A0A075B6T9_HUMAN Loading...

Zinc finger protein 268

AlphaFold DB , UniProt , Accession A0A075B6T9, Species HUMAN (Homo sapiens, Human), Gene ZNF268, Length 193 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
1M40.5Very low48.3Very low245 Ų245160.3 Ų160.3100%1.20784%0.843SS**  01030-66.7171.3-174.500107.1
2A41.7Very low48.1Very low102 Ų102156.2 Ų156.284%0.84383%0.828SS**  trans-102.5109.5-176.900000109.1R4A2-R4 PolarHBondContact O-N 2.99Å
3T47.2Very low47.1Very low135 Ų135150.8 Ų150.883%0.82881%0.808SS**  trans-79.8110.1178.1-31.90000108.4V5T3-V5 PolarHBondContact O-N 2.97Å
4R51.4Low46.6Very low226 Ų226147.6 Ų147.685%0.85380%0.8SS**  trans-73.1106.9171-70.517678.9162.74.1108.3A2 R6A2-R4 PolarHBondContact O-N 2.99Å; R4-R6 PolarHBondContact O-N 3.28Å
5V53.5Low46Very low130 Ų130149.1 Ų149.179%0.78881%0.806SS**  trans-72.1112.4166.5177.30000107.7T3 T7T3-V5 PolarHBondContact O-N 2.97Å; V5-T7 PolarHBondContact O-N 3.33Å
6R49.1Very low46.1Very low233 Ų233151.1 Ų151.188%0.87981%0.808SS**  trans-82.398.6168.5-75.5-172.7165.9146.2-2.4108.1R4 A8R4-R6 PolarHBondContact O-N 3.28Å; R6-A8 PolarHBondContact O-N 2.94Å
7T56.2Low45.9Very low118 Ų118151.7 Ų151.772%0.72481%0.805SS**  trans-79.5109.6162.6163.10000107.7V5 S9V5-T7 PolarHBondContact O-N 3.33Å; T7-S9 PolarHBondContact O-N 3.09Å
8A43.1Very low45.6Very low91 Ų91156.2 Ų156.275%0.75281%0.809SS**  trans-77.7107.3167.900000107.7R6 I10R6-A8 PolarHBondContact O-N 2.94Å; A8-I10 PolarHBondContact O-N 3.49Å
9S50.1Low45.9Very low112 Ų112155.3 Ų155.378%0.78381%0.805SS**  trans-66.1120.3167.4-59.30000108.3T7 W11T7-S9 PolarHBondContact O-N 3.09Å; S9-W11 PolarHBondContact O-N 3.29Å
10I51.8Low46Very low153 Ų153150.4 Ų150.479%0.78579%0.785SS**  trans-62.5115.9169.6-93.5142.6000108.1A8 V12A8-I10 PolarHBondContact O-N 3.49Å; I10-V12 HydrophobicContact CG2-CG2 3.9Å; I10-V12 PolarHBondContact O-N 3.29Å
11W46.6Very low46.1Very low218 Ų218147 Ų14783%0.82677%0.774SS**  trans-75.3105.8170.7-179.8-83.6000108.1S9S9-W11 PolarHBondContact O-N 3.29Å
12V46.8Very low46.2Very low111 Ų111143.4 Ų143.467%0.67375%0.747SS**  trans-87114.6164.4-177.40000106.1I10I10-V12 HydrophobicContact CG2-CG2 3.9Å; I10-V12 PolarHBondContact O-N 3.29Å
13P35.1Very low46.5Very low86 Ų86141.3 Ų141.356%0.55872%0.722SS**  trans-61.3138.2175.524.4-29.6000108.7L15P13-L15 PolarHBondContact O-N 3.1Å; P13-L15 VanDerWaalsContact O-N 3.16Å
14P39.4Very low46.6Very low107 Ų107144.2 Ų144.270%0.69572%0.718SS**  trans-54.7127.4174.421.9-29.9000107.6Q16P14-Q16 PolarHBondContact O-N 3.04Å
15L38.3Very low46.3Very low170 Ų170136.9 Ų136.989%0.8969%0.694SS**  trans-48.4105176.4-110135.1000107.4P13 E17P13-L15 PolarHBondContact O-N 3.1Å; P13-L15 VanDerWaalsContact O-N 3.16Å; L15-E17 VanDerWaalsContact C-N 3.33Å; L15-E17 PolarHBondContact O-N 3.48Å
16Q46.4Very low45.9Very low180 Ų180138.9 Ų138.984%0.84169%0.688SS**  trans-68.2101.4179-174.2144.34.200106.1P14 R18P14-Q16 PolarHBondContact O-N 3.04Å; Q16-R18 VanDerWaalsContact C-N 3.31Å; Q16-R18 PolarHBondContact O-N 3.09Å
17E43.2Very low45.9Very low162 Ų162135.7 Ų135.776%0.75768%0.68SS**  trans-51.1102.8168.6-73.8-167.9152.900106.7L15 N19L15-E17 VanDerWaalsContact C-N 3.33Å; L15-E17 PolarHBondContact O-N 3.48Å; E17-N19 PolarHBondContact O-N 3.36Å; E17-N19 PolarHBondContact O-OD1 2.85Å
18R41.1Very low45.3Very low233 Ų233136.7 Ų136.788%0.87968%0.68SS**  trans-68.294.9171.9178.2-175.9-79.8-141.6-2.3104.7Q16 S20Q16-R18 VanDerWaalsContact C-N 3.31Å; Q16-R18 PolarHBondContact O-N 3.09Å; R18-S20 PolarHBondContact O-N 3.26Å
19N49.8Very low45.4Very low138 Ų138140.5 Ų140.574%0.73868%0.683SS**  trans-28.999.6174.2-61.9-22.4000110.4E17E17-N19 PolarHBondContact O-N 3.36Å; E17-N19 PolarHBondContact O-OD1 2.85Å
20S48Very low45.1Very low57 Ų57138.4 Ų138.440%0.39968%0.678SS.*  trans-75.5149.6176.6880000107.2R18 W22 D23R18-S20 PolarHBondContact O-N 3.26Å; S20-W22 PolarHBondContact O-N 2.86Å; S20-W22 WeakPolarHBondContact OG-CB 2.98Å; S20-W22 PolarHBondContact OG-N 2.84Å; S20-D23 PolarHBondContact O-N 3.45Å
21S49.8Very low45Very low79 Ų79139 Ų13955%0.55268%0.678SS**Hα-helixtrans-47.3-18.7175-169.60000113.7
22W41.1Very low45Very low170 Ų170138.1 Ų138.164%0.64468%0.683SS**Hα-helixtrans-77.3-20.7179.5-59.8107.2000115.4S20 R24 I25 R26S20-W22 PolarHBondContact O-N 2.86Å; S20-W22 WeakPolarHBondContact OG-CB 2.98Å; S20-W22 PolarHBondContact OG-N 2.84Å; W22-R24 VanDerWaalsContact C-N 3.26Å; W22-R24 PolarHBondContact O-N 3.33Å; W22-I25 HydrophobicContact CD2-CD1 3.97Å; W22-I25 HydrophobicContact CE3-CB 4.09Å; W22-I25 HydrophobicContact CE3-CD1 3.23Å; W22-I25 HydrophobicContact CE3-CG1 4.2Å; W22-I25 HydrophobicContact CE3-CG2 4.15Å; W22-I25 HydrophobicContact CH2-CD1 4.09Å; W22-I25 HydrophobicContact CZ3-CD1 3.3Å; W22-I25 HydrophobicContact CZ3-CG1 4.48Å; W22-I25 HydrophobicContact CZ3-CG2 4.29Å; W22-I25 PolarHBondContact O-N 3.22Å; W22-I25 VanDerWaalsContact O-N 3.14Å; W22-R26 PolarHBondContact O-N 3.36Å
23D49.4Very low45Very low58 Ų58137.9 Ų137.931%0.3169%0.686SS.*Hα-helixtrans-71.3-25173.5-72.8-49.1000112.1S20 R26 K27S20-D23 PolarHBondContact O-N 3.45Å; D23-R26 IonicContact OD1-CZ 3.43Å; D23-R26 IonicContact OD1-NH1 2.79Å; D23-R26 PolarHBondContact OD1-NH1 2.82Å; D23-R26 IonicContact OD1-NH2 3.98Å; D23-K27 PolarHBondContact O-N 2.92Å
24R49Very low45.6Very low197 Ų197141.7 Ų141.774%0.74370%0.7SS**Hα-helixtrans-70.6-35.1168.8-71.2177.967.9-153.41.9111.8W22 K27 L28W22-R24 VanDerWaalsContact C-N 3.26Å; W22-R24 PolarHBondContact O-N 3.33Å; R24-K27 PolarHBondContact O-N 3.35Å; R24-L28 WeakPolarHBondContact O-CG 3.2Å; R24-L28 PolarHBondContact O-N 3.45Å
25I44.2Very low45.8Very low71 Ų71144.5 Ų144.536%0.36471%0.708SS.*Hα-helixtrans-73.6-41-177.4-66.5170000110.5W22 K27 L28W22-I25 HydrophobicContact CD2-CD1 3.97Å; W22-I25 HydrophobicContact CE3-CB 4.09Å; W22-I25 HydrophobicContact CE3-CD1 3.23Å; W22-I25 HydrophobicContact CE3-CG1 4.2Å; W22-I25 HydrophobicContact CE3-CG2 4.15Å; W22-I25 HydrophobicContact CH2-CD1 4.09Å; W22-I25 HydrophobicContact CZ3-CD1 3.3Å; W22-I25 HydrophobicContact CZ3-CG1 4.48Å; W22-I25 HydrophobicContact CZ3-CG2 4.29Å; W22-I25 PolarHBondContact O-N 3.22Å; W22-I25 VanDerWaalsContact O-N 3.14Å; I25-K27 PolarHBondContact O-N 3.12Å; I25-L28 PolarHBondContact O-N 3Å
26R44.7Very low45.6Very low172 Ų172139.9 Ų139.965%0.64970%0.702SS**Hα-helixtrans-63.2-29.1175.4-152.3-175.1-64.1124.41.1112.7W22 D23W22-R26 PolarHBondContact O-N 3.36Å; D23-R26 IonicContact OD1-CZ 3.43Å; D23-R26 IonicContact OD1-NH1 2.79Å; D23-R26 PolarHBondContact OD1-NH1 2.82Å; D23-R26 IonicContact OD1-NH2 3.98Å
27K49.9Very low45.5Very low167 Ų167140.3 Ų140.373%0.72670%0.704SS**Hα-helixtrans-75.4-24.8179.3-142.3165.8-175.6175.80113.4D23 R24 I25D23-K27 PolarHBondContact O-N 2.92Å; R24-K27 PolarHBondContact O-N 3.35Å; I25-K27 PolarHBondContact O-N 3.12Å
28L43.6Very low45.3Very low138 Ų138136.2 Ų136.272%0.72371%0.706SS**Hα-helixtrans-82.1-25.3179.6-69.1169.5000113.1R24 I25 G30R24-L28 WeakPolarHBondContact O-CG 3.2Å; R24-L28 PolarHBondContact O-N 3.45Å; I25-L28 PolarHBondContact O-N 3Å; L28-G30 VanDerWaalsContact C-N 3.28Å; L28-G30 PolarHBondContact O-N 3.12Å
29Q45.4Very low44.9Very low172 Ų172131.8 Ų131.880%0.80471%0.705SS**THydrogen-bonded Turntrans-78.5-6.5175.4-91.2173.8-34.700114.3
30G43.3Very low44.7Very low67 Ų67131.6 Ų131.669%0.69171%0.711SS**THydrogen-bonded Turntrans-96.12-179.700000115.6L28L28-G30 VanDerWaalsContact C-N 3.28Å; L28-G30 PolarHBondContact O-N 3.12Å
31Q49.3Very low44.5Very low167 Ų167132.1 Ų132.178%0.7873%0.726SS**  trans-125.669.9179.7-73.5-172.1-85.900111.9
32E47.8Very low44Very low198 Ų198136.9 Ų136.993%0.92574%0.744SS**  trans-127.190.2153.4-87.1-165.6103.500109
33S45.8Very low43.8Very low106 Ų106137.2 Ų137.274%0.74175%0.753SS**  trans-159.692.7160.4169.50000108.4
34I47.1Very low43.1Very low166 Ų166140.2 Ų140.285%0.85178%0.775SS**  trans-143102.3153.2-59.1-67.2000108.6
35L43.7Very low42.4Very low166 Ų166139 Ų13987%0.86978%0.782SS**  trans32117.4137.5-167.568.8000119.5
36G35.3Very low42.4Very low74 Ų74141.4 Ų141.476%0.76380%0.803SS**  trans179.689.1160.400000115.9
37Q43.2Very low42.2Very low189 Ų189136.8 Ų136.888%0.88381%0.809SS**  trans3147.9157.7-57.8-143.4-22.900123
38G39.3Very low41.3Very low76 Ų76135.1 Ų135.178%0.78481%0.812SS**  trans-76.8168.6-168.300000118.4
39T32.4Very low41Very low140 Ų140134.6 Ų134.686%0.85982%0.817SS**  trans-140.3115.3167.9-34.80000107.4
40P46Very low40.7Very low133 Ų133135.9 Ų135.986%0.86482%0.815SS**  trans-88.6127.517931-27.3000110.8
41G43.8Very low41.1Very low69 Ų69142.1 Ų142.171%0.71183%0.826SS**  trans112.4101160.200000114.2
42L39.5Very low40.7Very low178 Ų178140 Ų14093%0.93281%0.814SS**  trans-165.5125.9135.3-99159.9000108.6
43Q37.8Very low40.6Very low178 Ų178138.7 Ų138.783%0.83281%0.808SS**PPolyproline II helixtrans-62.6147.6-177.3-73.3-88.54200112.6
44P33.5Very low40.4Very low121 Ų121140.8 Ų140.879%0.78680%0.804SS**PPolyproline II helixtrans-82.9120172.3-1.319.8000111.2
45L36.1Very low40.6Very low170 Ų170135.3 Ų135.389%0.8978%0.78SS**PPolyproline II helixtrans-89.6143.4164.3-98.7159000110.3
46P43.9Very low41Very low122 Ų122137.5 Ų137.579%0.79278%0.777SS**PPolyproline II helixtrans-91.4130.2-17234.5-27.9000111
47G39Very low41.7Very low75 Ų75141.9 Ų141.977%0.77377%0.77SS**  trans159.868.4171.100000113.8
48T32Very low42Very low132 Ų132135.6 Ų135.681%0.8174%0.742SS**  trans-125134.615853.70000109.8R50T48-R50 PolarHBondContact O-N 3.27Å
49P37.7Very low42.7Very low127 Ų127137.2 Ų137.283%0.82573%0.73SS**  trans-63.2129175.7-1729.9000109.7Q51P49-Q51 PolarHBondContact O-N 3.11Å
50R37.7Very low43.8Very low200 Ų200137.3 Ų137.376%0.75572%0.718SS**  trans-57.893.8176.7-88.6-177155.4-178.80.6111.2T48 K52T48-R50 PolarHBondContact O-N 3.27Å; R50-K52 HydrophobicContact CB-CB 4.36Å; R50-K52 PolarHBondContact O-N 3.28Å
51Q53.1Low44.3Very low198 Ų198133 Ų13393%0.92569%0.689SS**  trans-80.966.4159.2-153.9170.8-0.600107.9P49 Q53P49-Q51 PolarHBondContact O-N 3.11Å; Q51-Q53 PolarHBondContact O-N 2.97Å
52K40.9Very low44.8Very low122 Ų122133.5 Ų133.553%0.5368%0.675SS.*  trans-85109.8-173.1-137.2-178.6-177-1730108.8R50 K54R50-K52 HydrophobicContact CB-CB 4.36Å; R50-K52 PolarHBondContact O-N 3.28Å; K52-K54 VanDerWaalsContact C-N 3.27Å; K52-K54 PolarHBondContact O-N 2.92Å
53Q45.5Very low45.3Very low170 Ų170131 Ų13179%0.79466%0.659SS**  trans63.523.4140.8-162.2169.1-15.200116.1Q51Q51-Q53 PolarHBondContact O-N 2.97Å
54K41.3Very low46.1Very low151 Ų151131 Ų13166%0.65765%0.651SS**  trans-74.9131.2160.5-82.9-172.2175.2-173.60107.4K52K52-K54 VanDerWaalsContact C-N 3.27Å; K52-K54 PolarHBondContact O-N 2.92Å
55S51.5Low47.3Very low50 Ų50128.4 Ų128.435%0.3563%0.63SS.*SBendtrans8166.1170.2-133.30000117
56R51.8Low47.8Very low212 Ų212126.5 Ų126.580%0.862%0.615SS**SBendtrans-120.8-18.8142.1-149.5-171.5-91-139.50.6112.2K60R56-K60 WeakPolarHBondContact O-CG 3.32Å
57R50.4Low48Very low166 Ų166124.3 Ų124.363%0.62660%0.596SS**SBendtrans-96-37.2174.4-66.2-175.777.6-171.48.1112.9E59 K60 V61 E94R57-E59 VanDerWaalsContact C-N 3.33Å; R57-K60 CarbonylContact O-C 3.58Å; R57-K60 WeakPolarHBondContact O-CA 3.18Å; R57-K60 WeakPolarHBondContact O-CB 3.45Å; R57-K60 PolarHBondContact O-N 3.35Å; R57-V61 WeakPolarHBondContact O-CG2 2.8Å; R57-V61 PolarHBondContact O-N 3.44Å; R57-E94 IonicContact CZ-OE1 3.63Å; R57-E94 IonicContact NE-OE1 3.8Å; R57-E94 IonicContact NH1-OE1 2.81Å; R57-E94 PolarHBondContact NH1-OE1 3.14Å
58I49.6Very low48.3Very low57 Ų57124.3 Ų124.329%0.29258%0.584SS.*Hα-helixtrans-63.4-43.1175.4-60.3172.9000109.9K60 V61 L62I58-K60 VanDerWaalsContact C-N 3.29Å; I58-K60 PolarHBondContact O-N 3.01Å; I58-V61 PolarHBondContact O-N 3.47Å; I58-V61 VanDerWaalsContact O-N 3.17Å; I58-L62 HydrophobicContact CG2-CD1 4.19Å; I58-L62 WeakPolarHBondContact O-CG 3.46Å; I58-L62 PolarHBondContact O-N 3.4Å
59E53.1Low49Very low111 Ų111125.5 Ų125.552%0.51958%0.581SS.*Hα-helixtrans-54.6-43.1168.6-93.7169.7-164.800112.6R57 V61 L62 E63R57-E59 VanDerWaalsContact C-N 3.33Å; E59-V61 PolarHBondContact O-N 2.97Å; E59-L62 PolarHBondContact O-N 3.28Å; E59-E63 VanDerWaalsContact O-CB 3.27Å; E59-E63 WeakPolarHBondContact O-CB 3.47Å; E59-E63 VanDerWaalsContact O-CG 3.28Å; E59-E63 WeakPolarHBondContact O-CG 3.28Å; E59-E63 PolarHBondContact O-N 3.36Å
60K55.5Low49.4Very low141 Ų141125.9 Ų125.961%0.61357%0.571SS**Hα-helixtrans-67.3-33.5177.4-78.8-176.8160.6-1690113.7R56 R57 I58 W64R56-K60 WeakPolarHBondContact O-CG 3.32Å; R57-K60 CarbonylContact O-C 3.58Å; R57-K60 WeakPolarHBondContact O-CA 3.18Å; R57-K60 WeakPolarHBondContact O-CB 3.45Å; R57-K60 PolarHBondContact O-N 3.35Å; I58-K60 VanDerWaalsContact C-N 3.29Å; I58-K60 PolarHBondContact O-N 3.01Å; K60-W64 WeakPolarHBondContact O-CB 3.4Å; K60-W64 PolarHBondContact O-N 2.96Å
61V56.5Low49.7Very low43 Ų43124 Ų12426%0.26157%0.571SS.*Hα-helixtrans-71.1-42.7176.3170.30000110R57 I58 E59 W64 L65 F90R57-V61 WeakPolarHBondContact O-CG2 2.8Å; R57-V61 PolarHBondContact O-N 3.44Å; I58-V61 PolarHBondContact O-N 3.47Å; I58-V61 VanDerWaalsContact O-N 3.17Å; E59-V61 PolarHBondContact O-N 2.97Å; V61-W64 PolarHBondContact O-N 2.93Å; V61-L65 HydrophobicContact CG1-CD1 4.02Å; V61-L65 WeakPolarHBondContact O-CD1 3.5Å; V61-L65 PolarHBondContact O-N 3.18Å; V61-F90 HydrophobicContact CG1-CE1 4.15Å; V61-F90 HydrophobicContact CG1-CZ 3.88Å; V61-F90 HydrophobicContact CG2-CE1 4.29Å
62L54.1Low49.3Very low79 Ų79118.5 Ų118.541%0.41455%0.553SS.*Hα-helixtrans-67-39.5175.1-66.8173.9000111.9I58 E59 L65 F66I58-L62 HydrophobicContact CG2-CD1 4.19Å; I58-L62 WeakPolarHBondContact O-CG 3.46Å; I58-L62 PolarHBondContact O-N 3.4Å; E59-L62 PolarHBondContact O-N 3.28Å; L62-L65 PolarHBondContact O-N 3.21Å; L62-F66 WeakPolarHBondContact O-CB 3.33Å; L62-F66 PolarHBondContact O-N 3.48Å
63E51.4Low49.6Very low126 Ų126122.5 Ų122.559%0.58957%0.57SS**Hα-helixtrans-60.2-42.9169.6-82-108.1144.200111.5E59 F66 I67E59-E63 VanDerWaalsContact O-CB 3.27Å; E59-E63 WeakPolarHBondContact O-CB 3.47Å; E59-E63 VanDerWaalsContact O-CG 3.28Å; E59-E63 WeakPolarHBondContact O-CG 3.28Å; E59-E63 PolarHBondContact O-N 3.36Å; E63-F66 CarbonylContact O-C 3.56Å; E63-F66 WeakPolarHBondContact O-CB 3.37Å; E63-F66 PolarHBondContact O-N 3.44Å; E63-F66 VanDerWaalsContact O-N 3.14Å; E63-I67 WeakPolarHBondContact O-CB 3.34Å; E63-I67 WeakPolarHBondContact O-CD1 3.47Å; E63-I67 WeakPolarHBondContact O-CG1 3.47Å; E63-I67 PolarHBondContact O-N 3.3Å
64W54Low49.7Very low178 Ų178120.5 Ų120.567%0.67456%0.563SS**Hα-helixtrans-65.2-39.2175.9-102.283.9000113.5K60 V61 F66 I67 S68K60-W64 WeakPolarHBondContact O-CB 3.4Å; K60-W64 PolarHBondContact O-N 2.96Å; V61-W64 PolarHBondContact O-N 2.93Å; W64-F66 PolarHBondContact O-N 3.44Å; W64-I67 PolarHBondContact O-N 3.44Å; W64-S68 WeakPolarHBondContact O-CB 3.33Å; W64-S68 PolarHBondContact O-N 3.16Å; W64-S68 PolarHBondContact O-OG 3.24Å
65L57.8Low49.7Very low66 Ų66119.8 Ų119.835%0.34657%0.572SS.*Hα-helixtrans-60.9-35.9171.2-94.8133.5000111.4V61 L62 L105 V109V61-L65 HydrophobicContact CG1-CD1 4.02Å; V61-L65 WeakPolarHBondContact O-CD1 3.5Å; V61-L65 PolarHBondContact O-N 3.18Å; L62-L65 PolarHBondContact O-N 3.21Å; L65-L105 HydrophobicContact CD2-CD2 3.75Å; L65-L105 HydrophobicContact CD2-CG 4.01Å; L65-V109 HydrophobicContact CD2-CG2 4.12Å
66F46.7Very low49.1Very low130 Ų130125.4 Ų125.457%0.5759%0.59SS**Hα-helixtrans-73.3-43.3175.8-163.2-102000111.9L62 E63 W64 S68 Q69L62-F66 WeakPolarHBondContact O-CB 3.33Å; L62-F66 PolarHBondContact O-N 3.48Å; E63-F66 CarbonylContact O-C 3.56Å; E63-F66 WeakPolarHBondContact O-CB 3.37Å; E63-F66 PolarHBondContact O-N 3.44Å; E63-F66 VanDerWaalsContact O-N 3.14Å; W64-F66 PolarHBondContact O-N 3.44Å; F66-S68 VanDerWaalsContact C-N 3.27Å; F66-S68 PolarHBondContact O-N 3.18Å; F66-Q69 VanDerWaalsContact O-CB 3.26Å; F66-Q69 WeakPolarHBondContact O-CB 3.46Å; F66-Q69 PolarHBondContact O-N 2.87Å; F66-Q69 VanDerWaalsContact O-N 3.08Å
67I47.9Very low48.8Very low76 Ų76121.4 Ų121.439%0.3959%0.594SS.*Hα-helixtrans-64.1-31.6175.9-67.3162.2000111.5E63 W64 Q69 E70E63-I67 WeakPolarHBondContact O-CB 3.34Å; E63-I67 WeakPolarHBondContact O-CD1 3.47Å; E63-I67 WeakPolarHBondContact O-CG1 3.47Å; E63-I67 PolarHBondContact O-N 3.3Å; W64-I67 PolarHBondContact O-N 3.44Å; I67-Q69 PolarHBondContact O-N 3.09Å; I67-E70 CarbonylContact O-C 3.47Å; I67-E70 PolarHBondContact O-N 2.66Å; I67-E70 VanDerWaalsContact O-O 3.1Å
68S46.9Very low48.6Very low75 Ų75123 Ų12352%0.52460%0.601SS.*THydrogen-bonded Turntrans-64.8-20.1176.1-62.90000112.7W64 F66 E70W64-S68 WeakPolarHBondContact O-CB 3.33Å; W64-S68 PolarHBondContact O-N 3.16Å; W64-S68 PolarHBondContact O-OG 3.24Å; F66-S68 VanDerWaalsContact C-N 3.27Å; F66-S68 PolarHBondContact O-N 3.18Å; S68-E70 VanDerWaalsContact C-N 3.34Å
69Q46.3Very low49.1Very low158 Ų158122.8 Ų122.874%0.73861%0.612SS**THydrogen-bonded Turntrans-79-18173.5-162.6165.244.800112.7F66 I67F66-Q69 VanDerWaalsContact O-CB 3.26Å; F66-Q69 WeakPolarHBondContact O-CB 3.46Å; F66-Q69 PolarHBondContact O-N 2.87Å; F66-Q69 VanDerWaalsContact O-N 3.08Å; I67-Q69 PolarHBondContact O-N 3.09Å
70E46.1Very low49.5Very low134 Ų134122.9 Ų122.963%0.62662%0.622SS**SBendtrans-110.888.6177.2-79.4166.2150.800110.4I67 S68 P72I67-E70 CarbonylContact O-C 3.47Å; I67-E70 PolarHBondContact O-N 2.66Å; I67-E70 VanDerWaalsContact O-O 3.1Å; S68-E70 VanDerWaalsContact C-N 3.34Å; E70-P72 WeakPolarHBondContact O-CD 3.43Å
71Q43.4Very low49.9Very low161 Ų161119.6 Ų119.675%0.75261%0.611SS**  trans-54119.7-176.8-69.2-72.5-9.800113.2
72P45Very low50.5Low83 Ų83120 Ų12054%0.53962%0.616SS.*  trans-72.5136.5166.2-7.624.1000109.6E70 I74E70-P72 WeakPolarHBondContact O-CD 3.43Å; P72-I74 HydrophobicContact CB-CG1 4.4Å; P72-I74 PolarHBondContact O-N 3.5Å
73K47.6Very low51.2Low205 Ų205117.3 Ų117.389%0.89160%0.601SS**  trans-70.995.3168.4-63.9176-177.31750108.6T75K73-T75 PolarHBondContact O-N 2.8Å
74I47.5Very low52.1Low129 Ų129117.7 Ų117.766%0.66260%0.604SS**  trans-82.897.8-179-54.2172.6000109.3P72P72-I74 HydrophobicContact CB-CG1 4.4Å; P72-I74 PolarHBondContact O-N 3.5Å
75T40.2Very low52.9Low135 Ų135114.3 Ų114.383%0.82860%0.6SS**  trans-10173.716658.20000110K73K73-T75 PolarHBondContact O-N 2.8Å
76K39.8Very low53.6Low169 Ų169113.5 Ų113.574%0.73560%0.597SS**SBendtrans-157.8129160.2-117.2169.6-179.3173.50107.7W78K76-W78 VanDerWaalsContact C-N 3.27Å; K76-W78 PolarHBondContact O-N 3.05Å
77S45.3Very low54.9Low127 Ų127109.5 Ų109.589%0.88858%0.58SS**  trans-71.483.9178.655.10000109.5
78W46.8Very low56.2Low201 Ų201109 Ų10976%0.76158%0.58SS**  trans-68.2145.5160.7-69.682000107.3K76K76-W78 VanDerWaalsContact C-N 3.27Å; K76-W78 PolarHBondContact O-N 3.05Å
79G58.8Low57.5Low52 Ų52111 Ų11154%0.53659%0.585SS.*SBendtrans-58.6-171.5178.700000112.8L81G79-L81 PolarHBondContact O-N 3.38Å
80P61.9Low58.9Low113 Ų113104.8 Ų104.873%0.73456%0.555SS**SBendtrans-54.3118-178.922-31.3000110.4S82 Y122P80-S82 PolarHBondContact O-N 3.13Å; P80-Y122 HydrophobicContact CB-CD1 4.12Å; P80-Y122 HydrophobicContact CB-CE1 3.94Å
81L64.4Low60.2Low72 Ų72101.4 Ų101.438%0.37754%0.544SS..PPolyproline II helixtrans-65.3128.5179.6-69.7173.5000108.6G79 L117 Y122G79-L81 PolarHBondContact O-N 3.38Å; L81-L117 HydrophobicContact CB-CD2 4.25Å; L81-Y122 HydrophobicContact CB-CD2 4.32Å; L81-Y122 HydrophobicContact CB-CE2 4.26Å; L81-Y122 HydrophobicContact CD1-CE2 4.49Å; L81-Y122 WeakPolarHBondContact O-CB 3.48Å
82S67.8Low61.5Low52 Ų5299.5 Ų99.536%0.36453%0.53SS..PPolyproline II helixtrans-102.9159.8176.378.20000110.4P80 M84 D85P80-S82 PolarHBondContact O-N 3.13Å; S82-M84 PolarHBondContact O-N 3.19Å; S82-M84 VanDerWaalsContact O-N 3.13Å; S82-M84 PolarHBondContact OG-N 3.01Å; S82-D85 WeakPolarHBondContact CA-OD2 3.47Å; S82-D85 WeakPolarHBondContact CB-OD2 3.46Å; S82-D85 PolarHBondContact N-OD2 3.33Å; S82-D85 WeakPolarHBondContact O-CB 3.44Å; S82-D85 PolarHBondContact O-N 3.25Å; S82-D85 PolarHBondContact OG-OD2 3.32Å
83F69.8Low62.8Low22 Ų22101.6 Ų101.610%0.09653%0.532CS..G310 helixtrans-57.1-28.2173-178.5-104.7000112.5D85 V86 F87 M110 Y114 L117 P127 I129 I130F83-D85 PolarHBondContact O-N 3.46Å; F83-V86 HydrophobicContact CD2-CG2 4.16Å; F83-V86 WeakPolarHBondContact O-CG2 3.4Å; F83-V86 PolarHBondContact O-N 2.82Å; F83-F87 HydrophobicContact CD1-CB 4.46Å; F83-F87 HydrophobicContact CD1-CD2 4.42Å; F83-F87 HydrophobicContact CE1-CB 4.24Å; F83-F87 AromaticContact CE1-CD2 3.51Å; F83-F87 HydrophobicContact CE1-CD2 3.51Å; F83-F87 HydrophobicContact CE1-CE2 4.36Å; F83-F87 HydrophobicContact CE1-CG 4.25Å; F83-F87 AromaticContact CZ-CD2 3.89Å; F83-F87 HydrophobicContact CZ-CD2 3.89Å; F83-F87 VanDerWaalsContact O-CB 3.3Å; F83-F87 WeakPolarHBondContact O-CB 3.4Å; F83-F87 PolarHBondContact O-N 2.89Å; F83-M110 HydrophobicContact CE1-CE 4.26Å; F83-M110 HydrophobicContact CE2-CE 4.13Å; F83-M110 HydrophobicContact CZ-CE 3.52Å; F83-Y114 HydrophobicContact CD2-CD2 4.2Å; F83-L117 HydrophobicContact CB-CD1 4.02Å; F83-L117 HydrophobicContact CD2-CD1 3.91Å; F83-L117 HydrophobicContact CG-CD1 4.48Å; F83-P127 HydrophobicContact CB-CG 4.26Å; F83-P127 HydrophobicContact CD1-CB 4.34Å; F83-P127 HydrophobicContact CD1-CG 3.49Å; F83-P127 VanDerWaalsContact CD1-CG 3.49Å; F83-P127 HydrophobicContact CE1-CG 4Å; F83-P127 HydrophobicContact CG-CG 3.91Å; F83-I129 HydrophobicContact CD1-CG2 4.5Å; F83-I129 HydrophobicContact CE1-CG2 3.66Å; F83-I129 HydrophobicContact CZ-CG2 4.42Å; F83-I130 HydrophobicContact CD2-CD1 4.43Å; F83-I130 HydrophobicContact CD2-CG1 4.4Å; F83-I130 HydrophobicContact CE1-CD1 4.05Å; F83-I130 HydrophobicContact CE1-CG1 3.95Å; F83-I130 HydrophobicContact CE2-CD1 3.48Å; F83-I130 VanDerWaalsContact CE2-CD1 3.48Å; F83-I130 HydrophobicContact CE2-CG1 3.87Å; F83-I130 HydrophobicContact CZ-CD1 3.24Å; F83-I130 HydrophobicContact CZ-CG1 3.61Å
84M70.4Confident63.9Low133 Ų13394.4 Ų94.466%0.65550%0.502SS*.G310 helixtrans-69.2-23.4179.4-140.76275.200112.9S82 V86 F87S82-M84 PolarHBondContact O-N 3.19Å; S82-M84 VanDerWaalsContact O-N 3.13Å; S82-M84 PolarHBondContact OG-N 3.01Å; M84-V86 VanDerWaalsContact C-N 3.32Å; M84-F87 HydrophobicContact SD-CB 4.37Å; M84-F87 HydrophobicContact SD-CD1 4.32Å; M84-F87 HydrophobicContact SD-CG 4.43Å
85D70.4Confident65.3Low108 Ų10888.8 Ų88.858%0.57847%0.473SS*.G310 helixtrans-76.4-22178.6-58.7-62.5000112.7S82 F83S82-D85 WeakPolarHBondContact CA-OD2 3.47Å; S82-D85 WeakPolarHBondContact CB-OD2 3.46Å; S82-D85 PolarHBondContact N-OD2 3.33Å; S82-D85 WeakPolarHBondContact O-CB 3.44Å; S82-D85 PolarHBondContact O-N 3.25Å; S82-D85 PolarHBondContact OG-OD2 3.32Å; F83-D85 PolarHBondContact O-N 3.46Å
86V71.8Confident67Low49 Ų4987.2 Ų87.230%0.29746%0.456SS..SBendtrans-109.71.3177.5-57.90000112.4F83 M84 N113 L117F83-V86 HydrophobicContact CD2-CG2 4.16Å; F83-V86 WeakPolarHBondContact O-CG2 3.4Å; F83-V86 PolarHBondContact O-N 2.82Å; M84-V86 VanDerWaalsContact C-N 3.32Å; V86-N113 HydrophobicContact CG2-CB 4.18Å; V86-L117 HydrophobicContact CG2-CD1 3.62Å; V86-L117 HydrophobicContact CG2-CG 4.47Å
87F74.3Confident68.8Low46 Ų4683.5 Ų83.520%0.20244%0.444CS..PPolyproline II helixtrans-81.1123.7-178.3179.6-99000110.5F83 M84 D89 Y106 M110 I129F83-F87 HydrophobicContact CD1-CB 4.46Å; F83-F87 HydrophobicContact CD1-CD2 4.42Å; F83-F87 HydrophobicContact CE1-CB 4.24Å; F83-F87 AromaticContact CE1-CD2 3.51Å; F83-F87 HydrophobicContact CE1-CD2 3.51Å; F83-F87 HydrophobicContact CE1-CE2 4.36Å; F83-F87 HydrophobicContact CE1-CG 4.25Å; F83-F87 AromaticContact CZ-CD2 3.89Å; F83-F87 HydrophobicContact CZ-CD2 3.89Å; F83-F87 VanDerWaalsContact O-CB 3.3Å; F83-F87 WeakPolarHBondContact O-CB 3.4Å; F83-F87 PolarHBondContact O-N 2.89Å; M84-F87 HydrophobicContact SD-CB 4.37Å; M84-F87 HydrophobicContact SD-CD1 4.32Å; M84-F87 HydrophobicContact SD-CG 4.43Å; F87-D89 HydrophobicContact CD1-CB 3.99Å; F87-D89 VanDerWaalsContact CE1-CA 3.47Å; F87-D89 HydrophobicContact CE1-CB 3.48Å; F87-D89 VanDerWaalsContact CE1-CB 3.48Å; F87-D89 HydrophobicContact CZ-CB 4.45Å; F87-Y106 WeakPolarHBondContact CE2-OH 3.28Å; F87-Y106 WeakPolarHBondContact CZ-OH 3.27Å; F87-M110 HydrophobicContact CB-CE 4.02Å; F87-M110 HydrophobicContact CD2-CE 3.09Å; F87-M110 HydrophobicContact CE2-CE 3.7Å; F87-M110 HydrophobicContact CG-CE 3.87Å; F87-I129 HydrophobicContact CE2-CD1 3.39Å; F87-I129 HydrophobicContact CE2-CG1 4.14Å; F87-I129 HydrophobicContact CE2-CG2 4.29Å; F87-I129 HydrophobicContact CZ-CD1 3.46Å; F87-I129 VanDerWaalsContact CZ-CD1 3.46Å
88V76.6Confident70.1Confident64 Ų6478.2 Ų78.239%0.38841%0.405SS..PPolyproline II helixtrans-91.7117.7167.9-179.40000108.2F90 Y106V88-F90 HydrophobicContact CG1-CE2 3.93Å; V88-F90 HydrophobicContact CG1-CZ 3.95Å; V88-Y106 HydrophobicContact CB-CE2 4.13Å; V88-Y106 VanDerWaalsContact O-CE2 3.23Å; V88-Y106 WeakPolarHBondContact O-CE2 3.31Å; V88-Y106 PolarHBondContact O-OH 2.93Å
89D73.7Confident71.5Confident118 Ų11873.3 Ų73.363%0.63139%0.394SS*.PPolyproline II helixtrans-89136.4175.774.8-32.9000111F87F87-D89 HydrophobicContact CD1-CB 3.99Å; F87-D89 VanDerWaalsContact CE1-CA 3.47Å; F87-D89 HydrophobicContact CE1-CB 3.48Å; F87-D89 VanDerWaalsContact CE1-CB 3.48Å; F87-D89 HydrophobicContact CZ-CB 4.45Å
90F74.4Confident72.3Confident27 Ų2774 Ų7412%0.11839%0.389CS..  trans-116.1145.3166.6-68.3-75.5000107.7V61 V88 E94 W95 L98 Y106 M141V61-F90 HydrophobicContact CG1-CE1 4.15Å; V61-F90 HydrophobicContact CG1-CZ 3.88Å; V61-F90 HydrophobicContact CG2-CE1 4.29Å; V88-F90 HydrophobicContact CG1-CE2 3.93Å; V88-F90 HydrophobicContact CG1-CZ 3.95Å; F90-E94 HydrophobicContact CB-CB 4.42Å; F90-E94 HydrophobicContact CD1-CB 4.3Å; F90-W95 HydrophobicContact CB-CB 4.31Å; F90-W95 HydrophobicContact CB-CE3 4.25Å; F90-W95 AromaticContact CD2-CE3 3.9Å; F90-W95 HydrophobicContact CD2-CE3 3.9Å; F90-W95 HydrophobicContact CD2-CZ3 4.1Å; F90-W95 HydrophobicContact CG-CE3 4.27Å; F90-L98 HydrophobicContact CD1-CD1 4.23Å; F90-L98 HydrophobicContact CD2-CD1 4.21Å; F90-L98 HydrophobicContact CE1-CD1 4.15Å; F90-L98 HydrophobicContact CE1-CD2 4.45Å; F90-L98 HydrophobicContact CE2-CD1 4.12Å; F90-L98 HydrophobicContact CG-CD1 4.26Å; F90-L98 HydrophobicContact CZ-CD1 4.09Å; F90-Y106 HydrophobicContact CD2-CD2 4.09Å; F90-Y106 AromaticContact CD2-CE2 3.81Å; F90-Y106 HydrophobicContact CD2-CE2 3.81Å; F90-Y106 AromaticContact CE2-CD2 3.45Å; F90-Y106 HydrophobicContact CE2-CD2 3.45Å; F90-Y106 VanDerWaalsContact CE2-CD2 3.45Å; F90-Y106 AromaticContact CE2-CE2 3.54Å; F90-Y106 HydrophobicContact CE2-CE2 3.54Å; F90-Y106 HydrophobicContact CE2-CG 4.16Å; F90-M141 HydrophobicContact CB-CE 4.41Å; F90-M141 WeakPolarHBondContact O-CE 3.24Å
91T74.4Confident72.9Confident64 Ų6471.4 Ų71.439%0.39338%0.377SS..  trans-72.8163.8163.2750000110E93 E94 W95 M141T91-E93 WeakPolarHBondContact CB-OE2 3.36Å; T91-E93 PolarHBondContact O-N 2.84Å; T91-E93 PolarHBondContact OG1-OE2 3.22Å; T91-E93 VanDerWaalsContact OG1-OE2 3.13Å; T91-E94 PolarHBondContact N-OE2 2.98Å; T91-E94 PolarHBondContact O-N 3.23Å; T91-E94 WeakPolarHBondContact OG1-CG 3.41Å; T91-E94 PolarHBondContact OG1-N 3.44Å; T91-W95 WeakPolarHBondContact O-CB 3.41Å; T91-W95 PolarHBondContact O-N 2.8Å; T91-M141 VanDerWaalsContact C-CE 3.46Å; T91-M141 WeakPolarHBondContact O-CE 3.49Å
92W71.3Confident73.4Confident120 Ų12070.2 Ų70.246%0.45537%0.369SS..Hα-helixtrans-58.2-40.5177.3179.2-112000111.7W95 Q96W92-W95 PolarHBondContact O-N 2.86Å; W92-Q96 HydrophobicContact CD2-CG 4.43Å; W92-Q96 HydrophobicContact CZ2-CG 4.35Å; W92-Q96 WeakPolarHBondContact O-CG 3.42Å; W92-Q96 PolarHBondContact O-N 3.4Å
93E71.2Confident73.9Confident127 Ų12769.3 Ų69.359%0.59336%0.359SS*.Hα-helixtrans-66.6-41178.2-58.471.7-153.800111.7T91 L97T91-E93 WeakPolarHBondContact CB-OE2 3.36Å; T91-E93 PolarHBondContact O-N 2.84Å; T91-E93 PolarHBondContact OG1-OE2 3.22Å; T91-E93 VanDerWaalsContact OG1-OE2 3.13Å; E93-L97 VanDerWaalsContact O-CG 3.28Å; E93-L97 WeakPolarHBondContact O-CG 3.44Å; E93-L97 PolarHBondContact O-N 2.94Å
94E72.1Confident74.2Confident54 Ų5468.7 Ų68.725%0.25236%0.357SS..Hα-helixtrans-67.6-39.6176.1-72.2174.2154.700111.1R57 F90 T91 L97 L98R57-E94 IonicContact CZ-OE1 3.63Å; R57-E94 IonicContact NE-OE1 3.8Å; R57-E94 IonicContact NH1-OE1 2.81Å; R57-E94 PolarHBondContact NH1-OE1 3.14Å; F90-E94 HydrophobicContact CB-CB 4.42Å; F90-E94 HydrophobicContact CD1-CB 4.3Å; T91-E94 PolarHBondContact N-OE2 2.98Å; T91-E94 PolarHBondContact O-N 3.23Å; T91-E94 WeakPolarHBondContact OG1-CG 3.41Å; T91-E94 PolarHBondContact OG1-N 3.44Å; E94-L97 PolarHBondContact O-N 2.91Å; E94-L98 PolarHBondContact O-N 3.26Å
95W76.4Confident74.6Confident12 Ų1266.3 Ų66.35%0.04535%0.347CS..Hα-helixtrans-62.9-43.1176.2-176.1-101.6000112.2F90 T91 W92 L97 L98 K103 Y106 L139 M141F90-W95 HydrophobicContact CB-CB 4.31Å; F90-W95 HydrophobicContact CB-CE3 4.25Å; F90-W95 AromaticContact CD2-CE3 3.9Å; F90-W95 HydrophobicContact CD2-CE3 3.9Å; F90-W95 HydrophobicContact CD2-CZ3 4.1Å; F90-W95 HydrophobicContact CG-CE3 4.27Å; T91-W95 WeakPolarHBondContact O-CB 3.41Å; T91-W95 PolarHBondContact O-N 2.8Å; W92-W95 PolarHBondContact O-N 2.86Å; W95-L97 PolarHBondContact O-N 3.38Å; W95-L98 HydrophobicContact CD2-CD1 4.38Å; W95-L98 HydrophobicContact CE3-CD1 3.65Å; W95-L98 HydrophobicContact CZ3-CD1 3.94Å; W95-L98 PolarHBondContact O-N 3.17Å; W95-K103 HydrophobicContact CH2-CB 4.07Å; W95-K103 HydrophobicContact CH2-CG 4.03Å; W95-K103 HydrophobicContact CZ2-CB 4.06Å; W95-K103 HydrophobicContact CZ2-CD 4.28Å; W95-K103 HydrophobicContact CZ2-CG 3.84Å; W95-K103 HydrophobicContact CZ3-CG 4.49Å; W95-K103 WeakPolarHBondContact O-CE 3.47Å; W95-K103 PolarHBondContact O-NZ 2.78Å; W95-Y106 AromaticContact CH2-CD1 3.42Å; W95-Y106 HydrophobicContact CH2-CD1 3.42Å; W95-Y106 VanDerWaalsContact CH2-CD1 3.42Å; W95-Y106 AromaticContact CH2-CE1 3.98Å; W95-Y106 HydrophobicContact CH2-CE1 3.98Å; W95-Y106 HydrophobicContact CH2-CG 4.12Å; W95-Y106 AromaticContact CZ3-CD1 3.32Å; W95-Y106 HydrophobicContact CZ3-CD1 3.32Å; W95-Y106 AromaticContact CZ3-CE1 3.69Å; W95-Y106 HydrophobicContact CZ3-CE1 3.69Å; W95-Y106 AromaticContact CZ3-CG 3.75Å; W95-Y106 HydrophobicContact CZ3-CG 3.75Å; W95-L139 HydrophobicContact CH2-CD1 3.72Å; W95-L139 HydrophobicContact CZ2-CB 4.15Å; W95-L139 HydrophobicContact CZ2-CD1 3.83Å; W95-L139 HydrophobicContact CZ2-CG 4.49Å; W95-L139 HydrophobicContact CZ3-CD1 4.33Å; W95-M141 HydrophobicContact CB-CE 3.94Å; W95-M141 HydrophobicContact CG-CE 4.41Å
96Q74.3Confident75.1Confident101 Ų10161.9 Ų61.947%0.47232%0.322SS..Hα-helixtrans-62.1-30.2177.1-72-56.5-45.700112.5W92 L98W92-Q96 HydrophobicContact CD2-CG 4.43Å; W92-Q96 HydrophobicContact CZ2-CG 4.35Å; W92-Q96 WeakPolarHBondContact O-CG 3.42Å; W92-Q96 PolarHBondContact O-N 3.4Å; Q96-L98 VanDerWaalsContact C-N 3.35Å
97L77.7Confident75.4Confident92 Ų9260.9 Ų60.948%0.48231%0.313SS..THydrogen-bonded Turntrans-80.2-10.3179.4-68172.4000114.4E93 E94 W95E93-L97 VanDerWaalsContact O-CG 3.28Å; E93-L97 WeakPolarHBondContact O-CG 3.44Å; E93-L97 PolarHBondContact O-N 2.94Å; E94-L97 PolarHBondContact O-N 2.91Å; W95-L97 PolarHBondContact O-N 3.38Å
98L73.7Confident75.4Confident16 Ų1661.4 Ų61.48%0.08432%0.322CS..SBendtrans-75.4137.7177.1-67.9171.6000111.4F90 E94 W95 Q96 Q102 K103F90-L98 HydrophobicContact CD1-CD1 4.23Å; F90-L98 HydrophobicContact CD2-CD1 4.21Å; F90-L98 HydrophobicContact CE1-CD1 4.15Å; F90-L98 HydrophobicContact CE1-CD2 4.45Å; F90-L98 HydrophobicContact CE2-CD1 4.12Å; F90-L98 HydrophobicContact CG-CD1 4.26Å; F90-L98 HydrophobicContact CZ-CD1 4.09Å; E94-L98 PolarHBondContact O-N 3.26Å; W95-L98 HydrophobicContact CD2-CD1 4.38Å; W95-L98 HydrophobicContact CE3-CD1 3.65Å; W95-L98 HydrophobicContact CZ3-CD1 3.94Å; W95-L98 PolarHBondContact O-N 3.17Å; Q96-L98 VanDerWaalsContact C-N 3.35Å; L98-Q102 HydrophobicContact CB-CB 4.24Å; L98-Q102 HydrophobicContact CD2-CB 4.13Å; L98-Q102 VanDerWaalsContact CD2-OE1 3.32Å; L98-K103 HydrophobicContact CB-CD 4.44Å; L98-K103 HydrophobicContact CB-CG 3.76Å; L98-K103 HydrophobicContact CD1-CG 4.41Å; L98-K103 WeakPolarHBondContact O-CE 3.29Å; L98-K103 PolarHBondContact O-NZ 3.01Å; L98-K103 VanDerWaalsContact O-NZ 3.11Å
99D76.3Confident75.5Confident98 Ų9860.4 Ų60.452%0.52432%0.316SS..  trans-65.1152.4173.6-65.1-41.5000110.5A101 Q102 K103D99-A101 PolarHBondContact O-N 2.9Å; D99-A101 VanDerWaalsContact O-N 3.12Å; D99-Q102 HydrophobicContact CB-CG 4.28Å; D99-Q102 VanDerWaalsContact N-OE1 3.14Å; D99-Q102 WeakPolarHBondContact O-CB 3.23Å; D99-Q102 PolarHBondContact O-N 3.48Å; D99-K103 PolarHBondContact O-N 3.37Å
100P75.5Confident75.9Confident67 Ų6754.9 Ų54.944%0.43529%0.287SS..Hα-helixtrans-52-38.1177.9-27.835000113.4K103 C104 I185P100-K103 PolarHBondContact O-N 3.05Å; P100-C104 PolarHBondContact O-N 3.27Å; P100-C104 PolarHBondContact O-SG 3.43Å; P100-I185 HydrophobicContact CB-CG2 4.05Å
101A74.2Confident76Confident57 Ų5756.1 Ų56.147%0.47129%0.294SS..Hα-helixtrans-64.9-39.5176.400000112.6D99 C104 L105D99-A101 PolarHBondContact O-N 2.9Å; D99-A101 VanDerWaalsContact O-N 3.12Å; A101-C104 PolarHBondContact O-N 3.21Å; A101-L105 WeakPolarHBondContact O-CB 3.4Å; A101-L105 PolarHBondContact O-N 2.84Å
102Q74.8Confident76.3Confident47 Ų4758.9 Ų58.922%0.2230%0.303CS..Hα-helixtrans-70.2-39.9177.9-66.4176.8-3100111.6L98 D99 C104 L105 Y106L98-Q102 HydrophobicContact CB-CB 4.24Å; L98-Q102 HydrophobicContact CD2-CB 4.13Å; L98-Q102 VanDerWaalsContact CD2-OE1 3.32Å; D99-Q102 HydrophobicContact CB-CG 4.28Å; D99-Q102 VanDerWaalsContact N-OE1 3.14Å; D99-Q102 WeakPolarHBondContact O-CB 3.23Å; D99-Q102 PolarHBondContact O-N 3.48Å; Q102-C104 VanDerWaalsContact C-N 3.3Å; Q102-C104 PolarHBondContact O-N 3.14Å; Q102-L105 PolarHBondContact O-N 3.47Å; Q102-Y106 WeakPolarHBondContact O-CB 3.42Å; Q102-Y106 PolarHBondContact O-N 3.39Å
103K78.8Confident76.8Confident34 Ų3455.4 Ų55.415%0.14829%0.293CS..Hα-helixtrans-60.6-40.9172.5-69.4172.5173.7155.90111.2W95 L98 D99 P100 Y106 R107W95-K103 HydrophobicContact CH2-CB 4.07Å; W95-K103 HydrophobicContact CH2-CG 4.03Å; W95-K103 HydrophobicContact CZ2-CB 4.06Å; W95-K103 HydrophobicContact CZ2-CD 4.28Å; W95-K103 HydrophobicContact CZ2-CG 3.84Å; W95-K103 HydrophobicContact CZ3-CG 4.49Å; W95-K103 WeakPolarHBondContact O-CE 3.47Å; W95-K103 PolarHBondContact O-NZ 2.78Å; L98-K103 HydrophobicContact CB-CD 4.44Å; L98-K103 HydrophobicContact CB-CG 3.76Å; L98-K103 HydrophobicContact CD1-CG 4.41Å; L98-K103 WeakPolarHBondContact O-CE 3.29Å; L98-K103 PolarHBondContact O-NZ 3.01Å; L98-K103 VanDerWaalsContact O-NZ 3.11Å; D99-K103 PolarHBondContact O-N 3.37Å; P100-K103 PolarHBondContact O-N 3.05Å; K103-Y106 PolarHBondContact O-N 2.98Å; K103-R107 WeakPolarHBondContact O-CG 3.15Å; K103-R107 PolarHBondContact O-N 3.36Å
104C76.8Confident77.1Confident8 Ų851.2 Ų51.25%0.05427%0.272CS..Hα-helixtrans-65.7-43.2175.6-68.30000112.3P100 A101 Q102 Y106 R107 S108 C182P100-C104 PolarHBondContact O-N 3.27Å; P100-C104 PolarHBondContact O-SG 3.43Å; A101-C104 PolarHBondContact O-N 3.21Å; Q102-C104 VanDerWaalsContact C-N 3.3Å; Q102-C104 PolarHBondContact O-N 3.14Å; C104-Y106 VanDerWaalsContact C-N 3.35Å; C104-R107 PolarHBondContact O-N 2.95Å; C104-S108 PolarHBondContact O-N 3.44Å; C104-S108 PolarHBondContact O-OG 3.35Å; C104-C182 HydrophobicContact CB-CB 4.27Å
105L77.9Confident77.5Confident84 Ų8451.7 Ų51.744%0.4428%0.281SS..Hα-helixtrans-61.9-44.9176.7-174.961.8000110.9L65 A101 Q102 R107 S108 V109L65-L105 HydrophobicContact CD2-CD2 3.75Å; L65-L105 HydrophobicContact CD2-CG 4.01Å; A101-L105 WeakPolarHBondContact O-CB 3.4Å; A101-L105 PolarHBondContact O-N 2.84Å; Q102-L105 PolarHBondContact O-N 3.47Å; L105-R107 PolarHBondContact O-N 3.23Å; L105-S108 PolarHBondContact O-N 2.96Å; L105-V109 HydrophobicContact CD1-CG2 4.14Å; L105-V109 HydrophobicContact CG-CG2 4.33Å; L105-V109 WeakPolarHBondContact O-CB 2.91Å; L105-V109 WeakPolarHBondContact O-CG2 3.46Å; L105-V109 PolarHBondContact O-N 3.26Å
106Y80.1Confident77.7Confident15 Ų1554.8 Ų54.86%0.05930%0.299CS..Hα-helixtrans-55-52.6173.4176.3-100.1000111.7F87 V88 F90 W95 Q102 K103 C104 S108 V109 M110 L139F87-Y106 WeakPolarHBondContact CE2-OH 3.28Å; F87-Y106 WeakPolarHBondContact CZ-OH 3.27Å; V88-Y106 HydrophobicContact CB-CE2 4.13Å; V88-Y106 VanDerWaalsContact O-CE2 3.23Å; V88-Y106 WeakPolarHBondContact O-CE2 3.31Å; V88-Y106 PolarHBondContact O-OH 2.93Å; F90-Y106 HydrophobicContact CD2-CD2 4.09Å; F90-Y106 AromaticContact CD2-CE2 3.81Å; F90-Y106 HydrophobicContact CD2-CE2 3.81Å; F90-Y106 AromaticContact CE2-CD2 3.45Å; F90-Y106 HydrophobicContact CE2-CD2 3.45Å; F90-Y106 VanDerWaalsContact CE2-CD2 3.45Å; F90-Y106 AromaticContact CE2-CE2 3.54Å; F90-Y106 HydrophobicContact CE2-CE2 3.54Å; F90-Y106 HydrophobicContact CE2-CG 4.16Å; W95-Y106 AromaticContact CH2-CD1 3.42Å; W95-Y106 HydrophobicContact CH2-CD1 3.42Å; W95-Y106 VanDerWaalsContact CH2-CD1 3.42Å; W95-Y106 AromaticContact CH2-CE1 3.98Å; W95-Y106 HydrophobicContact CH2-CE1 3.98Å; W95-Y106 HydrophobicContact CH2-CG 4.12Å; W95-Y106 AromaticContact CZ3-CD1 3.32Å; W95-Y106 HydrophobicContact CZ3-CD1 3.32Å; W95-Y106 AromaticContact CZ3-CE1 3.69Å; W95-Y106 HydrophobicContact CZ3-CE1 3.69Å; W95-Y106 AromaticContact CZ3-CG 3.75Å; W95-Y106 HydrophobicContact CZ3-CG 3.75Å; Q102-Y106 WeakPolarHBondContact O-CB 3.42Å; Q102-Y106 PolarHBondContact O-N 3.39Å; K103-Y106 PolarHBondContact O-N 2.98Å; C104-Y106 VanDerWaalsContact C-N 3.35Å; Y106-S108 PolarHBondContact O-N 3.44Å; Y106-V109 PolarHBondContact O-N 2.94Å; Y106-M110 HydrophobicContact CD1-CG 4.11Å; Y106-M110 HydrophobicContact CD2-CG 3.76Å; Y106-M110 HydrophobicContact CD2-SD 4.39Å; Y106-M110 HydrophobicContact CE1-CG 3.89Å; Y106-M110 HydrophobicContact CE2-CG 3.54Å; Y106-M110 HydrophobicContact CE2-SD 3.92Å; Y106-M110 HydrophobicContact CG-CG 4.11Å; Y106-M110 WeakPolarHBondContact O-CB 3.4Å; Y106-M110 WeakPolarHBondContact O-CG 3.35Å; Y106-M110 PolarHBondContact O-N 2.98Å; Y106-L139 HydrophobicContact CD1-CD1 4.11Å; Y106-L139 HydrophobicContact CE1-CD1 3.66Å
107R78.5Confident77.9Confident27 Ų2750.4 Ų50.410%0.10228%0.278CS..Hα-helixtrans-55.3-43.8178.3-67.4-159.7175.9110-19.4112K103 C104 L105 L111 L133 E137K103-R107 WeakPolarHBondContact O-CG 3.15Å; K103-R107 PolarHBondContact O-N 3.36Å; C104-R107 PolarHBondContact O-N 2.95Å; L105-R107 PolarHBondContact O-N 3.23Å; R107-L111 WeakPolarHBondContact O-CB 3.26Å; R107-L111 VanDerWaalsContact O-CG 3.29Å; R107-L111 WeakPolarHBondContact O-CG 3.41Å; R107-L111 PolarHBondContact O-N 3.42Å; R107-L111 VanDerWaalsContact O-N 3.1Å; R107-L133 HydrophobicContact CB-CD2 3.9Å; R107-L133 HydrophobicContact CG-CD2 3.5Å; R107-L133 VanDerWaalsContact CG-CD2 3.5Å; R107-E137 PolarHBondContact NH2-O 2.89Å
108S75.6Confident77.8Confident57 Ų5747.8 Ų47.840%0.39927%0.266SS..Hα-helixtrans-65.9-49.8-177.3-52.50000111.3C104 L105 Y106 M110 L111 E112C104-S108 PolarHBondContact O-N 3.44Å; C104-S108 PolarHBondContact O-OG 3.35Å; L105-S108 PolarHBondContact O-N 2.96Å; Y106-S108 PolarHBondContact O-N 3.44Å; S108-M110 VanDerWaalsContact C-N 3.34Å; S108-M110 PolarHBondContact O-N 2.99Å; S108-L111 PolarHBondContact O-N 2.91Å; S108-E112 WeakPolarHBondContact O-CB 3.37Å; S108-E112 PolarHBondContact O-N 2.88Å
109V77.9Confident77.9Confident44 Ų4451.6 Ų51.627%0.26729%0.294SS..Hα-helixtrans-62.4-40.5178.8171.60000111.3L65 L105 Y106 E112 N113L65-V109 HydrophobicContact CD2-CG2 4.12Å; L105-V109 HydrophobicContact CD1-CG2 4.14Å; L105-V109 HydrophobicContact CG-CG2 4.33Å; L105-V109 WeakPolarHBondContact O-CB 2.91Å; L105-V109 WeakPolarHBondContact O-CG2 3.46Å; L105-V109 PolarHBondContact O-N 3.26Å; Y106-V109 PolarHBondContact O-N 2.94Å; V109-E112 PolarHBondContact O-N 3.34Å; V109-N113 VanDerWaalsContact O-CB 3.31Å; V109-N113 WeakPolarHBondContact O-CB 3.23Å; V109-N113 PolarHBondContact O-N 3.1Å; V109-N113 PolarHBondContact O-ND2 3.36Å
110M81.7Confident77.9Confident1 Ų152.4 Ų52.41%0.00530%0.298CS..Hα-helixtrans-69.6-35.8-179.2-66.8-50.8-73.800113.3F83 F87 Y106 S108 Y114 L133F83-M110 HydrophobicContact CE1-CE 4.26Å; F83-M110 HydrophobicContact CE2-CE 4.13Å; F83-M110 HydrophobicContact CZ-CE 3.52Å; F87-M110 HydrophobicContact CB-CE 4.02Å; F87-M110 HydrophobicContact CD2-CE 3.09Å; F87-M110 HydrophobicContact CE2-CE 3.7Å; F87-M110 HydrophobicContact CG-CE 3.87Å; Y106-M110 HydrophobicContact CD1-CG 4.11Å; Y106-M110 HydrophobicContact CD2-CG 3.76Å; Y106-M110 HydrophobicContact CD2-SD 4.39Å; Y106-M110 HydrophobicContact CE1-CG 3.89Å; Y106-M110 HydrophobicContact CE2-CG 3.54Å; Y106-M110 HydrophobicContact CE2-SD 3.92Å; Y106-M110 HydrophobicContact CG-CG 4.11Å; Y106-M110 WeakPolarHBondContact O-CB 3.4Å; Y106-M110 WeakPolarHBondContact O-CG 3.35Å; Y106-M110 PolarHBondContact O-N 2.98Å; S108-M110 VanDerWaalsContact C-N 3.34Å; S108-M110 PolarHBondContact O-N 2.99Å; M110-Y114 PolarHBondContact O-N 3.42Å; M110-Y114 VanDerWaalsContact O-N 3.12Å; M110-L133 HydrophobicContact CB-CD1 3.63Å; M110-L133 HydrophobicContact CG-CD1 4.46Å
111L76.6Confident77.5Confident54 Ų5451.8 Ų51.828%0.28330%0.304SS..Hα-helixtrans-70.9-40.8174.1-72.7173.2000111.9R107 S108 Y114 S115 I130 L133 E134R107-L111 WeakPolarHBondContact O-CB 3.26Å; R107-L111 VanDerWaalsContact O-CG 3.29Å; R107-L111 WeakPolarHBondContact O-CG 3.41Å; R107-L111 PolarHBondContact O-N 3.42Å; R107-L111 VanDerWaalsContact O-N 3.1Å; S108-L111 PolarHBondContact O-N 2.91Å; L111-Y114 PolarHBondContact O-N 3.48Å; L111-S115 PolarHBondContact O-N 2.79Å; L111-I130 HydrophobicContact CD2-CG2 4.5Å; L111-L133 HydrophobicContact CD2-CB 3.87Å; L111-L133 HydrophobicContact CG-CB 4.18Å; L111-E134 HydrophobicContact CD2-CB 4.46Å; L111-E134 HydrophobicContact CD2-CG 3.49Å; L111-E134 VanDerWaalsContact CD2-CG 3.49Å
112E80.7Confident77.3Confident122 Ų12253.9 Ų53.957%0.5730%0.3SS*.Hα-helixtrans-63.4-44.4175.9-172.7171.5-178.900111.3S108 V109 Y114 S115 N116S108-E112 WeakPolarHBondContact O-CB 3.37Å; S108-E112 PolarHBondContact O-N 2.88Å; V109-E112 PolarHBondContact O-N 3.34Å; E112-Y114 VanDerWaalsContact C-N 3.33Å; E112-Y114 PolarHBondContact O-N 2.79Å; E112-S115 WeakPolarHBondContact O-CB 3.27Å; E112-S115 PolarHBondContact O-N 3.35Å; E112-N116 PolarHBondContact O-N 2.78Å; E112-N116 PolarHBondContact O-ND2 3.43Å
113N81.4Confident76.7Confident47 Ų4757.2 Ų57.225%0.25132%0.316SS..Hα-helixtrans-59.7-42.1174.9-74.4-9.6000112.2V86 V109 N116 L117V86-N113 HydrophobicContact CG2-CB 4.18Å; V109-N113 VanDerWaalsContact O-CB 3.31Å; V109-N113 WeakPolarHBondContact O-CB 3.23Å; V109-N113 PolarHBondContact O-N 3.1Å; V109-N113 PolarHBondContact O-ND2 3.36Å; N113-N116 PolarHBondContact O-N 2.81Å; N113-L117 WeakPolarHBondContact O-CG 3.47Å; N113-L117 PolarHBondContact O-N 3.26Å
114Y78.6Confident75.7Confident39 Ų3964.8 Ų64.815%0.15335%0.352CS..Hα-helixtrans-64.3-44.5174.8177.8-104.2000112.3F83 M110 L111 E112 N116 L117 V118 K126 I130F83-Y114 HydrophobicContact CD2-CD2 4.2Å; M110-Y114 PolarHBondContact O-N 3.42Å; M110-Y114 VanDerWaalsContact O-N 3.12Å; L111-Y114 PolarHBondContact O-N 3.48Å; E112-Y114 VanDerWaalsContact C-N 3.33Å; E112-Y114 PolarHBondContact O-N 2.79Å; Y114-N116 VanDerWaalsContact C-N 3.28Å; Y114-N116 PolarHBondContact O-N 2.79Å; Y114-L117 PolarHBondContact O-N 3.21Å; Y114-V118 HydrophobicContact CD1-CG2 4.14Å; Y114-V118 HydrophobicContact CD2-CG2 4.43Å; Y114-V118 HydrophobicContact CE1-CG2 3.7Å; Y114-V118 HydrophobicContact CE2-CG2 4Å; Y114-V118 HydrophobicContact CG-CG2 4.49Å; Y114-V118 WeakPolarHBondContact O-CG2 3.18Å; Y114-V118 PolarHBondContact O-N 3.08Å; Y114-K126 HydrophobicContact CE2-CG 4.45Å; Y114-K126 WeakPolarHBondContact OH-CB 3.46Å; Y114-K126 WeakPolarHBondContact OH-CG 3.48Å; Y114-I130 HydrophobicContact CD1-CG2 3.6Å; Y114-I130 HydrophobicContact CD2-CB 4.49Å; Y114-I130 HydrophobicContact CD2-CD1 4.44Å; Y114-I130 HydrophobicContact CD2-CG1 3.85Å; Y114-I130 HydrophobicContact CD2-CG2 4.15Å; Y114-I130 HydrophobicContact CE1-CG2 3.8Å; Y114-I130 HydrophobicContact CE2-CG1 4.47Å; Y114-I130 HydrophobicContact CE2-CG2 4.34Å; Y114-I130 HydrophobicContact CG-CB 4.47Å; Y114-I130 HydrophobicContact CG-CD1 4.11Å; Y114-I130 HydrophobicContact CG-CG1 3.92Å; Y114-I130 HydrophobicContact CG-CG2 3.78Å
115S80Confident75Confident64 Ų6470.2 Ų70.245%0.44839%0.385SS..Hα-helixtrans-57.8-42.9175.5-173.60000111.4L111 E112 L117 V118 S119L111-S115 PolarHBondContact O-N 2.79Å; E112-S115 WeakPolarHBondContact O-CB 3.27Å; E112-S115 PolarHBondContact O-N 3.35Å; S115-L117 PolarHBondContact O-N 2.88Å; S115-V118 WeakPolarHBondContact O-CB 3.22Å; S115-V118 PolarHBondContact O-N 3.38Å; S115-S119 PolarHBondContact O-N 2.91Å; S115-S119 PolarHBondContact O-OG 2.99Å; S115-S119 VanDerWaalsContact O-OG 3.1Å
116N81.4Confident74.5Confident76 Ų7670 Ų7041%0.40638%0.38SS..Hα-helixtrans-63.4-42.4177.6-68.9-24.4000111.7E112 N113 Y114 V118 S119 L120E112-N116 PolarHBondContact O-N 2.78Å; E112-N116 PolarHBondContact O-ND2 3.43Å; N113-N116 PolarHBondContact O-N 2.81Å; Y114-N116 VanDerWaalsContact C-N 3.28Å; Y114-N116 PolarHBondContact O-N 2.79Å; N116-V118 VanDerWaalsContact C-N 3.35Å; N116-V118 PolarHBondContact O-N 2.82Å; N116-S119 PolarHBondContact O-N 3.29Å; N116-L120 WeakPolarHBondContact O-CB 3.43Å; N116-L120 VanDerWaalsContact O-CG 3.24Å; N116-L120 WeakPolarHBondContact O-CG 3.47Å; N116-L120 PolarHBondContact O-N 2.87Å
117L78.1Confident74Confident9 Ų970.8 Ų70.85%0.04739%0.387CS..Hα-helixtrans-63.6-40175.1-72.1172.1000112.5L81 F83 V86 N113 Y114 S115 L120 G121 Y122L81-L117 HydrophobicContact CB-CD2 4.25Å; F83-L117 HydrophobicContact CB-CD1 4.02Å; F83-L117 HydrophobicContact CD2-CD1 3.91Å; F83-L117 HydrophobicContact CG-CD1 4.48Å; V86-L117 HydrophobicContact CG2-CD1 3.62Å; V86-L117 HydrophobicContact CG2-CG 4.47Å; N113-L117 WeakPolarHBondContact O-CG 3.47Å; N113-L117 PolarHBondContact O-N 3.26Å; Y114-L117 PolarHBondContact O-N 3.21Å; S115-L117 PolarHBondContact O-N 2.88Å; L117-L120 PolarHBondContact O-N 3.01Å; L117-G121 PolarHBondContact O-N 2.86Å; L117-Y122 HydrophobicContact CD2-CD2 4.29Å; L117-Y122 PolarHBondContact O-N 3.45Å
118V75.1Confident73.7Confident37 Ų3775.2 Ų75.222%0.22441%0.413CS..Hα-helixtrans-61-45.6173.9167.70000110.4Y114 S115 N116 L120 G121 Q123Y114-V118 HydrophobicContact CD1-CG2 4.14Å; Y114-V118 HydrophobicContact CD2-CG2 4.43Å; Y114-V118 HydrophobicContact CE1-CG2 3.7Å; Y114-V118 HydrophobicContact CE2-CG2 4Å; Y114-V118 HydrophobicContact CG-CG2 4.49Å; Y114-V118 WeakPolarHBondContact O-CG2 3.18Å; Y114-V118 PolarHBondContact O-N 3.08Å; S115-V118 WeakPolarHBondContact O-CB 3.22Å; S115-V118 PolarHBondContact O-N 3.38Å; N116-V118 VanDerWaalsContact C-N 3.35Å; N116-V118 PolarHBondContact O-N 2.82Å; V118-L120 VanDerWaalsContact C-N 3.29Å; V118-L120 PolarHBondContact O-N 3.45Å; V118-G121 PolarHBondContact O-N 2.54Å; V118-Q123 HydrophobicContact CG1-CG 4.49Å; V118-Q123 VanDerWaalsContact CG1-NE2 3.34Å; V118-Q123 PolarHBondContact O-NE2 2.68Å
119S75.5Confident73.3Confident97 Ų9774.3 Ų74.368%0.67840%0.403SS*.Hα-helixtrans-63.7-31.5176.4-64.20000113.4S115 N116 G121S115-S119 PolarHBondContact O-N 2.91Å; S115-S119 PolarHBondContact O-OG 2.99Å; S115-S119 VanDerWaalsContact O-OG 3.1Å; N116-S119 PolarHBondContact O-N 3.29Å; S119-G121 PolarHBondContact O-N 3.32Å
120L76.3Confident73Confident114 Ų11472.2 Ų72.260%0.59739%0.39SS*.THydrogen-bonded Turntrans-79.2-0.9174.4-68.1172.2000113.3N116 L117 V118 Y122N116-L120 WeakPolarHBondContact O-CB 3.43Å; N116-L120 VanDerWaalsContact O-CG 3.24Å; N116-L120 WeakPolarHBondContact O-CG 3.47Å; N116-L120 PolarHBondContact O-N 2.87Å; L117-L120 PolarHBondContact O-N 3.01Å; V118-L120 VanDerWaalsContact C-N 3.29Å; V118-L120 PolarHBondContact O-N 3.45Å; L120-Y122 VanDerWaalsContact C-N 3.34Å; L120-Y122 HydrophobicContact CB-CD2 3.49Å; L120-Y122 VanDerWaalsContact CB-CD2 3.49Å; L120-Y122 HydrophobicContact CB-CE2 3.72Å; L120-Y122 HydrophobicContact CD1-CD2 4.36Å; L120-Y122 HydrophobicContact CD1-CE2 4.32Å
121G68.3Low72.6Confident55 Ų5577.4 Ų77.457%0.56741%0.413SS*.THydrogen-bonded Turntrans81.98179.400000114.5L117 V118 S119 Q123L117-G121 PolarHBondContact O-N 2.86Å; V118-G121 PolarHBondContact O-N 2.54Å; S119-G121 PolarHBondContact O-N 3.32Å; G121-Q123 PolarHBondContact O-N 3.36Å
122Y68.8Low72.3Confident100 Ų10077.3 Ų77.339%0.39241%0.41SS..  trans-85.255.2178.8-63.2-67.9000112.2P80 L81 L117 L120P80-Y122 HydrophobicContact CB-CD1 4.12Å; P80-Y122 HydrophobicContact CB-CE1 3.94Å; L81-Y122 HydrophobicContact CB-CD2 4.32Å; L81-Y122 HydrophobicContact CB-CE2 4.26Å; L81-Y122 HydrophobicContact CD1-CE2 4.49Å; L81-Y122 WeakPolarHBondContact O-CB 3.48Å; L117-Y122 HydrophobicContact CD2-CD2 4.29Å; L117-Y122 PolarHBondContact O-N 3.45Å; L120-Y122 VanDerWaalsContact C-N 3.34Å; L120-Y122 HydrophobicContact CB-CD2 3.49Å; L120-Y122 VanDerWaalsContact CB-CD2 3.49Å; L120-Y122 HydrophobicContact CB-CE2 3.72Å; L120-Y122 HydrophobicContact CD1-CD2 4.36Å; L120-Y122 HydrophobicContact CD1-CE2 4.32Å
123Q62.9Low71.9Confident117 Ų11771.7 Ų71.755%0.54738%0.384SS..  trans-109.595.8-179.21-176-8.400109.6V118 G121V118-Q123 HydrophobicContact CG1-CG 4.49Å; V118-Q123 VanDerWaalsContact CG1-NE2 3.34Å; V118-Q123 PolarHBondContact O-NE2 2.68Å; G121-Q123 PolarHBondContact O-N 3.36Å
124H56.9Low71.4Confident193 Ų19373.9 Ų73.989%0.89439%0.393SS*.SBendtrans-102.1-44.7173.1-113.364.2000112
125T62.5Low70.8Confident122 Ų12276.9 Ų76.975%0.74841%0.408SS*.  trans-156.1136.3174.7-44.50000108.5P127T125-P127 VanDerWaalsContact O-CD 3.26Å; T125-P127 WeakPolarHBondContact O-CD 3.33Å
126K68.3Low69.5Low79 Ų7975.2 Ų75.234%0.34340%0.401SS..  trans-69.3115.6171.5-173.9172-163.2162.70108.6Y114 I130 E134Y114-K126 HydrophobicContact CE2-CG 4.45Å; Y114-K126 WeakPolarHBondContact OH-CB 3.46Å; Y114-K126 WeakPolarHBondContact OH-CG 3.48Å; K126-I130 HydrophobicContact CD-CG2 4.44Å; K126-I130 HydrophobicContact CG-CB 4.33Å; K126-I130 HydrophobicContact CG-CG2 4.05Å; K126-E134 VanDerWaalsContact CE-CD 3.48Å; K126-E134 WeakPolarHBondContact CE-OE1 3.44Å; K126-E134 VanDerWaalsContact CE-OE2 3.27Å; K126-E134 WeakPolarHBondContact CE-OE2 3.48Å; K126-E134 IonicContact NZ-OE1 2.68Å; K126-E134 PolarHBondContact NZ-OE1 3.28Å; K126-E134 IonicContact NZ-OE2 2.54Å; K126-E134 PolarHBondContact NZ-OE2 3.38Å
127P70.1Confident68.1Low32 Ų3276.4 Ų76.421%0.20841%0.405CS..  trans-72.9144.7-177.323.9-23.2000110.2F83 T125 I129 I130 F131F83-P127 HydrophobicContact CB-CG 4.26Å; F83-P127 HydrophobicContact CD1-CB 4.34Å; F83-P127 HydrophobicContact CD1-CG 3.49Å; F83-P127 VanDerWaalsContact CD1-CG 3.49Å; F83-P127 HydrophobicContact CE1-CG 4Å; F83-P127 HydrophobicContact CG-CG 3.91Å; T125-P127 VanDerWaalsContact O-CD 3.26Å; T125-P127 WeakPolarHBondContact O-CD 3.33Å; P127-I129 HydrophobicContact CB-CG2 4.24Å; P127-I129 HydrophobicContact CG-CG2 4.44Å; P127-I129 PolarHBondContact O-N 3.27Å; P127-I130 HydrophobicContact CG-CB 4.3Å; P127-I130 HydrophobicContact CG-CG1 3.8Å; P127-I130 WeakPolarHBondContact O-CB 3.34Å; P127-I130 PolarHBondContact O-N 3.5Å; P127-F131 PolarHBondContact O-N 2.94Å
128D70.6Confident66.8Low121 Ų12183.9 Ų83.965%0.64744%0.439SS*.Hα-helixtrans-54.3-30-175-66.2-32.3000113.2F131 K132D128-F131 WeakPolarHBondContact O-CB 3.38Å; D128-F131 PolarHBondContact O-N 3.19Å; D128-K132 WeakPolarHBondContact O-CG 3.36Å; D128-K132 PolarHBondContact O-N 2.93Å
129I66.9Low65.3Low37 Ų3782.2 Ų82.219%0.1943%0.429CS..Hα-helixtrans-66.5-35.6176.7-166.7149.3000112.8F83 F87 P127 K132 L133 L139F83-I129 HydrophobicContact CD1-CG2 4.5Å; F83-I129 HydrophobicContact CE1-CG2 3.66Å; F83-I129 HydrophobicContact CZ-CG2 4.42Å; F87-I129 HydrophobicContact CE2-CD1 3.39Å; F87-I129 HydrophobicContact CE2-CG1 4.14Å; F87-I129 HydrophobicContact CE2-CG2 4.29Å; F87-I129 HydrophobicContact CZ-CD1 3.46Å; F87-I129 VanDerWaalsContact CZ-CD1 3.46Å; P127-I129 HydrophobicContact CB-CG2 4.24Å; P127-I129 HydrophobicContact CG-CG2 4.44Å; P127-I129 PolarHBondContact O-N 3.27Å; I129-K132 PolarHBondContact O-N 3.2Å; I129-L133 HydrophobicContact CG1-CD1 4.5Å; I129-L133 WeakPolarHBondContact O-CB 3.3Å; I129-L133 VanDerWaalsContact O-CG 3.23Å; I129-L133 WeakPolarHBondContact O-CG 3.15Å; I129-L133 PolarHBondContact O-N 3.33Å; I129-L139 HydrophobicContact CG1-CD2 4.07Å
130I73.4Confident63.6Low0 Ų081.9 Ų81.90%043%0.426CS..Hα-helixtrans-69.3-39.1173.7-69.6-56.8000110.3F83 L111 Y114 K126 P127 K132 L133 E134F83-I130 HydrophobicContact CD2-CD1 4.43Å; F83-I130 HydrophobicContact CD2-CG1 4.4Å; F83-I130 HydrophobicContact CE1-CD1 4.05Å; F83-I130 HydrophobicContact CE1-CG1 3.95Å; F83-I130 HydrophobicContact CE2-CD1 3.48Å; F83-I130 VanDerWaalsContact CE2-CD1 3.48Å; F83-I130 HydrophobicContact CE2-CG1 3.87Å; F83-I130 HydrophobicContact CZ-CD1 3.24Å; F83-I130 HydrophobicContact CZ-CG1 3.61Å; L111-I130 HydrophobicContact CD2-CG2 4.5Å; Y114-I130 HydrophobicContact CD1-CG2 3.6Å; Y114-I130 HydrophobicContact CD2-CB 4.49Å; Y114-I130 HydrophobicContact CD2-CD1 4.44Å; Y114-I130 HydrophobicContact CD2-CG1 3.85Å; Y114-I130 HydrophobicContact CD2-CG2 4.15Å; Y114-I130 HydrophobicContact CE1-CG2 3.8Å; Y114-I130 HydrophobicContact CE2-CG1 4.47Å; Y114-I130 HydrophobicContact CE2-CG2 4.34Å; Y114-I130 HydrophobicContact CG-CB 4.47Å; Y114-I130 HydrophobicContact CG-CD1 4.11Å; Y114-I130 HydrophobicContact CG-CG1 3.92Å; Y114-I130 HydrophobicContact CG-CG2 3.78Å; K126-I130 HydrophobicContact CD-CG2 4.44Å; K126-I130 HydrophobicContact CG-CB 4.33Å; K126-I130 HydrophobicContact CG-CG2 4.05Å; P127-I130 HydrophobicContact CG-CB 4.3Å; P127-I130 HydrophobicContact CG-CG1 3.8Å; P127-I130 WeakPolarHBondContact O-CB 3.34Å; P127-I130 PolarHBondContact O-N 3.5Å; I130-K132 VanDerWaalsContact C-N 3.32Å; I130-K132 PolarHBondContact O-N 2.88Å; I130-L133 HydrophobicContact CD1-CD1 3.93Å; I130-L133 PolarHBondContact O-N 3.1Å; I130-E134 HydrophobicContact CG2-CG 4.44Å; I130-E134 WeakPolarHBondContact O-CG 3.35Å; I130-E134 PolarHBondContact O-N 3.12Å
131F72Confident61.9Low110 Ų11078.4 Ų78.448%0.48241%0.407SS..Hα-helixtrans-62-39.6175.5-176.2-106.3000112.4P127 D128 Q135P127-F131 PolarHBondContact O-N 2.94Å; D128-F131 WeakPolarHBondContact O-CB 3.38Å; D128-F131 PolarHBondContact O-N 3.19Å; F131-Q135 VanDerWaalsContact CD1-NE2 3.27Å; F131-Q135 WeakPolarHBondContact O-CG 3.26Å; F131-Q135 PolarHBondContact O-N 2.89Å; F131-Q135 PolarHBondContact O-NE2 3.4Å
132K70.3Confident60.3Low52 Ų5280.9 Ų80.923%0.22641%0.411CS..Hα-helixtrans-67.7-40173.2-71176.9173.6-174.70112.7D128 I129 I130 L139 C140D128-K132 WeakPolarHBondContact O-CG 3.36Å; D128-K132 PolarHBondContact O-N 2.93Å; I129-K132 PolarHBondContact O-N 3.2Å; I130-K132 VanDerWaalsContact C-N 3.32Å; I130-K132 PolarHBondContact O-N 2.88Å; K132-L139 HydrophobicContact CB-CD2 3.99Å; K132-C140 PolarHBondContact NZ-O 3.37Å
133L73Confident58.5Low4 Ų484.8 Ų84.82%0.02143%0.433CS..Hα-helixtrans-63.5-43.9178.2-80.1171.9000112.7R107 M110 L111 I129 I130 G136 L139R107-L133 HydrophobicContact CB-CD2 3.9Å; R107-L133 HydrophobicContact CG-CD2 3.5Å; R107-L133 VanDerWaalsContact CG-CD2 3.5Å; M110-L133 HydrophobicContact CB-CD1 3.63Å; M110-L133 HydrophobicContact CG-CD1 4.46Å; L111-L133 HydrophobicContact CD2-CB 3.87Å; L111-L133 HydrophobicContact CG-CB 4.18Å; I129-L133 HydrophobicContact CG1-CD1 4.5Å; I129-L133 WeakPolarHBondContact O-CB 3.3Å; I129-L133 VanDerWaalsContact O-CG 3.23Å; I129-L133 WeakPolarHBondContact O-CG 3.15Å; I129-L133 PolarHBondContact O-N 3.33Å; I130-L133 HydrophobicContact CD1-CD1 3.93Å; I130-L133 PolarHBondContact O-N 3.1Å; L133-G136 PolarHBondContact O-N 3.06Å; L133-L139 HydrophobicContact CD2-CD1 3.56Å; L133-L139 HydrophobicContact CD2-CD2 4.06Å; L133-L139 HydrophobicContact CD2-CG 3.93Å; L133-L139 HydrophobicContact CG-CD1 4.29Å; L133-L139 HydrophobicContact CG-CD2 4.05Å; L133-L139 HydrophobicContact CG-CG 4.47Å
134E70.3Confident57.1Low94 Ų9483.4 Ų83.444%0.43944%0.441SS..Hα-helixtrans-66.9-35.4179.7-76-179.8175.100113.5L111 K126 I130 G136L111-E134 HydrophobicContact CD2-CB 4.46Å; L111-E134 HydrophobicContact CD2-CG 3.49Å; L111-E134 VanDerWaalsContact CD2-CG 3.49Å; K126-E134 VanDerWaalsContact CE-CD 3.48Å; K126-E134 WeakPolarHBondContact CE-OE1 3.44Å; K126-E134 VanDerWaalsContact CE-OE2 3.27Å; K126-E134 WeakPolarHBondContact CE-OE2 3.48Å; K126-E134 IonicContact NZ-OE1 2.68Å; K126-E134 PolarHBondContact NZ-OE1 3.28Å; K126-E134 IonicContact NZ-OE2 2.54Å; K126-E134 PolarHBondContact NZ-OE2 3.38Å; I130-E134 HydrophobicContact CG2-CG 4.44Å; I130-E134 WeakPolarHBondContact O-CG 3.35Å; I130-E134 PolarHBondContact O-N 3.12Å; E134-G136 PolarHBondContact O-N 2.81Å
135Q65.3Low56.2Low101 Ų10183.5 Ų83.547%0.47244%0.442SS..THydrogen-bonded Turntrans-71.5-4.8177.8-72.2-177.6103.200112.9F131 E137F131-Q135 VanDerWaalsContact CD1-NE2 3.27Å; F131-Q135 WeakPolarHBondContact O-CG 3.26Å; F131-Q135 PolarHBondContact O-N 2.89Å; F131-Q135 PolarHBondContact O-NE2 3.4Å; Q135-E137 HydrophobicContact CB-CG 4.15Å; Q135-E137 PolarHBondContact O-N 3.01Å; Q135-E137 VanDerWaalsContact O-N 3.16Å
136G53.5Low54.6Low29 Ų2984.2 Ų84.230%0.29945%0.446SS..THydrogen-bonded Turntrans67.510.4-17800000113.2L133 E134L133-G136 PolarHBondContact O-N 3.06Å; E134-G136 PolarHBondContact O-N 2.81Å
137E52.8Low53.3Low102 Ų10286 Ų8648%0.47747%0.465SS..  trans-61.7139.6174.2-71-177.6162.900108.9R107 Q135 L139R107-E137 PolarHBondContact NH2-O 2.89Å; Q135-E137 HydrophobicContact CB-CG 4.15Å; Q135-E137 PolarHBondContact O-N 3.01Å; Q135-E137 VanDerWaalsContact O-N 3.16Å; E137-L139 PolarHBondContact O-N 3.26Å; E137-L139 VanDerWaalsContact O-N 3.09Å
138E49.6Very low51.7Low165 Ų16591 Ų9177%0.77149%0.49SS*.  trans-56.3117.8162.1-75.4-170.1125.400107.7C140E138-C140 PolarHBondContact O-N 3.04Å
139L44.2Very low49.8Very low3 Ų394 Ų942%0.01650%0.5CS..  trans-55.387.8-179.4-81.1171.8000109W95 Y106 I129 K132 L133 E137 M141W95-L139 HydrophobicContact CH2-CD1 3.72Å; W95-L139 HydrophobicContact CZ2-CB 4.15Å; W95-L139 HydrophobicContact CZ2-CD1 3.83Å; W95-L139 HydrophobicContact CZ2-CG 4.49Å; W95-L139 HydrophobicContact CZ3-CD1 4.33Å; Y106-L139 HydrophobicContact CD1-CD1 4.11Å; Y106-L139 HydrophobicContact CE1-CD1 3.66Å; I129-L139 HydrophobicContact CG1-CD2 4.07Å; K132-L139 HydrophobicContact CB-CD2 3.99Å; L133-L139 HydrophobicContact CD2-CD1 3.56Å; L133-L139 HydrophobicContact CD2-CD2 4.06Å; L133-L139 HydrophobicContact CD2-CG 3.93Å; L133-L139 HydrophobicContact CG-CD1 4.29Å; L133-L139 HydrophobicContact CG-CD2 4.05Å; L133-L139 HydrophobicContact CG-CG 4.47Å; E137-L139 PolarHBondContact O-N 3.26Å; E137-L139 VanDerWaalsContact O-N 3.09Å; L139-M141 HydrophobicContact CB-CG 4.21Å; L139-M141 PolarHBondContact O-N 2.88Å
140C40.6Very low48.4Very low89 Ų8998.1 Ų98.160%0.60153%0.528SS*.  trans-64.783.9151.3-95.20000104.7K132 E138 V142K132-C140 PolarHBondContact NZ-O 3.37Å; E138-C140 PolarHBondContact O-N 3.04Å; C140-V142 PolarHBondContact O-N 3.4Å
141M38.8Very low46.2Very low41 Ų41104.2 Ų104.220%0.20257%0.569CS.*  trans-53.3133.1173.2-70.5-154.3-56.100107.5F90 T91 W95 L139 Q143F90-M141 HydrophobicContact CB-CE 4.41Å; F90-M141 WeakPolarHBondContact O-CE 3.24Å; T91-M141 VanDerWaalsContact C-CE 3.46Å; T91-M141 WeakPolarHBondContact O-CE 3.49Å; W95-M141 HydrophobicContact CB-CE 3.94Å; W95-M141 HydrophobicContact CG-CE 4.41Å; L139-M141 HydrophobicContact CB-CG 4.21Å; L139-M141 PolarHBondContact O-N 2.88Å; M141-Q143 PolarHBondContact O-N 3.27Å
142V35.6Very low44.4Very low107 Ų107104.6 Ų104.665%0.64858%0.582SS**  trans-54.7107.8-177.2172.20000108.1C140 A144C140-V142 PolarHBondContact O-N 3.4Å; V142-A144 PolarHBondContact O-N 3.48Å
143Q31.5Very low42.8Very low183 Ų183109.4 Ų109.486%0.85561%0.609SS**PPolyproline II helixtrans-65.4124.4163.7-162.1174.321.200106.7M141 Q145M141-Q143 PolarHBondContact O-N 3.27Å; Q143-Q145 PolarHBondContact O-N 2.93Å
144A33.5Very low41.2Very low87 Ų87115.8 Ų115.872%0.71964%0.642SS**PPolyproline II helixtrans-50.1137.4171.200000110V142 V146V142-A144 PolarHBondContact O-N 3.48Å; A144-V146 PolarHBondContact O-N 3.4Å
145Q36.8Very low39.2Very low196 Ų196120 Ų12092%0.91666%0.659SS**PPolyproline II helixtrans-51.7128.3-174.2-65.4163.44900113.1Q143Q143-Q145 PolarHBondContact O-N 2.93Å
146V29.9Very low38Very low137 Ų137119.8 Ų119.883%0.8368%0.675SS**  trans-138132.7147.2-178.30000106.8A144A144-V146 PolarHBondContact O-N 3.4Å
147P40.8Very low36.6Very low115 Ų115121.9 Ų121.975%0.74770%0.696SS**  trans-81.6159.7-166.833.2-34.5000112.4
148N36.1Very low35.9Very low138 Ų138126.9 Ų126.974%0.73872%0.716SS**  trans76.595.7164.9-118.6-41.8000115.7
149Q31.6Very low34.9Very low183 Ų183124.7 Ų124.786%0.85572%0.719SS**  179.6138.895.2-91.316988.700111.3
150T36.4Very low34.1Very low125 Ų125134.1 Ų134.177%0.76776%0.76SS**  trans-42.3140.1-179-48.80000115.4
151C27.8Very low33.7Very low127 Ų127134.5 Ų134.586%0.85877%0.769SS**  trans-155.1149.6140.3-93.90000110.2
152P34.5Very low33.3Very low118 Ų118142.3 Ų142.377%0.76680%0.802SS**  -91.4140.8-126.732.7-34.7000115
153I35.8Very low33.4Very low153 Ų153143 Ų14379%0.78581%0.807SS**  trans-65.5145161.1-61.8168.6000108.6
154L39.1Very low33.4Very low138 Ų138141.8 Ų141.872%0.72381%0.805SS**  trans148.4126.3135.8-78.5176.5000109
155K29.6Very low33.2Very low183 Ų183142.3 Ų142.380%0.79681%0.81SS**  cis-151152.523.7-67.8-159.9176.1178.10114.3
156A39.2Very low32.7Very low97 Ų97136.4 Ų136.480%0.80280%0.801SS**  trans-49.4142.616300000114.4
157G25.2Very low32.8Very low72 Ų72138.5 Ų138.574%0.74281%0.806SS**  trans-138.187154.500000109.1S159G157-S159 PolarHBondContact O-N 3.28Å
158K36.6Very low33Very low208 Ų208139.6 Ų139.690%0.90481%0.811SS**  trans-63118.9165.6-74173.7175.2171.20107.9
159S29.1Very low32.9Very low118 Ų118138.7 Ų138.783%0.82582%0.815SS**  trans-125.3112.8159.6-64.60000109.1G157G157-S159 PolarHBondContact O-N 3.28Å
160K28.6Very low33.1Very low202 Ų202132.8 Ų132.888%0.87880%0.804SS**  trans-56.3144.3176.6-73.8179.2170.4178.60110.6K162K160-K162 PolarHBondContact O-N 3.36Å
161A31.8Very low33Very low97 Ų97136.1 Ų136.180%0.80281%0.811SS**  trans-49.6133.2162.400000111
162K29.5Very low33.6Very low204 Ų204134.1 Ų134.189%0.88781%0.811SS**  trans-121.9103.3158.9-168.5168.2-175.5174.50107.1K160K160-K162 PolarHBondContact O-N 3.36Å
163V38.5Very low33.6Very low123 Ų123135.9 Ų135.975%0.74581%0.813SS**  trans-86.2122.9164.7176.70000106.7
164L31.1Very low33.7Very low156 Ų156135.1 Ų135.182%0.81781%0.81SS**  176.5128.6123.7-94.8166.4000112.5
165A30.1Very low33.4Very low99 Ų99132.8 Ų132.882%0.81880%0.804SS**  trans67.6125.6140.300000121
166G26.2Very low34Very low71 Ų71127.4 Ų127.473%0.73279%0.794SS**  trans162.571.2158.400000117.4
167L32.1Very low33.9Very low181 Ų181128.2 Ų128.295%0.94879%0.794SS**  trans58145.6141.8-74.6149.3000123.4
168V44.9Very low34.5Very low139 Ų139133.1 Ų133.184%0.84280%0.795SS**  trans-78.7144.9-173.4165.40000112.9
169S32.5Very low34.3Very low119 Ų119125.5 Ų125.583%0.83276%0.763SS**  trans-167.7113.6141.7-159.40000106.7
170G37.4Very low35.1Very low59 Ų59123.9 Ų123.961%0.60875%0.748SS**  94.4114.587.300000108.4
171E34.3Very low36.1Very low195 Ų195118.4 Ų118.491%0.91173%0.734SS**  trans87.9103.6167.8-39.5-148.8145.900118.2L173E171-L173 PolarHBondContact O-N 3.04Å
172G38.7Very low36.6Very low85 Ų85114.9 Ų114.988%0.87670%0.702SS**SBend82.3-20.1123.200000121
173L35.7Very low37.3Very low154 Ų154107.7 Ų107.781%0.80668%0.677SS**  trans-134.2116.9177.6-109.678.1000110.6E171 C175E171-L173 PolarHBondContact O-N 3.04Å; L173-C175 PolarHBondContact O-N 3.13Å
174L37.1Very low37.6Very low137 Ų137104.2 Ų104.272%0.71766%0.658SS**  trans-60.8109.7168.3-143.877.5000107.4A176L174-A176 PolarHBondContact O-N 3.33Å
175C34.4Very low38.5Very low89 Ų89100 Ų10060%0.60164%0.635SS**  trans-52.1125-176.8-153.20000109.7L173 S177 K178L173-C175 PolarHBondContact O-N 3.13Å; C175-S177 PolarHBondContact O-N 3.01Å; C175-K178 PolarHBondContact O-N 3.24Å
176A40.5Very low39.1Very low71 Ų71100.7 Ų100.759%0.58763%0.625SS**G310 helixtrans-51.8-19.5-17900000113.3L174 K178 M179L174-A176 PolarHBondContact O-N 3.33Å; A176-K178 PolarHBondContact O-N 3.16Å; A176-M179 PolarHBondContact O-N 3.31Å
177S38.2Very low39.7Very low113 Ų113104.8 Ų104.879%0.7962%0.618SS**G310 helixtrans-68.7-8.1173.8-154.80000115.2C175C175-S177 PolarHBondContact O-N 3.01Å
178K37.5Very low39.9Very low176 Ų176104.3 Ų104.377%0.76560%0.604SS**G310 helixtrans-108.8-7.3174.5-71-171.9177.7177.30113.9C175 A176C175-K178 PolarHBondContact O-N 3.24Å; A176-K178 PolarHBondContact O-N 3.16Å
179M32.4Very low39.7Very low47 Ų47103.7 Ų103.723%0.23259%0.592CS.*SBendtrans-82.5123.5175.3-95.4156.342.700108.5A176 C183 W187A176-M179 PolarHBondContact O-N 3.31Å; M179-C183 HydrophobicContact CB-CB 3.65Å; M179-C183 HydrophobicContact CE-CB 4.14Å; M179-C183 HydrophobicContact CG-CB 3.41Å; M179-C183 VanDerWaalsContact CG-CB 3.41Å; M179-C183 HydrophobicContact SD-CB 4.29Å; M179-W187 HydrophobicContact CE-CB 3.92Å; M179-W187 HydrophobicContact CE-CD2 4.45Å; M179-W187 HydrophobicContact CE-CG 4.04Å
180T45.7Very low40Very low85 Ų85102.2 Ų102.252%0.52158%0.581SS.*  trans-53.8152.2168.652.40000108.5C182 C183T180-C182 PolarHBondContact O-N 3.05Å; T180-C183 PolarHBondContact O-N 2.95Å
181P48.8Very low40.1Very low87 Ų87104.8 Ų104.857%0.56558%0.58SS**Hα-helixtrans-50.5-29.9-178.8-27.633.9000113.4C184P181-C184 PolarHBondContact O-N 3.4Å
182C43.2Very low40.5Very low22 Ų22102.4 Ų102.415%0.14957%0.569CS.*Hα-helixtrans-65.1-37175-61.80000114C104 T180 C184 I185 L186C104-C182 HydrophobicContact CB-CB 4.27Å; T180-C182 PolarHBondContact O-N 3.05Å; C182-C184 VanDerWaalsContact C-N 3.34Å; C182-I185 PolarHBondContact O-N 2.79Å; C182-L186 PolarHBondContact O-N 3Å
183C44Very low40.3Very low53 Ų53108 Ų10836%0.35858%0.579SS.*Hα-helixtrans-71.6-29178.5-71.20000112.5M179 T180 I185 W187M179-C183 HydrophobicContact CB-CB 3.65Å; M179-C183 HydrophobicContact CE-CB 4.14Å; M179-C183 HydrophobicContact CG-CB 3.41Å; M179-C183 VanDerWaalsContact CG-CB 3.41Å; M179-C183 HydrophobicContact SD-CB 4.29Å; T180-C183 PolarHBondContact O-N 2.95Å; C183-I185 VanDerWaalsContact C-N 3.34Å; C183-W187 WeakPolarHBondContact O-CB 3.45Å; C183-W187 PolarHBondContact O-N 3.27Å
184C45.4Very low40.5Very low50 Ų50105.7 Ų105.734%0.33857%0.568SS.*Hα-helixtrans-67.9-33.7176.4-63.20000112.5P181 C182 R188P181-C184 PolarHBondContact O-N 3.4Å; C182-C184 VanDerWaalsContact C-N 3.34Å; C184-R188 VanDerWaalsContact O-CB 3.32Å; C184-R188 WeakPolarHBondContact O-CB 3.44Å; C184-R188 PolarHBondContact O-N 3.29Å
185I48.8Very low40.7Very low67 Ų67104.1 Ų104.134%0.34456%0.56SS.*Hα-helixtrans-73-43.2177.9-63.2176.5000110.9P100 C182 C183 R188 H189P100-I185 HydrophobicContact CB-CG2 4.05Å; C182-I185 PolarHBondContact O-N 2.79Å; C183-I185 VanDerWaalsContact C-N 3.34Å; I185-R188 PolarHBondContact O-N 3.36Å; I185-H189 PolarHBondContact O-N 3.23Å; I185-H189 VanDerWaalsContact O-N 3.09Å
186L43.8Very low41Very low115 Ų115104.9 Ų104.960%0.60256%0.558SS**Hα-helixtrans-65-39.1174.3-86.4158.6000112.3C182 H189 S190C182-L186 PolarHBondContact O-N 3Å; L186-H189 PolarHBondContact O-N 3.35Å; L186-S190 WeakPolarHBondContact O-CB 3.37Å; L186-S190 PolarHBondContact O-N 2.68Å; L186-S190 VanDerWaalsContact O-N 3.09Å
187W38.8Very low41.1Very low157 Ų157106.9 Ų106.960%0.59556%0.556SS**Hα-helixtrans-68.3-38.5177.9-165.570.7000112.4M179 C183 S190 L191M179-W187 HydrophobicContact CE-CB 3.92Å; M179-W187 HydrophobicContact CE-CD2 4.45Å; M179-W187 HydrophobicContact CE-CG 4.04Å; C183-W187 WeakPolarHBondContact O-CB 3.45Å; C183-W187 PolarHBondContact O-N 3.27Å; W187-S190 PolarHBondContact O-N 2.87Å; W187-L191 HydrophobicContact CD2-CD1 3.91Å; W187-L191 HydrophobicContact CE3-CD1 3.78Å; W187-L191 HydrophobicContact CH2-CD1 3.68Å; W187-L191 HydrophobicContact CZ2-CD1 3.79Å; W187-L191 HydrophobicContact CZ3-CD1 3.67Å; W187-L191 PolarHBondContact O-N 3.2Å
188R35.6Very low41.3Very low171 Ų171106.5 Ų106.565%0.64554%0.541SS*.Hα-helixtrans-63.6-45.9173.9-177.7176.7-63.8-135.31.3112.1C184 I185 S190 L191 E192C184-R188 VanDerWaalsContact O-CB 3.32Å; C184-R188 WeakPolarHBondContact O-CB 3.44Å; C184-R188 PolarHBondContact O-N 3.29Å; I185-R188 PolarHBondContact O-N 3.36Å; R188-S190 PolarHBondContact O-N 3.43Å; R188-L191 PolarHBondContact O-N 3.31Å; R188-L191 VanDerWaalsContact O-N 3.1Å; R188-E192 WeakPolarHBondContact CG-OE2 3.43Å; R188-E192 PolarHBondContact O-N 3.35Å
189H40.8Very low41.5Very low126 Ų126101.9 Ų101.958%0.58353%0.526SS*.Hα-helixtrans-64.8-27.5176.6-120.3131000113.5I185 L186 L191I185-H189 PolarHBondContact O-N 3.23Å; I185-H189 VanDerWaalsContact O-N 3.09Å; L186-H189 PolarHBondContact O-N 3.35Å; H189-L191 VanDerWaalsContact C-N 3.32Å
190S39.2Very low42.2Very low88 Ų88105.8 Ų105.862%0.61555%0.547SS*.THydrogen-bonded Turntrans-80.9-8.2175.8-170.10000114L186 W187 R188L186-S190 WeakPolarHBondContact O-CB 3.37Å; L186-S190 PolarHBondContact O-N 2.68Å; L186-S190 VanDerWaalsContact O-N 3.09Å; W187-S190 PolarHBondContact O-N 2.87Å; R188-S190 PolarHBondContact O-N 3.43Å
191L40.3Very low41.9Very low112 Ų112107.4 Ų107.459%0.58655%0.549SS*.THydrogen-bonded Turntrans-101.1-15.4174.6-90.8159.8000112.5W187 R188 H189W187-L191 HydrophobicContact CD2-CD1 3.91Å; W187-L191 HydrophobicContact CE3-CD1 3.78Å; W187-L191 HydrophobicContact CH2-CD1 3.68Å; W187-L191 HydrophobicContact CZ2-CD1 3.79Å; W187-L191 HydrophobicContact CZ3-CD1 3.67Å; W187-L191 PolarHBondContact O-N 3.2Å; R188-L191 PolarHBondContact O-N 3.31Å; R188-L191 VanDerWaalsContact O-N 3.1Å; H189-L191 VanDerWaalsContact C-N 3.32Å
192E41.2Very low41.3Very low146 Ų146109.1 Ų109.168%0.68255%0.548SS*.  trans-102.711.3-179.9-82.3161.890.500113.3R188R188-E192 WeakPolarHBondContact CG-OE2 3.43Å; R188-E192 PolarHBondContact O-N 3.35Å
193N34.6Very low41.1Very low202 Ų202117 Ų117100%1.0858%0.584SS**  trans-139.90176.1-147.729000110.1

Retrieved 193 of 193 residues in 116.3 ms (Link to these results)