-50179.3-166.250.6000110.3Q180 E181 A186 T187 D188 K193 V194Q180-D184 VanDerWaalsContact O-CB 3.23Å; Q180-D184 WeakPolarHBondContact O-CB 3.35Å; Q180-D184 PolarHBondContact O-N 3.31Å; E181-D184 PolarHBondContact O-N 3.47Å; D184-A186 VanDerWaalsContact C-N 3.31Å; D184-A186 PolarHBondContact O-N 3.07Å; D184-T187 PolarHBondContact O-N 3.15Å; D184-T187 VanDerWaalsContact O-N 3.11Å; D184-T187 PolarHBondContact O-OG1 2.96Å; D184-D188 VanDerWaalsContact O-CG 3.31Å; D184-D188 PolarHBondContact O-N 2.92Å; D184-K193 VanDerWaalsContact OD1-CD 3.31Å; D184-K193 WeakPolarHBondContact OD1-CD 3.36Å; D184-K193 WeakPolarHBondContact OD1-CE 3.44Å; D184-K193 IonicContact OD1-NZ 3.66Å; D184-K193 PolarHBondContact OD1-NZ 2.86Å; D184-K193 VanDerWaalsContact OD1-NZ 3.14Å; D184-K193 WeakPolarHBondContact OD2-CE 3.4Å; D184-K193 IonicContact OD2-NZ 3.42Å; D184-K193 PolarHBondContact OD2-NZ 3.29Å; D184-V194 HydrophobicContact CB-CB 4.28Å; D184-V194 PolarHBondContact OD1-N 3.35Å; D184-V194 VanDerWaalsContact OD1-N 3.16Å
185E94.2Very high93.7Very high151 Ų15143.1 Ų43.171%0.70623%0.234SC*.Hα-helixtrans-57.4-42.4177.4-176.3179.6-176.500112.5E181E181-E185 PolarHBondContact O-N 3.42Å
186A92.8Very high93.7Very high41 Ų4148.2 Ų48.234%0.33925%0.253SS..Hα-helixtrans-76.6-23-17900000113.6L151 A182 L183 D184L151-A186 HydrophobicContact CD1-CB 4.46Å; L151-A186 HydrophobicContact CD2-CB 3.7Å; A182-A186 WeakPolarHBondContact O-CB 3.47Å; A182-A186 PolarHBondContact O-N 2.88Å; L183-A186 PolarHBondContact O-N 3.08Å; D184-A186 VanDerWaalsContact C-N 3.31Å; D184-A186 PolarHBondContact O-N 3.07Å
187T93.3Very high93.8Very high0 Ų048 Ų480%025%0.251CS..Hα-helixtrans-99.1-12.7-177.859.70000114T148 L151 L183 D184 P189 W190 G191 I192T148-T187 HydrophobicContact CG2-CG2 4.04Å; L151-T187 HydrophobicContact CD2-CG2 3.73Å; L183-T187 VanDerWaalsContact O-CB 3.31Å; L183-T187 WeakPolarHBondContact O-CB 3.31Å; L183-T187 WeakPolarHBondContact O-CG2 3.5Å; L183-T187 PolarHBondContact O-N 3.47Å; L183-T187 PolarHBondContact O-OG1 3.16Å; D184-T187 PolarHBondContact O-N 3.15Å; D184-T187 VanDerWaalsContact O-N 3.11Å; D184-T187 PolarHBondContact O-OG1 2.96Å; T187-P189 VanDerWaalsContact C-CD 3.47Å; T187-W190 HydrophobicContact CG2-CE3 3.93Å; T187-W190 HydrophobicContact CG2-CZ3 3.96Å; T187-W190 WeakPolarHBondContact O-CA 3.26Å; T187-W190 WeakPolarHBondContact O-CB 3.22Å; T187-W190 PolarHBondContact O-N 3.45Å; T187-G191 PolarHBondContact O-N 3Å; T187-I192 PolarHBondContact O-N 2.94Å
188D91.5Very high93.8Very high78 Ų7849 Ų4942%0.41725%0.252SS..G310 helixtrans-51.4-44.2174.2-87.7-22.9000113.8D184 W190 G191D184-D188 VanDerWaalsContact O-CG 3.31Å; D184-D188 PolarHBondContact O-N 2.92Å; D188-W190 PolarHBondContact O-N 2.83Å; D188-G191 PolarHBondContact O-N 3.31Å
189P89.8Confident93.7Very high76 Ų7647.9 Ų47.949%0.49424%0.242SC..G310 helixtrans-62.3-24.2176.7-23.234.5000113.5N140 T187 G191N140-P189 PolarHBondContact ND2-O 3.24Å; T187-P189 VanDerWaalsContact C-CD 3.47Å; P189-G191 VanDerWaalsContact C-N 3.29Å
190W91.5Very high93.6Very high54 Ų5453 Ų5321%0.20526%0.264CS..G310 helixtrans-86.3-2.5176.6-52.5-21.1000112.1S136 A137 V141 L151 T187 D188 I192S136-W190 CarbonylContact C-O 3.48Å; A137-W190 WeakPolarHBondContact CA-O 3.35Å; A137-W190 WeakPolarHBondContact CB-O 3.27Å; A137-W190 PolarHBondContact N-O 3.12Å; A137-W190 VanDerWaalsContact N-O 3.08Å; V141-W190 HydrophobicContact CG2-CB 4.41Å; V141-W190 HydrophobicContact CG2-CD2 3.73Å; V141-W190 HydrophobicContact CG2-CG 3.58Å; V141-W190 HydrophobicContact CG2-CZ2 4.32Å; V141-W190 VanDerWaalsContact CG2-NE1 3.29Å; L151-W190 HydrophobicContact CB-CH2 4.43Å; L151-W190 HydrophobicContact CD2-CH2 3.85Å; L151-W190 HydrophobicContact CD2-CZ3 3.86Å; T187-W190 HydrophobicContact CG2-CE3 3.93Å; T187-W190 HydrophobicContact CG2-CZ3 3.96Å; T187-W190 WeakPolarHBondContact O-CA 3.26Å; T187-W190 WeakPolarHBondContact O-CB 3.22Å; T187-W190 PolarHBondContact O-N 3.45Å; D188-W190 PolarHBondContact O-N 2.83Å; W190-I192 VanDerWaalsContact C-N 3.26Å; W190-I192 HydrophobicContact CB-CD1 4.49Å; W190-I192 PolarHBondContact O-N 3.01Å
191G89.3Confident93.3Very high6 Ų653.9 Ų53.96%0.06227%0.271CS..THydrogen-bonded Turntrans72.321.1-178.600000113.7H132 C133 T187 D188 P189H132-G191 PolarHBondContact N-O 3.2Å; C133-G191 PolarHBondContact N-O 3.37Å; T187-G191 PolarHBondContact O-N 3Å; D188-G191 PolarHBondContact O-N 3.31Å; P189-G191 VanDerWaalsContact C-N 3.29Å
192I93.3Very high93.1Very high1 Ų149.1 Ų49.11%0.00525%0.25CS..EExtended strand (participates in β ladder)trans-98.7136.5173.5-70.3170.2000108.2F129 I131 A144 T148 T187 W190F129-I192 HydrophobicContact CB-CG2 3.83Å; F129-I192 HydrophobicContact CD2-CD1 4.47Å; F129-I192 HydrophobicContact CD2-CG1 4.49Å; F129-I192 HydrophobicContact CD2-CG2 3.58Å; F129-I192 HydrophobicContact CG-CG2 4.04Å; I131-I192 HydrophobicContact CG1-CG1 4.31Å; A144-I192 HydrophobicContact CB-CD1 3.81Å; T148-I192 VanDerWaalsContact OG1-CD1 3.32Å; T148-I192 WeakPolarHBondContact OG1-CD1 3.23Å; T187-I192 PolarHBondContact O-N 2.94Å; W190-I192 VanDerWaalsContact C-N 3.26Å; W190-I192 HydrophobicContact CB-CD1 4.49Å; W190-I192 PolarHBondContact O-N 3.01Å
193K93.7Very high92.9Very high74 Ų7453 Ų5332%0.32226%0.26SS..EExtended strand (participates in β ladder)trans-109.8125.3170.8-171.776.3-162.3167.80109.1F129 R130 H132 D184F129-K193 CarbonylContact C-O 3.46Å; F129-K193 VanDerWaalsContact CA-O 3.24Å; F129-K193 WeakPolarHBondContact CA-O 3.3Å; F129-K193 WeakPolarHBondContact CB-O 3.34Å; R130-K193 HydrophobicContact CG-CB 4.29Å; R130-K193 PolarHBondContact N-O 3.11Å; R130-K193 PolarHBondContact O-N 3.02Å; H132-K193 HydrophobicContact CB-CB 4.29Å; D184-K193 VanDerWaalsContact OD1-CD 3.31Å; D184-K193 WeakPolarHBondContact OD1-CD 3.36Å; D184-K193 WeakPolarHBondContact OD1-CE 3.44Å; D184-K193 IonicContact OD1-NZ 3.66Å; D184-K193 PolarHBondContact OD1-NZ 2.86Å; D184-K193 VanDerWaalsContact OD1-NZ 3.14Å; D184-K193 WeakPolarHBondContact OD2-CE 3.4Å; D184-K193 IonicContact OD2-NZ 3.42Å; D184-K193 PolarHBondContact OD2-NZ 3.29Å
194V95.9Very high92.7Very high2 Ų254.6 Ų54.61%0.01227%0.268CS..EExtended strand (participates in β ladder)trans-87.9120.2175-176.50000108.4V127 F129 Q180 L183 D184 V197V127-V194 HydrophobicContact CG1-CG1 3.93Å; F129-V194 HydrophobicContact CB-CG2 4.38Å; Q180-V194 HydrophobicContact CG-CG1 4.24Å; L183-V194 HydrophobicContact CB-CG2 4.1Å; D184-V194 HydrophobicContact CB-CB 4.28Å; D184-V194 PolarHBondContact OD1-N 3.35Å; D184-V194 VanDerWaalsContact OD1-N 3.16Å; V194-V197 HydrophobicContact CG1-CG2 3.96Å
195E92.8Very high92.5Very high58 Ų5856 Ų5627%0.27128%0.278SS..EExtended strand (participates in β ladder)trans-87.5-42.8-176.8-63.4-167.4148.300111.9T103 Y128 R130 Q180T103-E195 WeakPolarHBondContact CG2-OE2 3.49Å; T103-E195 VanDerWaalsContact OG1-CD 3.29Å; T103-E195 PolarHBondContact OG1-OE1 3.45Å; T103-E195 PolarHBondContact OG1-OE2 2.89Å; Y128-E195 PolarHBondContact O-N 3.11Å; R130-E195 WeakPolarHBondContact CD-OE1 3.48Å; R130-E195 HydrophobicContact CG-CG 4.26Å; R130-E195 IonicContact NE-OE1 2.56Å; R130-E195 PolarHBondContact NE-OE1 3.46Å; Q180-E195 PolarHBondContact NE2-O 3.33Å
196R93.8Very high92.4Very high108 Ų10854.7 Ų54.741%0.40827%0.272SS..EExtended strand (participates in β ladder)trans-158.7154176.778.8-168.578.4-157.90.1110.6Y128 E198Y128-R196 HydrophobicContact CD2-CG 3.23Å; Y128-R196 HydrophobicContact CE2-CG 3.91Å; Y128-R196 HydrophobicContact CG-CG 3.78Å; Y128-R196 PolarHBondContact N-O 3.4Å; Y128-R196 PolarHBondContact O-N 3.04Å; R196-E198 VanDerWaalsContact CD-OE1 3.27Å; R196-E198 WeakPolarHBondContact CD-OE1 3.49Å; R196-E198 HydrophobicContact CG-CG 4.46Å
197V96.5Very high92.3Very high7 Ų761.2 Ų61.24%0.04230%0.296CS..EExtended strand (participates in β ladder)trans-121136.4168.3-178.90000107.2V127 S176 M179 Q180 L183 V194V127-V197 HydrophobicContact CG1-CG2 4.34Å; V127-V197 HydrophobicContact CG2-CG1 4.36Å; V127-V197 HydrophobicContact CG2-CG2 4.36Å; S176-V197 VanDerWaalsContact CB-O 3.31Å; S176-V197 WeakPolarHBondContact CB-O 3.33Å; M179-V197 HydrophobicContact CB-CG1 4.47Å; M179-V197 HydrophobicContact CE-CG1 3.92Å; M179-V197 HydrophobicContact CG-CG1 4.07Å; M179-V197 HydrophobicContact CG-CG2 4.44Å; M179-V197 HydrophobicContact SD-CG1 3.74Å; Q180-V197 HydrophobicContact CB-CG2 4.09Å; L183-V197 HydrophobicContact CD1-CG2 4.04Å; V194-V197 HydrophobicContact CG1-CG2 3.96Å
198E94.4Very high92.2Very high78 Ų7864.1 Ų64.136%0.36431%0.311SS..EExtended strand (participates in β ladder)trans-126.4125.2178.6-70.9174.2-177.100109.2G125 V126 Y128 R196G125-E198 CarbonylContact C-O 3.56Å; G125-E198 WeakPolarHBondContact CA-O 3.31Å; V126-E198 PolarHBondContact N-O 3.43Å; V126-E198 PolarHBondContact O-N 3.47Å; Y128-E198 HydrophobicContact CE2-CB 4.45Å; Y128-E198 HydrophobicContact CE2-CG 4.13Å; Y128-E198 WeakPolarHBondContact CE2-OE2 3.47Å; Y128-E198 PolarHBondContact OH-OE2 3.07Å; Y128-E198 VanDerWaalsContact OH-OE2 3.09Å; R196-E198 VanDerWaalsContact CD-OE1 3.27Å; R196-E198 WeakPolarHBondContact CD-OE1 3.49Å; R196-E198 HydrophobicContact CG-CG 4.46Å
199I93.5Very high92.1Very high24 Ų2465.6 Ų65.612%0.12332%0.315CS..EExtended strand (participates in β ladder)trans-77.9126.4170.6-57.1170.8000107.6V123 I175 V202V123-I199 HydrophobicContact CG1-CG2 3.8Å; I175-I199 HydrophobicContact CB-CD1 3.89Å; I175-I199 HydrophobicContact CG2-CD1 3.69Å; I199-V202 HydrophobicContact CG2-CG2 4.17Å
200K91.6Very high92.3Very high109 Ų10969.9 Ų69.947%0.47432%0.322SS..EExtended strand (participates in β ladder)trans-90.2-76.5-174.3-179.1-178.2-177.5179.50110.6D124D124-K200 PolarHBondContact O-N 3.41Å; D124-K200 WeakPolarHBondContact OD1-CB 3.49Å
201D89.6Confident92.4Very high78 Ų7870.1 Ų70.142%0.41734%0.335SS..EExtended strand (participates in β ladder)trans-124.1142.2-179.2-66.9-44.2000111.7V123 D124V123-D201 WeakPolarHBondContact CA-O 3.41Å; D124-D201 PolarHBondContact N-O 3.23Å; D124-D201 WeakPolarHBondContact OD1-CA 3.19Å; D124-D201 WeakPolarHBondContact OD1-CB 3.14Å; D124-D201 PolarHBondContact OD1-N 2.95Å
202V91.8Very high92.4Very high23 Ų2373 Ų7314%0.13935%0.348CS..EExtended strand (participates in β ladder)trans-116.1108169.5-179.10000107.8V121 V123 I199V121-V202 HydrophobicContact CB-CG1 4.3Å; V121-V202 HydrophobicContact CG1-CG1 4.47Å; V123-V202 HydrophobicContact CG1-CG2 4.25Å; V123-V202 HydrophobicContact CG2-CB 4.37Å; V123-V202 HydrophobicContact CG2-CG1 4.01Å; V123-V202 HydrophobicContact CG2-CG2 4.02Å; I199-V202 HydrophobicContact CG2-CG2 4.17Å
203K91.6Very high92.4Very high122 Ų12275.7 Ų75.753%0.5337%0.37SS..EExtended strand (participates in β ladder)trans-98.1127-179.6-67175.6-175.9168.10110S122S122-K203 PolarHBondContact N-O 3.32Å; S122-K203 PolarHBondContact O-N 3.06Å
204L91.6Very high92.4Very high33 Ų3375 Ų7517%0.17338%0.378CS..PPolyproline II helixtrans-101.1150.6176.4-66.8137.8000109.5V119 V121 L165 Q206 L208 Q209V119-L204 HydrophobicContact CG1-CD2 4.43Å; V121-L204 HydrophobicContact CG1-CD2 3.91Å; L165-L204 HydrophobicContact CD1-CD2 3.76Å; L165-L204 HydrophobicContact CD2-CD2 3.96Å; L204-Q206 PolarHBondContact O-N 2.94Å; L204-L208 HydrophobicContact CD2-CD2 3.78Å; L204-Q209 HydrophobicContact CB-CB 4.33Å
205P91.1Very high92.3Very high52 Ų5281.6 Ų81.634%0.33841%0.409SS..PPolyproline II helixtrans-55.3135.3168.7-22.731.7000110.5T120 Q207 L208 Q209T120-P205 WeakPolarHBondContact O-CD 3.39Å; P205-Q207 PolarHBondContact O-N 2.94Å; P205-Q207 VanDerWaalsContact O-N 3.1Å; P205-L208 PolarHBondContact O-N 2.94Å; P205-Q209 PolarHBondContact O-N 3.11Å
206Q91.1Very high92.4Very high125 Ų12580.6 Ų80.658%0.58441%0.411SS*.Hα-helixtrans-57.6-32.9-173-169.7176.727.300113.1L204 R210L204-Q206 PolarHBondContact O-N 2.94Å; Q206-R210 WeakPolarHBondContact O-CG 3.48Å; Q206-R210 PolarHBondContact O-N 3.43Å
207Q91.3Very high92.4Very high178 Ų17882 Ų8283%0.83242%0.422SS*.Hα-helixtrans-63.7-47.3176.9-67.9-180-14.500111.9P205 A211P205-Q207 PolarHBondContact O-N 2.94Å; P205-Q207 VanDerWaalsContact O-N 3.1Å; Q207-A211 PolarHBondContact O-N 3.11Å
208L89.8Confident92.4Very high60 Ų6084.5 Ų84.531%0.31444%0.443SS..Hα-helixtrans-67.8-42.9179-172.181.4000111.2V119 L165 L204 P205 R210 A211 M212V119-L208 HydrophobicContact CG1-CD2 3.42Å; V119-L208 VanDerWaalsContact CG1-CD2 3.42Å; L165-L208 HydrophobicContact CD2-CD2 4.49Å; L204-L208 HydrophobicContact CD2-CD2 3.78Å; P205-L208 PolarHBondContact O-N 2.94Å; L208-R210 VanDerWaalsContact C-N 3.28Å; L208-R210 PolarHBondContact O-N 3.39Å; L208-A211 PolarHBondContact O-N 3.32Å; L208-A211 VanDerWaalsContact O-N 3.17Å; L208-M212 HydrophobicContact CD2-SD 4.03Å; L208-M212 HydrophobicContact CG-CG 4.26Å; L208-M212 HydrophobicContact CG-SD 3.98Å; L208-M212 WeakPolarHBondContact O-CB 3.47Å; L208-M212 WeakPolarHBondContact O-CG 3.46Å; L208-M212 PolarHBondContact O-N 3.28Å
209Q91.3Very high92.5Very high110 Ų11083.2 Ų83.251%0.51444%0.443SS..Hα-helixtrans-58.1-41.1179.7-170.5-177.923.200111.9L204 P205 A213L204-Q209 HydrophobicContact CB-CB 4.33Å; P205-Q209 PolarHBondContact O-N 3.11Å; Q209-A213 VanDerWaalsContact O-CB 3.28Å; Q209-A213 WeakPolarHBondContact O-CB 3.36Å; Q209-A213 PolarHBondContact O-N 3.47Å
210R93.6Very high92.6Very high165 Ų16591.1 Ų91.162%0.62347%0.471SS*.Hα-helixtrans-66.8-43.7176.3-71.9177.2-175-175.94.8112.2Q206 L208 A213 A214Q206-R210 WeakPolarHBondContact O-CG 3.48Å; Q206-R210 PolarHBondContact O-N 3.43Å; L208-R210 VanDerWaalsContact C-N 3.28Å; L208-R210 PolarHBondContact O-N 3.39Å; R210-A213 PolarHBondContact O-N 2.85Å; R210-A214 PolarHBondContact O-N 3.04Å
211A92.6Very high92.9Very high60 Ų6091 Ų9150%0.49647%0.472SS..Hα-helixtrans-63-46.1178.100000111.7Q207 L208 A213 A214 E215Q207-A211 PolarHBondContact O-N 3.11Å; L208-A211 PolarHBondContact O-N 3.32Å; L208-A211 VanDerWaalsContact O-N 3.17Å; A211-A213 PolarHBondContact O-N 3.38Å; A211-A214 PolarHBondContact O-N 2.97Å; A211-E215 PolarHBondContact O-N 3.5Å
212M90.5Very high93.2Very high67 Ų6789.6 Ų89.633%0.3347%0.472SS..Hα-helixtrans-63.8-38.7176-71.2-179.470.800112.4L165 L169 L208 E215 A216L165-M212 HydrophobicContact CD2-CE 3.92Å; L165-M212 HydrophobicContact CD2-SD 3.9Å; L169-M212 HydrophobicContact CD1-CE 4.49Å; L208-M212 HydrophobicContact CD2-SD 4.03Å; L208-M212 HydrophobicContact CG-CG 4.26Å; L208-M212 HydrophobicContact CG-SD 3.98Å; L208-M212 WeakPolarHBondContact O-CB 3.47Å; L208-M212 WeakPolarHBondContact O-CG 3.46Å; L208-M212 PolarHBondContact O-N 3.28Å; M212-E215 PolarHBondContact O-N 2.97Å; M212-A216 WeakPolarHBondContact O-CB 3.42Å; M212-A216 PolarHBondContact O-N 3.2Å
213A92.1Very high93.5Very high57 Ų5796.9 Ų96.947%0.47150%0.497SS..Hα-helixtrans-62.8-44.3175.800000111.4Q209 R210 A211 A216 E217Q209-A213 VanDerWaalsContact O-CB 3.28Å; Q209-A213 WeakPolarHBondContact O-CB 3.36Å; Q209-A213 PolarHBondContact O-N 3.47Å; R210-A213 PolarHBondContact O-N 2.85Å; A211-A213 PolarHBondContact O-N 3.38Å; A213-A216 PolarHBondContact O-N 3.04Å; A213-E217 WeakPolarHBondContact O-CB 3.32Å; A213-E217 PolarHBondContact O-N 2.83Å
214A95.1Very high93.8Very high58 Ų5893.8 Ų93.848%0.47949%0.494SS..Hα-helixtrans-64.5-42.5176.900000112.5R210 A211 E217 A218R210-A214 PolarHBondContact O-N 3.04Å; A211-A214 PolarHBondContact O-N 2.97Å; A214-E217 PolarHBondContact O-N 3.45Å; A214-A218 WeakPolarHBondContact O-CB 3.19Å; A214-A218 PolarHBondContact O-N 3.29Å
215E93.9Very high94Very high141 Ų14198.3 Ų98.366%0.65951%0.512SS*.Hα-helixtrans-64.5-43.5175.3-175.3-175.4-178.700112A211 M212 E217 A218 S219A211-E215 PolarHBondContact O-N 3.5Å; M212-E215 PolarHBondContact O-N 2.97Å; E215-E217 VanDerWaalsContact C-N 3.34Å; E215-E217 PolarHBondContact O-N 3.21Å; E215-A218 PolarHBondContact O-N 3.36Å; E215-S219 WeakPolarHBondContact O-CB 3.31Å; E215-S219 PolarHBondContact O-N 2.86Å; E215-S219 PolarHBondContact O-OG 2.88Å; E215-S219 VanDerWaalsContact O-OG 3.11Å
216A92.9Very high94.4Very high38 Ų38101 Ų10131%0.31452%0.523SS..Hα-helixtrans-64.1-39177.100000111.7M212 A213 S219 R220M212-A216 WeakPolarHBondContact O-CB 3.42Å; M212-A216 PolarHBondContact O-N 3.2Å; A213-A216 PolarHBondContact O-N 3.04Å; A216-S219 PolarHBondContact O-OG 3.02Å; A216-R220 VanDerWaalsContact O-CB 3.28Å; A216-R220 WeakPolarHBondContact O-CB 3.36Å; A216-R220 WeakPolarHBondContact O-CD 3.18Å; A216-R220 WeakPolarHBondContact O-CG 3.43Å; A216-R220 PolarHBondContact O-N 2.91Å
217E94.7Very high94.7Very high137 Ų137100.6 Ų100.664%0.6452%0.523SS*.Hα-helixtrans-65.4-49.7175.5-174.5169-162.200111.4A213 A214 E215 S219 R220 E221A213-E217 WeakPolarHBondContact O-CB 3.32Å; A213-E217 PolarHBondContact O-N 2.83Å; A214-E217 PolarHBondContact O-N 3.45Å; E215-E217 VanDerWaalsContact C-N 3.34Å; E215-E217 PolarHBondContact O-N 3.21Å; E217-S219 VanDerWaalsContact C-N 3.35Å; E217-S219 PolarHBondContact O-N 3.35Å; E217-R220 PolarHBondContact O-N 3.42Å; E217-E221 PolarHBondContact O-N 3.34Å
218A96.8Very high95Very high60 Ų6094.8 Ų94.850%0.49651%0.506SS..Hα-helixtrans-60.2-42.817800000112.3A214 E215 E221 A222A214-A218 WeakPolarHBondContact O-CB 3.19Å; A214-A218 PolarHBondContact O-N 3.29Å; E215-A218 PolarHBondContact O-N 3.36Å; A218-E221 PolarHBondContact O-N 2.74Å; A218-A222 WeakPolarHBondContact O-CB 3.13Å; A218-A222 PolarHBondContact O-N 3.37Å
219S95.7Very high95.4Very high51 Ų5194.7 Ų94.736%0.35751%0.513SS..Hα-helixtrans-68.6-36.7177.667.10000112.8E215 A216 E217 R223E215-S219 WeakPolarHBondContact O-CB 3.31Å; E215-S219 PolarHBondContact O-N 2.86Å; E215-S219 PolarHBondContact O-OG 2.88Å; E215-S219 VanDerWaalsContact O-OG 3.11Å; A216-S219 PolarHBondContact O-OG 3.02Å; E217-S219 VanDerWaalsContact C-N 3.35Å; E217-S219 PolarHBondContact O-N 3.35Å; S219-R223 WeakPolarHBondContact O-CB 2.89Å; S219-R223 VanDerWaalsContact O-CG 3.27Å; S219-R223 WeakPolarHBondContact O-CG 3.39Å; S219-R223 PolarHBondContact O-N 2.9Å
220R96.3Very high95.7Very high189 Ų18994.8 Ų94.871%0.71351%0.514SS*.Hα-helixtrans-65.8-43.3173.9-78.1173.2180-171.40.7111.4A216 E217 R223 A224A216-R220 VanDerWaalsContact O-CB 3.28Å; A216-R220 WeakPolarHBondContact O-CB 3.36Å; A216-R220 WeakPolarHBondContact O-CD 3.18Å; A216-R220 WeakPolarHBondContact O-CG 3.43Å; A216-R220 PolarHBondContact O-N 2.91Å; E217-R220 PolarHBondContact O-N 3.42Å; R220-R223 PolarHBondContact O-N 3.46Å; R220-A224 WeakPolarHBondContact O-CB 3.2Å; R220-A224 PolarHBondContact O-N 3.41Å
221E96.9Very high95.9Very high106 Ų10688.7 Ų88.750%0.49550%0.503SS..Hα-helixtrans-65-44.1177.4-164.3-168154.200111.4E217 A218 R223 A224 K225E217-E221 PolarHBondContact O-N 3.34Å; A218-E221 PolarHBondContact O-N 2.74Å; E221-R223 PolarHBondContact O-N 3.14Å; E221-A224 PolarHBondContact O-N 2.93Å; E221-K225 WeakPolarHBondContact O-CG 3.42Å; E221-K225 PolarHBondContact O-N 3.11Å; E221-K225 VanDerWaalsContact OE1-CE 3.25Å; E221-K225 WeakPolarHBondContact OE1-CE 3.31Å; E221-K225 IonicContact OE1-NZ 3.32Å; E221-K225 PolarHBondContact OE1-NZ 3.28Å
222A97.2Very high96.1Very high50 Ų5092.7 Ų92.741%0.41351%0.511SS..Hα-helixtrans-60.5-45.8175.700000111.8A218 A224 K225 I226A218-A222 WeakPolarHBondContact O-CB 3.13Å; A218-A222 PolarHBondContact O-N 3.37Å; A222-A224 PolarHBondContact O-N 3.07Å; A222-K225 PolarHBondContact O-N 3.37Å; A222-I226 WeakPolarHBondContact O-CG1 3.49Å; A222-I226 PolarHBondContact O-N 3.32Å; A222-I226 VanDerWaalsContact O-N 3.13Å
223R96.9Very high96.4Very high176 Ų17694.9 Ų94.966%0.66452%0.522SS*.Hα-helixtrans-62.9-41.1175.9-75.5177.5-175.6-1713.4112.1S219 R220 E221 K225 I226 I227S219-R223 WeakPolarHBondContact O-CB 2.89Å; S219-R223 VanDerWaalsContact O-CG 3.27Å; S219-R223 WeakPolarHBondContact O-CG 3.39Å; S219-R223 PolarHBondContact O-N 2.9Å; R220-R223 PolarHBondContact O-N 3.46Å; E221-R223 PolarHBondContact O-N 3.14Å; R223-K225 VanDerWaalsContact C-N 3.32Å; R223-K225 PolarHBondContact O-N 3.12Å; R223-I226 PolarHBondContact O-N 2.56Å; R223-I227 VanDerWaalsContact O-CG1 3.3Å; R223-I227 WeakPolarHBondContact O-CG1 3.47Å; R223-I227 PolarHBondContact O-N 2.96Å
224A97.7Very high96.6Very high56 Ų5695.9 Ų95.946%0.46352%0.519SS..Hα-helixtrans-60.9-41.317700000111.8R220 E221 A222 I227 A228R220-A224 WeakPolarHBondContact O-CB 3.2Å; R220-A224 PolarHBondContact O-N 3.41Å; E221-A224 PolarHBondContact O-N 2.93Å; A222-A224 PolarHBondContact O-N 3.07Å; A224-I227 PolarHBondContact O-N 3.39Å; A224-A228 WeakPolarHBondContact O-CB 3.41Å; A224-A228 PolarHBondContact O-N 3.49Å
225K97.4Very high96.7Very high128 Ų12895.6 Ų95.656%0.55752%0.517SS*.Hα-helixtrans-63.4-41.3175.6-73.3174.6-175165.30112.6E221 A222 R223 A228 A229E221-K225 WeakPolarHBondContact O-CG 3.42Å; E221-K225 PolarHBondContact O-N 3.11Å; E221-K225 VanDerWaalsContact OE1-CE 3.25Å; E221-K225 WeakPolarHBondContact OE1-CE 3.31Å; E221-K225 IonicContact OE1-NZ 3.32Å; E221-K225 PolarHBondContact OE1-NZ 3.28Å; A222-K225 PolarHBondContact O-N 3.37Å; R223-K225 VanDerWaalsContact C-N 3.32Å; R223-K225 PolarHBondContact O-N 3.12Å; K225-A228 PolarHBondContact O-N 3.42Å; K225-A229 WeakPolarHBondContact O-CB 3.02Å; K225-A229 PolarHBondContact O-N 2.98Å
226I97.9Very high96.9Very high110 Ų11092.3 Ų92.356%0.56451%0.51SS*.Hα-helixtrans-63.1-47.8176.5-65.8166.8000110.3A222 R223 A228 A229 E230A222-I226 WeakPolarHBondContact O-CG1 3.49Å; A222-I226 PolarHBondContact O-N 3.32Å; A222-I226 VanDerWaalsContact O-N 3.13Å; R223-I226 PolarHBondContact O-N 2.56Å; I226-A228 VanDerWaalsContact C-N 3.3Å; I226-A228 PolarHBondContact O-N 3.26Å; I226-A229 PolarHBondContact O-N 2.85Å; I226-E230 WeakPolarHBondContact O-CB 3.39Å; I226-E230 PolarHBondContact O-N 3.18Å
227I97.9Very high97.1Very high116 Ų11696.9 Ų96.960%0.59552%0.518SS*.Hα-helixtrans-61.9-39.2178.8-66.6166.3000111R223 A224 G231R223-I227 VanDerWaalsContact O-CG1 3.3Å; R223-I227 WeakPolarHBondContact O-CG1 3.47Å; R223-I227 PolarHBondContact O-N 2.96Å; A224-I227 PolarHBondContact O-N 3.39Å; I227-G231 PolarHBondContact O-N 3.39Å
228A97.6Very high97.1Very high56 Ų5693 Ų9346%0.46351%0.51SS..Hα-helixtrans-64.8-48.3176.500000112A224 K225 I226 E230 G231 E232A224-A228 WeakPolarHBondContact O-CB 3.41Å; A224-A228 PolarHBondContact O-N 3.49Å; K225-A228 PolarHBondContact O-N 3.42Å; I226-A228 VanDerWaalsContact C-N 3.3Å; I226-A228 PolarHBondContact O-N 3.26Å; A228-E230 VanDerWaalsContact C-N 3.35Å; A228-E230 PolarHBondContact O-N 2.99Å; A228-G231 PolarHBondContact O-N 3.39Å; A228-E232 WeakPolarHBondContact O-CG 3.43Å; A228-E232 PolarHBondContact O-N 3.15Å
229A97.6Very high97Very high57 Ų5796 Ų9647%0.47152%0.517SS..Hα-helixtrans-63.4-40.2178.100000112.2K225 I226 E232 M233K225-A229 WeakPolarHBondContact O-CB 3.02Å; K225-A229 PolarHBondContact O-N 2.98Å; I226-A229 PolarHBondContact O-N 2.85Å; A229-E232 PolarHBondContact O-N 3.24Å; A229-M233 WeakPolarHBondContact O-CB 3.03Å; A229-M233 PolarHBondContact O-N 3.08Å
230E97.6Very high97Very high112 Ų112100.4 Ų100.452%0.52353%0.53SS..Hα-helixtrans-66.7-39.8174.9-172.2170.6-170.100111.5I226 A228 M233 N234I226-E230 WeakPolarHBondContact O-CB 3.39Å; I226-E230 PolarHBondContact O-N 3.18Å; A228-E230 VanDerWaalsContact C-N 3.35Å; A228-E230 PolarHBondContact O-N 2.99Å; E230-M233 PolarHBondContact O-N 3.33Å; E230-N234 WeakPolarHBondContact O-CB 3.29Å; E230-N234 VanDerWaalsContact O-CG 3.26Å; E230-N234 PolarHBondContact O-N 3.13Å; E230-N234 PolarHBondContact O-ND2 3.01Å
231G98.2Very high96.9Very high38 Ų3896.9 Ų96.939%0.39252%0.522SS..Hα-helixtrans-58.8-46171.700000112.6I227 A228 N234 A235I227-G231 PolarHBondContact O-N 3.39Å; A228-G231 PolarHBondContact O-N 3.39Å; G231-N234 PolarHBondContact O-N 2.71Å; G231-A235 VanDerWaalsContact O-CB 3.31Å; G231-A235 WeakPolarHBondContact O-CB 3.39Å; G231-A235 PolarHBondContact O-N 3.31Å
232E96.8Very high96.6Very high143 Ų14393.7 Ų93.767%0.66851%0.513SS*.Hα-helixtrans-63.9-41.3176.2-76.5-176.517900112.4A228 A229 A235 S236A228-E232 WeakPolarHBondContact O-CG 3.43Å; A228-E232 PolarHBondContact O-N 3.15Å; A229-E232 PolarHBondContact O-N 3.24Å; E232-A235 PolarHBondContact O-N 2.93Å; E232-S236 VanDerWaalsContact O-CB 3.29Å; E232-S236 WeakPolarHBondContact O-CB 3.46Å; E232-S236 PolarHBondContact O-N 3.31Å; E232-S236 PolarHBondContact O-OG 3.36Å
233M97.1Very high96.4Very high113 Ų11394 Ų9456%0.55752%0.516SS*.Hα-helixtrans-63.6-45.3176.4-173.6-173.9-174.600111.4A229 E230 S236 R237A229-M233 WeakPolarHBondContact O-CB 3.03Å; A229-M233 PolarHBondContact O-N 3.08Å; E230-M233 PolarHBondContact O-N 3.33Å; M233-S236 PolarHBondContact O-N 3.31Å; M233-R237 PolarHBondContact O-N 3.37Å
234N97.3Very high96.1Very high79 Ų7990.7 Ų90.742%0.42251%0.511SS..Hα-helixtrans-65.2-43.3178.4-73.4-25.3000111.3E230 G231 R237 A238E230-N234 WeakPolarHBondContact O-CB 3.29Å; E230-N234 VanDerWaalsContact O-CG 3.26Å; E230-N234 PolarHBondContact O-N 3.13Å; E230-N234 PolarHBondContact O-ND2 3.01Å; G231-N234 PolarHBondContact O-N 2.71Å; N234-R237 PolarHBondContact O-N 2.91Å; N234-A238 PolarHBondContact O-N 3.42Å
235A96.9Very high95.7Very high52 Ų5292.5 Ų92.543%0.4352%0.516SS..Hα-helixtrans-61.1-44.5174.300000111.7G231 E232 R237 A238 L239G231-A235 VanDerWaalsContact O-CB 3.31Å; G231-A235 WeakPolarHBondContact O-CB 3.39Å; G231-A235 PolarHBondContact O-N 3.31Å; E232-A235 PolarHBondContact O-N 2.93Å; A235-R237 VanDerWaalsContact C-N 3.32Å; A235-R237 PolarHBondContact O-N 3.36Å; A235-A238 PolarHBondContact O-N 3.27Å; A235-L239 WeakPolarHBondContact O-CB 3.21Å; A235-L239 WeakPolarHBondContact O-CG 3.09Å; A235-L239 PolarHBondContact O-N 3.43Å
236S96.9Very high95.3Very high72 Ų7287.7 Ų87.750%0.50350%0.496SS..Hα-helixtrans-62.7-38.5177.9-61.80000112.2E232 M233 L239 K240E232-S236 VanDerWaalsContact O-CB 3.29Å; E232-S236 WeakPolarHBondContact O-CB 3.46Å; E232-S236 PolarHBondContact O-N 3.31Å; E232-S236 PolarHBondContact O-OG 3.36Å; M233-S236 PolarHBondContact O-N 3.31Å; S236-L239 PolarHBondContact O-N 3.33Å; S236-K240 WeakPolarHBondContact O-CB 2.88Å; S236-K240 PolarHBondContact O-N 2.94Å
237R97.1Very high94.8Very high133 Ų13385.1 Ų85.150%0.50250%0.497SS..Hα-helixtrans-64-48.1175.2-172.5-179.5-63.3172.22.5111.4M233 N234 A235 L239 K240 E241M233-R237 PolarHBondContact O-N 3.37Å; N234-R237 PolarHBondContact O-N 2.91Å; A235-R237 VanDerWaalsContact C-N 3.32Å; A235-R237 PolarHBondContact O-N 3.36Å; R237-L239 VanDerWaalsContact C-N 3.33Å; R237-L239 PolarHBondContact O-N 2.93Å; R237-K240 WeakPolarHBondContact O-CB 3.45Å; R237-K240 PolarHBondContact O-N 2.78Å; R237-E241 PolarHBondContact O-N 3.45Å
238A95.8Very high94.5Very high56 Ų5687.2 Ų87.246%0.46350%0.504SS..Hα-helixtrans-61.2-41.1177.200000112.1N234 A235 E241 A242N234-A238 PolarHBondContact O-N 3.42Å; A235-A238 PolarHBondContact O-N 3.27Å; A238-E241 PolarHBondContact O-N 3.08Å; A238-A242 WeakPolarHBondContact O-CB 3.48Å; A238-A242 PolarHBondContact O-N 3.14Å
239L93.8Very high94Very high124 Ų12486.3 Ų86.365%0.64950%0.497SS*.Hα-helixtrans-64.4-39.7175.4-73.5172.9000112.3A235 S236 R237 A242 A243A235-L239 WeakPolarHBondContact O-CB 3.21Å; A235-L239 WeakPolarHBondContact O-CG 3.09Å; A235-L239 PolarHBondContact O-N 3.43Å; S236-L239 PolarHBondContact O-N 3.33Å; R237-L239 VanDerWaalsContact C-N 3.33Å; R237-L239 PolarHBondContact O-N 2.93Å; L239-A242 PolarHBondContact O-N 3.41Å; L239-A243 WeakPolarHBondContact O-CB 3.07Å; L239-A243 PolarHBondContact O-N 3.17Å
240K95.4Very high93.3Very high143 Ų14388.6 Ų88.662%0.62251%0.507SS*.Hα-helixtrans-62-47.1175.1-179-173.4175.7-174.90111.4S236 R237 A243 L244S236-K240 WeakPolarHBondContact O-CB 2.88Å; S236-K240 PolarHBondContact O-N 2.94Å; R237-K240 WeakPolarHBondContact O-CB 3.45Å; R237-K240 PolarHBondContact O-N 2.78Å; K240-A243 PolarHBondContact O-N 3.46Å; K240-L244 WeakPolarHBondContact O-CG 3.3Å; K240-L244 PolarHBondContact O-N 3.05Å
241E94.7Very high92.8Very high115 Ų11586.8 Ų86.854%0.53751%0.507SS..Hα-helixtrans-60.7-46.5176.8-72.7172-167.700111.1R237 A238 A243 L244 V245R237-E241 PolarHBondContact O-N 3.45Å; A238-E241 PolarHBondContact O-N 3.08Å; E241-A243 VanDerWaalsContact C-N 3.31Å; E241-A243 PolarHBondContact O-N 2.7Å; E241-L244 PolarHBondContact O-N 3.23Å; E241-V245 WeakPolarHBondContact O-CG2 3.48Å; E241-V245 PolarHBondContact O-N 2.04Å; E241-V245 VanDerWaalsContact O-N 3.09Å
242A91.8Very high92.3Very high38 Ų3886.4 Ų86.431%0.31450%0.499SS..Hα-helixtrans-59.4-41.217500000112.1A238 L239 V245 I246A238-A242 WeakPolarHBondContact O-CB 3.48Å; A238-A242 PolarHBondContact O-N 3.14Å; L239-A242 PolarHBondContact O-N 3.41Å; A242-V245 PolarHBondContact O-N 3.03Å; A242-I246 WeakPolarHBondContact O-CB 3.42Å; A242-I246 WeakPolarHBondContact O-CD1 3.38Å; A242-I246 WeakPolarHBondContact O-CG1 3.32Å; A242-I246 PolarHBondContact O-N 3.46Å
243A91.3Very high91.7Very high58 Ų5884.6 Ų84.648%0.47949%0.494SS..Hα-helixtrans-65.1-39.4178.300000112.6L239 K240 E241 I246 G247L239-A243 WeakPolarHBondContact O-CB 3.07Å; L239-A243 PolarHBondContact O-N 3.17Å; K240-A243 PolarHBondContact O-N 3.46Å; E241-A243 VanDerWaalsContact C-N 3.31Å; E241-A243 PolarHBondContact O-N 2.7Å; A243-I246 PolarHBondContact O-N 3.24Å; A243-G247 PolarHBondContact O-N 3.21Å
244L91Very high91.1Very high106 Ų10685.8 Ų85.856%0.55550%0.498SS*.Hα-helixtrans-61.9-47.9174.7-70.3170.6000111.1K240 E241 I246 G247 E248K240-L244 WeakPolarHBondContact O-CG 3.3Å; K240-L244 PolarHBondContact O-N 3.05Å; E241-L244 PolarHBondContact O-N 3.23Å; L244-I246 PolarHBondContact O-N 2.99Å; L244-G247 PolarHBondContact O-N 2.91Å; L244-G247 VanDerWaalsContact O-N 3.07Å; L244-E248 PolarHBondContact O-N 3.4Å; L244-E248 VanDerWaalsContact O-N 3.15Å
245V89.8Confident90.6Very high93 Ų9387.3 Ų87.356%0.56451%0.506SS*.Hα-helixtrans-62.8-40.5178.3175.50000111.8E241 A242 G247 E248E241-V245 WeakPolarHBondContact O-CG2 3.48Å; E241-V245 PolarHBondContact O-N 2.04Å; E241-V245 VanDerWaalsContact O-N 3.09Å; A242-V245 PolarHBondContact O-N 3.03Å; V245-G247 VanDerWaalsContact C-N 3.3Å; V245-G247 PolarHBondContact O-N 3.46Å; V245-E248 PolarHBondContact O-N 3.19Å
246I89.1Confident90Very high27 Ų2790.8 Ų90.814%0.13851%0.508CS..Hα-helixtrans-62.8-39.5173.6-67.9161000110.9A242 A243 L244 E248 A249 A252 L253A242-I246 WeakPolarHBondContact O-CB 3.42Å; A242-I246 WeakPolarHBondContact O-CD1 3.38Å; A242-I246 WeakPolarHBondContact O-CG1 3.32Å; A242-I246 PolarHBondContact O-N 3.46Å; A243-I246 PolarHBondContact O-N 3.24Å; L244-I246 PolarHBondContact O-N 2.99Å; I246-E248 VanDerWaalsContact C-N 3.28Å; I246-E248 PolarHBondContact O-N 3.03Å; I246-A249 CarbonylContact O-C 3.57Å; I246-A249 PolarHBondContact O-N 3.41Å; I246-A252 HydrophobicContact CG2-CB 4.35Å; I246-L253 HydrophobicContact CG2-CB 4.42Å; I246-L253 HydrophobicContact CG2-CD1 4.47Å; I246-L253 HydrophobicContact CG2-CD2 3.52Å; I246-L253 HydrophobicContact CG2-CG 3.47Å; I246-L253 VanDerWaalsContact CG2-CG 3.47Å
247G87.6Confident89.3Confident57 Ų5791 Ų9159%0.58850%0.498SS*.Hα-helixtrans-65-29.7-179.300000113.6A243 L244 V245 A249A243-G247 PolarHBondContact O-N 3.21Å; L244-G247 PolarHBondContact O-N 2.91Å; L244-G247 VanDerWaalsContact O-N 3.07Å; V245-G247 VanDerWaalsContact C-N 3.3Å; V245-G247 PolarHBondContact O-N 3.46Å; G247-A249 VanDerWaalsContact C-N 3.26Å; G247-A249 PolarHBondContact O-N 3.48Å
248E90.9Very high88.8Confident159 Ų15989.6 Ų89.674%0.74350%0.5SS*.Hα-helixtrans-65.6-26.9175.3-69.4176.9179.100112.9L244 V245 I246L244-E248 PolarHBondContact O-N 3.4Å; L244-E248 VanDerWaalsContact O-N 3.15Å; V245-E248 PolarHBondContact O-N 3.19Å; I246-E248 VanDerWaalsContact C-N 3.28Å; I246-E248 PolarHBondContact O-N 3.03Å
249A88.5Confident88.4Confident38 Ų3893 Ų9331%0.31451%0.506SS..  trans-129103-177.500000111.8I246 G247 S251 A252I246-A249 CarbonylContact O-C 3.57Å; I246-A249 PolarHBondContact O-N 3.41Å; G247-A249 VanDerWaalsContact C-N 3.26Å; G247-A249 PolarHBondContact O-N 3.48Å; A249-S251 PolarHBondContact O-N 2.67Å; A249-S251 VanDerWaalsContact O-N 3.07Å; A249-A252 HydrophobicContact CB-CB 4.34Å; A249-A252 VanDerWaalsContact O-CB 3.27Å; A249-A252 WeakPolarHBondContact O-CB 3.35Å; A249-A252 PolarHBondContact O-N 2.98Å
250P82.9Confident88Confident104 Ų10490.6 Ų90.668%0.67550%0.497SS*.Hα-helixtrans-62.2-23.4-176.723-32.7000113.7A252 L253P250-A252 VanDerWaalsContact C-N 3.28Å; P250-A252 PolarHBondContact O-N 3.3Å; P250-L253 PolarHBondContact O-N 3.31Å
251S86.8Confident87.3Confident75 Ų7586.1 Ų86.152%0.52448%0.479SS..Hα-helixtrans-66-26.5172.952.40000113.4A249 Q254 L255A249-S251 PolarHBondContact O-N 2.67Å; A249-S251 VanDerWaalsContact O-N 3.07Å; S251-Q254 PolarHBondContact O-N 3.44Å; S251-L255 PolarHBondContact O-N 2.97Å; S251-L255 VanDerWaalsContact O-N 3.08Å
252A86.2Confident86.7Confident29 Ų2986.3 Ų86.324%0.2448%0.484CS..Hα-helixtrans-69.3-35.517800000112.3I246 A249 P250 Q254 L255 R256I246-A252 HydrophobicContact CG2-CB 4.35Å; A249-A252 HydrophobicContact CB-CB 4.34Å; A249-A252 VanDerWaalsContact O-CB 3.27Å; A249-A252 WeakPolarHBondContact O-CB 3.35Å; A249-A252 PolarHBondContact O-N 2.98Å; P250-A252 VanDerWaalsContact C-N 3.28Å; P250-A252 PolarHBondContact O-N 3.3Å; A252-Q254 VanDerWaalsContact C-N 3.31Å; A252-Q254 PolarHBondContact O-N 2.84Å; A252-L255 PolarHBondContact O-N 2.98Å; A252-R256 WeakPolarHBondContact O-CB 3.38Å; A252-R256 PolarHBondContact O-N 2.97Å
253L85.6Confident86.2Confident106 Ų10687.3 Ų87.356%0.55549%0.493SS*.Hα-helixtrans-61.4-41.7172.2-81.3168.9000111.4I246 P250 R256 Y257I246-L253 HydrophobicContact CG2-CB 4.42Å; I246-L253 HydrophobicContact CG2-CD1 4.47Å; I246-L253 HydrophobicContact CG2-CD2 3.52Å; I246-L253 HydrophobicContact CG2-CG 3.47Å; I246-L253 VanDerWaalsContact CG2-CG 3.47Å; P250-L253 PolarHBondContact O-N 3.31Å; L253-R256 PolarHBondContact O-N 3.31Å; L253-Y257 WeakPolarHBondContact O-CB 3.29Å; L253-Y257 PolarHBondContact O-N 2.93Å
254Q83.5Confident85.5Confident137 Ų13788.5 Ų88.564%0.6449%0.49SS*.Hα-helixtrans-67.7-40.4-179-144.9165.7300111.5S251 A252 Y257 L258S251-Q254 PolarHBondContact O-N 3.44Å; A252-Q254 VanDerWaalsContact C-N 3.31Å; A252-Q254 PolarHBondContact O-N 2.84Å; Q254-Y257 WeakPolarHBondContact O-CB 3.03Å; Q254-Y257 PolarHBondContact O-N 3.18Å; Q254-L258 WeakPolarHBondContact O-CG 3.5Å; Q254-L258 PolarHBondContact O-N 3.44Å
255L87.5Confident84.7Confident111 Ų11186.8 Ų86.858%0.58149%0.491SS*.Hα-helixtrans-64.2-43.7171.9-72.2171.8000112.3S251 A252 Y257 L258 Q259S251-L255 PolarHBondContact O-N 2.97Å; S251-L255 VanDerWaalsContact O-N 3.08Å; A252-L255 PolarHBondContact O-N 2.98Å; L255-Y257 VanDerWaalsContact C-N 3.32Å; L255-Y257 PolarHBondContact O-N 3.3Å; L255-L258 PolarHBondContact O-N 3.24Å; L255-Q259 WeakPolarHBondContact O-CG 3.46Å; L255-Q259 PolarHBondContact O-N 3.07Å
256R84.8Confident84.1Confident126 Ų12686 Ų8648%0.47549%0.494SS..Hα-helixtrans-59-44.9175.4-168.985.675.9172.90.1110.6A252 L253 L258 Q259 T260A252-R256 WeakPolarHBondContact O-CB 3.38Å; A252-R256 PolarHBondContact O-N 2.97Å; L253-R256 PolarHBondContact O-N 3.31Å; R256-L258 PolarHBondContact O-N 2.78Å; R256-Q259 WeakPolarHBondContact O-CB 3.35Å; R256-Q259 PolarHBondContact O-N 2.83Å; R256-T260 PolarHBondContact O-N 3.37Å; R256-T260 PolarHBondContact O-OG1 3.47Å
257Y82.3Confident83.4Confident76 Ų7691.3 Ų91.330%0.29852%0.519SS..Hα-helixtrans-58.6-45.5176.4178.9-102.8000112.5L253 Q254 L255 Q259 T260 L261 F274L253-Y257 WeakPolarHBondContact O-CB 3.29Å; L253-Y257 PolarHBondContact O-N 2.93Å; Q254-Y257 WeakPolarHBondContact O-CB 3.03Å; Q254-Y257 PolarHBondContact O-N 3.18Å; L255-Y257 VanDerWaalsContact C-N 3.32Å; L255-Y257 PolarHBondContact O-N 3.3Å; Y257-Q259 VanDerWaalsContact C-N 3.34Å; Y257-Q259 PolarHBondContact O-N 2.89Å; Y257-T260 WeakPolarHBondContact CA-OG1 3.21Å; Y257-T260 PolarHBondContact O-N 3.1Å; Y257-T260 PolarHBondContact O-OG1 3.16Å; Y257-L261 HydrophobicContact CD1-CD1 3.89Å; Y257-L261 HydrophobicContact CE1-CD1 3.45Å; Y257-L261 VanDerWaalsContact CE1-CD1 3.45Å; Y257-L261 HydrophobicContact CE1-CG 4.26Å; Y257-L261 WeakPolarHBondContact O-CG 3.41Å; Y257-L261 PolarHBondContact O-N 3.31Å; Y257-F274 WeakPolarHBondContact OH-CE1 3.43Å; Y257-F274 VanDerWaalsContact OH-CZ 3.31Å; Y257-F274 WeakPolarHBondContact OH-CZ 3.22Å
258L86.7Confident82.3Confident103 Ų10398.4 Ų98.454%0.53953%0.533SS..Hα-helixtrans-64.4-37.3175-68.5174.1000112.3Q254 L255 R256 L261 N262Q254-L258 WeakPolarHBondContact O-CG 3.5Å; Q254-L258 PolarHBondContact O-N 3.44Å; L255-L258 PolarHBondContact O-N 3.24Å; R256-L258 PolarHBondContact O-N 2.78Å; L258-L261 HydrophobicContact CD2-CD1 4.4Å; L258-L261 PolarHBondContact O-N 3.5Å; L258-N262 PolarHBondContact O-N 2.94Å
259Q85.9Confident80.8Confident127 Ų12796.6 Ų96.659%0.59353%0.528SS*.Hα-helixtrans-65.2-42.9174.8-74.5177.9-21.200112L255 R256 Y257 L261 N262 A263L255-Q259 WeakPolarHBondContact O-CG 3.46Å; L255-Q259 PolarHBondContact O-N 3.07Å; R256-Q259 WeakPolarHBondContact O-CB 3.35Å; R256-Q259 PolarHBondContact O-N 2.83Å; Y257-Q259 VanDerWaalsContact C-N 3.34Å; Y257-Q259 PolarHBondContact O-N 2.89Å; Q259-L261 VanDerWaalsContact C-N 3.33Å; Q259-L261 PolarHBondContact O-N 3.5Å; Q259-N262 PolarHBondContact O-N 3.4Å; Q259-A263 PolarHBondContact O-N 2.92Å
260T85.4Confident79.1Confident75 Ų75100.8 Ų100.846%0.4656%0.555SS.*Hα-helixtrans-62.9-40.8174.57.80000111.4R256 Y257 N262 A263 I264R256-T260 PolarHBondContact O-N 3.37Å; R256-T260 PolarHBondContact O-OG1 3.47Å; Y257-T260 WeakPolarHBondContact CA-OG1 3.21Å; Y257-T260 PolarHBondContact O-N 3.1Å; Y257-T260 PolarHBondContact O-OG1 3.16Å; T260-N262 VanDerWaalsContact C-N 3.3Å; T260-N262 PolarHBondContact O-N 3.26Å; T260-A263 PolarHBondContact O-N 3.01Å; T260-I264 WeakPolarHBondContact O-CB 3.47Å; T260-I264 WeakPolarHBondContact O-CD1 3.3Å; T260-I264 VanDerWaalsContact O-CG1 3.22Å; T260-I264 WeakPolarHBondContact O-CG1 3.5Å; T260-I264 PolarHBondContact O-N 3.3Å
261L81.1Confident78.2Confident48 Ų48101 Ų10125%0.25156%0.555SS.*Hα-helixtrans-60-41174.6-73.9175.6000112.1Y257 L258 Q259 I264 A265 F274Y257-L261 HydrophobicContact CD1-CD1 3.89Å; Y257-L261 HydrophobicContact CE1-CD1 3.45Å; Y257-L261 VanDerWaalsContact CE1-CD1 3.45Å; Y257-L261 HydrophobicContact CE1-CG 4.26Å; Y257-L261 WeakPolarHBondContact O-CG 3.41Å; Y257-L261 PolarHBondContact O-N 3.31Å; L258-L261 HydrophobicContact CD2-CD1 4.4Å; L258-L261 PolarHBondContact O-N 3.5Å; Q259-L261 VanDerWaalsContact C-N 3.33Å; Q259-L261 PolarHBondContact O-N 3.5Å; L261-I264 PolarHBondContact O-N 2.94Å; L261-A265 WeakPolarHBondContact O-CB 3.43Å; L261-A265 PolarHBondContact O-N 3.14Å; L261-F274 HydrophobicContact CD2-CE2 4.06Å; L261-F274 HydrophobicContact CD2-CZ 4.47Å
262N81.6Confident76.9Confident120 Ų120102.9 Ų102.964%0.64256%0.558SS**Hα-helixtrans-68.1-38.5177.6-16225.8000112.2L258 Q259 T260 A265 A266L258-N262 PolarHBondContact O-N 2.94Å; Q259-N262 PolarHBondContact O-N 3.4Å; T260-N262 VanDerWaalsContact C-N 3.3Å; T260-N262 PolarHBondContact O-N 3.26Å; N262-A265 PolarHBondContact O-N 3.34Å; N262-A266 PolarHBondContact O-N 2.96Å; N262-A266 VanDerWaalsContact O-N 3.08Å
263A81.4Confident75.9Confident59 Ų59108.6 Ų108.649%0.48858%0.583SS.*Hα-helixtrans-64.9-43175.200000112.1Q259 T260 A265 A266 E267Q259-A263 PolarHBondContact O-N 2.92Å; T260-A263 PolarHBondContact O-N 3.01Å; A263-A265 VanDerWaalsContact C-N 3.34Å; A263-A266 WeakPolarHBondContact O-CB 3.28Å; A263-A266 PolarHBondContact O-N 3.16Å; A263-E267 PolarHBondContact O-N 3.44Å
264I78.1Confident74.8Confident82 Ų82108.9 Ų108.942%0.42158%0.58SS.*Hα-helixtrans-65.5-37.3175.6-65.5163.4000111T260 L261 A266T260-I264 WeakPolarHBondContact O-CB 3.47Å; T260-I264 WeakPolarHBondContact O-CD1 3.3Å; T260-I264 VanDerWaalsContact O-CG1 3.22Å; T260-I264 WeakPolarHBondContact O-CG1 3.5Å; T260-I264 PolarHBondContact O-N 3.3Å; L261-I264 PolarHBondContact O-N 2.94Å; I264-A266 VanDerWaalsContact C-N 3.25Å; I264-A266 PolarHBondContact O-N 3.14Å
265A74.1Confident73.9Confident71 Ų71106.4 Ų106.459%0.58758%0.576SS**Hα-helixtrans-68.4-24.7175.400000113L261 N262 A263L261-A265 WeakPolarHBondContact O-CB 3.43Å; L261-A265 PolarHBondContact O-N 3.14Å; N262-A265 PolarHBondContact O-N 3.34Å; A263-A265 VanDerWaalsContact C-N 3.34Å
266A75.8Confident73.1Confident75 Ų75106.3 Ų106.362%0.6258%0.575SS**Hα-helixtrans-79.4-36.6177.800000113N262 A263 I264 K268N262-A266 PolarHBondContact O-N 2.96Å; N262-A266 VanDerWaalsContact O-N 3.08Å; A263-A266 WeakPolarHBondContact O-CB 3.28Å; A263-A266 PolarHBondContact O-N 3.16Å; I264-A266 VanDerWaalsContact C-N 3.25Å; I264-A266 PolarHBondContact O-N 3.14Å; A266-K268 PolarHBondContact O-N 2.95Å
267E75.8Confident72.1Confident140 Ų140103.3 Ų103.365%0.65457%0.572SS**SBendtrans-75.6105.4168.3-78.7-174.7165.200109.3A263 N269A263-E267 PolarHBondContact O-N 3.44Å; E267-N269 PolarHBondContact O-N 3.29Å
268K64.3Low71.4Confident206 Ų206105.3 Ų105.390%0.89659%0.587SS**  trans-62.963.6-175.9-61.7178.3179.4178.20114.5A266A266-K268 PolarHBondContact O-N 2.95Å
269N58.3Low70.3Confident120 Ų120106.4 Ų106.464%0.64259%0.593SS**  trans-98.6132.3175.5-82.5-26000110.7E267 T271E267-N269 PolarHBondContact O-N 3.29Å; N269-T271 VanDerWaalsContact C-N 3.29Å; N269-T271 PolarHBondContact O-N 2.92Å
270S54.1Low69.2Low126 Ų126106.7 Ų106.788%0.88160%0.596SS**SBendtrans-79.20.1-170.353.80000115.6
271T63.1Low68Low110 Ų110108.8 Ų108.868%0.67560%0.602SS**  trans-132.8102.5-179.3-49.20000109.6N269N269-T271 VanDerWaalsContact C-N 3.29Å; N269-T271 PolarHBondContact O-N 2.92Å
272I59.8Low67Low114 Ų114111.3 Ų111.359%0.58561%0.613SS**  trans-91.9103.1178.6-56.6172.3000108F274I272-F274 HydrophobicContact CG2-CD2 4.47Å; I272-F274 PolarHBondContact O-N 3.5Å
273I64.9Low66Low148 Ų148108.5 Ų108.576%0.75961%0.612SS**  trans-80.9117171.8-61.3173000107.1P275I273-P275 WeakPolarHBondContact O-CD 3.28Å
274F62.5Low65.1Low112 Ų112114.7 Ų114.749%0.49163%0.628SS.*  trans-93.1104.6-175.8-144.9-93.5000109.9Y257 L261 I272 L276Y257-F274 WeakPolarHBondContact OH-CE1 3.43Å; Y257-F274 VanDerWaalsContact OH-CZ 3.31Å; Y257-F274 WeakPolarHBondContact OH-CZ 3.22Å; L261-F274 HydrophobicContact CD2-CE2 4.06Å; L261-F274 HydrophobicContact CD2-CZ 4.47Å; I272-F274 HydrophobicContact CG2-CD2 4.47Å; I272-F274 PolarHBondContact O-N 3.5Å; F274-L276 HydrophobicContact CD1-CD2 3.81Å; F274-L276 HydrophobicContact CD1-CG 4.31Å; F274-L276 HydrophobicContact CE1-CD2 4.1Å; F274-L276 PolarHBondContact O-N 3.26Å; F274-L276 VanDerWaalsContact O-N 3.13Å
275P64.4Low64.1Low86 Ų86118.4 Ų118.456%0.55865%0.646SS**  trans-74.4106.617429.5-32.2000108.5I273I273-P275 WeakPolarHBondContact O-CD 3.28Å
276L70.4Confident63.2Low108 Ų108123.2 Ų123.257%0.56566%0.656SS**  trans-80.7129.9171.7-70.1172.5000109.4F274 I278F274-L276 HydrophobicContact CD1-CD2 3.81Å; F274-L276 HydrophobicContact CD1-CG 4.31Å; F274-L276 HydrophobicContact CE1-CD2 4.1Å; F274-L276 PolarHBondContact O-N 3.26Å; F274-L276 VanDerWaalsContact O-N 3.13Å; L276-I278 PolarHBondContact O-N 3.09Å
277P65.1Low62Low63 Ų63129.1 Ų129.141%0.40967%0.668SS.*  trans-62.7135.3177.421.5-28.5000110.9D279 M280P277-D279 PolarHBondContact O-N 3.47Å; P277-D279 VanDerWaalsContact O-N 3.11Å; P277-M280 HydrophobicContact CG-CG 4.25Å; P277-M280 HydrophobicContact CG-SD 4.15Å; P277-M280 PolarHBondContact O-N 3.03Å
278I66.3Low60.6Low119 Ų119135.7 Ų135.761%0.6169%0.694SS**Hα-helixtrans-59.7-26.6-173.3-63.9170.9000112L276 M280 M281 Q282L276-I278 PolarHBondContact O-N 3.09Å; I278-M280 VanDerWaalsContact C-N 3.27Å; I278-M280 PolarHBondContact O-N 3.44Å; I278-M281 WeakPolarHBondContact O-CA 3.44Å; I278-M281 WeakPolarHBondContact O-CB 3.47Å; I278-M281 PolarHBondContact O-N 3.19Å; I278-Q282 HydrophobicContact CG2-CG 4.29Å; I278-Q282 PolarHBondContact O-N 3.46Å
279D64.3Low60.4Low126 Ų126132.2 Ų132.267%0.67468%0.684SS**Hα-helixtrans-60.7-33.3177-61.1-31.1000112.9P277 M281P277-D279 PolarHBondContact O-N 3.47Å; P277-D279 VanDerWaalsContact O-N 3.11Å; D279-M281 VanDerWaalsContact C-N 3.32Å
280M62.1Low60.5Low132 Ų132132.8 Ų132.865%0.6569%0.686SS**Hα-helixtrans-72.8-26.3174.4-66.5-173.97200112.5P277 I278P277-M280 HydrophobicContact CG-CG 4.25Å; P277-M280 HydrophobicContact CG-SD 4.15Å; P277-M280 PolarHBondContact O-N 3.03Å; I278-M280 VanDerWaalsContact C-N 3.27Å; I278-M280 PolarHBondContact O-N 3.44Å
281M59.6Low60.9Low120 Ų120133.2 Ų133.259%0.59168%0.676SS**Hα-helixtrans-82.5-32176.2-67.3-134.9-58.100112.7I278 D279 G283 F284 M285I278-M281 WeakPolarHBondContact O-CA 3.44Å; I278-M281 WeakPolarHBondContact O-CB 3.47Å; I278-M281 PolarHBondContact O-N 3.19Å; D279-M281 VanDerWaalsContact C-N 3.32Å; M281-G283 VanDerWaalsContact C-N 3.27Å; M281-G283 PolarHBondContact O-N 3.2Å; M281-F284 PolarHBondContact O-N 3.07Å; M281-F284 VanDerWaalsContact O-N 3.09Å; M281-M285 PolarHBondContact O-N 3.3Å
282Q60.8Low60.7Low101 Ų101134.5 Ų134.547%0.47268%0.676SS.*Hα-helixtrans-61.9-33.8177.6-77.4-176.62.900112.7I278 F284 M285 Q286I278-Q282 HydrophobicContact CG2-CG 4.29Å; I278-Q282 PolarHBondContact O-N 3.46Å; Q282-F284 PolarHBondContact O-N 2.8Å; Q282-M285 PolarHBondContact O-N 3.05Å; Q282-M285 VanDerWaalsContact O-N 3.1Å; Q282-Q286 PolarHBondContact O-N 3.08Å
283G61Low60.8Low61 Ų61135.8 Ų135.863%0.62968%0.681SS**Hα-helixtrans-62.8-25.2174.200000114.5M281M281-G283 VanDerWaalsContact C-N 3.27Å; M281-G283 PolarHBondContact O-N 3.2Å
284F61.8Low60.5Low189 Ų189135 Ų13583%0.82968%0.676SS**Hα-helixtrans-87.4-20.9173.7-89.4-89.4000113.2M281 Q282M281-F284 PolarHBondContact O-N 3.07Å; M281-F284 VanDerWaalsContact O-N 3.09Å; Q282-F284 PolarHBondContact O-N 2.8Å
285M57.8Low60.4Low159 Ų159136.6 Ų136.678%0.78369%0.689SS**Hα-helixtrans-95.7-15.7-173.7-130.917362.900114.4M281 Q282 K287M281-M285 PolarHBondContact O-N 3.3Å; Q282-M285 PolarHBondContact O-N 3.05Å; Q282-M285 VanDerWaalsContact O-N 3.1Å; M285-K287 VanDerWaalsContact C-N 3.3Å; M285-K287 PolarHBondContact O-N 2.85Å
286Q56Low60.1Low173 Ų173140.5 Ų140.581%0.80870%0.699SS**SBendtrans-824.8176.7-89.2-172.1-4.500115.1Q282 K288Q282-Q286 PolarHBondContact O-N 3.08Å; Q286-K288 PolarHBondContact O-N 3.32Å
287K50.5Low59.2Low199 Ų199143.3 Ų143.387%0.86571%0.71SS**  trans-99.280176.9-133.7-179.1-172.1-179.70110.5M285M285-K287 VanDerWaalsContact C-N 3.3Å; M285-K287 PolarHBondContact O-N 2.85Å
288K45.3Very low58.7Low277 Ų277150.5 Ų150.5100%1.20474%0.738SS**  trans-144.30159.5-136.3-176.8-172.8-176.30110.5Q286Q286-K288 PolarHBondContact O-N 3.32Å

Retrieved 288 of 288 residues in 54.2 ms (Link to these results)