A0A087XJM8_POEFO Loading...

Retinaldehyde-binding protein 1-like

AlphaFold DB , UniProt , Accession A0A087XJM8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 312 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
1M36.8Very low43.1Very low247 Ų247132.2 Ų132.2100%1.21776%0.76SS**  01140-75.3-164.2-81.900107.7
2A34.1Very low44.7Very low101 Ų101135.3 Ų135.384%0.83576%0.762SS**  trans-76.712617800000109.1T4A2-T4 PolarHBondContact O-N 3.29Å; A2-T4 VanDerWaalsContact O-N 3.17Å
3A34.6Very low46Very low105 Ų105137.1 Ų137.187%0.86876%0.761SS**  trans-69.7108.5173.900000108.7G5A3-G5 PolarHBondContact O-N 2.84Å; A3-G5 VanDerWaalsContact O-N 3.12Å
4T39.2Very low46.7Very low135 Ų135128.6 Ų128.683%0.82871%0.712SS**  trans-63.5106.6168.4380000108.6A2 T6A2-T4 PolarHBondContact O-N 3.29Å; A2-T4 VanDerWaalsContact O-N 3.17Å; T4-T6 PolarHBondContact O-N 3.17Å
5G35.5Very low47.5Very low63 Ų63127.7 Ų127.765%0.64970%0.701SS**  trans-60.1126.3172.500000110.1A3 F7A3-G5 PolarHBondContact O-N 2.84Å; A3-G5 VanDerWaalsContact O-N 3.12Å; G5-F7 PolarHBondContact O-N 3.35Å; G5-F7 VanDerWaalsContact O-N 3.12Å
6T38.5Very low48.3Very low139 Ų139123.4 Ų123.485%0.85369%0.688SS**  trans-69.4104.4172.444.10000108.9T4 R8T4-T6 PolarHBondContact O-N 3.17Å; T6-R8 PolarHBondContact O-N 2.96Å
7F41.1Very low49.2Very low200 Ų200119.8 Ų119.888%0.87767%0.665SS**  trans-66.8109.1167.9-85.8-94.9000108.6G5 M9G5-F7 PolarHBondContact O-N 3.35Å; G5-F7 VanDerWaalsContact O-N 3.12Å; F7-M9 PolarHBondContact O-N 3.47Å
8R52.1Low49.7Very low190 Ų190118.9 Ų118.972%0.71765%0.65SS**PPolyproline II helixtrans-69.3119.5166.2175177.1163.7165.5-9.2107.6T6 V10 E14T6-R8 PolarHBondContact O-N 2.96Å; R8-V10 PolarHBondContact O-N 3.08Å; R8-E14 IonicContact NH2-OE2 2.92Å; R8-E14 PolarHBondContact NH2-OE2 2.99Å
9M43.2Very low50.2Low178 Ų178116.3 Ų116.388%0.87764%0.641SS**PPolyproline II helixtrans-64.5119.5168.9-63.7-148.2-53.400108.7F7F7-M9 PolarHBondContact O-N 3.47Å
10V50.1Low50.8Low39 Ų39118 Ų11824%0.23664%0.642CS.*PPolyproline II helixtrans-78.4126.4174.5-178.80000106.6R8 E14 Q15R8-V10 PolarHBondContact O-N 3.08Å; V10-E14 HydrophobicContact CG1-CB 3.6Å; V10-E14 HydrophobicContact CG1-CG 3.62Å; V10-Q15 HydrophobicContact CB-CG 4.24Å; V10-Q15 HydrophobicContact CG1-CG 3.74Å
11S68.7Low51.3Low57 Ų57115 Ų11540%0.39963%0.625SS.*PPolyproline II helixtrans-65.1157.4179.8660000111E13 E14 Q15S11-E13 PolarHBondContact O-N 3.41Å; S11-E14 CarbonylContact O-C 3.38Å; S11-E14 WeakPolarHBondContact O-CA 3.27Å; S11-E14 PolarHBondContact O-N 2.88Å; S11-E14 WeakPolarHBondContact OG-CB 3.35Å; S11-E14 PolarHBondContact OG-N 2.85Å; S11-E14 VanDerWaalsContact OG-N 3.17Å; S11-Q15 PolarHBondContact O-N 3.22Å
12E62.8Low52.7Low169 Ų169110.6 Ų110.679%0.7960%0.601SS**Hα-helixtrans-58.3-35.3175.2-68.2-177.4164.800111.7Q15 A16E12-Q15 PolarHBondContact O-N 3.27Å; E12-A16 VanDerWaalsContact O-CB 3.27Å; E12-A16 WeakPolarHBondContact O-CB 3.49Å; E12-A16 PolarHBondContact O-N 3.27Å
13E61.5Low54.9Low159 Ų159112.6 Ų112.674%0.74359%0.593SS**Hα-helixtrans-63.2-40.1172.6-65.9-178.5164.700112.3S11 M17S11-E13 PolarHBondContact O-N 3.41Å; E13-M17 WeakPolarHBondContact O-CB 3.34Å; E13-M17 PolarHBondContact O-N 3.36Å
14E56.1Low57.6Low18 Ų18109.1 Ų109.18%0.08456%0.56CS.*Hα-helixtrans-72.6-35.9178.6-168.2-177.5152.600111R8 V10 S11 R18R8-E14 IonicContact NH2-OE2 2.92Å; R8-E14 PolarHBondContact NH2-OE2 2.99Å; V10-E14 HydrophobicContact CG1-CB 3.6Å; V10-E14 HydrophobicContact CG1-CG 3.62Å; S11-E14 CarbonylContact O-C 3.38Å; S11-E14 WeakPolarHBondContact O-CA 3.27Å; S11-E14 PolarHBondContact O-N 2.88Å; S11-E14 WeakPolarHBondContact OG-CB 3.35Å; S11-E14 PolarHBondContact OG-N 2.85Å; S11-E14 VanDerWaalsContact OG-N 3.17Å; E14-R18 VanDerWaalsContact O-CG 3.24Å; E14-R18 WeakPolarHBondContact O-CG 3.24Å; E14-R18 PolarHBondContact O-N 3Å; E14-R18 IonicContact OE1-CZ 2.87Å; E14-R18 IonicContact OE1-NE 2.74Å; E14-R18 IonicContact OE1-NH2 3.6Å; E14-R18 PolarHBondContact OE1-NH2 3.13Å
15Q58.5Low60.1Low116 Ų116105.9 Ų105.954%0.54254%0.54SS..Hα-helixtrans-67.1-43.9171.3-76.4-179.8-9.600112.5V10 S11 E12 M17 R18 S19V10-Q15 HydrophobicContact CB-CG 4.24Å; V10-Q15 HydrophobicContact CG1-CG 3.74Å; S11-Q15 PolarHBondContact O-N 3.22Å; E12-Q15 PolarHBondContact O-N 3.27Å; Q15-M17 VanDerWaalsContact C-N 3.33Å; Q15-M17 PolarHBondContact O-N 3.02Å; Q15-R18 PolarHBondContact O-N 3.46Å; Q15-S19 PolarHBondContact O-N 2.84Å
16A61.1Low62.8Low59 Ų59103.9 Ų103.949%0.48852%0.515SS..Hα-helixtrans-64-37.9176.900000111.9E12 K20E12-A16 VanDerWaalsContact O-CB 3.27Å; E12-A16 WeakPolarHBondContact O-CB 3.49Å; E12-A16 PolarHBondContact O-N 3.27Å; A16-K20 PolarHBondContact O-N 3.01Å; A16-K20 VanDerWaalsContact O-N 3.08Å
17M62.1Low65.4Low61 Ų61106.2 Ų106.230%0.351%0.513SS..Hα-helixtrans-66.8-38.6172-84-132-78.500112.6E13 Q15 K20 L21 Q45E13-M17 WeakPolarHBondContact O-CB 3.34Å; E13-M17 PolarHBondContact O-N 3.36Å; Q15-M17 VanDerWaalsContact C-N 3.33Å; Q15-M17 PolarHBondContact O-N 3.02Å; M17-K20 WeakPolarHBondContact O-CB 3.29Å; M17-K20 PolarHBondContact O-N 2.99Å; M17-L21 WeakPolarHBondContact O-CG 3.45Å; M17-L21 PolarHBondContact O-N 3.29Å; M17-Q45 HydrophobicContact CE-CB 3.63Å; M17-Q45 HydrophobicContact CE-CG 3.84Å; M17-Q45 HydrophobicContact SD-CB 4.38Å
18R59.7Low68Low105 Ų105100.1 Ų100.140%0.39649%0.49SS..Hα-helixtrans-63.9-40.2176-74.9172.4-173.9-161.67.3112.9E14 Q15 K20 L21E14-R18 VanDerWaalsContact O-CG 3.24Å; E14-R18 WeakPolarHBondContact O-CG 3.24Å; E14-R18 PolarHBondContact O-N 3Å; E14-R18 IonicContact OE1-CZ 2.87Å; E14-R18 IonicContact OE1-NE 2.74Å; E14-R18 IonicContact OE1-NH2 3.6Å; E14-R18 PolarHBondContact OE1-NH2 3.13Å; Q15-R18 PolarHBondContact O-N 3.46Å; R18-K20 VanDerWaalsContact C-N 3.34Å; R18-L21 WeakPolarHBondContact O-CB 3.44Å; R18-L21 PolarHBondContact O-N 3.4Å
19S57.9Low70.1Confident68 Ų6892 Ų9248%0.47646%0.46SS..Hα-helixtrans-66.3-35.4173178.30000112.1Q15 L21 E22Q15-S19 PolarHBondContact O-N 2.84Å; S19-L21 VanDerWaalsContact C-N 3.33Å; S19-L21 PolarHBondContact O-N 3.35Å; S19-E22 PolarHBondContact O-N 3.41Å
20K62.1Low72.5Confident151 Ų15185.1 Ų85.166%0.65744%0.435SS*.Hα-helixtrans-65.4-30.9171.9-81.7-175.4175.9-1770113.7A16 M17 R18 E22 H23 L24A16-K20 PolarHBondContact O-N 3.01Å; A16-K20 VanDerWaalsContact O-N 3.08Å; M17-K20 WeakPolarHBondContact O-CB 3.29Å; M17-K20 PolarHBondContact O-N 2.99Å; R18-K20 VanDerWaalsContact C-N 3.34Å; K20-E22 PolarHBondContact O-N 3.45Å; K20-H23 PolarHBondContact O-N 3.42Å; K20-H23 VanDerWaalsContact O-N 3.09Å; K20-L24 PolarHBondContact O-N 3.11Å
21L62Low74.7Confident55 Ų5586.9 Ų86.929%0.28845%0.449SS..Hα-helixtrans-60.2-26.6177.4-72.5170.7000112.6M17 R18 S19 H23 L24 H42M17-L21 WeakPolarHBondContact O-CG 3.45Å; M17-L21 PolarHBondContact O-N 3.29Å; R18-L21 WeakPolarHBondContact O-CB 3.44Å; R18-L21 PolarHBondContact O-N 3.4Å; S19-L21 VanDerWaalsContact C-N 3.33Å; S19-L21 PolarHBondContact O-N 3.35Å; L21-H23 VanDerWaalsContact C-N 3.31Å; L21-L24 HydrophobicContact CD2-CD1 3.88Å; L21-H42 HydrophobicContact CD2-CB 3.77Å
22E66.5Low76Confident155 Ų15584.2 Ų84.272%0.72443%0.43SS*.THydrogen-bonded Turntrans-78.8-13.5178.7-63.7-179.2169.400113.4S19 K20S19-E22 PolarHBondContact O-N 3.41Å; K20-E22 PolarHBondContact O-N 3.45Å
23H80.8Confident77.5Confident143 Ų14377 Ų7766%0.66240%0.396SS*.THydrogen-bonded Turntrans-123.720.8-175.6-62.1-54.2000113.5K20 L21K20-H23 PolarHBondContact O-N 3.42Å; K20-H23 VanDerWaalsContact O-N 3.09Å; L21-H23 VanDerWaalsContact C-N 3.31Å
24L89.4Confident78.8Confident32 Ų3271.7 Ų71.717%0.16838%0.384CS..  trans-66.8144.2174.6-66.4177.6000111.3K20 L21 D28 H42K20-L24 PolarHBondContact O-N 3.11Å; L21-L24 HydrophobicContact CD2-CD1 3.88Å; L24-D28 HydrophobicContact CD2-CB 3.94Å; L24-H42 HydrophobicContact CD1-CB 4.29Å; L24-H42 VanDerWaalsContact CD1-CD2 3.46Å; L24-H42 WeakPolarHBondContact CD1-CD2 3.49Å; L24-H42 HydrophobicContact CD2-CB 4.47Å
25T92.3Very high80.2Confident67 Ų6775 Ų7541%0.41141%0.407SS..  trans-113.6171.7175.870.40000110K27 D28 H29T25-K27 PolarHBondContact O-N 3.5Å; T25-K27 PolarHBondContact OG1-N 3.26Å; T25-D28 WeakPolarHBondContact CA-OD2 3.28Å; T25-D28 PolarHBondContact N-OD2 3.39Å; T25-D28 PolarHBondContact O-N 2.87Å; T25-D28 PolarHBondContact OG1-OD2 3.12Å; T25-H29 PolarHBondContact O-CD2 3.28Å; T25-H29 VanDerWaalsContact O-CD2 3.23Å; T25-H29 PolarHBondContact O-NE2 2.95Å
26V92.5Very high81.7Confident21 Ų2171 Ų7113%0.12739%0.391CS..G310 helixtrans-58.8-28.6176-58.50000112.6D28 D280 I283V26-D28 VanDerWaalsContact C-N 3.32Å; V26-D28 PolarHBondContact O-N 3.26Å; V26-D280 HydrophobicContact CG1-CB 4.17Å; V26-I283 HydrophobicContact CB-CG2 4.18Å; V26-I283 HydrophobicContact CG1-CD1 4.01Å; V26-I283 HydrophobicContact CG1-CG2 3.92Å; V26-I283 HydrophobicContact CG2-CG2 3.98Å
27K93.5Very high83Confident188 Ų18876.8 Ų76.882%0.81741%0.408SS*.G310 helixtrans-78.6-13.2-176.1-64.8-179.8-179.1173.70114T25 H29T25-K27 PolarHBondContact O-N 3.5Å; T25-K27 PolarHBondContact OG1-N 3.26Å; K27-H29 VanDerWaalsContact C-N 3.27Å
28D94.7Very high84.4Confident72 Ų7282.7 Ų82.739%0.38543%0.432SS..G310 helixtrans-78.4-16.5-179.1-64.3-62.2000112.1L24 T25 V26 H42L24-D28 HydrophobicContact CD2-CB 3.94Å; T25-D28 WeakPolarHBondContact CA-OD2 3.28Å; T25-D28 PolarHBondContact N-OD2 3.39Å; T25-D28 PolarHBondContact O-N 2.87Å; T25-D28 PolarHBondContact OG1-OD2 3.12Å; V26-D28 VanDerWaalsContact C-N 3.32Å; V26-D28 PolarHBondContact O-N 3.26Å; D28-H42 PolarHBondContact O-CE1 3.18Å
29H95.7Very high86.1Confident18 Ų1879.3 Ų79.38%0.08342%0.421CS..SBendtrans-100.6154.6-175.6-49-78.1000112T25 K27 H42 R150 D151 K152 G154 E191T25-H29 PolarHBondContact O-CD2 3.28Å; T25-H29 VanDerWaalsContact O-CD2 3.23Å; T25-H29 PolarHBondContact O-NE2 2.95Å; K27-H29 VanDerWaalsContact C-N 3.27Å; H29-H42 AromaticContact CE1-CD2 3.91Å; H29-H42 AromaticContact CE1-NE2 3.29Å; H29-H42 PolarHBondContact CE1-NE2 2.8Å; H29-H42 VanDerWaalsContact CE1-NE2 3.29Å; H29-H42 AromaticContact ND1-NE2 3.11Å; H29-H42 PolarHBondContact ND1-NE2 2.9Å; H29-H42 VanDerWaalsContact ND1-NE2 3.11Å; H29-R150 HydrophobicContact CB-CB 4.29Å; H29-D151 PolarHBondContact CD2-O 3.36Å; H29-K152 PolarHBondContact NE2-O 2.95Å; H29-G154 PolarHBondContact CE1-N 3.21Å; H29-G154 VanDerWaalsContact CE1-N 3.32Å; H29-G154 VanDerWaalsContact ND1-CA 3.33Å; H29-G154 WeakPolarHBondContact ND1-CA 3.21Å; H29-G154 PolarHBondContact NE2-N 3.35Å; H29-E191 IonicContact ND1-OE1 3.36Å
30G95.6Very high87.8Confident34 Ų3477.2 Ų77.235%0.35141%0.406SS..  trans-74.9177.8179.400000113.9R150 E191G30-R150 VanDerWaalsContact O-CD 3.22Å; G30-R150 WeakPolarHBondContact O-CD 3.49Å; G30-R150 PolarHBondContact O-NE 3.48Å; G30-E191 WeakPolarHBondContact CA-OE2 3.4Å; G30-E191 PolarHBondContact N-OE2 3.45Å
31S95.4Very high89.4Confident77 Ų7772.2 Ų72.254%0.53840%0.398SS..  trans-52.2144.81761800000112.6F33 R150 N189S31-F33 PolarHBondContact OG-N 3Å; S31-F33 PolarHBondContact OG-O 3.24Å; S31-R150 PolarHBondContact O-NE 3.12Å; S31-R150 PolarHBondContact O-NH2 3.04Å; S31-N189 PolarHBondContact O-ND2 3.46Å
32V96.3Very high90.8Very high1 Ų170.8 Ų70.81%0.00639%0.39CS..SBendtrans-69.7-49.5170.8171.20000110.3V146 P148 R150 V156 L186V32-V146 HydrophobicContact CG1-CG1 3.72Å; V32-P148 VanDerWaalsContact CG2-O 3.25Å; V32-P148 WeakPolarHBondContact CG2-O 3.4Å; V32-R150 HydrophobicContact CG2-CG 3.62Å; V32-V156 HydrophobicContact CG1-CG1 4.32Å; V32-V156 HydrophobicContact CG1-CG2 4.15Å; V32-L186 HydrophobicContact CG1-CD2 4.14Å
33F94.1Very high92.2Very high18 Ų1863.4 Ų63.48%0.07936%0.355CS..SBendtrans-89.8151.8-176-52.1-75.9000111.9S31 V146 P148 L186 I300 Q303 L304S31-F33 PolarHBondContact OG-N 3Å; S31-F33 PolarHBondContact OG-O 3.24Å; F33-V146 HydrophobicContact CE1-CB 3.97Å; F33-V146 HydrophobicContact CE1-CG1 3.67Å; F33-V146 HydrophobicContact CZ-CB 3.94Å; F33-V146 HydrophobicContact CZ-CG1 3.71Å; F33-P148 HydrophobicContact CE2-CB 4.14Å; F33-P148 HydrophobicContact CE2-CG 4.47Å; F33-L186 HydrophobicContact CD1-CD2 4.02Å; F33-L186 HydrophobicContact CE1-CD2 4.41Å; F33-I300 HydrophobicContact CE1-CG2 4.49Å; F33-I300 HydrophobicContact CZ-CG2 4.16Å; F33-Q303 HydrophobicContact CB-CB 4.36Å; F33-Q303 HydrophobicContact CD1-CB 4.21Å; F33-Q303 HydrophobicContact CD2-CB 3.98Å; F33-Q303 HydrophobicContact CE2-CB 4.26Å; F33-Q303 HydrophobicContact CG-CB 3.93Å; F33-L304 HydrophobicContact CD1-CD2 3.78Å; F33-L304 HydrophobicContact CD1-CG 4.04Å; F33-L304 HydrophobicContact CE1-CD1 4.42Å; F33-L304 HydrophobicContact CE1-CD2 3.68Å; F33-L304 HydrophobicContact CE1-CG 3.71Å
34G88.3Confident92.9Very high46 Ų4659.2 Ų59.247%0.47434%0.339SS..SBendtrans77.5174.1179.400000114.6N189G34-N189 PolarHBondContact O-ND2 3.32Å
35P85.6Confident93.1Very high88 Ų8858.4 Ų58.457%0.57134%0.335SS*.  trans-68.2143.1-178.928-33.9000111.6H37P35-H37 PolarHBondContact O-N 3.18Å
36C90.8Very high93.2Very high32 Ų3256.6 Ų56.622%0.21632%0.321CS..  trans-77.3106.9172.6173.30000110.1K38 N189 E190C36-K38 VanDerWaalsContact SG-C 3.54Å; C36-N189 WeakPolarHBondContact CB-OD1 3.46Å; C36-E190 HydrophobicContact CB-CB 4.38Å
37H87.3Confident93.4Very high180 Ų18055.8 Ų55.883%0.83332%0.316SS*.SBendtrans-69.8-35.6177.6-62.9-65.7000113.4P35P35-H37 PolarHBondContact O-N 3.18Å
38K92.8Very high93.5Very high185 Ų18551.6 Ų51.680%0.80430%0.298SS*.SBendtrans-152.2124.3179-175.5179.2179.3-177.60109.8C36C36-K38 VanDerWaalsContact SG-C 3.54Å
39L94.6Very high93.3Very high34 Ų3450.9 Ų50.918%0.17829%0.294CS..  trans-66.6133.2174.2-72.7171.5000110.3T43 V44 E190 E191 I194L39-T43 HydrophobicContact CD2-CG2 4.07Å; L39-V44 HydrophobicContact CB-CG2 3.54Å; L39-V44 HydrophobicContact CD1-CG2 4.11Å; L39-V44 HydrophobicContact CG-CG2 4.49Å; L39-E190 HydrophobicContact CD1-CB 4.4Å; L39-E190 HydrophobicContact CD2-CB 3.9Å; L39-E190 HydrophobicContact CG-CB 4.33Å; L39-E191 HydrophobicContact CD2-CB 3.84Å; L39-I194 HydrophobicContact CD1-CD1 3.74Å; L39-I194 HydrophobicContact CD2-CD1 3.91Å
40P94.8Very high93.2Very high24 Ų2453.2 Ų53.216%0.15631%0.306CS..  trans-56.3145.4168.7-27.538000111.4H42 T43 V44 E191P40-H42 VanDerWaalsContact C-N 3.28Å; P40-H42 WeakPolarHBondContact CB-CE1 3.3Å; P40-H42 PolarHBondContact O-N 3Å; P40-T43 WeakPolarHBondContact O-CB 3.39Å; P40-T43 PolarHBondContact O-N 3.26Å; P40-V44 PolarHBondContact O-N 2.74Å; P40-E191 WeakPolarHBondContact CD-OE1 3.28Å; P40-E191 WeakPolarHBondContact CD-OE2 3.45Å; P40-E191 VanDerWaalsContact CG-OE1 3.3Å; P40-E191 WeakPolarHBondContact CG-OE1 3.43Å
41G94.1Very high93.2Very high46 Ų4651.6 Ų51.647%0.47429%0.289SS..Hα-helixtrans-58-39.8-174.500000113V44 Q45G41-V44 PolarHBondContact O-N 3.18Å; G41-Q45 PolarHBondContact O-N 3.4Å
42H92.4Very high93.2Very high26 Ų2652.4 Ų52.412%0.1228%0.284CS..Hα-helixtrans-67.1-34.7175.460.5-91.9000112.8L21 L24 D28 H29 P40 Q45 K46L21-H42 HydrophobicContact CD2-CB 3.77Å; L24-H42 HydrophobicContact CD1-CB 4.29Å; L24-H42 VanDerWaalsContact CD1-CD2 3.46Å; L24-H42 WeakPolarHBondContact CD1-CD2 3.49Å; L24-H42 HydrophobicContact CD2-CB 4.47Å; D28-H42 PolarHBondContact O-CE1 3.18Å; H29-H42 AromaticContact CE1-CD2 3.91Å; H29-H42 AromaticContact CE1-NE2 3.29Å; H29-H42 PolarHBondContact CE1-NE2 2.8Å; H29-H42 VanDerWaalsContact CE1-NE2 3.29Å; H29-H42 AromaticContact ND1-NE2 3.11Å; H29-H42 PolarHBondContact ND1-NE2 2.9Å; H29-H42 VanDerWaalsContact ND1-NE2 3.11Å; P40-H42 VanDerWaalsContact C-N 3.28Å; P40-H42 WeakPolarHBondContact CB-CE1 3.3Å; P40-H42 PolarHBondContact O-N 3Å; H42-Q45 PolarHBondContact O-N 3.18Å; H42-K46 WeakPolarHBondContact O-CB 3.48Å; H42-K46 PolarHBondContact O-N 2.99Å
43T95.8Very high93.2Very high0 Ų053.3 Ų53.30%029%0.288CS..Hα-helixtrans-67.9-38.9175.9-59.80000110.8L39 P40 K46 A47 E191 I194L39-T43 HydrophobicContact CD2-CG2 4.07Å; P40-T43 WeakPolarHBondContact O-CB 3.39Å; P40-T43 PolarHBondContact O-N 3.26Å; T43-K46 PolarHBondContact O-N 3.29Å; T43-A47 PolarHBondContact O-N 3.27Å; T43-E191 HydrophobicContact CG2-CG 4.05Å; T43-E191 PolarHBondContact OG1-OE1 3.17Å; T43-I194 HydrophobicContact CG2-CB 3.98Å; T43-I194 HydrophobicContact CG2-CD1 3.9Å; T43-I194 HydrophobicContact CG2-CG2 3.8Å
44V95.6Very high93.2Very high55 Ų5555.2 Ų55.233%0.33330%0.301SS..Hα-helixtrans-62.2-44.1171.8177.20000111L39 P40 G41 A47 K48L39-V44 HydrophobicContact CB-CG2 3.54Å; L39-V44 HydrophobicContact CD1-CG2 4.11Å; L39-V44 HydrophobicContact CG-CG2 4.49Å; P40-V44 PolarHBondContact O-N 2.74Å; G41-V44 PolarHBondContact O-N 3.18Å; V44-A47 PolarHBondContact O-N 2.97Å; V44-K48 PolarHBondContact O-N 3.45Å; V44-K48 VanDerWaalsContact O-N 3.11Å
45Q93.4Very high93.4Very high15 Ų1559.7 Ų59.77%0.0731%0.314CS..Hα-helixtrans-63.8-43.5177.6-171.256.34400111.7M17 G41 H42 A47 K48 D49M17-Q45 HydrophobicContact CE-CB 3.63Å; M17-Q45 HydrophobicContact CE-CG 3.84Å; M17-Q45 HydrophobicContact SD-CB 4.38Å; G41-Q45 PolarHBondContact O-N 3.4Å; H42-Q45 PolarHBondContact O-N 3.18Å; Q45-A47 VanDerWaalsContact C-N 3.29Å; Q45-A47 PolarHBondContact O-N 3.34Å; Q45-K48 WeakPolarHBondContact O-CB 3.38Å; Q45-K48 PolarHBondContact O-N 3.4Å; Q45-K48 VanDerWaalsContact O-N 3.07Å; Q45-D49 PolarHBondContact NE2-OD1 3.37Å; Q45-D49 PolarHBondContact NE2-OD2 3.17Å; Q45-D49 VanDerWaalsContact O-CG 3.29Å; Q45-D49 PolarHBondContact O-N 3.11Å
46K94.4Very high93.9Very high28 Ų2862.1 Ų62.112%0.12232%0.318CS..Hα-helixtrans-58.7-38.8174-174.4179.7-178.8179.40112.5H42 T43 D49 E50 Y153 N195H42-K46 WeakPolarHBondContact O-CB 3.48Å; H42-K46 PolarHBondContact O-N 2.99Å; T43-K46 PolarHBondContact O-N 3.29Å; K46-D49 PolarHBondContact O-N 2.9Å; K46-E50 WeakPolarHBondContact CE-OE1 3.18Å; K46-E50 HydrophobicContact CG-CG 4.09Å; K46-E50 WeakPolarHBondContact CG-OE1 3.42Å; K46-E50 WeakPolarHBondContact O-CB 3.4Å; K46-E50 PolarHBondContact O-N 3.07Å; K46-Y153 PolarHBondContact NZ-O 3.4Å; K46-Y153 VanDerWaalsContact NZ-O 3.15Å; K46-N195 WeakPolarHBondContact CD-OD1 3.46Å; K46-N195 WeakPolarHBondContact CE-OD1 3.34Å; K46-N195 PolarHBondContact NZ-OD1 3.11Å
47A96.3Very high94.1Very high4 Ų464.7 Ų64.73%0.03332%0.323CS..Hα-helixtrans-64.4-40.2174.400000112T43 V44 Q45 L51 H52 E53 I194T43-A47 PolarHBondContact O-N 3.27Å; V44-A47 PolarHBondContact O-N 2.97Å; Q45-A47 VanDerWaalsContact C-N 3.29Å; Q45-A47 PolarHBondContact O-N 3.34Å; A47-L51 HydrophobicContact CB-CD1 4.3Å; A47-L51 CarbonylContact O-C 3.6Å; A47-L51 VanDerWaalsContact O-CA 3.31Å; A47-L51 WeakPolarHBondContact O-CA 3.17Å; A47-L51 WeakPolarHBondContact O-CB 3.36Å; A47-L51 PolarHBondContact O-N 3.43Å; A47-H52 PolarHBondContact O-N 2.82Å; A47-H52 VanDerWaalsContact O-N 3.1Å; A47-E53 HydrophobicContact CB-CB 4.19Å; A47-E53 PolarHBondContact O-N 2.84Å; A47-I194 HydrophobicContact CB-CD1 3.9Å; A47-I194 HydrophobicContact CB-CG1 4.09Å; A47-I194 HydrophobicContact CB-CG2 4.02Å
48K95.2Very high94.6Very high101 Ų10159 Ų5944%0.43929%0.294SS..Hα-helixtrans-62.4-45.1173.1-68.9172.9179.9178.30111.6V44 Q45 H52 E53V44-K48 PolarHBondContact O-N 3.45Å; V44-K48 VanDerWaalsContact O-N 3.11Å; Q45-K48 WeakPolarHBondContact O-CB 3.38Å; Q45-K48 PolarHBondContact O-N 3.4Å; Q45-K48 VanDerWaalsContact O-N 3.07Å; K48-H52 WeakPolarHBondContact O-CA 3.45Å; K48-H52 PolarHBondContact O-N 3.31Å; K48-E53 VanDerWaalsContact CG-O 3.29Å; K48-E53 WeakPolarHBondContact CG-O 3.3Å
49D92.1Very high94.8Very high56 Ų5652.3 Ų52.330%0.29928%0.278SS..Hα-helixtrans-76.8-45.6-172.2-64.8-20.4000112.4Q45 K46Q45-D49 PolarHBondContact NE2-OD1 3.37Å; Q45-D49 PolarHBondContact NE2-OD2 3.17Å; Q45-D49 VanDerWaalsContact O-CG 3.29Å; Q45-D49 PolarHBondContact O-N 3.11Å; K46-D49 PolarHBondContact O-N 2.9Å
50E93.4Very high94.9Very high68 Ų6853.5 Ų53.532%0.31829%0.289SS..Hα-helixtrans-92.1-30.2-174.8-64.1-174.2-165.800114.4K46 K103 R233 K235K46-E50 WeakPolarHBondContact CE-OE1 3.18Å; K46-E50 HydrophobicContact CG-CG 4.09Å; K46-E50 WeakPolarHBondContact CG-OE1 3.42Å; K46-E50 WeakPolarHBondContact O-CB 3.4Å; K46-E50 PolarHBondContact O-N 3.07Å; E50-K103 WeakPolarHBondContact O-CD 3.31Å; E50-R233 IonicContact OE2-CZ 2.66Å; E50-R233 IonicContact OE2-NH1 2.83Å; E50-R233 PolarHBondContact OE2-NH1 2.86Å; E50-R233 IonicContact OE2-NH2 3.05Å; E50-R233 PolarHBondContact OE2-NH2 2.86Å; E50-K235 IonicContact OE2-NZ 3.62Å; E50-K235 PolarHBondContact OE2-NZ 3.45Å
51L95.7Very high95.1Very high0 Ų052.6 Ų52.60%028%0.284CS..Hα-helixtrans-110.5-10.5-174.1-45-178.1000112.3A47 E53 R100 K103 F104 I194A47-L51 HydrophobicContact CB-CD1 4.3Å; A47-L51 CarbonylContact O-C 3.6Å; A47-L51 VanDerWaalsContact O-CA 3.31Å; A47-L51 WeakPolarHBondContact O-CA 3.17Å; A47-L51 WeakPolarHBondContact O-CB 3.36Å; A47-L51 PolarHBondContact O-N 3.43Å; L51-E53 PolarHBondContact O-N 3.17Å; L51-R100 HydrophobicContact CD1-CB 4.14Å; L51-R100 HydrophobicContact CD1-CG 4.17Å; L51-R100 WeakPolarHBondContact CD2-O 3.31Å; L51-K103 HydrophobicContact CD2-CG 4.12Å; L51-K103 CarbonylContact O-C 3.59Å; L51-K103 VanDerWaalsContact O-C 3.25Å; L51-F104 HydrophobicContact CB-CD2 4.23Å; L51-F104 HydrophobicContact CB-CE2 4.38Å; L51-F104 WeakPolarHBondContact O-CD2 3.38Å; L51-I194 HydrophobicContact CD1-CG1 4.28Å; L51-I194 HydrophobicContact CD1-CG2 4.41Å
52H94.1Very high95.3Very high94 Ų9451 Ų5144%0.43526%0.264SS..  trans61.527.2-174.6-45.4-59.9000113.4A47 K48 T54 R57A47-H52 PolarHBondContact O-N 2.82Å; A47-H52 VanDerWaalsContact O-N 3.1Å; K48-H52 WeakPolarHBondContact O-CA 3.45Å; K48-H52 PolarHBondContact O-N 3.31Å; H52-T54 PolarHBondContact O-N 3.31Å; H52-R57 WeakPolarHBondContact O-CD 3.02Å
53E95.7Very high95.6Very high19 Ų1956.8 Ų56.89%0.08929%0.289CS..  trans-74.4118.3-177.1-172.8167.5172.800111.6A47 K48 L51 R58 R100 F104A47-E53 HydrophobicContact CB-CB 4.19Å; A47-E53 PolarHBondContact O-N 2.84Å; K48-E53 VanDerWaalsContact CG-O 3.29Å; K48-E53 WeakPolarHBondContact CG-O 3.3Å; L51-E53 PolarHBondContact O-N 3.17Å; E53-R58 IonicContact OE1-CZ 3.27Å; E53-R58 IonicContact OE1-NH1 3.74Å; E53-R58 PolarHBondContact OE1-NH1 3.19Å; E53-R100 IonicContact OE1-CZ 3.66Å; E53-R100 IonicContact OE1-NE 3.43Å; E53-R100 PolarHBondContact OE1-NE 3.14Å; E53-R100 IonicContact OE1-NH2 3.55Å; E53-R100 PolarHBondContact OE1-NH2 3.48Å; E53-R100 IonicContact OE2-CZ 2.77Å; E53-R100 IonicContact OE2-NE 3.66Å; E53-R100 PolarHBondContact OE2-NE 3.37Å; E53-R100 IonicContact OE2-NH2 2.64Å; E53-R100 PolarHBondContact OE2-NH2 2.94Å; E53-F104 HydrophobicContact CB-CD2 4.06Å; E53-F104 HydrophobicContact CB-CE2 3.44Å; E53-F104 VanDerWaalsContact CB-CE2 3.44Å; E53-F104 HydrophobicContact CB-CZ 3.9Å; E53-F104 HydrophobicContact CG-CD2 4.48Å; E53-F104 HydrophobicContact CG-CE1 4.28Å; E53-F104 HydrophobicContact CG-CE2 3.52Å; E53-F104 HydrophobicContact CG-CZ 3.4Å; E53-F104 WeakPolarHBondContact OE2-CE2 3.29Å
54T94.9Very high95.7Very high59 Ų5960.6 Ų60.636%0.36231%0.309SS..  trans-126.4166.2164.480.50000109.4H52 E56 R57 R58H52-T54 PolarHBondContact O-N 3.31Å; T54-E56 VanDerWaalsContact C-N 3.28Å; T54-E56 WeakPolarHBondContact CB-OE2 3.49Å; T54-E56 PolarHBondContact O-N 2.74Å; T54-E56 PolarHBondContact OG1-N 2.82Å; T54-E56 PolarHBondContact OG1-OE2 3.27Å; T54-R57 PolarHBondContact O-N 3.25Å; T54-R57 PolarHBondContact OG1-N 2.97Å; T54-R57 VanDerWaalsContact OG1-N 3.13Å; T54-R58 VanDerWaalsContact O-CB 3.28Å; T54-R58 WeakPolarHBondContact O-CB 3.47Å; T54-R58 PolarHBondContact O-N 3.35Å
55N92.8Very high95.9Very high139 Ų13958 Ų5874%0.74329%0.293SS*.Hα-helixtrans-60-42177.9-71.2-23.1000111.5R58 G59N55-R58 PolarHBondContact O-N 3.14Å; N55-G59 PolarHBondContact O-N 2.93Å; N55-G59 VanDerWaalsContact O-N 3.11Å
56E95.2Very high96.1Very high139 Ų13960.5 Ų60.565%0.6530%0.302SS*.Hα-helixtrans-64.8-48.8178.6-55.671.2-15200110.4T54 R58 G59 S60T54-E56 VanDerWaalsContact C-N 3.28Å; T54-E56 WeakPolarHBondContact CB-OE2 3.49Å; T54-E56 PolarHBondContact O-N 2.74Å; T54-E56 PolarHBondContact OG1-N 2.82Å; T54-E56 PolarHBondContact OG1-OE2 3.27Å; E56-R58 VanDerWaalsContact C-N 3.31Å; E56-R58 PolarHBondContact O-N 3.07Å; E56-G59 PolarHBondContact O-N 3.29Å; E56-S60 PolarHBondContact O-N 3.06Å; E56-S60 PolarHBondContact O-OG 3.23Å
57R95.8Very high96.3Very high87 Ų8762.2 Ų62.233%0.32832%0.315SS..Hα-helixtrans-64.5-37.4179.4-167.1-179.7-174.6153.8-10.6111.7H52 T54 S60 S61 F104H52-R57 WeakPolarHBondContact O-CD 3.02Å; T54-R57 PolarHBondContact O-N 3.25Å; T54-R57 PolarHBondContact OG1-N 2.97Å; T54-R57 VanDerWaalsContact OG1-N 3.13Å; R57-S60 PolarHBondContact O-N 2.89Å; R57-S60 PolarHBondContact O-OG 3.45Å; R57-S61 WeakPolarHBondContact O-CB 3.45Å; R57-S61 PolarHBondContact O-N 3.11Å; R57-S61 PolarHBondContact O-OG 3.06Å; R57-S61 VanDerWaalsContact O-OG 3.07Å; R57-F104 HydrophobicContact CG-CB 4.3Å; R57-F104 HydrophobicContact CG-CD1 4.33Å; R57-F104 VanDerWaalsContact NE-CB 3.27Å; R57-F104 PolarHBondContact NH2-O 2.95Å
58R96.6Very high96.4Very high59 Ų5963.3 Ų63.322%0.22332%0.32CS..Hα-helixtrans-60.1-49.2176.1-175.2172.7-179.4154-7.2110.7E53 T54 N55 E56 L62 V96 F104 E190E53-R58 IonicContact OE1-CZ 3.27Å; E53-R58 IonicContact OE1-NH1 3.74Å; E53-R58 PolarHBondContact OE1-NH1 3.19Å; T54-R58 VanDerWaalsContact O-CB 3.28Å; T54-R58 WeakPolarHBondContact O-CB 3.47Å; T54-R58 PolarHBondContact O-N 3.35Å; N55-R58 PolarHBondContact O-N 3.14Å; E56-R58 VanDerWaalsContact C-N 3.31Å; E56-R58 PolarHBondContact O-N 3.07Å; R58-L62 HydrophobicContact CG-CD1 4.07Å; R58-L62 WeakPolarHBondContact O-CB 3.36Å; R58-L62 WeakPolarHBondContact O-CD1 3.41Å; R58-L62 VanDerWaalsContact O-CG 3.27Å; R58-L62 WeakPolarHBondContact O-CG 3.27Å; R58-L62 PolarHBondContact O-N 2.88Å; R58-L62 VanDerWaalsContact O-N 3.14Å; R58-V96 HydrophobicContact CG-CG2 4.21Å; R58-F104 HydrophobicContact CB-CE1 4.1Å; R58-F104 HydrophobicContact CG-CE1 4.29Å; R58-E190 IonicContact CZ-OE1 3.88Å; R58-E190 IonicContact NH1-OE1 3.58Å; R58-E190 IonicContact NH1-OE2 2.99Å; R58-E190 IonicContact NH2-OE1 3.64Å; R58-E190 PolarHBondContact NH2-OE1 3.37Å
59G97.1Very high96.5Very high45 Ų4558.6 Ų58.646%0.46430%0.299SS..Hα-helixtrans-62.1-47.9177.300000113.2N55 E56 K63N55-G59 PolarHBondContact O-N 2.93Å; N55-G59 VanDerWaalsContact O-N 3.11Å; E56-G59 PolarHBondContact O-N 3.29Å; G59-K63 PolarHBondContact O-N 2.84Å
60S97.9Very high96.7Very high59 Ų5962.7 Ų62.741%0.41331%0.314SS..Hα-helixtrans-66.6-46.6-178.769.70000112.2E56 R57 L62 K63 D64E56-S60 PolarHBondContact O-N 3.06Å; E56-S60 PolarHBondContact O-OG 3.23Å; R57-S60 PolarHBondContact O-N 2.89Å; R57-S60 PolarHBondContact O-OG 3.45Å; S60-L62 VanDerWaalsContact C-N 3.33Å; S60-L62 PolarHBondContact O-N 3.35Å; S60-K63 WeakPolarHBondContact O-CB 3.2Å; S60-K63 PolarHBondContact O-N 3.46Å; S60-D64 PolarHBondContact O-N 3.19Å
61S98.4Very high96.9Very high6 Ų664.5 Ų64.54%0.04232%0.323CS..Hα-helixtrans-66.3-31.6-179.2-65.10000113.4R57 L65R57-S61 WeakPolarHBondContact O-CB 3.45Å; R57-S61 PolarHBondContact O-N 3.11Å; R57-S61 PolarHBondContact O-OG 3.06Å; R57-S61 VanDerWaalsContact O-OG 3.07Å; S61-L65 VanDerWaalsContact O-CB 3.22Å; S61-L65 WeakPolarHBondContact O-CB 3.45Å; S61-L65 PolarHBondContact O-N 2.91Å
62L98.4Very high96.9Very high11 Ų1168.8 Ų68.86%0.05834%0.339CS..Hα-helixtrans-65.7-44172.9-79.6165000111.5R58 S60 L65 R66 D92 L95 L99R58-L62 HydrophobicContact CG-CD1 4.07Å; R58-L62 WeakPolarHBondContact O-CB 3.36Å; R58-L62 WeakPolarHBondContact O-CD1 3.41Å; R58-L62 VanDerWaalsContact O-CG 3.27Å; R58-L62 WeakPolarHBondContact O-CG 3.27Å; R58-L62 PolarHBondContact O-N 2.88Å; R58-L62 VanDerWaalsContact O-N 3.14Å; S60-L62 VanDerWaalsContact C-N 3.33Å; S60-L62 PolarHBondContact O-N 3.35Å; L62-L65 PolarHBondContact O-N 3.43Å; L62-R66 WeakPolarHBondContact O-CG 3.39Å; L62-R66 PolarHBondContact O-N 3.25Å; L62-R66 VanDerWaalsContact O-N 3.11Å; L62-D92 HydrophobicContact CD1-CB 3.8Å; L62-D92 HydrophobicContact CD2-CB 4.03Å; L62-L95 HydrophobicContact CD2-CB 3.74Å; L62-L99 HydrophobicContact CD2-CD1 3.85Å; L62-L99 HydrophobicContact CG-CD1 3.88Å
63K98.3Very high97Very high149 Ų14964.9 Ų64.965%0.64832%0.323SS*.Hα-helixtrans-60.1-49.6174.9-176.7-177.3175.9-174.80110.8G59 S60 L65 R66 V67G59-K63 PolarHBondContact O-N 2.84Å; S60-K63 WeakPolarHBondContact O-CB 3.2Å; S60-K63 PolarHBondContact O-N 3.46Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 2.96Å; K63-R66 PolarHBondContact O-N 3.17Å; K63-V67 WeakPolarHBondContact O-CG2 3.22Å; K63-V67 PolarHBondContact O-N 3.36Å
64D98.6Very high97Very high80 Ų8068.7 Ų68.743%0.42835%0.351SS..Hα-helixtrans-63.6-38.8-178.9-63.9-17.1000111.8S60 R66 V67 M68 V106S60-D64 PolarHBondContact O-N 3.19Å; D64-R66 PolarHBondContact O-N 2.69Å; D64-V67 PolarHBondContact O-N 3.07Å; D64-M68 WeakPolarHBondContact O-CB 3.38Å; D64-M68 PolarHBondContact O-N 2.76Å; D64-V106 HydrophobicContact CB-CG1 4.16Å; D64-V106 HydrophobicContact CB-CG2 4.04Å
65L98.7Very high97Very high0 Ų071.8 Ų71.80%036%0.362CS..Hα-helixtrans-63-42.8176.4-177.161000111.7S61 L62 K63 V67 M68 M69 L95 L99 V106 A109 H110 M113S61-L65 VanDerWaalsContact O-CB 3.22Å; S61-L65 WeakPolarHBondContact O-CB 3.45Å; S61-L65 PolarHBondContact O-N 2.91Å; L62-L65 PolarHBondContact O-N 3.43Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 2.96Å; L65-V67 VanDerWaalsContact C-N 3.35Å; L65-M68 PolarHBondContact O-N 3.05Å; L65-M69 HydrophobicContact CG-SD 4.45Å; L65-M69 VanDerWaalsContact O-CG 3.3Å; L65-M69 WeakPolarHBondContact O-CG 3.09Å; L65-M69 PolarHBondContact O-N 3.22Å; L65-L95 HydrophobicContact CD2-CB 4.31Å; L65-L99 HydrophobicContact CD2-CD1 4.4Å; L65-L99 HydrophobicContact CD2-CD2 4.17Å; L65-L99 HydrophobicContact CD2-CG 4.03Å; L65-V106 HydrophobicContact CB-CG1 4.04Å; L65-V106 HydrophobicContact CD1-CG1 4.15Å; L65-A109 HydrophobicContact CD1-CB 4.37Å; L65-H110 HydrophobicContact CD1-CB 4.06Å; L65-M113 HydrophobicContact CD1-SD 4.02Å; L65-M113 HydrophobicContact CD2-SD 4.1Å; L65-M113 HydrophobicContact CG-SD 4.32Å
66R98.4Very high96.6Very high68 Ų6867.2 Ų67.226%0.25735%0.348SS..Hα-helixtrans-64.4-39.1176.7-71.9179.7176.4-72.30.8112.3L62 K63 D64 K70 G88 K90 D92 L95L62-R66 WeakPolarHBondContact O-CG 3.39Å; L62-R66 PolarHBondContact O-N 3.25Å; L62-R66 VanDerWaalsContact O-N 3.11Å; K63-R66 PolarHBondContact O-N 3.17Å; D64-R66 PolarHBondContact O-N 2.69Å; R66-K70 PolarHBondContact O-N 3.22Å; R66-G88 PolarHBondContact NH1-O 2.84Å; R66-K90 PolarHBondContact NH2-O 2.87Å; R66-D92 IonicContact CZ-OD1 2.74Å; R66-D92 VanDerWaalsContact CZ-OD1 3.31Å; R66-D92 IonicContact NE-OD1 3.79Å; R66-D92 PolarHBondContact NE-OD1 3.44Å; R66-D92 IonicContact NH2-OD1 3.92Å; R66-D92 PolarHBondContact NH2-OD1 3.03Å; R66-L95 HydrophobicContact CG-CD1 4.02Å; R66-L95 VanDerWaalsContact CZ-CD1 3.41Å
67V98.3Very high96.5Very high64 Ų6463 Ų6339%0.38833%0.33SS..Hα-helixtrans-62.6-50.5173.61710000109.8K63 D64 L65 M69 K70 E71K63-V67 WeakPolarHBondContact O-CG2 3.22Å; K63-V67 PolarHBondContact O-N 3.36Å; D64-V67 PolarHBondContact O-N 3.07Å; L65-V67 VanDerWaalsContact C-N 3.35Å; V67-M69 VanDerWaalsContact C-N 3.33Å; V67-M69 PolarHBondContact O-N 3.09Å; V67-K70 WeakPolarHBondContact O-CB 3.45Å; V67-K70 PolarHBondContact O-N 2.74Å; V67-E71 HydrophobicContact CG1-CG 4.2Å; V67-E71 WeakPolarHBondContact CG1-OE1 3.42Å; V67-E71 PolarHBondContact O-N 3.12Å
68M97.9Very high96.4Very high27 Ų2763.9 Ų63.913%0.13334%0.341CS..Hα-helixtrans-58.4-41.9-179.5-175.1174.3-66.300112.7D64 L65 K70 E71 R72 V106 H110D64-M68 WeakPolarHBondContact O-CB 3.38Å; D64-M68 PolarHBondContact O-N 2.76Å; L65-M68 PolarHBondContact O-N 3.05Å; M68-K70 VanDerWaalsContact C-N 3.28Å; M68-K70 PolarHBondContact O-N 3.41Å; M68-E71 PolarHBondContact O-N 3.23Å; M68-R72 HydrophobicContact CG-CG 3.93Å; M68-R72 WeakPolarHBondContact O-CB 3.46Å; M68-R72 VanDerWaalsContact O-CG 3.22Å; M68-R72 WeakPolarHBondContact O-CG 3.34Å; M68-R72 PolarHBondContact O-N 3.17Å; M68-V106 HydrophobicContact CB-CG1 4.47Å; M68-V106 HydrophobicContact CE-CB 4.37Å; M68-V106 HydrophobicContact CE-CG1 3.72Å; M68-V106 HydrophobicContact SD-CG1 4.05Å; M68-H110 HydrophobicContact CG-CB 4.32Å; M68-H110 HydrophobicContact SD-CB 3.61Å
69M97.7Very high96.4Very high2 Ų262.8 Ų62.81%0.0134%0.339CS..Hα-helixtrans-58.3-40.6176.4-71.816955.900112.3L65 V67 A73 V83 L84 F87 M113L65-M69 HydrophobicContact CG-SD 4.45Å; L65-M69 VanDerWaalsContact O-CG 3.3Å; L65-M69 WeakPolarHBondContact O-CG 3.09Å; L65-M69 PolarHBondContact O-N 3.22Å; V67-M69 VanDerWaalsContact C-N 3.33Å; V67-M69 PolarHBondContact O-N 3.09Å; M69-A73 VanDerWaalsContact O-CB 3.29Å; M69-A73 WeakPolarHBondContact O-CB 3.49Å; M69-A73 PolarHBondContact O-N 3.1Å; M69-V83 HydrophobicContact CE-CG1 4.11Å; M69-V83 HydrophobicContact CG-CG1 3.99Å; M69-V83 HydrophobicContact SD-CG1 4.47Å; M69-L84 HydrophobicContact CB-CD1 4.17Å; M69-L84 HydrophobicContact CE-CD1 4.24Å; M69-F87 HydrophobicContact CE-CB 3.59Å; M69-M113 HydrophobicContact CE-CE 4.13Å; M69-M113 HydrophobicContact SD-CE 3.71Å; M69-M113 HydrophobicContact SD-SD 4.16Å
70K97.2Very high96.4Very high141 Ų14160.6 Ų60.661%0.61332%0.317SS*.Hα-helixtrans-70.5-46.5178.7-68.2177.6-179.7-176.10111.6R66 V67 M68 A73 S74 L84R66-K70 PolarHBondContact O-N 3.22Å; V67-K70 WeakPolarHBondContact O-CB 3.45Å; V67-K70 PolarHBondContact O-N 2.74Å; M68-K70 VanDerWaalsContact C-N 3.28Å; M68-K70 PolarHBondContact O-N 3.41Å; K70-A73 PolarHBondContact O-N 3.19Å; K70-S74 PolarHBondContact O-N 3.37Å; K70-S74 VanDerWaalsContact O-N 3.11Å; K70-L84 HydrophobicContact CG-CD1 3.97Å
71E96.8Very high96.4Very high106 Ų10661.7 Ų61.750%0.49531%0.314SS..Hα-helixtrans-59.8-51.9178.9-70.8175.7165.300110.8V67 M68 A73 S74 E75V67-E71 HydrophobicContact CG1-CG 4.2Å; V67-E71 WeakPolarHBondContact CG1-OE1 3.42Å; V67-E71 PolarHBondContact O-N 3.12Å; M68-E71 PolarHBondContact O-N 3.23Å; E71-A73 VanDerWaalsContact C-N 3.35Å; E71-A73 PolarHBondContact O-N 2.87Å; E71-S74 WeakPolarHBondContact O-CB 3.37Å; E71-S74 PolarHBondContact O-N 3.24Å; E71-S74 PolarHBondContact O-OG 3.32Å; E71-E75 WeakPolarHBondContact O-CG 3.34Å; E71-E75 PolarHBondContact O-N 3.37Å; E71-E75 VanDerWaalsContact O-N 3.12Å
72R96.2Very high96.4Very high91 Ų9164.8 Ų64.834%0.34333%0.33SS..Hα-helixtrans-63.5-37-178.8-65-58.1-172.3-168.7-2.7113.2M68 S74 E75 A80M68-R72 HydrophobicContact CG-CG 3.93Å; M68-R72 WeakPolarHBondContact O-CB 3.46Å; M68-R72 VanDerWaalsContact O-CG 3.22Å; M68-R72 WeakPolarHBondContact O-CG 3.34Å; M68-R72 PolarHBondContact O-N 3.17Å; R72-S74 VanDerWaalsContact C-N 3.3Å; R72-S74 PolarHBondContact O-N 3.15Å; R72-E75 VanDerWaalsContact CD-OE2 3.23Å; R72-E75 WeakPolarHBondContact CD-OE2 3.33Å; R72-E75 IonicContact CZ-OE2 2.82Å; R72-E75 IonicContact NE-OE2 2.74Å; R72-E75 IonicContact NH1-OE1 3.31Å; R72-E75 PolarHBondContact NH1-OE1 3.02Å; R72-E75 IonicContact NH1-OE2 2.97Å; R72-E75 PolarHBondContact NH1-OE2 2.85Å; R72-E75 PolarHBondContact O-N 2.84Å; R72-A80 HydrophobicContact CB-CB 3.66Å
73A95.9Very high96.3Very high12 Ų1264.3 Ų64.310%0.09933%0.328CS..Hα-helixtrans-64.9-35.817400000112.1M69 K70 E71 E75 G76 K81 L84M69-A73 VanDerWaalsContact O-CB 3.29Å; M69-A73 WeakPolarHBondContact O-CB 3.49Å; M69-A73 PolarHBondContact O-N 3.1Å; K70-A73 PolarHBondContact O-N 3.19Å; E71-A73 VanDerWaalsContact C-N 3.35Å; E71-A73 PolarHBondContact O-N 2.87Å; A73-E75 VanDerWaalsContact C-N 3.34Å; A73-G76 PolarHBondContact O-N 2.93Å; A73-K81 HydrophobicContact CB-CG 4.21Å; A73-L84 HydrophobicContact CB-CB 3.97Å; A73-L84 HydrophobicContact CB-CD2 3.6Å; A73-L84 HydrophobicContact CB-CG 4.43Å
74S95.4Very high96.3Very high98 Ų9859.4 Ų59.469%0.68531%0.308SS*.Hα-helixtrans-72.8-24.2178.576.30000113.9K70 E71 R72 G76K70-S74 PolarHBondContact O-N 3.37Å; K70-S74 VanDerWaalsContact O-N 3.11Å; E71-S74 WeakPolarHBondContact O-CB 3.37Å; E71-S74 PolarHBondContact O-N 3.24Å; E71-S74 PolarHBondContact O-OG 3.32Å; R72-S74 VanDerWaalsContact C-N 3.3Å; R72-S74 PolarHBondContact O-N 3.15Å; S74-G76 PolarHBondContact O-N 3.15Å
75E94.9Very high96.3Very high124 Ų12461.6 Ų61.658%0.57932%0.32SS*.THydrogen-bonded Turntrans-73.2-4176.5-70.7172.9175.900113.5E71 R72 A73E71-E75 WeakPolarHBondContact O-CG 3.34Å; E71-E75 PolarHBondContact O-N 3.37Å; E71-E75 VanDerWaalsContact O-N 3.12Å; R72-E75 VanDerWaalsContact CD-OE2 3.23Å; R72-E75 WeakPolarHBondContact CD-OE2 3.33Å; R72-E75 IonicContact CZ-OE2 2.82Å; R72-E75 IonicContact NE-OE2 2.74Å; R72-E75 IonicContact NH1-OE1 3.31Å; R72-E75 PolarHBondContact NH1-OE1 3.02Å; R72-E75 IonicContact NH1-OE2 2.97Å; R72-E75 PolarHBondContact NH1-OE2 2.85Å; R72-E75 PolarHBondContact O-N 2.84Å; A73-E75 VanDerWaalsContact C-N 3.34Å
76G85.9Confident96.2Very high44 Ų4467.2 Ų67.245%0.45434%0.341SS..THydrogen-bonded Turntrans91.17.1176.100000115.4A73 S74 D78A73-G76 PolarHBondContact O-N 2.93Å; S74-G76 PolarHBondContact O-N 3.15Å; G76-D78 PolarHBondContact O-N 2.8Å
77D92Very high96.2Very high50 Ų5064.2 Ų64.227%0.26733%0.33SS..  trans-71.1112.3172.7177.7-12.8000110.5L79 A80 K81 K114D77-L79 VanDerWaalsContact C-N 3.31Å; D77-L79 PolarHBondContact O-N 3.28Å; D77-L79 WeakPolarHBondContact OD1-CB 3.36Å; D77-L79 PolarHBondContact OD1-N 3.35Å; D77-A80 HydrophobicContact CB-CB 3.72Å; D77-A80 WeakPolarHBondContact O-CB 3.36Å; D77-A80 PolarHBondContact O-N 2.82Å; D77-A80 VanDerWaalsContact O-N 3.07Å; D77-A80 PolarHBondContact OD1-N 2.96Å; D77-K81 PolarHBondContact O-N 3.17Å; D77-K114 VanDerWaalsContact OD2-CE 3.23Å; D77-K114 WeakPolarHBondContact OD2-CE 3.47Å; D77-K114 IonicContact OD2-NZ 2.69Å; D77-K114 PolarHBondContact OD2-NZ 3.19Å
78D94.8Very high96Very high105 Ų10562 Ų6256%0.56132%0.32SS*.Hα-helixtrans-63-33.2-177.4-71-21.5000113.5G76 K81 L82G76-D78 PolarHBondContact O-N 2.8Å; D78-K81 PolarHBondContact O-N 2.63Å; D78-K81 IonicContact OD1-NZ 3.31Å; D78-K81 PolarHBondContact OD1-NZ 2.9Å; D78-L82 WeakPolarHBondContact O-CG 3.22Å; D78-L82 PolarHBondContact O-N 2.95Å
79L96.1Very high96Very high36 Ų3668.7 Ų68.719%0.18836%0.356CS..Hα-helixtrans-71-36.4174-69.2177.1000110.7D77 K81 L82 V83 K114 V117 R118D77-L79 VanDerWaalsContact C-N 3.31Å; D77-L79 PolarHBondContact O-N 3.28Å; D77-L79 WeakPolarHBondContact OD1-CB 3.36Å; D77-L79 PolarHBondContact OD1-N 3.35Å; L79-K81 VanDerWaalsContact C-N 3.34Å; L79-L82 HydrophobicContact CD2-CD1 4.42Å; L79-L82 PolarHBondContact O-N 3.08Å; L79-V83 WeakPolarHBondContact O-CG2 3.39Å; L79-V83 PolarHBondContact O-N 2.92Å; L79-K114 HydrophobicContact CB-CB 4.37Å; L79-K114 HydrophobicContact CB-CG 4.15Å; L79-V117 HydrophobicContact CD2-CG2 4.24Å; L79-R118 HydrophobicContact CD1-CB 4.36Å; L79-R118 HydrophobicContact CD2-CB 4.09Å
80A97.1Very high95.9Very high0 Ų073.2 Ų73.20%038%0.376CS..Hα-helixtrans-65.8-36.317600000112.3R72 D77 V83 L84R72-A80 HydrophobicContact CB-CB 3.66Å; D77-A80 HydrophobicContact CB-CB 3.72Å; D77-A80 WeakPolarHBondContact O-CB 3.36Å; D77-A80 PolarHBondContact O-N 2.82Å; D77-A80 VanDerWaalsContact O-N 3.07Å; D77-A80 PolarHBondContact OD1-N 2.96Å; A80-V83 WeakPolarHBondContact O-CB 3.1Å; A80-V83 PolarHBondContact O-N 3.34Å; A80-L84 PolarHBondContact O-N 3.3Å
81K97.6Very high95.9Very high81 Ų8170.1 Ų70.135%0.35237%0.37SS..Hα-helixtrans-60.5-48.7171.2-66.7172.3-166.5153.90111.4A73 D77 D78 L79 V83 L84 D85A73-K81 HydrophobicContact CB-CG 4.21Å; D77-K81 PolarHBondContact O-N 3.17Å; D78-K81 PolarHBondContact O-N 2.63Å; D78-K81 IonicContact OD1-NZ 3.31Å; D78-K81 PolarHBondContact OD1-NZ 2.9Å; L79-K81 VanDerWaalsContact C-N 3.34Å; K81-V83 VanDerWaalsContact C-N 3.26Å; K81-V83 PolarHBondContact O-N 3.15Å; K81-L84 PolarHBondContact O-N 3.29Å; K81-D85 VanDerWaalsContact O-CG 3.29Å; K81-D85 PolarHBondContact O-N 3.02Å
82L97.6Very high96Very high72 Ų7268.5 Ų68.538%0.37737%0.365SS..Hα-helixtrans-61-35.3176.3-68.6174.6000112.8D78 L79 R86 V117D78-L82 WeakPolarHBondContact O-CG 3.22Å; D78-L82 PolarHBondContact O-N 2.95Å; L79-L82 HydrophobicContact CD2-CD1 4.42Å; L79-L82 PolarHBondContact O-N 3.08Å; L82-R86 VanDerWaalsContact O-CB 3.25Å; L82-R86 WeakPolarHBondContact O-CB 3.48Å; L82-R86 PolarHBondContact O-N 3.43Å; L82-V117 HydrophobicContact CB-CB 4.35Å; L82-V117 HydrophobicContact CB-CG2 4.17Å
83V98.2Very high95.9Very high0 Ų067.4 Ų67.40%037%0.371CS..Hα-helixtrans-62.8-48.8172.21650000110.6M69 L79 A80 K81 R86 F87 M113 K114 V117M69-V83 HydrophobicContact CE-CG1 4.11Å; M69-V83 HydrophobicContact CG-CG1 3.99Å; M69-V83 HydrophobicContact SD-CG1 4.47Å; L79-V83 WeakPolarHBondContact O-CG2 3.39Å; L79-V83 PolarHBondContact O-N 2.92Å; A80-V83 WeakPolarHBondContact O-CB 3.1Å; A80-V83 PolarHBondContact O-N 3.34Å; K81-V83 VanDerWaalsContact C-N 3.26Å; K81-V83 PolarHBondContact O-N 3.15Å; V83-R86 PolarHBondContact O-N 3.49Å; V83-F87 HydrophobicContact CG1-CD2 4.2Å; V83-F87 WeakPolarHBondContact O-CB 3.34Å; V83-F87 WeakPolarHBondContact O-CD2 3.25Å; V83-F87 PolarHBondContact O-N 3.26Å; V83-M113 HydrophobicContact CG1-CB 3.82Å; V83-M113 HydrophobicContact CG1-CE 3.97Å; V83-M113 HydrophobicContact CG1-SD 4.27Å; V83-M113 VanDerWaalsContact CG2-C 3.48Å; V83-M113 HydrophobicContact CG2-CB 3.87Å; V83-M113 WeakPolarHBondContact CG2-O 3.42Å; V83-K114 HydrophobicContact CG2-CB 4.48Å; V83-K114 HydrophobicContact CG2-CG 3.91Å; V83-V117 HydrophobicContact CG2-CG1 4.07Å; V83-V117 HydrophobicContact CG2-CG2 3.75Å
84L98.1Very high95.9Very high46 Ų4668.5 Ų68.524%0.24138%0.375CS..Hα-helixtrans-61.9-46.4178.8-177.363.2000111.6M69 K70 A73 A80 K81 R86 F87 G88M69-L84 HydrophobicContact CB-CD1 4.17Å; M69-L84 HydrophobicContact CE-CD1 4.24Å; K70-L84 HydrophobicContact CG-CD1 3.97Å; A73-L84 HydrophobicContact CB-CB 3.97Å; A73-L84 HydrophobicContact CB-CD2 3.6Å; A73-L84 HydrophobicContact CB-CG 4.43Å; A80-L84 PolarHBondContact O-N 3.3Å; K81-L84 PolarHBondContact O-N 3.29Å; L84-R86 VanDerWaalsContact C-N 3.3Å; L84-R86 PolarHBondContact O-N 3.15Å; L84-F87 PolarHBondContact O-N 3.12Å; L84-G88 VanDerWaalsContact O-CA 3.27Å; L84-G88 WeakPolarHBondContact O-CA 3.46Å; L84-G88 PolarHBondContact O-N 3.09Å
85D97.6Very high96.1Very high126 Ų12663.8 Ų63.867%0.67434%0.343SS*.Hα-helixtrans-60.7-40.5179.3-67.4-14.6000111.8K81K81-D85 VanDerWaalsContact O-CG 3.29Å; K81-D85 PolarHBondContact O-N 3.02Å
86R96.4Very high96.2Very high118 Ų11857.9 Ų57.945%0.44532%0.315SS..Hα-helixtrans-77.4-37.7-177.9-178.3171.9-73.7-91.20.9113.2L82 V83 L84 K90L82-R86 VanDerWaalsContact O-CB 3.25Å; L82-R86 WeakPolarHBondContact O-CB 3.48Å; L82-R86 PolarHBondContact O-N 3.43Å; V83-R86 PolarHBondContact O-N 3.49Å; L84-R86 VanDerWaalsContact C-N 3.3Å; L84-R86 PolarHBondContact O-N 3.15Å; R86-K90 VanDerWaalsContact O-CE 3.29Å; R86-K90 WeakPolarHBondContact O-CE 3.47Å; R86-K90 WeakPolarHBondContact O-CG 3.28Å
87F97.9Very high96.8Very high5 Ų557.3 Ų57.32%0.02230%0.299CS..Hα-helixtrans-117.3-11.6-165.7-62.1-68.9000114.9M69 V83 L84 D89 K90 L94 L95 F98 M113 Y116 V117M69-F87 HydrophobicContact CE-CB 3.59Å; V83-F87 HydrophobicContact CG1-CD2 4.2Å; V83-F87 WeakPolarHBondContact O-CB 3.34Å; V83-F87 WeakPolarHBondContact O-CD2 3.25Å; V83-F87 PolarHBondContact O-N 3.26Å; L84-F87 PolarHBondContact O-N 3.12Å; F87-D89 VanDerWaalsContact C-N 3.29Å; F87-D89 PolarHBondContact O-N 3.04Å; F87-K90 HydrophobicContact CD1-CG 4.31Å; F87-K90 WeakPolarHBondContact O-CB 3.42Å; F87-K90 PolarHBondContact O-N 3.44Å; F87-L94 HydrophobicContact CD1-CD2 3.58Å; F87-L94 HydrophobicContact CE1-CD2 3.67Å; F87-L95 HydrophobicContact CB-CD2 4.02Å; F87-F98 AromaticContact CE1-CE2 3.98Å; F87-F98 HydrophobicContact CE1-CE2 3.98Å; F87-F98 HydrophobicContact CE1-CZ 4.04Å; F87-F98 HydrophobicContact CE2-CZ 4.36Å; F87-F98 HydrophobicContact CZ-CE2 4.09Å; F87-F98 AromaticContact CZ-CZ 3.69Å; F87-F98 HydrophobicContact CZ-CZ 3.69Å; F87-M113 HydrophobicContact CB-CE 3.42Å; F87-M113 VanDerWaalsContact CB-CE 3.42Å; F87-M113 HydrophobicContact CD1-CE 4.14Å; F87-M113 HydrophobicContact CD2-CE 3.37Å; F87-M113 HydrophobicContact CE2-CB 4.43Å; F87-M113 HydrophobicContact CE2-CE 4.06Å; F87-M113 HydrophobicContact CG-CE 3.38Å; F87-Y116 HydrophobicContact CE1-CE1 4.37Å; F87-Y116 HydrophobicContact CE2-CD1 4.01Å; F87-Y116 HydrophobicContact CE2-CE1 4.28Å; F87-Y116 AromaticContact CZ-CD1 3.58Å; F87-Y116 HydrophobicContact CZ-CD1 3.58Å; F87-Y116 AromaticContact CZ-CE1 3.51Å; F87-Y116 HydrophobicContact CZ-CE1 3.51Å; F87-Y116 HydrophobicContact CZ-CG 4.28Å; F87-V117 HydrophobicContact CE2-CG1 4.01Å
88G96Very high97.2Very high18 Ų1855.1 Ų55.119%0.18629%0.287CS..THydrogen-bonded Turntrans-53.5-43.3-172.600000113.6R66 L84R66-G88 PolarHBondContact NH1-O 2.84Å; L84-G88 VanDerWaalsContact O-CA 3.27Å; L84-G88 WeakPolarHBondContact O-CA 3.46Å; L84-G88 PolarHBondContact O-N 3.09Å
89D95.9Very high97.3Very high167 Ų16750.1 Ų50.189%0.89326%0.26SS*.THydrogen-bonded Turntrans-101.87.6-178.7-57.5-42.7000113.5F87F87-D89 VanDerWaalsContact C-N 3.29Å; F87-D89 PolarHBondContact O-N 3.04Å
90K97.4Very high97.4Very high98 Ų9848.5 Ų48.543%0.42625%0.252SS..SBendtrans-75.3149.9179.3-64.6-61.7-179.8-173.50111.1R66 R86 F87 L94R66-K90 PolarHBondContact NH2-O 2.87Å; R86-K90 VanDerWaalsContact O-CE 3.29Å; R86-K90 WeakPolarHBondContact O-CE 3.47Å; R86-K90 WeakPolarHBondContact O-CG 3.28Å; F87-K90 HydrophobicContact CD1-CG 4.31Å; F87-K90 WeakPolarHBondContact O-CB 3.42Å; F87-K90 PolarHBondContact O-N 3.44Å; K90-L94 HydrophobicContact CB-CD1 4.34Å; K90-L94 HydrophobicContact CB-CD2 4.43Å; K90-L94 HydrophobicContact CD-CD1 4.48Å; K90-L94 HydrophobicContact CG-CD1 4.4Å
91P97.1Very high97.5Very high75 Ų7549 Ų4949%0.48726%0.256SS..  trans-66.4154.2-179.128.2-36.2000112S93 L94 L95P91-S93 PolarHBondContact O-N 2.97Å; P91-L94 HydrophobicContact CG-CB 4.4Å; P91-L94 WeakPolarHBondContact O-CB 3.27Å; P91-L94 PolarHBondContact O-N 2.76Å; P91-L95 PolarHBondContact O-N 3.42Å
92D97.2Very high97.5Very high73 Ų7346.3 Ų46.339%0.3924%0.244SC..Hα-helixtrans-58.9-29.4179.2-76.3-3.5000113.1L62 R66 L94 L95 V96L62-D92 HydrophobicContact CD1-CB 3.8Å; L62-D92 HydrophobicContact CD2-CB 4.03Å; R66-D92 IonicContact CZ-OD1 2.74Å; R66-D92 VanDerWaalsContact CZ-OD1 3.31Å; R66-D92 IonicContact NE-OD1 3.79Å; R66-D92 PolarHBondContact NE-OD1 3.44Å; R66-D92 IonicContact NH2-OD1 3.92Å; R66-D92 PolarHBondContact NH2-OD1 3.03Å; D92-L94 PolarHBondContact O-N 3.31Å; D92-L95 PolarHBondContact O-N 3.47Å; D92-V96 WeakPolarHBondContact O-CB 3.47Å; D92-V96 PolarHBondContact O-N 3.36Å
93S94.8Very high97.5Very high67 Ų6747.8 Ų47.847%0.46925%0.247SC..Hα-helixtrans-61.4-23.6174.757.50000113.5P91 R97P91-S93 PolarHBondContact O-N 2.97Å; S93-R97 PolarHBondContact O-NE 3.28Å
94L97.1Very high97.5Very high35 Ų3548 Ų4818%0.18325%0.248CC..Hα-helixtrans-85.3-46.6172-171.9156.9000110.6F87 K90 P91 D92 V96 R97 F98F87-L94 HydrophobicContact CD1-CD2 3.58Å; F87-L94 HydrophobicContact CE1-CD2 3.67Å; K90-L94 HydrophobicContact CB-CD1 4.34Å; K90-L94 HydrophobicContact CB-CD2 4.43Å; K90-L94 HydrophobicContact CD-CD1 4.48Å; K90-L94 HydrophobicContact CG-CD1 4.4Å; P91-L94 HydrophobicContact CG-CB 4.4Å; P91-L94 WeakPolarHBondContact O-CB 3.27Å; P91-L94 PolarHBondContact O-N 2.76Å; D92-L94 PolarHBondContact O-N 3.31Å; L94-V96 VanDerWaalsContact C-N 3.3Å; L94-V96 PolarHBondContact O-N 3.39Å; L94-R97 VanDerWaalsContact O-CB 3.23Å; L94-R97 WeakPolarHBondContact O-CB 3.44Å; L94-R97 WeakPolarHBondContact O-CD 3.47Å; L94-R97 WeakPolarHBondContact O-CG 3.46Å; L94-R97 PolarHBondContact O-N 3.16Å; L94-R97 VanDerWaalsContact O-N 3.16Å; L94-F98 HydrophobicContact CD2-CE2 3.97Å
95L98.3Very high97.5Very high0 Ų048.7 Ų48.70%025%0.252CS..Hα-helixtrans-64.2-34.7-176.6-58.2-173.2000112.6L62 L65 R66 F87 P91 D92 R97 F98 L99 M113L62-L95 HydrophobicContact CD2-CB 3.74Å; L65-L95 HydrophobicContact CD2-CB 4.31Å; R66-L95 HydrophobicContact CG-CD1 4.02Å; R66-L95 VanDerWaalsContact CZ-CD1 3.41Å; F87-L95 HydrophobicContact CB-CD2 4.02Å; P91-L95 PolarHBondContact O-N 3.42Å; D92-L95 PolarHBondContact O-N 3.47Å; L95-R97 PolarHBondContact O-N 3.14Å; L95-R97 VanDerWaalsContact O-N 3.14Å; L95-F98 PolarHBondContact O-N 3.24Å; L95-F98 VanDerWaalsContact O-N 3.1Å; L95-L99 PolarHBondContact O-N 2.87Å; L95-M113 HydrophobicContact CD2-CE 3.87Å
96V98.1Very high97.5Very high0 Ų043.6 Ų43.60%023%0.225CC..Hα-helixtrans-60.7-24.5178.277.90000112.7R58 D92 L94 F98 L99 R100 F104R58-V96 HydrophobicContact CG-CG2 4.21Å; D92-V96 WeakPolarHBondContact O-CB 3.47Å; D92-V96 PolarHBondContact O-N 3.36Å; L94-V96 VanDerWaalsContact C-N 3.3Å; L94-V96 PolarHBondContact O-N 3.39Å; V96-F98 VanDerWaalsContact C-N 3.29Å; V96-F98 PolarHBondContact O-N 3.45Å; V96-L99 PolarHBondContact O-N 3.1Å; V96-R100 HydrophobicContact CG2-CG 4.31Å; V96-R100 WeakPolarHBondContact O-CB 3.46Å; V96-R100 WeakPolarHBondContact O-CG 3.46Å; V96-R100 PolarHBondContact O-N 2.99Å; V96-F104 HydrophobicContact CG2-CE1 4.34Å; V96-F104 HydrophobicContact CG2-CZ 4.06Å
97R98.4Very high97.6Very high32 Ų3241.5 Ų41.512%0.12123%0.225CC..Hα-helixtrans-57.9-44.6175.7-57.2171.9-172.8-176.2-2.3110.6S93 L94 L95 A101 L187 Q193 P231S93-R97 PolarHBondContact O-NE 3.28Å; L94-R97 VanDerWaalsContact O-CB 3.23Å; L94-R97 WeakPolarHBondContact O-CB 3.44Å; L94-R97 WeakPolarHBondContact O-CD 3.47Å; L94-R97 WeakPolarHBondContact O-CG 3.46Å; L94-R97 PolarHBondContact O-N 3.16Å; L94-R97 VanDerWaalsContact O-N 3.16Å; L95-R97 PolarHBondContact O-N 3.14Å; L95-R97 VanDerWaalsContact O-N 3.14Å; R97-A101 WeakPolarHBondContact O-CB 3.21Å; R97-A101 PolarHBondContact O-N 2.9Å; R97-L187 PolarHBondContact NE-O 3.12Å; R97-Q193 HydrophobicContact CG-CG 4.26Å; R97-P231 HydrophobicContact CB-CB 3.88Å; R97-P231 HydrophobicContact CB-CG 4Å
98F98.7Very high97.6Very high3 Ų347.7 Ų47.71%0.01325%0.249CC..Hα-helixtrans-67.8-41.7178.4-65.9-89.9000112F87 L94 L95 V96 A101 R102 A109 L112 M113 Y116 P231F87-F98 AromaticContact CE1-CE2 3.98Å; F87-F98 HydrophobicContact CE1-CE2 3.98Å; F87-F98 HydrophobicContact CE1-CZ 4.04Å; F87-F98 HydrophobicContact CE2-CZ 4.36Å; F87-F98 HydrophobicContact CZ-CE2 4.09Å; F87-F98 AromaticContact CZ-CZ 3.69Å; F87-F98 HydrophobicContact CZ-CZ 3.69Å; L94-F98 HydrophobicContact CD2-CE2 3.97Å; L95-F98 PolarHBondContact O-N 3.24Å; L95-F98 VanDerWaalsContact O-N 3.1Å; V96-F98 VanDerWaalsContact C-N 3.29Å; V96-F98 PolarHBondContact O-N 3.45Å; F98-A101 PolarHBondContact O-N 2.95Å; F98-R102 PolarHBondContact O-N 3.32Å; F98-A109 HydrophobicContact CB-CB 4.25Å; F98-L112 HydrophobicContact CD1-CB 4.34Å; F98-L112 HydrophobicContact CD1-CD2 3.8Å; F98-L112 HydrophobicContact CD1-CG 3.78Å; F98-L112 HydrophobicContact CE1-CG 4.23Å; F98-M113 HydrophobicContact CB-CG 4.16Å; F98-M113 HydrophobicContact CD1-CB 4.28Å; F98-M113 HydrophobicContact CD1-CG 3.33Å; F98-M113 HydrophobicContact CD2-CG 4.06Å; F98-M113 HydrophobicContact CE1-CB 4.26Å; F98-M113 HydrophobicContact CE1-CG 3.63Å; F98-M113 HydrophobicContact CE2-CG 4.31Å; F98-M113 HydrophobicContact CG-CG 3.58Å; F98-M113 HydrophobicContact CG-SD 4.36Å; F98-M113 HydrophobicContact CZ-CG 4.12Å; F98-Y116 HydrophobicContact CE1-CD2 4.3Å; F98-Y116 HydrophobicContact CE1-CG 4.31Å; F98-Y116 HydrophobicContact CZ-CD2 4.11Å; F98-Y116 HydrophobicContact CZ-CE2 4.46Å; F98-Y116 HydrophobicContact CZ-CG 4.23Å; F98-P231 HydrophobicContact CD1-CB 3.94Å; F98-P231 HydrophobicContact CD1-CG 4.34Å; F98-P231 HydrophobicContact CD2-CB 4.35Å; F98-P231 HydrophobicContact CD2-CG 4.42Å; F98-P231 HydrophobicContact CE1-CB 4.09Å; F98-P231 HydrophobicContact CE1-CG 4.02Å; F98-P231 HydrophobicContact CE2-CB 4.5Å; F98-P231 HydrophobicContact CE2-CG 4.11Å; F98-P231 HydrophobicContact CG-CB 4.06Å; F98-P231 HydrophobicContact CZ-CB 4.37Å; F98-P231 HydrophobicContact CZ-CG 3.89Å
99L98.6Very high97.8Very high0 Ų046.8 Ų46.80%024%0.24CC..Hα-helixtrans-61.5-49.4175.7-69.3171.5000111.3L62 L65 L95 V96 A101 R102 K103 F104 V106 A109L62-L99 HydrophobicContact CD2-CD1 3.85Å; L62-L99 HydrophobicContact CG-CD1 3.88Å; L65-L99 HydrophobicContact CD2-CD1 4.4Å; L65-L99 HydrophobicContact CD2-CD2 4.17Å; L65-L99 HydrophobicContact CD2-CG 4.03Å; L95-L99 PolarHBondContact O-N 2.87Å; V96-L99 PolarHBondContact O-N 3.1Å; L99-A101 PolarHBondContact O-N 3.33Å; L99-R102 CarbonylContact O-C 3.54Å; L99-R102 VanDerWaalsContact O-C 3.24Å; L99-R102 PolarHBondContact O-N 3.49Å; L99-K103 PolarHBondContact O-N 3.44Å; L99-F104 HydrophobicContact CB-CD1 4.04Å; L99-F104 HydrophobicContact CB-CE1 4.06Å; L99-F104 HydrophobicContact CB-CG 4.39Å; L99-F104 HydrophobicContact CB-CZ 4.45Å; L99-F104 HydrophobicContact CD1-CD1 4.41Å; L99-F104 HydrophobicContact CD1-CE1 4.34Å; L99-F104 PolarHBondContact O-N 2.98Å; L99-V106 HydrophobicContact CD2-CG2 4.29Å; L99-A109 HydrophobicContact CD2-CB 3.86Å; L99-A109 HydrophobicContact CG-CB 4.47Å
100R98.4Very high97.9Very high2 Ų238.9 Ų38.91%0.00820%0.197CC..Hα-helixtrans-59-45.7176.8-78.7175.2167.1176-5.4112L51 E53 V96 R102 K103 F104 E190L51-R100 HydrophobicContact CD1-CB 4.14Å; L51-R100 HydrophobicContact CD1-CG 4.17Å; L51-R100 WeakPolarHBondContact CD2-O 3.31Å; E53-R100 IonicContact OE1-CZ 3.66Å; E53-R100 IonicContact OE1-NE 3.43Å; E53-R100 PolarHBondContact OE1-NE 3.14Å; E53-R100 IonicContact OE1-NH2 3.55Å; E53-R100 PolarHBondContact OE1-NH2 3.48Å; E53-R100 IonicContact OE2-CZ 2.77Å; E53-R100 IonicContact OE2-NE 3.66Å; E53-R100 PolarHBondContact OE2-NE 3.37Å; E53-R100 IonicContact OE2-NH2 2.64Å; E53-R100 PolarHBondContact OE2-NH2 2.94Å; V96-R100 HydrophobicContact CG2-CG 4.31Å; V96-R100 WeakPolarHBondContact O-CB 3.46Å; V96-R100 WeakPolarHBondContact O-CG 3.46Å; V96-R100 PolarHBondContact O-N 2.99Å; R100-R102 PolarHBondContact O-N 3.23Å; R100-R102 VanDerWaalsContact O-N 3.09Å; R100-K103 PolarHBondContact O-N 3.35Å; R100-F104 HydrophobicContact CG-CE2 3.76Å; R100-F104 HydrophobicContact CG-CZ 4Å; R100-E190 IonicContact CZ-OE2 2.76Å; R100-E190 VanDerWaalsContact CZ-OE2 3.31Å; R100-E190 VanDerWaalsContact NH1-CB 3.3Å; R100-E190 VanDerWaalsContact NH1-CG 3.27Å; R100-E190 IonicContact NH1-OE1 3.79Å; R100-E190 IonicContact NH1-OE2 3.73Å; R100-E190 PolarHBondContact NH1-OE2 3.5Å; R100-E190 IonicContact NH2-OE2 3.45Å; R100-E190 PolarHBondContact NH2-OE2 2.99Å
101A97.6Very high97.9Very high10 Ų1038.8 Ų38.88%0.08320%0.198CC..Hα-helixtrans-60.9-21.2177.200000113.2R97 F98 L99 L112 P231R97-A101 WeakPolarHBondContact O-CB 3.21Å; R97-A101 PolarHBondContact O-N 2.9Å; F98-A101 PolarHBondContact O-N 2.95Å; L99-A101 PolarHBondContact O-N 3.33Å; A101-L112 HydrophobicContact CB-CD2 3.78Å; A101-P231 HydrophobicContact CB-CB 4.25Å
102R97.9Very high98Very high26 Ų2635.3 Ų35.310%0.09818%0.176CC..THydrogen-bonded Turntrans-119.625.1-179.9-64.3-65.6178-80.2-0.6113.8F98 L99 R100 F104 D105 R108 A109 L112 D228F98-R102 PolarHBondContact O-N 3.32Å; L99-R102 CarbonylContact O-C 3.54Å; L99-R102 VanDerWaalsContact O-C 3.24Å; L99-R102 PolarHBondContact O-N 3.49Å; R100-R102 PolarHBondContact O-N 3.23Å; R100-R102 VanDerWaalsContact O-N 3.09Å; R102-F104 PolarHBondContact O-N 3.37Å; R102-D105 VanDerWaalsContact O-CB 3.26Å; R102-D105 WeakPolarHBondContact O-CB 3.23Å; R102-D105 PolarHBondContact O-N 3.05Å; R102-D105 VanDerWaalsContact O-N 3.07Å; R102-R108 HydrophobicContact CB-CB 3.93Å; R102-R108 HydrophobicContact CG-CB 4.05Å; R102-A109 HydrophobicContact CB-CB 4.31Å; R102-L112 HydrophobicContact CG-CB 4.24Å; R102-L112 HydrophobicContact CG-CD2 4.06Å; R102-D228 IonicContact CZ-OD1 2.69Å; R102-D228 IonicContact NE-OD1 2.83Å; R102-D228 IonicContact NH2-OD1 3.7Å; R102-D228 PolarHBondContact NH2-OD1 2.87Å
103K97.4Very high98.1Very high103 Ų10331.9 Ų31.945%0.44816%0.157SC..THydrogen-bonded Turntrans5539.4173.3-53.1179.5177.1176.60113.1E50 L51 L99 R100 D105E50-K103 WeakPolarHBondContact O-CD 3.31Å; L51-K103 HydrophobicContact CD2-CG 4.12Å; L51-K103 CarbonylContact O-C 3.59Å; L51-K103 VanDerWaalsContact O-C 3.25Å; L99-K103 PolarHBondContact O-N 3.44Å; R100-K103 PolarHBondContact O-N 3.35Å; K103-D105 PolarHBondContact O-N 3.32Å
104F98Very high98.2Very high4 Ų430 Ų302%0.01814%0.141CC..THydrogen-bonded Turntrans54.434-177.3-71.5-99.7000113.4L51 E53 R57 R58 V96 L99 R100 R102L51-F104 HydrophobicContact CB-CD2 4.23Å; L51-F104 HydrophobicContact CB-CE2 4.38Å; L51-F104 WeakPolarHBondContact O-CD2 3.38Å; E53-F104 HydrophobicContact CB-CD2 4.06Å; E53-F104 HydrophobicContact CB-CE2 3.44Å; E53-F104 VanDerWaalsContact CB-CE2 3.44Å; E53-F104 HydrophobicContact CB-CZ 3.9Å; E53-F104 HydrophobicContact CG-CD2 4.48Å; E53-F104 HydrophobicContact CG-CE1 4.28Å; E53-F104 HydrophobicContact CG-CE2 3.52Å; E53-F104 HydrophobicContact CG-CZ 3.4Å; E53-F104 WeakPolarHBondContact OE2-CE2 3.29Å; R57-F104 HydrophobicContact CG-CB 4.3Å; R57-F104 HydrophobicContact CG-CD1 4.33Å; R57-F104 VanDerWaalsContact NE-CB 3.27Å; R57-F104 PolarHBondContact NH2-O 2.95Å; R58-F104 HydrophobicContact CB-CE1 4.1Å; R58-F104 HydrophobicContact CG-CE1 4.29Å; V96-F104 HydrophobicContact CG2-CE1 4.34Å; V96-F104 HydrophobicContact CG2-CZ 4.06Å; L99-F104 HydrophobicContact CB-CD1 4.04Å; L99-F104 HydrophobicContact CB-CE1 4.06Å; L99-F104 HydrophobicContact CB-CG 4.39Å; L99-F104 HydrophobicContact CB-CZ 4.45Å; L99-F104 HydrophobicContact CD1-CD1 4.41Å; L99-F104 HydrophobicContact CD1-CE1 4.34Å; L99-F104 PolarHBondContact O-N 2.98Å; R100-F104 HydrophobicContact CG-CE2 3.76Å; R100-F104 HydrophobicContact CG-CZ 4Å; R102-F104 PolarHBondContact O-N 3.37Å
105D98.4Very high98.3Very high61 Ų6128.4 Ų28.433%0.32613%0.133SC..  trans-91.4109.8163.8-177.9-45.5000108.2R102 K103 T107 R108 A109R102-D105 VanDerWaalsContact O-CB 3.26Å; R102-D105 WeakPolarHBondContact O-CB 3.23Å; R102-D105 PolarHBondContact O-N 3.05Å; R102-D105 VanDerWaalsContact O-N 3.07Å; K103-D105 PolarHBondContact O-N 3.32Å; D105-T107 PolarHBondContact OD1-N 3.06Å; D105-R108 HydrophobicContact CB-CB 4.03Å; D105-R108 HydrophobicContact CB-CG 4.2Å; D105-R108 VanDerWaalsContact CG-CG 3.46Å; D105-R108 PolarHBondContact O-N 2.95Å; D105-R108 WeakPolarHBondContact OD1-CB 3.36Å; D105-R108 WeakPolarHBondContact OD1-CG 3.26Å; D105-R108 PolarHBondContact OD1-N 2.93Å; D105-R108 WeakPolarHBondContact OD2-CD 3.3Å; D105-A109 VanDerWaalsContact O-CB 3.29Å; D105-A109 WeakPolarHBondContact O-CB 3.35Å; D105-A109 PolarHBondContact O-N 3.37Å
106V98.6Very high98.3Very high18 Ų1829.2 Ų29.211%0.10914%0.136CC..Hα-helixtrans-64.5-43.2-172.91790000111.3D64 L65 M68 L99 A109 H110D64-V106 HydrophobicContact CB-CG1 4.16Å; D64-V106 HydrophobicContact CB-CG2 4.04Å; L65-V106 HydrophobicContact CB-CG1 4.04Å; L65-V106 HydrophobicContact CD1-CG1 4.15Å; M68-V106 HydrophobicContact CB-CG1 4.47Å; M68-V106 HydrophobicContact CE-CB 4.37Å; M68-V106 HydrophobicContact CE-CG1 3.72Å; M68-V106 HydrophobicContact SD-CG1 4.05Å; L99-V106 HydrophobicContact CD2-CG2 4.29Å; V106-A109 PolarHBondContact O-N 3.11Å; V106-H110 PolarHBondContact O-N 3.18Å
107T98.4Very high98.3Very high74 Ų7429.6 Ų29.645%0.45414%0.138SC..Hα-helixtrans-62.8-46.9179.4-56.80000110.8D105 A109 H110 E111D105-T107 PolarHBondContact OD1-N 3.06Å; T107-A109 VanDerWaalsContact C-N 3.32Å; T107-A109 PolarHBondContact O-N 3.47Å; T107-H110 PolarHBondContact O-N 2.75Å; T107-E111 PolarHBondContact O-N 2.79Å
108R98.4Very high98.2Very high135 Ų13533.7 Ų33.751%0.50915%0.154SC..Hα-helixtrans-68.2-33.2178.2-65.917970170.28112.4R102 D105 E111 L112R102-R108 HydrophobicContact CB-CB 3.93Å; R102-R108 HydrophobicContact CG-CB 4.05Å; D105-R108 HydrophobicContact CB-CB 4.03Å; D105-R108 HydrophobicContact CB-CG 4.2Å; D105-R108 VanDerWaalsContact CG-CG 3.46Å; D105-R108 PolarHBondContact O-N 2.95Å; D105-R108 WeakPolarHBondContact OD1-CB 3.36Å; D105-R108 WeakPolarHBondContact OD1-CG 3.26Å; D105-R108 PolarHBondContact OD1-N 2.93Å; D105-R108 WeakPolarHBondContact OD2-CD 3.3Å; R108-E111 PolarHBondContact O-N 3.44Å; R108-L112 PolarHBondContact O-N 2.77Å
109A98.6Very high98.2Very high0 Ų033.8 Ų33.80%015%0.154CC..Hα-helixtrans-64.3-44.417400000111.2L65 F98 L99 R102 D105 V106 T107 L112 M113L65-A109 HydrophobicContact CD1-CB 4.37Å; F98-A109 HydrophobicContact CB-CB 4.25Å; L99-A109 HydrophobicContact CD2-CB 3.86Å; L99-A109 HydrophobicContact CG-CB 4.47Å; R102-A109 HydrophobicContact CB-CB 4.31Å; D105-A109 VanDerWaalsContact O-CB 3.29Å; D105-A109 WeakPolarHBondContact O-CB 3.35Å; D105-A109 PolarHBondContact O-N 3.37Å; V106-A109 PolarHBondContact O-N 3.11Å; T107-A109 VanDerWaalsContact C-N 3.32Å; T107-A109 PolarHBondContact O-N 3.47Å; A109-L112 WeakPolarHBondContact O-CB 3.49Å; A109-L112 PolarHBondContact O-N 3.26Å; A109-M113 WeakPolarHBondContact O-CG 3.4Å; A109-M113 PolarHBondContact O-N 3.36Å
110H98.5Very high98.1Very high1 Ų135.2 Ų35.21%0.00516%0.159CC..Hα-helixtrans-62.1-43.3174.5-176.7-94.9000112.3L65 M68 V106 T107 L112 M113 K114L65-H110 HydrophobicContact CD1-CB 4.06Å; M68-H110 HydrophobicContact CG-CB 4.32Å; M68-H110 HydrophobicContact SD-CB 3.61Å; V106-H110 PolarHBondContact O-N 3.18Å; T107-H110 PolarHBondContact O-N 2.75Å; H110-L112 VanDerWaalsContact C-N 3.27Å; H110-L112 PolarHBondContact O-N 3.29Å; H110-M113 WeakPolarHBondContact O-CA 3.14Å; H110-M113 WeakPolarHBondContact O-CB 3.29Å; H110-M113 PolarHBondContact O-N 2.92Å; H110-K114 PolarHBondContact O-N 3.31Å
111E98.3Very high98Very high95 Ų9541.4 Ų41.444%0.44419%0.187SC..Hα-helixtrans-62.7-33.7174.8-73.3-55.7128.700112.7T107 R108 K114 G115T107-E111 PolarHBondContact O-N 2.79Å; R108-E111 PolarHBondContact O-N 3.44Å; E111-K114 WeakPolarHBondContact O-CB 3.33Å; E111-K114 PolarHBondContact O-N 3.13Å; E111-K114 IonicContact OE1-NZ 2.58Å; E111-K114 PolarHBondContact OE1-NZ 2.97Å; E111-K114 IonicContact OE2-NZ 2.95Å; E111-G115 PolarHBondContact O-N 2.66Å
112L98.6Very high97.9Very high3 Ų345 Ų452%0.01621%0.205CC..Hα-helixtrans-67.1-37.8170.7175.461.7000112.1F98 A101 R102 R108 A109 H110 K114 G115 Y116 D228 P231F98-L112 HydrophobicContact CD1-CB 4.34Å; F98-L112 HydrophobicContact CD1-CD2 3.8Å; F98-L112 HydrophobicContact CD1-CG 3.78Å; F98-L112 HydrophobicContact CE1-CG 4.23Å; A101-L112 HydrophobicContact CB-CD2 3.78Å; R102-L112 HydrophobicContact CG-CB 4.24Å; R102-L112 HydrophobicContact CG-CD2 4.06Å; R108-L112 PolarHBondContact O-N 2.77Å; A109-L112 WeakPolarHBondContact O-CB 3.49Å; A109-L112 PolarHBondContact O-N 3.26Å; H110-L112 VanDerWaalsContact C-N 3.27Å; H110-L112 PolarHBondContact O-N 3.29Å; L112-K114 VanDerWaalsContact C-N 3.29Å; L112-K114 PolarHBondContact O-N 3.17Å; L112-G115 PolarHBondContact O-N 2.9Å; L112-Y116 WeakPolarHBondContact O-CB 3.46Å; L112-Y116 PolarHBondContact O-N 3.03Å; L112-D228 WeakPolarHBondContact CD1-O 3.32Å; L112-P231 HydrophobicContact CD2-CB 4.2Å
113M98.6Very high97.8Very high0 Ų045 Ų450%020%0.204CC..Hα-helixtrans-62.3-39.4173.7-64.5173.984.500111L65 M69 V83 F87 L95 F98 A109 H110 Y116 V117L65-M113 HydrophobicContact CD1-SD 4.02Å; L65-M113 HydrophobicContact CD2-SD 4.1Å; L65-M113 HydrophobicContact CG-SD 4.32Å; M69-M113 HydrophobicContact CE-CE 4.13Å; M69-M113 HydrophobicContact SD-CE 3.71Å; M69-M113 HydrophobicContact SD-SD 4.16Å; V83-M113 HydrophobicContact CG1-CB 3.82Å; V83-M113 HydrophobicContact CG1-CE 3.97Å; V83-M113 HydrophobicContact CG1-SD 4.27Å; V83-M113 VanDerWaalsContact CG2-C 3.48Å; V83-M113 HydrophobicContact CG2-CB 3.87Å; V83-M113 WeakPolarHBondContact CG2-O 3.42Å; F87-M113 HydrophobicContact CB-CE 3.42Å; F87-M113 VanDerWaalsContact CB-CE 3.42Å; F87-M113 HydrophobicContact CD1-CE 4.14Å; F87-M113 HydrophobicContact CD2-CE 3.37Å; F87-M113 HydrophobicContact CE2-CB 4.43Å; F87-M113 HydrophobicContact CE2-CE 4.06Å; F87-M113 HydrophobicContact CG-CE 3.38Å; L95-M113 HydrophobicContact CD2-CE 3.87Å; F98-M113 HydrophobicContact CB-CG 4.16Å; F98-M113 HydrophobicContact CD1-CB 4.28Å; F98-M113 HydrophobicContact CD1-CG 3.33Å; F98-M113 HydrophobicContact CD2-CG 4.06Å; F98-M113 HydrophobicContact CE1-CB 4.26Å; F98-M113 HydrophobicContact CE1-CG 3.63Å; F98-M113 HydrophobicContact CE2-CG 4.31Å; F98-M113 HydrophobicContact CG-CG 3.58Å; F98-M113 HydrophobicContact CG-SD 4.36Å; F98-M113 HydrophobicContact CZ-CG 4.12Å; A109-M113 WeakPolarHBondContact O-CG 3.4Å; A109-M113 PolarHBondContact O-N 3.36Å; H110-M113 WeakPolarHBondContact O-CA 3.14Å; H110-M113 WeakPolarHBondContact O-CB 3.29Å; H110-M113 PolarHBondContact O-N 2.92Å; M113-Y116 WeakPolarHBondContact O-CB 3.07Å; M113-Y116 PolarHBondContact O-N 2.97Å; M113-V117 PolarHBondContact O-N 3.2Å
114K98.3Very high97.8Very high28 Ų2842.6 Ų42.612%0.12220%0.2CC..Hα-helixtrans-62.3-44.2172.2-72.1174.456.7178.90111.8D77 L79 V83 H110 E111 L112 Y116 V117 R118D77-K114 VanDerWaalsContact OD2-CE 3.23Å; D77-K114 WeakPolarHBondContact OD2-CE 3.47Å; D77-K114 IonicContact OD2-NZ 2.69Å; D77-K114 PolarHBondContact OD2-NZ 3.19Å; L79-K114 HydrophobicContact CB-CB 4.37Å; L79-K114 HydrophobicContact CB-CG 4.15Å; V83-K114 HydrophobicContact CG2-CB 4.48Å; V83-K114 HydrophobicContact CG2-CG 3.91Å; H110-K114 PolarHBondContact O-N 3.31Å; E111-K114 WeakPolarHBondContact O-CB 3.33Å; E111-K114 PolarHBondContact O-N 3.13Å; E111-K114 IonicContact OE1-NZ 2.58Å; E111-K114 PolarHBondContact OE1-NZ 2.97Å; E111-K114 IonicContact OE2-NZ 2.95Å; L112-K114 VanDerWaalsContact C-N 3.29Å; L112-K114 PolarHBondContact O-N 3.17Å; K114-Y116 VanDerWaalsContact C-N 3.32Å; K114-Y116 PolarHBondContact O-N 2.64Å; K114-V117 VanDerWaalsContact O-CG2 3.28Å; K114-V117 WeakPolarHBondContact O-CG2 3.37Å; K114-V117 PolarHBondContact O-N 3.07Å; K114-R118 VanDerWaalsContact O-CB 3.26Å; K114-R118 WeakPolarHBondContact O-CB 3.27Å; K114-R118 PolarHBondContact O-N 2.77Å
115G98.2Very high97.6Very high2 Ų245.5 Ų45.52%0.02121%0.213CC..Hα-helixtrans-57.4-44173.600000112.6E111 L112 R118 F119 D228E111-G115 PolarHBondContact O-N 2.66Å; L112-G115 PolarHBondContact O-N 2.9Å; G115-R118 PolarHBondContact O-N 3.25Å; G115-F119 WeakPolarHBondContact O-CB 3.43Å; G115-F119 PolarHBondContact O-N 3Å; G115-D228 CarbonylContact C-O 3.49Å; G115-D228 WeakPolarHBondContact CA-O 3.46Å
116Y98.3Very high97.5Very high17 Ų1742.6 Ų42.67%0.06720%0.198CC..Hα-helixtrans-61.5-45.2177.4177-76.9000113.6F87 F98 L112 M113 K114 R120 E184 S229 F230F87-Y116 HydrophobicContact CE1-CE1 4.37Å; F87-Y116 HydrophobicContact CE2-CD1 4.01Å; F87-Y116 HydrophobicContact CE2-CE1 4.28Å; F87-Y116 AromaticContact CZ-CD1 3.58Å; F87-Y116 HydrophobicContact CZ-CD1 3.58Å; F87-Y116 AromaticContact CZ-CE1 3.51Å; F87-Y116 HydrophobicContact CZ-CE1 3.51Å; F87-Y116 HydrophobicContact CZ-CG 4.28Å; F98-Y116 HydrophobicContact CE1-CD2 4.3Å; F98-Y116 HydrophobicContact CE1-CG 4.31Å; F98-Y116 HydrophobicContact CZ-CD2 4.11Å; F98-Y116 HydrophobicContact CZ-CE2 4.46Å; F98-Y116 HydrophobicContact CZ-CG 4.23Å; L112-Y116 WeakPolarHBondContact O-CB 3.46Å; L112-Y116 PolarHBondContact O-N 3.03Å; M113-Y116 WeakPolarHBondContact O-CB 3.07Å; M113-Y116 PolarHBondContact O-N 2.97Å; K114-Y116 VanDerWaalsContact C-N 3.32Å; K114-Y116 PolarHBondContact O-N 2.64Å; Y116-R120 VanDerWaalsContact CD2-NH1 3.31Å; Y116-R120 VanDerWaalsContact CE2-CZ 3.49Å; Y116-R120 PolarHBondContact O-N 2.81Å; Y116-R120 PolarHBondContact OH-NH2 2.99Å; Y116-E184 WeakPolarHBondContact CE2-OE1 3.2Å; Y116-E184 PolarHBondContact OH-OE1 3.45Å; Y116-S229 WeakPolarHBondContact CA-O 3.22Å; Y116-S229 VanDerWaalsContact CB-O 3.31Å; Y116-S229 WeakPolarHBondContact CB-O 3.33Å; Y116-S229 WeakPolarHBondContact CD2-O 3.41Å; Y116-F230 HydrophobicContact CE2-CD1 4.4Å
117V97.8Very high97.2Very high7 Ų743.5 Ų43.54%0.04220%0.2CC..Hα-helixtrans-73.7-33.5178.1-60.70000111.7L79 L82 V83 F87 M113 K114 R120 K121L79-V117 HydrophobicContact CD2-CG2 4.24Å; L82-V117 HydrophobicContact CB-CB 4.35Å; L82-V117 HydrophobicContact CB-CG2 4.17Å; V83-V117 HydrophobicContact CG2-CG1 4.07Å; V83-V117 HydrophobicContact CG2-CG2 3.75Å; F87-V117 HydrophobicContact CE2-CG1 4.01Å; M113-V117 PolarHBondContact O-N 3.2Å; K114-V117 VanDerWaalsContact O-CG2 3.28Å; K114-V117 WeakPolarHBondContact O-CG2 3.37Å; K114-V117 PolarHBondContact O-N 3.07Å; V117-R120 PolarHBondContact O-N 3.46Å; V117-K121 PolarHBondContact O-N 3.49Å; V117-K121 VanDerWaalsContact O-N 3.1Å
118R97.7Very high96.7Very high118 Ų11845.6 Ų45.645%0.44521%0.205SC..Hα-helixtrans-63.8-45.4173.8178.7176.561.4-167.2-3.8111.2L79 K114 G115 R120 K121 D122L79-R118 HydrophobicContact CD1-CB 4.36Å; L79-R118 HydrophobicContact CD2-CB 4.09Å; K114-R118 VanDerWaalsContact O-CB 3.26Å; K114-R118 WeakPolarHBondContact O-CB 3.27Å; K114-R118 PolarHBondContact O-N 2.77Å; G115-R118 PolarHBondContact O-N 3.25Å; R118-R120 PolarHBondContact O-N 3.28Å; R118-K121 CarbonylContact O-C 3.59Å; R118-K121 WeakPolarHBondContact O-CA 3.45Å; R118-K121 WeakPolarHBondContact O-CB 3.24Å; R118-K121 PolarHBondContact O-N 3Å; R118-D122 WeakPolarHBondContact CG-OD2 3.37Å; R118-D122 WeakPolarHBondContact O-CB 3.44Å; R118-D122 VanDerWaalsContact O-CG 3.32Å; R118-D122 PolarHBondContact O-N 3.03Å
119F97.7Very high96Very high5 Ų546 Ų462%0.02222%0.217CC..Hα-helixtrans-54.6-42.9177.2-175.4-106.1000111.9G115 K121 D122 Y123 L126 F127 D224 M225 S229 F230G115-F119 WeakPolarHBondContact O-CB 3.43Å; G115-F119 PolarHBondContact O-N 3Å; F119-K121 VanDerWaalsContact C-N 3.32Å; F119-K121 PolarHBondContact O-N 3.44Å; F119-D122 PolarHBondContact O-N 3.18Å; F119-Y123 AromaticContact CD2-CD2 3.43Å; F119-Y123 HydrophobicContact CD2-CD2 3.43Å; F119-Y123 VanDerWaalsContact CD2-CD2 3.43Å; F119-Y123 AromaticContact CD2-CE2 3.63Å; F119-Y123 HydrophobicContact CD2-CE2 3.63Å; F119-Y123 AromaticContact CE2-CD2 3.36Å; F119-Y123 HydrophobicContact CE2-CD2 3.36Å; F119-Y123 AromaticContact CE2-CE2 3.59Å; F119-Y123 HydrophobicContact CE2-CE2 3.59Å; F119-Y123 HydrophobicContact CE2-CG 4.45Å; F119-Y123 HydrophobicContact CG-CD2 4.13Å; F119-Y123 HydrophobicContact CZ-CD2 4.02Å; F119-Y123 WeakPolarHBondContact O-CB 3.4Å; F119-Y123 WeakPolarHBondContact O-CD2 3.18Å; F119-Y123 PolarHBondContact O-N 2.89Å; F119-L126 HydrophobicContact CE1-CD1 4.26Å; F119-L126 HydrophobicContact CZ-CD1 3.9Å; F119-F127 AromaticContact CD1-CE2 3.65Å; F119-F127 HydrophobicContact CD1-CE2 3.65Å; F119-F127 AromaticContact CD1-CZ 3.52Å; F119-F127 HydrophobicContact CD1-CZ 3.52Å; F119-F127 AromaticContact CE1-CE2 3.7Å; F119-F127 HydrophobicContact CE1-CE2 3.7Å; F119-F127 AromaticContact CE1-CZ 3.49Å; F119-F127 HydrophobicContact CE1-CZ 3.49Å; F119-F127 VanDerWaalsContact CE1-CZ 3.49Å; F119-D224 HydrophobicContact CD2-CB 4.14Å; F119-D224 HydrophobicContact CE2-CB 4.03Å; F119-M225 HydrophobicContact CE2-CB 4.18Å; F119-M225 HydrophobicContact CZ-CB 3.85Å; F119-S229 VanDerWaalsContact CD2-OG 3.27Å; F119-S229 WeakPolarHBondContact CD2-OG 3.49Å; F119-S229 WeakPolarHBondContact CG-OG 3.27Å; F119-F230 AromaticContact CD1-CE2 3.94Å; F119-F230 HydrophobicContact CD1-CE2 3.94Å; F119-F230 HydrophobicContact CD1-CZ 4.35Å; F119-F230 AromaticContact CE1-CE2 3.7Å; F119-F230 HydrophobicContact CE1-CE2 3.7Å; F119-F230 HydrophobicContact CE1-CZ 4.14Å; F119-F230 HydrophobicContact CZ-CE2 4.45Å
120R96.6Very high95.2Very high30 Ų3048.5 Ų48.511%0.11323%0.23CC..Hα-helixtrans-68.4-28.8176.1-76.1168.8168.6721.2114.2Y116 V117 R118 F127 E184Y116-R120 VanDerWaalsContact CD2-NH1 3.31Å; Y116-R120 VanDerWaalsContact CE2-CZ 3.49Å; Y116-R120 PolarHBondContact O-N 2.81Å; Y116-R120 PolarHBondContact OH-NH2 2.99Å; V117-R120 PolarHBondContact O-N 3.46Å; R118-R120 PolarHBondContact O-N 3.28Å; R120-F127 HydrophobicContact CB-CD2 4.05Å; R120-F127 HydrophobicContact CB-CE2 4.15Å; R120-F127 HydrophobicContact CG-CD1 3.98Å; R120-F127 HydrophobicContact CG-CD2 3.6Å; R120-F127 HydrophobicContact CG-CE1 3.86Å; R120-F127 HydrophobicContact CG-CE2 3.47Å; R120-F127 VanDerWaalsContact CG-CE2 3.47Å; R120-F127 HydrophobicContact CG-CG 3.84Å; R120-F127 HydrophobicContact CG-CZ 3.59Å; R120-E184 IonicContact CZ-OE1 3.62Å; R120-E184 IonicContact NH2-OE1 3.96Å; R120-E184 PolarHBondContact NH2-OE1 3.31Å
121K95.7Very high94.2Very high133 Ų13351.2 Ų51.258%0.57825%0.247SC*.Hα-helixtrans-79.7-38.4176.9-178.3-179.8174.7-1790111.8V117 R118 F119V117-K121 PolarHBondContact O-N 3.49Å; V117-K121 VanDerWaalsContact O-N 3.1Å; R118-K121 CarbonylContact O-C 3.59Å; R118-K121 WeakPolarHBondContact O-CA 3.45Å; R118-K121 WeakPolarHBondContact O-CB 3.24Å; R118-K121 PolarHBondContact O-N 3Å; F119-K121 VanDerWaalsContact C-N 3.32Å; F119-K121 PolarHBondContact O-N 3.44Å
122D96.2Very high93.2Very high86 Ų8648.9 Ų48.946%0.4624%0.24SC..Hα-helixtrans-77.9-26.1-177.5-67.2-5.5000111.6R118 F119 P124R118-D122 WeakPolarHBondContact CG-OD2 3.37Å; R118-D122 WeakPolarHBondContact O-CB 3.44Å; R118-D122 VanDerWaalsContact O-CG 3.32Å; R118-D122 PolarHBondContact O-N 3.03Å; F119-D122 PolarHBondContact O-N 3.18Å; D122-P124 VanDerWaalsContact C-CD 3.48Å
123Y96.8Very high92.2Very high24 Ų2454.4 Ų54.49%0.09427%0.266CS..  trans-128.759.4-178.8-52.7-60.5000112.5F119 E125 L126 F127 K220 K221 D224F119-Y123 AromaticContact CD2-CD2 3.43Å; F119-Y123 HydrophobicContact CD2-CD2 3.43Å; F119-Y123 VanDerWaalsContact CD2-CD2 3.43Å; F119-Y123 AromaticContact CD2-CE2 3.63Å; F119-Y123 HydrophobicContact CD2-CE2 3.63Å; F119-Y123 AromaticContact CE2-CD2 3.36Å; F119-Y123 HydrophobicContact CE2-CD2 3.36Å; F119-Y123 AromaticContact CE2-CE2 3.59Å; F119-Y123 HydrophobicContact CE2-CE2 3.59Å; F119-Y123 HydrophobicContact CE2-CG 4.45Å; F119-Y123 HydrophobicContact CG-CD2 4.13Å; F119-Y123 HydrophobicContact CZ-CD2 4.02Å; F119-Y123 WeakPolarHBondContact O-CB 3.4Å; F119-Y123 WeakPolarHBondContact O-CD2 3.18Å; F119-Y123 PolarHBondContact O-N 2.89Å; Y123-E125 WeakPolarHBondContact CA-OE2 3.48Å; Y123-E125 PolarHBondContact O-N 2.87Å; Y123-L126 HydrophobicContact CG-CD1 4.38Å; Y123-L126 PolarHBondContact O-N 2.83Å; Y123-L126 VanDerWaalsContact O-N 3.1Å; Y123-F127 VanDerWaalsContact O-CD2 3.31Å; Y123-F127 WeakPolarHBondContact O-CD2 3.26Å; Y123-K220 PolarHBondContact OH-NZ 3.44Å; Y123-K220 VanDerWaalsContact OH-NZ 3.1Å; Y123-K221 HydrophobicContact CD1-CD 3.96Å; Y123-K221 HydrophobicContact CD1-CG 3.67Å; Y123-K221 HydrophobicContact CE1-CD 4.21Å; Y123-K221 HydrophobicContact CE1-CG 3.46Å; Y123-K221 VanDerWaalsContact CE1-CG 3.46Å; Y123-K221 HydrophobicContact CE2-CG 4.48Å; Y123-K221 HydrophobicContact CG-CG 4.27Å; Y123-D224 HydrophobicContact CE2-CB 4.23Å; Y123-D224 PolarHBondContact OH-OD2 3.25Å
124P96.1Very high91.3Very high54 Ų5456.5 Ų56.535%0.35128%0.283SS..G310 helixtrans-57.7-32.3-177.826.2-35.3000112.7D122 L126 F127 E128D122-P124 VanDerWaalsContact C-CD 3.48Å; P124-L126 PolarHBondContact O-N 2.97Å; P124-L126 VanDerWaalsContact O-N 3.09Å; P124-F127 PolarHBondContact O-N 3.04Å; P124-E128 WeakPolarHBondContact O-CG 3.31Å; P124-E128 PolarHBondContact O-N 2.97Å
125E94.4Very high90.9Very high64 Ų6455.2 Ų55.230%0.29928%0.277SS..G310 helixtrans-59.9-20.8178.272.4-77.6-175.200113.8Y123 R177 K221Y123-E125 WeakPolarHBondContact CA-OE2 3.48Å; Y123-E125 PolarHBondContact O-N 2.87Å; E125-R177 PolarHBondContact O-NH1 2.92Å; E125-K221 WeakPolarHBondContact OE1-CE 3.42Å; E125-K221 IonicContact OE1-NZ 2.7Å; E125-K221 PolarHBondContact OE1-NZ 3.18Å
126L95.1Very high90.7Very high0 Ų056.1 Ų56.10%028%0.28CS..G310 helixtrans-84.4-10.9175.5-58.6-176.8000113.1F119 Y123 P124 D173 L176 R177 K221F119-L126 HydrophobicContact CE1-CD1 4.26Å; F119-L126 HydrophobicContact CZ-CD1 3.9Å; Y123-L126 HydrophobicContact CG-CD1 4.38Å; Y123-L126 PolarHBondContact O-N 2.83Å; Y123-L126 VanDerWaalsContact O-N 3.1Å; P124-L126 PolarHBondContact O-N 2.97Å; P124-L126 VanDerWaalsContact O-N 3.09Å; L126-D173 HydrophobicContact CD2-CB 3.92Å; L126-L176 HydrophobicContact CD1-CB 4.34Å; L126-L176 HydrophobicContact CD1-CD1 4.28Å; L126-L176 HydrophobicContact CD2-CB 3.99Å; L126-R177 HydrophobicContact CB-CG 4.31Å; L126-R177 HydrophobicContact CD2-CG 4.08Å; L126-R177 WeakPolarHBondContact O-CG 3.4Å; L126-K221 HydrophobicContact CD1-CD 4.42Å
127F92.6Very high90.4Very high37 Ų3759 Ų5916%0.16230%0.303CS..THydrogen-bonded Turntrans-128.6-17.2-171.6-60.4-76.3000114F119 R120 Y123 P124 N129 L130 C180 F230F119-F127 AromaticContact CD1-CE2 3.65Å; F119-F127 HydrophobicContact CD1-CE2 3.65Å; F119-F127 AromaticContact CD1-CZ 3.52Å; F119-F127 HydrophobicContact CD1-CZ 3.52Å; F119-F127 AromaticContact CE1-CE2 3.7Å; F119-F127 HydrophobicContact CE1-CE2 3.7Å; F119-F127 AromaticContact CE1-CZ 3.49Å; F119-F127 HydrophobicContact CE1-CZ 3.49Å; F119-F127 VanDerWaalsContact CE1-CZ 3.49Å; R120-F127 HydrophobicContact CB-CD2 4.05Å; R120-F127 HydrophobicContact CB-CE2 4.15Å; R120-F127 HydrophobicContact CG-CD1 3.98Å; R120-F127 HydrophobicContact CG-CD2 3.6Å; R120-F127 HydrophobicContact CG-CE1 3.86Å; R120-F127 HydrophobicContact CG-CE2 3.47Å; R120-F127 VanDerWaalsContact CG-CE2 3.47Å; R120-F127 HydrophobicContact CG-CG 3.84Å; R120-F127 HydrophobicContact CG-CZ 3.59Å; Y123-F127 VanDerWaalsContact O-CD2 3.31Å; Y123-F127 WeakPolarHBondContact O-CD2 3.26Å; P124-F127 PolarHBondContact O-N 3.04Å; F127-N129 PolarHBondContact O-N 3.21Å; F127-L130 HydrophobicContact CD1-CD2 3.91Å; F127-L130 HydrophobicContact CE1-CD2 4.5Å; F127-L130 WeakPolarHBondContact O-CB 3.2Å; F127-L130 PolarHBondContact O-N 3.35Å; F127-C180 HydrophobicContact CE1-CB 4.12Å; F127-F230 HydrophobicContact CZ-CZ 4.31Å
128E87.7Confident90.3Very high118 Ų11858.8 Ų58.855%0.55130%0.302SS*.THydrogen-bonded Turntrans-60.7127.7172.4-78.2178-169.500110.7P124 L130 R177P124-E128 WeakPolarHBondContact O-CG 3.31Å; P124-E128 PolarHBondContact O-N 2.97Å; E128-L130 PolarHBondContact O-N 3.33Å; E128-L130 VanDerWaalsContact O-N 3.1Å; E128-R177 PolarHBondContact O-NH1 3.25Å; E128-R177 PolarHBondContact O-NH2 2.94Å
129N83.8Confident90.1Very high145 Ų14553.3 Ų53.378%0.77528%0.281SS*.THydrogen-bonded Turntrans50.833.3-178-54.2-40000113.4F127 T131F127-N129 PolarHBondContact O-N 3.21Å; N129-T131 PolarHBondContact O-N 2.93Å; N129-T131 VanDerWaalsContact O-N 3.13Å
130L81.9Confident90Very high51 Ų5155.4 Ų55.427%0.26729%0.291SS..  trans-76.9100.5-179.7-169.870.3000110.1F127 E128 V135 R177 V181F127-L130 HydrophobicContact CD1-CD2 3.91Å; F127-L130 HydrophobicContact CE1-CD2 4.5Å; F127-L130 WeakPolarHBondContact O-CB 3.2Å; F127-L130 PolarHBondContact O-N 3.35Å; E128-L130 PolarHBondContact O-N 3.33Å; E128-L130 VanDerWaalsContact O-N 3.1Å; L130-V135 HydrophobicContact CD1-CG1 3.75Å; L130-R177 HydrophobicContact CD1-CB 3.96Å; L130-R177 HydrophobicContact CD1-CG 4.26Å; L130-V181 HydrophobicContact CD1-CG2 3.69Å; L130-V181 HydrophobicContact CD2-CG2 3.71Å; L130-V181 HydrophobicContact CG-CG2 3.67Å
131T77.8Confident89.9Confident59 Ų5955.9 Ų55.936%0.36230%0.302SS..  trans-113.8159.9170.479.10000110.1N129 E133 A134N129-T131 PolarHBondContact O-N 2.93Å; N129-T131 VanDerWaalsContact O-N 3.13Å; T131-E133 WeakPolarHBondContact CB-OE2 3.46Å; T131-E133 PolarHBondContact O-N 3Å; T131-E133 PolarHBondContact OG1-N 2.76Å; T131-E133 PolarHBondContact OG1-OE2 3.45Å; T131-A134 WeakPolarHBondContact O-CB 3.4Å; T131-A134 PolarHBondContact O-N 3.49Å; T131-A134 VanDerWaalsContact O-N 3.11Å; T131-A134 PolarHBondContact OG1-N 3.31Å; T131-A134 VanDerWaalsContact OG1-N 3.14Å
132P77.7Confident89.8Confident46 Ų4649.8 Ų49.830%0.29928%0.276SS..Hα-helixtrans-50.8-41.2170.3-29.438.4000113A134 V135 R136 F305P132-A134 VanDerWaalsContact C-N 3.32Å; P132-A134 PolarHBondContact O-N 2.88Å; P132-V135 WeakPolarHBondContact O-CG2 3.34Å; P132-V135 PolarHBondContact O-N 3Å; P132-R136 PolarHBondContact O-N 3.43Å; P132-R136 VanDerWaalsContact O-N 3.07Å; P132-F305 HydrophobicContact CB-CB 4.39Å; P132-F305 HydrophobicContact CB-CD1 3.66Å; P132-F305 HydrophobicContact CB-CE1 4.14Å; P132-F305 HydrophobicContact CB-CG 4.07Å; P132-F305 HydrophobicContact CG-CD1 4.43Å
133E78.3Confident89.8Confident119 Ų11947.2 Ų47.256%0.55626%0.26SS*.Hα-helixtrans-65.3-36.8179.2-57.171-150.800111.3T131 V135 R136T131-E133 WeakPolarHBondContact CB-OE2 3.46Å; T131-E133 PolarHBondContact O-N 3Å; T131-E133 PolarHBondContact OG1-N 2.76Å; T131-E133 PolarHBondContact OG1-OE2 3.45Å; E133-V135 PolarHBondContact O-N 3.32Å; E133-R136 PolarHBondContact O-N 2.89Å
134A79.1Confident89.8Confident43 Ų4346 Ų4636%0.35526%0.256SS..Hα-helixtrans-66.1-16.7-179.500000114.1T131 P132T131-A134 WeakPolarHBondContact O-CB 3.4Å; T131-A134 PolarHBondContact O-N 3.49Å; T131-A134 VanDerWaalsContact O-N 3.11Å; T131-A134 PolarHBondContact OG1-N 3.31Å; T131-A134 VanDerWaalsContact OG1-N 3.14Å; P132-A134 VanDerWaalsContact C-N 3.32Å; P132-A134 PolarHBondContact O-N 2.88Å
135V90.2Very high89.8Confident1 Ų143.8 Ų43.81%0.00624%0.241CC..Hα-helixtrans-117.2-3.4176.8-60.20000112.7L130 P132 E133 T138 I139 R177 A178 V181 F305L130-V135 HydrophobicContact CD1-CG1 3.75Å; P132-V135 WeakPolarHBondContact O-CG2 3.34Å; P132-V135 PolarHBondContact O-N 3Å; E133-V135 PolarHBondContact O-N 3.32Å; V135-T138 PolarHBondContact O-N 3.3Å; V135-I139 HydrophobicContact CB-CD1 4.43Å; V135-I139 HydrophobicContact CG2-CD1 4.05Å; V135-I139 WeakPolarHBondContact O-CG1 3.48Å; V135-I139 PolarHBondContact O-N 3.31Å; V135-I139 VanDerWaalsContact O-N 3.1Å; V135-R177 HydrophobicContact CG1-CB 3.92Å; V135-A178 HydrophobicContact CB-CB 4.3Å; V135-V181 HydrophobicContact CG1-CG2 4.01Å; V135-V181 HydrophobicContact CG2-CB 3.88Å; V135-V181 HydrophobicContact CG2-CG1 3.88Å; V135-V181 HydrophobicContact CG2-CG2 3.82Å; V135-F305 HydrophobicContact CG2-CE2 4.45Å; V135-F305 HydrophobicContact CG2-CZ 3.99Å
136R92.4Very high89.9Confident21 Ų2140.8 Ų40.88%0.07923%0.227CC..Hα-helixtrans-61.7-49-175.3-175.8177.7-169.21259.2110.8P132 E133 T138 I139 E140 G306 E308P132-R136 PolarHBondContact O-N 3.43Å; P132-R136 VanDerWaalsContact O-N 3.07Å; E133-R136 PolarHBondContact O-N 2.89Å; R136-T138 VanDerWaalsContact C-N 3.3Å; R136-T138 PolarHBondContact O-N 3.45Å; R136-I139 PolarHBondContact O-N 3.37Å; R136-I139 VanDerWaalsContact O-N 3.12Å; R136-E140 HydrophobicContact CG-CG 4.22Å; R136-E140 WeakPolarHBondContact CG-OE1 3.31Å; R136-E140 IonicContact CZ-OE1 3.48Å; R136-E140 IonicContact NE-OE1 3.88Å; R136-E140 PolarHBondContact NE-OE1 3.08Å; R136-E140 IonicContact NH2-OE1 3.74Å; R136-E140 WeakPolarHBondContact O-CB 3.29Å; R136-E140 WeakPolarHBondContact O-CG 3.38Å; R136-E140 PolarHBondContact O-N 3.01Å; R136-G306 PolarHBondContact NH1-O 3.4Å; R136-G306 PolarHBondContact NH2-O 3.1Å; R136-E308 IonicContact NE-OE1 3.25Å
137S93.1Very high90Very high77 Ų7741 Ų4154%0.53823%0.228SC..Hα-helixtrans-58.3-40.7178.253.90000112.4I139 E140 A141S137-I139 VanDerWaalsContact C-N 3.35Å; S137-I139 PolarHBondContact O-N 2.85Å; S137-E140 PolarHBondContact O-N 3.29Å; S137-A141 WeakPolarHBondContact O-CB 3.28Å; S137-A141 PolarHBondContact O-N 3.42Å
138T95Very high90.2Very high4 Ų442.4 Ų42.43%0.02524%0.241CC..Hα-helixtrans-62.7-41.7176.7-42.90000111.7V135 R136 A141 G142 Y143 I170 E174 A178V135-T138 PolarHBondContact O-N 3.3Å; R136-T138 VanDerWaalsContact C-N 3.3Å; R136-T138 PolarHBondContact O-N 3.45Å; T138-A141 PolarHBondContact O-N 3.48Å; T138-G142 PolarHBondContact O-N 2.74Å; T138-Y143 VanDerWaalsContact CG2-O 3.28Å; T138-Y143 WeakPolarHBondContact CG2-O 3.32Å; T138-Y143 PolarHBondContact O-N 3.02Å; T138-I170 HydrophobicContact CG2-CG2 3.74Å; T138-E174 HydrophobicContact CG2-CB 4.27Å; T138-A178 HydrophobicContact CG2-CB 4.21Å
139I94.6Very high90.5Very high2 Ų238.6 Ų38.61%0.0123%0.228CC..Hα-helixtrans-73.3-38.3179.1-67.2166.6000111.1V135 R136 S137 A141 G142 A178 I182 A301 L304 F305V135-I139 HydrophobicContact CB-CD1 4.43Å; V135-I139 HydrophobicContact CG2-CD1 4.05Å; V135-I139 WeakPolarHBondContact O-CG1 3.48Å; V135-I139 PolarHBondContact O-N 3.31Å; V135-I139 VanDerWaalsContact O-N 3.1Å; R136-I139 PolarHBondContact O-N 3.37Å; R136-I139 VanDerWaalsContact O-N 3.12Å; S137-I139 VanDerWaalsContact C-N 3.35Å; S137-I139 PolarHBondContact O-N 2.85Å; I139-A141 PolarHBondContact O-N 3.37Å; I139-G142 WeakPolarHBondContact O-CA 3.36Å; I139-G142 PolarHBondContact O-N 3.33Å; I139-A178 HydrophobicContact CD1-CB 4.14Å; I139-A178 HydrophobicContact CG1-CB 3.85Å; I139-I182 HydrophobicContact CD1-CD1 3.81Å; I139-I182 HydrophobicContact CD1-CG1 3.87Å; I139-I182 HydrophobicContact CG1-CD1 4.06Å; I139-A301 HydrophobicContact CG2-CB 4.08Å; I139-L304 HydrophobicContact CD1-CD1 4.5Å; I139-L304 HydrophobicContact CG2-CD1 4.14Å; I139-F305 HydrophobicContact CD1-CE2 3.44Å; I139-F305 VanDerWaalsContact CD1-CE2 3.44Å; I139-F305 HydrophobicContact CD1-CZ 3.51Å
140E95.2Very high91.2Very high50 Ų5031.9 Ų31.923%0.23419%0.191CC..Hα-helixtrans-67.8-24174.1-71.3177.8170.100112.6R136 S137 G142 Y297 A301R136-E140 HydrophobicContact CG-CG 4.22Å; R136-E140 WeakPolarHBondContact CG-OE1 3.31Å; R136-E140 IonicContact CZ-OE1 3.48Å; R136-E140 IonicContact NE-OE1 3.88Å; R136-E140 PolarHBondContact NE-OE1 3.08Å; R136-E140 IonicContact NH2-OE1 3.74Å; R136-E140 WeakPolarHBondContact O-CB 3.29Å; R136-E140 WeakPolarHBondContact O-CG 3.38Å; R136-E140 PolarHBondContact O-N 3.01Å; S137-E140 PolarHBondContact O-N 3.29Å; E140-G142 VanDerWaalsContact C-N 3.27Å; E140-Y297 WeakPolarHBondContact O-CB 3.42Å; E140-A301 HydrophobicContact CG-CB 3.45Å; E140-A301 VanDerWaalsContact CG-CB 3.45Å
141A94.3Very high91.9Very high40 Ų4029.5 Ų29.533%0.33118%0.179SC..THydrogen-bonded Turntrans-79.3-7168.500000113.5S137 T138 I139 Y143 I170S137-A141 WeakPolarHBondContact O-CB 3.28Å; S137-A141 PolarHBondContact O-N 3.42Å; T138-A141 PolarHBondContact O-N 3.48Å; I139-A141 PolarHBondContact O-N 3.37Å; A141-Y143 HydrophobicContact CB-CD2 3.97Å; A141-Y143 HydrophobicContact CB-CE2 4.21Å; A141-Y143 WeakPolarHBondContact O-CD2 3.37Å; A141-Y143 VanDerWaalsContact O-CE2 3.26Å; A141-Y143 WeakPolarHBondContact O-CE2 3.37Å; A141-I170 HydrophobicContact CB-CD1 3.44Å; A141-I170 VanDerWaalsContact CB-CD1 3.44Å
142G94.4Very high92.7Very high5 Ų529.7 Ų29.75%0.05218%0.175CC..THydrogen-bonded Turntrans95.515.8176.600000115.4T138 I139 E140 P144 V145T138-G142 PolarHBondContact O-N 2.74Å; I139-G142 WeakPolarHBondContact O-CA 3.36Å; I139-G142 PolarHBondContact O-N 3.33Å; E140-G142 VanDerWaalsContact C-N 3.27Å; G142-P144 CarbonylContact O-C 3.58Å; G142-V145 WeakPolarHBondContact O-CG2 3.11Å
143Y95.5Very high93.5Very high31 Ų3131.5 Ų31.512%0.12218%0.176CC..SBendtrans-122.9102.7-173.8-53.3-73.1000113.6T138 A141 F160 N161 W165 I170 A178T138-Y143 VanDerWaalsContact CG2-O 3.28Å; T138-Y143 WeakPolarHBondContact CG2-O 3.32Å; T138-Y143 PolarHBondContact O-N 3.02Å; A141-Y143 HydrophobicContact CB-CD2 3.97Å; A141-Y143 HydrophobicContact CB-CE2 4.21Å; A141-Y143 WeakPolarHBondContact O-CD2 3.37Å; A141-Y143 VanDerWaalsContact O-CE2 3.26Å; A141-Y143 WeakPolarHBondContact O-CE2 3.37Å; Y143-F160 HydrophobicContact CD1-CD2 4.21Å; Y143-F160 AromaticContact CD1-CE2 3.72Å; Y143-F160 HydrophobicContact CD1-CE2 3.72Å; Y143-F160 HydrophobicContact CD1-CZ 4.33Å; Y143-N161 WeakPolarHBondContact CE1-O 3.23Å; Y143-W165 HydrophobicContact CE1-CB 4.01Å; Y143-W165 HydrophobicContact CE1-CG 4.18Å; Y143-I170 HydrophobicContact CD2-CD1 3.52Å; Y143-I170 HydrophobicContact CE2-CD1 3.83Å; Y143-A178 WeakPolarHBondContact O-CB 3.49Å
144P96.1Very high94.4Very high0 Ų025.9 Ų25.90%015%0.15CC..SBendcis-82.5172-17.138.1-37.3000112G142 L159 Y179 I182G142-P144 CarbonylContact O-C 3.58Å; P144-L159 WeakPolarHBondContact CB-O 3.35Å; P144-Y179 HydrophobicContact CB-CD1 4.47Å; P144-Y179 HydrophobicContact CB-CD2 4.49Å; P144-Y179 HydrophobicContact CB-CE1 3.83Å; P144-Y179 HydrophobicContact CB-CE2 3.86Å; P144-Y179 VanDerWaalsContact CB-CZ 3.48Å; P144-Y179 HydrophobicContact CG-CD1 3.76Å; P144-Y179 HydrophobicContact CG-CD2 3.96Å; P144-Y179 HydrophobicContact CG-CE1 3.61Å; P144-Y179 HydrophobicContact CG-CE2 3.83Å; P144-Y179 HydrophobicContact CG-CG 3.92Å; P144-I182 HydrophobicContact CG-CD1 3.63Å
145V96.3Very high95.3Very high7 Ų724.7 Ų24.74%0.04214%0.136CC..EExtended strand (participates in β ladder)trans-97137.7173.6-173.50000110.3G142 L158 L159 A295 Y297 I300G142-V145 WeakPolarHBondContact O-CG2 3.11Å; V145-L158 WeakPolarHBondContact O-CA 3.44Å; V145-L159 HydrophobicContact CB-CB 4.16Å; V145-L159 PolarHBondContact N-O 2.83Å; V145-L159 PolarHBondContact O-N 2.82Å; V145-A295 HydrophobicContact CG1-CB 3.82Å; V145-Y297 HydrophobicContact CG1-CD1 4.28Å; V145-Y297 HydrophobicContact CG1-CE1 4.29Å; V145-Y297 HydrophobicContact CG2-CD1 3.89Å; V145-Y297 HydrophobicContact CG2-CE1 3.56Å; V145-I300 HydrophobicContact CG1-CD1 3.54Å
146V97.8Very high95.7Very high0 Ų024.6 Ų24.60%014%0.136CC..EExtended strand (participates in β ladder)trans-99.7119.4169.5-176.10000108.7V32 F33 V156 L158 I182 L186 I300 L304V32-V146 HydrophobicContact CG1-CG1 3.72Å; F33-V146 HydrophobicContact CE1-CB 3.97Å; F33-V146 HydrophobicContact CE1-CG1 3.67Å; F33-V146 HydrophobicContact CZ-CB 3.94Å; F33-V146 HydrophobicContact CZ-CG1 3.71Å; V146-V156 HydrophobicContact CG1-CG1 4.1Å; V146-L158 HydrophobicContact CB-CD2 4.41Å; V146-L158 HydrophobicContact CG1-CD2 4.35Å; V146-L158 HydrophobicContact CG2-CD2 3.82Å; V146-I182 HydrophobicContact CG2-CD1 4Å; V146-I182 HydrophobicContact CG2-CG1 4.26Å; V146-I182 HydrophobicContact CG2-CG2 3.61Å; V146-L186 HydrophobicContact CG1-CD1 3.76Å; V146-L186 HydrophobicContact CG2-CD1 4.15Å; V146-I300 HydrophobicContact CB-CG2 4.17Å; V146-I300 VanDerWaalsContact O-CD1 3.31Å; V146-I300 WeakPolarHBondContact O-CD1 3.19Å; V146-L304 HydrophobicContact CG2-CD1 4.11Å
147L97.1Very high96Very high6 Ų623.6 Ų23.63%0.03113%0.132CC..EExtended strand (participates in β ladder)trans-65.4131.4176.1-162.860.9000110.3S149 V157 L159 I283 P285L147-S149 PolarHBondContact O-N 3.4Å; L147-V157 HydrophobicContact CB-CB 3.87Å; L147-V157 WeakPolarHBondContact CB-O 3.4Å; L147-V157 HydrophobicContact CD2-CB 3.93Å; L147-V157 HydrophobicContact CD2-CG1 4.25Å; L147-V157 HydrophobicContact CD2-CG2 4.14Å; L147-V157 PolarHBondContact N-O 2.9Å; L147-L159 HydrophobicContact CD1-CD1 4.14Å; L147-I283 WeakPolarHBondContact CD1-O 3.4Å; L147-I283 HydrophobicContact CD2-CB 4.33Å; L147-I283 HydrophobicContact CD2-CD1 3.82Å; L147-I283 HydrophobicContact CD2-CG1 4.08Å; L147-P285 HydrophobicContact CD1-CG 4.07Å
148P95.1Very high96.3Very high65 Ų6520 Ų2042%0.42211%0.106SC..EExtended strand (participates in β ladder)trans-65.5-24.1-179.9-2535.5000114.3V32 F33 I300V32-P148 VanDerWaalsContact CG2-O 3.25Å; V32-P148 WeakPolarHBondContact CG2-O 3.4Å; F33-P148 HydrophobicContact CE2-CB 4.14Å; F33-P148 HydrophobicContact CE2-CG 4.47Å; P148-I300 HydrophobicContact CG-CG1 4.41Å
149S95.6Very high96.4Very high39 Ų3919.8 Ų19.827%0.27311%0.105SC..EExtended strand (participates in β ladder)trans-98.8148173.2-171.40000111.3L147L147-S149 PolarHBondContact O-N 3.4Å
150R97.9Very high96.6Very high3 Ų320.3 Ų20.31%0.01111%0.108CC..EExtended strand (participates in β ladder)trans-74.6161.6162.2-63171.2-176.7-76.1-7.9109.8H29 G30 S31 V32 G154 R155 N189 T192 I283H29-R150 HydrophobicContact CB-CB 4.29Å; G30-R150 VanDerWaalsContact O-CD 3.22Å; G30-R150 WeakPolarHBondContact O-CD 3.49Å; G30-R150 PolarHBondContact O-NE 3.48Å; S31-R150 PolarHBondContact O-NE 3.12Å; S31-R150 PolarHBondContact O-NH2 3.04Å; V32-R150 HydrophobicContact CG2-CG 3.62Å; R150-G154 WeakPolarHBondContact CD-O 3.47Å; R150-G154 PolarHBondContact NH1-O 2.92Å; R150-R155 VanDerWaalsContact CA-O 3.24Å; R150-R155 WeakPolarHBondContact CA-O 3.34Å; R150-R155 WeakPolarHBondContact CB-O 3.38Å; R150-N189 PolarHBondContact NH2-OD1 3.32Å; R150-T192 PolarHBondContact NH1-OG1 2.66Å; R150-T192 VanDerWaalsContact NH1-OG1 3.08Å; R150-T192 PolarHBondContact NH2-OG1 3.37Å; R150-I283 WeakPolarHBondContact O-CD1 3.17Å
151D96.9Very high96.6Very high1 Ų119.2 Ų19.21%0.00510%0.103CC..  trans-78.4179.6166.269.516.2000112.5H29 Y153 G154 R155 V157 F279 I283H29-D151 PolarHBondContact CD2-O 3.36Å; D151-Y153 PolarHBondContact O-N 3.07Å; D151-Y153 WeakPolarHBondContact OD1-CA 3.42Å; D151-Y153 WeakPolarHBondContact OD1-CB 3.38Å; D151-Y153 PolarHBondContact OD1-N 2.91Å; D151-G154 PolarHBondContact O-N 3.31Å; D151-G154 PolarHBondContact OD1-N 3.3Å; D151-G154 VanDerWaalsContact OD1-N 3.15Å; D151-R155 PolarHBondContact N-O 2.85Å; D151-R155 WeakPolarHBondContact OD1-CB 3.4Å; D151-R155 PolarHBondContact OD1-N 3.06Å; D151-R155 IonicContact OD1-NE 2.62Å; D151-R155 IonicContact OD2-CZ 3.27Å; D151-R155 IonicContact OD2-NE 3.59Å; D151-R155 PolarHBondContact OD2-NE 2.83Å; D151-R155 IonicContact OD2-NH2 2.82Å; D151-R155 PolarHBondContact OD2-NH2 3.18Å; D151-V157 HydrophobicContact CB-CG2 3.97Å; D151-F279 HydrophobicContact CB-CD1 4.34Å; D151-I283 HydrophobicContact CB-CD1 4.45Å
152K94.1Very high96.7Very high64 Ų6417.4 Ų17.428%0.2789%0.088SC..THydrogen-bonded Turntrans-59.9-16.2-179.868.2-178.5-175.61790114.4H29 K277 E278H29-K152 PolarHBondContact NE2-O 2.95Å; K152-K277 PolarHBondContact NZ-O 2.91Å; K152-E278 WeakPolarHBondContact CE-O 3.47Å
153Y95.1Very high96.5Very high84 Ų8420.5 Ų20.533%0.32910%0.103SC..THydrogen-bonded Turntrans-98.82.9177.1-50.6-74.7000113.4K46 D151 R155 E278K46-Y153 PolarHBondContact NZ-O 3.4Å; K46-Y153 VanDerWaalsContact NZ-O 3.15Å; D151-Y153 PolarHBondContact O-N 3.07Å; D151-Y153 WeakPolarHBondContact OD1-CA 3.42Å; D151-Y153 WeakPolarHBondContact OD1-CB 3.38Å; D151-Y153 PolarHBondContact OD1-N 2.91Å; Y153-R155 VanDerWaalsContact C-N 3.32Å; Y153-E278 VanDerWaalsContact CE2-OE2 3.28Å; Y153-E278 WeakPolarHBondContact CE2-OE2 3.38Å; Y153-E278 PolarHBondContact OH-OE2 3.35Å
154G96.9Very high95.7Very high0 Ų024 Ų240%013%0.132CC..SBendtrans7813.8-179.600000114H29 R150 D151 N195H29-G154 PolarHBondContact CE1-N 3.21Å; H29-G154 VanDerWaalsContact CE1-N 3.32Å; H29-G154 VanDerWaalsContact ND1-CA 3.33Å; H29-G154 WeakPolarHBondContact ND1-CA 3.21Å; H29-G154 PolarHBondContact NE2-N 3.35Å; R150-G154 WeakPolarHBondContact CD-O 3.47Å; R150-G154 PolarHBondContact NH1-O 2.92Å; D151-G154 PolarHBondContact O-N 3.31Å; D151-G154 PolarHBondContact OD1-N 3.3Å; D151-G154 VanDerWaalsContact OD1-N 3.15Å; G154-N195 VanDerWaalsContact C-CB 3.49Å; G154-N195 WeakPolarHBondContact O-CB 3.42Å; G154-N195 PolarHBondContact O-ND2 2.93Å
155R98.3Very high95.5Very high18 Ų1824.2 Ų24.27%0.06813%0.133CC..  trans-78.3146.2-179.7-55.9178.8-64.8-175.26.5109.7R150 D151 Y153 G196 V198 K235R150-R155 VanDerWaalsContact CA-O 3.24Å; R150-R155 WeakPolarHBondContact CA-O 3.34Å; R150-R155 WeakPolarHBondContact CB-O 3.38Å; D151-R155 PolarHBondContact N-O 2.85Å; D151-R155 WeakPolarHBondContact OD1-CB 3.4Å; D151-R155 PolarHBondContact OD1-N 3.06Å; D151-R155 IonicContact OD1-NE 2.62Å; D151-R155 IonicContact OD2-CZ 3.27Å; D151-R155 IonicContact OD2-NE 3.59Å; D151-R155 PolarHBondContact OD2-NE 2.83Å; D151-R155 IonicContact OD2-NH2 2.82Å; D151-R155 PolarHBondContact OD2-NH2 3.18Å; Y153-R155 VanDerWaalsContact C-N 3.32Å; R155-G196 VanDerWaalsContact CA-O 3.31Å; R155-G196 WeakPolarHBondContact CA-O 3.35Å; R155-V198 HydrophobicContact CB-CG1 4.09Å; R155-K235 HydrophobicContact CG-CG 4.34Å
156V98.7Very high95.3Very high0 Ų027.7 Ų27.70%015%0.151CC..EExtended strand (participates in β ladder)trans-70.3129.8163.6172.40000108.1V32 V146 L158 L186 T192 G196 F197 V198V32-V156 HydrophobicContact CG1-CG1 4.32Å; V32-V156 HydrophobicContact CG1-CG2 4.15Å; V146-V156 HydrophobicContact CG1-CG1 4.1Å; V156-L158 HydrophobicContact CG1-CD2 3.87Å; V156-L158 HydrophobicContact CG1-CG 4.3Å; V156-L186 HydrophobicContact CG1-CD1 3.67Å; V156-L186 HydrophobicContact CG2-CD1 4.49Å; V156-T192 HydrophobicContact CG2-CG2 3.65Å; V156-T192 WeakPolarHBondContact CG2-OG1 3.26Å; V156-G196 PolarHBondContact N-O 3.26Å; V156-F197 HydrophobicContact CB-CD1 3.58Å; V156-F197 HydrophobicContact CB-CE1 3.86Å; V156-F197 HydrophobicContact CB-CG 4.42Å; V156-F197 HydrophobicContact CG1-CD1 3.73Å; V156-F197 HydrophobicContact CG1-CE1 3.91Å; V156-F197 HydrophobicContact CG2-CD1 4.34Å; V156-F197 HydrophobicContact CG2-CE1 4.15Å; V156-F197 CarbonylContact O-C 3.59Å; V156-F197 WeakPolarHBondContact O-CA 3.48Å; V156-V198 PolarHBondContact O-N 3.45Å
157V98.6Very high94.8Very high0 Ų029.5 Ų29.50%016%0.161CC..EExtended strand (participates in β ladder)trans-99116176.2-171.40000108.4L147 D151 L159 V198 I200 F279L147-V157 HydrophobicContact CB-CB 3.87Å; L147-V157 WeakPolarHBondContact CB-O 3.4Å; L147-V157 HydrophobicContact CD2-CB 3.93Å; L147-V157 HydrophobicContact CD2-CG1 4.25Å; L147-V157 HydrophobicContact CD2-CG2 4.14Å; L147-V157 PolarHBondContact N-O 2.9Å; D151-V157 HydrophobicContact CB-CG2 3.97Å; V157-L159 HydrophobicContact CG1-CD2 3.59Å; V157-L159 HydrophobicContact CG1-CG 4.43Å; V157-V198 HydrophobicContact CB-CG1 4.17Å; V157-V198 HydrophobicContact CG1-CG1 4.21Å; V157-V198 HydrophobicContact CG2-CG1 3.79Å; V157-I200 HydrophobicContact CG1-CD1 3.57Å; V157-I200 HydrophobicContact CG1-CG1 3.97Å; V157-F279 HydrophobicContact CG1-CE1 4.32Å; V157-F279 HydrophobicContact CG2-CE1 4.36Å
158L98.6Very high94.4Very high0 Ų037.2 Ų37.20%020%0.197CC..EExtended strand (participates in β ladder)trans-100131.2173.1-58177.9000108V145 V146 V156 Y179 I182 L183 L186 F197 V198 L199 I200V145-L158 WeakPolarHBondContact O-CA 3.44Å; V146-L158 HydrophobicContact CB-CD2 4.41Å; V146-L158 HydrophobicContact CG1-CD2 4.35Å; V146-L158 HydrophobicContact CG2-CD2 3.82Å; V156-L158 HydrophobicContact CG1-CD2 3.87Å; V156-L158 HydrophobicContact CG1-CG 4.3Å; L158-Y179 HydrophobicContact CB-CE1 4.21Å; L158-Y179 HydrophobicContact CD1-CD1 4.02Å; L158-Y179 HydrophobicContact CD1-CE1 3.81Å; L158-I182 HydrophobicContact CD2-CG2 3.95Å; L158-L183 HydrophobicContact CD1-CD2 4.41Å; L158-L186 HydrophobicContact CD2-CD1 4.45Å; L158-F197 HydrophobicContact CD1-CD1 4Å; L158-F197 HydrophobicContact CG-CD1 4.28Å; L158-V198 PolarHBondContact N-O 2.97Å; L158-L199 HydrophobicContact CB-CG 4.32Å; L158-L199 HydrophobicContact CD1-CD1 4.36Å; L158-L199 CarbonylContact O-C 3.56Å; L158-L199 WeakPolarHBondContact O-CA 3.36Å; L158-I200 PolarHBondContact O-N 3.11Å
159L98.3Very high94.2Very high1 Ų141.1 Ų41.11%0.00521%0.209CC..EExtended strand (participates in β ladder)trans-116.3139.1-176.9-48.2175.6000109.5P144 V145 L147 V157 I200 P285 F288P144-L159 WeakPolarHBondContact CB-O 3.35Å; V145-L159 HydrophobicContact CB-CB 4.16Å; V145-L159 PolarHBondContact N-O 2.83Å; V145-L159 PolarHBondContact O-N 2.82Å; L147-L159 HydrophobicContact CD1-CD1 4.14Å; V157-L159 HydrophobicContact CG1-CD2 3.59Å; V157-L159 HydrophobicContact CG1-CG 4.43Å; L159-I200 WeakPolarHBondContact CA-O 3.22Å; L159-I200 HydrophobicContact CD2-CB 3.72Å; L159-I200 HydrophobicContact CD2-CD1 3.68Å; L159-I200 HydrophobicContact CD2-CG1 3.97Å; L159-P285 HydrophobicContact CD1-CG 3.83Å; L159-F288 HydrophobicContact CB-CD1 4.45Å; L159-F288 HydrophobicContact CB-CE1 3.79Å; L159-F288 HydrophobicContact CB-CE2 3.93Å; L159-F288 HydrophobicContact CB-CZ 3.51Å; L159-F288 HydrophobicContact CD1-CD2 4.01Å; L159-F288 HydrophobicContact CD1-CE2 4.04Å; L159-F288 HydrophobicContact CD1-CG 4.37Å; L159-F288 HydrophobicContact CD1-CZ 4.41Å; L159-F288 HydrophobicContact CD2-CD1 4.21Å; L159-F288 HydrophobicContact CD2-CE1 4.3Å; L159-F288 HydrophobicContact CD2-CG 4.49Å; L159-F288 HydrophobicContact CG-CZ 4.42Å
160F97.8Very high94.2Very high13 Ų1340.4 Ų40.46%0.05720%0.202CC..EExtended strand (participates in β ladder)trans-134.6124.1170.5-177.8-90.8000108.2Y143 I162 W165 V175 I200 E201 N202Y143-F160 HydrophobicContact CD1-CD2 4.21Å; Y143-F160 AromaticContact CD1-CE2 3.72Å; Y143-F160 HydrophobicContact CD1-CE2 3.72Å; Y143-F160 HydrophobicContact CD1-CZ 4.33Å; F160-I162 HydrophobicContact CE1-CB 4Å; F160-I162 HydrophobicContact CE1-CD1 4.37Å; F160-I162 HydrophobicContact CE1-CG1 4.13Å; F160-W165 HydrophobicContact CE1-CE3 4.31Å; F160-W165 HydrophobicContact CE1-CZ3 4.48Å; F160-W165 AromaticContact CZ-CD2 3.92Å; F160-W165 HydrophobicContact CZ-CD2 3.92Å; F160-W165 AromaticContact CZ-CE3 3.75Å; F160-W165 HydrophobicContact CZ-CE3 3.75Å; F160-W165 HydrophobicContact CZ-CG 4.45Å; F160-W165 HydrophobicContact CZ-CH2 4.27Å; F160-W165 AromaticContact CZ-CZ3 3.92Å; F160-W165 HydrophobicContact CZ-CZ3 3.92Å; F160-V175 HydrophobicContact CD2-CG1 4.11Å; F160-V175 HydrophobicContact CE2-CG1 3.76Å; F160-V175 HydrophobicContact CE2-CG2 4.34Å; F160-I200 PolarHBondContact N-O 3.32Å; F160-E201 WeakPolarHBondContact CB-OE2 3.35Å; F160-E201 VanDerWaalsContact CD1-OE2 3.3Å; F160-E201 WeakPolarHBondContact CD1-OE2 3.5Å; F160-N202 PolarHBondContact O-N 3.4Å
161N96.1Very high94Very high26 Ų2643.1 Ų43.114%0.13922%0.219CC..EExtended strand (participates in β ladder)trans-109.3118.9175.4-169-10.5000107.8Y143 D163 N202 F288Y143-N161 WeakPolarHBondContact CE1-O 3.23Å; N161-D163 VanDerWaalsContact C-N 3.26Å; N161-D163 WeakPolarHBondContact OD1-CB 3.48Å; N161-D163 PolarHBondContact OD1-N 3.27Å; N161-N202 HydrophobicContact CB-CB 4.44Å; N161-F288 HydrophobicContact CB-CE2 4.12Å; N161-F288 HydrophobicContact CB-CZ 3.7Å
162I95Very high93.9Very high3 Ų343.9 Ų43.92%0.01522%0.222CC..  trans-81.2-13.5179.4-156156.1000112.4F160 S164 W165 N202 F203 K204 F206F160-I162 HydrophobicContact CE1-CB 4Å; F160-I162 HydrophobicContact CE1-CD1 4.37Å; F160-I162 HydrophobicContact CE1-CG1 4.13Å; I162-S164 PolarHBondContact O-N 2.96Å; I162-W165 HydrophobicContact CD1-CE3 4.25Å; I162-W165 HydrophobicContact CG1-CE3 3.94Å; I162-W165 WeakPolarHBondContact O-CB 3.49Å; I162-W165 PolarHBondContact O-N 3.4Å; I162-W165 VanDerWaalsContact O-N 3.14Å; I162-N202 WeakPolarHBondContact CG2-O 3.16Å; I162-N202 PolarHBondContact N-O 3.43Å; I162-F203 HydrophobicContact CD1-CE1 4.4Å; I162-K204 WeakPolarHBondContact CG2-O 3.32Å; I162-F206 HydrophobicContact CD1-CD2 3.36Å; I162-F206 HydrophobicContact CD1-CE2 3.86Å; I162-F206 HydrophobicContact CD1-CG 4.26Å; I162-F206 HydrophobicContact CG1-CD2 4.27Å; I162-F206 HydrophobicContact CG2-CB 3.84Å
163D90Very high93.9Very high70 Ų7042.6 Ų42.637%0.37422%0.219SC..THydrogen-bonded Turntrans-61.2129.5178.2-162.313.4000109.5N161 W165 K204N161-D163 VanDerWaalsContact C-N 3.26Å; N161-D163 WeakPolarHBondContact OD1-CB 3.48Å; N161-D163 PolarHBondContact OD1-N 3.27Å; D163-W165 PolarHBondContact O-N 2.75Å; D163-W165 VanDerWaalsContact O-N 3.16Å; D163-K204 WeakPolarHBondContact CB-O 3.37Å; D163-K204 PolarHBondContact N-O 3.47Å
164S79.9Confident93.9Very high103 Ų10342 Ų4272%0.7222%0.219SC*.THydrogen-bonded Turntrans59.516.3-176.2-49.90000115.9I162 D166I162-S164 PolarHBondContact O-N 2.96Å; S164-D166 PolarHBondContact O-N 3.42Å
165W92.6Very high93.9Very high6 Ų642.2 Ų42.22%0.02322%0.22CC..  trans-71.7113.6170.7179.634.1000110.9Y143 F160 I162 D163 L167 I170 F172 V175 H210 I214Y143-W165 HydrophobicContact CE1-CB 4.01Å; Y143-W165 HydrophobicContact CE1-CG 4.18Å; F160-W165 HydrophobicContact CE1-CE3 4.31Å; F160-W165 HydrophobicContact CE1-CZ3 4.48Å; F160-W165 AromaticContact CZ-CD2 3.92Å; F160-W165 HydrophobicContact CZ-CD2 3.92Å; F160-W165 AromaticContact CZ-CE3 3.75Å; F160-W165 HydrophobicContact CZ-CE3 3.75Å; F160-W165 HydrophobicContact CZ-CG 4.45Å; F160-W165 HydrophobicContact CZ-CH2 4.27Å; F160-W165 AromaticContact CZ-CZ3 3.92Å; F160-W165 HydrophobicContact CZ-CZ3 3.92Å; I162-W165 HydrophobicContact CD1-CE3 4.25Å; I162-W165 HydrophobicContact CG1-CE3 3.94Å; I162-W165 WeakPolarHBondContact O-CB 3.49Å; I162-W165 PolarHBondContact O-N 3.4Å; I162-W165 VanDerWaalsContact O-N 3.14Å; D163-W165 PolarHBondContact O-N 2.75Å; D163-W165 VanDerWaalsContact O-N 3.16Å; W165-L167 HydrophobicContact CD2-CD2 4.1Å; W165-L167 HydrophobicContact CD2-CG 4.42Å; W165-L167 HydrophobicContact CE3-CD2 3.95Å; W165-L167 HydrophobicContact CE3-CG 4.35Å; W165-L167 HydrophobicContact CH2-CD2 3.33Å; W165-L167 HydrophobicContact CZ2-CD2 3.38Å; W165-L167 HydrophobicContact CZ2-CG 4.46Å; W165-L167 HydrophobicContact CZ3-CD2 3.61Å; W165-L167 HydrophobicContact CZ3-CG 4.43Å; W165-I170 PolarHBondContact NE1-O 3.41Å; W165-F172 HydrophobicContact CH2-CB 4.29Å; W165-F172 AromaticContact CH2-CD2 3.6Å; W165-F172 HydrophobicContact CH2-CD2 3.6Å; W165-F172 HydrophobicContact CH2-CE2 4.24Å; W165-F172 HydrophobicContact CH2-CG 4.24Å; W165-F172 HydrophobicContact CZ3-CD2 4.37Å; W165-V175 HydrophobicContact CZ2-CG2 3.88Å; W165-H210 PolarHBondContact O-NE2 2.87Å; W165-H210 VanDerWaalsContact O-NE2 3.12Å; W165-I214 HydrophobicContact CZ3-CD1 3.94Å; W165-I214 HydrophobicContact CZ3-CG1 4.38Å
166D90.4Very high93.8Very high79 Ų7941.4 Ų41.442%0.42222%0.217SC..  trans-92.2111.9172.7-165.4-27000110.7S164 E168 E169 I170S164-D166 PolarHBondContact O-N 3.42Å; D166-E168 PolarHBondContact O-N 2.83Å; D166-E168 WeakPolarHBondContact OD1-CB 3.36Å; D166-E168 PolarHBondContact OD1-N 3.43Å; D166-E169 HydrophobicContact CB-CB 4.1Å; D166-E169 HydrophobicContact CB-CG 4.08Å; D166-E169 PolarHBondContact O-N 3.17Å; D166-I170 PolarHBondContact O-N 3.05Å
167L88.2Confident93.6Very high38 Ų3843.3 Ų43.320%0.19922%0.224CC..THydrogen-bonded Turntrans-67.6-19.6179.2-75.4167.1000113.5W165 I214W165-L167 HydrophobicContact CD2-CD2 4.1Å; W165-L167 HydrophobicContact CD2-CG 4.42Å; W165-L167 HydrophobicContact CE3-CD2 3.95Å; W165-L167 HydrophobicContact CE3-CG 4.35Å; W165-L167 HydrophobicContact CH2-CD2 3.33Å; W165-L167 HydrophobicContact CZ2-CD2 3.38Å; W165-L167 HydrophobicContact CZ2-CG 4.46Å; W165-L167 HydrophobicContact CZ3-CD2 3.61Å; W165-L167 HydrophobicContact CZ3-CG 4.43Å; L167-I214 HydrophobicContact CD1-CG1 4.18Å; L167-I214 HydrophobicContact CD2-CG1 4.28Å
168E89.1Confident93.5Very high168 Ų16843.3 Ų43.379%0.78522%0.224SC*.THydrogen-bonded Turntrans-83.1-32.6177.3-61.6-172.217900111.6D166D166-E168 PolarHBondContact O-N 2.83Å; D166-E168 WeakPolarHBondContact OD1-CB 3.36Å; D166-E168 PolarHBondContact OD1-N 3.43Å
169E91.4Very high93.4Very high147 Ų14743.5 Ų43.569%0.68723%0.225SC*.THydrogen-bonded Turntrans-84.3-41.2177.9-65.7-67.3150.300112.4D166D166-E169 HydrophobicContact CB-CB 4.1Å; D166-E169 HydrophobicContact CB-CG 4.08Å; D166-E169 PolarHBondContact O-N 3.17Å
170I93.7Very high93.3Very high24 Ų2443.5 Ų43.512%0.12323%0.225CC..SBendtrans-130.8106.8178.4-61.7176.8000109T138 A141 Y143 W165 D166 E174 V175T138-I170 HydrophobicContact CG2-CG2 3.74Å; A141-I170 HydrophobicContact CB-CD1 3.44Å; A141-I170 VanDerWaalsContact CB-CD1 3.44Å; Y143-I170 HydrophobicContact CD2-CD1 3.52Å; Y143-I170 HydrophobicContact CE2-CD1 3.83Å; W165-I170 PolarHBondContact NE1-O 3.41Å; D166-I170 PolarHBondContact O-N 3.05Å; I170-E174 HydrophobicContact CG2-CB 4.25Å; I170-V175 HydrophobicContact CG2-CG2 3.82Å
171T94Very high93.1Very high60 Ų6043.5 Ų43.537%0.36823%0.226SC..  trans-70.3157.5-177.965.60000112.2D173 E174 V175T171-D173 PolarHBondContact O-N 2.66Å; T171-E174 WeakPolarHBondContact CB-OE2 3.16Å; T171-E174 WeakPolarHBondContact CG2-OE2 3.32Å; T171-E174 PolarHBondContact N-OE2 3.38Å; T171-E174 PolarHBondContact O-N 2.87Å; T171-E174 VanDerWaalsContact O-N 3.12Å; T171-E174 VanDerWaalsContact OG1-CG 3.3Å; T171-E174 WeakPolarHBondContact OG1-CG 3.29Å; T171-E174 PolarHBondContact OG1-N 2.91Å; T171-E174 PolarHBondContact OG1-OE2 2.97Å; T171-V175 PolarHBondContact O-N 2.87Å
172F94.6Very high93.1Very high17 Ų1742.2 Ų42.28%0.07522%0.22CC..Hα-helixtrans-56.1-39.3173.7-160.4-71.8000112W165 V175 L176 I214 E218 L219 M222W165-F172 HydrophobicContact CH2-CB 4.29Å; W165-F172 AromaticContact CH2-CD2 3.6Å; W165-F172 HydrophobicContact CH2-CD2 3.6Å; W165-F172 HydrophobicContact CH2-CE2 4.24Å; W165-F172 HydrophobicContact CH2-CG 4.24Å; W165-F172 HydrophobicContact CZ3-CD2 4.37Å; F172-V175 PolarHBondContact O-N 3.22Å; F172-L176 HydrophobicContact CD1-CD1 3.77Å; F172-L176 HydrophobicContact CD1-CG 3.77Å; F172-L176 HydrophobicContact CE1-CD1 3.68Å; F172-L176 HydrophobicContact CE1-CD2 3.96Å; F172-L176 HydrophobicContact CE1-CG 3.67Å; F172-L176 PolarHBondContact O-N 3.25Å; F172-I214 HydrophobicContact CD2-CG1 4.28Å; F172-I214 HydrophobicContact CD2-CG2 3.79Å; F172-I214 HydrophobicContact CE2-CG2 3.72Å; F172-E218 HydrophobicContact CB-CB 4.27Å; F172-E218 HydrophobicContact CB-CG 4.17Å; F172-E218 HydrophobicContact CD1-CB 3.73Å; F172-E218 HydrophobicContact CD1-CG 4.36Å; F172-E218 HydrophobicContact CD2-CB 4.16Å; F172-E218 HydrophobicContact CE1-CB 4.11Å; F172-E218 WeakPolarHBondContact CE1-O 3.36Å; F172-E218 HydrophobicContact CG-CB 3.79Å; F172-E218 HydrophobicContact CG-CG 4.24Å; F172-L219 HydrophobicContact CE2-CD2 4.32Å; F172-L219 HydrophobicContact CZ-CD2 4.4Å; F172-M222 HydrophobicContact CE1-CB 4.09Å; F172-M222 HydrophobicContact CZ-CB 4.11Å; F172-M222 HydrophobicContact CZ-SD 4.11Å
173D94.9Very high93.2Very high38 Ų3842.1 Ų42.120%0.20322%0.219CC..Hα-helixtrans-67.4-35.2179.4-77.7-16.5000111.7L126 T171 L176 R177 K221L126-D173 HydrophobicContact CD2-CB 3.92Å; T171-D173 PolarHBondContact O-N 2.66Å; D173-L176 PolarHBondContact O-N 2.87Å; D173-R177 WeakPolarHBondContact O-CB 3.28Å; D173-R177 WeakPolarHBondContact O-CG 3.19Å; D173-R177 PolarHBondContact O-N 3.36Å; D173-K221 WeakPolarHBondContact OD1-CD 3.15Å; D173-K221 IonicContact OD1-NZ 2.77Å; D173-K221 PolarHBondContact OD1-NZ 2.78Å; D173-K221 IonicContact OD2-NZ 2.87Å; D173-K221 PolarHBondContact OD2-NZ 2.62Å
174E95.1Very high93.3Very high70 Ų7041 Ų4133%0.32721%0.211SC..Hα-helixtrans-64.3-42.4172.8-75.4164.4125.700112.1T138 I170 T171 L176 R177 A178T138-E174 HydrophobicContact CG2-CB 4.27Å; I170-E174 HydrophobicContact CG2-CB 4.25Å; T171-E174 WeakPolarHBondContact CB-OE2 3.16Å; T171-E174 WeakPolarHBondContact CG2-OE2 3.32Å; T171-E174 PolarHBondContact N-OE2 3.38Å; T171-E174 PolarHBondContact O-N 2.87Å; T171-E174 VanDerWaalsContact O-N 3.12Å; T171-E174 VanDerWaalsContact OG1-CG 3.3Å; T171-E174 WeakPolarHBondContact OG1-CG 3.29Å; T171-E174 PolarHBondContact OG1-N 2.91Å; T171-E174 PolarHBondContact OG1-OE2 2.97Å; E174-L176 VanDerWaalsContact C-N 3.34Å; E174-L176 PolarHBondContact O-N 3.22Å; E174-R177 WeakPolarHBondContact O-CB 3.25Å; E174-R177 PolarHBondContact O-N 3.24Å; E174-A178 PolarHBondContact O-N 2.96Å
175V96.3Very high94Very high6 Ų639.9 Ų39.94%0.03619%0.194CC..Hα-helixtrans-60.8-43.9173.5-179.40000110.9F160 W165 I170 T171 F172 A178 Y179F160-V175 HydrophobicContact CD2-CG1 4.11Å; F160-V175 HydrophobicContact CE2-CG1 3.76Å; F160-V175 HydrophobicContact CE2-CG2 4.34Å; W165-V175 HydrophobicContact CZ2-CG2 3.88Å; I170-V175 HydrophobicContact CG2-CG2 3.82Å; T171-V175 PolarHBondContact O-N 2.87Å; F172-V175 PolarHBondContact O-N 3.22Å; V175-A178 WeakPolarHBondContact O-CB 3.47Å; V175-A178 PolarHBondContact O-N 2.87Å; V175-Y179 HydrophobicContact CG1-CD2 3.96Å; V175-Y179 HydrophobicContact CG1-CE2 3.83Å; V175-Y179 WeakPolarHBondContact O-CD2 3.21Å; V175-Y179 PolarHBondContact O-N 2.62Å
176L96.1Very high94.1Very high1 Ų139.9 Ų39.91%0.00519%0.194CC..Hα-helixtrans-65.9-36.8176.3-72.7-175000112.9L126 F172 D173 E174 A178 Y179 C180 K221 M222 M225L126-L176 HydrophobicContact CD1-CB 4.34Å; L126-L176 HydrophobicContact CD1-CD1 4.28Å; L126-L176 HydrophobicContact CD2-CB 3.99Å; F172-L176 HydrophobicContact CD1-CD1 3.77Å; F172-L176 HydrophobicContact CD1-CG 3.77Å; F172-L176 HydrophobicContact CE1-CD1 3.68Å; F172-L176 HydrophobicContact CE1-CD2 3.96Å; F172-L176 HydrophobicContact CE1-CG 3.67Å; F172-L176 PolarHBondContact O-N 3.25Å; D173-L176 PolarHBondContact O-N 2.87Å; E174-L176 VanDerWaalsContact C-N 3.34Å; E174-L176 PolarHBondContact O-N 3.22Å; L176-A178 VanDerWaalsContact C-N 3.33Å; L176-Y179 PolarHBondContact O-N 3.4Å; L176-C180 PolarHBondContact O-N 3.47Å; L176-C180 PolarHBondContact O-SG 3.47Å; L176-K221 HydrophobicContact CD1-CB 3.5Å; L176-K221 VanDerWaalsContact CD1-CB 3.5Å; L176-K221 HydrophobicContact CD1-CD 4.19Å; L176-K221 HydrophobicContact CD1-CG 4.49Å; L176-M222 HydrophobicContact CD2-CB 4.03Å; L176-M222 HydrophobicContact CD2-CG 4.15Å; L176-M225 HydrophobicContact CD2-CE 3.7Å; L176-M225 HydrophobicContact CD2-SD 4.06Å
177R95.9Very high94.4Very high39 Ų3936.1 Ų36.115%0.14717%0.174CC..Hα-helixtrans-59.8-45.8172.6-74.5169.669.6103.33.5110.3E125 L126 E128 L130 V135 D173 E174 C180 V181E125-R177 PolarHBondContact O-NH1 2.92Å; L126-R177 HydrophobicContact CB-CG 4.31Å; L126-R177 HydrophobicContact CD2-CG 4.08Å; L126-R177 WeakPolarHBondContact O-CG 3.4Å; E128-R177 PolarHBondContact O-NH1 3.25Å; E128-R177 PolarHBondContact O-NH2 2.94Å; L130-R177 HydrophobicContact CD1-CB 3.96Å; L130-R177 HydrophobicContact CD1-CG 4.26Å; V135-R177 HydrophobicContact CG1-CB 3.92Å; D173-R177 WeakPolarHBondContact O-CB 3.28Å; D173-R177 WeakPolarHBondContact O-CG 3.19Å; D173-R177 PolarHBondContact O-N 3.36Å; E174-R177 WeakPolarHBondContact O-CB 3.25Å; E174-R177 PolarHBondContact O-N 3.24Å; R177-C180 WeakPolarHBondContact O-CB 3.25Å; R177-C180 PolarHBondContact O-N 2.87Å; R177-V181 PolarHBondContact O-N 2.9Å
178A96.4Very high94.8Very high0 Ų038.9 Ų38.90%019%0.186CC..Hα-helixtrans-59.7-47175.200000111.9V135 T138 I139 Y143 E174 V175 L176 C180 V181 I182V135-A178 HydrophobicContact CB-CB 4.3Å; T138-A178 HydrophobicContact CG2-CB 4.21Å; I139-A178 HydrophobicContact CD1-CB 4.14Å; I139-A178 HydrophobicContact CG1-CB 3.85Å; Y143-A178 WeakPolarHBondContact O-CB 3.49Å; E174-A178 PolarHBondContact O-N 2.96Å; V175-A178 WeakPolarHBondContact O-CB 3.47Å; V175-A178 PolarHBondContact O-N 2.87Å; L176-A178 VanDerWaalsContact C-N 3.33Å; A178-C180 VanDerWaalsContact C-N 3.34Å; A178-C180 PolarHBondContact O-N 3.36Å; A178-V181 PolarHBondContact O-N 3.42Å; A178-I182 WeakPolarHBondContact O-CB 3.49Å; A178-I182 VanDerWaalsContact O-CG1 3.28Å; A178-I182 WeakPolarHBondContact O-CG1 3.14Å; A178-I182 PolarHBondContact O-N 3.38Å
179Y96.8Very high95.2Very high4 Ų431.1 Ų31.12%0.01615%0.15CC..Hα-helixtrans-55.7-46.1172.7-88.4-70000112.5P144 L158 V175 L176 V181 I182 L183 L199 M225P144-Y179 HydrophobicContact CB-CD1 4.47Å; P144-Y179 HydrophobicContact CB-CD2 4.49Å; P144-Y179 HydrophobicContact CB-CE1 3.83Å; P144-Y179 HydrophobicContact CB-CE2 3.86Å; P144-Y179 VanDerWaalsContact CB-CZ 3.48Å; P144-Y179 HydrophobicContact CG-CD1 3.76Å; P144-Y179 HydrophobicContact CG-CD2 3.96Å; P144-Y179 HydrophobicContact CG-CE1 3.61Å; P144-Y179 HydrophobicContact CG-CE2 3.83Å; P144-Y179 HydrophobicContact CG-CG 3.92Å; L158-Y179 HydrophobicContact CB-CE1 4.21Å; L158-Y179 HydrophobicContact CD1-CD1 4.02Å; L158-Y179 HydrophobicContact CD1-CE1 3.81Å; V175-Y179 HydrophobicContact CG1-CD2 3.96Å; V175-Y179 HydrophobicContact CG1-CE2 3.83Å; V175-Y179 WeakPolarHBondContact O-CD2 3.21Å; V175-Y179 PolarHBondContact O-N 2.62Å; L176-Y179 PolarHBondContact O-N 3.4Å; Y179-V181 VanDerWaalsContact C-N 3.34Å; Y179-V181 PolarHBondContact O-N 3.26Å; Y179-I182 PolarHBondContact O-N 2.91Å; Y179-L183 WeakPolarHBondContact O-CB 3.39Å; Y179-L183 WeakPolarHBondContact O-CG 3.46Å; Y179-L183 PolarHBondContact O-N 3.21Å; Y179-L199 HydrophobicContact CE1-CD2 4.42Å; Y179-M225 VanDerWaalsContact CB-SD 3.57Å; Y179-M225 HydrophobicContact CD1-CE 4.27Å; Y179-M225 HydrophobicContact CD2-CE 4.09Å; Y179-M225 HydrophobicContact CG-CE 3.81Å; Y179-M225 HydrophobicContact CG-SD 4.29Å
180C95.5Very high95.4Very high1 Ų126.5 Ų26.51%0.00713%0.128CC..Hα-helixtrans-58.1-46.8179.5-69.50000111.3F127 L176 R177 A178 L183 E184 F230F127-C180 HydrophobicContact CE1-CB 4.12Å; L176-C180 PolarHBondContact O-N 3.47Å; L176-C180 PolarHBondContact O-SG 3.47Å; R177-C180 WeakPolarHBondContact O-CB 3.25Å; R177-C180 PolarHBondContact O-N 2.87Å; A178-C180 VanDerWaalsContact C-N 3.34Å; A178-C180 PolarHBondContact O-N 3.36Å; C180-L183 PolarHBondContact O-N 3.44Å; C180-E184 WeakPolarHBondContact O-CG 3.42Å; C180-E184 PolarHBondContact O-N 3.39Å; C180-E184 VanDerWaalsContact O-N 3.08Å; C180-F230 HydrophobicContact CB-CZ 4Å
181V94.3Very high95.7Very high13 Ų1325.4 Ų25.48%0.07912%0.122CC..Hα-helixtrans-66.3-45.4179.11750000111.6L130 V135 R177 A178 Y179 L183 E184 K185 F305L130-V181 HydrophobicContact CD1-CG2 3.69Å; L130-V181 HydrophobicContact CD2-CG2 3.71Å; L130-V181 HydrophobicContact CG-CG2 3.67Å; V135-V181 HydrophobicContact CG1-CG2 4.01Å; V135-V181 HydrophobicContact CG2-CB 3.88Å; V135-V181 HydrophobicContact CG2-CG1 3.88Å; V135-V181 HydrophobicContact CG2-CG2 3.82Å; R177-V181 PolarHBondContact O-N 2.9Å; A178-V181 PolarHBondContact O-N 3.42Å; Y179-V181 VanDerWaalsContact C-N 3.34Å; Y179-V181 PolarHBondContact O-N 3.26Å; V181-L183 VanDerWaalsContact C-N 3.32Å; V181-L183 PolarHBondContact O-N 3.06Å; V181-E184 PolarHBondContact O-N 3.07Å; V181-K185 HydrophobicContact CG1-CG 4.48Å; V181-K185 WeakPolarHBondContact O-CG 3.48Å; V181-K185 PolarHBondContact O-N 2.91Å; V181-F305 HydrophobicContact CG1-CE1 3.45Å; V181-F305 VanDerWaalsContact CG1-CE1 3.45Å; V181-F305 HydrophobicContact CG1-CZ 3.72Å
182I95.5Very high95.9Very high0 Ų022.5 Ų22.50%011%0.105CC..Hα-helixtrans-57.8-46.2177.2-73.7166.3000110.5I139 P144 V146 L158 A178 Y179 K185 L186 L304I139-I182 HydrophobicContact CD1-CD1 3.81Å; I139-I182 HydrophobicContact CD1-CG1 3.87Å; I139-I182 HydrophobicContact CG1-CD1 4.06Å; P144-I182 HydrophobicContact CG-CD1 3.63Å; V146-I182 HydrophobicContact CG2-CD1 4Å; V146-I182 HydrophobicContact CG2-CG1 4.26Å; V146-I182 HydrophobicContact CG2-CG2 3.61Å; L158-I182 HydrophobicContact CD2-CG2 3.95Å; A178-I182 WeakPolarHBondContact O-CB 3.49Å; A178-I182 VanDerWaalsContact O-CG1 3.28Å; A178-I182 WeakPolarHBondContact O-CG1 3.14Å; A178-I182 PolarHBondContact O-N 3.38Å; Y179-I182 PolarHBondContact O-N 2.91Å; I182-K185 PolarHBondContact O-N 2.69Å; I182-L186 HydrophobicContact CG2-CD1 3.56Å; I182-L186 HydrophobicContact CG2-CG 4.14Å; I182-L186 WeakPolarHBondContact O-CB 3.34Å; I182-L186 VanDerWaalsContact O-CG 3.28Å; I182-L186 WeakPolarHBondContact O-CG 3.18Å; I182-L186 PolarHBondContact O-N 2.93Å; I182-L304 HydrophobicContact CG1-CD1 4.08Å
183L95.9Very high96.1Very high0 Ų021.9 Ų21.90%010%0.102CC..Hα-helixtrans-62.3-46.9178.9-71170.6000111.5L158 Y179 C180 V181 K185 L186 L187 F197 M225 F230 A232 F234L158-L183 HydrophobicContact CD1-CD2 4.41Å; Y179-L183 WeakPolarHBondContact O-CB 3.39Å; Y179-L183 WeakPolarHBondContact O-CG 3.46Å; Y179-L183 PolarHBondContact O-N 3.21Å; C180-L183 PolarHBondContact O-N 3.44Å; V181-L183 VanDerWaalsContact C-N 3.32Å; V181-L183 PolarHBondContact O-N 3.06Å; L183-K185 VanDerWaalsContact C-N 3.29Å; L183-K185 PolarHBondContact O-N 3.19Å; L183-L186 PolarHBondContact O-N 2.83Å; L183-L187 WeakPolarHBondContact O-CB 3.28Å; L183-L187 WeakPolarHBondContact O-CD1 3.19Å; L183-L187 WeakPolarHBondContact O-CG 3.23Å; L183-L187 PolarHBondContact O-N 2.83Å; L183-F197 HydrophobicContact CD2-CD1 4.02Å; L183-F197 HydrophobicContact CD2-CD2 4.17Å; L183-F197 HydrophobicContact CD2-CE1 3.78Å; L183-F197 HydrophobicContact CD2-CE2 3.94Å; L183-F197 HydrophobicContact CD2-CG 4.21Å; L183-F197 HydrophobicContact CD2-CZ 3.73Å; L183-M225 HydrophobicContact CD1-CG 4.28Å; L183-M225 HydrophobicContact CD1-SD 4.3Å; L183-F230 HydrophobicContact CB-CD1 4.25Å; L183-F230 HydrophobicContact CD1-CD1 4.37Å; L183-F230 HydrophobicContact CD1-CD2 4.24Å; L183-F230 HydrophobicContact CD1-CG 4.17Å; L183-A232 HydrophobicContact CD2-CB 4.43Å; L183-F234 HydrophobicContact CD1-CZ 3.85Å; L183-F234 HydrophobicContact CD2-CE1 4.05Å; L183-F234 HydrophobicContact CD2-CZ 3.86Å
184E93.3Very high96.2Very high46 Ų4620.1 Ų20.122%0.2159%0.093CC..Hα-helixtrans-57.5-43.3177.5-69.9-61.3160.500111.8Y116 R120 C180 V181 F230Y116-E184 WeakPolarHBondContact CE2-OE1 3.2Å; Y116-E184 PolarHBondContact OH-OE1 3.45Å; R120-E184 IonicContact CZ-OE1 3.62Å; R120-E184 IonicContact NH2-OE1 3.96Å; R120-E184 PolarHBondContact NH2-OE1 3.31Å; C180-E184 WeakPolarHBondContact O-CG 3.42Å; C180-E184 PolarHBondContact O-N 3.39Å; C180-E184 VanDerWaalsContact O-N 3.08Å; V181-E184 PolarHBondContact O-N 3.07Å; E184-F230 HydrophobicContact CG-CE1 4.43Å; E184-F230 WeakPolarHBondContact OE1-CE1 3.04Å
185K93.4Very high96.3Very high80 Ų8016.8 Ų16.835%0.3488%0.077SC..Hα-helixtrans-68.3-51.3179.1-72.4-69.7171.8-170.30112.5V181 I182 L183 L187 E188 F305V181-K185 HydrophobicContact CG1-CG 4.48Å; V181-K185 WeakPolarHBondContact O-CG 3.48Å; V181-K185 PolarHBondContact O-N 2.91Å; I182-K185 PolarHBondContact O-N 2.69Å; L183-K185 VanDerWaalsContact C-N 3.29Å; L183-K185 PolarHBondContact O-N 3.19Å; K185-L187 PolarHBondContact O-N 3.41Å; K185-E188 IonicContact NZ-OE1 3.69Å; K185-E188 VanDerWaalsContact O-CB 3.26Å; K185-E188 WeakPolarHBondContact O-CB 3.42Å; K185-E188 WeakPolarHBondContact O-CG 3.4Å; K185-E188 PolarHBondContact O-N 3.35Å; K185-F305 HydrophobicContact CG-CE1 4.4Å
186L96.6Very high96.4Very high6 Ų616.5 Ų16.53%0.0318%0.076CC..Hα-helixtrans-70.9-20.1-176.4-62.7-177.5000112.7V32 F33 V146 V156 L158 I182 L183 E188 N189 T192 F197 L304V32-L186 HydrophobicContact CG1-CD2 4.14Å; F33-L186 HydrophobicContact CD1-CD2 4.02Å; F33-L186 HydrophobicContact CE1-CD2 4.41Å; V146-L186 HydrophobicContact CG1-CD1 3.76Å; V146-L186 HydrophobicContact CG2-CD1 4.15Å; V156-L186 HydrophobicContact CG1-CD1 3.67Å; V156-L186 HydrophobicContact CG2-CD1 4.49Å; L158-L186 HydrophobicContact CD2-CD1 4.45Å; I182-L186 HydrophobicContact CG2-CD1 3.56Å; I182-L186 HydrophobicContact CG2-CG 4.14Å; I182-L186 WeakPolarHBondContact O-CB 3.34Å; I182-L186 VanDerWaalsContact O-CG 3.28Å; I182-L186 WeakPolarHBondContact O-CG 3.18Å; I182-L186 PolarHBondContact O-N 2.93Å; L183-L186 PolarHBondContact O-N 2.83Å; L186-E188 PolarHBondContact O-N 3.23Å; L186-N189 WeakPolarHBondContact O-CB 3.47Å; L186-N189 PolarHBondContact O-N 3.07Å; L186-T192 HydrophobicContact CB-CG2 4.43Å; L186-T192 VanDerWaalsContact O-CB 3.28Å; L186-T192 WeakPolarHBondContact O-CB 3.21Å; L186-T192 WeakPolarHBondContact O-CG2 3.45Å; L186-F197 HydrophobicContact CB-CE1 3.93Å; L186-F197 HydrophobicContact CB-CZ 4.04Å; L186-F197 HydrophobicContact CD1-CE1 4.1Å; L186-L304 HydrophobicContact CD2-CD2 4.01Å; L186-L304 HydrophobicContact CG-CD2 4.35Å
187L96.6Very high96.6Very high1 Ų116.5 Ų16.51%0.0058%0.075CC..THydrogen-bonded Turntrans-75.5-6.2170.9-75.2168.9000113.9R97 L183 K185 N189 Q193 F197 P231 A232R97-L187 PolarHBondContact NE-O 3.12Å; L183-L187 WeakPolarHBondContact O-CB 3.28Å; L183-L187 WeakPolarHBondContact O-CD1 3.19Å; L183-L187 WeakPolarHBondContact O-CG 3.23Å; L183-L187 PolarHBondContact O-N 2.83Å; K185-L187 PolarHBondContact O-N 3.41Å; L187-N189 PolarHBondContact O-N 3.1Å; L187-Q193 HydrophobicContact CD2-CG 4.22Å; L187-Q193 WeakPolarHBondContact O-CG 3.23Å; L187-Q193 PolarHBondContact O-NE2 3.13Å; L187-F197 HydrophobicContact CD2-CE2 3.9Å; L187-F197 HydrophobicContact CD2-CZ 4.32Å; L187-F197 HydrophobicContact CG-CE2 4.18Å; L187-F197 HydrophobicContact CG-CZ 4.19Å; L187-P231 HydrophobicContact CD1-CG 4.07Å; L187-P231 WeakPolarHBondContact CD2-O 3.37Å; L187-A232 HydrophobicContact CD1-CB 4.35Å; L187-A232 HydrophobicContact CD2-CB 4.46Å
188E94.9Very high96.7Very high96 Ų9614.6 Ų14.645%0.4497%0.068SC..THydrogen-bonded Turntrans-68-24.6167-62.1177-169.300111.7K185 L186K185-E188 IonicContact NZ-OE1 3.69Å; K185-E188 VanDerWaalsContact O-CB 3.26Å; K185-E188 WeakPolarHBondContact O-CB 3.42Å; K185-E188 WeakPolarHBondContact O-CG 3.4Å; K185-E188 PolarHBondContact O-N 3.35Å; L186-E188 PolarHBondContact O-N 3.23Å
189N97.4Very high96.8Very high5 Ų514.7 Ų14.73%0.0277%0.069CC..SBendtrans-83.7118178.6-174.1-56000111.5S31 G34 C36 R150 L186 L187 E191 T192 Q193S31-N189 PolarHBondContact O-ND2 3.46Å; G34-N189 PolarHBondContact O-ND2 3.32Å; C36-N189 WeakPolarHBondContact CB-OD1 3.46Å; R150-N189 PolarHBondContact NH2-OD1 3.32Å; L186-N189 WeakPolarHBondContact O-CB 3.47Å; L186-N189 PolarHBondContact O-N 3.07Å; L187-N189 PolarHBondContact O-N 3.1Å; N189-E191 VanDerWaalsContact C-N 3.29Å; N189-E191 PolarHBondContact O-N 3.07Å; N189-E191 WeakPolarHBondContact OD1-CA 3.34Å; N189-E191 VanDerWaalsContact OD1-CB 3.29Å; N189-E191 WeakPolarHBondContact OD1-CB 3.41Å; N189-E191 PolarHBondContact OD1-N 3.35Å; N189-T192 WeakPolarHBondContact O-CB 3.31Å; N189-T192 PolarHBondContact O-N 3.14Å; N189-T192 VanDerWaalsContact O-N 3.15Å; N189-T192 PolarHBondContact OD1-N 3.19Å; N189-Q193 WeakPolarHBondContact O-CG 3.48Å; N189-Q193 PolarHBondContact O-N 3.38Å; N189-Q193 VanDerWaalsContact O-N 3.12Å
190E97.3Very high96.9Very high49 Ų4914.5 Ų14.523%0.2297%0.068CC..Hα-helixtrans-60.5-34.4-178.7-71.1-147.7171.700113.6C36 L39 R58 R100 T192 Q193 I194C36-E190 HydrophobicContact CB-CB 4.38Å; L39-E190 HydrophobicContact CD1-CB 4.4Å; L39-E190 HydrophobicContact CD2-CB 3.9Å; L39-E190 HydrophobicContact CG-CB 4.33Å; R58-E190 IonicContact CZ-OE1 3.88Å; R58-E190 IonicContact NH1-OE1 3.58Å; R58-E190 IonicContact NH1-OE2 2.99Å; R58-E190 IonicContact NH2-OE1 3.64Å; R58-E190 PolarHBondContact NH2-OE1 3.37Å; R100-E190 IonicContact CZ-OE2 2.76Å; R100-E190 VanDerWaalsContact CZ-OE2 3.31Å; R100-E190 VanDerWaalsContact NH1-CB 3.3Å; R100-E190 VanDerWaalsContact NH1-CG 3.27Å; R100-E190 IonicContact NH1-OE1 3.79Å; R100-E190 IonicContact NH1-OE2 3.73Å; R100-E190 PolarHBondContact NH1-OE2 3.5Å; R100-E190 IonicContact NH2-OE2 3.45Å; R100-E190 PolarHBondContact NH2-OE2 2.99Å; E190-T192 VanDerWaalsContact C-N 3.32Å; E190-T192 PolarHBondContact O-N 3.11Å; E190-Q193 WeakPolarHBondContact O-CB 3.28Å; E190-Q193 PolarHBondContact O-N 3.3Å; E190-I194 WeakPolarHBondContact O-CG1 3.49Å; E190-I194 PolarHBondContact O-N 3.1Å; E190-I194 VanDerWaalsContact O-N 3.15Å
191E98.2Very high97Very high1 Ų115 Ų151%0.0057%0.07CC..Hα-helixtrans-65.7-38.7177.5178.9152.6-140.500111H29 G30 L39 P40 T43 N189 I194 N195H29-E191 IonicContact ND1-OE1 3.36Å; G30-E191 WeakPolarHBondContact CA-OE2 3.4Å; G30-E191 PolarHBondContact N-OE2 3.45Å; L39-E191 HydrophobicContact CD2-CB 3.84Å; P40-E191 WeakPolarHBondContact CD-OE1 3.28Å; P40-E191 WeakPolarHBondContact CD-OE2 3.45Å; P40-E191 VanDerWaalsContact CG-OE1 3.3Å; P40-E191 WeakPolarHBondContact CG-OE1 3.43Å; T43-E191 HydrophobicContact CG2-CG 4.05Å; T43-E191 PolarHBondContact OG1-OE1 3.17Å; N189-E191 VanDerWaalsContact C-N 3.29Å; N189-E191 PolarHBondContact O-N 3.07Å; N189-E191 WeakPolarHBondContact OD1-CA 3.34Å; N189-E191 VanDerWaalsContact OD1-CB 3.29Å; N189-E191 WeakPolarHBondContact OD1-CB 3.41Å; N189-E191 PolarHBondContact OD1-N 3.35Å; E191-I194 PolarHBondContact O-N 3.3Å; E191-N195 VanDerWaalsContact CG-ND2 3.31Å; E191-N195 WeakPolarHBondContact CG-ND2 3.45Å; E191-N195 WeakPolarHBondContact O-CB 3.44Å; E191-N195 PolarHBondContact O-N 2.95Å; E191-N195 PolarHBondContact OE1-ND2 3.32Å
192T98.5Very high97.1Very high0 Ų014.6 Ų14.60%07%0.067CC..Hα-helixtrans-64.6-40.5172.9-59.20000112.2R150 V156 L186 N189 E190 I194 G196 F197R150-T192 PolarHBondContact NH1-OG1 2.66Å; R150-T192 VanDerWaalsContact NH1-OG1 3.08Å; R150-T192 PolarHBondContact NH2-OG1 3.37Å; V156-T192 HydrophobicContact CG2-CG2 3.65Å; V156-T192 WeakPolarHBondContact CG2-OG1 3.26Å; L186-T192 HydrophobicContact CB-CG2 4.43Å; L186-T192 VanDerWaalsContact O-CB 3.28Å; L186-T192 WeakPolarHBondContact O-CB 3.21Å; L186-T192 WeakPolarHBondContact O-CG2 3.45Å; N189-T192 WeakPolarHBondContact O-CB 3.31Å; N189-T192 PolarHBondContact O-N 3.14Å; N189-T192 VanDerWaalsContact O-N 3.15Å; N189-T192 PolarHBondContact OD1-N 3.19Å; E190-T192 VanDerWaalsContact C-N 3.32Å; E190-T192 PolarHBondContact O-N 3.11Å; T192-I194 PolarHBondContact O-N 3.3Å; T192-G196 VanDerWaalsContact O-CA 3.27Å; T192-G196 WeakPolarHBondContact O-CA 3.22Å; T192-G196 PolarHBondContact O-N 3.05Å; T192-F197 HydrophobicContact CG2-CD2 4.39Å; T192-F197 HydrophobicContact CG2-CE1 3.79Å; T192-F197 HydrophobicContact CG2-CE2 3.63Å; T192-F197 HydrophobicContact CG2-CZ 3.28Å
193Q98.3Very high97.2Very high4 Ų415.9 Ų15.92%0.0197%0.073CC..Hα-helixtrans-60.1-35.8176.7-62165.519.400111.8R97 L187 N189 E190 R233R97-Q193 HydrophobicContact CG-CG 4.26Å; L187-Q193 HydrophobicContact CD2-CG 4.22Å; L187-Q193 WeakPolarHBondContact O-CG 3.23Å; L187-Q193 PolarHBondContact O-NE2 3.13Å; N189-Q193 WeakPolarHBondContact O-CG 3.48Å; N189-Q193 PolarHBondContact O-N 3.38Å; N189-Q193 VanDerWaalsContact O-N 3.12Å; E190-Q193 WeakPolarHBondContact O-CB 3.28Å; E190-Q193 PolarHBondContact O-N 3.3Å; Q193-R233 WeakPolarHBondContact O-CD 3.26Å
194I98.1Very high97.2Very high0 Ų021.3 Ų21.30%010%0.097CC..Hα-helixtrans-80.7-53.5179.3-63.8161.4000110.4L39 T43 A47 L51 E190 E191 T192 R233L39-I194 HydrophobicContact CD1-CD1 3.74Å; L39-I194 HydrophobicContact CD2-CD1 3.91Å; T43-I194 HydrophobicContact CG2-CB 3.98Å; T43-I194 HydrophobicContact CG2-CD1 3.9Å; T43-I194 HydrophobicContact CG2-CG2 3.8Å; A47-I194 HydrophobicContact CB-CD1 3.9Å; A47-I194 HydrophobicContact CB-CG1 4.09Å; A47-I194 HydrophobicContact CB-CG2 4.02Å; L51-I194 HydrophobicContact CD1-CG1 4.28Å; L51-I194 HydrophobicContact CD1-CG2 4.41Å; E190-I194 WeakPolarHBondContact O-CG1 3.49Å; E190-I194 PolarHBondContact O-N 3.1Å; E190-I194 VanDerWaalsContact O-N 3.15Å; E191-I194 PolarHBondContact O-N 3.3Å; T192-I194 PolarHBondContact O-N 3.3Å; I194-R233 PolarHBondContact O-NH1 3.37Å
195N98.1Very high97.2Very high1 Ų120.6 Ų20.61%0.00510%0.102CC..Hα-helixtrans-78.8-33.6-172-70.7-31.5000113K46 G154 E191 K235K46-N195 WeakPolarHBondContact CD-OD1 3.46Å; K46-N195 WeakPolarHBondContact CE-OD1 3.34Å; K46-N195 PolarHBondContact NZ-OD1 3.11Å; G154-N195 VanDerWaalsContact C-CB 3.49Å; G154-N195 WeakPolarHBondContact O-CB 3.42Å; G154-N195 PolarHBondContact O-ND2 2.93Å; E191-N195 VanDerWaalsContact CG-ND2 3.31Å; E191-N195 WeakPolarHBondContact CG-ND2 3.45Å; E191-N195 WeakPolarHBondContact O-CB 3.44Å; E191-N195 PolarHBondContact O-N 2.95Å; E191-N195 PolarHBondContact OE1-ND2 3.32Å; N195-K235 WeakPolarHBondContact O-CE 3.35Å
196G98.1Very high97.3Very high0 Ų017.2 Ų17.20%09%0.087CC..  trans88.8-161177.900000114.1R155 V156 T192 R233R155-G196 VanDerWaalsContact CA-O 3.31Å; R155-G196 WeakPolarHBondContact CA-O 3.35Å; V156-G196 PolarHBondContact N-O 3.26Å; T192-G196 VanDerWaalsContact O-CA 3.27Å; T192-G196 WeakPolarHBondContact O-CA 3.22Å; T192-G196 PolarHBondContact O-N 3.05Å; G196-R233 CarbonylContact C-O 3.24Å; G196-R233 WeakPolarHBondContact CA-O 3.19Å
197F98.6Very high97.1Very high0 Ų019.5 Ų19.50%010%0.101CC..EExtended strand (participates in β ladder)trans-122.1155.5-175.2-61.8-95.5000110.4V156 L158 L183 L186 L187 T192 A232 R233 F234 K235V156-F197 HydrophobicContact CB-CD1 3.58Å; V156-F197 HydrophobicContact CB-CE1 3.86Å; V156-F197 HydrophobicContact CB-CG 4.42Å; V156-F197 HydrophobicContact CG1-CD1 3.73Å; V156-F197 HydrophobicContact CG1-CE1 3.91Å; V156-F197 HydrophobicContact CG2-CD1 4.34Å; V156-F197 HydrophobicContact CG2-CE1 4.15Å; V156-F197 CarbonylContact O-C 3.59Å; V156-F197 WeakPolarHBondContact O-CA 3.48Å; L158-F197 HydrophobicContact CD1-CD1 4Å; L158-F197 HydrophobicContact CG-CD1 4.28Å; L183-F197 HydrophobicContact CD2-CD1 4.02Å; L183-F197 HydrophobicContact CD2-CD2 4.17Å; L183-F197 HydrophobicContact CD2-CE1 3.78Å; L183-F197 HydrophobicContact CD2-CE2 3.94Å; L183-F197 HydrophobicContact CD2-CG 4.21Å; L183-F197 HydrophobicContact CD2-CZ 3.73Å; L186-F197 HydrophobicContact CB-CE1 3.93Å; L186-F197 HydrophobicContact CB-CZ 4.04Å; L186-F197 HydrophobicContact CD1-CE1 4.1Å; L187-F197 HydrophobicContact CD2-CE2 3.9Å; L187-F197 HydrophobicContact CD2-CZ 4.32Å; L187-F197 HydrophobicContact CG-CE2 4.18Å; L187-F197 HydrophobicContact CG-CZ 4.19Å; T192-F197 HydrophobicContact CG2-CD2 4.39Å; T192-F197 HydrophobicContact CG2-CE1 3.79Å; T192-F197 HydrophobicContact CG2-CE2 3.63Å; T192-F197 HydrophobicContact CG2-CZ 3.28Å; F197-A232 HydrophobicContact CD2-CB 3.81Å; F197-A232 HydrophobicContact CE2-CB 3.74Å; F197-R233 PolarHBondContact N-O 3.48Å; F197-F234 HydrophobicContact CB-CD1 3.88Å; F197-F234 HydrophobicContact CB-CE1 4.08Å; F197-F234 HydrophobicContact CG-CE1 4.43Å; F197-F234 CarbonylContact O-C 3.59Å; F197-K235 PolarHBondContact O-N 3.26Å
198V98.4Very high96.8Very high0 Ų024.4 Ų24.40%013%0.126CC..EExtended strand (participates in β ladder)trans-134.9139.3166.958.70000108.6R155 V156 V157 L158 A236 F279R155-V198 HydrophobicContact CB-CG1 4.09Å; V156-V198 PolarHBondContact O-N 3.45Å; V157-V198 HydrophobicContact CB-CG1 4.17Å; V157-V198 HydrophobicContact CG1-CG1 4.21Å; V157-V198 HydrophobicContact CG2-CG1 3.79Å; L158-V198 PolarHBondContact N-O 2.97Å; V198-A236 WeakPolarHBondContact CA-O 3.46Å; V198-A236 HydrophobicContact CG2-CB 3.86Å; V198-F279 HydrophobicContact CG1-CE1 3.9Å; V198-F279 HydrophobicContact CG1-CZ 4.28Å; V198-F279 HydrophobicContact CG2-CE1 4.17Å; V198-F279 HydrophobicContact CG2-CZ 3.69Å
199L98.4Very high96.5Very high1 Ų126.3 Ų26.31%0.00513%0.134CC..EExtended strand (participates in β ladder)trans-104.1138.8176.6-76.468.1000108.9L158 Y179 M222 L226 F234 A236 V237 H238L158-L199 HydrophobicContact CB-CG 4.32Å; L158-L199 HydrophobicContact CD1-CD1 4.36Å; L158-L199 CarbonylContact O-C 3.56Å; L158-L199 WeakPolarHBondContact O-CA 3.36Å; Y179-L199 HydrophobicContact CE1-CD2 4.42Å; L199-M222 HydrophobicContact CD2-CE 4.29Å; L199-L226 HydrophobicContact CD1-CD2 4.25Å; L199-L226 HydrophobicContact CD2-CD1 4.48Å; L199-L226 HydrophobicContact CD2-CD2 3.89Å; L199-F234 HydrophobicContact CD1-CD1 3.58Å; L199-F234 HydrophobicContact CD1-CE1 3.86Å; L199-A236 PolarHBondContact N-O 2.9Å; L199-A236 VanDerWaalsContact N-O 3.08Å; L199-V237 HydrophobicContact CB-CG1 4.21Å; L199-V237 HydrophobicContact CB-CG2 4.3Å; L199-V237 CarbonylContact O-C 3.43Å; L199-V237 WeakPolarHBondContact O-CA 3.43Å; L199-H238 PolarHBondContact O-N 2.81Å
200I98.5Very high96.2Very high0 Ų027 Ų270%014%0.137CC..EExtended strand (participates in β ladder)trans-120.6119.6167.6-51.1177.1000107.3V157 L158 L159 F160 H238 I240 Y275 F279 L284 F288V157-I200 HydrophobicContact CG1-CD1 3.57Å; V157-I200 HydrophobicContact CG1-CG1 3.97Å; L158-I200 PolarHBondContact O-N 3.11Å; L159-I200 WeakPolarHBondContact CA-O 3.22Å; L159-I200 HydrophobicContact CD2-CB 3.72Å; L159-I200 HydrophobicContact CD2-CD1 3.68Å; L159-I200 HydrophobicContact CD2-CG1 3.97Å; F160-I200 PolarHBondContact N-O 3.32Å; I200-H238 CarbonylContact C-O 3.58Å; I200-H238 WeakPolarHBondContact CA-O 3.42Å; I200-I240 HydrophobicContact CG2-CD1 4.35Å; I200-Y275 HydrophobicContact CD1-CE2 3.95Å; I200-Y275 HydrophobicContact CG1-CE2 4.47Å; I200-Y275 HydrophobicContact CG2-CE2 3.9Å; I200-F279 HydrophobicContact CD1-CD1 3.95Å; I200-F279 HydrophobicContact CD1-CD2 4.19Å; I200-F279 HydrophobicContact CD1-CE1 3.67Å; I200-F279 HydrophobicContact CD1-CE2 3.93Å; I200-F279 HydrophobicContact CD1-CG 4.19Å; I200-F279 HydrophobicContact CD1-CZ 3.65Å; I200-F279 HydrophobicContact CG1-CE1 4.18Å; I200-F279 HydrophobicContact CG1-CE2 4.18Å; I200-F279 HydrophobicContact CG1-CZ 3.78Å; I200-L284 HydrophobicContact CD1-CD2 3.7Å; I200-F288 HydrophobicContact CG2-CD1 3.89Å; I200-F288 HydrophobicContact CG2-CE1 4.35Å
201E97.8Very high95.7Very high12 Ų1226.2 Ų26.26%0.05614%0.139CC..EExtended strand (participates in β ladder)trans-110.1102.7-176.3-59.7-69.9164.900107.6F160 F203 M222 V237 H238 V239 I240F160-E201 WeakPolarHBondContact CB-OE2 3.35Å; F160-E201 VanDerWaalsContact CD1-OE2 3.3Å; F160-E201 WeakPolarHBondContact CD1-OE2 3.5Å; E201-F203 HydrophobicContact CB-CD2 3.86Å; E201-F203 HydrophobicContact CB-CE2 3.75Å; E201-F203 HydrophobicContact CG-CE2 4.49Å; E201-F203 PolarHBondContact O-N 2.93Å; E201-M222 WeakPolarHBondContact OE1-CE 3.2Å; E201-V237 HydrophobicContact CG-CG1 4Å; E201-H238 PolarHBondContact N-O 2.85Å; E201-V239 HydrophobicContact CB-CG2 4.33Å; E201-V239 WeakPolarHBondContact O-CA 3.34Å; E201-I240 PolarHBondContact O-N 3.28Å
202N97.8Very high95.2Very high4 Ų430.9 Ų30.92%0.02117%0.172CC..EExtended strand (participates in β ladder)trans-81.6107.9172.6-170.8-4000109.2F160 N161 I162 K204 I240 H241 D287 F288F160-N202 PolarHBondContact O-N 3.4Å; N161-N202 HydrophobicContact CB-CB 4.44Å; I162-N202 WeakPolarHBondContact CG2-O 3.16Å; I162-N202 PolarHBondContact N-O 3.43Å; N202-K204 VanDerWaalsContact C-N 3.35Å; N202-K204 WeakPolarHBondContact OD1-CB 3.48Å; N202-K204 PolarHBondContact OD1-N 3.14Å; N202-I240 HydrophobicContact CB-CD1 4.06Å; N202-I240 HydrophobicContact CB-CG1 4.02Å; N202-H241 PolarHBondContact OD1-CD2 3Å; N202-D287 PolarHBondContact ND2-O 2.87Å; N202-F288 HydrophobicContact CB-CD1 3.87Å; N202-F288 HydrophobicContact CB-CE1 3.59Å; N202-F288 HydrophobicContact CB-CZ 4.25Å
203F96.9Very high94.7Very high27 Ų2732.6 Ų32.612%0.11819%0.19CC..  trans-949179.5-91.2-115000113.1I162 E201 G205 F206 V239 I240 H241 Q242 F246I162-F203 HydrophobicContact CD1-CE1 4.4Å; E201-F203 HydrophobicContact CB-CD2 3.86Å; E201-F203 HydrophobicContact CB-CE2 3.75Å; E201-F203 HydrophobicContact CG-CE2 4.49Å; E201-F203 PolarHBondContact O-N 2.93Å; F203-G205 PolarHBondContact O-N 2.93Å; F203-F206 HydrophobicContact CB-CB 4.33Å; F203-F206 HydrophobicContact CD1-CB 3.84Å; F203-F206 AromaticContact CD1-CD1 3.64Å; F203-F206 HydrophobicContact CD1-CD1 3.64Å; F203-F206 HydrophobicContact CD1-CD2 4.23Å; F203-F206 HydrophobicContact CD1-CE1 4.2Å; F203-F206 AromaticContact CD1-CG 3.66Å; F203-F206 HydrophobicContact CD1-CG 3.66Å; F203-F206 AromaticContact CE1-CD1 3.96Å; F203-F206 HydrophobicContact CE1-CD1 3.96Å; F203-F206 HydrophobicContact CE1-CD2 4.2Å; F203-F206 HydrophobicContact CE1-CE1 4.06Å; F203-F206 HydrophobicContact CE1-CE2 4.28Å; F203-F206 HydrophobicContact CE1-CG 4.03Å; F203-F206 HydrophobicContact CE1-CZ 4.21Å; F203-F206 HydrophobicContact CG-CB 4.45Å; F203-F206 WeakPolarHBondContact O-CB 3.43Å; F203-F206 PolarHBondContact O-N 3.02Å; F203-V239 HydrophobicContact CB-CG1 4.27Å; F203-V239 HydrophobicContact CD2-CG1 3.75Å; F203-V239 HydrophobicContact CE2-CG1 4.31Å; F203-V239 HydrophobicContact CG-CG1 4.01Å; F203-I240 WeakPolarHBondContact CB-O 3.28Å; F203-I240 PolarHBondContact N-O 3.38Å; F203-H241 CarbonylContact C-O 3.58Å; F203-Q242 HydrophobicContact CB-CB 3.89Å; F203-Q242 HydrophobicContact CG-CB 4.38Å; F203-F246 AromaticContact CD1-CD2 3.66Å; F203-F246 HydrophobicContact CD1-CD2 3.66Å; F203-F246 HydrophobicContact CD1-CE2 4.02Å; F203-F246 AromaticContact CE1-CD2 3.54Å; F203-F246 HydrophobicContact CE1-CD2 3.54Å; F203-F246 AromaticContact CE1-CE2 3.62Å; F203-F246 HydrophobicContact CE1-CE2 3.62Å; F203-F246 HydrophobicContact CE2-CE2 4.42Å; F203-F246 HydrophobicContact CG-CD2 4.46Å; F203-F246 HydrophobicContact CZ-CD2 4.24Å; F203-F246 AromaticContact CZ-CE2 3.84Å; F203-F246 HydrophobicContact CZ-CE2 3.84Å
204K95.4Very high94.3Very high114 Ų11433.4 Ų33.450%0.49619%0.194SC..THydrogen-bonded Turntrans-58.6132.3166.3-167.5172.7-175.3173.80108.4I162 D163 N202 F206 H241I162-K204 WeakPolarHBondContact CG2-O 3.32Å; D163-K204 WeakPolarHBondContact CB-O 3.37Å; D163-K204 PolarHBondContact N-O 3.47Å; N202-K204 VanDerWaalsContact C-N 3.35Å; N202-K204 WeakPolarHBondContact OD1-CB 3.48Å; N202-K204 PolarHBondContact OD1-N 3.14Å; K204-F206 VanDerWaalsContact C-N 3.26Å; K204-F206 PolarHBondContact O-N 3.03Å; K204-H241 HydrophobicContact CB-CB 3.75Å; K204-H241 HydrophobicContact CG-CB 4.46Å
205G93.6Very high94Very high31 Ų3139.8 Ų39.832%0.3222%0.221SC..THydrogen-bonded Turntrans77.83.9-17400000114.8F203 T207F203-G205 PolarHBondContact O-N 2.93Å; G205-T207 VanDerWaalsContact O-CG2 3.32Å; G205-T207 WeakPolarHBondContact O-CG2 3.28Å; G205-T207 PolarHBondContact O-N 3.27Å; G205-T207 VanDerWaalsContact O-N 3.14Å
206F95.1Very high93.8Very high9 Ų943.1 Ų43.14%0.03924%0.242CC..  trans-61.3120.3168.6-174.5-135.8000109.1I162 F203 K204 H210 A211 I214 P243 Y245I162-F206 HydrophobicContact CD1-CD2 3.36Å; I162-F206 HydrophobicContact CD1-CE2 3.86Å; I162-F206 HydrophobicContact CD1-CG 4.26Å; I162-F206 HydrophobicContact CG1-CD2 4.27Å; I162-F206 HydrophobicContact CG2-CB 3.84Å; F203-F206 HydrophobicContact CB-CB 4.33Å; F203-F206 HydrophobicContact CD1-CB 3.84Å; F203-F206 AromaticContact CD1-CD1 3.64Å; F203-F206 HydrophobicContact CD1-CD1 3.64Å; F203-F206 HydrophobicContact CD1-CD2 4.23Å; F203-F206 HydrophobicContact CD1-CE1 4.2Å; F203-F206 AromaticContact CD1-CG 3.66Å; F203-F206 HydrophobicContact CD1-CG 3.66Å; F203-F206 AromaticContact CE1-CD1 3.96Å; F203-F206 HydrophobicContact CE1-CD1 3.96Å; F203-F206 HydrophobicContact CE1-CD2 4.2Å; F203-F206 HydrophobicContact CE1-CE1 4.06Å; F203-F206 HydrophobicContact CE1-CE2 4.28Å; F203-F206 HydrophobicContact CE1-CG 4.03Å; F203-F206 HydrophobicContact CE1-CZ 4.21Å; F203-F206 HydrophobicContact CG-CB 4.45Å; F203-F206 WeakPolarHBondContact O-CB 3.43Å; F203-F206 PolarHBondContact O-N 3.02Å; K204-F206 VanDerWaalsContact C-N 3.26Å; K204-F206 PolarHBondContact O-N 3.03Å; F206-H210 HydrophobicContact CD2-CB 3.6Å; F206-H210 HydrophobicContact CE2-CB 3.51Å; F206-A211 HydrophobicContact CE1-CB 4.05Å; F206-A211 HydrophobicContact CE2-CB 4.23Å; F206-A211 HydrophobicContact CZ-CB 3.58Å; F206-I214 HydrophobicContact CE2-CD1 4.4Å; F206-P243 HydrophobicContact CB-CG 4.16Å; F206-P243 HydrophobicContact CD1-CG 3.68Å; F206-P243 HydrophobicContact CG-CG 4.39Å; F206-Y245 HydrophobicContact CD1-CD2 4.21Å; F206-Y245 AromaticContact CD1-CE2 3.63Å; F206-Y245 HydrophobicContact CD1-CE2 3.63Å; F206-Y245 HydrophobicContact CE1-CD2 4.09Å; F206-Y245 AromaticContact CE1-CE2 3.85Å; F206-Y245 HydrophobicContact CE1-CE2 3.85Å; F206-Y245 HydrophobicContact CG-CE2 4.45Å; F206-Y245 PolarHBondContact O-OH 2.82Å
207T93.1Very high93.7Very high54 Ų5446 Ų4633%0.33127%0.266SS..  trans-105.3165.1-177.269.70000111.9G205 Q209 H210 A211 Y245G205-T207 VanDerWaalsContact O-CG2 3.32Å; G205-T207 WeakPolarHBondContact O-CG2 3.28Å; G205-T207 PolarHBondContact O-N 3.27Å; G205-T207 VanDerWaalsContact O-N 3.14Å; T207-Q209 PolarHBondContact O-N 2.81Å; T207-Q209 PolarHBondContact OG1-N 2.84Å; T207-H210 PolarHBondContact N-ND1 3.48Å; T207-H210 PolarHBondContact O-N 2.95Å; T207-H210 VanDerWaalsContact OG1-CG 3.29Å; T207-H210 PolarHBondContact OG1-N 2.86Å; T207-H210 VanDerWaalsContact OG1-N 3.1Å; T207-H210 PolarHBondContact OG1-ND1 2.58Å; T207-A211 PolarHBondContact O-N 3.08Å; T207-Y245 WeakPolarHBondContact CA-OH 3.19Å
208M89.7Confident93.5Very high105 Ų10547.4 Ų47.452%0.51727%0.272SS..Hα-helixtrans-59.1-34.5167.8-74.8-74.9105.100112.5A211 S212 Y245M208-A211 PolarHBondContact O-N 3.08Å; M208-S212 WeakPolarHBondContact O-CB 3.37Å; M208-S212 PolarHBondContact O-N 3.42Å; M208-S212 PolarHBondContact O-OG 3.07Å; M208-S212 VanDerWaalsContact O-OG 3.14Å; M208-Y245 HydrophobicContact CE-CD1 3.3Å; M208-Y245 HydrophobicContact CE-CD2 3.02Å; M208-Y245 HydrophobicContact CE-CE1 3.42Å; M208-Y245 VanDerWaalsContact CE-CE1 3.42Å; M208-Y245 HydrophobicContact CE-CE2 3.12Å; M208-Y245 HydrophobicContact CE-CG 3.06Å
209Q88.9Confident93.3Very high135 Ų13548.5 Ų48.563%0.63128%0.278SS*.Hα-helixtrans-62.4-47.7176.7-178.2175.5-800110.1T207 A211 S212 G213T207-Q209 PolarHBondContact O-N 2.81Å; T207-Q209 PolarHBondContact OG1-N 2.84Å; Q209-A211 PolarHBondContact O-N 2.95Å; Q209-S212 PolarHBondContact O-N 3.29Å; Q209-S212 PolarHBondContact O-OG 2.9Å; Q209-G213 PolarHBondContact O-N 3.27Å
210H90.9Very high93.1Very high20 Ų2051.9 Ų51.99%0.09329%0.293CS..Hα-helixtrans-58.2-48.1173.2-58158.6000111.2W165 F206 T207 S212 G213 I214W165-H210 PolarHBondContact O-NE2 2.87Å; W165-H210 VanDerWaalsContact O-NE2 3.12Å; F206-H210 HydrophobicContact CD2-CB 3.6Å; F206-H210 HydrophobicContact CE2-CB 3.51Å; T207-H210 PolarHBondContact N-ND1 3.48Å; T207-H210 PolarHBondContact O-N 2.95Å; T207-H210 VanDerWaalsContact OG1-CG 3.29Å; T207-H210 PolarHBondContact OG1-N 2.86Å; T207-H210 VanDerWaalsContact OG1-N 3.1Å; T207-H210 PolarHBondContact OG1-ND1 2.58Å; H210-S212 VanDerWaalsContact C-N 3.25Å; H210-S212 PolarHBondContact O-N 2.83Å; H210-G213 PolarHBondContact O-N 3.01Å; H210-G213 VanDerWaalsContact O-N 3.16Å; H210-I214 WeakPolarHBondContact O-CG1 3.2Å; H210-I214 PolarHBondContact O-N 3.32Å
211A88.1Confident93Very high32 Ų3252.8 Ų52.826%0.26430%0.297SS..Hα-helixtrans-59.8-34.4-179.100000113.3F206 T207 M208 Q209F206-A211 HydrophobicContact CE1-CB 4.05Å; F206-A211 HydrophobicContact CE2-CB 4.23Å; F206-A211 HydrophobicContact CZ-CB 3.58Å; T207-A211 PolarHBondContact O-N 3.08Å; M208-A211 PolarHBondContact O-N 3.08Å; Q209-A211 PolarHBondContact O-N 2.95Å
212S87.2Confident92.9Very high99 Ų9954 Ų5469%0.69230%0.303SS*.Hα-helixtrans-85.6-26.9176.166.10000114.3M208 Q209 H210M208-S212 WeakPolarHBondContact O-CB 3.37Å; M208-S212 PolarHBondContact O-N 3.42Å; M208-S212 PolarHBondContact O-OG 3.07Å; M208-S212 VanDerWaalsContact O-OG 3.14Å; Q209-S212 PolarHBondContact O-N 3.29Å; Q209-S212 PolarHBondContact O-OG 2.9Å; H210-S212 VanDerWaalsContact C-N 3.25Å; H210-S212 PolarHBondContact O-N 2.83Å
213G88.6Confident92.9Very high36 Ų3654 Ų5437%0.37130%0.304SS..Hα-helixtrans-80.7-35-176.400000113.1Q209 H210 K215Q209-G213 PolarHBondContact O-N 3.27Å; H210-G213 PolarHBondContact O-N 3.01Å; H210-G213 VanDerWaalsContact O-N 3.16Å; G213-K215 PolarHBondContact O-N 2.6Å
214I89.3Confident92.8Very high21 Ų2154.2 Ų54.211%0.10831%0.306CS..SBendtrans-74.9120.4178.5-59.7165.7000109.7W165 L167 F172 F206 H210 L219W165-I214 HydrophobicContact CZ3-CD1 3.94Å; W165-I214 HydrophobicContact CZ3-CG1 4.38Å; L167-I214 HydrophobicContact CD1-CG1 4.18Å; L167-I214 HydrophobicContact CD2-CG1 4.28Å; F172-I214 HydrophobicContact CD2-CG1 4.28Å; F172-I214 HydrophobicContact CD2-CG2 3.79Å; F172-I214 HydrophobicContact CE2-CG2 3.72Å; F206-I214 HydrophobicContact CE2-CD1 4.4Å; H210-I214 WeakPolarHBondContact O-CG1 3.2Å; H210-I214 PolarHBondContact O-N 3.32Å; I214-L219 HydrophobicContact CG2-CD1 4.17Å; I214-L219 HydrophobicContact CG2-CD2 3.66Å; I214-L219 HydrophobicContact CG2-CG 3.69Å
215K92.7Very high92.9Very high134 Ų13448.9 Ų48.958%0.58328%0.282SS*.  trans-83147.3-175.8-61.5169.8-171.4157.60110.8G213 A217 E218 L219G213-K215 PolarHBondContact O-N 2.6Å; K215-A217 PolarHBondContact O-N 3.36Å; K215-A217 VanDerWaalsContact O-N 3.1Å; K215-E218 HydrophobicContact CB-CG 4.24Å; K215-E218 PolarHBondContact N-OE2 3Å; K215-E218 WeakPolarHBondContact O-CB 3.42Å; K215-E218 PolarHBondContact O-N 3.36Å; K215-L219 PolarHBondContact O-N 3.4Å; K215-L219 VanDerWaalsContact O-N 3.13Å
216T93.7Very high92.9Very high71 Ų7148.5 Ų48.544%0.43627%0.273SS..Hα-helixtrans-53.6-34.5172.8-52.60000112.8K220 V252 F256T216-K220 WeakPolarHBondContact O-CB 3.44Å; T216-K220 PolarHBondContact O-N 3.28Å; T216-V252 HydrophobicContact CG2-CG1 3.71Å; T216-F256 HydrophobicContact CG2-CE2 3.65Å; T216-F256 HydrophobicContact CG2-CZ 3.69Å
217A94.5Very high92.8Very high61 Ų6149.2 Ų49.250%0.50428%0.276SS..Hα-helixtrans-64.1-40176.400000112.4K215 K220 K221K215-A217 PolarHBondContact O-N 3.36Å; K215-A217 VanDerWaalsContact O-N 3.1Å; A217-K220 WeakPolarHBondContact O-CB 3.42Å; A217-K220 PolarHBondContact O-N 2.95Å; A217-K221 WeakPolarHBondContact O-CG 3.33Å; A217-K221 PolarHBondContact O-N 3.16Å
218E94.5Very high92.6Very high29 Ų2949.1 Ų49.114%0.13627%0.274CS..Hα-helixtrans-68.3-44178.1-68.2161.5172.800111F172 K215 K220 K221 M222F172-E218 HydrophobicContact CB-CB 4.27Å; F172-E218 HydrophobicContact CB-CG 4.17Å; F172-E218 HydrophobicContact CD1-CB 3.73Å; F172-E218 HydrophobicContact CD1-CG 4.36Å; F172-E218 HydrophobicContact CD2-CB 4.16Å; F172-E218 HydrophobicContact CE1-CB 4.11Å; F172-E218 WeakPolarHBondContact CE1-O 3.36Å; F172-E218 HydrophobicContact CG-CB 3.79Å; F172-E218 HydrophobicContact CG-CG 4.24Å; K215-E218 HydrophobicContact CB-CG 4.24Å; K215-E218 PolarHBondContact N-OE2 3Å; K215-E218 WeakPolarHBondContact O-CB 3.42Å; K215-E218 PolarHBondContact O-N 3.36Å; E218-K220 VanDerWaalsContact C-N 3.27Å; E218-K220 PolarHBondContact O-N 3.34Å; E218-K221 WeakPolarHBondContact O-CB 3.45Å; E218-K221 PolarHBondContact O-N 2.86Å; E218-M222 PolarHBondContact O-N 2.91Å
219L94.1Very high92.8Very high24 Ų2444.5 Ų44.513%0.12625%0.252CS..Hα-helixtrans-60.7-39173.9-63.2169.5000111.7F172 I214 K215 M222 V223 T249 V253F172-L219 HydrophobicContact CE2-CD2 4.32Å; F172-L219 HydrophobicContact CZ-CD2 4.4Å; I214-L219 HydrophobicContact CG2-CD1 4.17Å; I214-L219 HydrophobicContact CG2-CD2 3.66Å; I214-L219 HydrophobicContact CG2-CG 3.69Å; K215-L219 PolarHBondContact O-N 3.4Å; K215-L219 VanDerWaalsContact O-N 3.13Å; L219-M222 PolarHBondContact O-N 3.48Å; L219-V223 WeakPolarHBondContact O-CG2 3.38Å; L219-V223 PolarHBondContact O-N 2.83Å; L219-T249 HydrophobicContact CD1-CG2 4.23Å; L219-V253 HydrophobicContact CB-CG2 3.64Å; L219-V253 HydrophobicContact CD1-CG2 3.53Å; L219-V253 HydrophobicContact CD2-CG2 4.08Å; L219-V253 HydrophobicContact CG-CG2 3.93Å
220K95.7Very high93.1Very high71 Ų7138.3 Ų38.331%0.30922%0.223SC..Hα-helixtrans-63.1-41.3173.8-175.7-174.9176.4-62.70111.5Y123 T216 A217 E218 M222 V223 D224 F256Y123-K220 PolarHBondContact OH-NZ 3.44Å; Y123-K220 VanDerWaalsContact OH-NZ 3.1Å; T216-K220 WeakPolarHBondContact O-CB 3.44Å; T216-K220 PolarHBondContact O-N 3.28Å; A217-K220 WeakPolarHBondContact O-CB 3.42Å; A217-K220 PolarHBondContact O-N 2.95Å; E218-K220 VanDerWaalsContact C-N 3.27Å; E218-K220 PolarHBondContact O-N 3.34Å; K220-M222 VanDerWaalsContact C-N 3.33Å; K220-M222 PolarHBondContact O-N 2.94Å; K220-V223 PolarHBondContact O-N 3.09Å; K220-D224 IonicContact NZ-OD2 2.61Å; K220-D224 PolarHBondContact NZ-OD2 3.41Å; K220-D224 PolarHBondContact O-N 3.21Å; K220-F256 HydrophobicContact CB-CD2 4.26Å; K220-F256 HydrophobicContact CB-CE2 4.4Å; K220-F256 HydrophobicContact CB-CG 4.38Å; K220-F256 HydrophobicContact CD-CD1 4.21Å; K220-F256 HydrophobicContact CD-CE1 4.22Å; K220-F256 HydrophobicContact CG-CD1 4.13Å; K220-F256 HydrophobicContact CG-CE1 4.48Å; K220-F256 HydrophobicContact CG-CG 4.18Å
221K96.3Very high93.4Very high19 Ų1937.5 Ų37.58%0.08322%0.22CC..Hα-helixtrans-57.5-46.4174.5-66.8-179.5-160.3-1750111.2Y123 E125 L126 D173 L176 A217 E218 V223 D224 M225Y123-K221 HydrophobicContact CD1-CD 3.96Å; Y123-K221 HydrophobicContact CD1-CG 3.67Å; Y123-K221 HydrophobicContact CE1-CD 4.21Å; Y123-K221 HydrophobicContact CE1-CG 3.46Å; Y123-K221 VanDerWaalsContact CE1-CG 3.46Å; Y123-K221 HydrophobicContact CE2-CG 4.48Å; Y123-K221 HydrophobicContact CG-CG 4.27Å; E125-K221 WeakPolarHBondContact OE1-CE 3.42Å; E125-K221 IonicContact OE1-NZ 2.7Å; E125-K221 PolarHBondContact OE1-NZ 3.18Å; L126-K221 HydrophobicContact CD1-CD 4.42Å; D173-K221 WeakPolarHBondContact OD1-CD 3.15Å; D173-K221 IonicContact OD1-NZ 2.77Å; D173-K221 PolarHBondContact OD1-NZ 2.78Å; D173-K221 IonicContact OD2-NZ 2.87Å; D173-K221 PolarHBondContact OD2-NZ 2.62Å; L176-K221 HydrophobicContact CD1-CB 3.5Å; L176-K221 VanDerWaalsContact CD1-CB 3.5Å; L176-K221 HydrophobicContact CD1-CD 4.19Å; L176-K221 HydrophobicContact CD1-CG 4.49Å; A217-K221 WeakPolarHBondContact O-CG 3.33Å; A217-K221 PolarHBondContact O-N 3.16Å; E218-K221 WeakPolarHBondContact O-CB 3.45Å; E218-K221 PolarHBondContact O-N 2.86Å; K221-V223 PolarHBondContact O-N 3.1Å; K221-D224 PolarHBondContact O-N 3.36Å; K221-M225 PolarHBondContact O-N 3.03Å
222M95.8Very high93.8Very high37 Ų3736.5 Ų36.518%0.18221%0.211CC..Hα-helixtrans-60.5-46.1177.1-170.7-177-171.200111.6F172 L176 L199 E201 E218 L219 K220 D224 M225 L226F172-M222 HydrophobicContact CE1-CB 4.09Å; F172-M222 HydrophobicContact CZ-CB 4.11Å; F172-M222 HydrophobicContact CZ-SD 4.11Å; L176-M222 HydrophobicContact CD2-CB 4.03Å; L176-M222 HydrophobicContact CD2-CG 4.15Å; L199-M222 HydrophobicContact CD2-CE 4.29Å; E201-M222 WeakPolarHBondContact OE1-CE 3.2Å; E218-M222 PolarHBondContact O-N 2.91Å; L219-M222 PolarHBondContact O-N 3.48Å; K220-M222 VanDerWaalsContact C-N 3.33Å; K220-M222 PolarHBondContact O-N 2.94Å; M222-D224 PolarHBondContact O-N 3.24Å; M222-M225 HydrophobicContact CG-CE 4.36Å; M222-M225 WeakPolarHBondContact O-CB 3.5Å; M222-M225 PolarHBondContact O-N 3.48Å; M222-L226 HydrophobicContact CG-CD1 4.34Å; M222-L226 VanDerWaalsContact O-CG 3.32Å; M222-L226 WeakPolarHBondContact O-CG 3.44Å; M222-L226 PolarHBondContact O-N 2.95Å; M222-L226 VanDerWaalsContact O-N 3.08Å
223V96.3Very high94.2Very high6 Ų633.2 Ų33.24%0.03618%0.184CC..Hα-helixtrans-59-50.8175.5171.70000110.3L219 K220 K221 M225 L226 Q227 V253 F256 M257 L261L219-V223 WeakPolarHBondContact O-CG2 3.38Å; L219-V223 PolarHBondContact O-N 2.83Å; K220-V223 PolarHBondContact O-N 3.09Å; K221-V223 PolarHBondContact O-N 3.1Å; V223-M225 VanDerWaalsContact C-N 3.26Å; V223-M225 PolarHBondContact O-N 3.46Å; V223-L226 CarbonylContact O-C 3.56Å; V223-L226 WeakPolarHBondContact O-CA 3.47Å; V223-L226 PolarHBondContact O-N 3.1Å; V223-Q227 HydrophobicContact CG1-CG 3.85Å; V223-Q227 WeakPolarHBondContact O-CG 3.35Å; V223-Q227 PolarHBondContact O-N 2.9Å; V223-V253 HydrophobicContact CG2-CG1 3.27Å; V223-F256 HydrophobicContact CB-CB 4.31Å; V223-F256 HydrophobicContact CG1-CB 3.96Å; V223-F256 WeakPolarHBondContact CG1-O 3.4Å; V223-F256 HydrophobicContact CG2-CB 4.41Å; V223-M257 HydrophobicContact CG1-CG 4.07Å; V223-M257 HydrophobicContact CG2-CG 3.99Å; V223-L261 HydrophobicContact CG1-CD2 4.21Å
224D96.2Very high94.6Very high31 Ų3132 Ų3217%0.16617%0.168CC..Hα-helixtrans-59.7-37.3-179.5-73.2-21.7000112F119 Y123 K220 K221 M222 L226 Q227 S229F119-D224 HydrophobicContact CD2-CB 4.14Å; F119-D224 HydrophobicContact CE2-CB 4.03Å; Y123-D224 HydrophobicContact CE2-CB 4.23Å; Y123-D224 PolarHBondContact OH-OD2 3.25Å; K220-D224 IonicContact NZ-OD2 2.61Å; K220-D224 PolarHBondContact NZ-OD2 3.41Å; K220-D224 PolarHBondContact O-N 3.21Å; K221-D224 PolarHBondContact O-N 3.36Å; M222-D224 PolarHBondContact O-N 3.24Å; D224-L226 VanDerWaalsContact C-N 3.33Å; D224-L226 PolarHBondContact O-N 2.79Å; D224-Q227 CarbonylContact O-C 3.51Å; D224-Q227 PolarHBondContact O-N 2.92Å; D224-S229 WeakPolarHBondContact O-CB 3.4Å; D224-S229 PolarHBondContact O-OG 3.39Å
225M95.9Very high94.9Very high1 Ų133.1 Ų33.11%0.00517%0.172CC..Hα-helixtrans-57.5-44.8171.4178.118072.600111.8F119 L176 Y179 L183 K221 M222 V223 Q227 F230F119-M225 HydrophobicContact CE2-CB 4.18Å; F119-M225 HydrophobicContact CZ-CB 3.85Å; L176-M225 HydrophobicContact CD2-CE 3.7Å; L176-M225 HydrophobicContact CD2-SD 4.06Å; Y179-M225 VanDerWaalsContact CB-SD 3.57Å; Y179-M225 HydrophobicContact CD1-CE 4.27Å; Y179-M225 HydrophobicContact CD2-CE 4.09Å; Y179-M225 HydrophobicContact CG-CE 3.81Å; Y179-M225 HydrophobicContact CG-SD 4.29Å; L183-M225 HydrophobicContact CD1-CG 4.28Å; L183-M225 HydrophobicContact CD1-SD 4.3Å; K221-M225 PolarHBondContact O-N 3.03Å; M222-M225 HydrophobicContact CG-CE 4.36Å; M222-M225 WeakPolarHBondContact O-CB 3.5Å; M222-M225 PolarHBondContact O-N 3.48Å; V223-M225 VanDerWaalsContact C-N 3.26Å; V223-M225 PolarHBondContact O-N 3.46Å; M225-Q227 PolarHBondContact O-N 2.72Å; M225-F230 HydrophobicContact CB-CE2 4.47Å; M225-F230 HydrophobicContact CG-CD2 3.96Å; M225-F230 HydrophobicContact CG-CE2 3.72Å
226L94.2Very high95.1Very high23 Ų2326.9 Ų26.912%0.1215%0.146CC..Hα-helixtrans-74-20-178.2-64.7175000114.1L199 M222 V223 D224 F234 L261L199-L226 HydrophobicContact CD1-CD2 4.25Å; L199-L226 HydrophobicContact CD2-CD1 4.48Å; L199-L226 HydrophobicContact CD2-CD2 3.89Å; M222-L226 HydrophobicContact CG-CD1 4.34Å; M222-L226 VanDerWaalsContact O-CG 3.32Å; M222-L226 WeakPolarHBondContact O-CG 3.44Å; M222-L226 PolarHBondContact O-N 2.95Å; M222-L226 VanDerWaalsContact O-N 3.08Å; V223-L226 CarbonylContact O-C 3.56Å; V223-L226 WeakPolarHBondContact O-CA 3.47Å; V223-L226 PolarHBondContact O-N 3.1Å; D224-L226 VanDerWaalsContact C-N 3.33Å; D224-L226 PolarHBondContact O-N 2.79Å; L226-F234 HydrophobicContact CB-CD2 4.42Å; L226-F234 HydrophobicContact CD2-CD1 3.68Å; L226-F234 HydrophobicContact CD2-CD2 4.11Å; L226-F234 HydrophobicContact CD2-CE1 3.58Å; L226-F234 HydrophobicContact CD2-CE2 4.01Å; L226-F234 HydrophobicContact CD2-CG 3.94Å; L226-F234 HydrophobicContact CD2-CZ 3.74Å; L226-F234 WeakPolarHBondContact O-CD2 3.45Å; L226-L261 HydrophobicContact CB-CD2 4.24Å
227Q92.4Very high95.3Very high24 Ų2424.1 Ų24.111%0.11213%0.129CC..SBendtrans-127.7111.9-179.945169.653.500113.6V223 D224 M225 S229 F256 L261V223-Q227 HydrophobicContact CG1-CG 3.85Å; V223-Q227 WeakPolarHBondContact O-CG 3.35Å; V223-Q227 PolarHBondContact O-N 2.9Å; D224-Q227 CarbonylContact O-C 3.51Å; D224-Q227 PolarHBondContact O-N 2.92Å; M225-Q227 PolarHBondContact O-N 2.72Å; Q227-S229 VanDerWaalsContact C-N 3.31Å; Q227-S229 PolarHBondContact O-N 2.9Å; Q227-F256 PolarHBondContact NE2-O 2.99Å; Q227-L261 HydrophobicContact CG-CD2 4.34Å
228D88.9Confident95.4Very high53 Ų5321.4 Ų21.428%0.28311%0.106SC..SBendtrans67.617.4170.9-55.9-54.3000116.4R102 L112 G115 K258R102-D228 IonicContact CZ-OD1 2.69Å; R102-D228 IonicContact NE-OD1 2.83Å; R102-D228 IonicContact NH2-OD1 3.7Å; R102-D228 PolarHBondContact NH2-OD1 2.87Å; L112-D228 WeakPolarHBondContact CD1-O 3.32Å; G115-D228 CarbonylContact C-O 3.49Å; G115-D228 WeakPolarHBondContact CA-O 3.46Å; D228-K258 IonicContact OD2-NZ 3.07Å; D228-K258 PolarHBondContact OD2-NZ 2.86Å
229S94.4Very high95.6Very high8 Ų820.3 Ų20.36%0.05610%0.101CC..SBendtrans-105.8-26.2175.2-62.40000115Y116 F119 D224 Q227Y116-S229 WeakPolarHBondContact CA-O 3.22Å; Y116-S229 VanDerWaalsContact CB-O 3.31Å; Y116-S229 WeakPolarHBondContact CB-O 3.33Å; Y116-S229 WeakPolarHBondContact CD2-O 3.41Å; F119-S229 VanDerWaalsContact CD2-OG 3.27Å; F119-S229 WeakPolarHBondContact CD2-OG 3.49Å; F119-S229 WeakPolarHBondContact CG-OG 3.27Å; D224-S229 WeakPolarHBondContact O-CB 3.4Å; D224-S229 PolarHBondContact O-OG 3.39Å; Q227-S229 VanDerWaalsContact C-N 3.31Å; Q227-S229 PolarHBondContact O-N 2.9Å
230F96.1Very high95.8Very high4 Ų419.1 Ų19.12%0.01810%0.095CC..SBendtrans-124.4151.4179.1-72.2-94.4000111Y116 F119 F127 C180 L183 E184 M225 A232Y116-F230 HydrophobicContact CE2-CD1 4.4Å; F119-F230 AromaticContact CD1-CE2 3.94Å; F119-F230 HydrophobicContact CD1-CE2 3.94Å; F119-F230 HydrophobicContact CD1-CZ 4.35Å; F119-F230 AromaticContact CE1-CE2 3.7Å; F119-F230 HydrophobicContact CE1-CE2 3.7Å; F119-F230 HydrophobicContact CE1-CZ 4.14Å; F119-F230 HydrophobicContact CZ-CE2 4.45Å; F127-F230 HydrophobicContact CZ-CZ 4.31Å; C180-F230 HydrophobicContact CB-CZ 4Å; L183-F230 HydrophobicContact CB-CD1 4.25Å; L183-F230 HydrophobicContact CD1-CD1 4.37Å; L183-F230 HydrophobicContact CD1-CD2 4.24Å; L183-F230 HydrophobicContact CD1-CG 4.17Å; E184-F230 HydrophobicContact CG-CE1 4.43Å; E184-F230 WeakPolarHBondContact OE1-CE1 3.04Å; M225-F230 HydrophobicContact CB-CE2 4.47Å; M225-F230 HydrophobicContact CG-CD2 3.96Å; M225-F230 HydrophobicContact CG-CE2 3.72Å; F230-A232 HydrophobicContact CB-CB 4.18Å; F230-A232 PolarHBondContact O-N 3.28Å
231P96.5Very high95.8Very high4 Ų416.4 Ų16.43%0.0268%0.083CC..SBendtrans-74.640.7169.931.9-30.7000112.9R97 F98 A101 L112 L187R97-P231 HydrophobicContact CB-CB 3.88Å; R97-P231 HydrophobicContact CB-CG 4Å; F98-P231 HydrophobicContact CD1-CB 3.94Å; F98-P231 HydrophobicContact CD1-CG 4.34Å; F98-P231 HydrophobicContact CD2-CB 4.35Å; F98-P231 HydrophobicContact CD2-CG 4.42Å; F98-P231 HydrophobicContact CE1-CB 4.09Å; F98-P231 HydrophobicContact CE1-CG 4.02Å; F98-P231 HydrophobicContact CE2-CB 4.5Å; F98-P231 HydrophobicContact CE2-CG 4.11Å; F98-P231 HydrophobicContact CG-CB 4.06Å; F98-P231 HydrophobicContact CZ-CB 4.37Å; F98-P231 HydrophobicContact CZ-CG 3.89Å; A101-P231 HydrophobicContact CB-CB 4.25Å; L112-P231 HydrophobicContact CD2-CB 4.2Å; L187-P231 HydrophobicContact CD1-CG 4.07Å; L187-P231 WeakPolarHBondContact CD2-O 3.37Å
232A95.5Very high95.9Very high10 Ų1017.3 Ų17.38%0.0839%0.087CC..  trans-99.8151.8175.600000111.3L183 L187 F197 F230 F234L183-A232 HydrophobicContact CD2-CB 4.43Å; L187-A232 HydrophobicContact CD1-CB 4.35Å; L187-A232 HydrophobicContact CD2-CB 4.46Å; F197-A232 HydrophobicContact CD2-CB 3.81Å; F197-A232 HydrophobicContact CE2-CB 3.74Å; F230-A232 HydrophobicContact CB-CB 4.18Å; F230-A232 PolarHBondContact O-N 3.28Å; A232-F234 HydrophobicContact CB-CD2 4.31Å; A232-F234 HydrophobicContact CB-CE2 3.77Å; A232-F234 HydrophobicContact CB-CZ 3.97Å
233R96.4Very high95.8Very high31 Ų3117 Ų1712%0.1179%0.088CC..  trans-108.984.9172-58.2178.579.5-155.85.8109E50 Q193 I194 G196 F197 K235E50-R233 IonicContact OE2-CZ 2.66Å; E50-R233 IonicContact OE2-NH1 2.83Å; E50-R233 PolarHBondContact OE2-NH1 2.86Å; E50-R233 IonicContact OE2-NH2 3.05Å; E50-R233 PolarHBondContact OE2-NH2 2.86Å; Q193-R233 WeakPolarHBondContact O-CD 3.26Å; I194-R233 PolarHBondContact O-NH1 3.37Å; G196-R233 CarbonylContact C-O 3.24Å; G196-R233 WeakPolarHBondContact CA-O 3.19Å; F197-R233 PolarHBondContact N-O 3.48Å; R233-K235 PolarHBondContact O-N 3.35Å
234F96.6Very high95.6Very high10 Ų1027.1 Ų27.14%0.04413%0.126CC..EExtended strand (participates in β ladder)trans-66.9117.5170.8-61.9-75.1000109.5L183 F197 L199 L226 A232 R264L183-F234 HydrophobicContact CD1-CZ 3.85Å; L183-F234 HydrophobicContact CD2-CE1 4.05Å; L183-F234 HydrophobicContact CD2-CZ 3.86Å; F197-F234 HydrophobicContact CB-CD1 3.88Å; F197-F234 HydrophobicContact CB-CE1 4.08Å; F197-F234 HydrophobicContact CG-CE1 4.43Å; F197-F234 CarbonylContact O-C 3.59Å; L199-F234 HydrophobicContact CD1-CD1 3.58Å; L199-F234 HydrophobicContact CD1-CE1 3.86Å; L226-F234 HydrophobicContact CB-CD2 4.42Å; L226-F234 HydrophobicContact CD2-CD1 3.68Å; L226-F234 HydrophobicContact CD2-CD2 4.11Å; L226-F234 HydrophobicContact CD2-CE1 3.58Å; L226-F234 HydrophobicContact CD2-CE2 4.01Å; L226-F234 HydrophobicContact CD2-CG 3.94Å; L226-F234 HydrophobicContact CD2-CZ 3.74Å; L226-F234 WeakPolarHBondContact O-CD2 3.45Å; A232-F234 HydrophobicContact CB-CD2 4.31Å; A232-F234 HydrophobicContact CB-CE2 3.77Å; A232-F234 HydrophobicContact CB-CZ 3.97Å; F234-R264 VanDerWaalsContact O-CZ 3.22Å; F234-R264 PolarHBondContact O-NH1 3.27Å
235K96.6Very high95.3Very high44 Ų4427.4 Ų27.419%0.19113%0.125CC..EExtended strand (participates in β ladder)trans-95.7-33.1-173.3-65.7-65.5-167.9150.30112.4E50 R155 N195 F197 R233 R264E50-K235 IonicContact OE2-NZ 3.62Å; E50-K235 PolarHBondContact OE2-NZ 3.45Å; R155-K235 HydrophobicContact CG-CG 4.34Å; N195-K235 WeakPolarHBondContact O-CE 3.35Å; F197-K235 PolarHBondContact O-N 3.26Å; R233-K235 PolarHBondContact O-N 3.35Å; K235-R264 WeakPolarHBondContact O-CD 3.45Å; K235-R264 WeakPolarHBondContact O-CG 3.3Å
236A96.1Very high95.1Very high3 Ų328.2 Ų28.23%0.02513%0.128CC..EExtended strand (participates in β ladder)trans-158.8158.4177.400000110.6V198 L199 H238 R264 F266V198-A236 WeakPolarHBondContact CA-O 3.46Å; V198-A236 HydrophobicContact CG2-CB 3.86Å; L199-A236 PolarHBondContact N-O 2.9Å; L199-A236 VanDerWaalsContact N-O 3.08Å; A236-H238 VanDerWaalsContact CB-NE2 3.32Å; A236-H238 WeakPolarHBondContact CB-NE2 3.44Å; A236-R264 CarbonylContact C-O 3.6Å; A236-R264 WeakPolarHBondContact CA-O 3.35Å; A236-F266 HydrophobicContact CB-CD2 3.95Å; A236-F266 HydrophobicContact CB-CE2 3.75Å
237V97.4Very high94.9Very high14 Ų1431 Ų319%0.08515%0.147CC..EExtended strand (participates in β ladder)trans-126.5118.2165.1-178.70000105.7L199 E201 L261 R264 V265 F266L199-V237 HydrophobicContact CB-CG1 4.21Å; L199-V237 HydrophobicContact CB-CG2 4.3Å; L199-V237 CarbonylContact O-C 3.43Å; L199-V237 WeakPolarHBondContact O-CA 3.43Å; E201-V237 HydrophobicContact CG-CG1 4Å; V237-L261 HydrophobicContact CG2-CD1 4.49Å; V237-R264 PolarHBondContact N-O 3.12Å; V237-V265 HydrophobicContact CB-CG2 4.42Å; V237-V265 WeakPolarHBondContact O-CA 3.44Å; V237-F266 PolarHBondContact O-N 2.78Å
238H97.9Very high94.7Very high4 Ų434.3 Ų34.32%0.01917%0.169CC..EExtended strand (participates in β ladder)trans-106.9125.1179.7-65.1-85.8000109.3L199 I200 E201 A236 F266 H268 F279L199-H238 PolarHBondContact O-N 2.81Å; I200-H238 CarbonylContact C-O 3.58Å; I200-H238 WeakPolarHBondContact CA-O 3.42Å; E201-H238 PolarHBondContact N-O 2.85Å; A236-H238 VanDerWaalsContact CB-NE2 3.32Å; A236-H238 WeakPolarHBondContact CB-NE2 3.44Å; H238-F266 CarbonylContact C-O 3.54Å; H238-F266 WeakPolarHBondContact CA-O 3.41Å; H238-F266 AromaticContact CE1-CD2 3.65Å; H238-F266 AromaticContact ND1-CD2 3.9Å; H238-F266 AromaticContact ND1-CG 3.99Å; H238-H268 AromaticContact CG-NE2 3.6Å; H238-H268 AromaticContact ND1-CE1 3.58Å; H238-H268 AromaticContact ND1-NE2 2.97Å; H238-H268 PolarHBondContact ND1-NE2 3.31Å; H238-F279 HydrophobicContact CB-CE2 4.39Å; H238-F279 AromaticContact CD2-CE2 3.43Å; H238-F279 VanDerWaalsContact CD2-CE2 3.43Å; H238-F279 WeakPolarHBondContact CD2-CE2 3.35Å; H238-F279 AromaticContact CD2-CZ 3.39Å; H238-F279 WeakPolarHBondContact CD2-CZ 3.3Å; H238-F279 AromaticContact CG-CE2 3.75Å; H238-F279 AromaticContact NE2-CE2 3.63Å; H238-F279 AromaticContact NE2-CZ 3.66Å
239V97.6Very high94.8Very high5 Ų533 Ų333%0.0316%0.163CC..EExtended strand (participates in β ladder)trans-108.4124.4176.2-172.90000108.1E201 F203 Q242 F246 F266 V267 H268E201-V239 HydrophobicContact CB-CG2 4.33Å; E201-V239 WeakPolarHBondContact O-CA 3.34Å; F203-V239 HydrophobicContact CB-CG1 4.27Å; F203-V239 HydrophobicContact CD2-CG1 3.75Å; F203-V239 HydrophobicContact CE2-CG1 4.31Å; F203-V239 HydrophobicContact CG-CG1 4.01Å; V239-Q242 HydrophobicContact CG1-CB 3.81Å; V239-Q242 HydrophobicContact CG1-CG 4.36Å; V239-F246 HydrophobicContact CG1-CE1 4.48Å; V239-F246 HydrophobicContact CG1-CE2 4.13Å; V239-F246 HydrophobicContact CG1-CZ 4.02Å; V239-F246 HydrophobicContact CG2-CZ 4.11Å; V239-F266 PolarHBondContact N-O 2.95Å; V239-V267 HydrophobicContact CB-CG2 4.38Å; V239-H268 PolarHBondContact O-CD2 2.93Å; V239-H268 PolarHBondContact O-N 3.07Å
240I97.8Very high94.6Very high0 Ų035 Ų350%017%0.169CC..EExtended strand (participates in β ladder)trans-118.5151.3178.361.2174.3000110.2I200 E201 N202 F203 Q242 H268 L272 Y275 F288I200-I240 HydrophobicContact CG2-CD1 4.35Å; E201-I240 PolarHBondContact O-N 3.28Å; N202-I240 HydrophobicContact CB-CD1 4.06Å; N202-I240 HydrophobicContact CB-CG1 4.02Å; F203-I240 WeakPolarHBondContact CB-O 3.28Å; F203-I240 PolarHBondContact N-O 3.38Å; I240-Q242 PolarHBondContact O-N 3.34Å; I240-Q242 VanDerWaalsContact O-N 3.07Å; I240-H268 HydrophobicContact CG2-CB 4.28Å; I240-L272 HydrophobicContact CB-CD2 4.06Å; I240-L272 HydrophobicContact CG2-CD2 3.76Å; I240-Y275 HydrophobicContact CG2-CD2 3.99Å; I240-Y275 HydrophobicContact CG2-CE2 4.19Å; I240-Y275 HydrophobicContact CG2-CG 4.25Å; I240-F288 HydrophobicContact CD1-CD1 4.4Å
241H97.8Very high94.5Very high13 Ų1338.9 Ų38.96%0.0619%0.19CC..SBendtrans55.325.2176.8-51.6-63.3000115.5N202 F203 K204 G269 E270 D289N202-H241 PolarHBondContact OD1-CD2 3Å; F203-H241 CarbonylContact C-O 3.58Å; K204-H241 HydrophobicContact CB-CB 3.75Å; K204-H241 HydrophobicContact CG-CB 4.46Å; H241-G269 PolarHBondContact N-O 3.16Å; H241-E270 IonicContact CE1-OE2 3.76Å; H241-E270 PolarHBondContact CE1-OE2 3.23Å; H241-E270 IonicContact CG-OE2 3.94Å; H241-E270 IonicContact ND1-OE1 3.51Å; H241-E270 IonicContact ND1-OE2 2.78Å; H241-E270 PolarHBondContact ND1-OE2 3.23Å; H241-D289 IonicContact CD2-OD2 3.67Å; H241-D289 IonicContact CE1-OD2 3.36Å; H241-D289 IonicContact NE2-OD1 3.68Å; H241-D289 IonicContact NE2-OD2 2.87Å; H241-D289 PolarHBondContact NE2-OD2 3.16Å
242Q96.3Very high94.3Very high38 Ų3841.4 Ų41.418%0.17821%0.205CC..  trans-67.8134.3179.978.2-64.5-30.200111.4F203 V239 I240 F246 V267 G269F203-Q242 HydrophobicContact CB-CB 3.89Å; F203-Q242 HydrophobicContact CG-CB 4.38Å; V239-Q242 HydrophobicContact CG1-CB 3.81Å; V239-Q242 HydrophobicContact CG1-CG 4.36Å; I240-Q242 PolarHBondContact O-N 3.34Å; I240-Q242 VanDerWaalsContact O-N 3.07Å; Q242-F246 HydrophobicContact CB-CB 3.7Å; Q242-F246 HydrophobicContact CB-CD1 4Å; Q242-F246 HydrophobicContact CB-CD2 4.04Å; Q242-F246 HydrophobicContact CB-CG 3.64Å; Q242-F246 HydrophobicContact CG-CB 3.78Å; Q242-F246 HydrophobicContact CG-CD1 3.58Å; Q242-F246 HydrophobicContact CG-CE1 4.3Å; Q242-F246 HydrophobicContact CG-CG 3.71Å; Q242-V267 HydrophobicContact CG-CG1 3.73Å; Q242-G269 VanDerWaalsContact OE1-CA 3.31Å
243P95.1Very high94.1Very high31 Ų3141.8 Ų41.820%0.20121%0.207CC..  trans-71.8164.5178.530.5-36.4000111.4F206 Y245 F246F206-P243 HydrophobicContact CB-CG 4.16Å; F206-P243 HydrophobicContact CD1-CG 3.68Å; F206-P243 HydrophobicContact CG-CG 4.39Å; P243-Y245 HydrophobicContact CB-CD1 3.87Å; P243-Y245 HydrophobicContact CB-CD2 4.34Å; P243-Y245 HydrophobicContact CB-CE1 3.48Å; P243-Y245 VanDerWaalsContact CB-CE1 3.48Å; P243-Y245 HydrophobicContact CB-CE2 4.02Å; P243-Y245 HydrophobicContact CB-CG 4.32Å; P243-Y245 HydrophobicContact CG-CD1 4.19Å; P243-Y245 HydrophobicContact CG-CD2 3.75Å; P243-Y245 HydrophobicContact CG-CE1 3.78Å; P243-Y245 HydrophobicContact CG-CE2 3.3Å; P243-Y245 HydrophobicContact CG-CG 4.21Å; P243-Y245 PolarHBondContact O-N 2.87Å; P243-F246 WeakPolarHBondContact O-CB 3.33Å; P243-F246 PolarHBondContact O-N 3.04Å
244W91.3Very high94Very high219 Ų21945 Ų4583%0.8322%0.222SC*.THydrogen-bonded Turntrans-53.1-31.7-176.567.1-95.4000114.1T247W244-T247 PolarHBondContact O-OG1 3Å
245Y89.7Confident93.9Very high36 Ų3649.4 Ų49.414%0.14125%0.251CS..THydrogen-bonded Turntrans-83.7-6.5-179.252.5-101.4000114.6F206 T207 M208 P243 T247 T248F206-Y245 HydrophobicContact CD1-CD2 4.21Å; F206-Y245 AromaticContact CD1-CE2 3.63Å; F206-Y245 HydrophobicContact CD1-CE2 3.63Å; F206-Y245 HydrophobicContact CE1-CD2 4.09Å; F206-Y245 AromaticContact CE1-CE2 3.85Å; F206-Y245 HydrophobicContact CE1-CE2 3.85Å; F206-Y245 HydrophobicContact CG-CE2 4.45Å; F206-Y245 PolarHBondContact O-OH 2.82Å; T207-Y245 WeakPolarHBondContact CA-OH 3.19Å; M208-Y245 HydrophobicContact CE-CD1 3.3Å; M208-Y245 HydrophobicContact CE-CD2 3.02Å; M208-Y245 HydrophobicContact CE-CE1 3.42Å; M208-Y245 VanDerWaalsContact CE-CE1 3.42Å; M208-Y245 HydrophobicContact CE-CE2 3.12Å; M208-Y245 HydrophobicContact CE-CG 3.06Å; P243-Y245 HydrophobicContact CB-CD1 3.87Å; P243-Y245 HydrophobicContact CB-CD2 4.34Å; P243-Y245 HydrophobicContact CB-CE1 3.48Å; P243-Y245 VanDerWaalsContact CB-CE1 3.48Å; P243-Y245 HydrophobicContact CB-CE2 4.02Å; P243-Y245 HydrophobicContact CB-CG 4.32Å; P243-Y245 HydrophobicContact CG-CD1 4.19Å; P243-Y245 HydrophobicContact CG-CD2 3.75Å; P243-Y245 HydrophobicContact CG-CE1 3.78Å; P243-Y245 HydrophobicContact CG-CE2 3.3Å; P243-Y245 HydrophobicContact CG-CG 4.21Å; P243-Y245 PolarHBondContact O-N 2.87Å; Y245-T247 PolarHBondContact O-N 3.03Å; Y245-T247 VanDerWaalsContact O-N 3.14Å; Y245-T248 WeakPolarHBondContact O-CB 3.46Å; Y245-T248 PolarHBondContact O-N 3.47Å
246F92.7Very high93.9Very high18 Ų1850.5 Ų50.58%0.07926%0.256CS..Hα-helixtrans-53.5-33.1172170.5-98.1000111.9F203 V239 Q242 P243 T248 T249 Y250 V267F203-F246 AromaticContact CD1-CD2 3.66Å; F203-F246 HydrophobicContact CD1-CD2 3.66Å; F203-F246 HydrophobicContact CD1-CE2 4.02Å; F203-F246 AromaticContact CE1-CD2 3.54Å; F203-F246 HydrophobicContact CE1-CD2 3.54Å; F203-F246 AromaticContact CE1-CE2 3.62Å; F203-F246 HydrophobicContact CE1-CE2 3.62Å; F203-F246 HydrophobicContact CE2-CE2 4.42Å; F203-F246 HydrophobicContact CG-CD2 4.46Å; F203-F246 HydrophobicContact CZ-CD2 4.24Å; F203-F246 AromaticContact CZ-CE2 3.84Å; F203-F246 HydrophobicContact CZ-CE2 3.84Å; V239-F246 HydrophobicContact CG1-CE1 4.48Å; V239-F246 HydrophobicContact CG1-CE2 4.13Å; V239-F246 HydrophobicContact CG1-CZ 4.02Å; V239-F246 HydrophobicContact CG2-CZ 4.11Å; Q242-F246 HydrophobicContact CB-CB 3.7Å; Q242-F246 HydrophobicContact CB-CD1 4Å; Q242-F246 HydrophobicContact CB-CD2 4.04Å; Q242-F246 HydrophobicContact CB-CG 3.64Å; Q242-F246 HydrophobicContact CG-CB 3.78Å; Q242-F246 HydrophobicContact CG-CD1 3.58Å; Q242-F246 HydrophobicContact CG-CE1 4.3Å; Q242-F246 HydrophobicContact CG-CG 3.71Å; P243-F246 WeakPolarHBondContact O-CB 3.33Å; P243-F246 PolarHBondContact O-N 3.04Å; F246-T248 PolarHBondContact O-N 2.95Å; F246-T248 VanDerWaalsContact O-N 3.13Å; F246-T249 WeakPolarHBondContact O-CB 3.43Å; F246-T249 PolarHBondContact O-N 3.35Å; F246-Y250 HydrophobicContact CE1-CD2 4.2Å; F246-Y250 HydrophobicContact CE1-CG 4.26Å; F246-Y250 HydrophobicContact CZ-CD2 4.26Å; F246-Y250 PolarHBondContact O-N 2.77Å; F246-V267 HydrophobicContact CE1-CG1 4.33Å; F246-V267 HydrophobicContact CE1-CG2 4.02Å
247T90.1Very high93.8Very high82 Ų8251.3 Ų51.350%0.50326%0.26SS..Hα-helixtrans-52.7-35.7176.2-51.10000112.4W244 Y245 N251W244-T247 PolarHBondContact O-OG1 3Å; Y245-T247 PolarHBondContact O-N 3.03Å; Y245-T247 VanDerWaalsContact O-N 3.14Å; T247-N251 WeakPolarHBondContact O-CB 3.18Å; T247-N251 PolarHBondContact O-N 2.77Å; T247-N251 PolarHBondContact O-ND2 2.99Å; T247-N251 VanDerWaalsContact O-ND2 3.16Å
248T88.6Confident93.7Very high94 Ų9455.6 Ų55.658%0.57728%0.277SS*.Hα-helixtrans-66-51.1176.1-57.80000110.7Y245 F246 Y250 N251 V252Y245-T248 WeakPolarHBondContact O-CB 3.46Å; Y245-T248 PolarHBondContact O-N 3.47Å; F246-T248 PolarHBondContact O-N 2.95Å; F246-T248 VanDerWaalsContact O-N 3.13Å; T248-Y250 VanDerWaalsContact C-N 3.34Å; T248-Y250 PolarHBondContact O-N 3.49Å; T248-N251 PolarHBondContact O-N 3.34Å; T248-V252 WeakPolarHBondContact O-CG2 3.46Å; T248-V252 PolarHBondContact O-N 2.83Å; T248-V252 VanDerWaalsContact O-N 3.12Å
249T89.6Confident93.5Very high25 Ų2558.6 Ų58.615%0.15330%0.303CS..Hα-helixtrans-57.8-47.1175.7-52.50000110.8L219 F246 N251 V252 V253L219-T249 HydrophobicContact CD1-CG2 4.23Å; F246-T249 WeakPolarHBondContact O-CB 3.43Å; F246-T249 PolarHBondContact O-N 3.35Å; T249-N251 VanDerWaalsContact C-N 3.33Å; T249-N251 PolarHBondContact O-N 3.04Å; T249-V252 WeakPolarHBondContact O-CB 3.44Å; T249-V252 PolarHBondContact O-N 2.93Å; T249-V252 VanDerWaalsContact O-N 3.09Å; T249-V253 WeakPolarHBondContact O-CG2 3.39Å; T249-V253 PolarHBondContact O-N 3.16Å
250Y91.9Very high93.2Very high50 Ų5063.6 Ų63.620%0.19632%0.324CS..Hα-helixtrans-57.6-43.2176.8-178-102.1000112.3F246 T248 V252 V253 K254 M257 V265F246-Y250 HydrophobicContact CE1-CD2 4.2Å; F246-Y250 HydrophobicContact CE1-CG 4.26Å; F246-Y250 HydrophobicContact CZ-CD2 4.26Å; F246-Y250 PolarHBondContact O-N 2.77Å; T248-Y250 VanDerWaalsContact C-N 3.34Å; T248-Y250 PolarHBondContact O-N 3.49Å; Y250-V252 VanDerWaalsContact C-N 3.28Å; Y250-V252 PolarHBondContact O-N 2.98Å; Y250-V253 PolarHBondContact O-N 3.28Å; Y250-V253 VanDerWaalsContact O-N 3.14Å; Y250-K254 HydrophobicContact CE1-CB 4.44Å; Y250-K254 HydrophobicContact CE1-CD 4.03Å; Y250-K254 HydrophobicContact CE1-CG 4.43Å; Y250-K254 VanDerWaalsContact O-CB 3.24Å; Y250-K254 WeakPolarHBondContact O-CB 3.4Å; Y250-K254 PolarHBondContact O-N 3.49Å; Y250-M257 HydrophobicContact CD2-CE 4.19Å; Y250-M257 HydrophobicContact CE2-CE 3.58Å; Y250-V265 HydrophobicContact CE2-CB 4.44Å; Y250-V265 HydrophobicContact CE2-CG1 3.96Å
251N93.2Very high92.9Very high85 Ų8564.2 Ų64.246%0.45533%0.327SS..Hα-helixtrans-67.3-26.1178.3-75.2-26.9000113.6T247 T248 T249 P255T247-N251 WeakPolarHBondContact O-CB 3.18Å; T247-N251 PolarHBondContact O-N 2.77Å; T247-N251 PolarHBondContact O-ND2 2.99Å; T247-N251 VanDerWaalsContact O-ND2 3.16Å; T248-N251 PolarHBondContact O-N 3.34Å; T249-N251 VanDerWaalsContact C-N 3.33Å; T249-N251 PolarHBondContact O-N 3.04Å; N251-P255 VanDerWaalsContact O-CD 3.26Å; N251-P255 WeakPolarHBondContact O-CD 3.31Å
252V91.6Very high92.8Very high57 Ų5765.9 Ų65.935%0.34534%0.336SS..Hα-helixtrans-70.5-38.3171.5171.70000110.9T216 T248 T249 Y250 P255 F256T216-V252 HydrophobicContact CG2-CG1 3.71Å; T248-V252 WeakPolarHBondContact O-CG2 3.46Å; T248-V252 PolarHBondContact O-N 2.83Å; T248-V252 VanDerWaalsContact O-N 3.12Å; T249-V252 WeakPolarHBondContact O-CB 3.44Å; T249-V252 PolarHBondContact O-N 2.93Å; T249-V252 VanDerWaalsContact O-N 3.09Å; Y250-V252 VanDerWaalsContact C-N 3.28Å; Y250-V252 PolarHBondContact O-N 2.98Å; V252-P255 WeakPolarHBondContact O-CD 3.5Å; V252-F256 VanDerWaalsContact O-CE2 3.22Å; V252-F256 WeakPolarHBondContact O-CE2 3.43Å
253V91.9Very high92.6Very high19 Ų1971.1 Ų71.112%0.11536%0.361CS..Hα-helixtrans-83.3-33.2-177-174.80000112.8L219 V223 T249 Y250 P255 F256 M257L219-V253 HydrophobicContact CB-CG2 3.64Å; L219-V253 HydrophobicContact CD1-CG2 3.53Å; L219-V253 HydrophobicContact CD2-CG2 4.08Å; L219-V253 HydrophobicContact CG-CG2 3.93Å; V223-V253 HydrophobicContact CG2-CG1 3.27Å; T249-V253 WeakPolarHBondContact O-CG2 3.39Å; T249-V253 PolarHBondContact O-N 3.16Å; Y250-V253 PolarHBondContact O-N 3.28Å; Y250-V253 VanDerWaalsContact O-N 3.14Å; V253-P255 VanDerWaalsContact C-N 3.33Å; V253-P255 VanDerWaalsContact O-N 3.16Å; V253-F256 WeakPolarHBondContact O-CB 3.46Å; V253-F256 WeakPolarHBondContact O-CD2 3.44Å; V253-F256 PolarHBondContact O-N 3.47Å; V253-M257 HydrophobicContact CG1-CE 4.23Å; V253-M257 HydrophobicContact CG1-CG 4.38Å
254K93.7Very high92.6Very high98 Ų9872.5 Ų72.543%0.42636%0.362SS..G310 helixtrans-47.6-42.7-176-176.9-179.8-176.4179.90114.8Y250 F256 M257 L262Y250-K254 HydrophobicContact CE1-CB 4.44Å; Y250-K254 HydrophobicContact CE1-CD 4.03Å; Y250-K254 HydrophobicContact CE1-CG 4.43Å; Y250-K254 VanDerWaalsContact O-CB 3.24Å; Y250-K254 WeakPolarHBondContact O-CB 3.4Å; Y250-K254 PolarHBondContact O-N 3.49Å; K254-F256 PolarHBondContact O-N 3.29Å; K254-M257 HydrophobicContact CB-CE 4.25Å; K254-M257 PolarHBondContact O-N 2.61Å; K254-M257 VanDerWaalsContact O-N 3.16Å; K254-L262 HydrophobicContact CG-CD2 3.78Å
255P96Very high92.8Very high103 Ų10363.4 Ų63.467%0.66933%0.33SS*.G310 helixtrans-62.8-23.3178.5-24.336000114.7N251 V252 V253N251-P255 VanDerWaalsContact O-CD 3.26Å; N251-P255 WeakPolarHBondContact O-CD 3.31Å; V252-P255 WeakPolarHBondContact O-CD 3.5Å; V253-P255 VanDerWaalsContact C-N 3.33Å; V253-P255 VanDerWaalsContact O-N 3.16Å
256F95Very high93.1Very high66 Ų6666.1 Ų66.129%0.28934%0.343SS..G310 helixtrans-84.4-18178.8-50.7-58.5000112.7T216 K220 V223 Q227 V252 V253 K254T216-F256 HydrophobicContact CG2-CE2 3.65Å; T216-F256 HydrophobicContact CG2-CZ 3.69Å; K220-F256 HydrophobicContact CB-CD2 4.26Å; K220-F256 HydrophobicContact CB-CE2 4.4Å; K220-F256 HydrophobicContact CB-CG 4.38Å; K220-F256 HydrophobicContact CD-CD1 4.21Å; K220-F256 HydrophobicContact CD-CE1 4.22Å; K220-F256 HydrophobicContact CG-CD1 4.13Å; K220-F256 HydrophobicContact CG-CE1 4.48Å; K220-F256 HydrophobicContact CG-CG 4.18Å; V223-F256 HydrophobicContact CB-CB 4.31Å; V223-F256 HydrophobicContact CG1-CB 3.96Å; V223-F256 WeakPolarHBondContact CG1-O 3.4Å; V223-F256 HydrophobicContact CG2-CB 4.41Å; Q227-F256 PolarHBondContact NE2-O 2.99Å; V252-F256 VanDerWaalsContact O-CE2 3.22Å; V252-F256 WeakPolarHBondContact O-CE2 3.43Å; V253-F256 WeakPolarHBondContact O-CB 3.46Å; V253-F256 WeakPolarHBondContact O-CD2 3.44Å; V253-F256 PolarHBondContact O-N 3.47Å; K254-F256 PolarHBondContact O-N 3.29Å
257M94.8Very high93.3Very high21 Ų2168.4 Ų68.410%0.10336%0.359CS..SBendtrans-84.5130.7-175.5-64.3-166.6-89.900112.1V223 Y250 V253 K254 L261 L262 V265V223-M257 HydrophobicContact CG1-CG 4.07Å; V223-M257 HydrophobicContact CG2-CG 3.99Å; Y250-M257 HydrophobicContact CD2-CE 4.19Å; Y250-M257 HydrophobicContact CE2-CE 3.58Å; V253-M257 HydrophobicContact CG1-CE 4.23Å; V253-M257 HydrophobicContact CG1-CG 4.38Å; K254-M257 HydrophobicContact CB-CE 4.25Å; K254-M257 PolarHBondContact O-N 2.61Å; K254-M257 VanDerWaalsContact O-N 3.16Å; M257-L261 HydrophobicContact CB-CB 4.45Å; M257-L261 HydrophobicContact CB-CD2 4.25Å; M257-L261 HydrophobicContact CB-CG 4.44Å; M257-L261 HydrophobicContact CG-CD2 3.86Å; M257-L261 HydrophobicContact CG-CG 4.29Å; M257-L261 HydrophobicContact SD-CD2 4.06Å; M257-L261 HydrophobicContact SD-CG 4.02Å; M257-L262 HydrophobicContact CB-CD2 3.8Å; M257-L262 HydrophobicContact CB-CG 3.79Å; M257-L262 HydrophobicContact CE-CD2 3.67Å; M257-L262 HydrophobicContact CG-CD2 4.49Å; M257-L262 HydrophobicContact SD-CD2 4.14Å; M257-V265 HydrophobicContact SD-CG2 4.06Å
258K94.8Very high93.5Very high103 Ų10366.3 Ų66.345%0.44834%0.343SS..  trans-69.1154.3169.5-66.4176.2-172.1-174.80110.3D228 K260 L261 L262D228-K258 IonicContact OD2-NZ 3.07Å; D228-K258 PolarHBondContact OD2-NZ 2.86Å; K258-K260 PolarHBondContact O-N 3.45Å; K258-K260 VanDerWaalsContact O-N 3.07Å; K258-L261 WeakPolarHBondContact O-CA 3.46Å; K258-L261 PolarHBondContact O-N 3.33Å; K258-L262 PolarHBondContact O-N 3.1Å
259A95Very high93.9Very high67 Ų6762.4 Ų62.455%0.55432%0.321SS*.Hα-helixtrans-47.9-43.4-179.900000113.1L261 L262 E263A259-L261 VanDerWaalsContact C-N 3.32Å; A259-L261 PolarHBondContact O-N 2.98Å; A259-L262 WeakPolarHBondContact O-CB 3.09Å; A259-L262 PolarHBondContact O-N 3.32Å; A259-E263 WeakPolarHBondContact O-CG 3.45Å; A259-E263 PolarHBondContact O-N 3.17Å
260K90.9Very high94.1Very high111 Ų11167.6 Ų67.648%0.48334%0.344SS..Hα-helixtrans-62.4-33.6178-173.3-179.9179.8-161.60114.1K258 R264K258-K260 PolarHBondContact O-N 3.45Å; K258-K260 VanDerWaalsContact O-N 3.07Å; K260-R264 VanDerWaalsContact CE-CZ 3.42Å; K260-R264 VanDerWaalsContact CE-NH1 3.32Å; K260-R264 WeakPolarHBondContact O-CD 3.48Å; K260-R264 WeakPolarHBondContact O-CG 3.34Å
261L91.9Very high94.2Very high12 Ų1273.3 Ų73.36%0.06337%0.372CS..Hα-helixtrans-78.4-39.8175.8-179.858.3000110.2V223 L226 Q227 V237 M257 K258 A259 E263 R264 V265V223-L261 HydrophobicContact CG1-CD2 4.21Å; L226-L261 HydrophobicContact CB-CD2 4.24Å; Q227-L261 HydrophobicContact CG-CD2 4.34Å; V237-L261 HydrophobicContact CG2-CD1 4.49Å; M257-L261 HydrophobicContact CB-CB 4.45Å; M257-L261 HydrophobicContact CB-CD2 4.25Å; M257-L261 HydrophobicContact CB-CG 4.44Å; M257-L261 HydrophobicContact CG-CD2 3.86Å; M257-L261 HydrophobicContact CG-CG 4.29Å; M257-L261 HydrophobicContact SD-CD2 4.06Å; M257-L261 HydrophobicContact SD-CG 4.02Å; K258-L261 WeakPolarHBondContact O-CA 3.46Å; K258-L261 PolarHBondContact O-N 3.33Å; A259-L261 VanDerWaalsContact C-N 3.32Å; A259-L261 PolarHBondContact O-N 2.98Å; L261-E263 VanDerWaalsContact C-N 3.32Å; L261-E263 PolarHBondContact O-N 2.71Å; L261-R264 CarbonylContact O-C 3.53Å; L261-R264 WeakPolarHBondContact O-CA 3.43Å; L261-R264 WeakPolarHBondContact O-CB 3.21Å; L261-R264 PolarHBondContact O-N 2.76Å; L261-V265 PolarHBondContact O-N 2.77Å
262L93.9Very high94.3Very high48 Ų4870 Ų7025%0.25135%0.354SS..Hα-helixtrans-56.1-44.5175-71.3169.2000112.6K254 M257 K258 A259 R264 V265K254-L262 HydrophobicContact CG-CD2 3.78Å; M257-L262 HydrophobicContact CB-CD2 3.8Å; M257-L262 HydrophobicContact CB-CG 3.79Å; M257-L262 HydrophobicContact CE-CD2 3.67Å; M257-L262 HydrophobicContact CG-CD2 4.49Å; M257-L262 HydrophobicContact SD-CD2 4.14Å; K258-L262 PolarHBondContact O-N 3.1Å; A259-L262 WeakPolarHBondContact O-CB 3.09Å; A259-L262 PolarHBondContact O-N 3.32Å; L262-R264 PolarHBondContact O-N 3.21Å; L262-R264 VanDerWaalsContact O-N 3.11Å; L262-V265 PolarHBondContact O-N 2.7Å
263E93.8Very high94.3Very high149 Ų14973.5 Ų73.570%0.69637%0.371SS*.THydrogen-bonded Turntrans-64.6-10.8175.8-71.6169.2-170.400113.9A259 L261A259-E263 WeakPolarHBondContact O-CG 3.45Å; A259-E263 PolarHBondContact O-N 3.17Å; L261-E263 VanDerWaalsContact C-N 3.32Å; L261-E263 PolarHBondContact O-N 2.71Å
264R95.3Very high94.1Very high60 Ų6074.2 Ų74.223%0.22638%0.382CS..THydrogen-bonded Turntrans-109.9-2.2-176-71.4175.9175.3-172.4-20.8113.3F234 K235 A236 V237 K260 L261 L262 F266F234-R264 VanDerWaalsContact O-CZ 3.22Å; F234-R264 PolarHBondContact O-NH1 3.27Å; K235-R264 WeakPolarHBondContact O-CD 3.45Å; K235-R264 WeakPolarHBondContact O-CG 3.3Å; A236-R264 CarbonylContact C-O 3.6Å; A236-R264 WeakPolarHBondContact CA-O 3.35Å; V237-R264 PolarHBondContact N-O 3.12Å; K260-R264 VanDerWaalsContact CE-CZ 3.42Å; K260-R264 VanDerWaalsContact CE-NH1 3.32Å; K260-R264 WeakPolarHBondContact O-CD 3.48Å; K260-R264 WeakPolarHBondContact O-CG 3.34Å; L261-R264 CarbonylContact O-C 3.53Å; L261-R264 WeakPolarHBondContact O-CA 3.43Å; L261-R264 WeakPolarHBondContact O-CB 3.21Å; L261-R264 PolarHBondContact O-N 2.76Å; L262-R264 PolarHBondContact O-N 3.21Å; L262-R264 VanDerWaalsContact O-N 3.11Å; R264-F266 VanDerWaalsContact O-CD2 3.28Å; R264-F266 WeakPolarHBondContact O-CD2 3Å; R264-F266 WeakPolarHBondContact O-CE2 3.43Å
265V95.4Very high94.1Very high27 Ų2769.6 Ų69.616%0.16436%0.362CS..EExtended strand (participates in β ladder)trans-89.7119.1172.3-177.50000108.3V237 Y250 M257 L261 L262 V267V237-V265 HydrophobicContact CB-CG2 4.42Å; V237-V265 WeakPolarHBondContact O-CA 3.44Å; Y250-V265 HydrophobicContact CE2-CB 4.44Å; Y250-V265 HydrophobicContact CE2-CG1 3.96Å; M257-V265 HydrophobicContact SD-CG2 4.06Å; L261-V265 PolarHBondContact O-N 2.77Å; L262-V265 PolarHBondContact O-N 2.7Å; V265-V267 HydrophobicContact CG1-CG2 4.16Å
266F95.6Very high94Very high94 Ų9468.2 Ų68.241%0.41235%0.346SS..EExtended strand (participates in β ladder)trans-114.9122.8177.6-58.6-84.4000108.4A236 V237 H238 V239 R264A236-F266 HydrophobicContact CB-CD2 3.95Å; A236-F266 HydrophobicContact CB-CE2 3.75Å; V237-F266 PolarHBondContact O-N 2.78Å; H238-F266 CarbonylContact C-O 3.54Å; H238-F266 WeakPolarHBondContact CA-O 3.41Å; H238-F266 AromaticContact CE1-CD2 3.65Å; H238-F266 AromaticContact ND1-CD2 3.9Å; H238-F266 AromaticContact ND1-CG 3.99Å; V239-F266 PolarHBondContact N-O 2.95Å; R264-F266 VanDerWaalsContact O-CD2 3.28Å; R264-F266 WeakPolarHBondContact O-CD2 3Å; R264-F266 WeakPolarHBondContact O-CE2 3.43Å
267V96.1Very high93.8Very high66 Ų6672 Ų7240%0.436%0.362SS..EExtended strand (participates in β ladder)trans-112.5114.3-178.6-178.30000107.5V239 Q242 F246 V265V239-V267 HydrophobicContact CB-CG2 4.38Å; Q242-V267 HydrophobicContact CG-CG1 3.73Å; F246-V267 HydrophobicContact CE1-CG1 4.33Å; F246-V267 HydrophobicContact CE1-CG2 4.02Å; V265-V267 HydrophobicContact CG1-CG2 4.16Å
268H95.6Very high93.6Very high38 Ų3873.9 Ų73.918%0.17637%0.371CS..EExtended strand (participates in β ladder)trans-98.7-28.4-170-56.9-82.1000113.3H238 V239 I240 L272H238-H268 AromaticContact CG-NE2 3.6Å; H238-H268 AromaticContact ND1-CE1 3.58Å; H238-H268 AromaticContact ND1-NE2 2.97Å; H238-H268 PolarHBondContact ND1-NE2 3.31Å; V239-H268 PolarHBondContact O-CD2 2.93Å; V239-H268 PolarHBondContact O-N 3.07Å; I240-H268 HydrophobicContact CG2-CB 4.28Å; H268-L272 HydrophobicContact CB-CD2 4.24Å
269G95.1Very high93.6Very high11 Ų1169.1 Ų69.111%0.11335%0.35CS..EExtended strand (participates in β ladder)trans67.4-136.5-170.900000111.8H241 Q242H241-G269 PolarHBondContact N-O 3.16Å; Q242-G269 VanDerWaalsContact OE1-CA 3.31Å
270E94.6Very high93.5Very high135 Ų13569 Ų6963%0.63134%0.34SS*.THydrogen-bonded Turntrans-92.7-16.1-180-58.4-60148.900113H241 L272H241-E270 IonicContact CE1-OE2 3.76Å; H241-E270 PolarHBondContact CE1-OE2 3.23Å; H241-E270 IonicContact CG-OE2 3.94Å; H241-E270 IonicContact ND1-OE1 3.51Å; H241-E270 IonicContact ND1-OE2 2.78Å; H241-E270 PolarHBondContact ND1-OE2 3.23Å; E270-L272 PolarHBondContact O-N 3.39Å
271E94Very high93.7Very high169 Ų16964.7 Ų64.779%0.7933%0.325SS*.  trans-88.891.7-178.8-68.4-175.6-178.600110.5D273E271-D273 PolarHBondContact O-N 3.34Å
272L94.9Very high93.9Very high17 Ų1768.6 Ų68.69%0.08935%0.346CS..THydrogen-bonded Turntrans-86.78.4-170.2-60.2-174.3000115.5I240 H268 E270 G274 Y275 F276 D289I240-L272 HydrophobicContact CB-CD2 4.06Å; I240-L272 HydrophobicContact CG2-CD2 3.76Å; H268-L272 HydrophobicContact CB-CD2 4.24Å; E270-L272 PolarHBondContact O-N 3.39Å; L272-G274 VanDerWaalsContact C-N 3.26Å; L272-G274 PolarHBondContact O-N 3.4Å; L272-Y275 HydrophobicContact CB-CD1 4.22Å; L272-Y275 HydrophobicContact CD1-CD1 4.35Å; L272-Y275 HydrophobicContact CD2-CD1 4.4Å; L272-Y275 HydrophobicContact CD2-CG 4.48Å; L272-Y275 WeakPolarHBondContact O-CA 3.48Å; L272-Y275 WeakPolarHBondContact O-CB 3.47Å; L272-Y275 PolarHBondContact O-N 2.97Å; L272-F276 HydrophobicContact CB-CD2 3.8Å; L272-F276 HydrophobicContact CB-CE2 3.51Å; L272-F276 HydrophobicContact CB-CZ 4.43Å; L272-F276 HydrophobicContact CD1-CE2 3.96Å; L272-F276 HydrophobicContact CD1-CZ 4.21Å; L272-F276 HydrophobicContact CG-CE2 4.42Å; L272-F276 WeakPolarHBondContact O-CD2 3.41Å; L272-F276 PolarHBondContact O-N 2.94Å; L272-D289 HydrophobicContact CD1-CB 3.63Å
273D92.9Very high93.9Very high130 Ų13067.3 Ų67.370%0.69534%0.339SS*.Hα-helixtrans-58.1-38.2178.5-75.4-13.4000112.5E271 K277E271-D273 PolarHBondContact O-N 3.34Å; D273-K277 VanDerWaalsContact O-CG 3.32Å; D273-K277 WeakPolarHBondContact O-CG 3.33Å; D273-K277 PolarHBondContact O-N 3.34Å
274G87.8Confident94.1Very high34 Ų3460.2 Ų60.235%0.35131%0.306SS..Hα-helixtrans-69.5-37.8175.100000112.6L272 K277L272-G274 VanDerWaalsContact C-N 3.26Å; L272-G274 PolarHBondContact O-N 3.4Å; G274-K277 PolarHBondContact O-N 3.14Å
275Y92.1Very high94.2Very high0 Ų057.6 Ų57.60%030%0.296CS..Hα-helixtrans-63.7-48.6176.8169.8-108.5000111.8I200 I240 L272 K277 E278 F279 L284 F288I200-Y275 HydrophobicContact CD1-CE2 3.95Å; I200-Y275 HydrophobicContact CG1-CE2 4.47Å; I200-Y275 HydrophobicContact CG2-CE2 3.9Å; I240-Y275 HydrophobicContact CG2-CD2 3.99Å; I240-Y275 HydrophobicContact CG2-CE2 4.19Å; I240-Y275 HydrophobicContact CG2-CG 4.25Å; L272-Y275 HydrophobicContact CB-CD1 4.22Å; L272-Y275 HydrophobicContact CD1-CD1 4.35Å; L272-Y275 HydrophobicContact CD2-CD1 4.4Å; L272-Y275 HydrophobicContact CD2-CG 4.48Å; L272-Y275 WeakPolarHBondContact O-CA 3.48Å; L272-Y275 WeakPolarHBondContact O-CB 3.47Å; L272-Y275 PolarHBondContact O-N 2.97Å; Y275-K277 PolarHBondContact O-N 2.97Å; Y275-E278 PolarHBondContact O-N 3.34Å; Y275-F279 AromaticContact CD2-CD2 3.56Å; Y275-F279 HydrophobicContact CD2-CD2 3.56Å; Y275-F279 AromaticContact CD2-CE2 3.88Å; Y275-F279 HydrophobicContact CD2-CE2 3.88Å; Y275-F279 AromaticContact CE2-CD2 3.47Å; Y275-F279 HydrophobicContact CE2-CD2 3.47Å; Y275-F279 VanDerWaalsContact CE2-CD2 3.47Å; Y275-F279 AromaticContact CE2-CE2 3.8Å; Y275-F279 HydrophobicContact CE2-CE2 3.8Å; Y275-F279 HydrophobicContact CE2-CG 4.29Å; Y275-F279 HydrophobicContact CG-CD2 4.39Å; Y275-F279 WeakPolarHBondContact O-CD2 3.42Å; Y275-F279 PolarHBondContact O-N 3.13Å; Y275-L284 HydrophobicContact CE1-CD1 3.61Å; Y275-L284 HydrophobicContact CE2-CD1 4.46Å; Y275-L284 VanDerWaalsContact CZ-CD1 3.48Å; Y275-L284 WeakPolarHBondContact OH-CD1 3.44Å; Y275-L284 WeakPolarHBondContact OH-CD2 3.45Å; Y275-F288 PolarHBondContact OH-O 2.91Å
276F94.4Very high94.2Very high74 Ų7459.5 Ų59.533%0.32531%0.311SS..Hα-helixtrans-73.2-10.7178.8-67.1-59.8000114.6L272 E278 F279 A281 L284 D289L272-F276 HydrophobicContact CB-CD2 3.8Å; L272-F276 HydrophobicContact CB-CE2 3.51Å; L272-F276 HydrophobicContact CB-CZ 4.43Å; L272-F276 HydrophobicContact CD1-CE2 3.96Å; L272-F276 HydrophobicContact CD1-CZ 4.21Å; L272-F276 HydrophobicContact CG-CE2 4.42Å; L272-F276 WeakPolarHBondContact O-CD2 3.41Å; L272-F276 PolarHBondContact O-N 2.94Å; F276-E278 VanDerWaalsContact C-N 3.33Å; F276-F279 VanDerWaalsContact O-O 3.1Å; F276-A281 HydrophobicContact CD1-CB 3.99Å; F276-A281 HydrophobicContact CE1-CB 3.98Å; F276-L284 HydrophobicContact CE1-CD1 4.25Å; F276-D289 WeakPolarHBondContact CE1-O 3.43Å; F276-D289 HydrophobicContact CZ-CB 3.85Å; F276-D289 WeakPolarHBondContact CZ-O 3.49Å
277K90.8Very high94.2Very high146 Ų14656.8 Ų56.864%0.63530%0.301SS*.Hα-helixtrans-72.1-30.3164.8-75.6170.2-170.71740111.7K152 D273 G274 Y275K152-K277 PolarHBondContact NZ-O 2.91Å; D273-K277 VanDerWaalsContact O-CG 3.32Å; D273-K277 WeakPolarHBondContact O-CG 3.33Å; D273-K277 PolarHBondContact O-N 3.34Å; G274-K277 PolarHBondContact O-N 3.14Å; Y275-K277 PolarHBondContact O-N 2.97Å
278E90.5Very high94.3Very high61 Ų6153.8 Ų53.829%0.28528%0.282SS..Hα-helixtrans-89.1-36-178.9-65.9-55143.700112.9K152 Y153 Y275 F276K152-E278 WeakPolarHBondContact CE-O 3.47Å; Y153-E278 VanDerWaalsContact CE2-OE2 3.28Å; Y153-E278 WeakPolarHBondContact CE2-OE2 3.38Å; Y153-E278 PolarHBondContact OH-OE2 3.35Å; Y275-E278 PolarHBondContact O-N 3.34Å; F276-E278 VanDerWaalsContact C-N 3.33Å
279F94.4Very high94.3Very high3 Ų354.8 Ų54.81%0.01329%0.289CS..SBendtrans-118.1138.4-176.2-58.7-80.5000112.4D151 V157 V198 I200 H238 Y275 F276 A281 L284D151-F279 HydrophobicContact CB-CD1 4.34Å; V157-F279 HydrophobicContact CG1-CE1 4.32Å; V157-F279 HydrophobicContact CG2-CE1 4.36Å; V198-F279 HydrophobicContact CG1-CE1 3.9Å; V198-F279 HydrophobicContact CG1-CZ 4.28Å; V198-F279 HydrophobicContact CG2-CE1 4.17Å; V198-F279 HydrophobicContact CG2-CZ 3.69Å; I200-F279 HydrophobicContact CD1-CD1 3.95Å; I200-F279 HydrophobicContact CD1-CD2 4.19Å; I200-F279 HydrophobicContact CD1-CE1 3.67Å; I200-F279 HydrophobicContact CD1-CE2 3.93Å; I200-F279 HydrophobicContact CD1-CG 4.19Å; I200-F279 HydrophobicContact CD1-CZ 3.65Å; I200-F279 HydrophobicContact CG1-CE1 4.18Å; I200-F279 HydrophobicContact CG1-CE2 4.18Å; I200-F279 HydrophobicContact CG1-CZ 3.78Å; H238-F279 HydrophobicContact CB-CE2 4.39Å; H238-F279 AromaticContact CD2-CE2 3.43Å; H238-F279 VanDerWaalsContact CD2-CE2 3.43Å; H238-F279 WeakPolarHBondContact CD2-CE2 3.35Å; H238-F279 AromaticContact CD2-CZ 3.39Å; H238-F279 WeakPolarHBondContact CD2-CZ 3.3Å; H238-F279 AromaticContact CG-CE2 3.75Å; H238-F279 AromaticContact NE2-CE2 3.63Å; H238-F279 AromaticContact NE2-CZ 3.66Å; Y275-F279 AromaticContact CD2-CD2 3.56Å; Y275-F279 HydrophobicContact CD2-CD2 3.56Å; Y275-F279 AromaticContact CD2-CE2 3.88Å; Y275-F279 HydrophobicContact CD2-CE2 3.88Å; Y275-F279 AromaticContact CE2-CD2 3.47Å; Y275-F279 HydrophobicContact CE2-CD2 3.47Å; Y275-F279 VanDerWaalsContact CE2-CD2 3.47Å; Y275-F279 AromaticContact CE2-CE2 3.8Å; Y275-F279 HydrophobicContact CE2-CE2 3.8Å; Y275-F279 HydrophobicContact CE2-CG 4.29Å; Y275-F279 HydrophobicContact CG-CD2 4.39Å; Y275-F279 WeakPolarHBondContact O-CD2 3.42Å; Y275-F279 PolarHBondContact O-N 3.13Å; F276-F279 VanDerWaalsContact O-O 3.1Å; F279-A281 PolarHBondContact O-N 2.86Å; F279-L284 HydrophobicContact CB-CD1 3.57Å; F279-L284 HydrophobicContact CB-CD2 4.5Å; F279-L284 HydrophobicContact CB-CG 4.21Å; F279-L284 HydrophobicContact CG-CD1 4.37Å
280D93.3Very high94.4Very high65 Ų6554.9 Ų54.935%0.34829%0.29SS..  trans-73.4121.3170.9-171-18.1000109.4V26 D282 I283V26-D280 HydrophobicContact CG1-CB 4.17Å; D280-D282 PolarHBondContact O-N 2.95Å; D280-D282 VanDerWaalsContact O-N 3.17Å; D280-D282 WeakPolarHBondContact OD1-CB 3.5Å; D280-D282 PolarHBondContact OD1-N 2.96Å; D280-I283 HydrophobicContact CB-CG1 4.28Å; D280-I283 WeakPolarHBondContact O-CG1 3.2Å; D280-I283 PolarHBondContact O-N 3.25Å
281A94.9Very high94.5Very high19 Ų1955.8 Ų55.816%0.15729%0.292CS..THydrogen-bonded Turntrans-60.3-25.2179.300000112.4F276 F279 I283 L284 G290 K291F276-A281 HydrophobicContact CD1-CB 3.99Å; F276-A281 HydrophobicContact CE1-CB 3.98Å; F279-A281 PolarHBondContact O-N 2.86Å; A281-I283 VanDerWaalsContact C-N 3.28Å; A281-I283 PolarHBondContact O-N 2.79Å; A281-L284 PolarHBondContact O-N 3.06Å; A281-G290 CarbonylContact O-C 3.42Å; A281-G290 WeakPolarHBondContact O-CA 3.32Å; A281-K291 HydrophobicContact CB-CD 4.28Å; A281-K291 HydrophobicContact CB-CG 4.46Å; A281-K291 PolarHBondContact O-N 3.01Å
282D95.8Very high94.6Very high95 Ų9548.8 Ų48.851%0.50826%0.264SS..THydrogen-bonded Turntrans-71.5-21.7-179-66.4-8.7000112.6D280 K291D280-D282 PolarHBondContact O-N 2.95Å; D280-D282 VanDerWaalsContact O-N 3.17Å; D280-D282 WeakPolarHBondContact OD1-CB 3.5Å; D280-D282 PolarHBondContact OD1-N 2.96Å; D282-K291 WeakPolarHBondContact OD1-CD 3.35Å; D282-K291 IonicContact OD1-NZ 3.44Å; D282-K291 PolarHBondContact OD1-NZ 2.8Å
283I95.5Very high94.7Very high21 Ų2153.2 Ų53.211%0.10829%0.293CS..THydrogen-bonded Turntrans-94-19.4175.868.7164.8000113.1V26 L147 R150 D151 D280 A281V26-I283 HydrophobicContact CB-CG2 4.18Å; V26-I283 HydrophobicContact CG1-CD1 4.01Å; V26-I283 HydrophobicContact CG1-CG2 3.92Å; V26-I283 HydrophobicContact CG2-CG2 3.98Å; L147-I283 WeakPolarHBondContact CD1-O 3.4Å; L147-I283 HydrophobicContact CD2-CB 4.33Å; L147-I283 HydrophobicContact CD2-CD1 3.82Å; L147-I283 HydrophobicContact CD2-CG1 4.08Å; R150-I283 WeakPolarHBondContact O-CD1 3.17Å; D151-I283 HydrophobicContact CB-CD1 4.45Å; D280-I283 HydrophobicContact CB-CG1 4.28Å; D280-I283 WeakPolarHBondContact O-CG1 3.2Å; D280-I283 PolarHBondContact O-N 3.25Å; A281-I283 VanDerWaalsContact C-N 3.28Å; A281-I283 PolarHBondContact O-N 2.79Å
284L97.6Very high94.7Very high0 Ų050.7 Ų50.70%028%0.282CS..SBendtrans-81.4137.3-175.6-72.6169.5000110.9I200 Y275 F276 F279 A281 G290 K291 A292I200-L284 HydrophobicContact CD1-CD2 3.7Å; Y275-L284 HydrophobicContact CE1-CD1 3.61Å; Y275-L284 HydrophobicContact CE2-CD1 4.46Å; Y275-L284 VanDerWaalsContact CZ-CD1 3.48Å; Y275-L284 WeakPolarHBondContact OH-CD1 3.44Å; Y275-L284 WeakPolarHBondContact OH-CD2 3.45Å; F276-L284 HydrophobicContact CE1-CD1 4.25Å; F279-L284 HydrophobicContact CB-CD1 3.57Å; F279-L284 HydrophobicContact CB-CD2 4.5Å; F279-L284 HydrophobicContact CB-CG 4.21Å; F279-L284 HydrophobicContact CG-CD1 4.37Å; A281-L284 PolarHBondContact O-N 3.06Å; L284-G290 CarbonylContact O-C 3.59Å; L284-G290 VanDerWaalsContact O-CA 3.25Å; L284-G290 WeakPolarHBondContact O-CA 3.41Å; L284-K291 PolarHBondContact O-N 3.13Å; L284-A292 WeakPolarHBondContact O-CB 3.19Å; L284-A292 PolarHBondContact O-N 3.03Å
285P97.1Very high95Very high4 Ų450 Ų503%0.02627%0.273CS..BIsolated β-bridgetrans-62.7155.2171.8-24.637.2000112.6L147 L159 D287 F288 D289 G290 A292 A295L147-P285 HydrophobicContact CD1-CG 4.07Å; L159-P285 HydrophobicContact CD1-CG 3.83Å; P285-D287 WeakPolarHBondContact CB-OD1 3.48Å; P285-D287 PolarHBondContact O-N 3.36Å; P285-F288 HydrophobicContact CB-CD2 4.28Å; P285-F288 HydrophobicContact CG-CD2 4.44Å; P285-F288 CarbonylContact O-C 3.49Å; P285-F288 WeakPolarHBondContact O-CA 3.46Å; P285-F288 PolarHBondContact O-N 3.45Å; P285-D289 PolarHBondContact O-N 3Å; P285-G290 PolarHBondContact O-N 2.94Å; P285-A292 CarbonylContact C-O 3.25Å; P285-A292 WeakPolarHBondContact CA-O 3.34Å; P285-A295 HydrophobicContact CG-CB 4.4Å
286S96.2Very high95.1Very high68 Ų6854.3 Ų54.348%0.47630%0.296SS..G310 helixtrans-63.8-25.4-179.556.40000114.1F288 D289 A292 V294S286-F288 PolarHBondContact O-N 3.36Å; S286-D289 PolarHBondContact O-N 2.88Å; S286-A292 PolarHBondContact N-O 3.34Å; S286-V294 WeakPolarHBondContact OG-CG2 3.48Å
287D94.8Very high95.1Very high36 Ų3653.4 Ų53.419%0.19329%0.291CS..G310 helixtrans-80.33.3172.661.7-44.6000113.4N202 P285 V294N202-D287 PolarHBondContact ND2-O 2.87Å; P285-D287 WeakPolarHBondContact CB-OD1 3.48Å; P285-D287 PolarHBondContact O-N 3.36Å; D287-V294 HydrophobicContact CB-CG2 4.46Å
288F97.1Very high95.2Very high3 Ų351.5 Ų51.51%0.01329%0.285CS..G310 helixtrans-127.430.7168.9-69.2-96000111.1L159 N161 I200 N202 I240 Y275 P285 S286 G290L159-F288 HydrophobicContact CB-CD1 4.45Å; L159-F288 HydrophobicContact CB-CE1 3.79Å; L159-F288 HydrophobicContact CB-CE2 3.93Å; L159-F288 HydrophobicContact CB-CZ 3.51Å; L159-F288 HydrophobicContact CD1-CD2 4.01Å; L159-F288 HydrophobicContact CD1-CE2 4.04Å; L159-F288 HydrophobicContact CD1-CG 4.37Å; L159-F288 HydrophobicContact CD1-CZ 4.41Å; L159-F288 HydrophobicContact CD2-CD1 4.21Å; L159-F288 HydrophobicContact CD2-CE1 4.3Å; L159-F288 HydrophobicContact CD2-CG 4.49Å; L159-F288 HydrophobicContact CG-CZ 4.42Å; N161-F288 HydrophobicContact CB-CE2 4.12Å; N161-F288 HydrophobicContact CB-CZ 3.7Å; I200-F288 HydrophobicContact CG2-CD1 3.89Å; I200-F288 HydrophobicContact CG2-CE1 4.35Å; N202-F288 HydrophobicContact CB-CD1 3.87Å; N202-F288 HydrophobicContact CB-CE1 3.59Å; N202-F288 HydrophobicContact CB-CZ 4.25Å; I240-F288 HydrophobicContact CD1-CD1 4.4Å; Y275-F288 PolarHBondContact OH-O 2.91Å; P285-F288 HydrophobicContact CB-CD2 4.28Å; P285-F288 HydrophobicContact CG-CD2 4.44Å; P285-F288 CarbonylContact O-C 3.49Å; P285-F288 WeakPolarHBondContact O-CA 3.46Å; P285-F288 PolarHBondContact O-N 3.45Å; S286-F288 PolarHBondContact O-N 3.36Å; F288-G290 PolarHBondContact O-N 3.14Å; F288-G290 VanDerWaalsContact O-N 3.14Å
289D96.6Very high95.4Very high59 Ų5950.8 Ų50.832%0.31629%0.286SS..THydrogen-bonded Turntrans63.216.6175.9-56.5-93.1000115H241 L272 F276 P285 S286H241-D289 IonicContact CD2-OD2 3.67Å; H241-D289 IonicContact CE1-OD2 3.36Å; H241-D289 IonicContact NE2-OD1 3.68Å; H241-D289 IonicContact NE2-OD2 2.87Å; H241-D289 PolarHBondContact NE2-OD2 3.16Å; L272-D289 HydrophobicContact CD1-CB 3.63Å; F276-D289 WeakPolarHBondContact CE1-O 3.43Å; F276-D289 HydrophobicContact CZ-CB 3.85Å; F276-D289 WeakPolarHBondContact CZ-O 3.49Å; P285-D289 PolarHBondContact O-N 3Å; S286-D289 PolarHBondContact O-N 2.88Å
290G96.8Very high95.4Very high14 Ų1450.9 Ų50.914%0.14429%0.287CS..SBendtrans-87.6-169.4173.200000114.1A281 L284 P285 F288A281-G290 CarbonylContact O-C 3.42Å; A281-G290 WeakPolarHBondContact O-CA 3.32Å; L284-G290 CarbonylContact O-C 3.59Å; L284-G290 VanDerWaalsContact O-CA 3.25Å; L284-G290 WeakPolarHBondContact O-CA 3.41Å; P285-G290 PolarHBondContact O-N 2.94Å; F288-G290 PolarHBondContact O-N 3.14Å; F288-G290 VanDerWaalsContact O-N 3.14Å
291K97.1Very high95.4Very high153 Ų15347.8 Ų47.867%0.66527%0.27SS*.SBendtrans-111.4-10.8-179.3-63.1163.1-178.3172.50113.1A281 D282 L284A281-K291 HydrophobicContact CB-CD 4.28Å; A281-K291 HydrophobicContact CB-CG 4.46Å; A281-K291 PolarHBondContact O-N 3.01Å; D282-K291 WeakPolarHBondContact OD1-CD 3.35Å; D282-K291 IonicContact OD1-NZ 3.44Å; D282-K291 PolarHBondContact OD1-NZ 2.8Å; L284-K291 PolarHBondContact O-N 3.13Å
292A96.3Very high95.3Very high23 Ų2349.7 Ų49.719%0.1928%0.28CS..BIsolated β-bridgetrans-71.5153.717400000109.7L284 P285 S286L284-A292 WeakPolarHBondContact O-CB 3.19Å; L284-A292 PolarHBondContact O-N 3.03Å; P285-A292 CarbonylContact C-O 3.25Å; P285-A292 WeakPolarHBondContact CA-O 3.34Å; S286-A292 PolarHBondContact N-O 3.34Å
293P95.9Very high95.1Very high110 Ų11049.6 Ų49.671%0.71428%0.277SS*.PPolyproline II helixtrans-56.7157.9169.5-22.433.7000111.7A295P293-A295 PolarHBondContact O-N 3.2Å
294V94.3Very high94.7Very high76 Ų7649.5 Ų49.546%0.46128%0.276SS..PPolyproline II helixtrans-50.2136.2165.9179.60000108.7S286 D287S286-V294 WeakPolarHBondContact OG-CG2 3.48Å; D287-V294 HydrophobicContact CB-CG2 4.46Å
295A93.1Very high94.1Very high19 Ų1951.5 Ų51.516%0.15729%0.285CS..PPolyproline II helixtrans-64.7142.5-174.100000111.5V145 P285 P293 Y297 I300V145-A295 HydrophobicContact CG1-CB 3.82Å; P285-A295 HydrophobicContact CG-CB 4.4Å; P293-A295 PolarHBondContact O-N 3.2Å; A295-Y297 HydrophobicContact CB-CD1 4.15Å; A295-Y297 HydrophobicContact CB-CE1 3.96Å; A295-Y297 VanDerWaalsContact O-CD1 3.23Å; A295-Y297 WeakPolarHBondContact O-CD1 3.24Å; A295-Y297 VanDerWaalsContact O-CE1 3.28Å; A295-Y297 WeakPolarHBondContact O-CE1 3.41Å; A295-Y297 PolarHBondContact O-N 3.14Å; A295-I300 HydrophobicContact CB-CD1 3.86Å
296D94.5Very high93.4Very high92 Ų9252.5 Ų52.549%0.49230%0.296SS..  trans-82.296.9173.4-178.8-21.5000108.9Q298 S299 I300D296-Q298 VanDerWaalsContact C-N 3.31Å; D296-Q298 PolarHBondContact O-N 3.37Å; D296-Q298 PolarHBondContact OD1-N 2.81Å; D296-Q298 PolarHBondContact OD1-OE1 2.69Å; D296-S299 PolarHBondContact O-N 3.09Å; D296-S299 WeakPolarHBondContact OD1-CB 3.49Å; D296-S299 PolarHBondContact OD1-N 3.44Å; D296-S299 WeakPolarHBondContact OD2-CB 3.22Å; D296-I300 WeakPolarHBondContact O-CG1 3.32Å; D296-I300 PolarHBondContact O-N 3.14Å
297Y94.6Very high92.2Very high54 Ų5451.8 Ų51.821%0.21229%0.291CS..Hα-helixtrans-64.3-36.2-173.9-53.6-25.6000112.1E140 V145 A295 I300 A301E140-Y297 WeakPolarHBondContact O-CB 3.42Å; V145-Y297 HydrophobicContact CG1-CD1 4.28Å; V145-Y297 HydrophobicContact CG1-CE1 4.29Å; V145-Y297 HydrophobicContact CG2-CD1 3.89Å; V145-Y297 HydrophobicContact CG2-CE1 3.56Å; A295-Y297 HydrophobicContact CB-CD1 4.15Å; A295-Y297 HydrophobicContact CB-CE1 3.96Å; A295-Y297 VanDerWaalsContact O-CD1 3.23Å; A295-Y297 WeakPolarHBondContact O-CD1 3.24Å; A295-Y297 VanDerWaalsContact O-CE1 3.28Å; A295-Y297 WeakPolarHBondContact O-CE1 3.41Å; A295-Y297 PolarHBondContact O-N 3.14Å; Y297-I300 PolarHBondContact O-N 3.12Å; Y297-A301 WeakPolarHBondContact O-CB 3.26Å; Y297-A301 PolarHBondContact O-N 3.43Å
298Q93.7Very high90.5Very high107 Ų10756.2 Ų56.250%0.531%0.311SS..Hα-helixtrans-67.2-42.1177.6-66.177.95.300111.2D296 I300 A301 T302D296-Q298 VanDerWaalsContact C-N 3.31Å; D296-Q298 PolarHBondContact O-N 3.37Å; D296-Q298 PolarHBondContact OD1-N 2.81Å; D296-Q298 PolarHBondContact OD1-OE1 2.69Å; Q298-I300 VanDerWaalsContact C-N 3.35Å; Q298-A301 PolarHBondContact O-N 3.1Å; Q298-T302 WeakPolarHBondContact O-CB 3.43Å; Q298-T302 PolarHBondContact O-N 3.18Å; Q298-T302 PolarHBondContact O-OG1 3.29Å
299S93.9Very high88.2Confident46 Ų4663.2 Ų63.232%0.32235%0.348SS..Hα-helixtrans-63.2-41.5173.7-173.50000111.6D296 T302 Q303D296-S299 PolarHBondContact O-N 3.09Å; D296-S299 WeakPolarHBondContact OD1-CB 3.49Å; D296-S299 PolarHBondContact OD1-N 3.44Å; D296-S299 WeakPolarHBondContact OD2-CB 3.22Å; S299-T302 PolarHBondContact O-N 3.12Å; S299-Q303 WeakPolarHBondContact O-CG 3.36Å; S299-Q303 PolarHBondContact O-N 3.34Å; S299-Q303 PolarHBondContact OG-NE2 3.3Å
300I93.8Very high85.5Confident4 Ų465.6 Ų65.62%0.02137%0.365CS..Hα-helixtrans-63.5-47176.4-71.6165000111.3F33 V145 V146 P148 A295 D296 Y297 Q298 T302 Q303 L304F33-I300 HydrophobicContact CE1-CG2 4.49Å; F33-I300 HydrophobicContact CZ-CG2 4.16Å; V145-I300 HydrophobicContact CG1-CD1 3.54Å; V146-I300 HydrophobicContact CB-CG2 4.17Å; V146-I300 VanDerWaalsContact O-CD1 3.31Å; V146-I300 WeakPolarHBondContact O-CD1 3.19Å; P148-I300 HydrophobicContact CG-CG1 4.41Å; A295-I300 HydrophobicContact CB-CD1 3.86Å; D296-I300 WeakPolarHBondContact O-CG1 3.32Å; D296-I300 PolarHBondContact O-N 3.14Å; Y297-I300 PolarHBondContact O-N 3.12Å; Q298-I300 VanDerWaalsContact C-N 3.35Å; I300-T302 VanDerWaalsContact C-N 3.26Å; I300-T302 PolarHBondContact O-N 3.43Å; I300-Q303 PolarHBondContact O-N 3.38Å; I300-Q303 VanDerWaalsContact O-N 3.14Å; I300-L304 HydrophobicContact CG2-CD1 3.95Å; I300-L304 WeakPolarHBondContact O-CG 3.32Å; I300-L304 PolarHBondContact O-N 3.46Å
301A93.1Very high82.4Confident0 Ų068.5 Ų68.50%039%0.388CS..Hα-helixtrans-58.2-41.9175.700000111.3I139 E140 Y297 Q298 Q303 L304 F305I139-A301 HydrophobicContact CG2-CB 4.08Å; E140-A301 HydrophobicContact CG-CB 3.45Å; E140-A301 VanDerWaalsContact CG-CB 3.45Å; Y297-A301 WeakPolarHBondContact O-CB 3.26Å; Y297-A301 PolarHBondContact O-N 3.43Å; Q298-A301 PolarHBondContact O-N 3.1Å; A301-Q303 PolarHBondContact O-N 2.99Å; A301-L304 PolarHBondContact O-N 3.25Å; A301-F305 WeakPolarHBondContact O-CD2 3.5Å; A301-F305 PolarHBondContact O-N 3.16Å
302T92.6Very high79.2Confident59 Ų5972.5 Ų72.536%0.36242%0.415SS..Hα-helixtrans-64.3-38.4176-58.70000112.3Q298 S299 I300 L304 G306Q298-T302 WeakPolarHBondContact O-CB 3.43Å; Q298-T302 PolarHBondContact O-N 3.18Å; Q298-T302 PolarHBondContact O-OG1 3.29Å; S299-T302 PolarHBondContact O-N 3.12Å; I300-T302 VanDerWaalsContact C-N 3.26Å; I300-T302 PolarHBondContact O-N 3.43Å; T302-L304 VanDerWaalsContact C-N 3.33Å; T302-G306 CarbonylContact O-C 3.52Å; T302-G306 WeakPolarHBondContact O-CA 3.49Å; T302-G306 PolarHBondContact O-N 3.02Å
303Q91.8Very high78.4Confident94 Ų9475 Ų7544%0.43943%0.426SS..Hα-helixtrans-70.1-29.3175.8-71.3178.943.800112.8F33 S299 I300 A301F33-Q303 HydrophobicContact CB-CB 4.36Å; F33-Q303 HydrophobicContact CD1-CB 4.21Å; F33-Q303 HydrophobicContact CD2-CB 3.98Å; F33-Q303 HydrophobicContact CE2-CB 4.26Å; F33-Q303 HydrophobicContact CG-CB 3.93Å; S299-Q303 WeakPolarHBondContact O-CG 3.36Å; S299-Q303 PolarHBondContact O-N 3.34Å; S299-Q303 PolarHBondContact OG-NE2 3.3Å; I300-Q303 PolarHBondContact O-N 3.38Å; I300-Q303 VanDerWaalsContact O-N 3.14Å; A301-Q303 PolarHBondContact O-N 2.99Å
304L88.9Confident77.5Confident18 Ų1873.1 Ų73.19%0.09441%0.411CS..Hα-helixtrans-78-39.3177.1-75.9166.2000113.2F33 I139 V146 I182 L186 I300 A301 T302F33-L304 HydrophobicContact CD1-CD2 3.78Å; F33-L304 HydrophobicContact CD1-CG 4.04Å; F33-L304 HydrophobicContact CE1-CD1 4.42Å; F33-L304 HydrophobicContact CE1-CD2 3.68Å; F33-L304 HydrophobicContact CE1-CG 3.71Å; I139-L304 HydrophobicContact CD1-CD1 4.5Å; I139-L304 HydrophobicContact CG2-CD1 4.14Å; V146-L304 HydrophobicContact CG2-CD1 4.11Å; I182-L304 HydrophobicContact CG1-CD1 4.08Å; L186-L304 HydrophobicContact CD2-CD2 4.01Å; L186-L304 HydrophobicContact CG-CD2 4.35Å; I300-L304 HydrophobicContact CG2-CD1 3.95Å; I300-L304 WeakPolarHBondContact O-CG 3.32Å; I300-L304 PolarHBondContact O-N 3.46Å; A301-L304 PolarHBondContact O-N 3.25Å; T302-L304 VanDerWaalsContact C-N 3.33Å
305F84.9Confident76.5Confident42 Ų4272.9 Ų72.918%0.18441%0.408CS..Hα-helixtrans-123.5-10.6-167.5-52.8-54.9000115.2P132 V135 I139 V181 K185 A301P132-F305 HydrophobicContact CB-CB 4.39Å; P132-F305 HydrophobicContact CB-CD1 3.66Å; P132-F305 HydrophobicContact CB-CE1 4.14Å; P132-F305 HydrophobicContact CB-CG 4.07Å; P132-F305 HydrophobicContact CG-CD1 4.43Å; V135-F305 HydrophobicContact CG2-CE2 4.45Å; V135-F305 HydrophobicContact CG2-CZ 3.99Å; I139-F305 HydrophobicContact CD1-CE2 3.44Å; I139-F305 VanDerWaalsContact CD1-CE2 3.44Å; I139-F305 HydrophobicContact CD1-CZ 3.51Å; V181-F305 HydrophobicContact CG1-CE1 3.45Å; V181-F305 VanDerWaalsContact CG1-CE1 3.45Å; V181-F305 HydrophobicContact CG1-CZ 3.72Å; K185-F305 HydrophobicContact CG-CE1 4.4Å; A301-F305 WeakPolarHBondContact O-CD2 3.5Å; A301-F305 PolarHBondContact O-N 3.16Å
306G81.9Confident75.6Confident26 Ų2676.1 Ų76.127%0.26842%0.423SS..  trans86.2176.1-168.500000113R136 T302R136-G306 PolarHBondContact NH1-O 3.4Å; R136-G306 PolarHBondContact NH2-O 3.1Å; T302-G306 CarbonylContact O-C 3.52Å; T302-G306 WeakPolarHBondContact O-CA 3.49Å; T302-G306 PolarHBondContact O-N 3.02Å
307S70Confident74.4Confident52 Ų5275.1 Ų75.136%0.36442%0.419SS..  trans-67.7148.6173.246.70000111.3D309 T310S307-D309 PolarHBondContact O-N 3.28Å; S307-T310 PolarHBondContact O-N 2.99Å; S307-T310 PolarHBondContact O-OG1 2.81Å; S307-T310 PolarHBondContact OG-OG1 2.92Å
308E60.4Low73Confident130 Ų13076.5 Ų76.561%0.60743%0.433SS*.G310 helixtrans-58.3-32.9172.9-65.5-169.4142.900112R136 T310 A311R136-E308 IonicContact NE-OE1 3.25Å; E308-T310 PolarHBondContact O-N 3.14Å; E308-T310 VanDerWaalsContact O-N 3.13Å; E308-A311 PolarHBondContact O-N 2.99Å
309D47.8Very low71.5Confident150 Ų15074.4 Ų74.480%0.80243%0.428SS*.G310 helixtrans-69-8.3-178-69-31000115.3S307 A311S307-D309 PolarHBondContact O-N 3.28Å; D309-A311 VanDerWaalsContact C-N 3.31Å
310T40.9Very low69.8Low108 Ų10876.5 Ų76.566%0.66344%0.436SS*.G310 helixtrans-88.54.8176.933.70000113.9S307 E308S307-T310 PolarHBondContact O-N 2.99Å; S307-T310 PolarHBondContact O-OG1 2.81Å; S307-T310 PolarHBondContact OG-OG1 2.92Å; E308-T310 PolarHBondContact O-N 3.14Å; E308-T310 VanDerWaalsContact O-N 3.13Å
311A31.8Very low67.8Low76 Ų7682.6 Ų82.663%0.62847%0.471SS*.  trans-103.239.5-179.600000114.1E308 D309E308-A311 PolarHBondContact O-N 2.99Å; D309-A311 VanDerWaalsContact C-N 3.31Å
312L29.9Very low65.5Low236 Ų23690.1 Ų90.1100%1.23651%0.513SS*.  trans-119.40167.8-80.6169.2000111.8

Retrieved 312 of 312 residues in 590.6 ms (Link to these results)

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