A0A077ZA73_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZA73, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 310 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.6Very low29Very low241 Ų241159.4 Ų159.4100%1.18784%0.843SS**  0136.80-74.9171.1154.400107.6N3M1-N3 PolarHBondContact O-N 3.2Å
2T34.2Very low29.2Very low140 Ų140154.7 Ų154.786%0.85983%0.829SS**  trans-58.4111.3-156.2320000115.7Q4T2-Q4 PolarHBondContact O-N 3.39Å
3N31.2Very low29Very low164 Ų164156.2 Ų156.288%0.87782%0.824SS**  trans-79.4103.8164.4-85.1-19.1000109.3M1 S5M1-N3 PolarHBondContact O-N 3.2Å; N3-S5 PolarHBondContact O-N 2.92Å
4Q29.8Very low28.7Very low185 Ų185149.6 Ų149.686%0.86481%0.812SS**  trans-67.8106162.8-76.4177.8-800107.7T2 Q6T2-Q4 PolarHBondContact O-N 3.39Å; Q4-Q6 PolarHBondContact O-N 3.03Å
5S33.9Very low28.4Very low106 Ų106153.6 Ų153.674%0.74182%0.819SS**  trans-63.6104.8171.535.90000109.2N3 I7N3-S5 PolarHBondContact O-N 2.92Å; S5-I7 PolarHBondContact O-N 3.02Å; S5-I7 VanDerWaalsContact O-N 3.12Å
6Q27.3Very low28.3Very low182 Ų182155 Ų15585%0.8583%0.825SS**  trans-58.3111.1163.3-69.7178.4-12.400107.6Q4 E8Q4-Q6 PolarHBondContact O-N 3.03Å; Q6-E8 PolarHBondContact O-N 3.32Å
7I27.1Very low28.1Very low157 Ų157149.4 Ų149.481%0.80581%0.812SS**  trans-7897.4172.6-63168.3000105.5S5S5-I7 PolarHBondContact O-N 3.02Å; S5-I7 VanDerWaalsContact O-N 3.12Å
8E25.8Very low27.9Very low165 Ų165148.2 Ų148.277%0.77181%0.813SS**  trans-62.3136.6168.1-76-171.3158.400109.8Q6 I10Q6-E8 PolarHBondContact O-N 3.32Å; E8-I10 PolarHBondContact O-N 2.74Å
9P26.7Very low27.8Very low126 Ų126146.2 Ų146.282%0.81881%0.81SS**  trans-67.4120.6-179.125.4-31.2000110.6D11P9-D11 PolarHBondContact O-N 2.93Å; P9-D11 VanDerWaalsContact O-N 3.16Å
10I25.5Very low27.6Very low159 Ų159148.5 Ų148.582%0.81581%0.814SS**  trans-66.5109.6173.7-61167.6000107.8E8 P12E8-I10 PolarHBondContact O-N 2.74Å; I10-P12 VanDerWaalsContact O-CD 3.29Å; I10-P12 WeakPolarHBondContact O-CD 3.2Å
11D24.7Very low27.3Very low128 Ų128150 Ų15068%0.68482%0.815SS**  trans-64.9113.2174.5-153.7-6.5000109.1P9 F13P9-D11 PolarHBondContact O-N 2.93Å; P9-D11 VanDerWaalsContact O-N 3.16Å; D11-F13 PolarHBondContact O-N 2.85Å
12P31.7Very low26.9Very low103 Ų103143.3 Ų143.367%0.66980%0.798SS**SBendtrans-77-1.3-167.729.4-33.6000114I10 G14I10-P12 VanDerWaalsContact O-CD 3.29Å; I10-P12 WeakPolarHBondContact O-CD 3.2Å; P12-G14 VanDerWaalsContact C-N 3.33Å; P12-G14 PolarHBondContact O-N 3.46Å
13F26.2Very low26.3Very low175 Ų175142.2 Ų142.277%0.76879%0.791SS**  trans-97.839-178.4-58.2-74.8000112.8D11 K15D11-F13 PolarHBondContact O-N 2.85Å; F13-K15 PolarHBondContact O-N 2.9Å
14G25Very low25.9Very low64 Ų64142 Ų14266%0.6679%0.79SS**  trans-49.7110.2174.700000111.4P12 L16P12-G14 VanDerWaalsContact C-N 3.33Å; P12-G14 PolarHBondContact O-N 3.46Å; G14-L16 PolarHBondContact O-N 3.38Å; G14-L16 VanDerWaalsContact O-N 3.07Å
15K24.5Very low25.7Very low209 Ų209140.7 Ų140.791%0.90979%0.789SS**  trans-25.2101.7-178.5-66175.2178.8178.10113.5F13 G17F13-K15 PolarHBondContact O-N 2.9Å; K15-G17 PolarHBondContact O-N 3.39Å
16L26.6Very low25.1Very low176 Ų176138 Ų13892%0.92178%0.778SS**PPolyproline II helixtrans-66118168.1-76.9155.5000108.5G14G14-L16 PolarHBondContact O-N 3.38Å; G14-L16 VanDerWaalsContact O-N 3.07Å
17G24.2Very low25Very low59 Ų59137.2 Ų137.261%0.60878%0.779SS**PPolyproline II helixtrans-69.3156.3179.900000113.2K15K15-G17 PolarHBondContact O-N 3.39Å
18P25.7Very low24.8Very low128 Ų128140.6 Ų140.683%0.83178%0.782SS**PPolyproline II helixtrans-73.5128.2-169.928-32.9000112.6
19C25.3Very low24.6Very low111 Ų111142.8 Ų142.875%0.7579%0.789SS**PPolyproline II helixtrans-73.1125.2175.1-59.70000110.4H21C19-H21 PolarHBondContact O-N 3.41Å
20H23.2Very low24.3Very low191 Ų191141.2 Ų141.288%0.88478%0.782SS**  trans-66.9116174.4-89.6-90.8000110.7A22H20-A22 PolarHBondContact O-N 2.76Å
21H22.8Very low24.2Very low180 Ų180139.6 Ų139.683%0.83377%0.774SS**  trans-73.9102.4172.4-71.9-81.3000110.2C19C19-H21 PolarHBondContact O-N 3.41Å
22A22.9Very low24Very low102 Ų102139.5 Ų139.584%0.84378%0.782SS**  trans-96.7100.1162.400000108H20 N24H20-A22 PolarHBondContact O-N 2.76Å; A22-N24 PolarHBondContact O-N 3Å
23V22.3Very low23.6Very low116 Ų116140.6 Ų140.670%0.70378%0.78SS**  trans-68.3118.3172.6176.60000108.1
24N23.3Very low23.5Very low160 Ų160139.7 Ų139.786%0.85678%0.782SS**  trans-150.3123.6150.8-96.6-27.8000108.1A22A22-N24 PolarHBondContact O-N 3Å
25D24.6Very low23.4Very low157 Ų157144.8 Ų144.884%0.8479%0.788SS**  trans-57.7137.3-174.1-63.4-58.8000112.7
26G21.1Very low23.4Very low50 Ų50143.6 Ų143.652%0.51579%0.785SS.*SBendtrans105.476.2166.500000114.5W28G26-W28 PolarHBondContact O-N 3.43Å
27D24.8Very low23.3Very low165 Ų165137.4 Ų137.488%0.88276%0.764SS**  trans48.169.1144.6-59.4-24.2000117.7
28W22.9Very low23.3Very low229 Ų229145.8 Ų145.887%0.86778%0.779SS**  trans-120.897158.7-71.676.9000110.6G26 S30G26-W28 PolarHBondContact O-N 3.43Å; W28-S30 PolarHBondContact O-N 3.28Å
29F22.5Very low23.3Very low210 Ų210145 Ų14592%0.92177%0.772SS**  trans-66.572.2148.5-88.6-92.5000108L31F29-L31 PolarHBondContact O-N 2.97Å
30S21Very low23.2Very low94 Ų94144.4 Ų144.466%0.65776%0.761SS**  trans-74.879.6165.1-155.80000106.6W28 C32W28-S30 PolarHBondContact O-N 3.28Å; S30-C32 PolarHBondContact O-N 3.41Å
31L23.5Very low23.4Very low125 Ų125143.3 Ų143.365%0.65476%0.756SS**  trans-58107171.2-171.175.3000106F29 M33F29-L31 PolarHBondContact O-N 2.97Å; L31-M33 HydrophobicContact CD2-CG 3.94Å; L31-M33 HydrophobicContact CD2-SD 4.27Å; L31-M33 HydrophobicContact CG-CG 4.24Å; L31-M33 PolarHBondContact O-N 3.38Å
32C20.9Very low23.7Very low126 Ų126144.6 Ų144.685%0.85175%0.754SS**  trans-5974.3168.5-75.30000109.4S30 L34S30-C32 PolarHBondContact O-N 3.41Å; C32-L34 VanDerWaalsContact C-N 3.33Å; C32-L34 PolarHBondContact O-N 3.4Å
33M23.3Very low23.8Very low125 Ų125146.9 Ų146.962%0.61675%0.752SS**  trans-67.7101.1161.6-73.2-96.9-77.500104.5L31 H35L31-M33 HydrophobicContact CD2-CG 3.94Å; L31-M33 HydrophobicContact CD2-SD 4.27Å; L31-M33 HydrophobicContact CG-CG 4.24Å; L31-M33 PolarHBondContact O-N 3.38Å; M33-H35 PolarHBondContact O-N 2.89Å
34L23.2Very low23.9Very low156 Ų156147.6 Ų147.682%0.81775%0.751SS**  trans-5089.3151.6-96.4141.3000106.4C32 H36C32-L34 VanDerWaalsContact C-N 3.33Å; C32-L34 PolarHBondContact O-N 3.4Å; L34-H36 PolarHBondContact O-N 3.24Å
35H22Very low23.9Very low172 Ų172143.9 Ų143.980%0.79674%0.738SS**  trans-51.1100160.7-111.2-98.6000104.2M33 G37M33-H35 PolarHBondContact O-N 2.89Å; H35-G37 PolarHBondContact O-N 3.02Å
36H25.8Very low24.1Very low183 Ų183142.3 Ų142.385%0.84773%0.734SS**  trans-63.379.4157-84.2-75.9000105.5L34 Y38L34-H36 PolarHBondContact O-N 3.24Å; H36-Y38 PolarHBondContact O-N 3.48Å
37G23.9Very low24.2Very low46 Ų46147.4 Ų147.447%0.47475%0.75SS.*  trans-52.4128.717100000107.1H35 V39H35-G37 PolarHBondContact O-N 3.02Å; G37-V39 PolarHBondContact O-N 3.44Å
38Y24.9Very low24.1Very low235 Ų235145.7 Ų145.792%0.92275%0.749SS**  trans-37.2101.1164.7-85.2-106.1000109.4H36 D40H36-Y38 PolarHBondContact O-N 3.48Å; Y38-D40 VanDerWaalsContact C-N 3.3Å; Y38-D40 PolarHBondContact O-N 3.31Å
39V24.3Very low24Very low113 Ų113146.1 Ų146.169%0.68575%0.75SS**  trans-75.496.8166.1179.80000104.6G37 E41 L44G37-V39 PolarHBondContact O-N 3.44Å; V39-E41 PolarHBondContact O-N 3.49Å; V39-L44 HydrophobicContact CG1-CD1 4.09Å
40D24.6Very low24Very low98 Ų98141.2 Ų141.252%0.52474%0.742SS.*  trans-57.8105.7172-162.3-16.1000107.4Y38 R42 N43Y38-D40 VanDerWaalsContact C-N 3.3Å; Y38-D40 PolarHBondContact O-N 3.31Å; D40-R42 PolarHBondContact O-N 2.99Å; D40-R42 IonicContact OD1-NE 3.43Å; D40-R42 PolarHBondContact OD1-NE 2.91Å; D40-N43 PolarHBondContact O-N 3.13Å
41E27.8Very low24.1Very low167 Ų167148 Ų14878%0.7875%0.753SS**G310 helixtrans-57.3-10.5-174.5-73.7-174.514800113.1V39 N43V39-E41 PolarHBondContact O-N 3.49Å; E41-N43 VanDerWaalsContact C-N 3.32Å; E41-N43 PolarHBondContact O-N 2.9Å
42R27.8Very low24Very low207 Ų207150.3 Ų150.378%0.78176%0.761SS**G310 helixtrans-73.7-14.9179.3-72.9-174.4-85.2-169.8-5.3115.1D40D40-R42 PolarHBondContact O-N 2.99Å; D40-R42 IonicContact OD1-NE 3.43Å; D40-R42 PolarHBondContact OD1-NE 2.91Å
43N25.5Very low24.1Very low150 Ų150155.2 Ų155.280%0.80276%0.763SS**G310 helixtrans-103.78175.7-83.6-17.5000114.9D40 E41 S45D40-N43 PolarHBondContact O-N 3.13Å; E41-N43 VanDerWaalsContact C-N 3.32Å; E41-N43 PolarHBondContact O-N 2.9Å; N43-S45 PolarHBondContact O-N 2.69Å
44L24.5Very low24.1Very low131 Ų131160.4 Ų160.469%0.68678%0.776SS**  trans-79.848.7165.7-84.1146.7000110.7V39V39-L44 HydrophobicContact CG1-CD1 4.09Å
45S23.9Very low24.2Very low82 Ų82162.4 Ų162.457%0.57378%0.778SS**  trans-93.4113.9173.6175.60000108.9N43N43-S45 PolarHBondContact O-N 2.69Å
46T27.4Very low24.3Very low124 Ų124165.5 Ų165.576%0.76178%0.784SS**SBendtrans92.5-9.6151.359.40000124.3
47N24.7Very low24.2Very low158 Ų158160.7 Ų160.785%0.84577%0.771SS**  trans-131.334.8-175.5-96-23.7000119.7
48C22.4Very low24.3Very low128 Ų128162.2 Ų162.287%0.86578%0.779SS**  trans-132.461.8167-82.40000112.5
49R19.8Very low24.2Very low239 Ų239159.3 Ų159.390%0.90277%0.773SS**  trans-69123.2151.5-96.8-179.1172.8178.1-1.2108.2
50S22.2Very low24.2Very low106 Ų106163 Ų16374%0.74178%0.781SS**  trans62.7108.5164660000118.2
51R22.9Very low24.2Very low236 Ų236164.2 Ų164.289%0.89180%0.796SS**  -175.7103.4118.9-99.5170.1-177-163.41.4111.3
52Q23.2Very low24.1Very low174 Ų174159.8 Ų159.881%0.81379%0.788SS**  trans20.6116143.2-70.3168.4-25.600118.2R54Q52-R54 PolarHBondContact O-N 2.96Å
53Y22.6Very low24Very low229 Ų229154.5 Ų154.590%0.89878%0.78SS**  trans31.772.2145.2-63.8-85.5000116.3K55Y53-K55 PolarHBondContact O-N 3.39Å
54R23Very low24Very low235 Ų235153.9 Ų153.989%0.88779%0.786SS**  trans-66106.4160.6-92.5-175.7174.7175.4-1.6108.4Q52 Y56Q52-R54 PolarHBondContact O-N 2.96Å; R54-Y56 PolarHBondContact O-N 3.33Å
55K24.9Very low24Very low197 Ų197154 Ų15486%0.85778%0.781SS**  trans-43.1118.6164.9-76.1172.6174175.10108.6Y53 S57Y53-K55 PolarHBondContact O-N 3.39Å; K55-S57 VanDerWaalsContact C-N 3.27Å; K55-S57 PolarHBondContact O-N 3.21Å
56Y24.3Very low24.2Very low237 Ų237155.1 Ų155.193%0.92979%0.789SS**  trans-68.285.8169.4-69.4-91000108.5R54 A58R54-Y56 PolarHBondContact O-N 3.33Å; Y56-A58 PolarHBondContact O-N 3.42Å
57S23.1Very low24.3Very low83 Ų83158.7 Ų158.758%0.5880%0.797SS**  trans-79.5100.2161.149.70000107.2K55 H59K55-S57 VanDerWaalsContact C-N 3.27Å; K55-S57 PolarHBondContact O-N 3.21Å; S57-H59 PolarHBondContact O-CD2 3.44Å; S57-H59 PolarHBondContact O-N 2.8Å
58A25.7Very low24.7Very low77 Ų77154.1 Ų154.164%0.63679%0.788SS**  trans-64.7101.5168.500000107.9Y56 F60Y56-A58 PolarHBondContact O-N 3.42Å; A58-F60 VanDerWaalsContact C-N 3.35Å; A58-F60 HydrophobicContact CB-CD2 3.89Å; A58-F60 HydrophobicContact CB-CE2 3.85Å; A58-F60 PolarHBondContact O-N 3.11Å
59H23.5Very low25.1Very low174 Ų174156.1 Ų156.181%0.80678%0.784SS**  trans-7294.5167.2-72.5-83.6000107.3S57 C61S57-H59 PolarHBondContact O-CD2 3.44Å; S57-H59 PolarHBondContact O-N 2.8Å; H59-C61 PolarHBondContact O-N 3.46Å
60F24.8Very low25.9Very low190 Ų190147.4 Ų147.483%0.83376%0.757SS**  trans-78.4115.3170.3-91-91.5000108.4A58 A62A58-F60 VanDerWaalsContact C-N 3.35Å; A58-F60 HydrophobicContact CB-CD2 3.89Å; A58-F60 HydrophobicContact CB-CE2 3.85Å; A58-F60 PolarHBondContact O-N 3.11Å; F60-A62 PolarHBondContact O-N 2.93Å
61C24Very low26.4Very low125 Ų125149.8 Ų149.885%0.84576%0.756SS**  trans-74.8112.4165.1-155.30000106.8H59H59-C61 PolarHBondContact O-N 3.46Å
62A25.2Very low26.8Very low74 Ų74145.2 Ų145.261%0.61275%0.75SS**  trans-63.8128.117700000108.9F60 C64F60-A62 PolarHBondContact O-N 2.93Å; A62-C64 PolarHBondContact O-N 2.83Å
63P26.7Very low27.1Very low95 Ų95140.4 Ų140.462%0.61773%0.733SS**  trans-64.3129.7171.5-12.425.8000108.7F65P63-F65 VanDerWaalsContact C-N 3.29Å; P63-F65 HydrophobicContact CB-CD2 3.94Å; P63-F65 HydrophobicContact CB-CE2 3.6Å; P63-F65 HydrophobicContact CB-CZ 4.33Å; P63-F65 HydrophobicContact CG-CD2 4.47Å; P63-F65 HydrophobicContact CG-CE2 3.84Å; P63-F65 WeakPolarHBondContact O-CD2 3.34Å; P63-F65 PolarHBondContact O-N 2.8Å
64C24.4Very low27.4Very low138 Ų138134.5 Ų134.593%0.93271%0.714SS**  trans-64.588174-58.10000109.1A62A62-C64 PolarHBondContact O-N 2.83Å
65F26.4Very low27.7Very low132 Ų132126 Ų12658%0.57969%0.694SS**  trans-81.2129.8172.5-79.9-78.7000109.6P63 T70P63-F65 VanDerWaalsContact C-N 3.29Å; P63-F65 HydrophobicContact CB-CD2 3.94Å; P63-F65 HydrophobicContact CB-CE2 3.6Å; P63-F65 HydrophobicContact CB-CZ 4.33Å; P63-F65 HydrophobicContact CG-CD2 4.47Å; P63-F65 HydrophobicContact CG-CE2 3.84Å; P63-F65 WeakPolarHBondContact O-CD2 3.34Å; P63-F65 PolarHBondContact O-N 2.8Å; F65-T70 HydrophobicContact CB-CG2 4.21Å
66S27.1Very low28.1Very low106 Ų106122.3 Ų122.374%0.74168%0.678SS**  trans-57.1145.9178.145.30000112G68S66-G68 PolarHBondContact O-N 3.41Å
67E30.4Very low28.6Very low200 Ų200118.6 Ų118.694%0.93566%0.664SS**THydrogen-bonded Turntrans-45.6125.3-174.7-63.5173.4154.100112.8
68G32.8Very low28.9Very low62 Ų62120.7 Ų120.764%0.63966%0.662SS**THydrogen-bonded Turntrans142.3-25.5162.100000117.2S66S66-G68 PolarHBondContact O-N 3.41Å
69H30.5Very low29Very low169 Ų169119.5 Ų119.578%0.78265%0.653SS**SBendtrans-130.816.5-176.2-72.9-55.7000115T73H69-T73 PolarHBondContact O-OG1 3.41Å
70T37.1Very low29.3Very low57 Ų57115.2 Ų115.235%0.3564%0.635SS.*Hα-helixtrans-79-35.5-16246.90000115F65 M74F65-T70 HydrophobicContact CB-CG2 4.21Å; T70-M74 PolarHBondContact O-N 2.9Å
71E32.4Very low29.6Very low155 Ų155113.7 Ų113.772%0.72463%0.629SS**Hα-helixtrans-82-49.6-166.2-64.1-173.6166.800113.7T73 A75E71-T73 VanDerWaalsContact C-N 3.33Å; E71-T73 PolarHBondContact O-N 2.94Å; E71-A75 VanDerWaalsContact O-CB 3.31Å; E71-A75 WeakPolarHBondContact O-CB 3.47Å; E71-A75 PolarHBondContact O-N 3.26Å
72N30.1Very low29.9Very low140 Ų140112.2 Ų112.275%0.74961%0.613SS**Hα-helixtrans-68.2-34-176.2-73.5-20000112.6A75 F76N72-A75 PolarHBondContact O-N 3.14Å; N72-F76 WeakPolarHBondContact O-CB 3.29Å; N72-F76 PolarHBondContact O-N 2.9Å
73T30.7Very low30Very low74 Ų74113.4 Ų113.445%0.45461%0.612SS.*Hα-helixtrans-72.4-44.6-178-37.30000110.9H69 E71 F76 Y77H69-T73 PolarHBondContact O-OG1 3.41Å; E71-T73 VanDerWaalsContact C-N 3.33Å; E71-T73 PolarHBondContact O-N 2.94Å; T73-F76 PolarHBondContact O-N 2.87Å; T73-Y77 HydrophobicContact CG2-CD2 4.22Å; T73-Y77 HydrophobicContact CG2-CE2 3.81Å; T73-Y77 WeakPolarHBondContact O-CD2 3.38Å; T73-Y77 PolarHBondContact O-N 3.39Å
74M29.2Very low30.3Very low105 Ų105111.9 Ų111.952%0.51760%0.601SS.*Hα-helixtrans-61.4-45.6171.7-85.5-151.1-52.700111.5T70 F76 Y77 F78T70-M74 PolarHBondContact O-N 2.9Å; M74-F76 VanDerWaalsContact C-N 3.27Å; M74-F76 PolarHBondContact O-N 3.41Å; M74-Y77 PolarHBondContact O-N 2.81Å; M74-F78 HydrophobicContact CB-CD2 4.36Å; M74-F78 WeakPolarHBondContact O-CB 3.49Å; M74-F78 WeakPolarHBondContact O-CD2 3.39Å; M74-F78 PolarHBondContact O-N 3.36Å; M74-F78 HydrophobicContact SD-CE2 4.25Å
75A28.2Very low30.5Very low55 Ų55107.9 Ų107.946%0.45558%0.575SS.*Hα-helixtrans-59-39.4-179.700000111.9E71 N72 A79E71-A75 VanDerWaalsContact O-CB 3.31Å; E71-A75 WeakPolarHBondContact O-CB 3.47Å; E71-A75 PolarHBondContact O-N 3.26Å; N72-A75 PolarHBondContact O-N 3.14Å; A75-A79 WeakPolarHBondContact O-CB 3.34Å; A75-A79 PolarHBondContact O-N 2.66Å
76F32.7Very low30.6Very low120 Ų120105.8 Ų105.853%0.52657%0.572SS.*Hα-helixtrans-64.6-46.7176.2-175-101.8000112.4N72 T73 M74 A79 L80N72-F76 WeakPolarHBondContact O-CB 3.29Å; N72-F76 PolarHBondContact O-N 2.9Å; T73-F76 PolarHBondContact O-N 2.87Å; M74-F76 VanDerWaalsContact C-N 3.27Å; M74-F76 PolarHBondContact O-N 3.41Å; F76-A79 PolarHBondContact O-N 2.89Å; F76-L80 HydrophobicContact CD1-CD1 3.86Å; F76-L80 HydrophobicContact CE1-CD1 3.23Å; F76-L80 HydrophobicContact CE2-CD1 3.98Å; F76-L80 HydrophobicContact CG-CD1 4.47Å; F76-L80 HydrophobicContact CZ-CD1 3.3Å; F76-L80 WeakPolarHBondContact O-CB 3.5Å; F76-L80 PolarHBondContact O-N 3.5Å
77Y34.8Very low30.9Very low160 Ų160104.9 Ų104.963%0.62756%0.559SS**Hα-helixtrans-65.2-41.6177.8-75.2-65000112.2T73 M74 L80 F81T73-Y77 HydrophobicContact CG2-CD2 4.22Å; T73-Y77 HydrophobicContact CG2-CE2 3.81Å; T73-Y77 WeakPolarHBondContact O-CD2 3.38Å; T73-Y77 PolarHBondContact O-N 3.39Å; M74-Y77 PolarHBondContact O-N 2.81Å; Y77-L80 PolarHBondContact O-N 3.04Å; Y77-F81 WeakPolarHBondContact O-CB 3.46Å; Y77-F81 PolarHBondContact O-N 3.35Å
78F29.9Very low30.9Very low126 Ų126100.5 Ų100.555%0.55354%0.541SS*.Hα-helixtrans-65.1-41.6175.1-86.8-70.7000112.1M74 F81 N82M74-F78 HydrophobicContact CB-CD2 4.36Å; M74-F78 WeakPolarHBondContact O-CB 3.49Å; M74-F78 WeakPolarHBondContact O-CD2 3.39Å; M74-F78 PolarHBondContact O-N 3.36Å; M74-F78 HydrophobicContact SD-CE2 4.25Å; F78-F81 PolarHBondContact O-N 3.28Å; F78-N82 VanDerWaalsContact O-CB 3.28Å; F78-N82 WeakPolarHBondContact O-CB 3.39Å; F78-N82 VanDerWaalsContact O-CG 3.26Å; F78-N82 PolarHBondContact O-N 3.35Å; F78-N82 PolarHBondContact O-ND2 2.89Å
79A27.9Very low30.8Very low52 Ų52104.3 Ų104.343%0.4354%0.541SS..Hα-helixtrans-62.6-45176.400000111.6A75 F76 F81 N82 V83A75-A79 WeakPolarHBondContact O-CB 3.34Å; A75-A79 PolarHBondContact O-N 2.66Å; F76-A79 PolarHBondContact O-N 2.89Å; A79-F81 VanDerWaalsContact C-N 3.33Å; A79-F81 PolarHBondContact O-N 3.14Å; A79-N82 PolarHBondContact O-N 3.02Å; A79-V83 WeakPolarHBondContact O-CB 3.42Å; A79-V83 VanDerWaalsContact O-CG2 3.23Å; A79-V83 WeakPolarHBondContact O-CG2 3.33Å; A79-V83 PolarHBondContact O-N 3.06Å
80L30.8Very low30.8Very low84 Ų84100.9 Ų100.944%0.4453%0.525SS..Hα-helixtrans-61.3-40.7175.8-113.6137.7000112F76 Y77 T84F76-L80 HydrophobicContact CD1-CD1 3.86Å; F76-L80 HydrophobicContact CE1-CD1 3.23Å; F76-L80 HydrophobicContact CE2-CD1 3.98Å; F76-L80 HydrophobicContact CG-CD1 4.47Å; F76-L80 HydrophobicContact CZ-CD1 3.3Å; F76-L80 WeakPolarHBondContact O-CB 3.5Å; F76-L80 PolarHBondContact O-N 3.5Å; Y77-L80 PolarHBondContact O-N 3.04Å; L80-T84 WeakPolarHBondContact O-CB 3.44Å; L80-T84 VanDerWaalsContact O-CG2 3.24Å; L80-T84 WeakPolarHBondContact O-CG2 3.37Å; L80-T84 PolarHBondContact O-N 3.4Å; L80-T84 VanDerWaalsContact O-N 3.11Å; L80-T84 PolarHBondContact O-OG1 3.11Å
81F30.7Very low30.6Very low158 Ų158105.6 Ų105.669%0.69354%0.536SS*.Hα-helixtrans-73.5-35.5179-124.3-86.5000112.9Y77 F78 A79 T84 S85Y77-F81 WeakPolarHBondContact O-CB 3.46Å; Y77-F81 PolarHBondContact O-N 3.35Å; F78-F81 PolarHBondContact O-N 3.28Å; A79-F81 VanDerWaalsContact C-N 3.33Å; A79-F81 PolarHBondContact O-N 3.14Å; F81-T84 WeakPolarHBondContact CA-OG1 3.37Å; F81-T84 PolarHBondContact O-OG1 2.82Å; F81-T84 VanDerWaalsContact O-OG1 3.09Å; F81-S85 VanDerWaalsContact O-CB 3.25Å; F81-S85 WeakPolarHBondContact O-CB 3.44Å; F81-S85 PolarHBondContact O-N 2.97Å; F81-S85 PolarHBondContact O-OG 3.08Å
82N29Very low30.6Very low95 Ų95101.7 Ų101.751%0.50852%0.523SS..Hα-helixtrans-72.5-42.7177.5-74.3-23000111.5F78 A79 T84 S85 V86F78-N82 VanDerWaalsContact O-CB 3.28Å; F78-N82 WeakPolarHBondContact O-CB 3.39Å; F78-N82 VanDerWaalsContact O-CG 3.26Å; F78-N82 PolarHBondContact O-N 3.35Å; F78-N82 PolarHBondContact O-ND2 2.89Å; A79-N82 PolarHBondContact O-N 3.02Å; N82-T84 VanDerWaalsContact C-N 3.33Å; N82-T84 PolarHBondContact O-N 2.79Å; N82-S85 PolarHBondContact O-N 3.44Å; N82-S85 PolarHBondContact O-OG 3.47Å; N82-V86 VanDerWaalsContact O-CG2 3.3Å; N82-V86 WeakPolarHBondContact O-CG2 3.44Å; N82-V86 PolarHBondContact O-N 3.49Å
83V29.1Very low30.7Very low99 Ų99101.7 Ų101.760%0.652%0.518SS*.Hα-helixtrans-63.6-40.8175.5174.90000110.8A79 N87A79-V83 WeakPolarHBondContact O-CB 3.42Å; A79-V83 VanDerWaalsContact O-CG2 3.23Å; A79-V83 WeakPolarHBondContact O-CG2 3.33Å; A79-V83 PolarHBondContact O-N 3.06Å; V83-N87 VanDerWaalsContact O-CB 3.3Å; V83-N87 WeakPolarHBondContact O-CB 3.44Å; V83-N87 PolarHBondContact O-N 2.79Å
84T31.5Very low30.8Very low63 Ų63107.4 Ų107.439%0.38753%0.532SS..Hα-helixtrans-71.2-37.6178.251.30000113L80 F81 N82 L88L80-T84 WeakPolarHBondContact O-CB 3.44Å; L80-T84 VanDerWaalsContact O-CG2 3.24Å; L80-T84 WeakPolarHBondContact O-CG2 3.37Å; L80-T84 PolarHBondContact O-N 3.4Å; L80-T84 VanDerWaalsContact O-N 3.11Å; L80-T84 PolarHBondContact O-OG1 3.11Å; F81-T84 WeakPolarHBondContact CA-OG1 3.37Å; F81-T84 PolarHBondContact O-OG1 2.82Å; F81-T84 VanDerWaalsContact O-OG1 3.09Å; N82-T84 VanDerWaalsContact C-N 3.33Å; N82-T84 PolarHBondContact O-N 2.79Å; T84-L88 VanDerWaalsContact O-CB 3.31Å; T84-L88 WeakPolarHBondContact O-CB 3.42Å; T84-L88 WeakPolarHBondContact O-CD1 3.33Å; T84-L88 WeakPolarHBondContact O-CG 3.43Å; T84-L88 PolarHBondContact O-N 2.92Å
85S29.2Very low30.7Very low54 Ų54108.3 Ų108.338%0.37854%0.536SS..Hα-helixtrans-74.2-38.3-178.7610000113.5F81 N82 K89F81-S85 VanDerWaalsContact O-CB 3.25Å; F81-S85 WeakPolarHBondContact O-CB 3.44Å; F81-S85 PolarHBondContact O-N 2.97Å; F81-S85 PolarHBondContact O-OG 3.08Å; N82-S85 PolarHBondContact O-N 3.44Å; N82-S85 PolarHBondContact O-OG 3.47Å; S85-K89 WeakPolarHBondContact O-CB 3.38Å; S85-K89 PolarHBondContact O-N 2.84Å
86V29.1Very low30.8Very low88 Ų88111.3 Ų111.353%0.53354%0.544SS..Hα-helixtrans-66.4-43.8176.2177.50000110.5N82 L88 K89 E90N82-V86 VanDerWaalsContact O-CG2 3.3Å; N82-V86 WeakPolarHBondContact O-CG2 3.44Å; N82-V86 PolarHBondContact O-N 3.49Å; V86-L88 PolarHBondContact O-N 3.07Å; V86-K89 PolarHBondContact O-N 2.68Å; V86-K89 VanDerWaalsContact O-N 3.15Å; V86-E90 PolarHBondContact O-N 3.31Å
87N32Very low30.7Very low87 Ų87113.5 Ų113.547%0.46555%0.55SS.*Hα-helixtrans-69.5-33.2-179.3-142.7-18.4000112V83 R91V83-N87 VanDerWaalsContact O-CB 3.3Å; V83-N87 WeakPolarHBondContact O-CB 3.44Å; V83-N87 PolarHBondContact O-N 2.79Å; N87-R91 VanDerWaalsContact O-CB 3.32Å; N87-R91 WeakPolarHBondContact O-CB 3.28Å; N87-R91 PolarHBondContact O-N 2.88Å
88L30.9Very low30.6Very low107 Ų107110 Ų11056%0.5655%0.546SS*.Hα-helixtrans-66.6-40.7169.8-84.2162.5000112T84 V86 R91 V92T84-L88 VanDerWaalsContact O-CB 3.31Å; T84-L88 WeakPolarHBondContact O-CB 3.42Å; T84-L88 WeakPolarHBondContact O-CD1 3.33Å; T84-L88 WeakPolarHBondContact O-CG 3.43Å; T84-L88 PolarHBondContact O-N 2.92Å; V86-L88 PolarHBondContact O-N 3.07Å; L88-R91 PolarHBondContact O-N 2.86Å; L88-V92 WeakPolarHBondContact O-CB 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.38Å; L88-V92 PolarHBondContact O-N 2.89Å
89K31.5Very low30.9Very low143 Ų143112.6 Ų112.662%0.62256%0.56SS**Hα-helixtrans-67.2-43180-162.4178.5-179.6-1720111.5S85 V86 Q93S85-K89 WeakPolarHBondContact O-CB 3.38Å; S85-K89 PolarHBondContact O-N 2.84Å; V86-K89 PolarHBondContact O-N 2.68Å; V86-K89 VanDerWaalsContact O-N 3.15Å; K89-Q93 WeakPolarHBondContact O-CB 3.13Å; K89-Q93 WeakPolarHBondContact O-CG 3.49Å; K89-Q93 PolarHBondContact O-N 3.34Å
90E30.6Very low31.4Very low96 Ų96116.5 Ų116.545%0.44957%0.572SS.*Hα-helixtrans-66.2-41.6174-81.4-161.913600112.6V86 Q93 R94V86-E90 PolarHBondContact O-N 3.31Å; E90-Q93 PolarHBondContact O-N 3.2Å; E90-R94 PolarHBondContact O-N 3.43Å
91R31.6Very low31.5Very low156 Ų156114.9 Ų114.959%0.58958%0.576SS**Hα-helixtrans-68.6-34.2177.7-91.2179.5156.7171.7-3.7113.4N87 L88 M95N87-R91 VanDerWaalsContact O-CB 3.32Å; N87-R91 WeakPolarHBondContact O-CB 3.28Å; N87-R91 PolarHBondContact O-N 2.88Å; L88-R91 PolarHBondContact O-N 2.86Å; R91-M95 PolarHBondContact O-N 2.94Å
92V32.9Very low31.3Very low73 Ų73112.9 Ų112.944%0.44258%0.576SS.*Hα-helixtrans-73.8-32175.5174.60000110.9L88L88-V92 WeakPolarHBondContact O-CB 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.38Å; L88-V92 PolarHBondContact O-N 2.89Å
93Q32.9Very low31.4Very low141 Ų141117.8 Ų117.866%0.65960%0.596SS**Hα-helixtrans-75.4-35.5174.2-79-175.8-16.200113.7K89 E90 M95K89-Q93 WeakPolarHBondContact O-CB 3.13Å; K89-Q93 WeakPolarHBondContact O-CG 3.49Å; K89-Q93 PolarHBondContact O-N 3.34Å; E90-Q93 PolarHBondContact O-N 3.2Å; Q93-M95 VanDerWaalsContact C-N 3.25Å; Q93-M95 PolarHBondContact O-N 3.09Å
94R31.5Very low31.5Very low194 Ų194122.3 Ų122.373%0.73260%0.603SS**Hα-helixtrans-74.9-9.9175.5-72.2-170.7-169.5166.28.8114.2E90 D96E90-R94 PolarHBondContact O-N 3.43Å; R94-D96 PolarHBondContact O-N 2.86Å
95M28.7Very low31.6Very low124 Ų124131.2 Ų131.261%0.61163%0.629SS**SBendtrans-74.880.1160.8-99.7-171.6-67.300108.1R91 Q93 Y97R91-M95 PolarHBondContact O-N 2.94Å; Q93-M95 VanDerWaalsContact C-N 3.25Å; Q93-M95 PolarHBondContact O-N 3.09Å; M95-Y97 WeakPolarHBondContact O-CD2 3.44Å; M95-Y97 PolarHBondContact O-N 3.49Å
96D29.2Very low31.7Very low118 Ų118131.7 Ų131.763%0.63164%0.642SS**  trans-51.7101.2167.8-107.3-31.8000108.8R94 T98 Q99R94-D96 PolarHBondContact O-N 2.86Å; D96-T98 PolarHBondContact O-N 3.06Å; D96-Q99 PolarHBondContact O-N 2.93Å
97Y31.5Very low31.7Very low166 Ų166136.2 Ų136.265%0.65166%0.657SS**THydrogen-bonded Turntrans-60.2-4.6175.2-76-92.7000112.4M95 Q99 I100M95-Y97 WeakPolarHBondContact O-CD2 3.44Å; M95-Y97 PolarHBondContact O-N 3.49Å; Y97-Q99 VanDerWaalsContact C-N 3.3Å; Y97-Q99 PolarHBondContact O-N 3.3Å; Y97-I100 HydrophobicContact CD1-CD1 4.15Å; Y97-I100 PolarHBondContact O-N 3.03Å; Y97-I100 VanDerWaalsContact O-N 3.14Å
98T32.1Very low32Very low86 Ų86142.3 Ų142.353%0.52868%0.68SS.*Hα-helixtrans-62.7-31.5176.854.90000112.5D96 I100 G101 T102D96-T98 PolarHBondContact O-N 3.06Å; T98-I100 VanDerWaalsContact C-N 3.26Å; T98-I100 PolarHBondContact O-N 2.94Å; T98-G101 PolarHBondContact O-N 3.29Å; T98-T102 PolarHBondContact O-OG1 3.05Å
99Q35.5Very low32.4Very low181 Ų181141.4 Ų141.485%0.84668%0.683SS**Hα-helixtrans-72.7-14.6175.2-79.8-167.75.900114.3D96 Y97 G101D96-Q99 PolarHBondContact O-N 2.93Å; Y97-Q99 VanDerWaalsContact C-N 3.3Å; Y97-Q99 PolarHBondContact O-N 3.3Å; Q99-G101 VanDerWaalsContact C-N 3.35Å
100I39.4Very low32.6Very low133 Ų133144.5 Ų144.568%0.68270%0.696SS**Hα-helixtrans-84.3-16176.1-54.5178.9000110.8Y97 T98Y97-I100 HydrophobicContact CD1-CD1 4.15Å; Y97-I100 PolarHBondContact O-N 3.03Å; Y97-I100 VanDerWaalsContact O-N 3.14Å; T98-I100 VanDerWaalsContact C-N 3.26Å; T98-I100 PolarHBondContact O-N 2.94Å
101G31.5Very low32.9Very low51 Ų51150.5 Ų150.553%0.52672%0.715SS.*Hα-helixtrans-105.2-21-170.200000117.5T98 Q99T98-G101 PolarHBondContact O-N 3.29Å; Q99-G101 VanDerWaalsContact C-N 3.35Å
102T27.4Very low33.2Very low115 Ų115147.8 Ų147.871%0.70673%0.726SS**  trans-112.341.6-163.357.20000115.1T98T98-T102 PolarHBondContact O-OG1 3.05Å
103Q31Very low33.5Very low199 Ų199148.7 Ų148.793%0.9374%0.741SS**  trans-98.672152-84.7-1710.300109.4
104R30.9Very low33.8Very low194 Ų194151.1 Ų151.173%0.73275%0.749SS**  trans-129.167.6168.3-82.9-169.9166.7-168.3-2.4110.1
105R34.2Very low34.1Very low249 Ų249145.7 Ų145.794%0.9474%0.739SS**SBendtrans-94.1106.8149.6-81.7-172.5179176.8-0.1107
106G31.2Very low34.7Very low64 Ų64150 Ų15066%0.6675%0.749SS**SBendtrans58.886.5163.200000116.4
107H30.1Very low35.4Very low183 Ų183152.7 Ų152.785%0.84776%0.755SS**  trans-168.6112.1132.8-105.2-72.9000109S109H107-S109 PolarHBondContact O-N 3.07Å
108K37.7Very low35.7Very low216 Ų216155.5 Ų155.594%0.93977%0.765SS**  trans-63.697170.1-69.7176.2178.2177.40108.5
109S38.7Very low36.2Very low88 Ų88156.4 Ų156.462%0.61577%0.769SS**  trans-149.6117.5150.861.90000110H107 R111H107-S109 PolarHBondContact O-N 3.07Å; S109-R111 VanDerWaalsContact C-N 3.26Å; S109-R111 PolarHBondContact O-N 3.42Å
110F35.4Very low36.4Very low208 Ų208152.8 Ų152.891%0.91276%0.756SS**  trans-70.380.5172.9-91.8-102000109.5
111R36.8Very low36.6Very low221 Ų221152.1 Ų152.183%0.83475%0.753SS**SBendtrans-140.5119.2150.5-82.2-169.9178.6175.80106.8S109 A113S109-R111 VanDerWaalsContact C-N 3.26Å; S109-R111 PolarHBondContact O-N 3.42Å; R111-A113 PolarHBondContact O-N 3.33Å
112A39.5Very low37Very low99 Ų99155.6 Ų155.682%0.81876%0.755SS**  trans-46105.8173.400000108.3K114A112-K114 VanDerWaalsContact C-N 3.35Å; A112-K114 PolarHBondContact O-N 3.15Å
113A37.7Very low37.5Very low93 Ų93152.6 Ų152.677%0.76974%0.742SS**  trans-62.8102.4-178.900000106.2R111 P115R111-A113 PolarHBondContact O-N 3.33Å; A113-P115 WeakPolarHBondContact O-CD 3.23Å
114K39.1Very low38.1Very low191 Ų191145.6 Ų145.683%0.8372%0.719SS**PPolyproline II helixtrans-51.1118.3172.8-70.7179.3178.5178.20106A112 R116A112-K114 VanDerWaalsContact C-N 3.35Å; A112-K114 PolarHBondContact O-N 3.15Å; K114-R116 PolarHBondContact O-N 3Å; K114-R116 VanDerWaalsContact O-N 3.1Å
115P38.6Very low38.9Very low80 Ų80145 Ų14552%0.51972%0.717SS.*PPolyproline II helixtrans-53.3125.6-178.116.9-28.4000108.1A113 K117 L120A113-P115 WeakPolarHBondContact O-CD 3.23Å; P115-K117 PolarHBondContact O-N 3.24Å; P115-L120 HydrophobicContact CG-CD1 4.07Å
116R41.8Very low39.1Very low214 Ų214137.1 Ų137.181%0.80869%0.691SS**PPolyproline II helixtrans-50.9118.9-174.5-73.4179.2169177.7-3.1107.5K114 R118 V119K114-R116 PolarHBondContact O-N 3Å; K114-R116 VanDerWaalsContact O-N 3.1Å; R116-R118 PolarHBondContact O-N 3.07Å; R116-V119 PolarHBondContact O-N 2.9Å
117K43.2Very low39.8Very low176 Ų176137.5 Ų137.577%0.76568%0.681SS**Hα-helixtrans-43.2-27-174.2-74.9179.8175.9176.40114.9P115 V119 N121P115-K117 PolarHBondContact O-N 3.24Å; K117-V119 PolarHBondContact O-N 3.36Å; K117-N121 PolarHBondContact O-N 3.22Å
118R39.1Very low40.8Very low225 Ų225135.4 Ų135.485%0.84967%0.671SS**Hα-helixtrans-60.8-38.5176.6-65.4-172.4-174.2176.51.6113.2R116 H122R116-R118 PolarHBondContact O-N 3.07Å; R118-H122 PolarHBondContact O-N 3.26Å
119V41.4Very low41.2Very low104 Ų104130 Ų13063%0.6365%0.65SS**Hα-helixtrans-70.9-41.4-178.3-176.50000111.2R116 K117 N121 H122 A123R116-V119 PolarHBondContact O-N 2.9Å; K117-V119 PolarHBondContact O-N 3.36Å; V119-N121 PolarHBondContact O-N 2.71Å; V119-H122 PolarHBondContact O-N 3.41Å; V119-A123 PolarHBondContact O-N 2.88Å; V119-A123 VanDerWaalsContact O-N 3.16Å
120L39.1Very low41.6Very low106 Ų106129.2 Ų129.256%0.55564%0.638SS**Hα-helixtrans-64.4-39.6176.8-83.5161000112.6P115 A123 A124P115-L120 HydrophobicContact CG-CD1 4.07Å; L120-A123 PolarHBondContact O-N 2.97Å; L120-A124 WeakPolarHBondContact O-CB 3.24Å; L120-A124 PolarHBondContact O-N 3.3Å
121N45.1Very low42.2Very low118 Ų118126 Ų12663%0.63162%0.62SS**Hα-helixtrans-68.2-35.5178.1-77.7-5.5000112.6K117 V119 R125K117-N121 PolarHBondContact O-N 3.22Å; V119-N121 PolarHBondContact O-N 2.71Å; N121-R125 WeakPolarHBondContact O-CB 3.45Å; N121-R125 PolarHBondContact O-N 3.22Å; N121-R125 VanDerWaalsContact O-N 3.12Å
122H39.6Very low42.6Very low124 Ų124117.6 Ų117.657%0.57460%0.598SS**Hα-helixtrans-66-46.6175.8-173.5-89.7000111.1R118 V119 A124 R125 M126R118-H122 PolarHBondContact O-N 3.26Å; V119-H122 PolarHBondContact O-N 3.41Å; H122-A124 PolarHBondContact O-N 3.25Å; H122-R125 PolarHBondContact O-N 3.47Å; H122-M126 WeakPolarHBondContact O-CG 3.41Å; H122-M126 PolarHBondContact O-N 2.89Å
123A37.8Very low43Very low52 Ų52116.5 Ų116.543%0.4358%0.578SS.*Hα-helixtrans-60.8-44.2177.700000112.4V119 L120 R125 M126 V127V119-A123 PolarHBondContact O-N 2.88Å; V119-A123 VanDerWaalsContact O-N 3.16Å; L120-A123 PolarHBondContact O-N 2.97Å; A123-R125 VanDerWaalsContact C-N 3.33Å; A123-R125 PolarHBondContact O-N 2.84Å; A123-M126 PolarHBondContact O-N 3.4Å; A123-V127 WeakPolarHBondContact O-CG2 3.5Å; A123-V127 PolarHBondContact O-N 3.04Å
124A42.6Very low43.5Very low53 Ų53117.1 Ų117.144%0.43857%0.565SS.*Hα-helixtrans-60.7-41.9176.800000112.1L120 H122 V127 E128L120-A124 WeakPolarHBondContact O-CB 3.24Å; L120-A124 PolarHBondContact O-N 3.3Å; H122-A124 PolarHBondContact O-N 3.25Å; A124-V127 PolarHBondContact O-N 3.2Å; A124-E128 PolarHBondContact O-N 2.9Å
125R48.6Very low43.8Very low181 Ų181116 Ų11668%0.68356%0.556SS**Hα-helixtrans-64.8-42.4177.7-168.7176.9178.6-179.1-1.6112.2N121 H122 A123 V127 E128 E129N121-R125 WeakPolarHBondContact O-CB 3.45Å; N121-R125 PolarHBondContact O-N 3.22Å; N121-R125 VanDerWaalsContact O-N 3.12Å; H122-R125 PolarHBondContact O-N 3.47Å; A123-R125 VanDerWaalsContact C-N 3.33Å; A123-R125 PolarHBondContact O-N 2.84Å; R125-V127 VanDerWaalsContact C-N 3.33Å; R125-V127 PolarHBondContact O-N 2.98Å; R125-E128 PolarHBondContact O-N 3.37Å; R125-E129 WeakPolarHBondContact O-CB 3.48Å; R125-E129 PolarHBondContact O-N 3.21Å
126M38.5Very low44.2Very low84 Ų84118.8 Ų118.841%0.41456%0.56SS.*Hα-helixtrans-62.8-38.6175.5-68.6-61.7-65.200112.2H122 A123 N130H122-M126 WeakPolarHBondContact O-CG 3.41Å; H122-M126 PolarHBondContact O-N 2.89Å; A123-M126 PolarHBondContact O-N 3.4Å; M126-N130 WeakPolarHBondContact O-CB 3.3Å; M126-N130 VanDerWaalsContact O-CG 3.31Å; M126-N130 PolarHBondContact O-N 3.02Å; M126-N130 PolarHBondContact O-ND2 3.45Å
127V45.7Very low44.3Very low72 Ų72111.6 Ų111.644%0.43655%0.545SS..Hα-helixtrans-66.5-40.7176172.30000111.3A123 A124 R125 R131A123-V127 WeakPolarHBondContact O-CG2 3.5Å; A123-V127 PolarHBondContact O-N 3.04Å; A124-V127 PolarHBondContact O-N 3.2Å; R125-V127 VanDerWaalsContact C-N 3.33Å; R125-V127 PolarHBondContact O-N 2.98Å; V127-R131 WeakPolarHBondContact O-CB 3.38Å; V127-R131 WeakPolarHBondContact O-CG 3.27Å; V127-R131 PolarHBondContact O-N 2.74Å
128E50.2Low44.4Very low138 Ų138106 Ų10665%0.64553%0.532SS*.Hα-helixtrans-67.6-42.9176.6-76.6-175.6167.200112.5A124 R125 R131 A132A124-E128 PolarHBondContact O-N 2.9Å; R125-E128 PolarHBondContact O-N 3.37Å; E128-R131 PolarHBondContact O-N 2.93Å; E128-A132 PolarHBondContact O-N 3.46Å
129E46Very low44.8Very low104 Ų104100.1 Ų100.149%0.48652%0.516SS..Hα-helixtrans-64.7-42.6178-171.3166.3-171.400111.6R125 R131 A132 N133R125-E129 WeakPolarHBondContact O-CB 3.48Å; R125-E129 PolarHBondContact O-N 3.21Å; E129-R131 PolarHBondContact O-N 3.23Å; E129-A132 PolarHBondContact O-N 3.44Å; E129-N133 PolarHBondContact O-N 2.82Å
130N47.7Very low44.7Very low71 Ų71100 Ų10038%0.3851%0.51SS..Hα-helixtrans-63.4-42.1174-76.9-20.7000112.1M126 A132 N133 E134M126-N130 WeakPolarHBondContact O-CB 3.3Å; M126-N130 VanDerWaalsContact O-CG 3.31Å; M126-N130 PolarHBondContact O-N 3.02Å; M126-N130 PolarHBondContact O-ND2 3.45Å; N130-A132 VanDerWaalsContact C-N 3.3Å; N130-A132 PolarHBondContact O-N 3Å; N130-N133 PolarHBondContact O-N 3.34Å; N130-E134 WeakPolarHBondContact O-CB 3.09Å; N130-E134 WeakPolarHBondContact O-CG 3.2Å; N130-E134 PolarHBondContact O-N 3.2Å
131R48.5Very low44.8Very low141 Ų141100.5 Ų100.553%0.53251%0.509SS..Hα-helixtrans-62.6-36.7174.2-80.5177.8174.8170.60.4112.4V127 E128 E129 R135V127-R131 WeakPolarHBondContact O-CB 3.38Å; V127-R131 WeakPolarHBondContact O-CG 3.27Å; V127-R131 PolarHBondContact O-N 2.74Å; E128-R131 PolarHBondContact O-N 2.93Å; E129-R131 PolarHBondContact O-N 3.23Å; R131-R135 WeakPolarHBondContact O-CB 3.35Å; R131-R135 WeakPolarHBondContact O-CG 3.3Å; R131-R135 PolarHBondContact O-N 3.34Å
132A45.2Very low44.6Very low43 Ų43101.1 Ų101.136%0.35551%0.506SS..Hα-helixtrans-66.9-41.3175.600000111.3E128 E129 N130 R135 K136E128-A132 PolarHBondContact O-N 3.46Å; E129-A132 PolarHBondContact O-N 3.44Å; N130-A132 VanDerWaalsContact C-N 3.3Å; N130-A132 PolarHBondContact O-N 3Å; A132-R135 PolarHBondContact O-N 3.11Å; A132-K136 WeakPolarHBondContact O-CG 3.29Å; A132-K136 PolarHBondContact O-N 3.12Å
133N47.2Very low44.6Very low76 Ų7698.3 Ų98.341%0.40650%0.495SS..Hα-helixtrans-68-39.9176.9-71.2-19.6000112.3E129 N130 R135 K136 A137E129-N133 PolarHBondContact O-N 2.82Å; N130-N133 PolarHBondContact O-N 3.34Å; N133-R135 PolarHBondContact O-N 3.1Å; N133-K136 PolarHBondContact O-N 3.49Å; N133-A137 WeakPolarHBondContact O-CB 2.99Å; N133-A137 PolarHBondContact O-N 3.42Å
134E47.6Very low44.9Very low106 Ų106101.5 Ų101.550%0.49550%0.501SS..Hα-helixtrans-61.4-42.3173-74.9170.9-176.200111.7N130 A137 A138N130-E134 WeakPolarHBondContact O-CB 3.09Å; N130-E134 WeakPolarHBondContact O-CG 3.2Å; N130-E134 PolarHBondContact O-N 3.2Å; E134-A137 PolarHBondContact O-N 3.44Å; E134-A138 WeakPolarHBondContact O-CB 3.44Å; E134-A138 PolarHBondContact O-N 3.41Å
135R46Very low44.6Very low169 Ų169101.7 Ų101.764%0.63850%0.499SS*.Hα-helixtrans-63.7-41.3174.9-72.9170.9-170.7176.14.2112.2R131 A132 N133 A138 M139R131-R135 WeakPolarHBondContact O-CB 3.35Å; R131-R135 WeakPolarHBondContact O-CG 3.3Å; R131-R135 PolarHBondContact O-N 3.34Å; A132-R135 PolarHBondContact O-N 3.11Å; N133-R135 PolarHBondContact O-N 3.1Å; R135-A138 PolarHBondContact O-N 3.42Å; R135-M139 WeakPolarHBondContact O-CB 3.31Å; R135-M139 PolarHBondContact O-N 2.9Å
136K46.7Very low44.2Very low138 Ų13896.4 Ų96.460%0.649%0.487SS*.Hα-helixtrans-62.1-45.4174.2-74.8176.2-177.7175.20110.8A132 N133 M139 M140A132-K136 WeakPolarHBondContact O-CG 3.29Å; A132-K136 PolarHBondContact O-N 3.12Å; N133-K136 PolarHBondContact O-N 3.49Å; K136-M139 PolarHBondContact O-N 3.38Å; K136-M140 WeakPolarHBondContact O-CB 3.3Å; K136-M140 VanDerWaalsContact O-CG 3.26Å; K136-M140 WeakPolarHBondContact O-CG 3.4Å; K136-M140 PolarHBondContact O-N 2.9Å
137A44.4Very low44.1Very low62 Ų6296.7 Ų96.751%0.51250%0.497SS..Hα-helixtrans-61.9-45.9177.700000111.9N133 E134 M139 M140 H141N133-A137 WeakPolarHBondContact O-CB 2.99Å; N133-A137 PolarHBondContact O-N 3.42Å; E134-A137 PolarHBondContact O-N 3.44Å; A137-M139 VanDerWaalsContact C-N 3.35Å; A137-M139 PolarHBondContact O-N 3.47Å; A137-M140 PolarHBondContact O-N 3.18Å; A137-H141 WeakPolarHBondContact O-CB 3.45Å; A137-H141 PolarHBondContact O-N 3.04Å
138A45.9Very low43.8Very low59 Ų5998.5 Ų98.549%0.48851%0.509SS..Hα-helixtrans-61.9-41.6176.300000112.2E134 R135 H141 F142E134-A138 WeakPolarHBondContact O-CB 3.44Å; E134-A138 PolarHBondContact O-N 3.41Å; R135-A138 PolarHBondContact O-N 3.42Å; A138-H141 PolarHBondContact O-N 2.83Å; A138-F142 WeakPolarHBondContact O-CB 3.22Å; A138-F142 PolarHBondContact O-N 3.36Å
139M46.5Very low43.1Very low101 Ų10195.9 Ų95.950%0.49851%0.506SS..Hα-helixtrans-67.6-40.8177-166.5171.3102.100111.9R135 K136 A137 F142 L143 M206R135-M139 WeakPolarHBondContact O-CB 3.31Å; R135-M139 PolarHBondContact O-N 2.9Å; K136-M139 PolarHBondContact O-N 3.38Å; A137-M139 VanDerWaalsContact C-N 3.35Å; A137-M139 PolarHBondContact O-N 3.47Å; M139-F142 PolarHBondContact O-N 2.84Å; M139-L143 VanDerWaalsContact O-CG 3.31Å; M139-L143 WeakPolarHBondContact O-CG 3.38Å; M139-L143 PolarHBondContact O-N 2.69Å; M139-M206 HydrophobicContact CE-CE 4.37Å
140M40Very low42.5Very low103 Ų10398.7 Ų98.751%0.50752%0.524SS..Hα-helixtrans-65.4-40175.1-71.8-57.9-63.500111.9K136 A137 L143 Q144K136-M140 WeakPolarHBondContact O-CB 3.3Å; K136-M140 VanDerWaalsContact O-CG 3.26Å; K136-M140 WeakPolarHBondContact O-CG 3.4Å; K136-M140 PolarHBondContact O-N 2.9Å; A137-M140 PolarHBondContact O-N 3.18Å; M140-L143 PolarHBondContact O-N 3.49Å; M140-L143 HydrophobicContact SD-CD1 4.18Å; M140-Q144 WeakPolarHBondContact O-CG 3.4Å; M140-Q144 PolarHBondContact O-N 3.24Å
141H42.1Very low41.7Very low115 Ų115100.6 Ų100.653%0.53254%0.543SS..Hα-helixtrans-62.4-43.4173.9-174.1-82000111.2A137 A138 L143 Q144 S145A137-H141 WeakPolarHBondContact O-CB 3.45Å; A137-H141 PolarHBondContact O-N 3.04Å; A138-H141 PolarHBondContact O-N 2.83Å; H141-L143 VanDerWaalsContact C-N 3.34Å; H141-L143 PolarHBondContact O-N 2.65Å; H141-Q144 PolarHBondContact O-N 3.28Å; H141-S145 WeakPolarHBondContact O-CB 3.41Å; H141-S145 PolarHBondContact O-N 2.96Å; H141-S145 PolarHBondContact O-OG 3.14Å; H141-S145 VanDerWaalsContact O-OG 3.12Å
142F40.4Very low41Very low132 Ų132100.7 Ų100.758%0.57956%0.559SS**Hα-helixtrans-62.1-40.1174.8-174.5-96.6000112.5A138 M139 Q144 S145 T146A138-F142 WeakPolarHBondContact O-CB 3.22Å; A138-F142 PolarHBondContact O-N 3.36Å; M139-F142 PolarHBondContact O-N 2.84Å; F142-Q144 VanDerWaalsContact C-N 3.34Å; F142-S145 WeakPolarHBondContact CA-OG 3.37Å; F142-S145 PolarHBondContact O-OG 3.39Å; F142-S145 VanDerWaalsContact O-OG 3.11Å; F142-T146 HydrophobicContact CD1-CG2 4.26Å; F142-T146 HydrophobicContact CE1-CG2 3.88Å; F142-T146 HydrophobicContact CE2-CG2 4.24Å; F142-T146 HydrophobicContact CZ-CG2 3.87Å; F142-T146 WeakPolarHBondContact O-CB 3.26Å; F142-T146 VanDerWaalsContact O-CG2 3.3Å; F142-T146 WeakPolarHBondContact O-CG2 3.4Å; F142-T146 PolarHBondContact O-N 2.89Å; F142-T146 PolarHBondContact O-OG1 3.32Å
143L40Very low40.4Very low64 Ų64107.6 Ų107.634%0.33558%0.581SS.*Hα-helixtrans-65.9-35.6174.6-71.4170.8000112.3M139 M140 H141 T146 S147M139-L143 VanDerWaalsContact O-CG 3.31Å; M139-L143 WeakPolarHBondContact O-CG 3.38Å; M139-L143 PolarHBondContact O-N 2.69Å; M140-L143 PolarHBondContact O-N 3.49Å; M140-L143 HydrophobicContact SD-CD1 4.18Å; H141-L143 VanDerWaalsContact C-N 3.34Å; H141-L143 PolarHBondContact O-N 2.65Å; L143-T146 PolarHBondContact O-OG1 3.05Å; L143-S147 PolarHBondContact O-N 3.08Å
144Q42.8Very low39.5Very low120 Ų120110.2 Ų110.256%0.56160%0.595SS**Hα-helixtrans-71.6-45.9175.1-74.9176.1-1000111.8M140 H141 F142 T146 S147M140-Q144 WeakPolarHBondContact O-CG 3.4Å; M140-Q144 PolarHBondContact O-N 3.24Å; H141-Q144 PolarHBondContact O-N 3.28Å; F142-Q144 VanDerWaalsContact C-N 3.34Å; Q144-T146 VanDerWaalsContact C-N 3.28Å; Q144-T146 PolarHBondContact O-N 3.46Å; Q144-S147 PolarHBondContact O-N 3.46Å; Q144-S147 PolarHBondContact O-OG 3.33Å
145S37.8Very low38.9Very low56 Ų56114 Ų11439%0.39262%0.615SS.*Hα-helixtrans-66.8-29.2-179.862.20000112.8H141 F142 S147H141-S145 WeakPolarHBondContact O-CB 3.41Å; H141-S145 PolarHBondContact O-N 2.96Å; H141-S145 PolarHBondContact O-OG 3.14Å; H141-S145 VanDerWaalsContact O-OG 3.12Å; F142-S145 WeakPolarHBondContact CA-OG 3.37Å; F142-S145 PolarHBondContact O-OG 3.39Å; F142-S145 VanDerWaalsContact O-OG 3.11Å; S145-S147 VanDerWaalsContact C-N 3.27Å
146T39Very low38.2Very low71 Ų71116.6 Ų116.644%0.43663%0.625SS.*THydrogen-bonded Turntrans-79.2-7.1172.5520000113.6F142 L143 Q144F142-T146 HydrophobicContact CD1-CG2 4.26Å; F142-T146 HydrophobicContact CE1-CG2 3.88Å; F142-T146 HydrophobicContact CE2-CG2 4.24Å; F142-T146 HydrophobicContact CZ-CG2 3.87Å; F142-T146 WeakPolarHBondContact O-CB 3.26Å; F142-T146 VanDerWaalsContact O-CG2 3.3Å; F142-T146 WeakPolarHBondContact O-CG2 3.4Å; F142-T146 PolarHBondContact O-N 2.89Å; F142-T146 PolarHBondContact O-OG1 3.32Å; L143-T146 PolarHBondContact O-OG1 3.05Å; Q144-T146 VanDerWaalsContact C-N 3.28Å; Q144-T146 PolarHBondContact O-N 3.46Å
147S37.3Very low37.6Very low90 Ų90116.4 Ų116.463%0.62964%0.636SS**THydrogen-bonded Turntrans-95.3-12.3177.982.80000114.7L143 Q144 S145L143-S147 PolarHBondContact O-N 3.08Å; Q144-S147 PolarHBondContact O-N 3.46Å; Q144-S147 PolarHBondContact O-OG 3.33Å; S145-S147 VanDerWaalsContact C-N 3.27Å
148T38.4Very low37.1Very low110 Ų110123.5 Ų123.568%0.67566%0.655SS**SBendtrans-103.45.4-173.847.70000115.6
149S35Very low36.4Very low83 Ų83125.2 Ų125.258%0.5866%0.664SS**SBendtrans-106.190.5171.460.20000109.2
150D34.3Very low35.8Very low162 Ų162126.4 Ų126.487%0.86668%0.679SS**  trans172.940.7150.7-82.3-16.4000111.3
151S31Very low35.4Very low111 Ų111127.3 Ų127.378%0.77669%0.694SS**  trans-117.249.3172.583.90000112.5
152T34.3Very low34.8Very low143 Ų143126.1 Ų126.188%0.87770%0.704SS**  trans-10373.2151.5450000107.5
153F31.2Very low34.4Very low188 Ų188131.2 Ų131.283%0.82572%0.719SS**  trans-130.4100.7169.4-150.3-94.8000109.4
154D28.4Very low34Very low131 Ų131137.4 Ų137.470%0.70174%0.743SS**  trans29.3112.3161.7-88.7-41.9000120.2R156D154-R156 VanDerWaalsContact C-N 3.29Å; D154-R156 PolarHBondContact O-N 2.94Å
155M35.6Very low33.4Very low185 Ų185142.6 Ų142.691%0.91176%0.758SS**SBendtrans-58.687.4151.4-81.4-156.5165.600110.7
156R31.2Very low33.1Very low224 Ų224149.6 Ų149.685%0.84578%0.782SS**  trans-178.684.7158.3-100.5157.8-169.6-155.35.6106.8D154D154-R156 VanDerWaalsContact C-N 3.29Å; D154-R156 PolarHBondContact O-N 2.94Å
157T33.7Very low32.8Very low134 Ų134153 Ų15382%0.82280%0.797SS**  -174.6110.288.916.80000105.8S159T157-S159 PolarHBondContact O-N 3.44Å
158K33.8Very low32.4Very low211 Ų211151.9 Ų151.992%0.91780%0.8SS**  trans-66.685.9167.5-68.4177.9179.8176.90107.4P160K158-P160 WeakPolarHBondContact O-CD 3.41Å
159S31Very low32.1Very low96 Ų96154.1 Ų154.167%0.67181%0.808SS**  trans-70.7123.4159.563.10000106.4T157 C161T157-S159 PolarHBondContact O-N 3.44Å; S159-C161 VanDerWaalsContact C-N 3.26Å; S159-C161 PolarHBondContact O-N 2.85Å
160P35.5Very low31.9Very low126 Ų126156.9 Ų156.982%0.81882%0.821SS**  trans-70.292179.327-30.4000107.4K158 A162K158-P160 WeakPolarHBondContact O-CD 3.41Å; P160-A162 PolarHBondContact O-N 3.32Å
161C30.8Very low31.8Very low121 Ų121153.5 Ų153.582%0.81882%0.816SS**  trans-65103.9173.6-1470000106.6S159 R163S159-C161 VanDerWaalsContact C-N 3.26Å; S159-C161 PolarHBondContact O-N 2.85Å; C161-R163 PolarHBondContact O-N 2.85Å; C161-R163 VanDerWaalsContact O-N 3.07Å
162A30.5Very low31.9Very low90 Ų90154 Ų15474%0.74482%0.816SS**  trans-49.1117.1-177.500000109.4P160 K164P160-A162 PolarHBondContact O-N 3.32Å; A162-K164 VanDerWaalsContact C-N 3.27Å; A162-K164 PolarHBondContact O-N 3.33Å
163R31.8Very low31.8Very low239 Ų239156.2 Ų156.290%0.90282%0.819SS**  trans-62.990.1177.9-156.1175.3-172.8171.61.3107.4C161 R165C161-R163 PolarHBondContact O-N 2.85Å; C161-R163 VanDerWaalsContact O-N 3.07Å; R163-R165 PolarHBondContact O-N 3.46Å
164K31.3Very low31.8Very low194 Ų194155.8 Ų155.884%0.84382%0.82SS**  trans-57.4106.2166.2-102.3-176.4176.1179.80106A162 F166A162-K164 VanDerWaalsContact C-N 3.27Å; A162-K164 PolarHBondContact O-N 3.33Å; K164-F166 VanDerWaalsContact C-N 3.33Å; K164-F166 PolarHBondContact O-N 2.93Å
165R30.2Very low32Very low230 Ų230154 Ų15487%0.86882%0.823SS**  trans-59.399.6171.4-67.7-175.1177.4-168.7-0.6106.5R163 N167R163-R165 PolarHBondContact O-N 3.46Å; R165-N167 PolarHBondContact O-N 3.2Å
166F31.4Very low31.8Very low203 Ų203149.5 Ų149.589%0.8982%0.815SS**  trans-73.2105.6164.4-132.1-94.3000105K164 G168K164-F166 VanDerWaalsContact C-N 3.33Å; K164-F166 PolarHBondContact O-N 2.93Å; F166-G168 PolarHBondContact O-N 3.13Å; F166-G168 VanDerWaalsContact O-N 3.08Å
167N32.2Very low31.9Very low141 Ų141146.5 Ų146.575%0.75482%0.815SS**  trans-55.4114.9175-81.6-12.3000107.9R165 N169R165-N167 PolarHBondContact O-N 3.2Å; N167-N169 PolarHBondContact O-N 3.45Å
168G29.6Very low31.8Very low67 Ų67145.6 Ų145.669%0.69181%0.809SS**  trans-61.8118.3171.800000108.9F166F166-G168 PolarHBondContact O-N 3.13Å; F166-G168 VanDerWaalsContact O-N 3.08Å
169N30.4Very low31.7Very low158 Ų158143.2 Ų143.285%0.84581%0.807SS**  trans-158.865.4160-89.8-13.8000106.9N167N167-N169 PolarHBondContact O-N 3.45Å
170T31.8Very low31.7Very low141 Ų141146.4 Ų146.487%0.86581%0.811SS**  trans-133.885.6161.87.10000106.3
171A31.4Very low31.4Very low90 Ų90149.2 Ų149.274%0.74481%0.813SS**  trans-57.5144.1170.500000109.6M173A171-M173 PolarHBondContact O-N 3.21Å; A171-M173 VanDerWaalsContact O-N 3.12Å
172P33.9Very low31.3Very low121 Ų121151.8 Ų151.879%0.78681%0.813SS**  trans-67.4113.4-179.127.5-31.2000108.8E174P172-E174 PolarHBondContact O-N 3.2Å; P172-E174 VanDerWaalsContact O-N 3.11Å
173M32.6Very low31.2Very low190 Ų190155.8 Ų155.894%0.93682%0.816SS**  trans-64.5110.1176.3-170.5166.2163.800108.3A171A171-M173 PolarHBondContact O-N 3.21Å; A171-M173 VanDerWaalsContact O-N 3.12Å
174E30Very low31.1Very low180 Ų180149.6 Ų149.684%0.84181%0.807SS**  trans-53.8139.4-179.9-72.5-178.914500111.2P172 A176P172-E174 PolarHBondContact O-N 3.2Å; P172-E174 VanDerWaalsContact O-N 3.11Å; E174-A176 PolarHBondContact O-N 3.01Å
175A33.5Very low30.9Very low93 Ų93147.4 Ų147.477%0.76981%0.805SS**  trans-6298.2178.100000109.9L177A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 3.32Å
176A32Very low30.9Very low90 Ų90141.9 Ų141.974%0.74480%0.796SS**  trans-65.193.4168.600000109.3E174 T178E174-A176 PolarHBondContact O-N 3.01Å; A176-T178 PolarHBondContact O-N 3.41Å
177L31.5Very low30.8Very low162 Ų162137.2 Ų137.285%0.84878%0.784SS**  trans-62.4102.1153.2-83.1140.8000107.8A175A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 3.32Å
178T33.4Very low30.7Very low114 Ų114139.1 Ų139.170%0.69979%0.788SS**  trans-131.999.9158.328.50000107.9A176 E180A176-T178 PolarHBondContact O-N 3.41Å; T178-E180 PolarHBondContact O-N 3.5Å
179D30.1Very low30.6Very low161 Ų161147.1 Ų147.186%0.86180%0.798SS**  trans-53.787.6153.5-84.1-44.2000108.8
180E30.9Very low30.8Very low164 Ų164148.5 Ų148.577%0.76680%0.796SS**  trans-116.891.3160.1-76.4-94.2112.200105.9T178 E182T178-E180 PolarHBondContact O-N 3.5Å; E180-E182 PolarHBondContact O-N 3.42Å
181Q31Very low30.9Very low184 Ų184146.4 Ų146.486%0.8679%0.788SS**  trans-65.665.5176-161.5178.639.400109.4Q183Q181-Q183 VanDerWaalsContact C-N 3.33Å; Q181-Q183 PolarHBondContact O-N 3.44Å
182E28.5Very low31.1Very low175 Ų175146 Ų14682%0.81878%0.779SS**  trans-68.995.3168.6-87.2-162.8140.200108.1E180 P184E180-E182 PolarHBondContact O-N 3.42Å; E182-P184 WeakPolarHBondContact O-CD 3.41Å; E182-P184 VanDerWaalsContact O-N 3.1Å
183Q27.1Very low31.2Very low174 Ų174150.3 Ų150.381%0.81378%0.78SS**  trans-54115.4161.1-80.4-174.3-1.500107.6Q181 N185Q181-Q183 VanDerWaalsContact C-N 3.33Å; Q181-Q183 PolarHBondContact O-N 3.44Å; Q183-N185 PolarHBondContact O-N 2.98Å
184P29.2Very low31Very low109 Ų109142.9 Ų142.971%0.70875%0.752SS**  trans-65.7108.2173.825.8-30.4000106.4E182 V186E182-P184 WeakPolarHBondContact O-CD 3.41Å; E182-P184 VanDerWaalsContact O-N 3.1Å; P184-V186 HydrophobicContact CB-CG2 4.27Å; P184-V186 HydrophobicContact CG-CG2 4.42Å; P184-V186 WeakPolarHBondContact O-CG2 3.32Å; P184-V186 PolarHBondContact O-N 3.25Å
185N28Very low30.9Very low148 Ų148141.1 Ų141.179%0.79174%0.742SS**  trans-6684.9168-159.7-12000106.2Q183 T187Q183-N185 PolarHBondContact O-N 2.98Å; N185-T187 PolarHBondContact O-N 2.88Å
186V30.8Very low30.8Very low114 Ų114141.6 Ų141.669%0.69173%0.731SS**  trans-6979.5-178.9-174.20000107.2P184 H188P184-V186 HydrophobicContact CB-CG2 4.27Å; P184-V186 HydrophobicContact CG-CG2 4.42Å; P184-V186 WeakPolarHBondContact O-CG2 3.32Å; P184-V186 PolarHBondContact O-N 3.25Å; V186-H188 PolarHBondContact O-N 3.04Å
187T29Very low31Very low105 Ų105142.5 Ų142.564%0.64472%0.722SS**  trans-54.9124.2159.742.90000106.4N185 R189N185-T187 PolarHBondContact O-N 2.88Å; T187-R189 PolarHBondContact O-N 3Å
188H29.4Very low31Very low181 Ų181139.8 Ų139.884%0.83871%0.708SS**  trans-54.974.5176.5-101.3-87.1000110.5V186 K190V186-H188 PolarHBondContact O-N 3.04Å; H188-K190 PolarHBondContact O-N 2.83Å
189R28Very low31.2Very low235 Ų235139.3 Ų139.389%0.88770%0.698SS**  trans-70.789.9163-94.5-171.5173-179.50.1105.8T187 S191T187-R189 PolarHBondContact O-N 3Å; R189-S191 PolarHBondContact O-N 3.04Å
190K34.5Very low31.6Very low188 Ų188138.1 Ų138.182%0.81769%0.685SS**  trans-40106.6158.8-66174-179.1174.50105.8H188 S192H188-K190 PolarHBondContact O-N 2.83Å; K190-S192 PolarHBondContact O-N 2.87Å
191S33.7Very low32Very low97 Ų97136.7 Ų136.768%0.67868%0.68SS**  trans-59.692.2176.6174.40000106.6R189R189-S191 PolarHBondContact O-N 3.04Å
192S35.2Very low32.6Very low81 Ų81134.4 Ų134.457%0.56667%0.668SS**  trans-70.9139.6179.868.70000106.4K190 G194 F195K190-S192 PolarHBondContact O-N 2.87Å; S192-G194 PolarHBondContact O-N 3.38Å; S192-F195 PolarHBondContact O-N 2.83Å
193R36Very low33.4Very low212 Ų212130.1 Ų130.180%0.865%0.649SS**THydrogen-bonded Turntrans-39.9-26174.9-99.8173.4159.6168.8-7.4114.2F195 L196 L197R193-F195 VanDerWaalsContact C-N 3.31Å; R193-F195 PolarHBondContact O-N 2.71Å; R193-L196 PolarHBondContact O-N 2.78Å; R193-L197 PolarHBondContact O-N 2.73Å
194G29.7Very low34.3Very low34 Ų34126.8 Ų126.835%0.35163%0.63SS.*Hα-helixtrans-57.3-34.1174.300000114.8S192 L197 L198S192-G194 PolarHBondContact O-N 3.38Å; G194-L197 PolarHBondContact O-N 3.48Å; G194-L198 WeakPolarHBondContact O-CG 3.47Å; G194-L198 PolarHBondContact O-N 2.86Å
195F27.7Very low35.2Very low143 Ų143127.4 Ų127.463%0.62762%0.623SS**Hα-helixtrans-68.8-41.4-178.6-155.3-90.2000112S192 R193 L197 L198 E199S192-F195 PolarHBondContact O-N 2.83Å; R193-F195 VanDerWaalsContact C-N 3.31Å; R193-F195 PolarHBondContact O-N 2.71Å; F195-L197 VanDerWaalsContact C-N 3.34Å; F195-L198 PolarHBondContact O-N 3.31Å; F195-E199 PolarHBondContact O-N 3.35Å; F195-E199 VanDerWaalsContact O-N 3.14Å
196L32.2Very low36Very low102 Ų102125.1 Ų125.153%0.53461%0.609SS.*Hα-helixtrans-68.8-32.8174.5-73.1168.1000112.3R193 K200R193-L196 PolarHBondContact O-N 2.78Å; L196-K200 WeakPolarHBondContact O-CG 3.4Å; L196-K200 PolarHBondContact O-N 3.48Å; L196-K200 VanDerWaalsContact O-N 3.13Å
197L34.3Very low36.7Very low109 Ų109123.6 Ų123.657%0.57160%0.596SS**Hα-helixtrans-67.4-43.5175.5-106.6144.8000111.9R193 G194 F195 E199 K200 M201R193-L197 PolarHBondContact O-N 2.73Å; G194-L197 PolarHBondContact O-N 3.48Å; F195-L197 VanDerWaalsContact C-N 3.34Å; L197-E199 VanDerWaalsContact C-N 3.31Å; L197-E199 PolarHBondContact O-N 3.26Å; L197-K200 PolarHBondContact O-N 3.39Å; L197-M201 PolarHBondContact O-N 2.98Å; L197-M201 VanDerWaalsContact O-N 3.1Å
198L32Very low37.7Very low106 Ų106120.1 Ų120.156%0.55558%0.575SS**Hα-helixtrans-61.9-39.4175-77.4164.5000111.6G194 F195 K202G194-L198 WeakPolarHBondContact O-CG 3.47Å; G194-L198 PolarHBondContact O-N 2.86Å; F195-L198 PolarHBondContact O-N 3.31Å; L198-K202 WeakPolarHBondContact O-CB 3.47Å; L198-K202 WeakPolarHBondContact O-CG 3.12Å; L198-K202 PolarHBondContact O-N 3.46Å
199E38.4Very low38.4Very low104 Ų104115 Ų11549%0.48656%0.559SS.*Hα-helixtrans-66.8-40.7178.1-156.1171.8-163.900111.9F195 L197 K202 I203F195-E199 PolarHBondContact O-N 3.35Å; F195-E199 VanDerWaalsContact O-N 3.14Å; L197-E199 VanDerWaalsContact C-N 3.31Å; L197-E199 PolarHBondContact O-N 3.26Å; E199-K202 PolarHBondContact O-N 3.38Å; E199-I203 VanDerWaalsContact O-CG1 3.3Å; E199-I203 WeakPolarHBondContact O-CG1 3.39Å; E199-I203 PolarHBondContact O-N 3.49Å
200K39.1Very low39.2Very low135 Ų135109.5 Ų109.559%0.58754%0.539SS*.Hα-helixtrans-64.3-44.7176.7-74.6-178.1179.2-169.80113.2L196 L197 I203 Y204L196-K200 WeakPolarHBondContact O-CG 3.4Å; L196-K200 PolarHBondContact O-N 3.48Å; L196-K200 VanDerWaalsContact O-N 3.13Å; L197-K200 PolarHBondContact O-N 3.39Å; K200-I203 PolarHBondContact O-N 2.84Å; K200-Y204 PolarHBondContact O-N 2.86Å
201M37.9Very low39.8Very low134 Ų134104.7 Ų104.766%0.6652%0.515SS*.Hα-helixtrans-66.5-39.5176.4-86.9-166153.100111.8L197 I203 Y204 E205L197-M201 PolarHBondContact O-N 2.98Å; L197-M201 VanDerWaalsContact O-N 3.1Å; M201-I203 PolarHBondContact O-N 3.06Å; M201-Y204 PolarHBondContact O-N 2.97Å; M201-E205 WeakPolarHBondContact O-CG 3.49Å; M201-E205 PolarHBondContact O-N 2.75Å
202K44.6Very low40.6Very low137 Ų137107.5 Ų107.560%0.59651%0.511SS*.Hα-helixtrans-62-40.1175.9-77177.7179.4-172.20112.8L198 E199 M206L198-K202 WeakPolarHBondContact O-CB 3.47Å; L198-K202 WeakPolarHBondContact O-CG 3.12Å; L198-K202 PolarHBondContact O-N 3.46Å; E199-K202 PolarHBondContact O-N 3.38Å; K202-M206 WeakPolarHBondContact O-CB 3.17Å; K202-M206 PolarHBondContact O-N 3.08Å
203I44.5Very low41Very low85 Ų85108.9 Ų108.944%0.43651%0.511SS..Hα-helixtrans-63.6-44.5175.9-67.4164000110.4E199 K200 M201 M206 I207E199-I203 VanDerWaalsContact O-CG1 3.3Å; E199-I203 WeakPolarHBondContact O-CG1 3.39Å; E199-I203 PolarHBondContact O-N 3.49Å; K200-I203 PolarHBondContact O-N 2.84Å; M201-I203 PolarHBondContact O-N 3.06Å; I203-M206 PolarHBondContact O-N 3.42Å; I203-I207 HydrophobicContact CG2-CD1 3.82Å; I203-I207 HydrophobicContact CG2-CG1 4.46Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.32Å; I203-I207 PolarHBondContact O-N 3.06Å
204Y46.2Very low41.4Very low104 Ų104104.3 Ų104.341%0.40849%0.494SS..Hα-helixtrans-62.8-48.2177.2-177-97.5000112K200 M201 M206 I207 V208K200-Y204 PolarHBondContact O-N 2.86Å; M201-Y204 PolarHBondContact O-N 2.97Å; Y204-M206 VanDerWaalsContact C-N 3.26Å; Y204-M206 PolarHBondContact O-N 3.46Å; Y204-I207 PolarHBondContact O-N 3.01Å; Y204-V208 HydrophobicContact CD1-CG2 4.02Å; Y204-V208 HydrophobicContact CD2-CG2 4.49Å; Y204-V208 HydrophobicContact CE1-CG2 3.59Å; Y204-V208 HydrophobicContact CE2-CG2 4.1Å; Y204-V208 HydrophobicContact CG-CG2 4.46Å; Y204-V208 WeakPolarHBondContact O-CG2 3.41Å; Y204-V208 PolarHBondContact O-N 3.27Å
205E47.6Very low42.1Very low121 Ų121105 Ų10557%0.56549%0.488SS*.Hα-helixtrans-59.2-38.1175.7-76.7-176.3165.200112M201 S209M201-E205 WeakPolarHBondContact O-CG 3.49Å; M201-E205 PolarHBondContact O-N 2.75Å; E205-S209 WeakPolarHBondContact O-CB 3.46Å; E205-S209 PolarHBondContact O-N 2.96Å; E205-S209 PolarHBondContact O-OG 3.05Å
206M45.1Very low43Very low101 Ų101107 Ų10750%0.49849%0.492SS..Hα-helixtrans-65.1-45.6175.8-174-176.670.700111.5M139 K202 I203 Y204 S209 W210M139-M206 HydrophobicContact CE-CE 4.37Å; K202-M206 WeakPolarHBondContact O-CB 3.17Å; K202-M206 PolarHBondContact O-N 3.08Å; I203-M206 PolarHBondContact O-N 3.42Å; Y204-M206 VanDerWaalsContact C-N 3.26Å; Y204-M206 PolarHBondContact O-N 3.46Å; M206-S209 PolarHBondContact O-N 2.85Å; M206-W210 VanDerWaalsContact O-CB 3.28Å; M206-W210 WeakPolarHBondContact O-CB 3.31Å; M206-W210 PolarHBondContact O-N 3.12Å
207I46.7Very low43.7Very low82 Ų82106 Ų10642%0.42149%0.49SS..Hα-helixtrans-62.7-46.7177.2-67.8166.4000110.5I203 Y204 W210 W211I203-I207 HydrophobicContact CG2-CD1 3.82Å; I203-I207 HydrophobicContact CG2-CG1 4.46Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.32Å; I203-I207 PolarHBondContact O-N 3.06Å; Y204-I207 PolarHBondContact O-N 3.01Å; I207-W210 PolarHBondContact O-N 2.88Å; I207-W211 WeakPolarHBondContact O-CB 3.49Å; I207-W211 PolarHBondContact O-N 2.83Å
208V48.8Very low44Very low32 Ų32108.5 Ų108.519%0.19449%0.492CS..Hα-helixtrans-65.2-40.4178.31730000111.3Y204 W211 R212Y204-V208 HydrophobicContact CD1-CG2 4.02Å; Y204-V208 HydrophobicContact CD2-CG2 4.49Å; Y204-V208 HydrophobicContact CE1-CG2 3.59Å; Y204-V208 HydrophobicContact CE2-CG2 4.1Å; Y204-V208 HydrophobicContact CG-CG2 4.46Å; Y204-V208 WeakPolarHBondContact O-CG2 3.41Å; Y204-V208 PolarHBondContact O-N 3.27Å; V208-W211 PolarHBondContact O-N 2.93Å; V208-R212 WeakPolarHBondContact O-CB 3.39Å; V208-R212 WeakPolarHBondContact O-CG 3.49Å; V208-R212 PolarHBondContact O-N 3.22Å
209S44.1Very low44.1Very low73 Ų73107.8 Ų107.851%0.5150%0.495SS..Hα-helixtrans-65.9-44177.6-63.30000111.6E205 M206 R212 L213E205-S209 WeakPolarHBondContact O-CB 3.46Å; E205-S209 PolarHBondContact O-N 2.96Å; E205-S209 PolarHBondContact O-OG 3.05Å; M206-S209 PolarHBondContact O-N 2.85Å; S209-R212 PolarHBondContact O-N 3.3Å; S209-L213 WeakPolarHBondContact O-CB 3.22Å; S209-L213 PolarHBondContact O-N 3.07Å
210W45.4Very low44.1Very low119 Ų119110.4 Ų110.445%0.45151%0.505SS..Hα-helixtrans-62-43174.7179.883.3000111.6M206 I207 L213 R214M206-W210 VanDerWaalsContact O-CB 3.28Å; M206-W210 WeakPolarHBondContact O-CB 3.31Å; M206-W210 PolarHBondContact O-N 3.12Å; I207-W210 PolarHBondContact O-N 2.88Å; W210-L213 WeakPolarHBondContact O-CB 3.2Å; W210-L213 PolarHBondContact O-N 3.21Å; W210-R214 PolarHBondContact O-N 2.91Å
211W46.7Very low44.1Very low87 Ų87111.1 Ų111.133%0.3352%0.515SS..Hα-helixtrans-64.6-45.4176.7-17679000112.3I207 V208 L213 R214 Q215 L259I207-W211 WeakPolarHBondContact O-CB 3.49Å; I207-W211 PolarHBondContact O-N 2.83Å; V208-W211 PolarHBondContact O-N 2.93Å; W211-L213 VanDerWaalsContact C-N 3.27Å; W211-L213 PolarHBondContact O-N 3.5Å; W211-R214 PolarHBondContact O-N 3.4Å; W211-R214 VanDerWaalsContact O-N 3.14Å; W211-Q215 HydrophobicContact CD2-CG 4.1Å; W211-Q215 HydrophobicContact CE3-CG 4.37Å; W211-Q215 HydrophobicContact CH2-CG 4.2Å; W211-Q215 HydrophobicContact CZ2-CG 3.91Å; W211-Q215 VanDerWaalsContact CZ2-NE2 3.3Å; W211-Q215 HydrophobicContact CZ3-CG 4.42Å; W211-Q215 WeakPolarHBondContact O-CG 3.49Å; W211-Q215 PolarHBondContact O-N 3.31Å; W211-L259 HydrophobicContact CD2-CD1 4.45Å
212R50.2Low43.9Very low157 Ų157109.5 Ų109.559%0.59252%0.516SS*.Hα-helixtrans-59.4-38.3173.5-77.5-179.1179.9178.60.9112V208 S209 R216V208-R212 WeakPolarHBondContact O-CB 3.39Å; V208-R212 WeakPolarHBondContact O-CG 3.49Å; V208-R212 PolarHBondContact O-N 3.22Å; S209-R212 PolarHBondContact O-N 3.3Å; R212-R216 WeakPolarHBondContact O-CB 3.35Å; R212-R216 WeakPolarHBondContact O-CG 3.43Å; R212-R216 PolarHBondContact O-N 3.11Å
213L44.5Very low43.6Very low109 Ų109111.6 Ų111.657%0.57153%0.526SS*.Hα-helixtrans-63.2-44.6175.2-174.866.9000111S209 W210 W211 R216 T217S209-L213 WeakPolarHBondContact O-CB 3.22Å; S209-L213 PolarHBondContact O-N 3.07Å; W210-L213 WeakPolarHBondContact O-CB 3.2Å; W210-L213 PolarHBondContact O-N 3.21Å; W211-L213 VanDerWaalsContact C-N 3.27Å; W211-L213 PolarHBondContact O-N 3.5Å; L213-R216 PolarHBondContact O-N 3.45Å; L213-T217 PolarHBondContact O-N 2.89Å; L213-T217 PolarHBondContact O-OG1 2.84Å
214R43.9Very low43.1Very low117 Ų117113 Ų11344%0.44254%0.538SS..Hα-helixtrans-66.7-36.3178.7-158.6176.4-170.9178.42.6113.2W210 W211 T217 R218W210-R214 PolarHBondContact O-N 2.91Å; W211-R214 PolarHBondContact O-N 3.4Å; W211-R214 VanDerWaalsContact O-N 3.14Å; R214-T217 WeakPolarHBondContact CA-OG1 3.34Å; R214-T217 PolarHBondContact O-N 3.42Å; R214-T217 PolarHBondContact O-OG1 3Å; R214-R218 PolarHBondContact O-N 3.31Å; R214-R218 VanDerWaalsContact O-N 3.13Å
215Q43.7Very low42.6Very low48 Ų48114.8 Ų114.822%0.22456%0.56CS.*Hα-helixtrans-67-40.4172.6-69.7-68.8-0.700111.3W211 T217 R218 C219W211-Q215 HydrophobicContact CD2-CG 4.1Å; W211-Q215 HydrophobicContact CE3-CG 4.37Å; W211-Q215 HydrophobicContact CH2-CG 4.2Å; W211-Q215 HydrophobicContact CZ2-CG 3.91Å; W211-Q215 VanDerWaalsContact CZ2-NE2 3.3Å; W211-Q215 HydrophobicContact CZ3-CG 4.42Å; W211-Q215 WeakPolarHBondContact O-CG 3.49Å; W211-Q215 PolarHBondContact O-N 3.31Å; Q215-T217 VanDerWaalsContact C-N 3.34Å; Q215-T217 PolarHBondContact O-N 3.02Å; Q215-R218 PolarHBondContact O-N 3.09Å; Q215-C219 PolarHBondContact O-N 3.36Å; Q215-C219 PolarHBondContact O-SG 2.74Å
216R46.8Very low41.9Very low184 Ų184117.3 Ų117.369%0.69457%0.569SS**Hα-helixtrans-64.8-34.4175.8-76.9177.8179.5-176.20113.3R212 L213R212-R216 WeakPolarHBondContact O-CB 3.35Å; R212-R216 WeakPolarHBondContact O-CG 3.43Å; R212-R216 PolarHBondContact O-N 3.11Å; L213-R216 PolarHBondContact O-N 3.45Å
217T46.9Very low41.5Very low82 Ų82123.5 Ų123.550%0.50359%0.586SS.*Hα-helixtrans-70.4-42174.7510000111.1L213 R214 Q215 C219 K220L213-T217 PolarHBondContact O-N 2.89Å; L213-T217 PolarHBondContact O-OG1 2.84Å; R214-T217 WeakPolarHBondContact CA-OG1 3.34Å; R214-T217 PolarHBondContact O-N 3.42Å; R214-T217 PolarHBondContact O-OG1 3Å; Q215-T217 VanDerWaalsContact C-N 3.34Å; Q215-T217 PolarHBondContact O-N 3.02Å; T217-C219 PolarHBondContact O-N 2.67Å; T217-K220 PolarHBondContact O-N 3.17Å
218R40.6Very low40.9Very low162 Ų162126.8 Ų126.861%0.61161%0.605SS**Hα-helixtrans-66.3-30.6176.1-72.5-176.1173.2-172.3-3.6114.2R214 Q215 K220R214-R218 PolarHBondContact O-N 3.31Å; R214-R218 VanDerWaalsContact O-N 3.13Å; Q215-R218 PolarHBondContact O-N 3.09Å; R218-K220 VanDerWaalsContact C-N 3.35Å
219C34.8Very low40Very low90 Ų90134.6 Ų134.661%0.60864%0.636SS**G310 helixtrans-79.5-10.1177.1-720000114.6Q215 T217Q215-C219 PolarHBondContact O-N 3.36Å; Q215-C219 PolarHBondContact O-SG 2.74Å; T217-C219 PolarHBondContact O-N 2.67Å
220K37.9Very low39.5Very low160 Ų160137 Ų13770%0.69665%0.65SS**G310 helixtrans-77.2-20.1179.9-89-176.2176.2-176.70113.9T217 R218 S222T217-K220 PolarHBondContact O-N 3.17Å; R218-K220 VanDerWaalsContact C-N 3.35Å; K220-S222 VanDerWaalsContact C-N 3.29Å; K220-S222 PolarHBondContact O-N 3.24Å
221D38.9Very low38.9Very low149 Ų149135.3 Ų135.380%0.79766%0.661SS**G310 helixtrans-84.7-3.8-177.7-59.5-29.5000113.4K223D221-K223 VanDerWaalsContact C-N 3.34Å; D221-K223 PolarHBondContact O-N 2.83Å
222S35Very low38.1Very low100 Ų100137.7 Ų137.770%0.69968%0.681SS**G310 helixtrans-90.114.7178.3178.40000113.9K220 V224K220-S222 VanDerWaalsContact C-N 3.29Å; K220-S222 PolarHBondContact O-N 3.24Å; S222-V224 VanDerWaalsContact C-N 3.32Å; S222-V224 PolarHBondContact O-N 2.87Å
223K36.6Very low37.2Very low181 Ų181137.1 Ų137.179%0.78769%0.689SS**SBendtrans-76.387.5174.8-77.5-166178-173.90111.3D221D221-K223 VanDerWaalsContact C-N 3.34Å; D221-K223 PolarHBondContact O-N 2.83Å
224V34.2Very low36.6Very low116 Ų116143.3 Ų143.370%0.70371%0.705SS**  trans5175.3137.4-167.50000113.6S222 K226S222-V224 VanDerWaalsContact C-N 3.32Å; S222-V224 PolarHBondContact O-N 2.87Å; V224-K226 VanDerWaalsContact C-N 3.26Å; V224-K226 HydrophobicContact CG1-CG 4.29Å; V224-K226 PolarHBondContact O-N 3.34Å
225V35.5Very low36Very low141 Ų141142.2 Ų142.286%0.85572%0.721SS**  trans-59.7100.7149176.80000105.8R227V225-R227 PolarHBondContact O-N 3.49Å
226K34.2Very low35.4Very low174 Ų174149.3 Ų149.376%0.75775%0.754SS**  trans-53.7114171.9-79.2179.8174.7179.10107.3V224 N228V224-K226 VanDerWaalsContact C-N 3.26Å; V224-K226 HydrophobicContact CG1-CG 4.29Å; V224-K226 PolarHBondContact O-N 3.34Å; K226-N228 PolarHBondContact O-N 3.34Å
227R37Very low34.6Very low230 Ų230147.4 Ų147.487%0.86876%0.763SS**  trans-50101.1166.8-93.2174.9162.3159.6-6.1108.6V225 K229V225-R227 PolarHBondContact O-N 3.49Å; R227-K229 PolarHBondContact O-N 3.01Å
228N32.4Very low33.8Very low151 Ų151147.7 Ų147.781%0.80777%0.774SS**  trans-70.4104.3153.3-70.9-19.7000105.2K226 P230K226-N228 PolarHBondContact O-N 3.34Å; N228-P230 WeakPolarHBondContact O-CD 3.48Å
229K30.5Very low33.1Very low196 Ų196147.2 Ų147.285%0.85278%0.783SS**PPolyproline II helixtrans-64.8117.2168.2-81.9179.6172.9-178.60107.5R227R227-K229 PolarHBondContact O-N 3.01Å
230P34.3Very low32.9Very low125 Ų125148.3 Ų148.381%0.81279%0.792SS**PPolyproline II helixtrans-78.1121.6159.40.819.3000107N228N228-P230 WeakPolarHBondContact O-CD 3.48Å
231A31.3Very low32.6Very low82 Ų82145.7 Ų145.768%0.67879%0.794SS**PPolyproline II helixtrans-68.2144.6168.900000110.1
232D30.7Very low32.4Very low138 Ų138144.4 Ų144.474%0.73879%0.793SS**  trans61.3100.1146.4-64.7-14000119
233N31.2Very low32.4Very low145 Ų145148.2 Ų148.278%0.77581%0.805SS**  150.4140.191.1-94-35.1000113.8
234R31.1Very low32Very low239 Ų239142.6 Ų142.690%0.90280%0.799SS**  trans87.4111.3156.3-74.6177.8175.3-179.6-1.6119.9
235A31.3Very low31.8Very low93 Ų93148.7 Ų148.777%0.76981%0.809SS**  trans-46.5131167.100000114.6
236Q31.7Very low31.4Very low197 Ų197146.4 Ų146.492%0.92180%0.799SS**  trans-132.4118.2144.2-73.7-173.4-0.900108
237T29.6Very low31.4Very low144 Ų144142.7 Ų142.788%0.88380%0.795SS**  trans-83.7115.6174.6-22.30000107.4
238A30.8Very low31.3Very low88 Ų88135.9 Ų135.973%0.72779%0.788SS**  trans-163.4118.3157.400000110.4
239D27.1Very low31.4Very low153 Ų153133.4 Ų133.482%0.81878%0.779SS**  trans62.7114.8152-64-24.9000122.4S241D239-S241 PolarHBondContact O-N 3.47Å
240S30.4Very low31.4Very low112 Ų112129.9 Ų129.978%0.78377%0.768SS**  trans-33.2117.8156.347.70000114.4
241S30.5Very low31.4Very low106 Ų106131.8 Ų131.874%0.74177%0.766SS**  trans-123.3126.6147.4-77.20000107.8D239 L243D239-S241 PolarHBondContact O-N 3.47Å; S241-L243 PolarHBondContact O-N 3.19Å
242P35.9Very low31.6Very low121 Ų121131.5 Ų131.579%0.78675%0.754SS**  trans-64.7129.3-170.227.6-32.1000108.4G244P242-G244 VanDerWaalsContact C-N 3.32Å; P242-G244 PolarHBondContact O-N 3.41Å
243L34.6Very low31.7Very low180 Ų180128.9 Ų128.994%0.94274%0.74SS**  trans-50100.4176.2-83.3113.5000109S241 R245S241-L243 PolarHBondContact O-N 3.19Å; L243-R245 PolarHBondContact O-N 3Å
244G27Very low32Very low64 Ų64127.6 Ų127.666%0.6673%0.733SS**  trans-50.5113.9172.300000107.7P242 S246P242-G244 VanDerWaalsContact C-N 3.32Å; P242-G244 PolarHBondContact O-N 3.41Å; G244-S246 VanDerWaalsContact C-N 3.32Å; G244-S246 PolarHBondContact O-N 3.43Å
245R30.1Very low32.2Very low244 Ų244119.8 Ų119.892%0.92171%0.714SS**  trans-44.4107.2157.3-97.6176.7169.6171.7-3.4105.9L243 S247L243-R245 PolarHBondContact O-N 3Å; R245-S247 PolarHBondContact O-N 3.24Å
246S28.3Very low32.4Very low92 Ų92117.2 Ų117.264%0.64369%0.691SS**  trans-56.2115.2-177-50.30000107.7G244 A248 T249G244-S246 VanDerWaalsContact C-N 3.32Å; G244-S246 PolarHBondContact O-N 3.43Å; S246-A248 PolarHBondContact O-N 2.87Å; S246-T249 PolarHBondContact O-N 3.11Å; S246-T249 PolarHBondContact O-OG1 2.73Å
247S33.2Very low32.7Very low97 Ų97112.4 Ų112.468%0.67867%0.671SS**THydrogen-bonded Turntrans-58.75.9179.9-54.80000114.7R245 T249R245-S247 PolarHBondContact O-N 3.24Å; S247-T249 PolarHBondContact O-N 2.93Å
248A36.1Very low33.2Very low87 Ų87107.7 Ų107.772%0.71965%0.646SS**THydrogen-bonded Turntrans-68-20.3172.400000113.1S246S246-A248 PolarHBondContact O-N 2.87Å
249T33.8Very low33.7Very low98 Ų98106.4 Ų106.460%0.60163%0.627SS**THydrogen-bonded Turntrans-84.4-28179.1-12.60000113.2S246 S247 Q251 N252S246-T249 PolarHBondContact O-N 3.11Å; S246-T249 PolarHBondContact O-OG1 2.73Å; S247-T249 PolarHBondContact O-N 2.93Å; T249-Q251 PolarHBondContact O-N 2.64Å; T249-N252 PolarHBondContact O-N 3.19Å
250L29.5Very low34.2Very low122 Ų122103.8 Ų103.864%0.63961%0.612SS**Hα-helixtrans-72.5-23.3-173.8-96.4152.7000114.8
251Q34.9Very low34.7Very low165 Ų165103.2 Ų103.277%0.77160%0.598SS**Hα-helixtrans-80.6-20177.7-75.6-161-600114.1T249T249-Q251 PolarHBondContact O-N 2.64Å
252N36.9Very low35.2Very low77 Ų77102.7 Ų102.741%0.41259%0.585SS.*Hα-helixtrans-83.8-27.2-178.2-132.7-0.7000112T249 S256T249-N252 PolarHBondContact O-N 3.19Å; N252-S256 WeakPolarHBondContact O-CB 3.24Å; N252-S256 PolarHBondContact O-N 2.9Å; N252-S256 PolarHBondContact O-OG 3.25Å
253D30.8Very low35.3Very low82 Ų82104.1 Ų104.144%0.43958%0.575SS.*Hα-helixtrans-71.2-38.9-176.7-67-18.3000111.9C255 S256 N257D253-C255 PolarHBondContact O-N 3.33Å; D253-S256 PolarHBondContact O-N 3.27Å; D253-N257 WeakPolarHBondContact O-CB 3.39Å; D253-N257 VanDerWaalsContact O-CG 3.28Å; D253-N257 PolarHBondContact O-N 3.12Å; D253-N257 PolarHBondContact O-ND2 3.38Å
254N38.8Very low35.5Very low118 Ų118103.8 Ų103.863%0.63156%0.561SS**Hα-helixtrans-64.2-42.1-179-74.8-4.3000112.9A258N254-A258 PolarHBondContact O-N 2.98Å; N254-A258 VanDerWaalsContact O-N 3.11Å
255C35.1Very low36.1Very low76 Ų76102.9 Ų102.951%0.51454%0.543SS..Hα-helixtrans-74.9-33.5177.6-80.20000112.9D253 A258 L259D253-C255 PolarHBondContact O-N 3.33Å; C255-A258 PolarHBondContact O-N 2.99Å; C255-L259 PolarHBondContact O-N 3.32Å; C255-L259 VanDerWaalsContact O-N 3.08Å
256S35.7Very low36.6Very low39 Ų3995.5 Ų95.527%0.27352%0.521SS..Hα-helixtrans-65.6-42.4176.4-56.10000110.6N252 D253 L259 L260N252-S256 WeakPolarHBondContact O-CB 3.24Å; N252-S256 PolarHBondContact O-N 2.9Å; N252-S256 PolarHBondContact O-OG 3.25Å; D253-S256 PolarHBondContact O-N 3.27Å; S256-L259 PolarHBondContact O-N 3.45Å; S256-L260 WeakPolarHBondContact O-CB 3.41Å; S256-L260 VanDerWaalsContact O-CG 3.29Å; S256-L260 WeakPolarHBondContact O-CG 3.23Å; S256-L260 PolarHBondContact O-N 3.42Å
257N37.9Very low37.1Very low96 Ų9694.3 Ų94.351%0.51351%0.51SS..Hα-helixtrans-63.2-45.6174.7-75-17.6000111.8D253 L259 L260 E261D253-N257 WeakPolarHBondContact O-CB 3.39Å; D253-N257 VanDerWaalsContact O-CG 3.28Å; D253-N257 PolarHBondContact O-N 3.12Å; D253-N257 PolarHBondContact O-ND2 3.38Å; N257-L259 VanDerWaalsContact C-N 3.32Å; N257-L259 PolarHBondContact O-N 3.03Å; N257-L260 PolarHBondContact O-N 3.03Å; N257-L260 VanDerWaalsContact O-N 3.14Å; N257-E261 WeakPolarHBondContact O-CB 3.39Å; N257-E261 PolarHBondContact O-N 3Å
258A39.4Very low37.5Very low44 Ų4491.7 Ų91.736%0.36449%0.488SS..Hα-helixtrans-59.6-41.1176.900000112.6N254 C255 E261 I262N254-A258 PolarHBondContact O-N 2.98Å; N254-A258 VanDerWaalsContact O-N 3.11Å; C255-A258 PolarHBondContact O-N 2.99Å; A258-E261 PolarHBondContact O-N 3.46Å; A258-I262 WeakPolarHBondContact O-CD1 3.29Å; A258-I262 VanDerWaalsContact O-CG1 3.24Å; A258-I262 WeakPolarHBondContact O-CG1 3.28Å; A258-I262 PolarHBondContact O-N 2.96Å
259L40.8Very low37.6Very low61 Ų6192 Ų9232%0.31948%0.475SS..Hα-helixtrans-68.5-36.8176-74.9173.2000112.7W211 C255 S256 N257 R263W211-L259 HydrophobicContact CD2-CD1 4.45Å; C255-L259 PolarHBondContact O-N 3.32Å; C255-L259 VanDerWaalsContact O-N 3.08Å; S256-L259 PolarHBondContact O-N 3.45Å; N257-L259 VanDerWaalsContact C-N 3.32Å; N257-L259 PolarHBondContact O-N 3.03Å; L259-R263 WeakPolarHBondContact O-CB 3.41Å; L259-R263 PolarHBondContact O-N 3.39Å
260L38.2Very low37.6Very low98 Ų9894.1 Ų94.151%0.51347%0.473SS..Hα-helixtrans-67.5-38.7174.5-74.6171.4000111.7S256 N257 R263 W264S256-L260 WeakPolarHBondContact O-CB 3.41Å; S256-L260 VanDerWaalsContact O-CG 3.29Å; S256-L260 WeakPolarHBondContact O-CG 3.23Å; S256-L260 PolarHBondContact O-N 3.42Å; N257-L260 PolarHBondContact O-N 3.03Å; N257-L260 VanDerWaalsContact O-N 3.14Å; L260-R263 WeakPolarHBondContact O-CB 3.44Å; L260-R263 PolarHBondContact O-N 2.94Å; L260-W264 WeakPolarHBondContact O-CB 3.32Å; L260-W264 PolarHBondContact O-N 3.29Å
261E40.4Very low38Very low101 Ų10196.6 Ų96.647%0.47247%0.474SS..Hα-helixtrans-66.7-45.1177.5-161.1174.6-15900110.8N257 A258 R263 W264 V265N257-E261 WeakPolarHBondContact O-CB 3.39Å; N257-E261 PolarHBondContact O-N 3Å; A258-E261 PolarHBondContact O-N 3.46Å; E261-R263 VanDerWaalsContact C-N 3.29Å; E261-R263 PolarHBondContact O-N 3.18Å; E261-W264 PolarHBondContact O-N 3.16Å; E261-W264 VanDerWaalsContact O-N 3.11Å; E261-V265 WeakPolarHBondContact O-CG2 3.25Å; E261-V265 PolarHBondContact O-N 2.96Å
262I42.7Very low38.2Very low94 Ų9493.7 Ų93.748%0.48246%0.458SS..Hα-helixtrans-57.5-44.4171.8-68.2164.5000110.7A258 W264 I266A258-I262 WeakPolarHBondContact O-CD1 3.29Å; A258-I262 VanDerWaalsContact O-CG1 3.24Å; A258-I262 WeakPolarHBondContact O-CG1 3.28Å; A258-I262 PolarHBondContact O-N 2.96Å; I262-W264 VanDerWaalsContact C-N 3.34Å; I262-W264 PolarHBondContact O-N 3.31Å; I262-I266 HydrophobicContact CG2-CD1 3.76Å; I262-I266 VanDerWaalsContact O-CG1 3.23Å; I262-I266 WeakPolarHBondContact O-CG1 3.34Å; I262-I266 PolarHBondContact O-N 3.04Å
263R37.5Very low38.2Very low152 Ų15295.5 Ų95.557%0.57447%0.472SS*.Hα-helixtrans-62.2-42.5176.8-175.9-177.5179-162.50.1111.3L259 L260 E261 I266 T267L259-R263 WeakPolarHBondContact O-CB 3.41Å; L259-R263 PolarHBondContact O-N 3.39Å; L260-R263 WeakPolarHBondContact O-CB 3.44Å; L260-R263 PolarHBondContact O-N 2.94Å; E261-R263 VanDerWaalsContact C-N 3.29Å; E261-R263 PolarHBondContact O-N 3.18Å; R263-I266 PolarHBondContact O-N 2.91Å; R263-T267 WeakPolarHBondContact O-CB 3.31Å; R263-T267 PolarHBondContact O-N 3.2Å; R263-T267 PolarHBondContact O-OG1 2.92Å
264W38.6Very low38.3Very low172 Ų17298.5 Ų98.565%0.65248%0.481SS*.Hα-helixtrans-65-47.6-179.5-166.984.4000111.2L260 E261 I262 I266 T267 D268L260-W264 WeakPolarHBondContact O-CB 3.32Å; L260-W264 PolarHBondContact O-N 3.29Å; E261-W264 PolarHBondContact O-N 3.16Å; E261-W264 VanDerWaalsContact O-N 3.11Å; I262-W264 VanDerWaalsContact C-N 3.34Å; I262-W264 PolarHBondContact O-N 3.31Å; W264-I266 PolarHBondContact O-N 2.92Å; W264-T267 CarbonylContact O-C 3.6Å; W264-T267 PolarHBondContact O-N 3.41Å; W264-D268 HydrophobicContact CE3-CB 4.47Å; W264-D268 HydrophobicContact CZ3-CB 4.45Å; W264-D268 WeakPolarHBondContact O-CB 3.3Å; W264-D268 PolarHBondContact O-N 2.88Å
265V39.2Very low37.9Very low46 Ų4697.7 Ų97.728%0.27948%0.481SS..Hα-helixtrans-59.4-44.9177.2177.30000111.3E261 T267 E269 Y301E261-V265 WeakPolarHBondContact O-CG2 3.25Å; E261-V265 PolarHBondContact O-N 2.96Å; V265-T267 VanDerWaalsContact C-N 3.28Å; V265-T267 PolarHBondContact O-N 3.25Å; V265-E269 WeakPolarHBondContact O-CB 3.4Å; V265-E269 PolarHBondContact O-N 2.87Å; V265-Y301 VanDerWaalsContact CG1-OH 3.27Å; V265-Y301 WeakPolarHBondContact CG1-OH 3.4Å
266I41.3Very low37.8Very low88 Ų88101.2 Ų101.245%0.45149%0.49SS..Hα-helixtrans-62.5-36.8176.8-67.1168.6000111.3I262 R263 W264 Y270I262-I266 HydrophobicContact CG2-CD1 3.76Å; I262-I266 VanDerWaalsContact O-CG1 3.23Å; I262-I266 WeakPolarHBondContact O-CG1 3.34Å; I262-I266 PolarHBondContact O-N 3.04Å; R263-I266 PolarHBondContact O-N 2.91Å; W264-I266 PolarHBondContact O-N 2.92Å; I266-Y270 WeakPolarHBondContact O-CB 3.18Å; I266-Y270 PolarHBondContact O-N 3.37Å; I266-Y270 VanDerWaalsContact O-N 3.15Å
267T39Very low37.6Very low68 Ų68105.1 Ų105.142%0.41751%0.514SS..Hα-helixtrans-79.5-36.5-177.1-490000112.5R263 W264 V265 Y270 R271R263-T267 WeakPolarHBondContact O-CB 3.31Å; R263-T267 PolarHBondContact O-N 3.2Å; R263-T267 PolarHBondContact O-OG1 2.92Å; W264-T267 CarbonylContact O-C 3.6Å; W264-T267 PolarHBondContact O-N 3.41Å; V265-T267 VanDerWaalsContact C-N 3.28Å; V265-T267 PolarHBondContact O-N 3.25Å; T267-Y270 WeakPolarHBondContact O-CB 3.34Å; T267-Y270 PolarHBondContact O-N 3.21Å; T267-R271 PolarHBondContact O-N 3.45Å
268D41Very low37.4Very low41 Ų41106.3 Ų106.322%0.21952%0.52CS..Hα-helixtrans-69.5-42.3176.9-172.156.3000111.3W264 Y270 R271 K272W264-D268 HydrophobicContact CE3-CB 4.47Å; W264-D268 HydrophobicContact CZ3-CB 4.45Å; W264-D268 WeakPolarHBondContact O-CB 3.3Å; W264-D268 PolarHBondContact O-N 2.88Å; D268-Y270 VanDerWaalsContact C-N 3.31Å; D268-Y270 PolarHBondContact O-N 3.49Å; D268-R271 WeakPolarHBondContact O-CA 3.38Å; D268-R271 WeakPolarHBondContact O-CB 3.33Å; D268-R271 PolarHBondContact O-N 3.04Å; D268-K272 PolarHBondContact O-N 2.79Å; D268-K272 WeakPolarHBondContact OD2-CE 3.32Å; D268-K272 IonicContact OD2-NZ 2.71Å; D268-K272 PolarHBondContact OD2-NZ 2.95Å
269E38.6Very low36.9Very low93 Ų93109.2 Ų109.244%0.43553%0.529SS..Hα-helixtrans-59.5-41169.4-82.9-79.7144.700111.6V265 R271 K272 V273V265-E269 WeakPolarHBondContact O-CB 3.4Å; V265-E269 PolarHBondContact O-N 2.87Å; E269-R271 PolarHBondContact O-N 3.16Å; E269-K272 PolarHBondContact O-N 2.76Å; E269-V273 VanDerWaalsContact O-CG2 3.3Å; E269-V273 WeakPolarHBondContact O-CG2 3.3Å; E269-V273 PolarHBondContact O-N 3.22Å
270Y32.5Very low36.3Very low144 Ų144117.2 Ų117.257%0.56556%0.555SS**Hα-helixtrans-59-35.2173.7-175.7-90.7000112.4I266 T267 D268 K274I266-Y270 WeakPolarHBondContact O-CB 3.18Å; I266-Y270 PolarHBondContact O-N 3.37Å; I266-Y270 VanDerWaalsContact O-N 3.15Å; T267-Y270 WeakPolarHBondContact O-CB 3.34Å; T267-Y270 PolarHBondContact O-N 3.21Å; D268-Y270 VanDerWaalsContact C-N 3.31Å; D268-Y270 PolarHBondContact O-N 3.49Å; Y270-K274 HydrophobicContact CE1-CD 4.06Å; Y270-K274 VanDerWaalsContact OH-CE 3.26Å; Y270-K274 WeakPolarHBondContact OH-CE 3.18Å; Y270-K274 PolarHBondContact OH-NZ 3.15Å; Y270-K274 VanDerWaalsContact OH-NZ 3.09Å
271R38.9Very low36.1Very low173 Ų173121.6 Ų121.665%0.65357%0.57SS**Hα-helixtrans-71-48.7173.5-80.2-174.7177-177.3-0.7111.8T267 D268 E269 V273 K274 T275T267-R271 PolarHBondContact O-N 3.45Å; D268-R271 WeakPolarHBondContact O-CA 3.38Å; D268-R271 WeakPolarHBondContact O-CB 3.33Å; D268-R271 PolarHBondContact O-N 3.04Å; E269-R271 PolarHBondContact O-N 3.16Å; R271-V273 VanDerWaalsContact C-N 3.28Å; R271-V273 PolarHBondContact O-N 3.47Å; R271-K274 CarbonylContact O-C 3.6Å; R271-K274 WeakPolarHBondContact O-CA 3.5Å; R271-K274 PolarHBondContact O-N 2.9Å; R271-T275 PolarHBondContact O-N 3.46Å; R271-T275 PolarHBondContact O-OG1 2.99Å
272K39.1Very low35.6Very low104 Ų104124.6 Ų124.645%0.45258%0.582SS.*Hα-helixtrans-57.1-41.1-179.4-72.4173.6179.9157.50112.4D268 E269 K274 T275 E276D268-K272 PolarHBondContact O-N 2.79Å; D268-K272 WeakPolarHBondContact OD2-CE 3.32Å; D268-K272 IonicContact OD2-NZ 2.71Å; D268-K272 PolarHBondContact OD2-NZ 2.95Å; E269-K272 PolarHBondContact O-N 2.76Å; K272-K274 VanDerWaalsContact C-N 3.27Å; K272-K274 PolarHBondContact O-N 3.01Å; K272-T275 PolarHBondContact O-N 3.2Å; K272-E276 PolarHBondContact O-N 3.03Å
273V36.7Very low34.9Very low115 Ų115125.7 Ų125.770%0.69758%0.583SS**Hα-helixtrans-65.6-28.3176.11760000112.6E269 R271E269-V273 VanDerWaalsContact O-CG2 3.3Å; E269-V273 WeakPolarHBondContact O-CG2 3.3Å; E269-V273 PolarHBondContact O-N 3.22Å; R271-V273 VanDerWaalsContact C-N 3.28Å; R271-V273 PolarHBondContact O-N 3.47Å
274K32.6Very low34.5Very low145 Ų145130.3 Ų130.363%0.6360%0.601SS**Hα-helixtrans-83-28.3174-81-167.8177.5-177.50113.4Y270 R271 K272Y270-K274 HydrophobicContact CE1-CD 4.06Å; Y270-K274 VanDerWaalsContact OH-CE 3.26Å; Y270-K274 WeakPolarHBondContact OH-CE 3.18Å; Y270-K274 PolarHBondContact OH-NZ 3.15Å; Y270-K274 VanDerWaalsContact OH-NZ 3.09Å; R271-K274 CarbonylContact O-C 3.6Å; R271-K274 WeakPolarHBondContact O-CA 3.5Å; R271-K274 PolarHBondContact O-N 2.9Å; K272-K274 VanDerWaalsContact C-N 3.27Å; K272-K274 PolarHBondContact O-N 3.01Å
275T31.2Very low34Very low101 Ų101123.9 Ų123.962%0.6259%0.588SS**Hα-helixtrans-100.3-4.9-17053.50000115.2R271 K272 P277R271-T275 PolarHBondContact O-N 3.46Å; R271-T275 PolarHBondContact O-OG1 2.99Å; K272-T275 PolarHBondContact O-N 3.2Å; T275-P277 WeakPolarHBondContact O-CD 3.33Å
276E32.2Very low33.7Very low150 Ų150125.7 Ų125.770%0.70160%0.603SS**SBendtrans-70.6109.2168.5-78.6-166.7167.500109.9K272 L278K272-E276 PolarHBondContact O-N 3.03Å; E276-L278 PolarHBondContact O-N 3.48Å
277P31.6Very low33.4Very low121 Ų121130.9 Ų130.979%0.78663%0.625SS**  trans-66.3104.7170.728.8-31.8000106.9T275 N279T275-P277 WeakPolarHBondContact O-CD 3.33Å; P277-N279 PolarHBondContact O-N 2.78Å
278L33.6Very low33.3Very low121 Ų121137 Ų13763%0.63465%0.646SS**  trans-41.3105178-74163.2000109.6E276 R280 F283E276-L278 PolarHBondContact O-N 3.48Å; L278-R280 PolarHBondContact O-N 3.4Å; L278-F283 HydrophobicContact CB-CE2 4.11Å; L278-F283 HydrophobicContact CD2-CE2 3.83Å; L278-F283 HydrophobicContact CD2-CZ 3.97Å; L278-F283 HydrophobicContact CG-CE2 4.44Å
279N28.7Very low33Very low106 Ų106140.3 Ų140.357%0.56766%0.663SS**  trans-61.499.4-175.5-161.8-20.9000107.7P277 K281 F282P277-N279 PolarHBondContact O-N 2.78Å; N279-K281 PolarHBondContact O-N 2.88Å; N279-F282 PolarHBondContact O-N 3.37Å
280R29.5Very low32.7Very low229 Ų229139.1 Ų139.186%0.86466%0.66SS**G310 helixtrans-55.3-15.2-170.4-80.9-178.5170.4177.4-2.9113.8L278 F282 F283L278-R280 PolarHBondContact O-N 3.4Å; R280-F282 VanDerWaalsContact C-N 3.32Å; R280-F282 PolarHBondContact O-N 3.03Å; R280-F283 PolarHBondContact O-N 2.88Å
281K32.9Very low32.6Very low190 Ų190138.3 Ų138.383%0.82667%0.674SS**G310 helixtrans-71.4-20.6176.9-65.3-172.7179.4-178.90113.9N279N279-K281 PolarHBondContact O-N 2.88Å
282F30.1Very low32.3Very low164 Ų164141.2 Ų141.272%0.71969%0.685SS**G310 helixtrans-87.6-2.3175.7-82.3-82.7000114.6N279 R280 N290N279-F282 PolarHBondContact O-N 3.37Å; R280-F282 VanDerWaalsContact C-N 3.32Å; R280-F282 PolarHBondContact O-N 3.03Å; F282-N290 PolarHBondContact O-ND2 3.17Å
283F27.1Very low31.9Very low116 Ų116144.9 Ų144.951%0.50970%0.701SS.*  trans-106.635.3-175.2-77.8-85.9000114.3L278 R280L278-F283 HydrophobicContact CB-CE2 4.11Å; L278-F283 HydrophobicContact CD2-CE2 3.83Å; L278-F283 HydrophobicContact CD2-CZ 3.97Å; L278-F283 HydrophobicContact CG-CE2 4.44Å; R280-F283 PolarHBondContact O-N 2.88Å
284R29.5Very low31.5Very low250 Ų250147 Ų14794%0.94370%0.703SS**  trans-92.46.2164-84-165.1-178.3-156.92114.4
285G29.5Very low31.5Very low37 Ų37145 Ų14538%0.38171%0.708SS.*SBendtrans-92.9124.5168.200000110.1
286S31.6Very low31.6Very low84 Ų84146.4 Ų146.459%0.58771%0.71SS**  trans-39.9136.7179.557.40000112.5K288 D289S286-K288 PolarHBondContact O-N 3.12Å; S286-D289 PolarHBondContact O-N 3.33Å
287E35.5Very low31.7Very low196 Ų196145 Ų14592%0.91671%0.707SS**THydrogen-bonded Turntrans-45.3-12.2-172.4-78.6179134.500117.1
288K36.5Very low31.8Very low196 Ų196146.6 Ų146.685%0.85270%0.698SS**THydrogen-bonded Turntrans-83.8-17.5-178.7-69.7-176.2177.4174.40115.2S286S286-K288 PolarHBondContact O-N 3.12Å
289D35.3Very low31.7Very low111 Ų111149.8 Ų149.859%0.59470%0.703SS**SBendtrans-102.7-20.1-169.6-75.3-31000116.1S286S286-D289 PolarHBondContact O-N 3.33Å
290N31.4Very low31.9Very low68 Ų68149 Ų14936%0.36471%0.706SS.*G310 helixtrans-86.5-12.1-168.1-81.3-8.1000115.9F282 R292F282-N290 PolarHBondContact O-ND2 3.17Å; N290-R292 PolarHBondContact O-N 2.91Å
291C31Very low32Very low128 Ų128142.8 Ų142.887%0.86568%0.683SS**G310 helixtrans-71-12.3174.6-710000113.8
292R32.6Very low31.9Very low233 Ų233140.8 Ų140.888%0.87967%0.67SS**G310 helixtrans-92.1-9-173.1-99.9-175.6176.9-172.7-0.1116.2N290N290-R292 PolarHBondContact O-N 2.91Å
293K31.1Very low32Very low182 Ų182137.8 Ų137.879%0.79166%0.662SS**SBendtrans-112.4-0.8-169.5-73.5-169.2177.7-177.90117.1S295K293-S295 VanDerWaalsContact C-N 3.27Å; K293-S295 PolarHBondContact O-N 3.1Å
294Q28.7Very low32.1Very low159 Ų159139.3 Ų139.374%0.74367%0.665SS**  trans-93.259.6166.9-71.3-175.7-7.500110.4I296Q294-I296 VanDerWaalsContact C-N 3.28Å; Q294-I296 PolarHBondContact O-N 2.88Å
295S32.6Very low32.2Very low103 Ų103130.5 Ų130.572%0.7265%0.646SS**  trans-69.595.7159.955.40000106.7K293 N297K293-S295 VanDerWaalsContact C-N 3.27Å; K293-S295 PolarHBondContact O-N 3.1Å; S295-N297 PolarHBondContact O-N 2.84Å; S295-N297 VanDerWaalsContact O-N 3.08Å
296I32.9Very low32.3Very low131 Ų131136 Ų13667%0.67266%0.659SS**  trans-43.9118.7166.9-63.1166.9000106.9Q294 W298Q294-I296 VanDerWaalsContact C-N 3.28Å; Q294-I296 PolarHBondContact O-N 2.88Å; I296-W298 HydrophobicContact CG2-CE3 4.3Å; I296-W298 PolarHBondContact O-N 2.92Å
297N33.9Very low32.5Very low119 Ų119138.4 Ų138.464%0.63666%0.661SS**  trans-71.380.1-175-165.1-0.7000109.4S295 Y299 S300S295-N297 PolarHBondContact O-N 2.84Å; S295-N297 VanDerWaalsContact O-N 3.08Å; N297-Y299 PolarHBondContact O-N 3.03Å; N297-S300 PolarHBondContact O-N 3.25Å
298W34.4Very low32.1Very low156 Ų156133.6 Ų133.659%0.59164%0.64SS**Hα-helixtrans-56.6-20.4-173.2-156.2-122.8000113.3I296 S300 Y301 R302I296-W298 HydrophobicContact CG2-CE3 4.3Å; I296-W298 PolarHBondContact O-N 2.92Å; W298-S300 VanDerWaalsContact C-N 3.31Å; W298-S300 PolarHBondContact O-N 3.2Å; W298-Y301 PolarHBondContact O-N 3.4Å; W298-R302 PolarHBondContact O-N 3.39Å
299Y30.6Very low31.8Very low187 Ų187132.1 Ų132.173%0.73364%0.636SS**Hα-helixtrans-63.3-33.2175.4-82.5-84000113.3N297N297-Y299 PolarHBondContact O-N 3.03Å
300S33.5Very low31.7Very low90 Ų90134.4 Ų134.463%0.62966%0.657SS**Hα-helixtrans-72.9-37.6179.1-170.60000111.8N297 W298N297-S300 PolarHBondContact O-N 3.25Å; W298-S300 VanDerWaalsContact C-N 3.31Å; W298-S300 PolarHBondContact O-N 3.2Å
301Y31.3Very low31.7Very low98 Ų98137.8 Ų137.838%0.38467%0.672SS.*Hα-helixtrans-70.6-34.4-179.6-141.9-85000113V265 W298 Y304 A305V265-Y301 VanDerWaalsContact CG1-OH 3.27Å; V265-Y301 WeakPolarHBondContact CG1-OH 3.4Å; W298-Y301 PolarHBondContact O-N 3.4Å; Y301-Y304 PolarHBondContact O-N 3.33Å; Y301-A305 PolarHBondContact O-N 3.37Å
302R30.6Very low31.8Very low148 Ų148138.3 Ų138.356%0.55866%0.662SS**Hα-helixtrans-66.8-40.3-179.6-166.1176.2175.2-177.1-3.5111.6W298 F306W298-R302 PolarHBondContact O-N 3.39Å; R302-F306 HydrophobicContact CG-CD2 3.9Å; R302-F306 HydrophobicContact CG-CE2 3.77Å; R302-F306 WeakPolarHBondContact O-CD2 3.42Å; R302-F306 PolarHBondContact O-N 3.36Å
303N32Very low31.7Very low102 Ų102133 Ų13355%0.54565%0.649SS.*Hα-helixtrans-69.7-34.2179.9-75.1-8000112.4F306 Q307N303-F306 PolarHBondContact O-N 3.31Å; N303-Q307 WeakPolarHBondContact O-CB 3.45Å; N303-Q307 WeakPolarHBondContact O-CG 3.19Å; N303-Q307 PolarHBondContact O-N 3.14Å
304Y30.1Very low31.7Very low147 Ų147130.1 Ų130.158%0.57664%0.641SS**Hα-helixtrans-64.8-42.9179.2-157.4-96.8000112.4Y301 F306 Q307 M308Y301-Y304 PolarHBondContact O-N 3.33Å; Y304-F306 PolarHBondContact O-N 2.95Å; Y304-Q307 PolarHBondContact O-N 2.84Å; Y304-M308 HydrophobicContact CE1-CE 4.03Å; Y304-M308 WeakPolarHBondContact O-CG 3.38Å
305A30.8Very low31.9Very low66 Ų66128.3 Ų128.355%0.54564%0.635SS.*Hα-helixtrans-70.7-27.6-179.900000113.8Y301Y301-A305 PolarHBondContact O-N 3.37Å
306F32.6Very low31.9Very low151 Ų151130 Ų13066%0.66263%0.629SS**Hα-helixtrans-89.1-19.4178.1-74.8-68.3000113.6R302 N303 Y304R302-F306 HydrophobicContact CG-CD2 3.9Å; R302-F306 HydrophobicContact CG-CE2 3.77Å; R302-F306 WeakPolarHBondContact O-CD2 3.42Å; R302-F306 PolarHBondContact O-N 3.36Å; N303-F306 PolarHBondContact O-N 3.31Å; Y304-F306 PolarHBondContact O-N 2.95Å
307Q34.9Very low31.8Very low135 Ų135129.9 Ų129.963%0.63163%0.626SS**Hα-helixtrans-79.9-17.2175.1-80.3177.9-19.200113.7N303 Y304 H309N303-Q307 WeakPolarHBondContact O-CB 3.45Å; N303-Q307 WeakPolarHBondContact O-CG 3.19Å; N303-Q307 PolarHBondContact O-N 3.14Å; Y304-Q307 PolarHBondContact O-N 2.84Å; Q307-H309 PolarHBondContact O-N 2.99Å
308M27.3Very low31.6Very low96 Ų96130.8 Ų130.847%0.47363%0.625SS.*THydrogen-bonded Turntrans-82.815.4-178.8-70.9-71.7-12400114.5Y304Y304-M308 HydrophobicContact CE1-CE 4.03Å; Y304-M308 WeakPolarHBondContact O-CG 3.38Å
309H29.4Very low31.4Very low164 Ų164128.7 Ų128.776%0.75963%0.628SS**  trans-110.4106.6173.7-114.7-64.8000109.9Q307Q307-H309 PolarHBondContact O-N 2.99Å
310P33.9Very low31.5Very low160 Ų160123.4 Ų123.4100%1.03962%0.619SS**  trans-67.10166.228-32.1000111.8

Retrieved 310 of 310 residues in 308.2 ms (Link to these results)