X2JE64_DROME Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession X2JE64, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG4198, Length 476 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
1M50.5Low58.1Low207 Ų207140.4 Ų140.4100%1.0269%0.689SS**  087.50-74.4179.182.600110.8
2S46.5Very low59.5Low83 Ų83143.3 Ų143.358%0.5869%0.687SS**  trans-151.958.716563.70000109.6Q4S2-Q4 PolarHBondContact O-N 3.24Å
3Y47.1Very low60.8Low233 Ų233145.9 Ų145.991%0.91469%0.685SS**THydrogen-bonded Turntrans-72.26.6-175.1-72.9-82.1000114.3
4Q54.5Low61.3Low188 Ų188140.2 Ų140.288%0.87966%0.66SS**THydrogen-bonded Turntrans-135-1.3-176.4-72.4179-9.800115.5S2 K6S2-Q4 PolarHBondContact O-N 3.24Å; Q4-K6 PolarHBondContact O-N 2.98Å
5I54.8Low62Low120 Ų120138.8 Ų138.862%0.61565%0.651SS**  trans-90.394.4169-52.9176.7000106S7I5-S7 PolarHBondContact O-N 3.33Å
6K58.7Low62.9Low196 Ų196135 Ų13585%0.85264%0.636SS**  trans-49.3111.2165.2-69-178.6179.9179.70106.1Q4 T8Q4-K6 PolarHBondContact O-N 2.98Å; K6-T8 PolarHBondContact O-N 3.15Å
7S54.5Low63.4Low77 Ų77133.9 Ų133.954%0.53863%0.63SS.*  trans-50.7111.4-174.558.30000108.2I5I5-S7 PolarHBondContact O-N 3.33Å
8T64.1Low63.5Low65 Ų65127.8 Ų127.840%0.39961%0.605SS.*  trans-61.3147177.154.30000107.8K6 Y10 F11 R12K6-T8 PolarHBondContact O-N 3.15Å; T8-Y10 PolarHBondContact O-N 3.15Å; T8-F11 PolarHBondContact O-N 2.81Å; T8-F11 WeakPolarHBondContact OG1-CD2 3.42Å; T8-R12 PolarHBondContact O-N 3.07Å
9P70.7Confident63.9Low99 Ų99129 Ų12964%0.64361%0.607SS**Hα-helixtrans-50.7-27.3179.4-26.833.2000113R13P9-R13 WeakPolarHBondContact O-CG 3.23Å; P9-R13 PolarHBondContact O-N 3.37Å; P9-R13 VanDerWaalsContact O-N 3.14Å
10Y69.4Low64.4Low154 Ų154131.6 Ų131.660%0.60462%0.616SS**Hα-helixtrans-61.1-50.2172.5-173.7-105.5000113.7T8 R12 R13 M14T8-Y10 PolarHBondContact O-N 3.15Å; Y10-R12 VanDerWaalsContact C-N 3.28Å; Y10-R12 PolarHBondContact O-N 2.99Å; Y10-R13 PolarHBondContact O-N 3.47Å; Y10-M14 HydrophobicContact CD1-CE 3.58Å; Y10-M14 HydrophobicContact CD1-CG 4.48Å; Y10-M14 HydrophobicContact CD1-SD 4.08Å; Y10-M14 HydrophobicContact CE1-CE 3.3Å; Y10-M14 HydrophobicContact CE1-CG 4.11Å; Y10-M14 HydrophobicContact CE1-SD 3.33Å; Y10-M14 WeakPolarHBondContact CE1-SD 3.38Å; Y10-M14 VanDerWaalsContact CZ-SD 3.57Å; Y10-M14 PolarHBondContact O-N 3.23Å
11F68.4Low65Low122 Ų122130.3 Ų130.354%0.53561%0.614SS.*Hα-helixtrans-62.2-36177.2-92.1-80.3000112.4T8 M14 F15T8-F11 PolarHBondContact O-N 2.81Å; T8-F11 WeakPolarHBondContact OG1-CD2 3.42Å; F11-M14 HydrophobicContact CD1-CE 3.82Å; F11-M14 HydrophobicContact CE1-CE 3.95Å; F11-M14 HydrophobicContact CG-CE 4.17Å; F11-M14 HydrophobicContact CZ-CE 4.4Å; F11-M14 PolarHBondContact O-N 3.09Å; F11-F15 VanDerWaalsContact O-CB 3.29Å; F11-F15 WeakPolarHBondContact O-CB 3.31Å; F11-F15 PolarHBondContact O-N 3.5Å
12R75.1Confident66.7Low176 Ų176121.6 Ų121.666%0.66458%0.577SS**Hα-helixtrans-67.7-38.2177.8-145.9175-170.4-142.42.5111.8T8 Y10 N16T8-R12 PolarHBondContact O-N 3.07Å; Y10-R12 VanDerWaalsContact C-N 3.28Å; Y10-R12 PolarHBondContact O-N 2.99Å; R12-N16 WeakPolarHBondContact O-CB 3.45Å; R12-N16 PolarHBondContact O-N 2.98Å; R12-N16 VanDerWaalsContact O-N 3.09Å; R12-N16 PolarHBondContact O-ND2 3.12Å
13R76.5Confident68.2Low177 Ų177122.6 Ų122.667%0.66857%0.573SS**Hα-helixtrans-67.1-47.3173.4-72.5-177.8-163.5169.94.4111.8P9 Y10 F15 N16 E17P9-R13 WeakPolarHBondContact O-CG 3.23Å; P9-R13 PolarHBondContact O-N 3.37Å; P9-R13 VanDerWaalsContact O-N 3.14Å; Y10-R13 PolarHBondContact O-N 3.47Å; R13-F15 VanDerWaalsContact C-N 3.33Å; R13-F15 PolarHBondContact O-N 2.75Å; R13-N16 PolarHBondContact O-N 3.49Å; R13-E17 WeakPolarHBondContact O-CB 3.42Å; R13-E17 WeakPolarHBondContact O-CG 3.42Å; R13-E17 PolarHBondContact O-N 3.47Å
14M67.8Low69.8Low66 Ų66113.7 Ų113.733%0.32554%0.541SS..Hα-helixtrans-60.8-40.7177.3-72.7-164-57.100112.5Y10 F11 E17 S18Y10-M14 HydrophobicContact CD1-CE 3.58Å; Y10-M14 HydrophobicContact CD1-CG 4.48Å; Y10-M14 HydrophobicContact CD1-SD 4.08Å; Y10-M14 HydrophobicContact CE1-CE 3.3Å; Y10-M14 HydrophobicContact CE1-CG 4.11Å; Y10-M14 HydrophobicContact CE1-SD 3.33Å; Y10-M14 WeakPolarHBondContact CE1-SD 3.38Å; Y10-M14 VanDerWaalsContact CZ-SD 3.57Å; Y10-M14 PolarHBondContact O-N 3.23Å; F11-M14 HydrophobicContact CD1-CE 3.82Å; F11-M14 HydrophobicContact CE1-CE 3.95Å; F11-M14 HydrophobicContact CG-CE 4.17Å; F11-M14 HydrophobicContact CZ-CE 4.4Å; F11-M14 PolarHBondContact O-N 3.09Å; M14-E17 PolarHBondContact O-N 3.38Å; M14-S18 VanDerWaalsContact O-CB 3.27Å; M14-S18 WeakPolarHBondContact O-CB 3.3Å; M14-S18 PolarHBondContact O-N 3.31Å
15F71.6Confident71.2Confident119 Ų119109.7 Ų109.752%0.52252%0.522SS..Hα-helixtrans-65.2-43.2176.8-175.5-97.1000111.8F11 R13 S18 K19 L24F11-F15 VanDerWaalsContact O-CB 3.29Å; F11-F15 WeakPolarHBondContact O-CB 3.31Å; F11-F15 PolarHBondContact O-N 3.5Å; R13-F15 VanDerWaalsContact C-N 3.33Å; R13-F15 PolarHBondContact O-N 2.75Å; F15-S18 PolarHBondContact O-N 2.96Å; F15-K19 WeakPolarHBondContact O-CB 3.39Å; F15-K19 PolarHBondContact O-N 3.46Å; F15-L24 HydrophobicContact CD2-CD1 4.01Å; F15-L24 HydrophobicContact CE2-CD1 3.69Å; F15-L24 HydrophobicContact CE2-CD2 4.29Å; F15-L24 HydrophobicContact CZ-CD1 4.01Å
16N75.4Confident72.6Confident78 Ų78112.7 Ų112.742%0.41753%0.525SS..Hα-helixtrans-68.1-37.1177.7-72.3-18.6000112.4R12 R13 K19 K20R12-N16 WeakPolarHBondContact O-CB 3.45Å; R12-N16 PolarHBondContact O-N 2.98Å; R12-N16 VanDerWaalsContact O-N 3.09Å; R12-N16 PolarHBondContact O-ND2 3.12Å; R13-N16 PolarHBondContact O-N 3.49Å; N16-K19 PolarHBondContact O-N 3.05Å; N16-K20 WeakPolarHBondContact O-CB 3.48Å; N16-K20 VanDerWaalsContact O-CG 3.31Å; N16-K20 WeakPolarHBondContact O-CG 3.27Å; N16-K20 PolarHBondContact O-N 2.96Å
17E71.7Confident73.8Confident116 Ų116109 Ų10954%0.54251%0.514SS..Hα-helixtrans-67-42.3173-79.3172.6-179.300111.6R13 M14 K19 K20 N21R13-E17 WeakPolarHBondContact O-CB 3.42Å; R13-E17 WeakPolarHBondContact O-CG 3.42Å; R13-E17 PolarHBondContact O-N 3.47Å; M14-E17 PolarHBondContact O-N 3.38Å; E17-K19 VanDerWaalsContact C-N 3.31Å; E17-K19 PolarHBondContact O-N 2.9Å; E17-K20 PolarHBondContact O-N 3.42Å; E17-N21 VanDerWaalsContact O-CB 3.24Å; E17-N21 WeakPolarHBondContact O-CB 3.41Å; E17-N21 PolarHBondContact O-N 2.83Å; E17-N21 PolarHBondContact O-ND2 3.42Å
18S64.9Low75.3Confident24 Ų24113.6 Ų113.617%0.16852%0.52CS..Hα-helixtrans-66.1-32.9176.3-165.60000112.6M14 F15 G22 Q23 L24M14-S18 VanDerWaalsContact O-CB 3.27Å; M14-S18 WeakPolarHBondContact O-CB 3.3Å; M14-S18 PolarHBondContact O-N 3.31Å; F15-S18 PolarHBondContact O-N 2.96Å; S18-G22 PolarHBondContact O-N 3.48Å; S18-Q23 PolarHBondContact O-N 3.32Å; S18-Q23 WeakPolarHBondContact OG-CB 3.42Å; S18-Q23 PolarHBondContact OG-OE1 2.82Å; S18-L24 PolarHBondContact O-N 3.28Å
19K72.8Confident76.4Confident151 Ų151113.3 Ų113.366%0.65752%0.516SS*.Hα-helixtrans-67.8-44.4172.4-168.1178.2180-178.10111.2F15 N16 E17 G22 L24F15-K19 WeakPolarHBondContact O-CB 3.39Å; F15-K19 PolarHBondContact O-N 3.46Å; N16-K19 PolarHBondContact O-N 3.05Å; E17-K19 VanDerWaalsContact C-N 3.31Å; E17-K19 PolarHBondContact O-N 2.9Å; K19-G22 PolarHBondContact O-N 2.92Å; K19-L24 HydrophobicContact CB-CD1 3.97Å
20K73.1Confident77.1Confident180 Ų180112.9 Ų112.978%0.78351%0.505SS*.Hα-helixtrans-68.9-33.5177.1-73.3178.8179.9-172.40113.2N16 E17 G22N16-K20 WeakPolarHBondContact O-CB 3.48Å; N16-K20 VanDerWaalsContact O-CG 3.31Å; N16-K20 WeakPolarHBondContact O-CG 3.27Å; N16-K20 PolarHBondContact O-N 2.96Å; E17-K20 PolarHBondContact O-N 3.42Å; K20-G22 VanDerWaalsContact C-N 3.27Å; K20-G22 PolarHBondContact O-N 3.27Å
21N77.9Confident78Confident105 Ų105113.3 Ų113.356%0.56151%0.507SS*.THydrogen-bonded Turntrans-84.12.8-179.6-67.9-16.5000113.5E17 Q23E17-N21 VanDerWaalsContact O-CB 3.24Å; E17-N21 WeakPolarHBondContact O-CB 3.41Å; E17-N21 PolarHBondContact O-N 2.83Å; E17-N21 PolarHBondContact O-ND2 3.42Å; N21-Q23 HydrophobicContact CB-CG 4.34Å; N21-Q23 PolarHBondContact O-N 2.93Å; N21-Q23 VanDerWaalsContact O-N 3.07Å
22G84.8Confident78.8Confident24 Ų24112.8 Ų112.825%0.24751%0.506CS..THydrogen-bonded Turntrans66.57.2179.200000114.9S18 K19 K20 L24 Q25 R26S18-G22 PolarHBondContact O-N 3.48Å; K19-G22 PolarHBondContact O-N 2.92Å; K20-G22 VanDerWaalsContact C-N 3.27Å; K20-G22 PolarHBondContact O-N 3.27Å; G22-L24 VanDerWaalsContact C-N 3.32Å; G22-L24 PolarHBondContact O-N 2.87Å; G22-Q25 WeakPolarHBondContact O-CB 3.21Å; G22-Q25 PolarHBondContact O-N 2.96Å; G22-R26 WeakPolarHBondContact O-CG 3.4Å; G22-R26 PolarHBondContact O-N 3.06Å
23Q78.4Confident79.3Confident105 Ų105111.1 Ų111.149%0.49150%0.5SS..Hα-helixtrans-65.6-37.8179-73.4177.8-10.500111.4S18 N21 Q25 R26 L27S18-Q23 PolarHBondContact O-N 3.32Å; S18-Q23 WeakPolarHBondContact OG-CB 3.42Å; S18-Q23 PolarHBondContact OG-OE1 2.82Å; N21-Q23 HydrophobicContact CB-CG 4.34Å; N21-Q23 PolarHBondContact O-N 2.93Å; N21-Q23 VanDerWaalsContact O-N 3.07Å; Q23-Q25 VanDerWaalsContact C-N 3.3Å; Q23-Q25 PolarHBondContact O-N 2.91Å; Q23-R26 PolarHBondContact O-N 2.98Å; Q23-L27 WeakPolarHBondContact O-CB 3.42Å; Q23-L27 WeakPolarHBondContact O-CG 3.42Å; Q23-L27 PolarHBondContact O-N 3.11Å
24L79.8Confident79.4Confident46 Ų46107.4 Ų107.424%0.24149%0.492CS..Hα-helixtrans-63.8-35.6173.1-85164.3000112.3F15 S18 K19 G22 R28F15-L24 HydrophobicContact CD2-CD1 4.01Å; F15-L24 HydrophobicContact CE2-CD1 3.69Å; F15-L24 HydrophobicContact CE2-CD2 4.29Å; F15-L24 HydrophobicContact CZ-CD1 4.01Å; S18-L24 PolarHBondContact O-N 3.28Å; K19-L24 HydrophobicContact CB-CD1 3.97Å; G22-L24 VanDerWaalsContact C-N 3.32Å; G22-L24 PolarHBondContact O-N 2.87Å; L24-R28 WeakPolarHBondContact O-CG 3.45Å; L24-R28 PolarHBondContact O-N 3.33Å; L24-R28 VanDerWaalsContact O-N 3.14Å
25Q83.9Confident80.1Confident104 Ų104108.9 Ų108.949%0.48650%0.498SS..Hα-helixtrans-69.3-47.9175.9-170.361.439.800110.6G22 Q23 L27 R28 D29G22-Q25 WeakPolarHBondContact O-CB 3.21Å; G22-Q25 PolarHBondContact O-N 2.96Å; Q23-Q25 VanDerWaalsContact C-N 3.3Å; Q23-Q25 PolarHBondContact O-N 2.91Å; Q25-L27 VanDerWaalsContact C-N 3.25Å; Q25-L27 PolarHBondContact O-N 2.96Å; Q25-R28 WeakPolarHBondContact O-CA 3.37Å; Q25-R28 WeakPolarHBondContact O-CB 3.44Å; Q25-R28 PolarHBondContact O-N 3.24Å; Q25-D29 PolarHBondContact NE2-OD1 2.98Å; Q25-D29 PolarHBondContact O-N 2.94Å
26R84.7Confident80.7Confident182 Ų182108.9 Ų108.969%0.68750%0.5SS*.Hα-helixtrans-57.5-37.7176-69.5179.3-175.5-179.22.2112.9G22 Q23 E30G22-R26 WeakPolarHBondContact O-CG 3.4Å; G22-R26 PolarHBondContact O-N 3.06Å; Q23-R26 PolarHBondContact O-N 2.98Å; R26-E30 VanDerWaalsContact O-CB 3.26Å; R26-E30 WeakPolarHBondContact O-CB 3.47Å; R26-E30 PolarHBondContact O-N 3.08Å
27L84.8Confident81.1Confident118 Ų118112.2 Ų112.262%0.61851%0.511SS*.Hα-helixtrans-67.5-36.4175-81.5167000112.6Q23 Q25 Y31Q23-L27 WeakPolarHBondContact O-CB 3.42Å; Q23-L27 WeakPolarHBondContact O-CG 3.42Å; Q23-L27 PolarHBondContact O-N 3.11Å; Q25-L27 VanDerWaalsContact C-N 3.25Å; Q25-L27 PolarHBondContact O-N 2.96Å; L27-Y31 WeakPolarHBondContact O-CB 3.44Å; L27-Y31 PolarHBondContact O-N 3.39Å
28R85.7Confident81.6Confident174 Ų174111 Ų11166%0.65751%0.508SS*.Hα-helixtrans-66-49.4173.4-72.6174.5-177.4-129.50.9110.9L24 Q25 E30 Y31 E32L24-R28 WeakPolarHBondContact O-CG 3.45Å; L24-R28 PolarHBondContact O-N 3.33Å; L24-R28 VanDerWaalsContact O-N 3.14Å; Q25-R28 WeakPolarHBondContact O-CA 3.37Å; Q25-R28 WeakPolarHBondContact O-CB 3.44Å; Q25-R28 PolarHBondContact O-N 3.24Å; R28-E30 VanDerWaalsContact C-N 3.27Å; R28-E30 PolarHBondContact O-N 3.36Å; R28-Y31 PolarHBondContact O-N 3.06Å; R28-Y31 VanDerWaalsContact O-N 3.15Å; R28-E32 PolarHBondContact O-N 3.04Å
29D87.8Confident82.5Confident60 Ų60113.9 Ų113.932%0.32152%0.522SS..Hα-helixtrans-64.1-32.3-179.9-53.2-16.7000112Q25 R33Q25-D29 PolarHBondContact NE2-OD1 2.98Å; Q25-D29 PolarHBondContact O-N 2.94Å; D29-R33 WeakPolarHBondContact O-CB 3.34Å; D29-R33 WeakPolarHBondContact O-CG 3.36Å; D29-R33 PolarHBondContact O-N 2.9Å; D29-R33 VanDerWaalsContact O-N 3.15Å; D29-R33 PolarHBondContact O-NE 3.18Å; D29-R33 VanDerWaalsContact O-NE 3.15Å
30E85.2Confident83.3Confident89 Ų89115.5 Ų115.542%0.41652%0.524SS..Hα-helixtrans-72.8-41.1174.1-165.667.2-158.200111.7R26 R28 E32 R33 I34R26-E30 VanDerWaalsContact O-CB 3.26Å; R26-E30 WeakPolarHBondContact O-CB 3.47Å; R26-E30 PolarHBondContact O-N 3.08Å; R28-E30 VanDerWaalsContact C-N 3.27Å; R28-E30 PolarHBondContact O-N 3.36Å; E30-E32 VanDerWaalsContact C-N 3.35Å; E30-R33 PolarHBondContact O-N 3.22Å; E30-R33 IonicContact OE2-CZ 2.81Å; E30-R33 VanDerWaalsContact OE2-CZ 3.27Å; E30-R33 IonicContact OE2-NE 3.04Å; E30-R33 IonicContact OE2-NH2 3.22Å; E30-R33 PolarHBondContact OE2-NH2 2.92Å; E30-I34 HydrophobicContact CG-CD1 4.04Å; E30-I34 VanDerWaalsContact O-CG1 3.26Å; E30-I34 WeakPolarHBondContact O-CG1 3.36Å; E30-I34 PolarHBondContact O-N 3.44Å
31Y87Confident84Confident164 Ų164109.1 Ų109.164%0.64350%0.5SS*.Hα-helixtrans-62.4-43.6175.9-174.5-91.6000111.5L27 R28 I34 Q35L27-Y31 WeakPolarHBondContact O-CB 3.44Å; L27-Y31 PolarHBondContact O-N 3.39Å; R28-Y31 PolarHBondContact O-N 3.06Å; R28-Y31 VanDerWaalsContact O-N 3.15Å; Y31-I34 PolarHBondContact O-N 3.02Å; Y31-Q35 WeakPolarHBondContact O-CB 3.33Å; Y31-Q35 PolarHBondContact O-N 3.4Å
32E86.3Confident84.3Confident111 Ų111108 Ų10852%0.51949%0.494SS..Hα-helixtrans-62-46.8176.4-171.4167.5-15000111.5R28 E30 I34 Q35 E36R28-E32 PolarHBondContact O-N 3.04Å; E30-E32 VanDerWaalsContact C-N 3.35Å; E32-I34 PolarHBondContact O-N 2.93Å; E32-Q35 WeakPolarHBondContact O-CB 3.39Å; E32-Q35 PolarHBondContact O-N 3.46Å; E32-E36 WeakPolarHBondContact O-CG 3.46Å; E32-E36 PolarHBondContact O-N 2.97Å
33R85.1Confident84.7Confident140 Ų140113.5 Ų113.553%0.52851%0.512SS..Hα-helixtrans-60.2-41.1175.1-79.3-177.2-71.1179.52.4113.5D29 E30 Q35 F37D29-R33 WeakPolarHBondContact O-CB 3.34Å; D29-R33 WeakPolarHBondContact O-CG 3.36Å; D29-R33 PolarHBondContact O-N 2.9Å; D29-R33 VanDerWaalsContact O-N 3.15Å; D29-R33 PolarHBondContact O-NE 3.18Å; D29-R33 VanDerWaalsContact O-NE 3.15Å; E30-R33 PolarHBondContact O-N 3.22Å; E30-R33 IonicContact OE2-CZ 2.81Å; E30-R33 VanDerWaalsContact OE2-CZ 3.27Å; E30-R33 IonicContact OE2-NE 3.04Å; E30-R33 IonicContact OE2-NH2 3.22Å; E30-R33 PolarHBondContact OE2-NH2 2.92Å; R33-Q35 VanDerWaalsContact C-N 3.34Å; R33-F37 WeakPolarHBondContact O-CB 3.42Å; R33-F37 PolarHBondContact O-N 3.3Å
34I79.2Confident85.4Confident100 Ų100113.1 Ų113.151%0.51351%0.512SS..Hα-helixtrans-68.1-38.6177.7-68.9167.7000110.5E30 Y31 E32 F37 N38E30-I34 HydrophobicContact CG-CD1 4.04Å; E30-I34 VanDerWaalsContact O-CG1 3.26Å; E30-I34 WeakPolarHBondContact O-CG1 3.36Å; E30-I34 PolarHBondContact O-N 3.44Å; Y31-I34 PolarHBondContact O-N 3.02Å; E32-I34 PolarHBondContact O-N 2.93Å; I34-F37 PolarHBondContact O-N 3.28Å; I34-N38 WeakPolarHBondContact O-CB 3.46Å; I34-N38 PolarHBondContact O-N 3.31Å
35Q83.2Confident86.1Confident96 Ų96117.1 Ų117.145%0.44953%0.527SS..Hα-helixtrans-63.2-49176.1-175.9175.6-23.200111.2Y31 E32 R33 F37 N38 D39Y31-Q35 WeakPolarHBondContact O-CB 3.33Å; Y31-Q35 PolarHBondContact O-N 3.4Å; E32-Q35 WeakPolarHBondContact O-CB 3.39Å; E32-Q35 PolarHBondContact O-N 3.46Å; R33-Q35 VanDerWaalsContact C-N 3.34Å; Q35-F37 VanDerWaalsContact C-N 3.31Å; Q35-F37 PolarHBondContact O-N 3.42Å; Q35-N38 WeakPolarHBondContact O-CB 3.33Å; Q35-N38 PolarHBondContact O-N 3.12Å; Q35-N38 VanDerWaalsContact O-N 3.1Å; Q35-D39 PolarHBondContact O-N 3.43Å
36E83.8Confident86.5Confident119 Ų119116.8 Ų116.856%0.55653%0.527SS*.Hα-helixtrans-58.9-40.6176-72.3178.6177.400112.6E32 N38 D39 R40E32-E36 WeakPolarHBondContact O-CG 3.46Å; E32-E36 PolarHBondContact O-N 2.97Å; E36-N38 VanDerWaalsContact C-N 3.32Å; E36-N38 PolarHBondContact O-N 3.31Å; E36-D39 PolarHBondContact O-N 3.43Å; E36-R40 WeakPolarHBondContact O-CB 3.46Å; E36-R40 PolarHBondContact O-N 3.39Å
37F83.9Confident86.9Confident148 Ų148116 Ų11665%0.64952%0.524SS*.Hα-helixtrans-63.2-40175.9-178.6-95000112R33 I34 Q35 T41R33-F37 WeakPolarHBondContact O-CB 3.42Å; R33-F37 PolarHBondContact O-N 3.3Å; I34-F37 PolarHBondContact O-N 3.28Å; Q35-F37 VanDerWaalsContact C-N 3.31Å; Q35-F37 PolarHBondContact O-N 3.42Å; F37-T41 WeakPolarHBondContact O-CB 3.28Å; F37-T41 PolarHBondContact O-N 3.46Å; F37-T41 PolarHBondContact O-OG1 2.91Å
38N81.2Confident87.3Confident90 Ų90116 Ų11648%0.48152%0.521SS..Hα-helixtrans-67.5-44.1177.3-159.82000110.9I34 Q35 E36 R40 T41 I42I34-N38 WeakPolarHBondContact O-CB 3.46Å; I34-N38 PolarHBondContact O-N 3.31Å; Q35-N38 WeakPolarHBondContact O-CB 3.33Å; Q35-N38 PolarHBondContact O-N 3.12Å; Q35-N38 VanDerWaalsContact O-N 3.1Å; E36-N38 VanDerWaalsContact C-N 3.32Å; E36-N38 PolarHBondContact O-N 3.31Å; N38-R40 PolarHBondContact O-N 3.16Å; N38-T41 CarbonylContact O-C 3.59Å; N38-T41 WeakPolarHBondContact O-CA 3.17Å; N38-T41 WeakPolarHBondContact O-CB 3.4Å; N38-T41 PolarHBondContact O-N 2.97Å; N38-T41 VanDerWaalsContact O-N 3.08Å; N38-I42 VanDerWaalsContact O-CG1 3.27Å; N38-I42 WeakPolarHBondContact O-CG1 3.34Å; N38-I42 PolarHBondContact O-N 3.42Å
39D84.2Confident87.8Confident86 Ų86112.1 Ų112.146%0.4652%0.516SS..Hα-helixtrans-62-43.3177.5-73.1-18.3000111.8Q35 E36 T41 I42 E43Q35-D39 PolarHBondContact O-N 3.43Å; E36-D39 PolarHBondContact O-N 3.43Å; D39-T41 VanDerWaalsContact C-N 3.27Å; D39-T41 PolarHBondContact O-N 3.35Å; D39-I42 PolarHBondContact O-N 3.47Å; D39-E43 WeakPolarHBondContact O-CB 3.37Å; D39-E43 PolarHBondContact O-N 3.43Å
40R89.5Confident88.1Confident184 Ų184117.4 Ų117.469%0.69453%0.532SS*.Hα-helixtrans-61-36.9173.5-169.1177-174-175.72.5112.4E36 N38 M44E36-R40 WeakPolarHBondContact O-CB 3.46Å; E36-R40 PolarHBondContact O-N 3.39Å; N38-R40 PolarHBondContact O-N 3.16Å; R40-M44 WeakPolarHBondContact O-CB 3.31Å; R40-M44 PolarHBondContact O-N 2.98Å
41T88.6Confident88.6Confident47 Ų47116.9 Ų116.929%0.28853%0.531SS..Hα-helixtrans-70.7-41.8177.3-60.30000111.5F37 N38 D39 M44 K45F37-T41 WeakPolarHBondContact O-CB 3.28Å; F37-T41 PolarHBondContact O-N 3.46Å; F37-T41 PolarHBondContact O-OG1 2.91Å; N38-T41 CarbonylContact O-C 3.59Å; N38-T41 WeakPolarHBondContact O-CA 3.17Å; N38-T41 WeakPolarHBondContact O-CB 3.4Å; N38-T41 PolarHBondContact O-N 2.97Å; N38-T41 VanDerWaalsContact O-N 3.08Å; D39-T41 VanDerWaalsContact C-N 3.27Å; D39-T41 PolarHBondContact O-N 3.35Å; T41-M44 PolarHBondContact O-N 3.42Å; T41-K45 WeakPolarHBondContact O-CG 3.48Å; T41-K45 PolarHBondContact O-N 3.33Å
42I83.9Confident89.1Confident82 Ų82117 Ų11742%0.42154%0.535SS..Hα-helixtrans-62.7-45.5175.5-68.9164.9000109.7N38 D39 M44 K45 M46N38-I42 VanDerWaalsContact O-CG1 3.27Å; N38-I42 WeakPolarHBondContact O-CG1 3.34Å; N38-I42 PolarHBondContact O-N 3.42Å; D39-I42 PolarHBondContact O-N 3.47Å; I42-M44 PolarHBondContact O-N 3.08Å; I42-K45 PolarHBondContact O-N 2.97Å; I42-M46 HydrophobicContact CG2-CG 4.36Å; I42-M46 WeakPolarHBondContact O-CB 3.45Å; I42-M46 WeakPolarHBondContact O-CG 3.44Å; I42-M46 PolarHBondContact O-N 2.94Å
43E92.6Very high89.5Confident138 Ų138120.9 Ų120.965%0.64555%0.545SS*.Hα-helixtrans-58.4-47.3176.5-171.1-173.2179.700111.4D39 K45 M46 R47D39-E43 WeakPolarHBondContact O-CB 3.37Å; D39-E43 PolarHBondContact O-N 3.43Å; E43-K45 PolarHBondContact O-N 3.41Å; E43-M46 PolarHBondContact O-N 3.34Å; E43-R47 WeakPolarHBondContact O-CB 3.39Å; E43-R47 PolarHBondContact O-N 3.39Å
44M93.4Very high90Very high97 Ų97118.6 Ų118.648%0.47854%0.543SS..Hα-helixtrans-59.6-44.8177.1-170.766.772.100111.8R40 T41 I42 R47 Q48R40-M44 WeakPolarHBondContact O-CB 3.31Å; R40-M44 PolarHBondContact O-N 2.98Å; T41-M44 PolarHBondContact O-N 3.42Å; I42-M44 PolarHBondContact O-N 3.08Å; M44-R47 WeakPolarHBondContact O-CB 3.47Å; M44-R47 PolarHBondContact O-N 3.19Å; M44-Q48 WeakPolarHBondContact O-CG 3.48Å; M44-Q48 PolarHBondContact O-N 3.08Å
45K94.6Very high90.8Very high131 Ų131120.1 Ų120.157%0.5755%0.546SS*.Hα-helixtrans-63.3-42.8176.3-75.5179.6178.5176.40111.7T41 I42 E43 R47 Q48 V49T41-K45 WeakPolarHBondContact O-CG 3.48Å; T41-K45 PolarHBondContact O-N 3.33Å; I42-K45 PolarHBondContact O-N 2.97Å; E43-K45 PolarHBondContact O-N 3.41Å; K45-R47 VanDerWaalsContact C-N 3.34Å; K45-R47 PolarHBondContact O-N 3.46Å; K45-Q48 WeakPolarHBondContact O-CB 3.45Å; K45-Q48 PolarHBondContact O-N 3.28Å; K45-V49 WeakPolarHBondContact O-CG2 3.43Å; K45-V49 PolarHBondContact O-N 3.42Å
46M91.4Very high91.4Very high97 Ų97124.5 Ų124.548%0.47856%0.558SS.*Hα-helixtrans-64.9-38.6177.1-73-59.5-76.900111.9I42 E43 V49 R50I42-M46 HydrophobicContact CG2-CG 4.36Å; I42-M46 WeakPolarHBondContact O-CB 3.45Å; I42-M46 WeakPolarHBondContact O-CG 3.44Å; I42-M46 PolarHBondContact O-N 2.94Å; E43-M46 PolarHBondContact O-N 3.34Å; M46-V49 PolarHBondContact O-N 2.9Å; M46-R50 VanDerWaalsContact O-CG 3.3Å; M46-R50 WeakPolarHBondContact O-CG 3.43Å; M46-R50 PolarHBondContact O-N 2.84Å
47R92.8Very high91.7Very high164 Ų164124 Ų12462%0.61956%0.556SS**Hα-helixtrans-61.8-45.3172.4-171.1179.4-170.7-1793.9111.5E43 M44 K45 V49 R50 L51E43-R47 WeakPolarHBondContact O-CB 3.39Å; E43-R47 PolarHBondContact O-N 3.39Å; M44-R47 WeakPolarHBondContact O-CB 3.47Å; M44-R47 PolarHBondContact O-N 3.19Å; K45-R47 VanDerWaalsContact C-N 3.34Å; K45-R47 PolarHBondContact O-N 3.46Å; R47-V49 PolarHBondContact O-N 3.49Å; R47-R50 PolarHBondContact O-N 3.25Å; R47-L51 HydrophobicContact CG-CD1 4.25Å; R47-L51 WeakPolarHBondContact O-CB 3.25Å; R47-L51 WeakPolarHBondContact O-CG 3.14Å; R47-L51 PolarHBondContact O-N 3.49Å
48Q94.3Very high92.1Very high119 Ų119121.7 Ų121.756%0.55655%0.549SS*.Hα-helixtrans-60.8-43.1175.4-73.4177.5-3.200112.1M44 K45 L51 K52M44-Q48 WeakPolarHBondContact O-CG 3.48Å; M44-Q48 PolarHBondContact O-N 3.08Å; K45-Q48 WeakPolarHBondContact O-CB 3.45Å; K45-Q48 PolarHBondContact O-N 3.28Å; Q48-L51 PolarHBondContact O-N 3.26Å; Q48-K52 WeakPolarHBondContact O-CB 3.32Å; Q48-K52 PolarHBondContact O-N 2.94Å
49V96.4Very high92.6Very high92 Ų92123.4 Ų123.456%0.55856%0.555SS**Hα-helixtrans-61.7-45.2176.1170.40000111.2K45 M46 R47 K52 R53K45-V49 WeakPolarHBondContact O-CG2 3.43Å; K45-V49 PolarHBondContact O-N 3.42Å; M46-V49 PolarHBondContact O-N 2.9Å; R47-V49 PolarHBondContact O-N 3.49Å; V49-K52 PolarHBondContact O-N 2.96Å; V49-R53 PolarHBondContact O-N 3.35Å
50R93.6Very high92.8Very high172 Ų172123.6 Ų123.665%0.64956%0.559SS**Hα-helixtrans-59.9-47.9175.9-72.7173.6-176.3174.62.8111.3M46 R47 R53 L54M46-R50 VanDerWaalsContact O-CG 3.3Å; M46-R50 WeakPolarHBondContact O-CG 3.43Å; M46-R50 PolarHBondContact O-N 2.84Å; R47-R50 PolarHBondContact O-N 3.25Å; R50-R53 PolarHBondContact O-N 2.95Å; R50-L54 WeakPolarHBondContact O-CG 3.48Å; R50-L54 PolarHBondContact O-N 3.31Å
51L96.3Very high92.6Very high78 Ų78120.1 Ų120.141%0.40855%0.553SS.*Hα-helixtrans-62.2-45.1177.8-73.2172.3000112R47 Q48 R53 L54 F55R47-L51 HydrophobicContact CG-CD1 4.25Å; R47-L51 WeakPolarHBondContact O-CB 3.25Å; R47-L51 WeakPolarHBondContact O-CG 3.14Å; R47-L51 PolarHBondContact O-N 3.49Å; Q48-L51 PolarHBondContact O-N 3.26Å; L51-R53 VanDerWaalsContact C-N 3.28Å; L51-R53 PolarHBondContact O-N 3.25Å; L51-L54 PolarHBondContact O-N 2.96Å; L51-L54 VanDerWaalsContact O-N 3.16Å; L51-F55 HydrophobicContact CB-CD2 4.47Å; L51-F55 HydrophobicContact CB-CE2 4.36Å; L51-F55 WeakPolarHBondContact O-CD2 3.36Å; L51-F55 PolarHBondContact O-N 3.49Å
52K96.7Very high92.5Very high166 Ų166125.8 Ų125.872%0.72257%0.573SS**Hα-helixtrans-61.1-38178.1-169.9174.6-176.5175.80112Q48 V49 R56Q48-K52 WeakPolarHBondContact O-CB 3.32Å; Q48-K52 PolarHBondContact O-N 2.94Å; V49-K52 PolarHBondContact O-N 2.96Å; K52-R56 WeakPolarHBondContact O-CB 3.47Å; K52-R56 PolarHBondContact O-N 2.86Å; K52-R56 VanDerWaalsContact O-N 3.09Å
53R95.5Very high92.2Very high192 Ų192127.3 Ų127.373%0.72559%0.586SS**Hα-helixtrans-64.7-45.7173.9-174.7177.2-179.1166.20.9111.6V49 R50 L51 R56 E57V49-R53 PolarHBondContact O-N 3.35Å; R50-R53 PolarHBondContact O-N 2.95Å; L51-R53 VanDerWaalsContact C-N 3.28Å; L51-R53 PolarHBondContact O-N 3.25Å; R53-R56 PolarHBondContact O-N 3.46Å; R53-E57 WeakPolarHBondContact O-CB 3.3Å; R53-E57 PolarHBondContact O-N 3.35Å
54L95.9Very high91Very high93 Ų93124 Ų12449%0.48758%0.583SS.*Hα-helixtrans-61.5-45.4176.9-72171.6000111.9R50 L51 R56 E57 I58R50-L54 WeakPolarHBondContact O-CG 3.48Å; R50-L54 PolarHBondContact O-N 3.31Å; L51-L54 PolarHBondContact O-N 2.96Å; L51-L54 VanDerWaalsContact O-N 3.16Å; L54-R56 VanDerWaalsContact C-N 3.33Å; L54-R56 PolarHBondContact O-N 3.24Å; L54-E57 PolarHBondContact O-N 3.09Å; L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.47Å; L54-I58 PolarHBondContact O-N 2.89Å
55F96.2Very high89.4Confident131 Ų131122 Ų12258%0.57559%0.586SS**Hα-helixtrans-60.7-42.3176.6-77.9-60.9000112.2L51 E57 I58 E59L51-F55 HydrophobicContact CB-CD2 4.47Å; L51-F55 HydrophobicContact CB-CE2 4.36Å; L51-F55 WeakPolarHBondContact O-CD2 3.36Å; L51-F55 PolarHBondContact O-N 3.49Å; F55-E57 VanDerWaalsContact C-N 3.34Å; F55-E57 PolarHBondContact O-N 3.06Å; F55-I58 PolarHBondContact O-N 3.06Å; F55-E59 WeakPolarHBondContact O-CG 3.49Å; F55-E59 PolarHBondContact O-N 3.34Å
56R94.1Very high87.4Confident188 Ų188119 Ų11971%0.70959%0.593SS**Hα-helixtrans-63.4-39.5175.4-169.7178.2-174.5-179.12.3112.1K52 R53 L54 E59 V60K52-R56 WeakPolarHBondContact O-CB 3.47Å; K52-R56 PolarHBondContact O-N 2.86Å; K52-R56 VanDerWaalsContact O-N 3.09Å; R53-R56 PolarHBondContact O-N 3.46Å; L54-R56 VanDerWaalsContact C-N 3.33Å; L54-R56 PolarHBondContact O-N 3.24Å; R56-E59 PolarHBondContact O-N 3.36Å; R56-V60 VanDerWaalsContact O-CG2 3.28Å; R56-V60 WeakPolarHBondContact O-CG2 3.43Å; R56-V60 PolarHBondContact O-N 3.1Å
57E91.3Very high85.5Confident108 Ų108118.8 Ų118.851%0.50561%0.606SS.*Hα-helixtrans-65.5-42.7176.8-172.6170.4-177.800111.6R53 L54 F55 E59 V60 I61R53-E57 WeakPolarHBondContact O-CB 3.3Å; R53-E57 PolarHBondContact O-N 3.35Å; L54-E57 PolarHBondContact O-N 3.09Å; F55-E57 VanDerWaalsContact C-N 3.34Å; F55-E57 PolarHBondContact O-N 3.06Å; E57-E59 PolarHBondContact O-N 3.43Å; E57-V60 PolarHBondContact O-N 3.42Å; E57-I61 HydrophobicContact CG-CD1 4.33Å; E57-I61 WeakPolarHBondContact O-CG1 3.39Å; E57-I61 PolarHBondContact O-N 3.42Å
58I92.6Very high83.6Confident100 Ų100115.2 Ų115.251%0.51361%0.612SS.*Hα-helixtrans-61.8-42.8173.8-67.6165.7000110.9L54 F55 I61 K62L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.47Å; L54-I58 PolarHBondContact O-N 2.89Å; F55-I58 PolarHBondContact O-N 3.06Å; I58-I61 PolarHBondContact O-N 3.26Å; I58-K62 WeakPolarHBondContact O-CB 3.4Å; I58-K62 PolarHBondContact O-N 2.92Å
59E91.4Very high81.4Confident127 Ų127113.1 Ų113.159%0.59362%0.623SS**Hα-helixtrans-61.5-42.5174.9-78.5178.2174.900112.1F55 R56 E57 I61 K62 V63F55-E59 WeakPolarHBondContact O-CG 3.49Å; F55-E59 PolarHBondContact O-N 3.34Å; R56-E59 PolarHBondContact O-N 3.36Å; E57-E59 PolarHBondContact O-N 3.43Å; E59-I61 PolarHBondContact O-N 3.44Å; E59-K62 PolarHBondContact O-N 3.37Å; E59-V63 VanDerWaalsContact O-CG2 3.31Å; E59-V63 WeakPolarHBondContact O-CG2 3.33Å; E59-V63 PolarHBondContact O-N 2.85Å
60V88.6Confident79.2Confident90 Ų90112.8 Ų112.855%0.54564%0.638SS.*Hα-helixtrans-62.1-43.1175.8169.80000111R56 E57 V63 A64R56-V60 VanDerWaalsContact O-CG2 3.28Å; R56-V60 WeakPolarHBondContact O-CG2 3.43Å; R56-V60 PolarHBondContact O-N 3.1Å; E57-V60 PolarHBondContact O-N 3.42Å; V60-V63 PolarHBondContact O-N 3.16Å; V60-A64 WeakPolarHBondContact O-CB 3.42Å; V60-A64 PolarHBondContact O-N 3.29Å
61I85.1Confident77.2Confident110 Ų110108.9 Ų108.956%0.56464%0.642SS**Hα-helixtrans-65.1-40.7175.9-66.5166.3000110.8E57 I58 E59 V63 A64 G65E57-I61 HydrophobicContact CG-CD1 4.33Å; E57-I61 WeakPolarHBondContact O-CG1 3.39Å; E57-I61 PolarHBondContact O-N 3.42Å; I58-I61 PolarHBondContact O-N 3.26Å; E59-I61 PolarHBondContact O-N 3.44Å; I61-V63 PolarHBondContact O-N 3.36Å; I61-A64 PolarHBondContact O-N 3.47Å; I61-G65 WeakPolarHBondContact O-CA 3.44Å; I61-G65 PolarHBondContact O-N 3.41Å
62K85.8Confident74.8Confident166 Ų166111 Ų11172%0.72266%0.664SS**Hα-helixtrans-63.3-41.3177.7-174.3179.4177.8-177.30111.9I58 E59 G66I58-K62 WeakPolarHBondContact O-CB 3.4Å; I58-K62 PolarHBondContact O-N 2.92Å; E59-K62 PolarHBondContact O-N 3.37Å; K62-G66 PolarHBondContact O-N 2.87Å
63V77Confident72.2Confident115 Ų115106.8 Ų106.870%0.69767%0.667SS**Hα-helixtrans-73.4-40.1177.41750000111.3E59 V60 I61E59-V63 VanDerWaalsContact O-CG2 3.31Å; E59-V63 WeakPolarHBondContact O-CG2 3.33Å; E59-V63 PolarHBondContact O-N 2.85Å; V60-V63 PolarHBondContact O-N 3.16Å; I61-V63 PolarHBondContact O-N 3.36Å
64A68.5Low69.9Low68 Ų68102 Ų10256%0.56268%0.677SS**Hα-helixtrans-72.3-31.7177.900000113.2V60 I61V60-A64 WeakPolarHBondContact O-CB 3.42Å; V60-A64 PolarHBondContact O-N 3.29Å; I61-A64 PolarHBondContact O-N 3.47Å
65G58.6Low67.1Low54 Ų54101.2 Ų101.256%0.55769%0.692SS**Hα-helixtrans-79.7-18.2177.300000114.3I61I61-G65 WeakPolarHBondContact O-CA 3.44Å; I61-G65 PolarHBondContact O-N 3.41Å
66G53.9Low64.7Low68 Ų68101.6 Ų101.670%0.70171%0.705SS**SBendtrans-80.8-15.8178.100000115.1K62K62-G66 PolarHBondContact O-N 2.87Å
67A51.4Low62.1Low93 Ų9397.8 Ų97.877%0.76971%0.707SS**SBendtrans-101.5-4.5-175.800000114.4
68A52.4Low59.6Low90 Ų9098.9 Ų98.974%0.74472%0.721SS**SBendtrans-142.469.6-176.500000111.7
69G47.8Very low57.3Low75 Ų7598.6 Ų98.677%0.77373%0.734SS**  trans179.536.6179.300000116.4
70G51.4Low54.7Low85 Ų8598.2 Ų98.288%0.87675%0.745SS**  trans-106.280.8168.100000111.1
71A50.8Low52.6Low90 Ų9099.2 Ų99.274%0.74476%0.756SS**  trans-176140.5155.200000111.2
72S45.8Very low51Low122 Ų122100.1 Ų100.185%0.85377%0.769SS**  trans81102.3-176.774.60000114.2
73G41.9Very low48.8Very low78 Ų7897.5 Ų97.580%0.80477%0.772SS**  cis70.695.637.300000107.6
74G46.5Very low47.2Very low90 Ų9099.4 Ų99.493%0.92878%0.779SS**  81.191.464.200000108.5
75G38.7Very low46.1Very low77 Ų77102.9 Ų102.979%0.79479%0.793SS**  trans-175.281.4-176.400000113.7
76T44.9Very low45Very low139 Ų139106.3 Ų106.385%0.85380%0.798SS**  trans-65.8126.6159.923.70000110.9
77S40.6Very low44.5Very low108 Ų108111.1 Ų111.176%0.75580%0.802SS**  trans-178.2116.2143.512.30000113.3
78T38Very low44Very low131 Ų131111.4 Ų111.480%0.80480%0.799SS**  40.6118.9126.156.30000121.4
79A44.7Very low43.5Very low95 Ų95116.9 Ų116.979%0.78581%0.806SS**  trans4131.7138.600000119.5
80S37.3Very low43.1Very low118 Ų118117.1 Ų117.183%0.82581%0.809SS**  178136118.852.80000111.4
81S44.2Very low42.9Very low111 Ų111121.1 Ų121.178%0.77681%0.809SS**  trans-50.5167.7167.5-49.10000113.7
82P51Low42.6Very low129 Ų129121.7 Ų121.784%0.83881%0.814SS**  -135.7143.2122.232.1-18.1000114.4
83S39.6Very low42.4Very low112 Ų112119.9 Ų119.978%0.78381%0.814SS**  trans-70.3151.5170.744.20000113
84N42.8Very low42.3Very low155 Ų155120.1 Ų120.183%0.82982%0.817SS**  trans-52.3172.6156.8-84.9-47.6000113.5
85V44.8Very low42.1Very low141 Ų141127.1 Ų127.186%0.85582%0.815SS**  trans100132174.1-174.90000111.4
86D36.8Very low42.2Very low126 Ų126129 Ų12967%0.67481%0.811SS**  cis179.3163.7-13.7-169.19.1000104.9
87Q43.1Very low42.3Very low168 Ų168128.3 Ų128.379%0.78581%0.807SS**  trans73.8138.6164.2-51.8176.323.800117.1
88S41.1Very low42.6Very low100 Ų100135.1 Ų135.170%0.69982%0.816SS**  cis-164.21462551.80000112.5
89F41.7Very low43Very low204 Ų204140.2 Ų140.290%0.89582%0.821SS**  trans30.2130.2138.5-73.2-92.1000122.3
90G40.2Very low43.4Very low80 Ų80146.8 Ų146.883%0.82583%0.825SS**  trans-18089.3158.300000113.7
91L46.8Very low43.9Very low169 Ų169152.5 Ų152.589%0.88583%0.829SS**  trans-68140.9173.4-83.4135.2000113.2
92A44.6Very low44.2Very low102 Ų102156.1 Ų156.184%0.84383%0.833SS**  trans147.6110.4145.500000108
93G40.3Very low44.2Very low84 Ų84159.6 Ų159.687%0.86684%0.838SS**  93.694.365.500000109
94G39.8Very low44.7Very low84 Ų84158 Ų15887%0.86683%0.832SS**  trans-177.696.2-179.400000114.7
95R42.9Very low44.9Very low236 Ų236158.7 Ų158.789%0.89183%0.83SS**  trans-70.2152.6-178.9-90.9-178.5-178.3-169.61.1114
96V41.8Very low45Very low117 Ų117155.6 Ų155.671%0.70983%0.827SS**  trans82.4113.8130.9169.20000119.4
97T47.3Very low45.6Very low124 Ų124153.8 Ų153.876%0.76183%0.829SS**  trans51.6110.3146.165.70000119.6
98R44.9Very low46Very low252 Ų252152.8 Ų152.895%0.95183%0.828SS**  trans-141.993.2133.1-118.7179-172.4-164.83111.7
99R48.3Very low46.4Very low237 Ų237154.3 Ų154.389%0.89483%0.833SS**  trans-41.6144.4150.3-99.1178.3168.6-176.3-2.8110.7
100R51.3Low46.8Very low233 Ų233151.4 Ų151.488%0.87983%0.826SS**  trans75.192139.1-161.9-175.8-156.9-1705.2116.7
101R48.8Very low47.5Very low239 Ų239151.9 Ų151.990%0.90282%0.823SS**  trans166.172.2132.5-100-174.4162.2-163.2-1.8111.3
102Q50.7Low48.1Very low187 Ų187148.8 Ų148.887%0.87482%0.815SS**SBendtrans-147.118.2159.1-69.4-161.2300114
103Q51.4Low49.3Very low201 Ų201145.9 Ų145.994%0.93979%0.789SS**SBendtrans-102.729.6175.2-76.4-173.1-15.100113.3
104A48.5Very low51.4Low80 Ų80145.4 Ų145.466%0.66177%0.769SS**SBendtrans-130.323.2-178.400000114.2
105H47.7Very low53.6Low168 Ų168146.3 Ų146.378%0.77876%0.759SS**SBendtrans-122.17.7172.7-66.3-55.2000114.1
106G47.8Very low55.7Low77 Ų77142.7 Ų142.779%0.79475%0.753SS**SBendtrans-85.1-2.9178.100000115.7
107A49.7Very low57.9Low87 Ų87142.5 Ų142.572%0.71974%0.744SS**SBendtrans-121.32-165.700000115.9
108I51.5Low59.9Low148 Ų148143.9 Ų143.976%0.75974%0.735SS**SBendtrans-119.4-0.8-174.3-54.9-179.1000113.3
109T49Very low62.1Low131 Ų131136.6 Ų136.680%0.80471%0.713SS**SBendtrans-113.137.3179.4-26.30000113.2
110L50.6Low64.3Low143 Ų143130.8 Ų130.875%0.74970%0.696SS**  trans-102.51.1170.1-74.2174.1000113.4S112L110-S112 PolarHBondContact O-N 3.37Å
111A53.1Low66.3Low91 Ų91125.6 Ų125.675%0.75268%0.68SS**THydrogen-bonded Turntrans-101.859.7-174.900000112.6
112S60.2Low68.5Low104 Ų104119.7 Ų119.773%0.72766%0.662SS**THydrogen-bonded Turntrans173.340.515446.80000112.9L110 T114L110-S112 PolarHBondContact O-N 3.37Å; S112-T114 PolarHBondContact O-N 2.9Å
113S70.3Confident70.6Confident41 Ų41118.7 Ų118.729%0.28765%0.651SS.*  trans-63.3117.3161.7530000107.9R118S113-R118 PolarHBondContact O-NE 3.49Å; S113-R118 WeakPolarHBondContact OG-CG 3.49Å; S113-R118 PolarHBondContact OG-NE 3.4Å
114T83.3Confident72.8Confident73 Ų73113.3 Ų113.345%0.44863%0.628SS.*  trans-57.3150.3176.462.40000108.7S112 Q116 Q117 R118S112-T114 PolarHBondContact O-N 2.9Å; T114-Q116 PolarHBondContact O-N 2.9Å; T114-Q116 VanDerWaalsContact O-N 3.09Å; T114-Q117 WeakPolarHBondContact O-CA 3.44Å; T114-Q117 WeakPolarHBondContact O-CB 3.39Å; T114-Q117 PolarHBondContact O-N 2.84Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.37Å; T114-Q117 PolarHBondContact OG1-N 3.34Å; T114-R118 PolarHBondContact O-N 3.31Å
115P85.9Confident75.1Confident103 Ų103113.5 Ų113.567%0.66962%0.615SS**Hα-helixtrans-54.1-33.318019.2-31.6000112.4R118 M119P115-R118 PolarHBondContact O-N 2.95Å; P115-M119 WeakPolarHBondContact O-CG 3.49Å; P115-M119 PolarHBondContact O-N 3.33Å; P115-M119 VanDerWaalsContact O-N 3.09Å
116Q86.8Confident77.4Confident160 Ų160109.5 Ų109.575%0.74860%0.602SS**Hα-helixtrans-65.3-40.7173.5-74.7164.7-22.800113T114 R118 M119 H120T114-Q116 PolarHBondContact O-N 2.9Å; T114-Q116 VanDerWaalsContact O-N 3.09Å; Q116-R118 VanDerWaalsContact C-N 3.34Å; Q116-R118 PolarHBondContact O-N 3.42Å; Q116-M119 PolarHBondContact O-N 3.09Å; Q116-H120 WeakPolarHBondContact O-CB 3.43Å; Q116-H120 PolarHBondContact O-N 3.01Å
117Q89.1Confident79.7Confident114 Ų114111.2 Ų111.253%0.53359%0.592SS.*Hα-helixtrans-67.4-34.9176.9-165.9179.715.300111.9T114 H120 K121T114-Q117 WeakPolarHBondContact O-CA 3.44Å; T114-Q117 WeakPolarHBondContact O-CB 3.39Å; T114-Q117 PolarHBondContact O-N 2.84Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.37Å; T114-Q117 PolarHBondContact OG1-N 3.34Å; Q117-H120 PolarHBondContact O-N 3.47Å; Q117-K121 WeakPolarHBondContact O-CB 3.49Å; Q117-K121 PolarHBondContact O-N 3.19Å
118R89.1Confident81.9Confident153 Ų153109.4 Ų109.458%0.57758%0.577SS**Hα-helixtrans-64.2-46.1173.2-64.2-176.2-167.8172.74.1111.6S113 T114 P115 Q116 H120 K121 Q122S113-R118 PolarHBondContact O-NE 3.49Å; S113-R118 WeakPolarHBondContact OG-CG 3.49Å; S113-R118 PolarHBondContact OG-NE 3.4Å; T114-R118 PolarHBondContact O-N 3.31Å; P115-R118 PolarHBondContact O-N 2.95Å; Q116-R118 VanDerWaalsContact C-N 3.34Å; Q116-R118 PolarHBondContact O-N 3.42Å; R118-H120 VanDerWaalsContact C-N 3.33Å; R118-H120 PolarHBondContact O-N 3.42Å; R118-K121 PolarHBondContact O-N 2.95Å; R118-Q122 WeakPolarHBondContact O-CB 3.3Å; R118-Q122 PolarHBondContact O-N 3.04Å
119M91Very high84.1Confident99 Ų99110.5 Ų110.549%0.48857%0.572SS.*Hα-helixtrans-61.1-41.7175.3-71.4-64.6-66.200111.9P115 Q116 Q122 R123P115-M119 WeakPolarHBondContact O-CG 3.49Å; P115-M119 PolarHBondContact O-N 3.33Å; P115-M119 VanDerWaalsContact O-N 3.09Å; Q116-M119 PolarHBondContact O-N 3.09Å; M119-Q122 PolarHBondContact O-N 3.31Å; M119-R123 WeakPolarHBondContact O-CG 3.41Å; M119-R123 PolarHBondContact O-N 3.47Å
120H93.7Very high86.2Confident114 Ų114107 Ų10753%0.52856%0.556SS.*Hα-helixtrans-63.9-45.1176.7-178.266.5000112Q116 Q117 R118 Q122 R123 I124Q116-H120 WeakPolarHBondContact O-CB 3.43Å; Q116-H120 PolarHBondContact O-N 3.01Å; Q117-H120 PolarHBondContact O-N 3.47Å; R118-H120 VanDerWaalsContact C-N 3.33Å; R118-H120 PolarHBondContact O-N 3.42Å; H120-Q122 VanDerWaalsContact C-N 3.34Å; H120-Q122 PolarHBondContact O-N 2.76Å; H120-R123 WeakPolarHBondContact O-CB 3.34Å; H120-R123 PolarHBondContact O-N 3.24Å; H120-I124 VanDerWaalsContact NE2-CD1 3.28Å; H120-I124 WeakPolarHBondContact NE2-CD1 3.42Å; H120-I124 WeakPolarHBondContact O-CG1 3.33Å; H120-I124 PolarHBondContact O-N 2.94Å
121K94.2Very high88.4Confident125 Ų125109.3 Ų109.354%0.54356%0.555SS.*Hα-helixtrans-60.7-43.1175.4-172.9177.5176.1-176.50111.6Q117 R118 R123 I124 E125Q117-K121 WeakPolarHBondContact O-CB 3.49Å; Q117-K121 PolarHBondContact O-N 3.19Å; R118-K121 PolarHBondContact O-N 2.95Å; K121-R123 PolarHBondContact O-N 3.45Å; K121-I124 PolarHBondContact O-N 3.49Å; K121-E125 WeakPolarHBondContact CE-OE1 3.49Å; K121-E125 WeakPolarHBondContact O-CG 3.36Å; K121-E125 PolarHBondContact O-N 3.26Å
122Q94.6Very high90.4Very high114 Ų114111.2 Ų111.253%0.53355%0.548SS..Hα-helixtrans-60.7-44.2175.2-171179.77.100111.6R118 M119 H120 I124 E125 T126R118-Q122 WeakPolarHBondContact O-CB 3.3Å; R118-Q122 PolarHBondContact O-N 3.04Å; M119-Q122 PolarHBondContact O-N 3.31Å; H120-Q122 VanDerWaalsContact C-N 3.34Å; H120-Q122 PolarHBondContact O-N 2.76Å; Q122-I124 VanDerWaalsContact C-N 3.35Å; Q122-I124 PolarHBondContact O-N 2.93Å; Q122-E125 PolarHBondContact O-N 2.89Å; Q122-T126 PolarHBondContact O-N 3.38Å; Q122-T126 PolarHBondContact O-OG1 3.11Å
123R95.2Very high92.1Very high166 Ų166111.6 Ų111.663%0.62654%0.542SS*.Hα-helixtrans-59.8-43.5175.4-73.4173.9-178.7-1790.9112.1M119 H120 K121 T126 L127M119-R123 WeakPolarHBondContact O-CG 3.41Å; M119-R123 PolarHBondContact O-N 3.47Å; H120-R123 WeakPolarHBondContact O-CB 3.34Å; H120-R123 PolarHBondContact O-N 3.24Å; K121-R123 PolarHBondContact O-N 3.45Å; R123-T126 PolarHBondContact O-N 2.89Å; R123-L127 WeakPolarHBondContact O-CB 3.45Å; R123-L127 WeakPolarHBondContact O-CG 3.48Å; R123-L127 PolarHBondContact O-N 2.91Å
124I97Very high93.3Very high89 Ų89111.4 Ų111.446%0.45655%0.547SS..Hα-helixtrans-62.5-45.6176.7-69.9171.4000110.7H120 K121 Q122 T126 L127 A128H120-I124 VanDerWaalsContact NE2-CD1 3.28Å; H120-I124 WeakPolarHBondContact NE2-CD1 3.42Å; H120-I124 WeakPolarHBondContact O-CG1 3.33Å; H120-I124 PolarHBondContact O-N 2.94Å; K121-I124 PolarHBondContact O-N 3.49Å; Q122-I124 VanDerWaalsContact C-N 3.35Å; Q122-I124 PolarHBondContact O-N 2.93Å; I124-T126 VanDerWaalsContact C-N 3.35Å; I124-T126 PolarHBondContact O-N 2.85Å; I124-L127 PolarHBondContact O-N 3.42Å; I124-A128 WeakPolarHBondContact O-CB 3.47Å; I124-A128 PolarHBondContact O-N 3.39Å
125E96.7Very high93.9Very high83 Ų83114.5 Ų114.539%0.38856%0.556SS.*Hα-helixtrans-62.7-41.6177.8-73.2176.4-165.400111.7K121 Q122 A128 R129K121-E125 WeakPolarHBondContact CE-OE1 3.49Å; K121-E125 WeakPolarHBondContact O-CG 3.36Å; K121-E125 PolarHBondContact O-N 3.26Å; Q122-E125 PolarHBondContact O-N 2.89Å; E125-A128 PolarHBondContact O-N 2.92Å; E125-R129 WeakPolarHBondContact O-CG 3.3Å; E125-R129 PolarHBondContact O-N 3.37Å
126T96.1Very high94.3Very high85 Ų85112.2 Ų112.252%0.52154%0.536SS..Hα-helixtrans-62-43.5174.3-55.90000111.4Q122 R123 I124 R129 A130Q122-T126 PolarHBondContact O-N 3.38Å; Q122-T126 PolarHBondContact O-OG1 3.11Å; R123-T126 PolarHBondContact O-N 2.89Å; I124-T126 VanDerWaalsContact C-N 3.35Å; I124-T126 PolarHBondContact O-N 2.85Å; T126-R129 PolarHBondContact O-N 3.09Å; T126-A130 WeakPolarHBondContact O-CB 3.45Å; T126-A130 PolarHBondContact O-N 3.49Å
127L97.1Very high94.4Very high112 Ų112108.5 Ų108.559%0.58652%0.521SS*.Hα-helixtrans-64.4-39.5176.3-75.1170.2000112.1R123 I124 A130 R131R123-L127 WeakPolarHBondContact O-CB 3.45Å; R123-L127 WeakPolarHBondContact O-CG 3.48Å; R123-L127 PolarHBondContact O-N 2.91Å; I124-L127 PolarHBondContact O-N 3.42Å; L127-A130 PolarHBondContact O-N 3.4Å; L127-R131 WeakPolarHBondContact O-CG 3.49Å; L127-R131 PolarHBondContact O-N 3.06Å
128A96.4Very high94.4Very high49 Ų49107 Ų10741%0.40552%0.523SS..Hα-helixtrans-63.5-45.3176.100000111.4I124 E125 R131 Q132I124-A128 WeakPolarHBondContact O-CB 3.47Å; I124-A128 PolarHBondContact O-N 3.39Å; E125-A128 PolarHBondContact O-N 2.92Å; A128-R131 PolarHBondContact O-N 3.25Å; A128-Q132 PolarHBondContact O-N 3.46Å
129R96.3Very high94.6Very high172 Ų172106.6 Ų106.665%0.64952%0.521SS*.Hα-helixtrans-62.8-42.2174.6-69.6-177.6-160.7-166.46.1111.9E125 T126 R131 Q132 L133E125-R129 WeakPolarHBondContact O-CG 3.3Å; E125-R129 PolarHBondContact O-N 3.37Å; T126-R129 PolarHBondContact O-N 3.09Å; R129-R131 VanDerWaalsContact C-N 3.33Å; R129-R131 PolarHBondContact O-N 2.94Å; R129-Q132 PolarHBondContact O-N 3.02Å; R129-L133 WeakPolarHBondContact O-CB 3.28Å; R129-L133 PolarHBondContact O-N 3.5Å
130A94.6Very high94.4Very high57 Ų57108.7 Ų108.747%0.47152%0.524SS..Hα-helixtrans-62.2-40.7177.300000111.8T126 L127 L133 G134T126-A130 WeakPolarHBondContact O-CB 3.45Å; T126-A130 PolarHBondContact O-N 3.49Å; L127-A130 PolarHBondContact O-N 3.4Å; A130-L133 PolarHBondContact O-N 3.07Å; A130-G134 PolarHBondContact O-N 2.82Å
131R95.8Very high93.9Very high191 Ų191107.5 Ų107.572%0.72152%0.521SS*.Hα-helixtrans-62.8-46.3173.9-77.2-179.4178.2176.5-0.2112.2L127 A128 R129 L133 G134 Q135L127-R131 WeakPolarHBondContact O-CG 3.49Å; L127-R131 PolarHBondContact O-N 3.06Å; A128-R131 PolarHBondContact O-N 3.25Å; R129-R131 VanDerWaalsContact C-N 3.33Å; R129-R131 PolarHBondContact O-N 2.94Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 3.31Å; R131-G134 PolarHBondContact O-N 2.94Å; R131-Q135 WeakPolarHBondContact O-CG 3.33Å; R131-Q135 PolarHBondContact O-N 3.37Å
132Q95.4Very high93.5Very high131 Ų131102.9 Ų102.961%0.61251%0.509SS*.Hα-helixtrans-60.6-42.5176.3-75.5-179.9-22.100111.8A128 R129 Q135 E136A128-Q132 PolarHBondContact O-N 3.46Å; R129-Q132 PolarHBondContact O-N 3.02Å; Q132-Q135 PolarHBondContact O-N 3.33Å; Q132-E136 PolarHBondContact O-N 3.43Å
133L96.4Very high93Very high112 Ų112101.8 Ų101.859%0.58651%0.507SS*.Hα-helixtrans-64.9-42.3177.2-172.8130.8000111.7R129 A130 R131 Q135 E136 I137R129-L133 WeakPolarHBondContact O-CB 3.28Å; R129-L133 PolarHBondContact O-N 3.5Å; A130-L133 PolarHBondContact O-N 3.07Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 3.31Å; L133-Q135 PolarHBondContact O-N 2.99Å; L133-E136 PolarHBondContact O-N 3.4Å; L133-I137 HydrophobicContact CD2-CD1 3.57Å; L133-I137 HydrophobicContact CG-CD1 4.2Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.41Å; L133-I137 PolarHBondContact O-N 2.9Å
134G95.4Very high92.1Very high38 Ų3898 Ų9839%0.39250%0.497SS..Hα-helixtrans-61.4-41.7173.900000112.9A130 R131 I137 S138A130-G134 PolarHBondContact O-N 2.82Å; R131-G134 PolarHBondContact O-N 2.94Å; G134-I137 PolarHBondContact O-N 3.26Å; G134-S138 WeakPolarHBondContact O-CB 3.19Å; G134-S138 PolarHBondContact O-N 3.31Å
135Q94.9Very high91.3Very high138 Ų13897 Ų9765%0.64550%0.501SS*.Hα-helixtrans-63.7-43.9174.8-74.2175.9-9.900111.9R131 Q132 L133 S138 R139R131-Q135 WeakPolarHBondContact O-CG 3.33Å; R131-Q135 PolarHBondContact O-N 3.37Å; Q132-Q135 PolarHBondContact O-N 3.33Å; L133-Q135 PolarHBondContact O-N 2.99Å; Q135-S138 PolarHBondContact O-N 2.94Å; Q135-R139 WeakPolarHBondContact O-CB 3.46Å; Q135-R139 PolarHBondContact O-N 3.24Å
136E94Very high90.6Very high54 Ų54100.6 Ų100.625%0.25252%0.518SS..Hα-helixtrans-65.4-39.9178.2-179.860.4-169.300112.1Q132 L133 R139 R140Q132-E136 PolarHBondContact O-N 3.43Å; L133-E136 PolarHBondContact O-N 3.4Å; E136-R139 VanDerWaalsContact CD-NH2 3.32Å; E136-R139 PolarHBondContact O-N 3.36Å; E136-R139 IonicContact OE1-CZ 3.27Å; E136-R139 IonicContact OE1-NE 3.07Å; E136-R139 IonicContact OE1-NH2 3.32Å; E136-R139 PolarHBondContact OE1-NH2 3.01Å; E136-R139 IonicContact OE2-CZ 2.64Å; E136-R139 VanDerWaalsContact OE2-CZ 3.32Å; E136-R139 IonicContact OE2-NE 3.68Å; E136-R139 PolarHBondContact OE2-NE 3.21Å; E136-R139 IonicContact OE2-NH2 3.72Å; E136-R139 PolarHBondContact OE2-NH2 2.84Å; E136-R140 WeakPolarHBondContact O-CG 3.26Å; E136-R140 PolarHBondContact O-N 3.37Å; E136-R140 IonicContact OE1-CZ 2.77Å; E136-R140 VanDerWaalsContact OE1-CZ 3.22Å; E136-R140 IonicContact OE1-NE 3.74Å; E136-R140 PolarHBondContact OE1-NE 3.48Å; E136-R140 IonicContact OE1-NH2 2.82Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å
137I89.5Confident89.9Confident82 Ų8299.9 Ų99.942%0.42152%0.521SS..Hα-helixtrans-63.6-45.2173.5-69169.7000110.3L133 G134 R139 R140 N141L133-I137 HydrophobicContact CD2-CD1 3.57Å; L133-I137 HydrophobicContact CG-CD1 4.2Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.41Å; L133-I137 PolarHBondContact O-N 2.9Å; G134-I137 PolarHBondContact O-N 3.26Å; I137-R139 VanDerWaalsContact C-N 3.3Å; I137-R139 PolarHBondContact O-N 2.91Å; I137-R140 PolarHBondContact O-N 3.21Å; I137-N141 WeakPolarHBondContact O-CB 3.45Å; I137-N141 VanDerWaalsContact O-CG 3.27Å; I137-N141 PolarHBondContact O-N 2.98Å
138S89.8Confident88.8Confident82 Ų8297.7 Ų97.757%0.57353%0.526SS*.Hα-helixtrans-60.7-40.4177-165.80000111.7G134 Q135 N141 G142G134-S138 WeakPolarHBondContact O-CB 3.19Å; G134-S138 PolarHBondContact O-N 3.31Å; Q135-S138 PolarHBondContact O-N 2.94Å; S138-N141 PolarHBondContact O-N 3.48Å; S138-G142 PolarHBondContact O-N 3.01Å
139R93.6Very high87.3Confident145 Ų14597.9 Ų97.955%0.54752%0.522SS..Hα-helixtrans-61.7-48175.5-172.1-179.374.7114.32.4111.4Q135 E136 I137 G142 L143Q135-R139 WeakPolarHBondContact O-CB 3.46Å; Q135-R139 PolarHBondContact O-N 3.24Å; E136-R139 VanDerWaalsContact CD-NH2 3.32Å; E136-R139 PolarHBondContact O-N 3.36Å; E136-R139 IonicContact OE1-CZ 3.27Å; E136-R139 IonicContact OE1-NE 3.07Å; E136-R139 IonicContact OE1-NH2 3.32Å; E136-R139 PolarHBondContact OE1-NH2 3.01Å; E136-R139 IonicContact OE2-CZ 2.64Å; E136-R139 VanDerWaalsContact OE2-CZ 3.32Å; E136-R139 IonicContact OE2-NE 3.68Å; E136-R139 PolarHBondContact OE2-NE 3.21Å; E136-R139 IonicContact OE2-NH2 3.72Å; E136-R139 PolarHBondContact OE2-NH2 2.84Å; I137-R139 VanDerWaalsContact C-N 3.3Å; I137-R139 PolarHBondContact O-N 2.91Å; R139-G142 PolarHBondContact O-N 3.47Å; R139-L143 WeakPolarHBondContact O-CG 3.43Å; R139-L143 PolarHBondContact O-N 3.48Å
140R86.7Confident85.6Confident144 Ų14491 Ų9154%0.54350%0.504SS..Hα-helixtrans-64.3-40.1177.1-72.9-177.3-170.6152.97.7112.7E136 I137 G142 L143 M144E136-R140 WeakPolarHBondContact O-CG 3.26Å; E136-R140 PolarHBondContact O-N 3.37Å; E136-R140 IonicContact OE1-CZ 2.77Å; E136-R140 VanDerWaalsContact OE1-CZ 3.22Å; E136-R140 IonicContact OE1-NE 3.74Å; E136-R140 PolarHBondContact OE1-NE 3.48Å; E136-R140 IonicContact OE1-NH2 2.82Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å; I137-R140 PolarHBondContact O-N 3.21Å; R140-G142 VanDerWaalsContact C-N 3.3Å; R140-G142 PolarHBondContact O-N 3.44Å; R140-L143 PolarHBondContact O-N 3.47Å; R140-M144 WeakPolarHBondContact O-CG 3.47Å; R140-M144 PolarHBondContact O-N 2.97Å
141N83.2Confident84.1Confident88 Ų8891 Ų9147%0.47151%0.509SS..Hα-helixtrans-63.6-38.4175.3-73.4-11.7000111.6I137 S138 M144 A145I137-N141 WeakPolarHBondContact O-CB 3.45Å; I137-N141 VanDerWaalsContact O-CG 3.27Å; I137-N141 PolarHBondContact O-N 2.98Å; S138-N141 PolarHBondContact O-N 3.48Å; N141-M144 PolarHBondContact O-N 3.45Å; N141-A145 WeakPolarHBondContact O-CB 3.41Å; N141-A145 PolarHBondContact O-N 3.4Å
142G85.7Confident82.5Confident28 Ų2888.2 Ų88.229%0.28950%0.503SS..Hα-helixtrans-59.5-50.6171.100000111.9S138 R139 R140 M144 A145 E146S138-G142 PolarHBondContact O-N 3.01Å; R139-G142 PolarHBondContact O-N 3.47Å; R140-G142 VanDerWaalsContact C-N 3.3Å; R140-G142 PolarHBondContact O-N 3.44Å; G142-M144 VanDerWaalsContact C-N 3.34Å; G142-M144 PolarHBondContact O-N 2.89Å; G142-A145 WeakPolarHBondContact O-CB 3.39Å; G142-A145 PolarHBondContact O-N 3.21Å; G142-A145 VanDerWaalsContact O-N 3.07Å; G142-E146 WeakPolarHBondContact O-CG 3.45Å; G142-E146 PolarHBondContact O-N 2.94Å
143L83.9Confident81.1Confident92 Ų9284.7 Ų84.748%0.48249%0.488SS..Hα-helixtrans-60.2-39.9177.5-68.4172.4000112.9R139 R140 A145 E146 A147R139-L143 WeakPolarHBondContact O-CG 3.43Å; R139-L143 PolarHBondContact O-N 3.48Å; R140-L143 PolarHBondContact O-N 3.47Å; L143-A145 VanDerWaalsContact C-N 3.33Å; L143-E146 PolarHBondContact O-N 2.9Å; L143-A147 VanDerWaalsContact O-CB 3.29Å; L143-A147 WeakPolarHBondContact O-CB 3.42Å; L143-A147 PolarHBondContact O-N 2.92Å
144M76.4Confident79.5Confident87 Ų8788.6 Ų88.643%0.42950%0.495SS..Hα-helixtrans-69.1-30.2175.6-71-157.9-59.600113R140 N141 G142R140-M144 WeakPolarHBondContact O-CG 3.47Å; R140-M144 PolarHBondContact O-N 2.97Å; N141-M144 PolarHBondContact O-N 3.45Å; G142-M144 VanDerWaalsContact C-N 3.34Å; G142-M144 PolarHBondContact O-N 2.89Å
145A79.3Confident78.3Confident66 Ų6689.8 Ų89.855%0.54550%0.498SS..Hα-helixtrans-73-43.7173.800000111.3N141 G142 L143 A147 G148N141-A145 WeakPolarHBondContact O-CB 3.41Å; N141-A145 PolarHBondContact O-N 3.4Å; G142-A145 WeakPolarHBondContact O-CB 3.39Å; G142-A145 PolarHBondContact O-N 3.21Å; G142-A145 VanDerWaalsContact O-N 3.07Å; L143-A145 VanDerWaalsContact C-N 3.33Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 3.32Å; A145-G148 PolarHBondContact O-N 2.97Å
146E82.7Confident77.3Confident160 Ų16088.2 Ų88.275%0.74849%0.49SS*.Hα-helixtrans-64.8-35.6177.4-73.2175.3-175.600112.6G142 L143 G148G142-E146 WeakPolarHBondContact O-CG 3.45Å; G142-E146 PolarHBondContact O-N 2.94Å; L143-E146 PolarHBondContact O-N 2.9Å; E146-G148 PolarHBondContact O-N 3.36Å; E146-G148 VanDerWaalsContact O-N 3.07Å
147A81.8Confident76.4Confident69 Ų6990.4 Ų90.457%0.5750%0.503SS*.THydrogen-bonded Turntrans-71.96.3175.900000114L143 A145 T149L143-A147 VanDerWaalsContact O-CB 3.29Å; L143-A147 WeakPolarHBondContact O-CB 3.42Å; L143-A147 PolarHBondContact O-N 2.92Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 3.32Å; A147-T149 VanDerWaalsContact CB-OG1 3.31Å; A147-T149 WeakPolarHBondContact CB-OG1 3.33Å; A147-T149 PolarHBondContact O-N 2.64Å; A147-T149 PolarHBondContact O-OG1 3.38Å; A147-T149 VanDerWaalsContact O-OG1 3.05Å
148G72.8Confident75.7Confident67 Ų6794.6 Ų94.669%0.69151%0.513SS*.THydrogen-bonded Turntrans64.25177.700000114.5A145 E146 G150A145-G148 PolarHBondContact O-N 2.97Å; E146-G148 PolarHBondContact O-N 3.36Å; E146-G148 VanDerWaalsContact O-N 3.07Å; G148-G150 PolarHBondContact O-N 3.34Å
149T64.4Low75.2Confident53 Ų5396.4 Ų96.433%0.32551%0.514SS..THydrogen-bonded Turntrans-85.4-1.4-172.4-4.70000112.2A147 G151 L153A147-T149 VanDerWaalsContact CB-OG1 3.31Å; A147-T149 WeakPolarHBondContact CB-OG1 3.33Å; A147-T149 PolarHBondContact O-N 2.64Å; A147-T149 PolarHBondContact O-OG1 3.38Å; A147-T149 VanDerWaalsContact O-OG1 3.05Å; T149-G151 VanDerWaalsContact C-N 3.32Å; T149-G151 PolarHBondContact O-N 3.08Å; T149-L153 HydrophobicContact CG2-CD1 3.56Å; T149-L153 HydrophobicContact CG2-CD2 4.43Å; T149-L153 HydrophobicContact CG2-CG 3.71Å; T149-L153 VanDerWaalsContact O-CB 3.27Å; T149-L153 WeakPolarHBondContact O-CB 3.45Å; T149-L153 WeakPolarHBondContact O-CG 3.27Å; T149-L153 PolarHBondContact O-N 3.05Å; T149-L153 VanDerWaalsContact O-N 3.1Å
150G61.4Low74.7Confident26 Ų2693.2 Ų93.227%0.26851%0.511SS..THydrogen-bonded Turntrans-66.9-20.5-172.100000116.1G148 R154G148-G150 PolarHBondContact O-N 3.34Å; G150-R154 WeakPolarHBondContact O-CD 3.46Å; G150-R154 WeakPolarHBondContact O-CG 3.39Å; G150-R154 PolarHBondContact O-NE 3.45Å
151G63.5Low74.4Confident57 Ų5789 Ų8959%0.58851%0.507SS*.THydrogen-bonded Turntrans-84.3-56177.100000112.7T149 R154T149-G151 VanDerWaalsContact C-N 3.32Å; T149-G151 PolarHBondContact O-N 3.08Å; G151-R154 PolarHBondContact O-N 3.04Å
152F62.4Low74.6Confident134 Ų13490.1 Ų90.159%0.58851%0.507SS*.Hα-helixtrans-71.1-40.1-175.8-176.1-98.8000113.1R154 S155 E156F152-R154 VanDerWaalsContact C-N 3.29Å; F152-R154 PolarHBondContact O-N 2.95Å; F152-S155 PolarHBondContact O-N 3.4Å; F152-S155 PolarHBondContact O-OG 2.9Å; F152-E156 HydrophobicContact CE1-CG 4Å; F152-E156 HydrophobicContact CE2-CG 4.49Å; F152-E156 HydrophobicContact CZ-CG 3.98Å; F152-E156 PolarHBondContact O-N 3.48Å; F152-E156 VanDerWaalsContact O-N 3.16Å
153L64.8Low75Confident57 Ų5794.2 Ų94.230%0.29852%0.522SS..Hα-helixtrans-68-29177-67.1179.3000112.1T149 L157T149-L153 HydrophobicContact CG2-CD1 3.56Å; T149-L153 HydrophobicContact CG2-CD2 4.43Å; T149-L153 HydrophobicContact CG2-CG 3.71Å; T149-L153 VanDerWaalsContact O-CB 3.27Å; T149-L153 WeakPolarHBondContact O-CB 3.45Å; T149-L153 WeakPolarHBondContact O-CG 3.27Å; T149-L153 PolarHBondContact O-N 3.05Å; T149-L153 VanDerWaalsContact O-N 3.1Å; L153-L157 HydrophobicContact CB-CD1 4.21Å; L153-L157 WeakPolarHBondContact O-CA 3.44Å; L153-L157 WeakPolarHBondContact O-CB 3.31Å; L153-L157 WeakPolarHBondContact O-CD1 3.42Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.06Å
154R64.1Low75.4Confident193 Ų19395.6 Ų95.673%0.72853%0.526SS*.Hα-helixtrans-69.6-38.4178.2-76.8-179.7-166.7-133.51.8112.1G150 G151 F152 R158G150-R154 WeakPolarHBondContact O-CD 3.46Å; G150-R154 WeakPolarHBondContact O-CG 3.39Å; G150-R154 PolarHBondContact O-NE 3.45Å; G151-R154 PolarHBondContact O-N 3.04Å; F152-R154 VanDerWaalsContact C-N 3.29Å; F152-R154 PolarHBondContact O-N 2.95Å; R154-R158 WeakPolarHBondContact O-CB 3.46Å; R154-R158 PolarHBondContact O-N 3.44Å
155S69.9Low76Confident64 Ų6494.2 Ų94.245%0.44853%0.528SS..Hα-helixtrans-68.5-45.6175.246.10000111.7F152 R158 M159F152-S155 PolarHBondContact O-N 3.4Å; F152-S155 PolarHBondContact O-OG 2.9Å; S155-R158 PolarHBondContact O-N 3.18Å; S155-M159 WeakPolarHBondContact O-CG 3.46Å; S155-M159 PolarHBondContact O-N 2.83Å
156E73.1Confident76.7Confident105 Ų10593.1 Ų93.149%0.49152%0.52SS..Hα-helixtrans-70.5-41178.8-71.6-141.3142.400113.1F152 R158 M159 T160F152-E156 HydrophobicContact CE1-CG 4Å; F152-E156 HydrophobicContact CE2-CG 4.49Å; F152-E156 HydrophobicContact CZ-CG 3.98Å; F152-E156 PolarHBondContact O-N 3.48Å; F152-E156 VanDerWaalsContact O-N 3.16Å; E156-R158 VanDerWaalsContact C-N 3.26Å; E156-R158 PolarHBondContact O-N 2.91Å; E156-M159 PolarHBondContact O-N 3.24Å; E156-M159 VanDerWaalsContact O-N 3.15Å; E156-T160 WeakPolarHBondContact O-CG2 3.32Å; E156-T160 PolarHBondContact O-N 3.45Å; E156-T160 PolarHBondContact O-OG1 3.1Å
157L75.4Confident77.2Confident99 Ų9989.1 Ų89.152%0.51850%0.504SS..Hα-helixtrans-63.6-34.5174-72.4168.8000111.4L153 T160 A161L153-L157 HydrophobicContact CB-CD1 4.21Å; L153-L157 WeakPolarHBondContact O-CA 3.44Å; L153-L157 WeakPolarHBondContact O-CB 3.31Å; L153-L157 WeakPolarHBondContact O-CD1 3.42Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.06Å; L157-T160 VanDerWaalsContact CA-OG1 3.26Å; L157-T160 WeakPolarHBondContact CA-OG1 3.26Å; L157-T160 PolarHBondContact O-OG1 3.02Å; L157-T160 VanDerWaalsContact O-OG1 3.06Å; L157-A161 WeakPolarHBondContact O-CB 3.47Å; L157-A161 PolarHBondContact O-N 3.36Å
158R75.7Confident77.8Confident170 Ų17089.4 Ų89.464%0.64250%0.495SS*.Hα-helixtrans-67.3-39.7173.7-172.3178-175.3-167.2-0.4111.4R154 S155 E156 K162R154-R158 WeakPolarHBondContact O-CB 3.46Å; R154-R158 PolarHBondContact O-N 3.44Å; S155-R158 PolarHBondContact O-N 3.18Å; E156-R158 VanDerWaalsContact C-N 3.26Å; E156-R158 PolarHBondContact O-N 2.91Å; R158-K162 WeakPolarHBondContact O-CB 3.44Å; R158-K162 VanDerWaalsContact O-CG 3.23Å; R158-K162 WeakPolarHBondContact O-CG 3.33Å; R158-K162 PolarHBondContact O-N 3.24Å
159M78.8Confident78.7Confident121 Ų12189.1 Ų89.160%0.59649%0.487SS*.Hα-helixtrans-68-44.7177.4-73.8-57.6-67.700112.2S155 E156 K162 L163S155-M159 WeakPolarHBondContact O-CG 3.46Å; S155-M159 PolarHBondContact O-N 2.83Å; E156-M159 PolarHBondContact O-N 3.24Å; E156-M159 VanDerWaalsContact O-N 3.15Å; M159-K162 PolarHBondContact O-N 2.82Å; M159-K162 HydrophobicContact SD-CD 4.29Å; M159-L163 WeakPolarHBondContact O-CB 3.34Å; M159-L163 PolarHBondContact O-N 2.93Å
160T81.9Confident80.2Confident78 Ų7895 Ų9548%0.47950%0.503SS..Hα-helixtrans-65.5-40175.550.90000111.9E156 L157 L163 Q164E156-T160 WeakPolarHBondContact O-CG2 3.32Å; E156-T160 PolarHBondContact O-N 3.45Å; E156-T160 PolarHBondContact O-OG1 3.1Å; L157-T160 VanDerWaalsContact CA-OG1 3.26Å; L157-T160 WeakPolarHBondContact CA-OG1 3.26Å; L157-T160 PolarHBondContact O-OG1 3.02Å; L157-T160 VanDerWaalsContact O-OG1 3.06Å; T160-L163 PolarHBondContact O-N 2.99Å; T160-Q164 WeakPolarHBondContact O-CB 3.46Å; T160-Q164 PolarHBondContact O-N 3.43Å
161A81.3Confident81.9Confident54 Ų54101.4 Ų101.445%0.44652%0.519SS..Hα-helixtrans-64.4-39.8173.400000112.4L157 Q164 A165L157-A161 WeakPolarHBondContact O-CB 3.47Å; L157-A161 PolarHBondContact O-N 3.36Å; A161-Q164 PolarHBondContact O-N 2.84Å; A161-A165 VanDerWaalsContact O-CB 3.27Å; A161-A165 WeakPolarHBondContact O-CB 3.49Å; A161-A165 PolarHBondContact O-N 2.86Å
162K87.8Confident83.3Confident112 Ų112100.3 Ų100.349%0.48750%0.504SS..Hα-helixtrans-62.8-45173.2-79.4176.5176.6-172.70111.4R158 M159 Q164 A165 A166R158-K162 WeakPolarHBondContact O-CB 3.44Å; R158-K162 VanDerWaalsContact O-CG 3.23Å; R158-K162 WeakPolarHBondContact O-CG 3.33Å; R158-K162 PolarHBondContact O-N 3.24Å; M159-K162 PolarHBondContact O-N 2.82Å; M159-K162 HydrophobicContact SD-CD 4.29Å; K162-Q164 VanDerWaalsContact C-N 3.35Å; K162-A165 PolarHBondContact O-N 3.47Å; K162-A166 WeakPolarHBondContact O-CB 3.41Å; K162-A166 PolarHBondContact O-N 2.87Å
163L93Very high84.9Confident114 Ų11495.9 Ų95.960%0.59749%0.492SS*.Hα-helixtrans-62.3-43.3177.6-170.476000111.2M159 T160 A166 N167M159-L163 WeakPolarHBondContact O-CB 3.34Å; M159-L163 PolarHBondContact O-N 2.93Å; T160-L163 PolarHBondContact O-N 2.99Å; L163-A166 PolarHBondContact O-N 3.25Å; L163-N167 PolarHBondContact O-N 3.12Å; L163-N167 PolarHBondContact O-ND2 3.25Å
164Q92.4Very high86.5Confident121 Ų12196.6 Ų96.657%0.56550%0.499SS*.Hα-helixtrans-64.6-46176.2-174.6171.4-0.600111.5T160 A161 K162 A166 N167 D168T160-Q164 WeakPolarHBondContact O-CB 3.46Å; T160-Q164 PolarHBondContact O-N 3.43Å; A161-Q164 PolarHBondContact O-N 2.84Å; K162-Q164 VanDerWaalsContact C-N 3.35Å; Q164-A166 VanDerWaalsContact C-N 3.28Å; Q164-A166 PolarHBondContact O-N 2.92Å; Q164-N167 PolarHBondContact O-N 3.11Å; Q164-N167 VanDerWaalsContact O-N 3.13Å; Q164-D168 WeakPolarHBondContact O-CB 3.47Å; Q164-D168 PolarHBondContact O-N 3.39Å
165A90.3Very high88.1Confident58 Ų5892.5 Ų92.548%0.47949%0.488SS..Hα-helixtrans-60.3-38.5175.700000112.1A161 K162 A169A161-A165 VanDerWaalsContact O-CB 3.27Å; A161-A165 WeakPolarHBondContact O-CB 3.49Å; A161-A165 PolarHBondContact O-N 2.86Å; K162-A165 PolarHBondContact O-N 3.47Å; A165-A169 VanDerWaalsContact O-CB 3.27Å; A165-A169 WeakPolarHBondContact O-CB 3.35Å; A165-A169 PolarHBondContact O-N 3.38Å
166A93.4Very high89.4Confident44 Ų4498.1 Ų98.136%0.36450%0.499SS..Hα-helixtrans-65.7-41.1174.500000112K162 L163 Q164 A169 R170K162-A166 WeakPolarHBondContact O-CB 3.41Å; K162-A166 PolarHBondContact O-N 2.87Å; L163-A166 PolarHBondContact O-N 3.25Å; Q164-A166 VanDerWaalsContact C-N 3.28Å; Q164-A166 PolarHBondContact O-N 2.92Å; A166-A169 PolarHBondContact O-N 3.48Å; A166-R170 WeakPolarHBondContact O-CG 3.4Å; A166-R170 PolarHBondContact O-N 3.44Å
167N93Very high90.5Very high76 Ų76102 Ų10241%0.40651%0.509SS..Hα-helixtrans-66.9-41.7175.7-77.3-31.1000112.5L163 Q164 A169 R170 R171L163-N167 PolarHBondContact O-N 3.12Å; L163-N167 PolarHBondContact O-ND2 3.25Å; Q164-N167 PolarHBondContact O-N 3.11Å; Q164-N167 VanDerWaalsContact O-N 3.13Å; N167-A169 VanDerWaalsContact C-N 3.33Å; N167-R170 WeakPolarHBondContact O-CB 3.42Å; N167-R170 PolarHBondContact O-N 3.24Å; N167-R171 PolarHBondContact O-N 3.26Å
168D94.1Very high91.5Very high75 Ų75101.3 Ų101.340%0.40151%0.506SS..Hα-helixtrans-64.8-39.8175.6-70.6-21.1000110.9Q164 R171 A172Q164-D168 WeakPolarHBondContact O-CB 3.47Å; Q164-D168 PolarHBondContact O-N 3.39Å; D168-R171 PolarHBondContact O-N 2.96Å; D168-A172 WeakPolarHBondContact O-CB 3.35Å; D168-A172 PolarHBondContact O-N 3.31Å
169A92Very high92.6Very high61 Ų6198.8 Ų98.850%0.50451%0.505SS..Hα-helixtrans-62.6-41.9173.600000112.1A165 A166 N167 A172 A173A165-A169 VanDerWaalsContact O-CB 3.27Å; A165-A169 WeakPolarHBondContact O-CB 3.35Å; A165-A169 PolarHBondContact O-N 3.38Å; A166-A169 PolarHBondContact O-N 3.48Å; N167-A169 VanDerWaalsContact C-N 3.33Å; A169-A172 PolarHBondContact O-N 2.86Å; A169-A173 WeakPolarHBondContact O-CB 3.33Å; A169-A173 PolarHBondContact O-N 2.85Å
170R95.4Very high93.5Very high176 Ų17695.3 Ų95.366%0.66450%0.496SS*.Hα-helixtrans-61.9-46.2174.3-75.1174179.4174.2-1.7111.5A166 N167 A173 V174A166-R170 WeakPolarHBondContact O-CG 3.4Å; A166-R170 PolarHBondContact O-N 3.44Å; N167-R170 WeakPolarHBondContact O-CB 3.42Å; N167-R170 PolarHBondContact O-N 3.24Å; R170-A173 PolarHBondContact O-N 3.15Å; R170-V174 WeakPolarHBondContact O-CG2 3.45Å; R170-V174 PolarHBondContact O-N 2.98Å
171R97.3Very high94.2Very high161 Ų16194.3 Ų94.361%0.60850%0.495SS*.Hα-helixtrans-60.9-47.4177.1-172.2-177.4-70.6156.4-2.2111.3N167 D168 A173 V174 E175N167-R171 PolarHBondContact O-N 3.26Å; D168-R171 PolarHBondContact O-N 2.96Å; R171-A173 VanDerWaalsContact C-N 3.27Å; R171-A173 PolarHBondContact O-N 2.93Å; R171-V174 PolarHBondContact O-N 3.24Å; R171-V174 VanDerWaalsContact O-N 3.15Å; R171-E175 WeakPolarHBondContact O-CG 3.4Å; R171-E175 PolarHBondContact O-N 3.42Å
172A94.1Very high95Very high33 Ų3398.7 Ų98.727%0.27350%0.504SS..Hα-helixtrans-61.9-34.6177.500000112.7D168 A169 R176D168-A172 WeakPolarHBondContact O-CB 3.35Å; D168-A172 PolarHBondContact O-N 3.31Å; A169-A172 PolarHBondContact O-N 2.86Å; A172-R176 VanDerWaalsContact O-CG 3.31Å; A172-R176 WeakPolarHBondContact O-CG 3.41Å; A172-R176 PolarHBondContact O-N 3.15Å; A172-R176 VanDerWaalsContact O-N 3.11Å
173A95.9Very high95.4Very high41 Ų41103.3 Ų103.334%0.33952%0.518SS..Hα-helixtrans-67.1-40.9174.900000112.1A169 R170 R171 R176 R177A169-A173 WeakPolarHBondContact O-CB 3.33Å; A169-A173 PolarHBondContact O-N 2.85Å; R170-A173 PolarHBondContact O-N 3.15Å; R171-A173 VanDerWaalsContact C-N 3.27Å; R171-A173 PolarHBondContact O-N 2.93Å; A173-R176 PolarHBondContact O-N 3.41Å; A173-R177 WeakPolarHBondContact O-CG 3.24Å; A173-R177 PolarHBondContact O-N 3.15Å; A173-R177 VanDerWaalsContact O-N 3.12Å
174V97.6Very high95.5Very high73 Ų73103 Ų10344%0.44252%0.516SS..Hα-helixtrans-63.5-47.3174.5173.80000110.7R170 R171 R176 R177 D178R170-V174 WeakPolarHBondContact O-CG2 3.45Å; R170-V174 PolarHBondContact O-N 2.98Å; R171-V174 PolarHBondContact O-N 3.24Å; R171-V174 VanDerWaalsContact O-N 3.15Å; V174-R176 VanDerWaalsContact C-N 3.27Å; V174-R176 PolarHBondContact O-N 2.92Å; V174-R177 WeakPolarHBondContact O-CA 3.35Å; V174-R177 WeakPolarHBondContact O-CB 3.38Å; V174-R177 PolarHBondContact O-N 3.01Å; V174-D178 PolarHBondContact O-N 3.33Å
175E97.8Very high95.7Very high106 Ų106100.1 Ų100.150%0.49551%0.51SS..Hα-helixtrans-58.2-39178-72.3173.7-173.300112.5R171 D178 L179R171-E175 WeakPolarHBondContact O-CG 3.4Å; R171-E175 PolarHBondContact O-N 3.42Å; E175-D178 PolarHBondContact O-N 3.48Å; E175-L179 WeakPolarHBondContact O-CB 3.44Å; E175-L179 VanDerWaalsContact O-CG 3.29Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 3.14Å
176R96.7Very high96.1Very high182 Ų182104.8 Ų104.869%0.68752%0.516SS*.Hα-helixtrans-64.7-40.8174.3-72.8175.7-166.31655.5112.3A172 A173 V174 D178 L179 A180A172-R176 VanDerWaalsContact O-CG 3.31Å; A172-R176 WeakPolarHBondContact O-CG 3.41Å; A172-R176 PolarHBondContact O-N 3.15Å; A172-R176 VanDerWaalsContact O-N 3.11Å; A173-R176 PolarHBondContact O-N 3.41Å; V174-R176 VanDerWaalsContact C-N 3.27Å; V174-R176 PolarHBondContact O-N 2.92Å; R176-D178 VanDerWaalsContact C-N 3.35Å; R176-L179 PolarHBondContact O-N 2.88Å; R176-A180 WeakPolarHBondContact O-CB 3.49Å; R176-A180 PolarHBondContact O-N 3.06Å
177R96.9Very high96.3Very high187 Ų187104.2 Ų104.271%0.70651%0.514SS*.Hα-helixtrans-63.3-43.1175.6-72.7176.9-179.9172.20.8110.7A173 V174 A180 A181A173-R177 WeakPolarHBondContact O-CG 3.24Å; A173-R177 PolarHBondContact O-N 3.15Å; A173-R177 VanDerWaalsContact O-N 3.12Å; V174-R177 WeakPolarHBondContact O-CA 3.35Å; V174-R177 WeakPolarHBondContact O-CB 3.38Å; V174-R177 PolarHBondContact O-N 3.01Å; R177-A180 PolarHBondContact O-N 3.29Å; R177-A181 WeakPolarHBondContact O-CB 3.47Å; R177-A181 PolarHBondContact O-N 2.88Å
178D97.3Very high96.5Very high85 Ų85104.8 Ų104.846%0.45552%0.517SS..Hα-helixtrans-65.3-40.9178.5-67.8-15.6000112.1V174 E175 R176 A181 K182V174-D178 PolarHBondContact O-N 3.33Å; E175-D178 PolarHBondContact O-N 3.48Å; R176-D178 VanDerWaalsContact C-N 3.35Å; D178-A181 PolarHBondContact O-N 2.95Å; D178-K182 WeakPolarHBondContact O-CB 3.5Å; D178-K182 VanDerWaalsContact O-CG 3.3Å; D178-K182 WeakPolarHBondContact O-CG 3.27Å; D178-K182 PolarHBondContact O-N 3.15Å
179L97.5Very high96.7Very high116 Ų116104.8 Ų104.861%0.60752%0.517SS*.Hα-helixtrans-64.3-40.2174.1-72.7172.6000112E175 R176 K182 R183E175-L179 WeakPolarHBondContact O-CB 3.44Å; E175-L179 VanDerWaalsContact O-CG 3.29Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 3.14Å; R176-L179 PolarHBondContact O-N 2.88Å; L179-K182 PolarHBondContact O-N 2.9Å; L179-R183 PolarHBondContact O-N 2.91Å
180A97.3Very high96.9Very high49 Ų49106.5 Ų106.541%0.40552%0.515SS..Hα-helixtrans-64.4-44.3174.600000111.4R176 R177 K182 R183 I184R176-A180 WeakPolarHBondContact O-CB 3.49Å; R176-A180 PolarHBondContact O-N 3.06Å; R177-A180 PolarHBondContact O-N 3.29Å; A180-K182 PolarHBondContact O-N 3.46Å; A180-R183 PolarHBondContact O-N 2.95Å; A180-I184 WeakPolarHBondContact O-CG1 3.4Å; A180-I184 PolarHBondContact O-N 3.33Å
181A97.4Very high97Very high56 Ų56101 Ų10146%0.46350%0.503SS..Hα-helixtrans-60.6-44.2176.200000111.7R177 D178 R183 I184 S185R177-A181 WeakPolarHBondContact O-CB 3.47Å; R177-A181 PolarHBondContact O-N 2.88Å; D178-A181 PolarHBondContact O-N 2.95Å; A181-R183 VanDerWaalsContact C-N 3.35Å; A181-R183 PolarHBondContact O-N 3.25Å; A181-I184 PolarHBondContact O-N 2.93Å; A181-S185 WeakPolarHBondContact O-CB 3.37Å; A181-S185 PolarHBondContact O-N 2.95Å
182K98Very high97.1Very high147 Ų147102 Ų10264%0.63951%0.507SS*.Hα-helixtrans-60-42.4174.3-75.3172.7-178.21760112.2D178 L179 A180 S185 Y186D178-K182 WeakPolarHBondContact O-CB 3.5Å; D178-K182 VanDerWaalsContact O-CG 3.3Å; D178-K182 WeakPolarHBondContact O-CG 3.27Å; D178-K182 PolarHBondContact O-N 3.15Å; L179-K182 PolarHBondContact O-N 2.9Å; A180-K182 PolarHBondContact O-N 3.46Å; K182-S185 PolarHBondContact O-N 3.06Å; K182-Y186 WeakPolarHBondContact O-CB 3.36Å; K182-Y186 PolarHBondContact O-N 3.32Å
183R96Very high97.3Very high208 Ų208105 Ų10579%0.78552%0.516SS*.Hα-helixtrans-63.9-41.7176.8-175.1178.1179.7-179.1-0.4112L179 A180 A181 G187L179-R183 PolarHBondContact O-N 2.91Å; A180-R183 PolarHBondContact O-N 2.95Å; A181-R183 VanDerWaalsContact C-N 3.35Å; A181-R183 PolarHBondContact O-N 3.25Å; R183-G187 PolarHBondContact O-N 3.46Å
184I95.3Very high97.3Very high108 Ų108106.9 Ų106.955%0.55452%0.52SS*.Hα-helixtrans-65.1-46176.3-67.5166.2000110.2A180 A181 Y186 G187 N188A180-I184 WeakPolarHBondContact O-CG1 3.4Å; A180-I184 PolarHBondContact O-N 3.33Å; A181-I184 PolarHBondContact O-N 2.93Å; I184-Y186 PolarHBondContact O-N 3.38Å; I184-G187 PolarHBondContact O-N 2.87Å; I184-N188 WeakPolarHBondContact O-CB 3.39Å; I184-N188 VanDerWaalsContact O-CG 3.25Å; I184-N188 PolarHBondContact O-N 3.07Å; I184-N188 PolarHBondContact O-ND2 3.38Å
185S97.4Very high97.4Very high61 Ų61107.5 Ų107.543%0.42752%0.52SS..Hα-helixtrans-57.2-49.6177-1670000111.3A181 K182 G187 N188 D189A181-S185 WeakPolarHBondContact O-CB 3.37Å; A181-S185 PolarHBondContact O-N 2.95Å; K182-S185 PolarHBondContact O-N 3.06Å; S185-G187 VanDerWaalsContact C-N 3.34Å; S185-G187 PolarHBondContact O-N 3.43Å; S185-N188 WeakPolarHBondContact O-CB 3.48Å; S185-N188 PolarHBondContact O-N 2.82Å; S185-N188 VanDerWaalsContact O-N 3.11Å; S185-D189 VanDerWaalsContact O-CG 3.27Å; S185-D189 PolarHBondContact O-N 3.01Å
186Y97.6Very high97.4Very high156 Ų156107 Ų10761%0.61252%0.517SS*.Hα-helixtrans-59.2-43.3177.8178.4-101.4000112.6K182 I184 N188 D189 Q190K182-Y186 WeakPolarHBondContact O-CB 3.36Å; K182-Y186 PolarHBondContact O-N 3.32Å; I184-Y186 PolarHBondContact O-N 3.38Å; Y186-N188 VanDerWaalsContact C-N 3.33Å; Y186-N188 PolarHBondContact O-N 3.33Å; Y186-D189 PolarHBondContact O-N 3.32Å; Y186-Q190 WeakPolarHBondContact O-CB 3.34Å; Y186-Q190 PolarHBondContact O-N 3.26Å
187G97.6Very high97.4Very high31 Ų31105.8 Ų105.832%0.3251%0.513SS..Hα-helixtrans-62.8-39175.300000112.8R183 I184 S185 Q190 S191R183-G187 PolarHBondContact O-N 3.46Å; I184-G187 PolarHBondContact O-N 2.87Å; S185-G187 VanDerWaalsContact C-N 3.34Å; S185-G187 PolarHBondContact O-N 3.43Å; G187-Q190 PolarHBondContact O-N 3.47Å; G187-S191 WeakPolarHBondContact O-CB 3.29Å; G187-S191 PolarHBondContact O-N 3.37Å
188N97.9Very high97.5Very high89 Ų89101.5 Ų101.548%0.47650%0.502SS..Hα-helixtrans-65.8-43175.7-71-17.8000111.7I184 S185 Y186 S191 R192I184-N188 WeakPolarHBondContact O-CB 3.39Å; I184-N188 VanDerWaalsContact O-CG 3.25Å; I184-N188 PolarHBondContact O-N 3.07Å; I184-N188 PolarHBondContact O-ND2 3.38Å; S185-N188 WeakPolarHBondContact O-CB 3.48Å; S185-N188 PolarHBondContact O-N 2.82Å; S185-N188 VanDerWaalsContact O-N 3.11Å; Y186-N188 VanDerWaalsContact C-N 3.33Å; Y186-N188 PolarHBondContact O-N 3.33Å; N188-S191 WeakPolarHBondContact O-CB 3.48Å; N188-S191 PolarHBondContact O-N 2.83Å; N188-R192 WeakPolarHBondContact O-CG 3.38Å; N188-R192 PolarHBondContact O-N 3.18Å
189D97.8Very high97.5Very high75 Ų75102.3 Ų102.340%0.40151%0.506SS..Hα-helixtrans-64.2-42.3177.6-65.1-28.1000111.2S185 Y186 S191 R192 Q193S185-D189 VanDerWaalsContact O-CG 3.27Å; S185-D189 PolarHBondContact O-N 3.01Å; Y186-D189 PolarHBondContact O-N 3.32Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.89Å; D189-R192 PolarHBondContact O-N 3.48Å; D189-Q193 WeakPolarHBondContact O-CG 3.27Å; D189-Q193 PolarHBondContact O-N 3.45Å
190Q97.3Very high97.5Very high96 Ų9699.3 Ų99.345%0.44949%0.49SS..Hα-helixtrans-62.3-41.4174.2-168.2-179.916.700111.8Y186 G187 Q193 N194Y186-Q190 WeakPolarHBondContact O-CB 3.34Å; Y186-Q190 PolarHBondContact O-N 3.26Å; G187-Q190 PolarHBondContact O-N 3.47Å; Q190-Q193 PolarHBondContact O-N 3.42Å; Q190-N194 VanDerWaalsContact O-CG 3.31Å; Q190-N194 PolarHBondContact O-N 2.9Å; Q190-N194 PolarHBondContact O-ND2 2.84Å
191S97.4Very high97.5Very high61 Ų61102 Ų10243%0.42749%0.494SS..Hα-helixtrans-62.9-45.5175-175.40000111.8G187 N188 D189 Q193 N194 I195G187-S191 WeakPolarHBondContact O-CB 3.29Å; G187-S191 PolarHBondContact O-N 3.37Å; N188-S191 WeakPolarHBondContact O-CB 3.48Å; N188-S191 PolarHBondContact O-N 2.83Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.89Å; S191-Q193 VanDerWaalsContact C-N 3.34Å; S191-Q193 PolarHBondContact O-N 2.98Å; S191-N194 PolarHBondContact O-N 3.39Å; S191-N194 VanDerWaalsContact O-N 3.16Å; S191-I195 WeakPolarHBondContact O-CG1 3.48Å; S191-I195 PolarHBondContact O-N 2.96Å
192R98Very high97.5Very high181 Ų181107.3 Ų107.368%0.68350%0.502SS*.Hα-helixtrans-57.3-46.4175.2-73.8174.7-174.1-104.52.6111.4N188 D189 N194 I195 Q196N188-R192 WeakPolarHBondContact O-CG 3.38Å; N188-R192 PolarHBondContact O-N 3.18Å; D189-R192 PolarHBondContact O-N 3.48Å; R192-N194 PolarHBondContact O-N 2.87Å; R192-I195 PolarHBondContact O-N 3.23Å; R192-Q196 WeakPolarHBondContact O-CB 3.5Å; R192-Q196 PolarHBondContact O-N 2.9Å
193Q97.8Very high97.4Very high98 Ų98105.8 Ų105.846%0.45850%0.497SS..Hα-helixtrans-61.3-42.5176.3-71.6-17913.500112.1D189 Q190 S191 Q196 R197D189-Q193 WeakPolarHBondContact O-CG 3.27Å; D189-Q193 PolarHBondContact O-N 3.45Å; Q190-Q193 PolarHBondContact O-N 3.42Å; S191-Q193 VanDerWaalsContact C-N 3.34Å; S191-Q193 PolarHBondContact O-N 2.98Å; Q193-Q196 PolarHBondContact O-N 3.18Å; Q193-R197 WeakPolarHBondContact O-CG 3.37Å; Q193-R197 PolarHBondContact O-N 3.49Å
194N97.4Very high97.4Very high79 Ų79102.4 Ų102.442%0.42248%0.484SS..Hα-helixtrans-64.2-42.3177.9-74.8-18.9000112.2Q190 S191 R192 R197 M198Q190-N194 VanDerWaalsContact O-CG 3.31Å; Q190-N194 PolarHBondContact O-N 2.9Å; Q190-N194 PolarHBondContact O-ND2 2.84Å; S191-N194 PolarHBondContact O-N 3.39Å; S191-N194 VanDerWaalsContact O-N 3.16Å; R192-N194 PolarHBondContact O-N 2.87Å; N194-R197 PolarHBondContact O-N 3.48Å; N194-M198 PolarHBondContact O-N 3.48Å
195I98.1Very high97.4Very high87 Ų87104.2 Ų104.245%0.44648%0.484SS..Hα-helixtrans-61.4-46.2175.2-68.6166.8000110.1S191 R192 R197 M198 L199S191-I195 WeakPolarHBondContact O-CG1 3.48Å; S191-I195 PolarHBondContact O-N 2.96Å; R192-I195 PolarHBondContact O-N 3.23Å; I195-R197 PolarHBondContact O-N 3.09Å; I195-M198 WeakPolarHBondContact O-CB 3.23Å; I195-M198 PolarHBondContact O-N 3.22Å; I195-L199 HydrophobicContact CG2-CD1 4.03Å; I195-L199 HydrophobicContact CG2-CG 4.36Å; I195-L199 WeakPolarHBondContact O-CG 3.31Å; I195-L199 PolarHBondContact O-N 3.34Å
196Q97.9Very high97.3Very high95 Ų95106.4 Ų106.444%0.44449%0.488SS..Hα-helixtrans-60.4-44.1178.6-170.1-179.56.400111.9R192 Q193 M198 L199 I200R192-Q196 WeakPolarHBondContact O-CB 3.5Å; R192-Q196 PolarHBondContact O-N 2.9Å; Q193-Q196 PolarHBondContact O-N 3.18Å; Q196-M198 VanDerWaalsContact C-N 3.33Å; Q196-M198 PolarHBondContact O-N 3.14Å; Q196-L199 PolarHBondContact O-N 3.38Å; Q196-I200 HydrophobicContact CG-CD1 4.13Å; Q196-I200 WeakPolarHBondContact O-CG1 3.27Å; Q196-I200 PolarHBondContact O-N 3.4Å
197R98Very high97.1Very high156 Ų156103.5 Ų103.559%0.58948%0.48SS*.Hα-helixtrans-59.8-43.3174.9-70.1176.6-159-178.67.6111.9Q193 N194 I195 I200 Q201Q193-R197 WeakPolarHBondContact O-CG 3.37Å; Q193-R197 PolarHBondContact O-N 3.49Å; N194-R197 PolarHBondContact O-N 3.48Å; I195-R197 PolarHBondContact O-N 3.09Å; R197-I200 PolarHBondContact O-N 2.96Å; R197-Q201 WeakPolarHBondContact O-CB 3.09Å; R197-Q201 PolarHBondContact O-N 3.39Å
198M97.9Very high96.9Very high97 Ų97108 Ų10848%0.47849%0.493SS..Hα-helixtrans-61.7-43.2175.4-96.5-142.9-60.400112.3N194 I195 Q196 Q201 R202N194-M198 PolarHBondContact O-N 3.48Å; I195-M198 WeakPolarHBondContact O-CB 3.23Å; I195-M198 PolarHBondContact O-N 3.22Å; Q196-M198 VanDerWaalsContact C-N 3.33Å; Q196-M198 PolarHBondContact O-N 3.14Å; M198-Q201 PolarHBondContact O-N 3.24Å; M198-R202 WeakPolarHBondContact O-CG 3.39Å; M198-R202 PolarHBondContact O-N 2.96Å
199L98Very high96.5Very high102 Ų102110 Ų11053%0.53450%0.499SS..Hα-helixtrans-62.7-45.9178.5-71.3173.7000111.3I195 Q196 Q201 R202 Q203I195-L199 HydrophobicContact CG2-CD1 4.03Å; I195-L199 HydrophobicContact CG2-CG 4.36Å; I195-L199 WeakPolarHBondContact O-CG 3.31Å; I195-L199 PolarHBondContact O-N 3.34Å; Q196-L199 PolarHBondContact O-N 3.38Å; L199-Q201 VanDerWaalsContact C-N 3.31Å; L199-Q201 PolarHBondContact O-N 2.91Å; L199-R202 PolarHBondContact O-N 3.26Å; L199-Q203 PolarHBondContact O-N 2.89Å
200I97.4Very high96.2Very high54 Ų54112 Ų11228%0.27751%0.506SS..Hα-helixtrans-60.3-42.2175.5-66.8166.5000110.8Q196 R197 Q203 R204Q196-I200 HydrophobicContact CG-CD1 4.13Å; Q196-I200 WeakPolarHBondContact O-CG1 3.27Å; Q196-I200 PolarHBondContact O-N 3.4Å; R197-I200 PolarHBondContact O-N 2.96Å; I200-Q203 PolarHBondContact O-N 2.91Å; I200-R204 WeakPolarHBondContact O-CG 3.36Å; I200-R204 PolarHBondContact O-N 2.82Å
201Q97.6Very high95.7Very high106 Ų106110.1 Ų110.150%0.49551%0.506SS..Hα-helixtrans-65.1-40.4178.5-168.9-179.523.400112.1R197 M198 L199 R205R197-Q201 WeakPolarHBondContact O-CB 3.09Å; R197-Q201 PolarHBondContact O-N 3.39Å; M198-Q201 PolarHBondContact O-N 3.24Å; L199-Q201 VanDerWaalsContact C-N 3.31Å; L199-Q201 PolarHBondContact O-N 2.91Å; Q201-R205 WeakPolarHBondContact O-CG 3.41Å; Q201-R205 PolarHBondContact O-N 2.9Å
202R96.8Very high95.2Very high166 Ų166113 Ų11363%0.62652%0.516SS*.Hα-helixtrans-64.2-43175.1-73.9-178.9-174.7-1731.8111.5M198 L199 R205 H206M198-R202 WeakPolarHBondContact O-CG 3.39Å; M198-R202 PolarHBondContact O-N 2.96Å; L199-R202 PolarHBondContact O-N 3.26Å; R202-R205 PolarHBondContact O-N 3.43Å; R202-H206 PolarHBondContact O-N 3.34Å
203Q96.3Very high94.3Very high116 Ų116107.2 Ų107.254%0.54251%0.508SS..Hα-helixtrans-59.5-49.4176.3-177.6177-100111.4L199 I200 R205 H206 E207L199-Q203 PolarHBondContact O-N 2.89Å; I200-Q203 PolarHBondContact O-N 2.91Å; Q203-R205 VanDerWaalsContact C-N 3.31Å; Q203-R205 PolarHBondContact O-N 2.94Å; Q203-H206 WeakPolarHBondContact O-CB 3.3Å; Q203-H206 PolarHBondContact O-N 2.9Å; Q203-H206 VanDerWaalsContact O-N 3.08Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.4Å; Q203-E207 PolarHBondContact NE2-OE1 3.3Å; Q203-E207 WeakPolarHBondContact O-CG 3.44Å; Q203-E207 PolarHBondContact O-N 3.41Å
204R96.4Very high93.4Very high136 Ų136105.8 Ų105.851%0.51351%0.513SS..Hα-helixtrans-59.4-39.3177-71.7-175.6-169.6-1682.5112.8I200 H206 E207 Q208I200-R204 WeakPolarHBondContact O-CG 3.36Å; I200-R204 PolarHBondContact O-N 2.82Å; R204-H206 VanDerWaalsContact C-N 3.35Å; R204-E207 PolarHBondContact O-N 3.31Å; R204-Q208 WeakPolarHBondContact O-CB 3.4Å; R204-Q208 VanDerWaalsContact O-CG 3.27Å; R204-Q208 WeakPolarHBondContact O-CG 3.26Å; R204-Q208 PolarHBondContact O-N 2.89Å
205R95.1Very high92.4Very high147 Ų147107.1 Ų107.156%0.55552%0.523SS*.Hα-helixtrans-64.9-40175.5-75.5-176.8-176.7-176.42.8111.8Q201 R202 Q203 Q208 Q209Q201-R205 WeakPolarHBondContact O-CG 3.41Å; Q201-R205 PolarHBondContact O-N 2.9Å; R202-R205 PolarHBondContact O-N 3.43Å; Q203-R205 VanDerWaalsContact C-N 3.31Å; Q203-R205 PolarHBondContact O-N 2.94Å; R205-Q208 PolarHBondContact O-N 3.46Å; R205-Q209 WeakPolarHBondContact O-CB 3.44Å; R205-Q209 VanDerWaalsContact O-CG 3.3Å; R205-Q209 WeakPolarHBondContact O-CG 3.47Å; R205-Q209 PolarHBondContact O-N 3.41Å
206H94.1Very high91.1Very high107 Ų107109.1 Ų109.150%0.49554%0.539SS..Hα-helixtrans-65.2-44.1177.1-166-84.1000111.5R202 Q203 R204 Q209 Q210R202-H206 PolarHBondContact O-N 3.34Å; Q203-H206 WeakPolarHBondContact O-CB 3.3Å; Q203-H206 PolarHBondContact O-N 2.9Å; Q203-H206 VanDerWaalsContact O-N 3.08Å; R204-H206 VanDerWaalsContact C-N 3.35Å; H206-Q209 PolarHBondContact O-N 3.46Å; H206-Q210 PolarHBondContact CE1-NE2 2.99Å; H206-Q210 PolarHBondContact ND1-NE2 2.89Å; H206-Q210 WeakPolarHBondContact O-CG 3.36Å; H206-Q210 PolarHBondContact O-N 3.3Å
207E94.4Very high89.4Confident95 Ų95108.3 Ų108.344%0.44455%0.549SS..Hα-helixtrans-62.2-41.9174.5-71167.5-17400111.8Q203 R204 Q210 A211Q203-E207 WeakPolarHBondContact CG-OE1 3.4Å; Q203-E207 PolarHBondContact NE2-OE1 3.3Å; Q203-E207 WeakPolarHBondContact O-CG 3.44Å; Q203-E207 PolarHBondContact O-N 3.41Å; R204-E207 PolarHBondContact O-N 3.31Å; E207-Q210 PolarHBondContact O-N 3.47Å; E207-A211 WeakPolarHBondContact O-CB 3.15Å; E207-A211 PolarHBondContact O-N 2.9Å
208Q92.4Very high87.4Confident126 Ų126105.2 Ų105.259%0.58955%0.551SS**Hα-helixtrans-62.6-42.1174-76.6175.9-2.400112.3R204 R205 A211 L212R204-Q208 WeakPolarHBondContact O-CB 3.4Å; R204-Q208 VanDerWaalsContact O-CG 3.27Å; R204-Q208 WeakPolarHBondContact O-CG 3.26Å; R204-Q208 PolarHBondContact O-N 2.89Å; R205-Q208 PolarHBondContact O-N 3.46Å; Q208-A211 PolarHBondContact O-N 2.85Å; Q208-L212 VanDerWaalsContact O-CG 3.31Å; Q208-L212 WeakPolarHBondContact O-CG 3.07Å; Q208-L212 PolarHBondContact O-N 3.35Å
209Q91.3Very high85.4Confident131 Ų131106.1 Ų106.161%0.61257%0.565SS**Hα-helixtrans-64.1-40.9175.8-75.2175.6-1.700111.6R205 H206 L212 A213R205-Q209 WeakPolarHBondContact O-CB 3.44Å; R205-Q209 VanDerWaalsContact O-CG 3.3Å; R205-Q209 WeakPolarHBondContact O-CG 3.47Å; R205-Q209 PolarHBondContact O-N 3.41Å; H206-Q209 PolarHBondContact O-N 3.46Å; Q209-L212 PolarHBondContact O-N 3.36Å; Q209-A213 WeakPolarHBondContact O-CB 3.38Å; Q209-A213 PolarHBondContact O-N 3.34Å
210Q89.6Confident83.3Confident117 Ų117105.9 Ų105.955%0.54758%0.577SS.*Hα-helixtrans-64.2-43.1174.4-75.2-175.8-10.300112.2H206 E207 L212 A213 A214H206-Q210 PolarHBondContact CE1-NE2 2.99Å; H206-Q210 PolarHBondContact ND1-NE2 2.89Å; H206-Q210 WeakPolarHBondContact O-CG 3.36Å; H206-Q210 PolarHBondContact O-N 3.3Å; E207-Q210 PolarHBondContact O-N 3.47Å; Q210-L212 PolarHBondContact O-N 3.37Å; Q210-A213 PolarHBondContact O-N 2.95Å; Q210-A214 WeakPolarHBondContact O-CB 3.05Å; Q210-A214 PolarHBondContact O-N 2.92Å
211A87.3Confident81.4Confident55 Ų55107.5 Ų107.546%0.45560%0.598SS.*Hα-helixtrans-62.7-42.3177.400000111.9E207 Q208 A214 T215E207-A211 WeakPolarHBondContact O-CB 3.15Å; E207-A211 PolarHBondContact O-N 2.9Å; Q208-A211 PolarHBondContact O-N 2.85Å; A211-A214 PolarHBondContact O-N 2.93Å; A211-T215 PolarHBondContact O-N 3.33Å; A211-T215 PolarHBondContact O-OG1 2.85Å
212L87.1Confident79.4Confident121 Ų121108.7 Ų108.763%0.63462%0.616SS**Hα-helixtrans-64.6-43.3175.1-70.4172.1000111.7Q208 Q209 Q210 A214 T215 V216Q208-L212 VanDerWaalsContact O-CG 3.31Å; Q208-L212 WeakPolarHBondContact O-CG 3.07Å; Q208-L212 PolarHBondContact O-N 3.35Å; Q209-L212 PolarHBondContact O-N 3.36Å; Q210-L212 PolarHBondContact O-N 3.37Å; L212-A214 PolarHBondContact O-N 3.13Å; L212-T215 PolarHBondContact O-N 2.85Å; L212-V216 WeakPolarHBondContact O-CG2 3.08Å; L212-V216 PolarHBondContact O-N 3.34Å; L212-V216 VanDerWaalsContact O-N 3.12Å
213A80.5Confident77.3Confident61 Ų61106.3 Ų106.350%0.50462%0.624SS.*Hα-helixtrans-62.5-40.7176.300000112.4Q209 Q210 T215 V216 A217Q209-A213 WeakPolarHBondContact O-CB 3.38Å; Q209-A213 PolarHBondContact O-N 3.34Å; Q210-A213 PolarHBondContact O-N 2.95Å; A213-T215 VanDerWaalsContact C-N 3.32Å; A213-T215 PolarHBondContact O-N 3.29Å; A213-V216 PolarHBondContact O-N 3.49Å; A213-A217 WeakPolarHBondContact O-CB 3.03Å; A213-A217 PolarHBondContact O-N 2.94Å; A213-A217 VanDerWaalsContact O-N 3.09Å
214A77.4Confident75.1Confident68 Ų68106.2 Ų106.256%0.56264%0.636SS**Hα-helixtrans-65.5-33.7175.800000112.7Q210 A211 L212Q210-A214 WeakPolarHBondContact O-CB 3.05Å; Q210-A214 PolarHBondContact O-N 2.92Å; A211-A214 PolarHBondContact O-N 2.93Å; L212-A214 PolarHBondContact O-N 3.13Å
215T76.1Confident72.9Confident106 Ų106106.7 Ų106.765%0.6565%0.649SS**Hα-helixtrans-70.1-37.4177.2-47.80000111.6A211 L212 A213A211-T215 PolarHBondContact O-N 3.33Å; A211-T215 PolarHBondContact O-OG1 2.85Å; L212-T215 PolarHBondContact O-N 2.85Å; A213-T215 VanDerWaalsContact C-N 3.32Å; A213-T215 PolarHBondContact O-N 3.29Å
216V71.7Confident71Confident129 Ų129103.8 Ų103.878%0.78265%0.651SS**Hα-helixtrans-74.6-27.8177.81770000112.2L212 A213 S218L212-V216 WeakPolarHBondContact O-CG2 3.08Å; L212-V216 PolarHBondContact O-N 3.34Å; L212-V216 VanDerWaalsContact O-N 3.12Å; A213-V216 PolarHBondContact O-N 3.49Å; V216-S218 VanDerWaalsContact C-N 3.33Å; V216-S218 PolarHBondContact O-N 3.48Å
217A62.3Low68.7Low79 Ų79108.4 Ų108.465%0.65367%0.666SS**THydrogen-bonded Turntrans-82.9-1.7179.500000114.5A213 P219A213-A217 WeakPolarHBondContact O-CB 3.03Å; A213-A217 PolarHBondContact O-N 2.94Å; A213-A217 VanDerWaalsContact O-N 3.09Å; A217-P219 VanDerWaalsContact O-CD 3.23Å; A217-P219 WeakPolarHBondContact O-CD 3.47Å
218S54.8Low66.2Low90 Ų90112.1 Ų112.163%0.62968%0.683SS**SBendtrans-80.3109.8173.3-158.10000109.3V216 A220V216-S218 VanDerWaalsContact C-N 3.33Å; V216-S218 PolarHBondContact O-N 3.48Å; S218-A220 PolarHBondContact O-N 3.49Å; S218-A220 VanDerWaalsContact O-N 3.15Å
219P56.3Low64.3Low117 Ų117112.1 Ų112.176%0.7669%0.691SS**  trans-65.7119.3-178.726.4-31.8000109.2A217 A221A217-P219 VanDerWaalsContact O-CD 3.23Å; A217-P219 WeakPolarHBondContact O-CD 3.47Å; P219-A221 PolarHBondContact O-N 3.37Å
220A54.5Low62Low96 Ų96111.5 Ų111.579%0.79370%0.702SS**  trans-52.7110.917100000109.2S218S218-A220 PolarHBondContact O-N 3.49Å; S218-A220 VanDerWaalsContact O-N 3.15Å
221A57.9Low60.2Low88 Ų88113.2 Ų113.273%0.72771%0.713SS**  trans-59.8126.5164.200000107.6P219 S223P219-A221 PolarHBondContact O-N 3.37Å; A221-S223 PolarHBondContact O-N 3.16Å
222P56Low57.9Low132 Ų132114.6 Ų114.686%0.85772%0.724SS**  trans-74.4113.3177.628.9-31.2000108.5
223S52.6Low56.1Low116 Ų116117.7 Ų117.781%0.81174%0.736SS**  trans-120.7120.5161.864.70000110.4A221A221-S223 PolarHBondContact O-N 3.16Å
224S48.3Very low54.3Low113 Ų113122.9 Ų122.979%0.7975%0.749SS**  trans-61.3137.3178.6-68.20000113.1
225N52Low52.7Low146 Ų146124.7 Ų124.778%0.78176%0.756SS**  trans54.4123.2139.4-75.3-12.4000122.3
226S54.4Low51.4Low86 Ų86126 Ų12660%0.60176%0.763SS**  trans68.4126.713676.40000116.1
227Y45.3Very low50.1Low204 Ų204125.9 Ų125.980%0.876%0.763SS**  cis-160.2163.240.3-86.5-89000110.6
228Q43.1Very low49.2Very low173 Ų173132.7 Ų132.781%0.80877%0.772SS**  trans58.3104.9145.6-77.5-178-21.300120.8
229V52.3Low48.8Very low126 Ų126133.6 Ų133.676%0.76478%0.776SS**  16112.4121.4-172.30000116.4
230S41.6Very low48.3Very low118 Ų118139.6 Ų139.683%0.82578%0.783SS**  trans-144.3111.8141.7-79.30000109.1A232S230-A232 PolarHBondContact O-N 2.87Å; S230-A232 VanDerWaalsContact O-N 3.15Å
231I51.8Low48Very low153 Ų153141.7 Ų141.779%0.78578%0.776SS**  trans-69.1100.6170.7-65.2166000106.6
232A40.8Very low47.5Very low84 Ų84145.3 Ų145.369%0.69478%0.778SS**  trans-104.9104.2164.100000107.8S230 Q234S230-A232 PolarHBondContact O-N 2.87Å; S230-A232 VanDerWaalsContact O-N 3.15Å; A232-Q234 PolarHBondContact O-N 3.15Å
233Q49.3Very low47.2Very low187 Ų187146.2 Ų146.287%0.87477%0.765SS**  trans-58.9100.8163.8-72.1174.82.200107.8
234Q41.3Very low47Very low169 Ų169145.6 Ų145.679%0.7976%0.757SS**  trans-84.3131.7162.8-75.3-149.6-2.500109A232 V236A232-Q234 PolarHBondContact O-N 3.15Å; Q234-V236 PolarHBondContact O-N 3.03Å
235P44.5Very low47Very low107 Ų107145.1 Ų145.170%0.69575%0.745SS**  trans-65.5128.6176.726.4-31.2000109.1T237P235-T237 PolarHBondContact O-N 3.37Å
236V47.9Very low47Very low134 Ų134143.7 Ų143.781%0.81274%0.738SS**  trans-62.286.7169.61790000108.2Q234 R238Q234-V236 PolarHBondContact O-N 3.03Å; V236-R238 VanDerWaalsContact C-N 3.32Å; V236-R238 PolarHBondContact O-N 3.38Å
237T44.3Very low47Very low125 Ų125143.1 Ų143.177%0.76773%0.733SS**  trans-72.395.5160.137.40000106.7P235 P239P235-T237 PolarHBondContact O-N 3.37Å; T237-P239 WeakPolarHBondContact O-CD 3.45Å; T237-P239 VanDerWaalsContact O-N 3.14Å
238R44.3Very low47.5Very low222 Ų222140 Ų14084%0.83873%0.726SS**  trans-46.4120.3163.3-84.8178.4170162.1-2.8107.8V236 R240V236-R238 VanDerWaalsContact C-N 3.32Å; V236-R238 PolarHBondContact O-N 3.38Å; R238-R240 PolarHBondContact O-N 2.87Å
239P46.7Very low48Very low110 Ų110137.5 Ų137.571%0.71471%0.714SS**  trans-64.2109162.70.213.8000104.8T237 H241T237-P239 WeakPolarHBondContact O-CD 3.45Å; T237-P239 VanDerWaalsContact O-N 3.14Å; P239-H241 PolarHBondContact O-N 3.03Å
240R45.4Very low48.3Very low242 Ų242136.5 Ų136.591%0.91370%0.701SS**  trans-63.996.9168.8-154.6-173.9-168.8-164.83.7104.7R238 E242R238-R240 PolarHBondContact O-N 2.87Å; R240-E242 PolarHBondContact O-N 2.89Å
241H49.3Very low49.2Very low141 Ų141137.3 Ų137.365%0.65369%0.692SS**  trans-58106.3-179-112.77.3000108.6P239 Y243P239-H241 PolarHBondContact O-N 3.03Å; H241-Y243 HydrophobicContact CB-CD2 3.81Å; H241-Y243 AromaticContact CD2-CD2 3.37Å; H241-Y243 WeakPolarHBondContact CD2-CD2 3.47Å; H241-Y243 AromaticContact CD2-CE2 3.21Å; H241-Y243 WeakPolarHBondContact CD2-CE2 3.42Å; H241-Y243 AromaticContact CG-CD2 3.66Å; H241-Y243 AromaticContact CG-CE2 3.92Å; H241-Y243 AromaticContact NE2-CE2 3.55Å; H241-Y243 PolarHBondContact O-N 3.06Å
242E47Very low49.4Very low164 Ų164136.4 Ų136.477%0.76668%0.684SS**  trans-61.176.2159.9-70.1168.316400108R240 T244R240-E242 PolarHBondContact O-N 2.89Å; E242-T244 VanDerWaalsContact C-N 3.33Å
243Y48.8Very low50.1Low151 Ų151137.9 Ų137.959%0.59268%0.68SS**  trans-91.83.1179.1-119.3-98000112.6H241H241-Y243 HydrophobicContact CB-CD2 3.81Å; H241-Y243 AromaticContact CD2-CD2 3.37Å; H241-Y243 WeakPolarHBondContact CD2-CD2 3.47Å; H241-Y243 AromaticContact CD2-CE2 3.21Å; H241-Y243 WeakPolarHBondContact CD2-CE2 3.42Å; H241-Y243 AromaticContact CG-CD2 3.66Å; H241-Y243 AromaticContact CG-CE2 3.92Å; H241-Y243 AromaticContact NE2-CE2 3.55Å; H241-Y243 PolarHBondContact O-N 3.06Å
244T49.9Very low50.4Low103 Ų103133.7 Ų133.763%0.63266%0.663SS**SBendtrans-94.2-31.2-177.6470000113.6E242 C247E242-T244 VanDerWaalsContact C-N 3.33Å; T244-C247 PolarHBondContact O-N 3.48Å
245D47.4Very low51Low103 Ų103128.3 Ų128.355%0.55165%0.647SS**Hα-helixtrans-77.7-32.5-172.7-78.96.7000113.5C247 Q248 Q249D245-C247 PolarHBondContact O-N 3.43Å; D245-Q248 PolarHBondContact O-N 3.32Å; D245-Q249 PolarHBondContact O-N 2.93Å; D245-Q249 VanDerWaalsContact O-N 3.12Å
246N52.3Low51.4Low115 Ų115128 Ų12862%0.61564%0.643SS**Hα-helixtrans-68.7-22.7176.5-110.7-40.6000113.1Q250N246-Q250 PolarHBondContact O-N 3.27Å
247C53Low51.4Low75 Ų75126.3 Ų126.351%0.50763%0.633SS.*Hα-helixtrans-81.3-28.9178.7-147.40000112.1T244 D245 Q251T244-C247 PolarHBondContact O-N 3.48Å; D245-C247 PolarHBondContact O-N 3.43Å; C247-Q251 PolarHBondContact O-N 2.86Å
248Q55.9Low51.5Low138 Ų138124.8 Ų124.865%0.64563%0.628SS**Hα-helixtrans-75.7-43.4172.9-80.1-177.8-6.500111.5D245 Q250 Q251 E252D245-Q248 PolarHBondContact O-N 3.32Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.4Å; Q248-Q251 PolarHBondContact O-N 3.27Å; Q248-Q251 VanDerWaalsContact O-N 3.08Å; Q248-E252 PolarHBondContact O-N 2.99Å
249Q55.5Low51.6Low121 Ų121122 Ų12257%0.56562%0.624SS**Hα-helixtrans-66.4-30.9179.7-153.1173.437.400112.7D245 L253D245-Q249 PolarHBondContact O-N 2.93Å; D245-Q249 VanDerWaalsContact O-N 3.12Å; Q249-L253 PolarHBondContact O-N 2.77Å; Q249-L253 VanDerWaalsContact O-N 3.1Å
250Q57.9Low51.5Low105 Ų105128 Ų12849%0.49163%0.633SS.*Hα-helixtrans-71.7-32.6171-97.8-175.211.900113.8N246 Q248 L254N246-Q250 PolarHBondContact O-N 3.27Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.4Å; Q250-L254 WeakPolarHBondContact O-CD1 3.27Å; Q250-L254 WeakPolarHBondContact O-CG 3.35Å; Q250-L254 PolarHBondContact O-N 3.37Å
251Q60.1Low51.5Low134 Ų134121.5 Ų121.563%0.62662%0.624SS**Hα-helixtrans-71.2-35.7173.9-78.4-177.930.300111.6C247 Q248 L254 A255C247-Q251 PolarHBondContact O-N 2.86Å; Q248-Q251 PolarHBondContact O-N 3.27Å; Q248-Q251 VanDerWaalsContact O-N 3.08Å; Q251-L254 PolarHBondContact O-N 2.97Å; Q251-A255 WeakPolarHBondContact O-CB 3.45Å; Q251-A255 PolarHBondContact O-N 3.07Å
252E56.6Low51.4Low134 Ų134120.7 Ų120.763%0.62663%0.63SS**Hα-helixtrans-69.1-40.3177.5-155.6169.5-160.200111.7Q248 L254 A255 V256Q248-E252 PolarHBondContact O-N 2.99Å; E252-L254 VanDerWaalsContact C-N 3.33Å; E252-L254 PolarHBondContact O-N 3.04Å; E252-A255 PolarHBondContact O-N 3.24Å; E252-V256 VanDerWaalsContact O-CG2 3.25Å; E252-V256 WeakPolarHBondContact O-CG2 3.41Å; E252-V256 PolarHBondContact O-N 2.87Å
253L55.2Low51.3Low116 Ų116122 Ų12261%0.60764%0.635SS**Hα-helixtrans-65.2-32.6172.5-86.7156.9000113.3Q249 T257Q249-L253 PolarHBondContact O-N 2.77Å; Q249-L253 VanDerWaalsContact O-N 3.1Å; L253-T257 WeakPolarHBondContact O-CG2 3.42Å; L253-T257 PolarHBondContact O-N 2.82Å; L253-T257 PolarHBondContact O-OG1 2.81Å
254L55.3Low51.1Low98 Ų98124.3 Ų124.351%0.51365%0.652SS.*Hα-helixtrans-76.4-35.4175.6-77.3163.1000112.3Q250 Q251 E252 T257 S258Q250-L254 WeakPolarHBondContact O-CD1 3.27Å; Q250-L254 WeakPolarHBondContact O-CG 3.35Å; Q250-L254 PolarHBondContact O-N 3.37Å; Q251-L254 PolarHBondContact O-N 2.97Å; E252-L254 VanDerWaalsContact C-N 3.33Å; E252-L254 PolarHBondContact O-N 3.04Å; L254-T257 PolarHBondContact O-N 3.4Å; L254-T257 PolarHBondContact O-OG1 3.37Å; L254-S258 PolarHBondContact O-N 2.8Å
255A53.8Low50.5Low56 Ų56123.1 Ų123.146%0.46366%0.66SS.*Hα-helixtrans-63.9-42.417300000111.7Q251 E252 T257 S258 E259Q251-A255 WeakPolarHBondContact O-CB 3.45Å; Q251-A255 PolarHBondContact O-N 3.07Å; E252-A255 PolarHBondContact O-N 3.24Å; A255-T257 VanDerWaalsContact C-N 3.27Å; A255-T257 PolarHBondContact O-N 3.43Å; A255-S258 PolarHBondContact O-N 2.95Å; A255-E259 PolarHBondContact O-N 3.25Å
256V52.7Low50Low101 Ų101126.1 Ų126.161%0.61268%0.676SS**Hα-helixtrans-66-27.2178.1172.80000112.6E252E252-V256 VanDerWaalsContact O-CG2 3.25Å; E252-V256 WeakPolarHBondContact O-CG2 3.41Å; E252-V256 PolarHBondContact O-N 2.87Å
257T49Very low49.3Very low98 Ų98127.7 Ų127.760%0.60168%0.679SS**Hα-helixtrans-83.2-15.2173.357.30000114.3L253 L254 A255L253-T257 WeakPolarHBondContact O-CG2 3.42Å; L253-T257 PolarHBondContact O-N 2.82Å; L253-T257 PolarHBondContact O-OG1 2.81Å; L254-T257 PolarHBondContact O-N 3.4Å; L254-T257 PolarHBondContact O-OG1 3.37Å; A255-T257 VanDerWaalsContact C-N 3.27Å; A255-T257 PolarHBondContact O-N 3.43Å
258S44.9Very low48.8Very low93 Ų93132.3 Ų132.365%0.6570%0.698SS**Hα-helixtrans-83-22178.6-165.90000113L254 A255L254-S258 PolarHBondContact O-N 2.8Å; A255-S258 PolarHBondContact O-N 2.95Å
259E47.1Very low48.2Very low164 Ų164132.1 Ų132.177%0.76670%0.697SS**THydrogen-bonded Turntrans-87.5-5.4-178.5-64.9-166.9163.500114A255A255-E259 PolarHBondContact O-N 3.25Å
260R44.8Very low47.2Very low236 Ų236134.9 Ų134.989%0.89171%0.712SS**THydrogen-bonded Turntrans-100.213.3-175.7-142.9177.7-173.2-179.92.2115.2
261S44.2Very low46.2Very low105 Ų105137.3 Ų137.373%0.73472%0.723SS**SBendtrans-124.234.5-176.8-169.10000113.6
262T48.8Very low45.2Very low125 Ų125137.5 Ų137.577%0.76774%0.738SS**  trans-133.59.7173.931.10000115.1
263E45.1Very low44.2Very low190 Ų190139.5 Ų139.589%0.88875%0.747SS**  trans-108.279.9176-75-171.8155.400112.1
264Q43.3Very low43.8Very low201 Ų201137.5 Ų137.594%0.93976%0.755SS**  trans-173.9108.6143.8-110.4176.44.400109.2
265G37.4Very low42.7Very low77 Ų77142.1 Ų142.179%0.79477%0.774SS**SBendtrans162.261.6175.100000115
266D37.6Very low42.1Very low166 Ų166144.6 Ų144.689%0.88879%0.788SS**  trans55.8102.3148.9-67.6-15.4000122L268D266-L268 PolarHBondContact O-N 2.86Å
267H38Very low41.7Very low149 Ų149150.4 Ų150.469%0.6980%0.8SS**  trans-53.2109.6149.7-167.3-75.2000113Q269H267-Q269 PolarHBondContact CE1-OE1 3.16Å
268L42.2Very low41.3Very low172 Ų172151.3 Ų151.390%0.90181%0.811SS**  trans-127.7101147-84.3176.2000109.7D266D266-L268 PolarHBondContact O-N 2.86Å
269Q42.2Very low41.5Very low133 Ų133155.6 Ų155.662%0.62182%0.82SS**  trans-61.4122.1166.5-175177.2200109.2H267H267-Q269 PolarHBondContact CE1-OE1 3.16Å
270M35.9Very low41Very low180 Ų180156.9 Ų156.989%0.88783%0.826SS**  trans-131.2111.9162.3-96.3-75.7-7100107.9
271E35.3Very low40.8Very low156 Ų156150.5 Ų150.573%0.72982%0.818SS**  trans-61.7131.2-175.8-68.1166.5146.400111E273E271-E273 PolarHBondContact O-N 3.07Å
272C39.6Very low40.8Very low137 Ų137154.7 Ų154.793%0.92682%0.823SS**  trans-82.496.9158.3-87.10000108
273E36.6Very low40.1Very low176 Ų176157.3 Ų157.382%0.82283%0.827SS**  trans-129120.7154.9-72.8-164.6162.300109.2E271E271-E273 PolarHBondContact O-N 3.07Å
274G46Very low39.7Very low75 Ų75153.3 Ų153.377%0.77382%0.82SS**  trans-74.2140.2175.500000111
275Q33.2Very low39.4Very low194 Ų194151.1 Ų151.191%0.90782%0.815SS**  trans-149.7135.1155.9-104.5167.838.200110.6
276S40.7Very low39.6Very low108 Ų108155 Ų15576%0.75582%0.817SS**  trans-28.7147.1175.3-68.40000120.1
277Y44.2Very low39.9Very low223 Ų223152.7 Ų152.788%0.87581%0.812SS**  trans37.2110.4137-79.3-95.3000118.9
278S40.2Very low40.1Very low118 Ų118154 Ų15483%0.82582%0.824SS**  -154.2130.7124.458.10000111.1
279E50Low40Very low182 Ų182150.7 Ų150.785%0.8582%0.821SS**  trans-64.8124.8166.4-63.7169.6134.300108.8
280Q35.6Very low39.8Very low191 Ų191153.4 Ų153.489%0.89383%0.834SS**  trans-171.2122.5145-109.3163.531.800113.6
281S41.2Very low40.1Very low103 Ų103150 Ų15072%0.7283%0.828SS**  trans67.493.6138.8-150.50000119H283S281-H283 PolarHBondContact O-N 3.37Å
282F43Very low40.6Very low192 Ų192150.6 Ų150.684%0.84283%0.833SS**  trans-50120.9152.3-79.5-96.3000111.3
283H35.4Very low40.6Very low180 Ų180152 Ų15283%0.83383%0.831SS**  trans-145.6102.1145.4-91.27.5000108.1S281S281-H283 PolarHBondContact O-N 3.37Å
284S37.1Very low41.2Very low106 Ų106151.6 Ų151.674%0.74183%0.829SS**  trans-66.2127172.8-59.70000110.4
285N35.3Very low41.4Very low156 Ų156155 Ų15583%0.83483%0.829SS**  trans-113.483.7163.5-91.2-26000108.3
286D42.4Very low42.2Very low157 Ų157153.3 Ų153.384%0.8483%0.826SS**  trans-103.995.3157.8-92.3-29.2000106.8
287C43.6Very low42.4Very low118 Ų118155 Ų15580%0.79783%0.826SS**  trans-152.863.2174.4-91.60000110.9
288L43.3Very low42.5Very low178 Ų178147.9 Ų147.993%0.93282%0.821SS**  trans-148.373.5157.6-79.2-177000110.2
289A39.3Very low42.8Very low101 Ų101151 Ų15184%0.83582%0.823SS**  trans-124113.215300000107.1S291A289-S291 PolarHBondContact O-N 2.99Å
290Q38.4Very low42.8Very low191 Ų191151 Ų15189%0.89382%0.822SS**  trans-61119.9-177.9-79.3164.9-18.500110.6M292Q290-M292 PolarHBondContact O-N 3.47Å
291S42.3Very low43.3Very low109 Ų109150.3 Ų150.376%0.76282%0.819SS**  trans-63.4113.5156.2164.30000108.9A289A289-S291 PolarHBondContact O-N 2.99Å
292M45.1Very low43.7Very low168 Ų168152.3 Ų152.383%0.82882%0.821SS**  trans-147.690.9153.1-83.8-136.1-89.200106Q290Q290-M292 PolarHBondContact O-N 3.47Å
293D40.1Very low43.9Very low167 Ų167150.8 Ų150.889%0.89382%0.816SS**  trans-167.271.1157.9-83.3-33000106.8
294E48.5Very low44.4Very low167 Ų167152.3 Ų152.378%0.7882%0.816SS**  trans-111.7141.9155.6-77.6-167.9165.700108.1
295D50.8Low45Very low145 Ų145152.5 Ų152.578%0.77581%0.813SS**  trans7895.9165.9-50.8-29.8000116.6
296L50.1Low45.5Very low159 Ų159155 Ų15583%0.83281%0.811SS**  -172.4136.8124.3-92.2168.5000109.8
297D44.8Very low45.6Very low144 Ų144156.2 Ų156.277%0.7781%0.811SS**  trans10537.3158.3-46.4-23.9000119.8E299D297-E299 PolarHBondContact O-N 2.9Å
298G46.2Very low45.8Very low74 Ų74162 Ų16276%0.76382%0.816SS**THydrogen-bonded Turntrans-88.135.8170.100000116.8
299E46.8Very low45.9Very low184 Ų184164.5 Ų164.586%0.8681%0.813SS**THydrogen-bonded Turntrans-121.8-7-177.7-72-89.8153.300114.7D297D297-E299 PolarHBondContact O-N 2.9Å
300E48.7Very low46.1Very low180 Ų180167.3 Ų167.384%0.84181%0.814SS**SBendtrans-96.6-11.7-175.9-157.3167.4-168.500114.1
301E47.3Very low46.3Very low177 Ų177161.5 Ų161.583%0.82781%0.805SS**SBendtrans-88-13.1-175.2-158.3173.2177.100114.3
302L48.8Very low46.5Very low145 Ų145164.1 Ų164.176%0.75981%0.811SS**SBendtrans-89.4-9.1-177.7-91.8160.8000114.9
303E48.4Very low46.4Very low160 Ų160160.3 Ų160.375%0.74881%0.806SS**SBendtrans-91.2-21.8-179.8-162.1161.3-158.500112.9T305E303-T305 PolarHBondContact O-N 3.27Å
304Y45.8Very low46.6Very low212 Ų212159.7 Ų159.783%0.83180%0.802SS**THydrogen-bonded Turntrans-78.6-18.5-177.9-150.2-100.1000114.1
305T49.5Very low46.2Very low110 Ų110161.5 Ų161.568%0.67581%0.811SS**THydrogen-bonded Turntrans-91.2-5.6-179.827.10000114.4E303E303-T305 PolarHBondContact O-N 3.27Å
306R46.1Very low45.7Very low210 Ų210162.9 Ų162.979%0.79281%0.813SS**SBendtrans-88.9-16.5-178.7-138.2178-158.9172.76.4114.7
307H44.4Very low46Very low182 Ų182159.9 Ų159.984%0.84380%0.803SS**THydrogen-bonded Turntrans-92.86.7-176.6-93.3-47000115.9
308R46.3Very low45.5Very low240 Ų240161.4 Ų161.491%0.90681%0.805SS**THydrogen-bonded Turntrans-108.911.4-177-137.4-177-177.3176.81.7115.2
309R46.9Very low45.1Very low230 Ų230169.8 Ų169.887%0.86881%0.814SS**SBendtrans-126.55.6-173.3-106.8-170.5-164.3178.86.8117.8
310D42.9Very low44.6Very low160 Ų160170.4 Ų170.486%0.85682%0.817SS**  trans-123.868.5-179-63.5-30.8000111.3
311G42.1Very low43.8Very low68 Ų68167 Ų16770%0.70181%0.813SS**  trans-160.247.818000000113.9
312D46Very low43Very low165 Ų165163.7 Ų163.788%0.88281%0.808SS**  trans-152.7139.4161.4-91.8-33.7000108.5
313A43.3Very low42.2Very low87 Ų87163.6 Ų163.672%0.71981%0.807SS**  trans91.2116.8-170.300000112.6
314D44.3Very low41.4Very low154 Ų154161.3 Ų161.382%0.82480%0.804SS**  cis-159.7138.523.4-75.2-54.5000108.8
315E39.9Very low40.7Very low205 Ų205156.7 Ų156.796%0.95880%0.798SS**  trans-168.6111.7142.4-108.3-178.5-162.200111.2
316E42Very low40.1Very low175 Ų175158.6 Ų158.682%0.81880%0.803SS**  trans-130.9167.8164.5-124.5-108.9136.600104.8
317P54.6Low39.4Very low95 Ų95155.2 Ų155.262%0.61780%0.801SS**  cis-130.2-163.6-3.711.217.4000112.7
318E36.3Very low38.9Very low176 Ų176154.3 Ų154.382%0.82280%0.795SS**  trans103.789.3157.3-63.6-168.3155.300116.3
319R37.1Very low38.2Very low251 Ų251150.5 Ų150.595%0.94779%0.787SS**  -149.2101.2121.9-70.7-154.5173.2169.1-1.8111
320Q36.4Very low37.5Very low196 Ų196150.6 Ų150.692%0.91679%0.788SS**  trans-64.8144.1153.7-71.3171.3-6.300109.7
321S32.2Very low37.2Very low108 Ų108147.7 Ų147.776%0.75578%0.78SS**  141.3135.7130-168.50000113.6
322C29.6Very low36.8Very low108 Ų108150 Ų15073%0.7378%0.781SS**  trans84.8124.6172.4-58.90000116
323L31.9Very low36.2Very low143 Ų143150 Ų15075%0.74978%0.78SS**  cis-174128.60.5-119152.9000106.4
324V32.7Very low35.7Very low112 Ų112150.3 Ų150.368%0.67978%0.783SS**  trans55.4102.2132.2170.80000118.4
325T30.9Very low35Very low116 Ų116147.2 Ų147.271%0.71278%0.778SS**  76143.680590000117.9
326L36.1Very low34.7Very low149 Ų149144.2 Ų144.278%0.7877%0.774SS**  trans89.7125.8165.9-58.7172.2000115.7
327N32.1Very low34.2Very low140 Ų140141.6 Ų141.675%0.74978%0.775SS**  cis-149.5142.428.3-77.6-54.9000109.4
328K33Very low34.1Very low162 Ų162142.4 Ų142.470%0.70478%0.78SS**  82.197.357.3-163.3163.8-172.7170.40115.2
329E33Very low34.2Very low160 Ų160142.2 Ų142.275%0.74878%0.784SS**  trans51.4124.2134.1-61.5172.1171.400122.8
330R31.5Very low34Very low232 Ų232137.3 Ų137.388%0.87578%0.776SS**  177118.7118.8-103179.2164.8-177.4-4.1109.8
331S35.8Very low33.8Very low99 Ų99134.8 Ų134.869%0.69277%0.767SS**  67.3136.886-64.30000113.1
332T33.5Very low34.1Very low117 Ų117140.9 Ų140.972%0.71877%0.773SS**  cis175.4157.83.323.20000107.6
333L33.5Very low34.3Very low165 Ų165146.1 Ų146.186%0.86478%0.777SS**  trans84.4121.1146.5-70.5157.2000122.9
334A32.6Very low34.5Very low94 Ų94146.4 Ų146.478%0.77778%0.784SS**  147.9105.7124.700000109.6
335A31Very low34.8Very low88 Ų88149 Ų14973%0.72779%0.786SS**  87.9136.757.400000115.3
336T33.9Very low35.3Very low143 Ų143148.9 Ų148.988%0.87779%0.791SS**  trans88.3139.6166.878.80000117.9
337S30.8Very low35.3Very low119 Ų119146.9 Ų146.983%0.83279%0.789SS**  cis-176165.4-22.2-1510000107.2
338P51.7Low35.7Very low112 Ų112148.1 Ų148.173%0.72779%0.794SS**  trans-114.5175.6-152.543.3-36.8000117.4
339L38.9Very low35.9Very low172 Ų172147.4 Ų147.490%0.90180%0.798SS**  trans-160.3119.4155.4-86.4168.8000106
340D32.4Very low36.1Very low148 Ų148145.1 Ų145.179%0.79180%0.8SS**  cis89.5130.544.8-151.920.6000116.6
341M33.3Very low36.5Very low144 Ų144143.9 Ų143.971%0.70980%0.796SS**  trans83.8108.4161.6-60.7-136.4-67.900123.5
342R38.8Very low36.4Very low235 Ų235150.9 Ų150.989%0.88781%0.808SS**  152.5104.9116-80.7178.4-163.5-177.25.8108.8
343R32.7Very low36.6Very low219 Ų219153 Ų15383%0.82681%0.807SS**  61.892.561.6-155.6-170.4-147.7-146.310.8114.3
344V37.2Very low36.9Very low148 Ų148151.7 Ų151.790%0.89781%0.806SS**  trans-144.9133136-179.30000109.2
345K38.5Very low37.3Very low166 Ų166154.2 Ų154.272%0.72280%0.802SS**  trans-95.6148.6-179.4-78.1167.2160.6-178.40110.7
346S40.3Very low37.4Very low114 Ų114158.4 Ų158.480%0.79781%0.811SS**  -178.2107.8128.851.70000107.3
347S36.3Very low37.4Very low107 Ų107156.8 Ų156.875%0.74881%0.805SS**  64.996.360.7-169.70000113
348I41.8Very low39Very low166 Ų166156.7 Ų156.785%0.85180%0.802SS**  -168.2123.5116.1-107.5160.6000111.5
349D37.4Very low38.1Very low147 Ų147159.6 Ų159.679%0.78681%0.81SS**  trans-70.5155.4167.8-72-55.6000111.6
350S36.9Very low37.8Very low112 Ų112155.3 Ų155.378%0.78380%0.8SS**  169.1125.1101.3-171.30000113.1
351Y38.1Very low37.8Very low206 Ų206154.3 Ų154.381%0.80880%0.804SS**  trans-46.4150.1159-77.7-105.9000114.4
352R35.6Very low37.7Very low247 Ų247150.4 Ų150.493%0.93280%0.801SS**  -151.7123.6125.4-114.9-175.9-168.6-165.54112.7
353K36.9Very low37.6Very low160 Ų160145.1 Ų145.170%0.69680%0.8SS**  trans-96.8131.7172.4173.5178.4-175.5175.10107.4H355K353-H355 WeakPolarHBondContact CE-NE2 3.29Å
354T40.2Very low37.6Very low139 Ų139140.6 Ų140.685%0.85379%0.792SS**  trans-146.4118.3157.440.80000110
355H41.4Very low37.3Very low147 Ų147143.8 Ų143.868%0.68179%0.788SS**  trans-70.8154.2160.8-71.8-102.3000110.2K353K353-H355 WeakPolarHBondContact CE-NE2 3.29Å
356L33.1Very low37Very low175 Ų175142 Ų14292%0.91679%0.791SS**  177.8137.1125.9-91.6153.7000110.3
357S32.7Very low36.7Very low110 Ų110147.4 Ų147.477%0.76979%0.794SS**  trans-101.5-157177.9-54.60000110.3
358P65.4Low36.7Very low116 Ų116148.7 Ų148.775%0.75380%0.797SS**  -122-172-102.937.4-17.1000112.9
359L31.9Very low36.6Very low173 Ų173147 Ų14791%0.90679%0.794SS**  trans147.6151.6159.5-82.3152000106.7
360A33.1Very low36.2Very low82 Ų82143.7 Ų143.768%0.67879%0.794SS**  cis172.7175.6-9.200000105.5
361S31.8Very low35.9Very low128 Ų128142 Ų14290%0.89580%0.795SS**  trans86.4124.8167.6-150.10000114.8
362G32.5Very low35.8Very low61 Ų61136.6 Ų136.663%0.62979%0.793SS**  cis131.5151.618.700000109.2
363S35.4Very low35.8Very low125 Ų125134.4 Ų134.487%0.87479%0.793SS**  trans94.3113.3175.3-30.40000114.9
364N32.9Very low35.7Very low123 Ų123132 Ų13266%0.65880%0.797SS**  cis96.2136.828.8-151.111.3000115.1
365W30.9Very low35.5Very low215 Ų215131 Ų13181%0.81480%0.795SS**  trans79134.2173.2-45.4100.4000116.5
366V33.3Very low35.4Very low128 Ų128130.5 Ų130.578%0.77680%0.802SS**  -158.6141.451.7166.60000111.9V368V366-V368 HydrophobicContact CG1-CG2 4.3Å
367R33.5Very low35.6Very low228 Ų228129.9 Ų129.986%0.8680%0.798SS**  trans-84.4131.3171177.9-171.2-82.8179.7-7.3109.7
368V36.7Very low35.5Very low134 Ų134127.8 Ų127.881%0.81279%0.794SS**  trans-123.7130.9165.5175.90000110.2V366V366-V368 HydrophobicContact CG1-CG2 4.3Å
369V38Very low34.1Very low132 Ų132127.7 Ų127.780%0.880%0.796SS**  trans-98.7143.1179.11680000109.1
370G30.7Very low34.5Very low76 Ų76128.3 Ų128.378%0.78479%0.794SS**  trans168.7131.1162.300000107.5
371G30.4Very low35.3Very low77 Ų77132.8 Ų132.879%0.79480%0.801SS**  cis143.4130.122.700000105.2
372A36.1Very low36.3Very low93 Ų93132.8 Ų132.877%0.76980%0.798SS**  trans-53.5159.2-165.500000117.2
373Q36Very low36.5Very low201 Ų201135.6 Ų135.694%0.93981%0.807SS**  -168.6142.7118.9-101.4171.162.300114.3
374S34.6Very low36.5Very low110 Ų110132.9 Ų132.977%0.76980%0.8SS**  trans-62.6156.5-178.4-55.30000115.2
375S34.7Very low36.8Very low117 Ų117133.9 Ų133.982%0.81881%0.81SS**  trans-150.3123.2137.746.10000111.1
376T39.5Very low37.5Very low136 Ų136130 Ų13083%0.83481%0.81SS**  trans-94.2124.1178.3-42.80000107.6
377I36.7Very low38.5Very low163 Ų163129 Ų12984%0.83681%0.807SS**  trans-131.1121.6166.2-63.1-179.4000108.3
378G31.6Very low39.5Very low65 Ų65123.6 Ų123.667%0.6780%0.8SS**PPolyproline II helixtrans-70.9137.9-172.500000113.7
379S35.8Very low40.3Very low114 Ų114122.9 Ų122.980%0.79780%0.799SS**PPolyproline II helixtrans-85.2116.9168.372.30000109.9
380H40.2Very low40.8Very low187 Ų187124.9 Ų124.987%0.86680%0.804SS**PPolyproline II helixtrans-79.5121.2160.6-78.3-88.4000109.2
381Q49.8Very low41.2Very low176 Ų176127.9 Ų127.982%0.82280%0.802SS**PPolyproline II helixtrans-72.2155.8159.7-74.2-167.6-34.100110
382P52.4Low41.5Very low128 Ų128130.9 Ų130.983%0.83180%0.8SS**  trans-127.414713129.3-17000114
383S37.8Very low41.5Very low119 Ų119134.2 Ų134.283%0.83280%0.8SS**  trans-46145.7179.8-55.70000115.8
384G35.9Very low41.7Very low69 Ų69130.8 Ų130.871%0.71179%0.787SS**  trans-74.5171.3174.600000114.3
385T38.4Very low41.7Very low144 Ų144133.1 Ų133.188%0.88379%0.786SS**  trans-153.8124.2151.5-54.70000107.8
386V45Very low41.9Very low132 Ų132134 Ų13480%0.878%0.78SS**PPolyproline II helixtrans-85135.7175.7172.80000108.5
387P54.1Low41.6Very low109 Ų109133.8 Ų133.871%0.70877%0.774SS**PPolyproline II helixtrans-92.4148.7163.932.9-27.1000111.7
388P56Low42.1Very low113 Ų113131.8 Ų131.873%0.73478%0.775SS**PPolyproline II helixtrans-81.4166.5-173.835.2-35.2000112.6
389P52.7Low42.7Very low120 Ų120136.8 Ų136.878%0.77978%0.781SS**PPolyproline II helixtrans-84.4140.9178.234.7-30.5000110.5
390L48Very low43.1Very low173 Ų173136 Ų13691%0.90678%0.775SS**  trans-127.3128.7163.6-82172000110
391N39.3Very low43.3Very low140 Ų140133 Ų13375%0.74977%0.765SS**  trans-79.7158.5173.3-82.4-9.9000111.8
392D38.2Very low43.1Very low139 Ų139128.8 Ų128.874%0.74376%0.756SS**  trans72.8123.3144.4-63-27.4000123.1
393E35Very low42.9Very low163 Ų163126.8 Ų126.876%0.76275%0.745SS**  trans84.6118.5136-86.3-168.7115.800123
394L40.6Very low43.4Very low130 Ų130129.9 Ų129.968%0.68174%0.738SS**  trans92.9123.1133.7-73.4165.9000121
395Q34.8Very low44.1Very low158 Ų158136.1 Ų136.174%0.73874%0.74SS**  trans90.9117.1139.1-77.91794.900120.8
396L38.6Very low44.5Very low135 Ų135135.7 Ų135.771%0.70773%0.728SS**  trans60.1116140.2-73.2144.8000116.2
397D32.8Very low44.5Very low132 Ų132135.7 Ų135.771%0.70672%0.719SS**  -162.6143.281.6-87.8-37000114.7Q399D397-Q399 PolarHBondContact O-N 3.43Å
398S47.8Very low44.4Very low121 Ų121134.1 Ų134.185%0.84671%0.707SS**THydrogen-bonded Turntrans-77.531-179.3-65.40000114.7
399Q43.1Very low43.9Very low171 Ų171132.2 Ų132.280%0.79970%0.697SS**THydrogen-bonded Turntrans-102.1-3.7-177.1-73.8-169.86.500115.5D397D397-Q399 PolarHBondContact O-N 3.43Å
400S46.1Very low43.7Very low96 Ų96133.6 Ų133.667%0.67169%0.694SS**THydrogen-bonded Turntrans-86.4-6.5-176.2-85.50000116.7
401N42.8Very low43.4Very low124 Ų124132.4 Ų132.466%0.66369%0.686SS**Hα-helixtrans-82.2-14.9-175.5-77.5-16.2000114.6
402S45.4Very low43.7Very low89 Ų89131.5 Ų131.562%0.62268%0.681SS**Hα-helixtrans-79.4-31.9176.9165.80000112.9R404S402-R404 VanDerWaalsContact C-N 3.32Å; S402-R404 PolarHBondContact O-N 3.47Å
403S48.8Very low43.8Very low85 Ų85129.6 Ų129.659%0.59468%0.678SS**Hα-helixtrans-71.3-26.7-179-171.70000113.2E407S403-E407 PolarHBondContact O-N 3.42Å
404R48.5Very low44.4Very low185 Ų185131.8 Ų131.870%0.69868%0.68SS**Hα-helixtrans-77.6-26.7-173.7-147.9173.8178.5-171.7-1.3113.3S402 V408S402-R404 VanDerWaalsContact C-N 3.32Å; S402-R404 PolarHBondContact O-N 3.47Å; R404-V408 WeakPolarHBondContact O-CG2 3.31Å; R404-V408 PolarHBondContact O-N 3.31Å
405W50.4Low44.4Very low200 Ų200134.7 Ų134.776%0.75869%0.687SS**Hα-helixtrans-78.9-31.5175.6-71.6103.8000113E407 S409W405-E407 VanDerWaalsContact C-N 3.32Å; W405-S409 WeakPolarHBondContact O-CB 3.48Å; W405-S409 PolarHBondContact O-N 3.27Å; W405-S409 VanDerWaalsContact O-N 3.08Å
406H47.6Very low44.9Very low135 Ų135131 Ų13163%0.62569%0.691SS**Hα-helixtrans-67.9-32.8173.3-90.2-57.3000112.6S409 M410H406-S409 PolarHBondContact O-N 3.37Å; H406-M410 PolarHBondContact O-N 3.41Å
407E45.3Very low45.2Very low132 Ų132129.3 Ų129.362%0.61770%0.697SS**Hα-helixtrans-71.6-38.9177.7-156169.9-162.100112.3S403 W405 M410S403-E407 PolarHBondContact O-N 3.42Å; W405-E407 VanDerWaalsContact C-N 3.32Å; E407-M410 PolarHBondContact O-N 3.1Å
408V50.5Low45.8Very low75 Ų75127.4 Ų127.446%0.45570%0.699SS.*Hα-helixtrans-67.8-36.2173.3176.80000111.6R404 M410 M411 L412R404-V408 WeakPolarHBondContact O-CG2 3.31Å; R404-V408 PolarHBondContact O-N 3.31Å; V408-M410 VanDerWaalsContact C-N 3.33Å; V408-M410 PolarHBondContact O-N 3.07Å; V408-M411 PolarHBondContact O-N 3.2Å; V408-L412 HydrophobicContact CG1-CD1 4.06Å
409S46.4Very low45.5Very low73 Ų73127.2 Ų127.251%0.5170%0.698SS.*Hα-helixtrans-69.4-26.1179.4-169.40000113.8W405 H406W405-S409 WeakPolarHBondContact O-CB 3.48Å; W405-S409 PolarHBondContact O-N 3.27Å; W405-S409 VanDerWaalsContact O-N 3.08Å; H406-S409 PolarHBondContact O-N 3.37Å
410M48Very low45.4Very low149 Ų149127 Ų12773%0.73470%0.702SS**Hα-helixtrans-80.1-21.5175.2-68.3-149.7-59.200113.1H406 E407 V408H406-M410 PolarHBondContact O-N 3.41Å; E407-M410 PolarHBondContact O-N 3.1Å; V408-M410 VanDerWaalsContact C-N 3.33Å; V408-M410 PolarHBondContact O-N 3.07Å
411M41.8Very low45.3Very low149 Ų149129.6 Ų129.673%0.73471%0.707SS**Hα-helixtrans-81.1-18.2176.3-75.7-16752.600114.2V408V408-M411 PolarHBondContact O-N 3.2Å
412L44.5Very low45.2Very low121 Ų121129.1 Ų129.163%0.63471%0.711SS**G310 helixtrans-85.4-10.2-176.2-80.3155.6000114.5V408 W414V408-L412 HydrophobicContact CG1-CD1 4.06Å; L412-W414 PolarHBondContact O-N 3.05Å
413S41.6Very low45.1Very low98 Ų98130.2 Ų130.269%0.68571%0.714SS**G310 helixtrans-75.70.5-180-660000114.6
414W47.4Very low44.9Very low210 Ų210133.9 Ų133.980%0.79573%0.727SS**G310 helixtrans-1051.2-173.6-76.515.5000115.3L412L412-W414 PolarHBondContact O-N 3.05Å
415F40.5Very low44.5Very low191 Ų191135 Ų13584%0.83873%0.732SS**SBendtrans-94.75.1179.9-90.2-83000115.3
416G45.6Very low44Very low80 Ų80130 Ų13083%0.82573%0.734SS**SBendtrans-91.23.5-172.200000117.5
417A44Very low43.8Very low99 Ų99131.7 Ų131.782%0.81875%0.748SS**SBendtrans-137.863.4-169.400000113.3
418A45.9Very low44.1Very low92 Ų92129.5 Ų129.576%0.7675%0.752SS**  trans-160.391.516000000109.7
419S41.4Very low44.6Very low118 Ų118131.5 Ų131.583%0.82577%0.767SS**  trans-14673.5165.4-57.50000108.2
420D40.5Very low45.2Very low166 Ų166133.6 Ų133.689%0.88878%0.779SS**  trans-149.686.5161-83.6-36.2000106.7
421I44.3Very low45.4Very low150 Ų150132.2 Ų132.277%0.76978%0.781SS**  trans-118.6126.5164.2-62.7175.2000106.1T423I421-T423 PolarHBondContact O-N 2.93Å
422P41.7Very low45.3Very low115 Ų115134.2 Ų134.275%0.74779%0.788SS**  trans-70124.3176.528.9-30.8000109.1D424P422-D424 PolarHBondContact O-N 3.49Å
423T43.3Very low45.6Very low111 Ų111134.8 Ų134.868%0.68180%0.796SS**  trans-93.294.1176.4-33.50000108.8I421 Y425I421-T423 PolarHBondContact O-N 2.93Å; T423-Y425 HydrophobicContact CG2-CD2 3.43Å; T423-Y425 VanDerWaalsContact CG2-CD2 3.43Å; T423-Y425 HydrophobicContact CG2-CE2 3.67Å; T423-Y425 PolarHBondContact O-N 2.96Å
424D44.1Very low45.7Very low162 Ų162136 Ų13687%0.86680%0.802SS**  trans-81.599.4162.9-85-32.4000108.3P422P422-D424 PolarHBondContact O-N 3.49Å
425Y39.9Very low45.6Very low208 Ų208131.2 Ų131.282%0.81680%0.801SS**  trans-106.3123.5161.7-93.6-78000108.7T423T423-Y425 HydrophobicContact CG2-CD2 3.43Å; T423-Y425 VanDerWaalsContact CG2-CD2 3.43Å; T423-Y425 HydrophobicContact CG2-CE2 3.67Å; T423-Y425 PolarHBondContact O-N 2.96Å
426A39.7Very low45.5Very low97 Ų97129.4 Ų129.480%0.80279%0.794SS**  trans-68.1129165.500000109.7A428A426-A428 PolarHBondContact O-N 3.47Å; A426-A428 VanDerWaalsContact O-N 3.16Å
427D42.4Very low45Very low170 Ų170136.5 Ų136.591%0.90980%0.798SS**  trans-58.4110.4173.4-101.2-29.2000110
428A52.9Low44.7Very low86 Ų86138.2 Ų138.271%0.71179%0.794SS**PPolyproline II helixtrans-81.7135.2160.900000109A426A426-A428 PolarHBondContact O-N 3.47Å; A426-A428 VanDerWaalsContact O-N 3.16Å
429P60.8Low44.2Very low117 Ų117139.7 Ų139.776%0.7680%0.797SS**PPolyproline II helixtrans-69.6149.4178.528.6-33.2000111.4
430P59Low43.8Very low117 Ų117141.3 Ų141.376%0.7680%0.796SS**PPolyproline II helixtrans-70.8148.6-176.628.8-33.7000111.9
431P51.5Low43.9Very low119 Ų119139.3 Ų139.377%0.77380%0.795SS**PPolyproline II helixtrans-70135174.528.7-32.2000110.8
432E41.2Very low43.5Very low191 Ų191139.6 Ų139.689%0.89380%0.797SS**PPolyproline II helixtrans-63.2132.1172.8-64.4-174.9164.300110.7
433V48.9Very low43.4Very low133 Ų133139.6 Ų139.681%0.80680%0.799SS**PPolyproline II helixtrans-96.6124.1175.7-1710000108.4S435V433-S435 PolarHBondContact O-N 3.35Å
434P44.5Very low43.2Very low123 Ų123141.7 Ų141.780%0.79981%0.807SS**PPolyproline II helixtrans-68.7116.5173.4-19.332.3000111.3
435S44.7Very low42.9Very low110 Ų110138.8 Ų138.877%0.76981%0.805SS**  trans-85103.2167.9157.70000109.3V433V433-S435 PolarHBondContact O-N 3.35Å
436H39.3Very low42.9Very low153 Ų153136.3 Ų136.371%0.70881%0.806SS**  trans-162.2117.3156.1-105.4-69.9000109.2
437Y35.2Very low42.9Very low229 Ų229139.5 Ų139.590%0.89881%0.809SS**  trans-163.9104.3133.4-90.8-66.3000108.2
438D37.5Very low42.9Very low136 Ų136139.5 Ų139.573%0.72781%0.806SS**  trans-65.8135.9152.6-67.8-56.9000108.6
439C34.5Very low42.9Very low122 Ų122140.7 Ų140.782%0.82481%0.807SS**  trans-148.185.9159.6-93.50000108.5
440D33.7Very low42Very low153 Ų153141.3 Ų141.382%0.81881%0.808SS**  trans-66128.4149.1-79-41000108.8
441S42.3Very low41.6Very low123 Ų123140.9 Ų140.986%0.8681%0.806SS**  trans-163.3104.4145.6-85.10000111
442I37.3Very low40.7Very low157 Ų157141 Ų14181%0.80580%0.804SS**  trans-66.8130.7163.1-68.1158.8000108.7
443S38.6Very low40.6Very low115 Ų115137.7 Ų137.780%0.80480%0.797SS**  trans-151.8120.8149.970.40000111.8
444N39Very low39.9Very low155 Ų155138.1 Ų138.183%0.82980%0.804SS**  trans-53.5144.8171.2-64.3-44.6000113.5
445A37.1Very low39.4Very low101 Ų101143.6 Ų143.684%0.83581%0.809SS**  trans-163105.5142.200000109.9
446D41.4Very low38.8Very low156 Ų156148.8 Ų148.883%0.83481%0.812SS**  trans-68.6135.5153.2-78-53.7000109
447D39.9Very low38.7Very low164 Ų164149 Ų14988%0.87781%0.813SS**  167.2129.8124.5-94.9-30.9000112.8
448M41.1Very low38.7Very low169 Ų169148.3 Ų148.383%0.83381%0.809SS**  trans-62.2174.7168.3-81.4-79.8-164.200112.1
449P52.8Low39Very low112 Ų112150.7 Ų150.773%0.72782%0.818SS**  cis-142.5179.321.636.3-12.7000117.4
450T42.5Very low39.2Very low129 Ų129152.2 Ų152.279%0.79181%0.811SS**  trans-61.4150.4168.412.10000113.7
451P51Low39.6Very low109 Ų109149.9 Ų149.971%0.70881%0.812SS**  -142.9136.2117.428.7-9.4000113.4
452T33Very low39.4Very low120 Ų120152.2 Ų152.274%0.73681%0.81SS**  76.2107.895.4-39.50000115.4
453V38Very low39.4Very low122 Ų122153.7 Ų153.774%0.73981%0.813SS**  trans54.6113.6139.6-174.80000118.7
454C33.6Very low40Very low143 Ų143153.2 Ų153.297%0.96681%0.807SS**  trans-148.7136.5135-103.10000112.8
455R34.8Very low40.5Very low237 Ų237151.9 Ų151.989%0.89481%0.81SS**  trans-114.8132-170.1171.1-168.7-174.9-174.23107.3
456R32.4Very low40.7Very low220 Ų220154.8 Ų154.883%0.8381%0.812SS**  trans-165.2109.8153.9-115.7-179174.7-176.6-0.2110.5
457Q36Very low41Very low158 Ų158152.1 Ų152.174%0.73881%0.811SS**  65.8102.9107.9-70179.70.800112.4
458R35.8Very low40.9Very low213 Ų213148.7 Ų148.780%0.80481%0.806SS**  48.398.164.7-121.5-167.9-159.3-176.56.6113.1
459M44.3Very low41.1Very low186 Ų186147.8 Ų147.892%0.91681%0.81SS**  trans-132.2123.5154.6-78.8-82.2-78.800107.2
460F39.4Very low40.5Very low155 Ų155151.6 Ų151.668%0.6882%0.818SS**  trans-76.2151.5170.9-83.4-100.8000110.3
461A41.3Very low40.8Very low103 Ų103150 Ų15085%0.85182%0.819SS**  trans-160111.7136.200000109.3
462E37.7Very low40.6Very low172 Ų172153.8 Ų153.880%0.80483%0.827SS**  trans-70.7148.2163.2-65.5168.7135.800110.1
463Q37.4Very low41.9Very low188 Ų188157 Ų15788%0.87983%0.833SS**  -166.9141.8116.7-107.9-170.23.600112
464P52.1Low42.4Very low105 Ų105159.4 Ų159.468%0.68284%0.837SS**  trans-96.6154.1175.437.5-30.1000111.6
465S48.3Very low44Very low128 Ų128157.5 Ų157.590%0.89582%0.822SS**  trans-126.3106.8162.7-67.30000110
466D42Very low44.8Very low161 Ų161159.4 Ų159.486%0.86184%0.837SS**  trans-61.7136.5157.7-76.2-46.3000110.4
467A47.6Very low45.4Very low100 Ų100156.4 Ų156.483%0.82684%0.838SS**  trans-144.4106150.700000108.2
468A38.1Very low45.9Very low93 Ų93156.3 Ų156.377%0.76984%0.843SS**  trans-63.5146.6173.900000111.6
469T44.3Very low46.4Very low150 Ų150153.1 Ų153.192%0.9285%0.845SS**  trans-141.6106.4144.4-120000108.7
470Q40.5Very low46.6Very low191 Ų191151.2 Ų151.289%0.89384%0.841SS**  trans-85130171.4-148.2176.49.500107
471A49.4Very low47Very low97 Ų97150.9 Ų150.980%0.80285%0.851SS**  trans-162.686.6158.200000106.3
472Q46.9Very low47.4Very low188 Ų188154.1 Ų154.188%0.87985%0.851SS**  77.999.989.1-159.1174.113.900111.4
473E59Low48.1Very low187 Ų187152.9 Ų152.987%0.87486%0.855SS**  trans-62.3141.4157.9-64.6175.5144.900109.7
474E49.5Very low48.9Very low173 Ų173150.2 Ų150.281%0.80885%0.853SS**  -154.9151126.1-106.3-149.8172.700111.6
475P66.5Low48.6Very low102 Ų102153.9 Ų153.966%0.66287%0.867SS**  trans-101.3149.1178.637.7-28.8000112.7
476F51.5Low48.7Very low277 Ų277156.3 Ų156.3100%1.21586%0.864SS**  trans-153.60145-94.9-71.9000110.1

Retrieved 476 of 476 residues in 465.3 ms (Link to these results)