A0A096NXT5_PAPAN Loading...

Protein FAM161A

Involved in ciliogenesis.

AlphaFold DB , UniProt , Accession A0A096NXT5, Species PAPAN (Papio anubis, Olive baboon), Gene FAM161A, Length 716 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
1M52.2Low45.8Very low222 Ų222121.6 Ų121.6100%1.09468%0.68SS**  081.20-58.1-179.8-16100109.6
2A48.4Very low45.3Very low77 Ų77117.8 Ų117.864%0.63668%0.676SS**  trans-140.8-35.6-177.500000113.1S4A2-S4 VanDerWaalsContact C-N 3.35Å; A2-S4 PolarHBondContact O-N 3.17Å
3A47.3Very low44.9Very low82 Ų82115.4 Ų115.468%0.67867%0.67SS**SBendtrans-63.6-37.5173.600000113H5 R6 A7A3-H5 PolarHBondContact O-N 3.49Å; A3-R6 PolarHBondContact O-N 3.38Å; A3-A7 PolarHBondContact O-N 3.03Å
4S48.8Very low44.7Very low81 Ų81114.2 Ų114.257%0.56667%0.672SS**Hα-helixtrans-57.3-33.7-179-37.70000113.3A2 A8A2-S4 VanDerWaalsContact C-N 3.35Å; A2-S4 PolarHBondContact O-N 3.17Å; S4-A8 WeakPolarHBondContact O-CB 3.43Å; S4-A8 PolarHBondContact O-N 3.1Å; S4-A8 VanDerWaalsContact O-N 3.1Å
5H46.3Very low44.5Very low133 Ų133117.3 Ų117.362%0.61668%0.683SS**Hα-helixtrans-81.4-14.5-180-69.9-73.5000114.2A3 K9A3-H5 PolarHBondContact O-N 3.49Å; H5-K9 WeakPolarHBondContact O-CG 3.47Å
6R47.4Very low44.6Very low207 Ų207122 Ų12278%0.78170%0.696SS**Hα-helixtrans-85.5-40.7170.1-81-174.1171.9172.4-2.2111.6A3 K9 L10A3-R6 PolarHBondContact O-N 3.38Å; R6-K9 PolarHBondContact O-N 2.93Å; R6-L10 PolarHBondContact O-N 2.94Å
7A44.8Very low44.7Very low60 Ų60119.5 Ų119.550%0.49668%0.684SS.*Hα-helixtrans-62.9-44.8173.400000112A3 K9 L10 V11A3-A7 PolarHBondContact O-N 3.03Å; A7-K9 PolarHBondContact O-N 2.94Å; A7-L10 PolarHBondContact O-N 3.43Å; A7-L10 VanDerWaalsContact O-N 3.11Å; A7-V11 PolarHBondContact O-N 3.07Å
8A42.1Very low44.7Very low59 Ų59118.7 Ų118.749%0.48868%0.684SS.*Hα-helixtrans-62.8-24.4176.700000113.9S4 A12S4-A8 WeakPolarHBondContact O-CB 3.43Å; S4-A8 PolarHBondContact O-N 3.1Å; S4-A8 VanDerWaalsContact O-N 3.1Å; A8-A12 WeakPolarHBondContact O-CB 3.22Å; A8-A12 PolarHBondContact O-N 3.21Å
9K45Very low45.1Very low168 Ų168116.1 Ų116.173%0.7367%0.67SS**Hα-helixtrans-80-19.1175.4-85.8-173.7171.9-1730114.3H5 R6 A7H5-K9 WeakPolarHBondContact O-CG 3.47Å; R6-K9 PolarHBondContact O-N 2.93Å; A7-K9 PolarHBondContact O-N 2.94Å
10L40.8Very low45.2Very low137 Ų137115.1 Ų115.172%0.71766%0.662SS**Hα-helixtrans-94.4-21.3175.7-67.8173.9000113R6 A7 S13R6-L10 PolarHBondContact O-N 2.94Å; A7-L10 PolarHBondContact O-N 3.43Å; A7-L10 VanDerWaalsContact O-N 3.11Å; L10-S13 PolarHBondContact O-OG 3.03Å; L10-S13 VanDerWaalsContact O-OG 3.12Å
11V40.8Very low45.6Very low112 Ų112115.1 Ų115.168%0.67967%0.667SS**Hα-helixtrans-82.4-24.9173.2177.90000111.8A7 S13A7-V11 PolarHBondContact O-N 3.07Å; V11-S13 VanDerWaalsContact C-N 3.3Å; V11-S13 PolarHBondContact O-N 3.19Å
12A39.3Very low45.6Very low76 Ų76112.4 Ų112.463%0.62866%0.655SS**THydrogen-bonded Turntrans-78.4-6.6176.700000114.7A8A8-A12 WeakPolarHBondContact O-CB 3.22Å; A8-A12 PolarHBondContact O-N 3.21Å
13S39.9Very low46.2Very low86 Ų86113.8 Ų113.860%0.60166%0.656SS**THydrogen-bonded Turntrans-98.8-2.1-177.757.40000114.9L10 V11 L15L10-S13 PolarHBondContact O-OG 3.03Å; L10-S13 VanDerWaalsContact O-OG 3.12Å; V11-S13 VanDerWaalsContact C-N 3.3Å; V11-S13 PolarHBondContact O-N 3.19Å; S13-L15 VanDerWaalsContact C-N 3.29Å; S13-L15 PolarHBondContact O-N 2.91Å
14S42.7Very low46.1Very low99 Ų99120.4 Ų120.469%0.69266%0.663SS**  trans-89.258.9174.567.50000111.9
15L41.6Very low46.3Very low161 Ų161119.5 Ų119.584%0.84366%0.66SS**  trans-76.4124.3168.2-77.2176.2000110S13 T17S13-L15 VanDerWaalsContact C-N 3.29Å; S13-L15 PolarHBondContact O-N 2.91Å; L15-T17 PolarHBondContact O-N 2.8Å
16Q45.7Very low46.1Very low192 Ų192123.6 Ų123.690%0.89767%0.67SS**  trans-57.8115.5-179.6-129.1158.8-11.700110.6
17T47.4Very low45.8Very low79 Ų79117.9 Ų117.949%0.48566%0.658SS.*PPolyproline II helixtrans-64.2128.6172.321.30000109.8L15 V19L15-T17 PolarHBondContact O-N 2.8Å; T17-V19 PolarHBondContact O-N 3.18Å
18P43.7Very low45.7Very low106 Ų106119.1 Ų119.169%0.68867%0.668SS**PPolyproline II helixtrans-67.1126.3-179.426.3-33.2000110.5
19V51.9Low45.4Very low69 Ų69123.8 Ų123.842%0.41868%0.68SS.*BIsolated β-bridgetrans-100.3133.3174.1174.60000108.2T17 R26T17-V19 PolarHBondContact O-N 3.18Å; V19-R26 HydrophobicContact CG2-CG 4.37Å
20N48.1Very low45Very low96 Ų96126.8 Ų126.851%0.51369%0.689SS.*PPolyproline II helixtrans-64.1123179.8-102.6-44.6000110.7I22 T23 R24N20-I22 PolarHBondContact O-N 2.9Å; N20-T23 PolarHBondContact O-N 3.19Å; N20-R24 PolarHBondContact O-N 3Å
21P54.2Low44.7Very low116 Ų116128.4 Ų128.475%0.75369%0.692SS**THydrogen-bonded Turntrans-69-19.6-168.325.3-34.1000114.2
22I50.6Low44.6Very low164 Ų164134.9 Ų134.984%0.84171%0.705SS**THydrogen-bonded Turntrans-89.3-30.4-177.5-61.7175.1000112.4N20N20-I22 PolarHBondContact O-N 2.9Å
23T61Low44.6Very low107 Ų107139.2 Ų139.266%0.65671%0.712SS**THydrogen-bonded Turntrans-116.1-8.7-173.516.20000114.9N20 A25N20-T23 PolarHBondContact O-N 3.19Å; T23-A25 PolarHBondContact O-N 2.91Å
24R47Very low44.8Very low221 Ų221139.7 Ų139.783%0.83471%0.708SS**  trans52.98.2179.5-67.2-172.5177-174.70116.6N20N20-R24 PolarHBondContact O-N 3Å
25A51.6Low45Very low61 Ų61139.6 Ų139.650%0.50470%0.704SS.*PPolyproline II helixtrans-78.8139174.600000111T23T23-A25 PolarHBondContact O-N 2.91Å
26R42.8Very low45.3Very low220 Ų220138.2 Ų138.283%0.8370%0.697SS**BIsolated β-bridgetrans-73.5132.9176.5-64.1-177.8179.9-174.9-0.1109.8V19 A28V19-R26 HydrophobicContact CG2-CG 4.37Å; R26-A28 PolarHBondContact O-N 3.43Å
27V41.8Very low45.3Very low87 Ų87136.3 Ų136.353%0.52769%0.688SS.*PPolyproline II helixtrans-72.4124.7174.2179.90000108.7
28A41.9Very low45.3Very low86 Ų86135.2 Ų135.271%0.71169%0.687SS**PPolyproline II helixtrans-67.9136.5176.800000110.7R26R26-A28 PolarHBondContact O-N 3.43Å
29Q34.8Very low45.4Very low157 Ų157135.6 Ų135.673%0.73468%0.683SS**PPolyproline II helixtrans-77.8128.7167.1-67.8-177.4-39.100108.1E31Q29-E31 PolarHBondContact O-N 3.37Å
30Y36.6Very low45Very low231 Ų231134.9 Ų134.991%0.90668%0.684SS**  trans-73.6105.6159.6-86.9-89.2000107.3
31E35.9Very low44.9Very low170 Ų170133 Ų13379%0.79468%0.682SS**  trans-61.6134.4161.2-64.5-172.6151.900107.9Q29 E33Q29-E31 PolarHBondContact O-N 3.37Å; E31-E33 PolarHBondContact O-N 3.25Å
32R38Very low44.5Very low249 Ų249130 Ų13094%0.9467%0.667SS**  trans-80.2103.4166.9-80.2-174.2178.3142.4-1.6106.9
33E39.5Very low44.2Very low167 Ų167129 Ų12978%0.7866%0.659SS**  trans-59.7138.5165.7-66.4179.8168.600109.8E31E31-E33 PolarHBondContact O-N 3.25Å
34D44.9Very low43.2Very low96 Ų96127.8 Ų127.851%0.51366%0.66SS.*  trans-74.6121.3178.6-167.3-8.4000108.7L36 Q37D34-L36 PolarHBondContact O-N 3.21Å; D34-Q37 PolarHBondContact O-N 3.06Å
35P46.7Very low43.1Very low96 Ų96124 Ų12462%0.62366%0.655SS**Hα-helixtrans-61.4-10.9-171.321.8-34.8000115.1
36L47.3Very low42.4Very low132 Ų132128.3 Ų128.369%0.69167%0.668SS**Hα-helixtrans-76.4-25172.8-62.3176.7000113.2D34D34-L36 PolarHBondContact O-N 3.21Å
37Q45.8Very low42.2Very low152 Ų152126.6 Ų126.671%0.7167%0.67SS**Hα-helixtrans-85.8-29.5-177.2-145.316512.700112.4D34 A41D34-Q37 PolarHBondContact O-N 3.06Å; Q37-A41 PolarHBondContact O-N 3.17Å
38A46.9Very low41.8Very low56 Ų56130.3 Ų130.346%0.46369%0.687SS.*Hα-helixtrans-70-29.3172.900000113.2A42A38-A42 PolarHBondContact O-N 3.15Å
39L46.3Very low41.7Very low115 Ų115135.5 Ų135.560%0.60270%0.696SS**Hα-helixtrans-72.1-43.9175-71.6171.9000111.7A41 A42 E43L39-A41 VanDerWaalsContact C-N 3.28Å; L39-A41 PolarHBondContact O-N 3.22Å; L39-A42 WeakPolarHBondContact O-CB 3.4Å; L39-A42 PolarHBondContact O-N 3.48Å; L39-E43 PolarHBondContact O-N 3.39Å
40A44Very low41.5Very low53 Ų53137.4 Ų137.444%0.43871%0.705SS.*Hα-helixtrans-62.2-34.417500000112.8A42 A44A40-A42 VanDerWaalsContact C-N 3.32Å; A40-A44 PolarHBondContact O-N 3.25Å
41A45.4Very low41.3Very low57 Ų57133 Ų13347%0.47169%0.692SS.*Hα-helixtrans-71.6-23.817400000113.6Q37 L39Q37-A41 PolarHBondContact O-N 3.17Å; L39-A41 VanDerWaalsContact C-N 3.28Å; L39-A41 PolarHBondContact O-N 3.22Å
42A46.5Very low41Very low53 Ų53131.4 Ų131.444%0.43869%0.685SS.*Hα-helixtrans-82.3-34.2174.500000112.4A38 L39 A40 A44 I45A38-A42 PolarHBondContact O-N 3.15Å; L39-A42 WeakPolarHBondContact O-CB 3.4Å; L39-A42 PolarHBondContact O-N 3.48Å; A40-A42 VanDerWaalsContact C-N 3.32Å; A42-A44 VanDerWaalsContact C-N 3.34Å; A42-I45 PolarHBondContact O-N 3.44Å
43E43.7Very low40.8Very low144 Ų144125.7 Ų125.767%0.67367%0.667SS**Hα-helixtrans-64.7-37.7171.2-72.9178.2145.100111.5L39 I45 L46L39-E43 PolarHBondContact O-N 3.39Å; E43-I45 PolarHBondContact O-N 2.91Å; E43-I45 VanDerWaalsContact O-N 3.08Å; E43-L46 PolarHBondContact O-N 3.01Å; E43-L46 VanDerWaalsContact O-N 3.15Å
44A40.4Very low40.2Very low81 Ų81124 Ų12467%0.66967%0.668SS**THydrogen-bonded Turntrans-69.70.3178.600000115.7A40 A42A40-A44 PolarHBondContact O-N 3.25Å; A42-A44 VanDerWaalsContact C-N 3.34Å
45I43.3Very low39.3Very low142 Ų142123.7 Ų123.773%0.72868%0.679SS**THydrogen-bonded Turntrans-106.62.1176-62.5172000111A42 E43A42-I45 PolarHBondContact O-N 3.44Å; E43-I45 PolarHBondContact O-N 2.91Å; E43-I45 VanDerWaalsContact O-N 3.08Å
46L37.9Very low38.3Very low150 Ų150127.1 Ų127.179%0.78569%0.686SS**SBendtrans-109.217.8-175.3-72.2174000115.3E43E43-L46 PolarHBondContact O-N 3.01Å; E43-L46 VanDerWaalsContact O-N 3.15Å
47E37.6Very low37.8Very low185 Ų185126.5 Ų126.586%0.86469%0.69SS**SBendtrans-109.11.6178.9-71.9-154.3148.900116.5
48D34.3Very low36.8Very low165 Ų165123.3 Ų123.388%0.88269%0.69SS**  trans-115.780.4176.9-77.4-40.2000113.2
49E39.6Very low35.7Very low195 Ų195129.7 Ų129.791%0.91171%0.71SS**  trans-137.2117.7158.1-87.4-151-177.500113.6
50E32Very low34.8Very low197 Ų197128.3 Ų128.392%0.92172%0.715SS**  trans-160.8150.4154.9-76.7-159.913700107.5
51E32Very low34Very low137 Ų137131 Ų13164%0.6473%0.731SS**  cis-127.8175.9-37.3-112.3-111.686.300103.5K53E51-K53 IonicContact OE1-NZ 2.78Å; E51-K53 WeakPolarHBondContact OE2-CE 3.41Å; E51-K53 IonicContact OE2-NZ 2.78Å; E51-K53 PolarHBondContact OE2-NZ 3.01Å
52E29.7Very low33.1Very low138 Ų138132.3 Ų132.365%0.64574%0.742SS**  cis-147.3150.722.8-139.4-151.3-170.600110.8
53K32.1Very low32.1Very low129 Ų129136.7 Ų136.756%0.56176%0.758SS**  trans29.2148.2131.8-67.8-179.6-152116.40120.7E51E51-K53 IonicContact OE1-NZ 2.78Å; E51-K53 WeakPolarHBondContact OE2-CE 3.41Å; E51-K53 IonicContact OE2-NZ 2.78Å; E51-K53 PolarHBondContact OE2-NZ 3.01Å
54V27.7Very low31.4Very low130 Ų130136.3 Ų136.379%0.78876%0.759SS**  cis-167.1169.412.6112.70000112.2
55A27.1Very low30.8Very low90 Ų90138.9 Ų138.974%0.74476%0.762SS**  trans85.283.5159.600000121.3
56Q25.5Very low30Very low168 Ų168138.9 Ų138.979%0.78577%0.769SS**  trans-44.7164134.1-88.1-90.6-18.500113
57P35.9Very low29.8Very low120 Ų120136.7 Ų136.778%0.77977%0.766SS**  -153.8166.853.144.3-23.1000122.5
58A24.3Very low29.3Very low84 Ų84137.1 Ų137.169%0.69477%0.765SS**  trans92.3113.4138.400000120.4
59E25.3Very low29Very low191 Ų191133.6 Ų133.689%0.89375%0.754SS**  trans-69.9165.9158.9-48.5171.812200112
60A25.8Very low28.5Very low86 Ų86127.6 Ų127.671%0.71175%0.745SS**  171.9147.211400000114.2
61S27.2Very low28.5Very low109 Ų109124.3 Ų124.376%0.76274%0.738SS**  trans41.7113.9144.961.80000120
62A28.2Very low28.5Very low85 Ų85124.4 Ų124.470%0.70274%0.742SS**  94.416366.200000113.3
63D24.8Very low28.7Very low144 Ų144124.5 Ų124.577%0.7774%0.743SS**  trans68.8143.6165.6-64.9-11.2000118.2
64L29.4Very low28.6Very low136 Ų136125 Ų12571%0.71275%0.747SS**  cis-155.5170.7-3.7-119.5170.1000111.1
65N27.7Very low28.8Very low135 Ų135122.2 Ų122.272%0.72274%0.738SS**  trans-48.7150.4166.7-59.9-79.8000113.7
66T26.9Very low29.4Very low142 Ų142124 Ų12487%0.87174%0.742SS**  trans-147.1126.7140.3-63.20000110.2
67S32.1Very low29.7Very low105 Ų105123.7 Ų123.773%0.73474%0.744SS**  trans-124.1115.4172.7-58.30000109.2
68F26.8Very low29.5Very low193 Ų193122.5 Ų122.585%0.84674%0.738SS**  trans-179.1125.7154.1-127.6-112.2000106.5
69S29.1Very low30Very low91 Ų91123.9 Ų123.964%0.63674%0.743SS**  cis87.5129.832.683.10000115.5
70G29.2Very low30.7Very low70 Ų70122.3 Ų122.372%0.72274%0.736SS**  trans107.684.4-176.300000111.8
71V32.5Very low31.4Very low128 Ų128125.4 Ų125.478%0.77674%0.74SS**  71.6108.154.6-175.10000113.5E73V71-E73 HydrophobicContact CG1-CG 4.35Å
72D30.8Very low32Very low138 Ų138130 Ų13074%0.73875%0.747SS**  -163.9101.1116.9-13734.1000107.4
73E34.5Very low32.4Very low140 Ų140131.5 Ų131.565%0.65475%0.747SS**  84123.888-86.9-151.7-171.800114.7V71V71-E73 HydrophobicContact CG1-CG 4.35Å
74H30.2Very low33Very low140 Ų140132.1 Ų132.165%0.64875%0.75SS**  -165.591.5119-108.79000114.4R487H74-R487 VanDerWaalsContact C-NH2 3.35Å; H74-R487 PolarHBondContact CD2-NH1 3.49Å; H74-R487 PolarHBondContact O-NH2 2.93Å
75A32.7Very low33.4Very low72 Ų72134.1 Ų134.160%0.59575%0.754SS**  trans64131.2155.200000121.6
76P38Very low34.4Very low128 Ų128134 Ų13483%0.83176%0.76SS**  trans-98.2175.5171.438.6-31.7000113.4
77I32.9Very low35.7Very low161 Ų161130 Ų13083%0.82675%0.747SS**  trans-111.8128.7177.2-71.2173.3000111
78S30.7Very low36.8Very low95 Ų95131.2 Ų131.266%0.66474%0.744SS**  trans24.7116.5163.965.40000120
79S35.6Very low38.1Very low113 Ų113125.7 Ų125.779%0.7972%0.72SS**  trans-109.1120151.1560000109.4
80E40.3Very low39.5Very low158 Ų158129.1 Ų129.174%0.73873%0.726SS**  trans-111.4149.3161.3-101.276.7-147.100109.9
81D40Very low41.7Very low151 Ų151127.7 Ų127.781%0.80771%0.705SS**  trans62.471.8165.8-62.5-12.3000119
82F39.4Very low43.8Very low204 Ų204128.1 Ų128.190%0.89570%0.703SS**  trans-118131.2133.8-80.5-78000111.2N84F82-N84 PolarHBondContact O-N 2.96Å
83V37.7Very low46.3Very low117 Ų117127.4 Ų127.471%0.70970%0.695SS**  trans-61.3123.8-175.9177.10000110.8F85V83-F85 PolarHBondContact O-N 3.45Å; V83-F85 VanDerWaalsContact O-N 3.11Å
84N35.8Very low48.6Very low157 Ų157125.1 Ų125.184%0.8469%0.685SS**  trans-66.1107.2171.2-87.1-43.1000110.7F82 P86F82-N84 PolarHBondContact O-N 2.96Å; N84-P86 WeakPolarHBondContact O-CD 3.38Å
85F38.3Very low51.3Low179 Ų179124 Ų12479%0.78568%0.676SS**  trans-79117.9159.2-68.9-84.7000108.9V83 G87V83-F85 PolarHBondContact O-N 3.45Å; V83-F85 VanDerWaalsContact O-N 3.11Å; F85-G87 PolarHBondContact O-N 3.4Å
86P50.3Low54Low133 Ų133126.6 Ų126.686%0.86467%0.674SS**SBendtrans-77.5119173.930.9-31.3000109.6N84N84-P86 WeakPolarHBondContact O-CD 3.38Å
87G53.1Low56.5Low57 Ų57125.4 Ų125.459%0.58866%0.655SS**  trans132.730.3171.800000117.2F85 H89F85-G87 PolarHBondContact O-N 3.4Å; G87-H89 PolarHBondContact O-N 2.97Å
88I54.8Low59.3Low131 Ų131122.7 Ų122.767%0.67264%0.638SS**  trans-68.8110.9158.3-59.8175000106.4H90I88-H90 PolarHBondContact O-CE1 2.81Å; I88-H90 PolarHBondContact O-N 2.9Å; I88-H90 PolarHBondContact O-ND1 3.23Å
89H53.6Low62.3Low76 Ų76120.3 Ų120.335%0.35262%0.619SS.*  trans-70.8121.5169.7-68.7-81.1000107.9G87 S91 E94G87-H89 PolarHBondContact O-N 2.97Å; H89-S91 PolarHBondContact O-N 3.16Å; H89-E94 HydrophobicContact CB-CB 4.37Å
90H59Low65Low164 Ų164121 Ų12176%0.75961%0.61SS**SBendtrans-84-3.3-169.5-6979.8000112.5I88 E94I88-H90 PolarHBondContact O-CE1 2.81Å; I88-H90 PolarHBondContact O-N 2.9Å; I88-H90 PolarHBondContact O-ND1 3.23Å; H90-E94 PolarHBondContact N-OE2 2.86Å
91S75.6Confident67.6Low40 Ų40118.5 Ų118.528%0.2860%0.598SS.*SBendtrans-141.8151.1166.666.70000111.4H89 E93 E94 Y95H89-S91 PolarHBondContact O-N 3.16Å; S91-E93 PolarHBondContact O-N 3.01Å; S91-E94 PolarHBondContact O-N 2.72Å; S91-E94 WeakPolarHBondContact OG-CG 3.37Å; S91-E94 PolarHBondContact OG-N 3.44Å; S91-E94 PolarHBondContact OG-OE1 3Å; S91-Y95 PolarHBondContact O-N 3.18Å
92N77.5Confident70.2Confident136 Ų136117.1 Ų117.173%0.72759%0.59SS**Hα-helixtrans-61.4-26.9173.4-70.5-15.1000111.9Y95 F96N92-Y95 WeakPolarHBondContact O-CB 3.23Å; N92-Y95 PolarHBondContact O-N 2.93Å; N92-F96 WeakPolarHBondContact O-CD2 3.43Å; N92-F96 PolarHBondContact O-N 3.35Å; N92-F96 VanDerWaalsContact O-N 3.1Å
93E83Confident72.9Confident124 Ų124113.5 Ų113.558%0.57957%0.574SS**Hα-helixtrans-68.6-42.1177.7-167.3-176.6148.800111.9S91 Y95 F96 K97S91-E93 PolarHBondContact O-N 3.01Å; E93-Y95 VanDerWaalsContact C-N 3.32Å; E93-Y95 PolarHBondContact O-N 2.82Å; E93-F96 PolarHBondContact O-N 3.36Å; E93-K97 HydrophobicContact CG-CD 4.48Å; E93-K97 WeakPolarHBondContact O-CG 3.46Å; E93-K97 PolarHBondContact O-N 2.88Å; E93-K97 VanDerWaalsContact OE1-CE 3.29Å; E93-K97 WeakPolarHBondContact OE1-CE 3.49Å; E93-K97 IonicContact OE1-NZ 3Å; E93-K97 PolarHBondContact OE1-NZ 3.05Å
94E82.6Confident75.6Confident91 Ų91110.4 Ų110.443%0.42556%0.56SS.*Hα-helixtrans-62.1-38.6172.1-76.5155.7-134.100112.3H89 H90 S91 K98H89-E94 HydrophobicContact CB-CB 4.37Å; H90-E94 PolarHBondContact N-OE2 2.86Å; S91-E94 PolarHBondContact O-N 2.72Å; S91-E94 WeakPolarHBondContact OG-CG 3.37Å; S91-E94 PolarHBondContact OG-N 3.44Å; S91-E94 PolarHBondContact OG-OE1 3Å; E94-K98 WeakPolarHBondContact O-CB 3.45Å; E94-K98 PolarHBondContact O-N 3.36Å
95Y86.6Confident78.5Confident118 Ų118105.3 Ų105.346%0.46354%0.54SS..Hα-helixtrans-60.7-50175.6171.6-98.4000111.2S91 N92 E93 K98 V99S91-Y95 PolarHBondContact O-N 3.18Å; N92-Y95 WeakPolarHBondContact O-CB 3.23Å; N92-Y95 PolarHBondContact O-N 2.93Å; E93-Y95 VanDerWaalsContact C-N 3.32Å; E93-Y95 PolarHBondContact O-N 2.82Å; Y95-K98 PolarHBondContact O-N 3.46Å; Y95-V99 HydrophobicContact CE1-CG2 4.1Å; Y95-V99 HydrophobicContact CE2-CG2 4.15Å; Y95-V99 WeakPolarHBondContact O-CG2 3.45Å; Y95-V99 PolarHBondContact O-N 3.4Å
96F89Confident81.2Confident126 Ų126101.7 Ų101.755%0.55353%0.525SS*.Hα-helixtrans-65.8-40.4179.2-72.4-61.9000112.7N92 E93 K98 V99 E100N92-F96 WeakPolarHBondContact O-CD2 3.43Å; N92-F96 PolarHBondContact O-N 3.35Å; N92-F96 VanDerWaalsContact O-N 3.1Å; E93-F96 PolarHBondContact O-N 3.36Å; F96-K98 VanDerWaalsContact C-N 3.32Å; F96-K98 PolarHBondContact O-N 3.42Å; F96-V99 PolarHBondContact O-N 2.92Å; F96-V99 VanDerWaalsContact O-N 3.17Å; F96-E100 WeakPolarHBondContact O-CG 3.25Å; F96-E100 PolarHBondContact O-N 2.92Å
97K91.6Very high83.4Confident102 Ų102101.1 Ų101.144%0.44351%0.514SS..Hα-helixtrans-59-41.7172.3-73.3174.5-174.8169.10112E93 V99 E100 E101E93-K97 HydrophobicContact CG-CD 4.48Å; E93-K97 WeakPolarHBondContact O-CG 3.46Å; E93-K97 PolarHBondContact O-N 2.88Å; E93-K97 VanDerWaalsContact OE1-CE 3.29Å; E93-K97 WeakPolarHBondContact OE1-CE 3.49Å; E93-K97 IonicContact OE1-NZ 3Å; E93-K97 PolarHBondContact OE1-NZ 3.05Å; K97-V99 VanDerWaalsContact C-N 3.35Å; K97-V99 PolarHBondContact O-N 2.99Å; K97-E100 PolarHBondContact O-N 2.93Å; K97-E101 WeakPolarHBondContact O-CG 3.37Å; K97-E101 PolarHBondContact O-N 3.28Å
98K92Very high85.3Confident105 Ų105103.6 Ų103.646%0.45751%0.511SS..Hα-helixtrans-67.7-34.2176.5-158.674.7-159.2165.60112.7E94 Y95 F96 E101 L102E94-K98 WeakPolarHBondContact O-CB 3.45Å; E94-K98 PolarHBondContact O-N 3.36Å; Y95-K98 PolarHBondContact O-N 3.46Å; F96-K98 VanDerWaalsContact C-N 3.32Å; F96-K98 PolarHBondContact O-N 3.42Å; K98-E101 WeakPolarHBondContact CD-OE2 3.49Å; K98-E101 WeakPolarHBondContact CE-OE2 3.43Å; K98-E101 IonicContact NZ-OE2 2.94Å; K98-E101 PolarHBondContact NZ-OE2 3.07Å; K98-L102 VanDerWaalsContact O-CB 3.29Å; K98-L102 WeakPolarHBondContact O-CB 3.43Å; K98-L102 PolarHBondContact O-N 3.02Å
99V92Very high87.3Confident45 Ų45100.5 Ų100.527%0.27350%0.498SS..Hα-helixtrans-66.9-37172.2169.90000111.5Y95 F96 K97 L102 K103Y95-V99 HydrophobicContact CE1-CG2 4.1Å; Y95-V99 HydrophobicContact CE2-CG2 4.15Å; Y95-V99 WeakPolarHBondContact O-CG2 3.45Å; Y95-V99 PolarHBondContact O-N 3.4Å; F96-V99 PolarHBondContact O-N 2.92Å; F96-V99 VanDerWaalsContact O-N 3.17Å; K97-V99 VanDerWaalsContact C-N 3.35Å; K97-V99 PolarHBondContact O-N 2.99Å; V99-L102 PolarHBondContact O-N 3.47Å; V99-K103 HydrophobicContact CG1-CD 4.39Å; V99-K103 VanDerWaalsContact O-CG 3.29Å; V99-K103 WeakPolarHBondContact O-CG 3.48Å; V99-K103 PolarHBondContact O-N 3.29Å
100E92.9Very high89.3Confident128 Ų128100.7 Ų100.760%0.59850%0.5SS*.Hα-helixtrans-67.8-45.5173.6-73.2175.8174.900112.2F96 K97 L102 K103 A104F96-E100 WeakPolarHBondContact O-CG 3.25Å; F96-E100 PolarHBondContact O-N 2.92Å; K97-E100 PolarHBondContact O-N 2.93Å; E100-L102 VanDerWaalsContact C-N 3.28Å; E100-L102 PolarHBondContact O-N 2.66Å; E100-K103 WeakPolarHBondContact O-CB 3.45Å; E100-K103 PolarHBondContact O-N 2.65Å; E100-A104 PolarHBondContact O-N 3.44Å
101E94.8Very high91.1Very high104 Ų10495.5 Ų95.549%0.48649%0.485SS..Hα-helixtrans-56.8-41.2171.6-73.8175-157.300111.9K97 K98 A104 A105K97-E101 WeakPolarHBondContact O-CG 3.37Å; K97-E101 PolarHBondContact O-N 3.28Å; K98-E101 WeakPolarHBondContact CD-OE2 3.49Å; K98-E101 WeakPolarHBondContact CE-OE2 3.43Å; K98-E101 IonicContact NZ-OE2 2.94Å; K98-E101 PolarHBondContact NZ-OE2 3.07Å; E101-A104 PolarHBondContact O-N 3.43Å; E101-A105 WeakPolarHBondContact O-CB 3.43Å; E101-A105 PolarHBondContact O-N 2.84Å
102L95.4Very high92Very high123 Ų12399.4 Ų99.464%0.64450%0.497SS*.Hα-helixtrans-71-34.7179.2-167.9145.5000112.1K98 V99 E100 H106K98-L102 VanDerWaalsContact O-CB 3.29Å; K98-L102 WeakPolarHBondContact O-CB 3.43Å; K98-L102 PolarHBondContact O-N 3.02Å; V99-L102 PolarHBondContact O-N 3.47Å; E100-L102 VanDerWaalsContact C-N 3.28Å; E100-L102 PolarHBondContact O-N 2.66Å; L102-H106 VanDerWaalsContact O-CB 3.31Å; L102-H106 WeakPolarHBondContact O-CB 3.41Å; L102-H106 PolarHBondContact O-N 3.26Å
103K95.1Very high92.7Very high128 Ų12897.7 Ų97.756%0.55749%0.487SS*.Hα-helixtrans-64.4-44.4169.6-75169.8-180177.60111.5V99 E100 H106 L107V99-K103 HydrophobicContact CG1-CD 4.39Å; V99-K103 VanDerWaalsContact O-CG 3.29Å; V99-K103 WeakPolarHBondContact O-CG 3.48Å; V99-K103 PolarHBondContact O-N 3.29Å; E100-K103 WeakPolarHBondContact O-CB 3.45Å; E100-K103 PolarHBondContact O-N 2.65Å; K103-H106 PolarHBondContact O-N 2.91Å; K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 2.86Å
104A95.7Very high93.3Very high51 Ų5197.6 Ų97.642%0.42149%0.487SS..Hα-helixtrans-62.2-48.5176.900000111.4E100 E101 H106 L107 E108E100-A104 PolarHBondContact O-N 3.44Å; E101-A104 PolarHBondContact O-N 3.43Å; A104-H106 VanDerWaalsContact C-N 3.29Å; A104-H106 PolarHBondContact O-N 2.96Å; A104-L107 PolarHBondContact O-N 3.47Å; A104-E108 PolarHBondContact O-N 3.31Å
105A95.8Very high93.8Very high50 Ų5099.8 Ų99.841%0.41350%0.495SS..Hα-helixtrans-59.3-39.2174.700000112.1E101 E108 T109E101-A105 WeakPolarHBondContact O-CB 3.43Å; E101-A105 PolarHBondContact O-N 2.84Å; A105-E108 PolarHBondContact O-N 3.05Å; A105-T109 WeakPolarHBondContact O-CG2 3.18Å; A105-T109 PolarHBondContact O-N 2.99Å
106H95Very high94Very high103 Ų10398.9 Ų98.948%0.47750%0.496SS..Hα-helixtrans-64.3-46174.5-178.147.7000112.1L102 K103 A104 E108 T109 M110L102-H106 VanDerWaalsContact O-CB 3.31Å; L102-H106 WeakPolarHBondContact O-CB 3.41Å; L102-H106 PolarHBondContact O-N 3.26Å; K103-H106 PolarHBondContact O-N 2.91Å; A104-H106 VanDerWaalsContact C-N 3.29Å; A104-H106 PolarHBondContact O-N 2.96Å; H106-E108 VanDerWaalsContact C-N 3.32Å; H106-E108 PolarHBondContact O-N 3.39Å; H106-T109 WeakPolarHBondContact CA-OG1 3.43Å; H106-T109 PolarHBondContact O-N 3.06Å; H106-T109 PolarHBondContact O-OG1 3.1Å; H106-M110 WeakPolarHBondContact O-CG 3.47Å; H106-M110 PolarHBondContact O-N 2.59Å
107L95.9Very high94.1Very high121 Ų121100 Ų10063%0.63450%0.498SS*.Hα-helixtrans-59.1-41.3175.2-70.6171.1000112K103 A104 T109 M110 A111K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 2.86Å; A104-L107 PolarHBondContact O-N 3.47Å; L107-T109 VanDerWaalsContact C-N 3.35Å; L107-T109 PolarHBondContact O-N 3.33Å; L107-M110 PolarHBondContact O-N 3.13Å; L107-A111 PolarHBondContact O-N 2.81Å
108E94.7Very high93.9Very high110 Ų11099 Ų9951%0.51450%0.495SS..Hα-helixtrans-60.6-40.3171.6-75.8-172.5-15200113.1A104 A105 H106 M110 A111 K112A104-E108 PolarHBondContact O-N 3.31Å; A105-E108 PolarHBondContact O-N 3.05Å; H106-E108 VanDerWaalsContact C-N 3.32Å; H106-E108 PolarHBondContact O-N 3.39Å; E108-M110 VanDerWaalsContact C-N 3.32Å; E108-A111 PolarHBondContact O-N 2.91Å; E108-K112 WeakPolarHBondContact O-CB 3.36Å; E108-K112 WeakPolarHBondContact O-CD 3.37Å; E108-K112 VanDerWaalsContact O-CG 3.25Å; E108-K112 WeakPolarHBondContact O-CG 3.39Å; E108-K112 PolarHBondContact O-N 3Å; E108-K112 IonicContact OE2-NZ 3.88Å; E108-K112 PolarHBondContact OE2-NZ 2.94Å
109T96.3Very high93.6Very high65 Ų6597.4 Ų97.440%0.39949%0.491SS..Hα-helixtrans-65.9-36.5175.960.30000111.7A105 H106 L107 K112 L113A105-T109 WeakPolarHBondContact O-CG2 3.18Å; A105-T109 PolarHBondContact O-N 2.99Å; H106-T109 WeakPolarHBondContact CA-OG1 3.43Å; H106-T109 PolarHBondContact O-N 3.06Å; H106-T109 PolarHBondContact O-OG1 3.1Å; L107-T109 VanDerWaalsContact C-N 3.35Å; L107-T109 PolarHBondContact O-N 3.33Å; T109-K112 PolarHBondContact O-N 3.35Å; T109-L113 WeakPolarHBondContact O-CG 3.43Å; T109-L113 PolarHBondContact O-N 3.43Å
110M95.8Very high93Very high81 Ų81101.4 Ų101.440%0.39951%0.505SS..Hα-helixtrans-68.1-44.4176.2-64-57.495.100111.1H106 L107 E108 K112 L113 E114H106-M110 WeakPolarHBondContact O-CG 3.47Å; H106-M110 PolarHBondContact O-N 2.59Å; L107-M110 PolarHBondContact O-N 3.13Å; E108-M110 VanDerWaalsContact C-N 3.32Å; M110-K112 VanDerWaalsContact C-N 3.32Å; M110-K112 PolarHBondContact O-N 3.16Å; M110-L113 HydrophobicContact CE-CD1 3.69Å; M110-L113 PolarHBondContact O-N 3.1Å; M110-L113 VanDerWaalsContact O-N 3.16Å; M110-E114 WeakPolarHBondContact O-CB 3.43Å; M110-E114 PolarHBondContact O-N 3.37Å
111A95.2Very high92Very high54 Ų5499.3 Ų99.345%0.44650%0.498SS..Hα-helixtrans-62.1-36.8174.800000112.8L107 E108 K115L107-A111 PolarHBondContact O-N 2.81Å; E108-A111 PolarHBondContact O-N 2.91Å; A111-K115 WeakPolarHBondContact O-CB 3.43Å; A111-K115 PolarHBondContact O-N 3.26Å
112K95.2Very high90.5Very high123 Ų12399.9 Ų99.954%0.53550%0.5SS..Hα-helixtrans-66.1-40.1173.4-73.3163.7-169.2157.60111.8E108 T109 M110 M116E108-K112 WeakPolarHBondContact O-CB 3.36Å; E108-K112 WeakPolarHBondContact O-CD 3.37Å; E108-K112 VanDerWaalsContact O-CG 3.25Å; E108-K112 WeakPolarHBondContact O-CG 3.39Å; E108-K112 PolarHBondContact O-N 3Å; E108-K112 IonicContact OE2-NZ 3.88Å; E108-K112 PolarHBondContact OE2-NZ 2.94Å; T109-K112 PolarHBondContact O-N 3.35Å; M110-K112 VanDerWaalsContact C-N 3.32Å; M110-K112 PolarHBondContact O-N 3.16Å; K112-M116 WeakPolarHBondContact O-CB 3.38Å; K112-M116 WeakPolarHBondContact O-CG 3.35Å; K112-M116 PolarHBondContact O-N 3.2Å
113L93.3Very high89Confident99 Ų99101 Ų10152%0.51851%0.506SS..Hα-helixtrans-69.3-39.7175-73.3178.1000112.6T109 M110 M116 Y117T109-L113 WeakPolarHBondContact O-CG 3.43Å; T109-L113 PolarHBondContact O-N 3.43Å; M110-L113 HydrophobicContact CE-CD1 3.69Å; M110-L113 PolarHBondContact O-N 3.1Å; M110-L113 VanDerWaalsContact O-N 3.16Å; L113-M116 PolarHBondContact O-N 3.42Å; L113-Y117 WeakPolarHBondContact O-CB 3.21Å; L113-Y117 PolarHBondContact O-N 2.97Å
114E95.3Very high87.2Confident122 Ų122103.6 Ų103.657%0.5752%0.517SS*.Hα-helixtrans-60.4-49.2173.4-178.3174.9-165.100110.3M110 M116 Y117 Q118M110-E114 WeakPolarHBondContact O-CB 3.43Å; M110-E114 PolarHBondContact O-N 3.37Å; E114-M116 PolarHBondContact O-N 2.93Å; E114-Y117 WeakPolarHBondContact O-CA 3.12Å; E114-Y117 WeakPolarHBondContact O-CB 3.33Å; E114-Y117 PolarHBondContact O-N 3.28Å; E114-Q118 WeakPolarHBondContact O-CG 3.5Å; E114-Q118 PolarHBondContact O-N 2.98Å
115K93.4Very high84.7Confident137 Ų137108 Ų10860%0.59653%0.529SS*.Hα-helixtrans-57-48.8174.3-173178.7176.5179.80111.7A111 Y117 Q118 D119A111-K115 WeakPolarHBondContact O-CB 3.43Å; A111-K115 PolarHBondContact O-N 3.26Å; K115-Y117 PolarHBondContact O-N 3.33Å; K115-Q118 PolarHBondContact O-N 3.29Å; K115-D119 WeakPolarHBondContact O-CB 3.38Å; K115-D119 PolarHBondContact O-N 3.43Å
116M89.8Confident82Confident99 Ų99111.8 Ų111.849%0.48855%0.546SS..Hα-helixtrans-59.3-27.9175-78.2179.659.700113.8K112 L113 E114 K120K112-M116 WeakPolarHBondContact O-CB 3.38Å; K112-M116 WeakPolarHBondContact O-CG 3.35Å; K112-M116 PolarHBondContact O-N 3.2Å; L113-M116 PolarHBondContact O-N 3.42Å; E114-M116 PolarHBondContact O-N 2.93Å; M116-K120 WeakPolarHBondContact O-CB 3.26Å; M116-K120 WeakPolarHBondContact O-CD 3.45Å; M116-K120 VanDerWaalsContact O-CG 3.23Å; M116-K120 WeakPolarHBondContact O-CG 3.33Å; M116-K120 PolarHBondContact O-N 3.03Å
117Y90.7Very high79.2Confident150 Ų150114.1 Ų114.159%0.58856%0.558SS**Hα-helixtrans-76.6-44.9176-173.8-101.3000111.1L113 E114 K115 K120 L121L113-Y117 WeakPolarHBondContact O-CB 3.21Å; L113-Y117 PolarHBondContact O-N 2.97Å; E114-Y117 WeakPolarHBondContact O-CA 3.12Å; E114-Y117 WeakPolarHBondContact O-CB 3.33Å; E114-Y117 PolarHBondContact O-N 3.28Å; K115-Y117 PolarHBondContact O-N 3.33Å; Y117-K120 WeakPolarHBondContact O-CB 3.38Å; Y117-K120 PolarHBondContact O-N 3.32Å; Y117-L121 HydrophobicContact CD1-CD1 4.09Å; Y117-L121 HydrophobicContact CE1-CD1 3.76Å; Y117-L121 HydrophobicContact CE1-CG 4.33Å; Y117-L121 WeakPolarHBondContact O-CG 3.39Å; Y117-L121 PolarHBondContact O-N 3.48Å
118Q88.3Confident76.5Confident81 Ų81114.3 Ų114.338%0.37957%0.566SS.*Hα-helixtrans-61.9-46.3173.1-58.4-61.7-1.600111.4E114 K115 K120 L121 H122E114-Q118 WeakPolarHBondContact O-CG 3.5Å; E114-Q118 PolarHBondContact O-N 2.98Å; K115-Q118 PolarHBondContact O-N 3.29Å; Q118-K120 PolarHBondContact O-N 3.32Å; Q118-L121 WeakPolarHBondContact O-CA 3.37Å; Q118-L121 WeakPolarHBondContact O-CB 3.38Å; Q118-L121 PolarHBondContact O-N 3.29Å; Q118-H122 PolarHBondContact O-CD2 3.39Å; Q118-H122 PolarHBondContact O-N 2.98Å
119D84.8Confident73.5Confident72 Ų72115.1 Ų115.139%0.38558%0.578SS.*Hα-helixtrans-55.3-38.3175.2-65.9-18.8000110.9K115 L123K115-D119 WeakPolarHBondContact O-CB 3.38Å; K115-D119 PolarHBondContact O-N 3.43Å; D119-L123 WeakPolarHBondContact O-CB 3.37Å; D119-L123 WeakPolarHBondContact O-CG 3.25Å; D119-L123 PolarHBondContact O-N 3.48Å
120K79.9Confident70.7Confident129 Ų129117 Ų11756%0.56159%0.589SS**Hα-helixtrans-72.1-26.6174.8-79.7174.9-179-177.60114.5M116 Y117 Q118M116-K120 WeakPolarHBondContact O-CB 3.26Å; M116-K120 WeakPolarHBondContact O-CD 3.45Å; M116-K120 VanDerWaalsContact O-CG 3.23Å; M116-K120 WeakPolarHBondContact O-CG 3.33Å; M116-K120 PolarHBondContact O-N 3.03Å; Y117-K120 WeakPolarHBondContact O-CB 3.38Å; Y117-K120 PolarHBondContact O-N 3.32Å; Q118-K120 PolarHBondContact O-N 3.32Å
121L71.5Confident67.9Low84 Ų84121.4 Ų121.444%0.4461%0.613SS.*Hα-helixtrans-73.3-45172.1-67.5175.4000110Y117 Q118 L123 K124Y117-L121 HydrophobicContact CD1-CD1 4.09Å; Y117-L121 HydrophobicContact CE1-CD1 3.76Å; Y117-L121 HydrophobicContact CE1-CG 4.33Å; Y117-L121 WeakPolarHBondContact O-CG 3.39Å; Y117-L121 PolarHBondContact O-N 3.48Å; Q118-L121 WeakPolarHBondContact O-CA 3.37Å; Q118-L121 WeakPolarHBondContact O-CB 3.38Å; Q118-L121 PolarHBondContact O-N 3.29Å; L121-L123 VanDerWaalsContact C-N 3.34Å; L121-L123 PolarHBondContact O-N 3.48Å; L121-K124 PolarHBondContact O-N 2.61Å
122H63Low65.2Low115 Ų115129 Ų12953%0.53263%0.63SS.*Hα-helixtrans-63.7-35.5175.1-62.5-53.6000112.9Q118 K124 E125Q118-H122 PolarHBondContact O-CD2 3.39Å; Q118-H122 PolarHBondContact O-N 2.98Å; H122-K124 PolarHBondContact O-N 2.85Å; H122-E125 PolarHBondContact O-N 3.23Å
123L63.9Low62.2Low147 Ų147132.4 Ų132.477%0.7765%0.648SS**THydrogen-bonded Turntrans-66.9-11.2172.6-75.4167.9000114.3D119 L121D119-L123 WeakPolarHBondContact O-CB 3.37Å; D119-L123 WeakPolarHBondContact O-CG 3.25Å; D119-L123 PolarHBondContact O-N 3.48Å; L121-L123 VanDerWaalsContact C-N 3.34Å; L121-L123 PolarHBondContact O-N 3.48Å
124K57.7Low59.2Low182 Ų182132.4 Ų132.479%0.79166%0.662SS**THydrogen-bonded Turntrans-97.1-4.8171.4-86.6-167.4169.6-167.20113.7L121 H122 V126L121-K124 PolarHBondContact O-N 2.61Å; H122-K124 PolarHBondContact O-N 2.85Å; K124-V126 PolarHBondContact O-N 3.17Å
125E44.3Very low56.4Low145 Ų145132 Ų13268%0.67867%0.673SS**  trans-85.263.2177-161.7165.1-162.700110.9H122 Q127H122-E125 PolarHBondContact O-N 3.23Å; E125-Q127 PolarHBondContact O-N 2.65Å
126V38.2Very low53.7Low128 Ų128133.5 Ų133.578%0.77669%0.686SS**PPolyproline II helixtrans-70.1118.1157.9174.80000106.7K124K124-V126 PolarHBondContact O-N 3.17Å
127Q35.8Very low51Low153 Ų153133.1 Ų133.172%0.71569%0.694SS**PPolyproline II helixtrans-61.1136.8-176-66.2-167.2-3.700112.4E125 V129E125-Q127 PolarHBondContact O-N 2.65Å; Q127-V129 PolarHBondContact O-N 2.9Å
128P39.3Very low48.1Very low124 Ų124132.9 Ų132.981%0.80570%0.702SS**PPolyproline II helixtrans-70.4122.7151.530.4-29.8000108.6V130P128-V130 PolarHBondContact O-N 2.81Å; P128-V130 VanDerWaalsContact O-N 3.17Å
129V32.8Very low45.4Very low128 Ų128133 Ų13378%0.77673%0.725SS**  trans-70.8110.7-179.2169.20000110.7Q127Q127-V129 PolarHBondContact O-N 2.9Å
130V37Very low42.9Very low104 Ų104135.2 Ų135.263%0.6375%0.746SS**  trans53.6109.5146-174.10000118P128 R132P128-V130 PolarHBondContact O-N 2.81Å; P128-V130 VanDerWaalsContact O-N 3.17Å; V130-R132 HydrophobicContact CG1-CG 4.05Å
131I37.2Very low40.4Very low173 Ų173139.6 Ų139.689%0.88776%0.759SS**  -111.1128.8126.1-64.5179.5000106.6
132R38Very low38.6Very low213 Ų213140.3 Ų140.380%0.80477%0.771SS**  trans-68.8143174.4-70.2176.4165.5-156.8-2.5109.5V130V130-R132 HydrophobicContact CG1-CG 4.05Å
133E32.1Very low36.9Very low196 Ų196140.8 Ų140.892%0.91678%0.782SS**  -168.8170.6114.8-105.4166.3-157.200113.5
134A30.9Very low35.5Very low98 Ų98138.4 Ų138.481%0.8178%0.778SS**  trans-62.6152.5-151.500000118.8
135S36.8Very low34.3Very low115 Ų115137.6 Ų137.680%0.80478%0.777SS**  trans-51.6141.6168.8-39.20000115.5
136L35.1Very low33.8Very low167 Ų167140.5 Ų140.587%0.87479%0.787SS**  trans-173.4115.8140.1-94.1153.6000106.4
137S33.5Very low33.3Very low92 Ų92142 Ų14264%0.64379%0.791SS**  71.5122.290.5-135.90000115.6
138D30.5Very low33.3Very low145 Ų145139.3 Ų139.378%0.77579%0.789SS**  trans58.692.6155-54.7-55.9000121.5
139G32Very low32.9Very low83 Ų83143.6 Ų143.686%0.85679%0.79SS**  61.179.597.600000119.3
140S32.2Very low32.7Very low118 Ų118144.8 Ų144.883%0.82579%0.787SS**  trans-168.2160.1152.951.70000111
141R27.2Very low32.6Very low221 Ų221145.8 Ų145.883%0.83480%0.796SS**  cis-173.9127.5-27.8174.2-165.9171.1176-1108
142S33.3Very low32.2Very low99 Ų99143.6 Ų143.669%0.69279%0.79SS**  trans61157.3163.663.40000116.6
143V26.8Very low31.8Very low126 Ų126138.2 Ų138.276%0.76479%0.785SS**  cis-154.3152.343.3162.70000111
144S35.4Very low31.8Very low97 Ų97137.1 Ų137.168%0.67879%0.785SS**  trans11.4130.6154.2-161.90000120.5
145E32.4Very low31.6Very low165 Ų165140.8 Ų140.877%0.77179%0.787SS**  166126.8108.2-91.3-175.1179.900111.6
146K33.5Very low31.1Very low205 Ų205139.9 Ų139.989%0.89178%0.777SS**  -177.3129.1129.5-96.5142-160.6163.80111.5
147N26.8Very low30.8Very low161 Ų161137.6 Ų137.686%0.86178%0.775SS**  trans-78.3156.1-176.4-71.5-48000112.9
148S36.7Very low30.6Very low95 Ų95142.4 Ų142.466%0.66479%0.785SS**  trans-51.7146.8166.553.80000114
149Y30.9Very low30.6Very low214 Ų214141 Ų14184%0.83979%0.786SS**  trans-149.8164.6137.7-88.7-58.9000112.1
150H28.5Very low30.4Very low153 Ų153146.2 Ų146.271%0.70879%0.788SS**  trans-83158.2-155-57.9-81.5000116.3
151P35.5Very low31.4Very low125 Ų125145.5 Ų145.581%0.81278%0.781SS**  trans-81.4117.4156.233-29.2000110.6
152V28.6Very low31.5Very low127 Ų127141.1 Ų141.177%0.7777%0.774SS**  trans-97.4100.1166.4177.90000106.5
153S29.7Very low31.4Very low100 Ų100142.4 Ų142.470%0.69977%0.773SS**  57.665.288.1-172.90000113.1M155S153-M155 PolarHBondContact O-N 3.34Å; S153-M155 VanDerWaalsContact O-N 3.16Å
154L31.5Very low31.5Very low174 Ų174139.9 Ų139.991%0.91177%0.772SS**  trans-68.5107.1162.9-74.6174.4000109.4
155M26.8Very low31.1Very low174 Ų174143.4 Ų143.486%0.85778%0.778SS**  trans-68.8132.6173.8-175170.6167.500110.3S153S153-M155 PolarHBondContact O-N 3.34Å; S153-M155 VanDerWaalsContact O-N 3.16Å
156T26.9Very low30.8Very low96 Ų96141.1 Ų141.159%0.58978%0.78SS**  trans-64.5130173.949.30000112F158T156-F158 WeakPolarHBondContact OG1-CE2 3.29Å
157S27.7Very low30.4Very low120 Ų120135.8 Ų135.884%0.83977%0.768SS**  trans-95.2113157.3-51.70000108.7
158F29.3Very low30.4Very low192 Ų192133 Ų13384%0.84276%0.761SS**  trans-76.5132.6172.8-69.1-96.1000110.5T156T156-F158 WeakPolarHBondContact OG1-CE2 3.29Å
159S30Very low29.9Very low116 Ų116137.7 Ų137.781%0.81177%0.77SS**  trans-152.298154.546.10000110.4
160E28.8Very low29.8Very low192 Ų192138.3 Ų138.390%0.89777%0.773SS**  trans-120.3156.8153.5-100.8-148.2127.900109
161P53.2Low29.7Very low103 Ų103137.5 Ų137.567%0.66978%0.778SS**  trans-107.9176.2-145.540-33.9000113.1
162D29.1Very low29.3Very low129 Ų129136.6 Ų136.669%0.6978%0.775SS**  -164.3143.5123.7-121.7-4.9000115.8
163L31.8Very low29.3Very low127 Ų127135.7 Ų135.767%0.66577%0.774SS**  trans65.4138.9146.9-61.7164.8000122.7
164G28.9Very low29.4Very low72 Ų72136.5 Ų136.574%0.74278%0.78SS**  trans130.853176.100000112.8
165Q26.7Very low29.5Very low172 Ų172137 Ų13780%0.80478%0.778SS**  71.599.174.4-163.7173.413.800114.2
166S25.7Very low30Very low116 Ų116136.8 Ų136.881%0.81177%0.774SS**  trans69154.4160.1-54.20000117.2
167S25.4Very low30.5Very low93 Ų93140.2 Ų140.265%0.6578%0.784SS**  cis-149127.7-2.243.30000108.4
168S27.6Very low31Very low103 Ų103141.5 Ų141.572%0.7278%0.78SS**  43.8104.494.7173.50000115.4
169F26.4Very low31.9Very low194 Ų194136.9 Ų136.985%0.85177%0.77SS**  trans-147.7120.6132.2-80.4-65.7000110.6
170Y28.6Very low32Very low227 Ų227138.4 Ų138.489%0.8977%0.769SS**  trans-120.7138.3159.7-118.1-84.4000105.9
171V26.5Very low32.3Very low135 Ų135136.7 Ų136.782%0.81877%0.765SS**  trans-122.3116.4168.9176.20000108.2
172S26.5Very low31.9Very low106 Ų106140.5 Ų140.574%0.74177%0.774SS**  trans-162.5103.1159.5-1580000104.8
173S29.1Very low32.9Very low109 Ų109143.4 Ų143.476%0.76278%0.78SS**  68.99869.7-164.90000113.1
174S30.9Very low33.6Very low116 Ų116144.1 Ų144.181%0.81178%0.78SS**  -169.7145.1124.666.70000109.5
175E34.3Very low34.2Very low186 Ų186148.6 Ų148.687%0.86978%0.776SS**  trans-78.8172.7176-56.2-178.8133.800109.9
176E35.8Very low35.2Very low169 Ų169144.5 Ų144.579%0.7977%0.771SS**  -170.7137.877.1-157.5151-143.400112
177E37.4Very low36.5Very low167 Ų167148.2 Ų148.278%0.7877%0.768SS**  trans44.2147.7154.3-63.3-170.8150.100124.5
178L39.8Very low38Very low147 Ų147149.1 Ų149.177%0.7776%0.762SS**  cis-179.5179.7-32.7-106-178.7000105.6
179P47.3Very low39.6Very low95 Ų95149.3 Ų149.362%0.61776%0.755SS**  cis-133.5-176.81.938.3-17.9000117.2
180N31.1Very low41.5Very low148 Ų148149.9 Ų149.979%0.79175%0.751SS**  trans89.997.6158.6-56-32.1000120.2
181L37.1Very low43.3Very low156 Ų156145.8 Ų145.882%0.81774%0.742SS**  -169.6127.5102.1-16960.4000113.1K183L181-K183 PolarHBondContact O-N 2.91Å
182E44.4Very low45.3Very low183 Ų183144.9 Ų144.986%0.85573%0.73SS**THydrogen-bonded Turntrans-82.432.1-157-156.2-175.5174.400117.1
183K50Low47.8Very low191 Ų191142.5 Ų142.583%0.8372%0.716SS**THydrogen-bonded Turntrans-124.23-165.7-74.1-174.6177.5175.90118.9L181L181-K183 PolarHBondContact O-N 2.91Å
184E45.2Very low50.3Low142 Ų142144.8 Ų144.866%0.66471%0.71SS**SBendtrans-110.3-17.8-176.2-153.1140.8-145.700114.9A186 R187E184-A186 PolarHBondContact O-N 3.37Å; E184-R187 PolarHBondContact O-N 2.92Å; E184-R187 VanDerWaalsContact O-N 3.13Å
185Y42.6Very low52.5Low165 Ų165141.1 Ų141.165%0.64769%0.686SS**Hα-helixtrans-55.9-20.4-174.7-85.3-85.4000116.8R187 N189Y185-R187 VanDerWaalsContact C-N 3.35Å; Y185-N189 PolarHBondContact O-ND2 3.01Å
186A47.6Very low54.7Low86 Ų86139 Ų13971%0.71167%0.674SS**Hα-helixtrans-74-22.9179.800000113.7E184E184-A186 PolarHBondContact O-N 3.37Å
187R52.5Low56.8Low195 Ų195136.5 Ų136.574%0.73666%0.662SS**Hα-helixtrans-90.3-43.1-176.7-174.4170.7-72.2-152.2-1.6112.3E184 Y185 N189 R190E184-R187 PolarHBondContact O-N 2.92Å; E184-R187 VanDerWaalsContact O-N 3.13Å; Y185-R187 VanDerWaalsContact C-N 3.35Å; R187-N189 PolarHBondContact O-N 3.33Å; R187-R190 PolarHBondContact O-N 2.85Å
188E56.4Low58.8Low112 Ų112132.7 Ų132.752%0.52365%0.647SS.*Hα-helixtrans-67.6-35.4-178-66.1176.3136.600112R190 M191 M192E188-R190 PolarHBondContact O-N 3.42Å; E188-M191 PolarHBondContact O-N 3.44Å; E188-M192 PolarHBondContact O-N 2.88Å
189N61.6Low60.7Low107 Ų107130.1 Ų130.157%0.57263%0.633SS**Hα-helixtrans-58.4-30.2175-87.2-28.2000113.7Y185 R187 A193Y185-N189 PolarHBondContact O-ND2 3.01Å; R187-N189 PolarHBondContact O-N 3.33Å; N189-A193 VanDerWaalsContact O-CB 3.23Å; N189-A193 WeakPolarHBondContact O-CB 3.38Å; N189-A193 PolarHBondContact O-N 3.29Å
190R66.3Low62.2Low205 Ų205130.6 Ų130.677%0.77463%0.63SS**Hα-helixtrans-73.4-37.5173.7-73.7-173.8176.9-179.2-0.7112.6R187 E188 Y194R187-R190 PolarHBondContact O-N 2.85Å; E188-R190 PolarHBondContact O-N 3.42Å; R190-Y194 WeakPolarHBondContact O-CB 3.39Å; R190-Y194 PolarHBondContact O-N 2.89Å
191M66.3Low64.6Low142 Ų142126.8 Ų126.870%0.761%0.61SS**Hα-helixtrans-71.8-38.1176.4-66.7-172.466.800111.4E188 Y194 A195E188-M191 PolarHBondContact O-N 3.44Å; M191-Y194 PolarHBondContact O-N 3.22Å; M191-A195 VanDerWaalsContact O-CB 3.31Å; M191-A195 WeakPolarHBondContact O-CB 3.44Å; M191-A195 PolarHBondContact O-N 3.21Å
192M69.8Low66.4Low116 Ų116126 Ų12657%0.57160%0.603SS**Hα-helixtrans-65.7-40.5171.8-80.9-68.1-164.300112.5E188 A195 K196E188-M192 PolarHBondContact O-N 2.88Å; M192-A195 PolarHBondContact O-N 3.36Å; M192-K196 WeakPolarHBondContact O-CB 3.36Å; M192-K196 VanDerWaalsContact O-CG 3.24Å; M192-K196 WeakPolarHBondContact O-CG 3.4Å; M192-K196 PolarHBondContact O-N 2.95Å
193A77.6Confident67.6Low55 Ų55125.4 Ų125.446%0.45559%0.594SS.*Hα-helixtrans-62.6-47.8173.600000111.3N189 A195 K196 E197N189-A193 VanDerWaalsContact O-CB 3.23Å; N189-A193 WeakPolarHBondContact O-CB 3.38Å; N189-A193 PolarHBondContact O-N 3.29Å; A193-A195 PolarHBondContact O-N 3.23Å; A193-K196 PolarHBondContact O-N 3.46Å; A193-E197 VanDerWaalsContact O-CB 3.3Å; A193-E197 WeakPolarHBondContact O-CB 3.45Å; A193-E197 PolarHBondContact O-N 2.99Å
194Y81.3Confident68.5Low158 Ų158123.2 Ų123.262%0.6258%0.584SS**Hα-helixtrans-61.2-40.8176.5-178.8-103.7000112.7R190 M191 E197 L198R190-Y194 WeakPolarHBondContact O-CB 3.39Å; R190-Y194 PolarHBondContact O-N 2.89Å; M191-Y194 PolarHBondContact O-N 3.22Å; Y194-E197 PolarHBondContact O-N 2.88Å; Y194-L198 VanDerWaalsContact O-CB 3.23Å; Y194-L198 WeakPolarHBondContact O-CB 3.48Å; Y194-L198 PolarHBondContact O-N 2.75Å
195A79Confident69.5Low38 Ų38123.6 Ų123.631%0.31459%0.591SS.*Hα-helixtrans-65.7-42.7175.300000112.1M191 M192 A193 E197 L198 I199M191-A195 VanDerWaalsContact O-CB 3.31Å; M191-A195 WeakPolarHBondContact O-CB 3.44Å; M191-A195 PolarHBondContact O-N 3.21Å; M192-A195 PolarHBondContact O-N 3.36Å; A193-A195 PolarHBondContact O-N 3.23Å; A195-E197 VanDerWaalsContact C-N 3.35Å; A195-L198 PolarHBondContact O-N 2.9Å; A195-I199 WeakPolarHBondContact O-CB 3.31Å; A195-I199 WeakPolarHBondContact O-CD1 3.27Å; A195-I199 VanDerWaalsContact O-CG1 3.22Å; A195-I199 WeakPolarHBondContact O-CG1 3.46Å; A195-I199 PolarHBondContact O-N 3.48Å
196K79.7Confident70.5Confident142 Ų142121.1 Ų121.162%0.61758%0.584SS**Hα-helixtrans-64.4-38.6175.1-74.4173.4-179.5-176.70112M192 A193 N200M192-K196 WeakPolarHBondContact O-CB 3.36Å; M192-K196 VanDerWaalsContact O-CG 3.24Å; M192-K196 WeakPolarHBondContact O-CG 3.4Å; M192-K196 PolarHBondContact O-N 2.95Å; A193-K196 PolarHBondContact O-N 3.46Å; K196-N200 WeakPolarHBondContact O-CB 3.3Å; K196-N200 PolarHBondContact O-N 3.18Å
197E80.5Confident71.3Confident117 Ų117120 Ų12055%0.54757%0.57SS.*Hα-helixtrans-71.5-40.2177.6-170.8166.5-146.100111.9A193 Y194 A195 N200 N201A193-E197 VanDerWaalsContact O-CB 3.3Å; A193-E197 WeakPolarHBondContact O-CB 3.45Å; A193-E197 PolarHBondContact O-N 2.99Å; Y194-E197 PolarHBondContact O-N 2.88Å; A195-E197 VanDerWaalsContact C-N 3.35Å; E197-N200 PolarHBondContact O-N 2.78Å; E197-N201 WeakPolarHBondContact O-CB 3.3Å; E197-N201 PolarHBondContact O-N 2.81Å; E197-N201 PolarHBondContact O-ND2 2.95Å
198L78.8Confident71.8Confident87 Ų87114.5 Ų114.546%0.45556%0.557SS.*Hα-helixtrans-59.7-47.9171.2-178.965.6000111.1Y194 A195 N201 M202Y194-L198 VanDerWaalsContact O-CB 3.23Å; Y194-L198 WeakPolarHBondContact O-CB 3.48Å; Y194-L198 PolarHBondContact O-N 2.75Å; A195-L198 PolarHBondContact O-N 2.9Å; L198-N201 PolarHBondContact O-N 2.78Å; L198-M202 WeakPolarHBondContact O-CG 3.49Å; L198-M202 PolarHBondContact O-N 3.35Å
199I80Confident71.9Confident93 Ų93114.8 Ų114.848%0.47756%0.559SS.*Hα-helixtrans-60.3-51.3175.5-68.9163.6000110.1A195 N201 M202 W203A195-I199 WeakPolarHBondContact O-CB 3.31Å; A195-I199 WeakPolarHBondContact O-CD1 3.27Å; A195-I199 VanDerWaalsContact O-CG1 3.22Å; A195-I199 WeakPolarHBondContact O-CG1 3.46Å; A195-I199 PolarHBondContact O-N 3.48Å; I199-N201 PolarHBondContact O-N 2.86Å; I199-M202 WeakPolarHBondContact O-CB 3.16Å; I199-M202 PolarHBondContact O-N 3.21Å; I199-W203 PolarHBondContact O-N 3.38Å
200N79.1Confident71.8Confident105 Ų105115 Ų11556%0.56156%0.56SS**Hα-helixtrans-57.8-37.1178.3-106.3-13.4000112.6K196 E197 W203 K204K196-N200 WeakPolarHBondContact O-CB 3.3Å; K196-N200 PolarHBondContact O-N 3.18Å; E197-N200 PolarHBondContact O-N 2.78Å; N200-W203 PolarHBondContact O-N 3.29Å; N200-K204 WeakPolarHBondContact O-CG 3.49Å; N200-K204 PolarHBondContact O-N 2.98Å
201N79.8Confident71.5Confident68 Ų68114.6 Ų114.636%0.36456%0.56SS.*Hα-helixtrans-69.4-32.5176.2-67.9-22.9000112.2E197 L198 I199 W203 K204E197-N201 WeakPolarHBondContact O-CB 3.3Å; E197-N201 PolarHBondContact O-N 2.81Å; E197-N201 PolarHBondContact O-ND2 2.95Å; L198-N201 PolarHBondContact O-N 2.78Å; I199-N201 PolarHBondContact O-N 2.86Å; N201-W203 PolarHBondContact O-N 3.07Å; N201-K204 PolarHBondContact O-N 2.78Å; N201-K204 WeakPolarHBondContact OD1-CE 3.49Å; N201-K204 PolarHBondContact OD1-NZ 3.05Å
202M75.3Confident71.1Confident138 Ų138113.1 Ų113.168%0.6855%0.554SS**Hα-helixtrans-65.3-23.4172.2-68.8176.367.200113.7L198 I199L198-M202 WeakPolarHBondContact O-CG 3.49Å; L198-M202 PolarHBondContact O-N 3.35Å; I199-M202 WeakPolarHBondContact O-CB 3.16Å; I199-M202 PolarHBondContact O-N 3.21Å
203W69.2Low70.1Confident172 Ų172116.9 Ų116.965%0.65256%0.562SS**Hα-helixtrans-93.5-13.1176.3-66.699.7000114.1I199 N200 N201 F206I199-W203 PolarHBondContact O-N 3.38Å; N200-W203 PolarHBondContact O-N 3.29Å; N201-W203 PolarHBondContact O-N 3.07Å; W203-F206 HydrophobicContact CE3-CD1 4.34Å; W203-F206 HydrophobicContact CZ3-CD1 4.42Å
204K69.4Low68.3Low144 Ų144119.1 Ų119.163%0.62657%0.573SS**Hα-helixtrans-71.5-33.7179.4-78.8172.7-169.7168.40113.5N200 N201N200-K204 WeakPolarHBondContact O-CG 3.49Å; N200-K204 PolarHBondContact O-N 2.98Å; N201-K204 PolarHBondContact O-N 2.78Å; N201-K204 WeakPolarHBondContact OD1-CE 3.49Å; N201-K204 PolarHBondContact OD1-NZ 3.05Å
205D66.2Low66.4Low150 Ų150120.9 Ų120.980%0.80258%0.584SS**THydrogen-bonded Turntrans-96.410179.8-59.6-26.5000112.3C207D205-C207 PolarHBondContact O-N 2.82Å
206F63.5Low64.8Low114 Ų114126.4 Ų126.450%0.561%0.608SS.*  trans-91.298.9-178.4-173.3-96.3000111.2W203 V208W203-F206 HydrophobicContact CE3-CD1 4.34Å; W203-F206 HydrophobicContact CZ3-CD1 4.42Å; F206-V208 HydrophobicContact CE1-CG2 4.06Å
207C65.8Low62.8Low62 Ų62125.4 Ų125.442%0.41961%0.614SS.*  trans-106.8129.1174.8-163.60000110.6D205 E209 D210D205-C207 PolarHBondContact O-N 2.82Å; C207-E209 VanDerWaalsContact C-N 3.3Å; C207-E209 PolarHBondContact O-N 3.25Å; C207-E209 PolarHBondContact SG-OE2 3.27Å; C207-D210 PolarHBondContact O-N 2.92Å
208V62.7Low60.8Low79 Ų79123.1 Ų123.148%0.47962%0.621SS.*THydrogen-bonded Turntrans-71.2-29.5-175.11790000111.3F206 D210 Y211 I212F206-V208 HydrophobicContact CE1-CG2 4.06Å; V208-D210 PolarHBondContact O-N 2.79Å; V208-Y211 PolarHBondContact O-N 3.23Å; V208-I212 HydrophobicContact CG1-CD1 3.96Å; V208-I212 HydrophobicContact CG1-CG1 4.36Å; V208-I212 PolarHBondContact O-N 2.83Å
209E57.4Low58.8Low118 Ų118128.5 Ų128.555%0.55164%0.642SS**Hα-helixtrans-57.6-25.3175.3-79.157.6-141.600113.8C207 Y211 I212 R213C207-E209 VanDerWaalsContact C-N 3.3Å; C207-E209 PolarHBondContact O-N 3.25Å; C207-E209 PolarHBondContact SG-OE2 3.27Å; E209-Y211 VanDerWaalsContact C-N 3.33Å; E209-I212 PolarHBondContact O-N 3.22Å; E209-R213 PolarHBondContact O-N 3.4Å
210D60.5Low56.8Low113 Ų113132.9 Ų132.960%0.60466%0.66SS**Hα-helixtrans-74.3-24.2175.5-74.1-32000112.8C207 V208C207-D210 PolarHBondContact O-N 2.92Å; V208-D210 PolarHBondContact O-N 2.79Å
211Y60Low54.7Low195 Ų195134.7 Ų134.777%0.76568%0.675SS**Hα-helixtrans-86.6-27.3171.7-104-90.9000113.1V208 E209 R213V208-Y211 PolarHBondContact O-N 3.23Å; E209-Y211 VanDerWaalsContact C-N 3.33Å; Y211-R213 PolarHBondContact O-N 3.2Å
212I57.7Low52.7Low112 Ų112134.8 Ų134.857%0.57469%0.685SS**Hα-helixtrans-73.9-17.1178-65.1170.7000111.7V208 E209 C214V208-I212 HydrophobicContact CG1-CD1 3.96Å; V208-I212 HydrophobicContact CG1-CG1 4.36Å; V208-I212 PolarHBondContact O-N 2.83Å; E209-I212 PolarHBondContact O-N 3.22Å; I212-C214 PolarHBondContact O-N 3.03Å
213R48.8Very low51.2Low194 Ų194137.4 Ų137.473%0.73270%0.696SS**  trans-75.963.9175.5-154.8-179.9-56.4-138.64.3112.4E209 Y211 K215E209-R213 PolarHBondContact O-N 3.4Å; Y211-R213 PolarHBondContact O-N 3.2Å; R213-K215 PolarHBondContact O-N 2.81Å
214C38.7Very low50Low102 Ų102138.3 Ų138.369%0.68970%0.704SS**  trans-46.7122.3166.3-710000110.1I212 D216I212-C214 PolarHBondContact O-N 3.03Å; C214-D216 PolarHBondContact O-N 3.45Å
215K43.1Very low48.8Very low196 Ų196137.4 Ų137.485%0.85271%0.711SS**  trans-77.571.7171-76.8-165.5176.3-175.70111.1R213 T217R213-K215 PolarHBondContact O-N 2.81Å; K215-T217 PolarHBondContact O-N 2.96Å
216D44.8Very low47.9Very low154 Ų154142.3 Ų142.382%0.82472%0.718SS**  trans-69.185.3147-81.3-36.1000108.1C214C214-D216 PolarHBondContact O-N 3.45Å
217T38.3Very low47.5Very low121 Ų121146.1 Ų146.174%0.74274%0.735SS**  trans-150.468.4168.16.50000110.4K215K215-T217 PolarHBondContact O-N 2.96Å
218G38.7Very low47.3Very low68 Ų68152.9 Ų152.970%0.70176%0.757SS**  trans-117.818.2169.200000113.6
219F36.5Very low46.5Very low200 Ų200161.1 Ų161.188%0.87778%0.779SS**  trans-121.8112-179.3-69.2-67.4000112.1
220H37.7Very low46.3Very low185 Ų185165.2 Ų165.286%0.85680%0.795SS**  trans-63.5133.1164.1-72.3-90.8000110.1A222H220-A222 VanDerWaalsContact C-N 3.29Å; H220-A222 PolarHBondContact O-N 2.85Å
221T34.1Very low45.9Very low143 Ų143168.8 Ų168.888%0.87781%0.808SS**  trans-67.886.6168.7-38.50000109.8
222A37.7Very low45.4Very low71 Ų71170.3 Ų170.359%0.58781%0.813SS**  trans-86.9111.3166.600000108.6H220 K224H220-A222 VanDerWaalsContact C-N 3.29Å; H220-A222 PolarHBondContact O-N 2.85Å; A222-K224 PolarHBondContact O-N 2.94Å; A222-K224 VanDerWaalsContact O-N 3.17Å
223E43.4Very low45.5Very low192 Ų192170.1 Ų170.190%0.89782%0.817SS**  trans-54.1120.7175-65.1-175.7134.300110.6
224K45.5Very low45.9Very low191 Ų191165.1 Ų165.183%0.8381%0.809SS**  trans-123.3113.6169.1-73.7-176.8-179.8173.80108.9A222A222-K224 PolarHBondContact O-N 2.94Å; A222-K224 VanDerWaalsContact O-N 3.17Å
225T44.1Very low47.1Very low125 Ų125165.9 Ų165.977%0.76781%0.811SS**PPolyproline II helixtrans-53139.4-179.648.20000112K227T225-K227 PolarHBondContact O-N 3.07Å; T225-K227 VanDerWaalsContact O-N 3.15Å
226R47Very low48.2Very low254 Ų254163.7 Ų163.796%0.95881%0.807SS**PPolyproline II helixtrans-51.6118.7178.3-72.1176.2170.2173.7-3.8110.9
227K54.2Low49.3Very low194 Ų194162.4 Ų162.484%0.84381%0.805SS**PPolyproline II helixtrans-103.7137.5161.9-70.3-173.2177.5-1780109.2T225T225-K227 PolarHBondContact O-N 3.07Å; T225-K227 VanDerWaalsContact O-N 3.15Å
228K61.8Low51.1Low203 Ų203162.4 Ų162.488%0.88380%0.804SS**PPolyproline II helixtrans-64.4156.6-174.7-67.6-173.3178-176.90111.5K230K228-K230 PolarHBondContact O-N 3.33Å
229R47.2Very low52.9Low253 Ų253164.2 Ų164.296%0.95580%0.804SS**PPolyproline II helixtrans-53.6126.6177.1-63.6-176.8179.7-169.6-0.7109.7
230K51.9Low54.9Low204 Ų204163 Ų16389%0.88780%0.801SS**PPolyproline II helixtrans-85.1144.9163.1-76.8-170.4172.9-1700108.9K228K228-K230 PolarHBondContact O-N 3.33Å
231E53.8Low57.2Low188 Ų188157.1 Ų157.188%0.87978%0.779SS**PPolyproline II helixtrans-63.1145.6179.7-153.2152.8-14300111V233E231-V233 PolarHBondContact O-N 3.25Å; E231-V233 VanDerWaalsContact O-N 3.14Å
232W48Very low59.5Low227 Ų227155.7 Ų155.786%0.8676%0.761SS**  trans-79.7100.9-170.2-170.377.6000110.8P234W232-P234 HydrophobicContact CH2-CB 4.28Å; W232-P234 HydrophobicContact CZ3-CB 4.38Å
233V61.3Low61.8Low108 Ų108160.6 Ų160.666%0.65577%0.772SS**  trans-93.7130.5164.5-174.80000107.2E231 T235E231-V233 PolarHBondContact O-N 3.25Å; E231-V233 VanDerWaalsContact O-N 3.14Å; V233-T235 VanDerWaalsContact C-N 3.25Å; V233-T235 PolarHBondContact O-N 2.9Å
234P56.1Low63.3Low89 Ų89156.8 Ų156.858%0.57876%0.755SS**  trans-71.281.7179.729.3-35.2000110.8W232 I236W232-P234 HydrophobicContact CH2-CB 4.28Å; W232-P234 HydrophobicContact CZ3-CB 4.38Å; P234-I236 PolarHBondContact O-N 3.26Å
235T64.9Low65.1Low118 Ų118151.5 Ų151.572%0.72474%0.735SS**  trans-70.9107.2166.9-47.60000107.1V233 T237V233-T235 VanDerWaalsContact C-N 3.25Å; V233-T235 PolarHBondContact O-N 2.9Å; T235-T237 PolarHBondContact O-N 3.22Å
236I64.8Low67.1Low150 Ų150148.5 Ų148.577%0.76971%0.713SS**  trans-55.7111.1177.7-63.1172.1000108P234 V238P234-I236 PolarHBondContact O-N 3.26Å; I236-V238 VanDerWaalsContact C-N 3.32Å; I236-V238 PolarHBondContact O-N 2.97Å
237T69Low68.9Low127 Ų127146 Ų14678%0.77970%0.703SS**  trans-71.790.7178.8-55.20000108.5T235 P239T235-T237 PolarHBondContact O-N 3.22Å; T237-P239 WeakPolarHBondContact O-CD 3.31Å
238V74.9Confident70.4Confident120 Ų120141.3 Ų141.373%0.72769%0.685SS**PPolyproline II helixtrans-64.8116.9166.7-1780000106.6I236 E240I236-V238 VanDerWaalsContact C-N 3.32Å; I236-V238 PolarHBondContact O-N 2.97Å; V238-E240 PolarHBondContact O-N 3.49Å
239P77Confident71.4Confident106 Ų106137.3 Ų137.369%0.68867%0.669SS**PPolyproline II helixtrans-62.2137.8179.625.8-33.4000109.4T237T237-P239 WeakPolarHBondContact O-CD 3.31Å
240E78.8Confident73.1Confident175 Ų175131 Ų13182%0.81865%0.649SS**PPolyproline II helixtrans-58.3126.1176.5-170.7176.8173.300108.9V238 F242V238-E240 PolarHBondContact O-N 3.49Å; E240-F242 PolarHBondContact O-N 3.27Å
241P85.4Confident74.5Confident61 Ų61128.4 Ų128.440%0.39664%0.637SS.*PPolyproline II helixtrans-63.2129.7-174.423.8-33.1000110M245 I246P241-M245 HydrophobicContact CB-CB 4.16Å; P241-M245 HydrophobicContact CB-CE 3.61Å; P241-M245 HydrophobicContact CB-SD 4.39Å; P241-I246 HydrophobicContact CB-CG1 4.42Å; P241-I246 HydrophobicContact CG-CD1 4.36Å; P241-I246 HydrophobicContact CG-CG1 4.14Å
242F82.3Confident75.7Confident114 Ų114125.5 Ų125.550%0.562%0.622SS.*PPolyproline II helixtrans-54.8146.5-179.457-107.8000111.1E240 M244 M245 I246E240-F242 PolarHBondContact O-N 3.27Å; F242-M244 HydrophobicContact CD2-CB 3.6Å; F242-M244 HydrophobicContact CD2-CE 4.02Å; F242-M244 HydrophobicContact CD2-CG 4.32Å; F242-M244 HydrophobicContact CE2-CB 3.7Å; F242-M244 HydrophobicContact CE2-CE 3.32Å; F242-M244 HydrophobicContact CE2-CG 3.89Å; F242-M244 HydrophobicContact CE2-SD 4.45Å; F242-M244 HydrophobicContact CZ-CE 3.86Å; F242-M244 PolarHBondContact O-N 2.88Å; F242-M245 HydrophobicContact CD1-CE 3.62Å; F242-M245 HydrophobicContact CD1-CG 3.96Å; F242-M245 HydrophobicContact CD2-CB 4.08Å; F242-M245 HydrophobicContact CD2-CG 3.65Å; F242-M245 HydrophobicContact CE1-CE 3.66Å; F242-M245 HydrophobicContact CE1-CG 3.58Å; F242-M245 HydrophobicContact CE1-SD 4.07Å; F242-M245 HydrophobicContact CE2-CB 4Å; F242-M245 HydrophobicContact CE2-CG 3.25Å; F242-M245 HydrophobicContact CG-CE 4.24Å; F242-M245 HydrophobicContact CG-CG 4.01Å; F242-M245 HydrophobicContact CZ-CB 4.41Å; F242-M245 HydrophobicContact CZ-CE 4.32Å; F242-M245 HydrophobicContact CZ-CG 3.22Å; F242-M245 HydrophobicContact CZ-SD 4.18Å; F242-M245 WeakPolarHBondContact O-CA 3.35Å; F242-M245 WeakPolarHBondContact O-CB 3.29Å; F242-M245 PolarHBondContact O-N 3.33Å; F242-I246 PolarHBondContact O-N 2.98Å
243Q85.8Confident77.1Confident173 Ų173119.6 Ų119.681%0.80860%0.604SS**Hα-helixtrans-55.8-28-171.7-66.5-178.4-1.900113.7I246 R247Q243-I246 PolarHBondContact O-N 3.39Å; Q243-R247 WeakPolarHBondContact O-CB 3.22Å; Q243-R247 PolarHBondContact O-N 3.1Å
244M75.8Confident77.5Confident113 Ų113120.2 Ų120.256%0.55760%0.599SS**Hα-helixtrans-66.2-35.6171.7172.3179.276.500113.4F242 R247 E248F242-M244 HydrophobicContact CD2-CB 3.6Å; F242-M244 HydrophobicContact CD2-CE 4.02Å; F242-M244 HydrophobicContact CD2-CG 4.32Å; F242-M244 HydrophobicContact CE2-CB 3.7Å; F242-M244 HydrophobicContact CE2-CE 3.32Å; F242-M244 HydrophobicContact CE2-CG 3.89Å; F242-M244 HydrophobicContact CE2-SD 4.45Å; F242-M244 HydrophobicContact CZ-CE 3.86Å; F242-M244 PolarHBondContact O-N 2.88Å; M244-R247 PolarHBondContact O-N 3.48Å; M244-E248 WeakPolarHBondContact O-CG 3.38Å; M244-E248 PolarHBondContact O-N 2.95Å
245M83.3Confident77.8Confident80 Ų80120.3 Ų120.339%0.39460%0.603SS.*Hα-helixtrans-64.7-44.6170-73.2-154.6-93.700111P241 F242 R247 E248 Q249P241-M245 HydrophobicContact CB-CB 4.16Å; P241-M245 HydrophobicContact CB-CE 3.61Å; P241-M245 HydrophobicContact CB-SD 4.39Å; F242-M245 HydrophobicContact CD1-CE 3.62Å; F242-M245 HydrophobicContact CD1-CG 3.96Å; F242-M245 HydrophobicContact CD2-CB 4.08Å; F242-M245 HydrophobicContact CD2-CG 3.65Å; F242-M245 HydrophobicContact CE1-CE 3.66Å; F242-M245 HydrophobicContact CE1-CG 3.58Å; F242-M245 HydrophobicContact CE1-SD 4.07Å; F242-M245 HydrophobicContact CE2-CB 4Å; F242-M245 HydrophobicContact CE2-CG 3.25Å; F242-M245 HydrophobicContact CG-CE 4.24Å; F242-M245 HydrophobicContact CG-CG 4.01Å; F242-M245 HydrophobicContact CZ-CB 4.41Å; F242-M245 HydrophobicContact CZ-CE 4.32Å; F242-M245 HydrophobicContact CZ-CG 3.22Å; F242-M245 HydrophobicContact CZ-SD 4.18Å; F242-M245 WeakPolarHBondContact O-CA 3.35Å; F242-M245 WeakPolarHBondContact O-CB 3.29Å; F242-M245 PolarHBondContact O-N 3.33Å; M245-R247 PolarHBondContact O-N 3.17Å; M245-E248 PolarHBondContact O-N 3.41Å; M245-Q249 WeakPolarHBondContact O-CB 3.22Å; M245-Q249 PolarHBondContact O-N 3.07Å
246I85.9Confident77.8Confident62 Ų62122.1 Ų122.132%0.31860%0.604SS.*Hα-helixtrans-61.2-38.8178.6-57.5175.6000110.1P241 F242 Q243 K250P241-I246 HydrophobicContact CB-CG1 4.42Å; P241-I246 HydrophobicContact CG-CD1 4.36Å; P241-I246 HydrophobicContact CG-CG1 4.14Å; F242-I246 PolarHBondContact O-N 2.98Å; Q243-I246 PolarHBondContact O-N 3.39Å; I246-K250 HydrophobicContact CG2-CD 4.41Å; I246-K250 WeakPolarHBondContact O-CB 3.46Å; I246-K250 WeakPolarHBondContact O-CG 3.12Å; I246-K250 PolarHBondContact O-N 3.39Å
247R85.9Confident77.9Confident200 Ų200120.2 Ų120.276%0.75559%0.591SS**Hα-helixtrans-65.7-44.5174.1-174.6-179.7-177.7177.90.5112.3Q243 M244 M245 K251Q243-R247 WeakPolarHBondContact O-CB 3.22Å; Q243-R247 PolarHBondContact O-N 3.1Å; M244-R247 PolarHBondContact O-N 3.48Å; M245-R247 PolarHBondContact O-N 3.17Å; R247-K251 VanDerWaalsContact O-CB 3.31Å; R247-K251 WeakPolarHBondContact O-CB 3.39Å; R247-K251 PolarHBondContact O-N 2.97Å
248E85.3Confident77.8Confident96 Ų96116.3 Ų116.345%0.44957%0.569SS.*Hα-helixtrans-67.9-37.2177.5-77.6-175.4-170.200112.9M244 M245 K251 K252M244-E248 WeakPolarHBondContact O-CG 3.38Å; M244-E248 PolarHBondContact O-N 2.95Å; M245-E248 PolarHBondContact O-N 3.41Å; E248-K251 PolarHBondContact O-N 3.24Å; E248-K252 WeakPolarHBondContact O-CB 3.4Å; E248-K252 WeakPolarHBondContact O-CG 3.29Å; E248-K252 PolarHBondContact O-N 3.31Å
249Q82.6Confident77.4Confident119 Ų119119 Ų11956%0.55657%0.571SS**Hα-helixtrans-70.4-41.8178.2-170.4162.7-23.800111.2M245 K251 K252 E253M245-Q249 WeakPolarHBondContact O-CB 3.22Å; M245-Q249 PolarHBondContact O-N 3.07Å; Q249-K251 VanDerWaalsContact C-N 3.35Å; Q249-K251 PolarHBondContact O-N 3.12Å; Q249-K252 CarbonylContact O-C 3.58Å; Q249-K252 WeakPolarHBondContact O-CB 3.42Å; Q249-K252 PolarHBondContact O-N 3.35Å; Q249-K252 VanDerWaalsContact O-N 3.16Å; Q249-E253 WeakPolarHBondContact O-CG 3.32Å; Q249-E253 PolarHBondContact O-N 2.89Å
250K82.6Confident77Confident121 Ų121117.3 Ų117.353%0.52656%0.561SS.*Hα-helixtrans-60.2-42.4169-75178.5178.5-177.50112.4I246 K252 E253 E254I246-K250 HydrophobicContact CG2-CD 4.41Å; I246-K250 WeakPolarHBondContact O-CB 3.46Å; I246-K250 WeakPolarHBondContact O-CG 3.12Å; I246-K250 PolarHBondContact O-N 3.39Å; K250-K252 VanDerWaalsContact C-N 3.31Å; K250-K252 PolarHBondContact O-N 3.04Å; K250-E253 PolarHBondContact O-N 3.41Å; K250-E254 WeakPolarHBondContact O-CB 3.45Å; K250-E254 VanDerWaalsContact O-CG 3.29Å; K250-E254 WeakPolarHBondContact O-CG 3.26Å; K250-E254 PolarHBondContact O-N 2.86Å
251K81.4Confident76.9Confident149 Ų149113.1 Ų113.165%0.64854%0.544SS*.Hα-helixtrans-62.4-37.6174.3-174.1-176.7177-171.20111.8R247 E248 Q249 S255R247-K251 VanDerWaalsContact O-CB 3.31Å; R247-K251 WeakPolarHBondContact O-CB 3.39Å; R247-K251 PolarHBondContact O-N 2.97Å; E248-K251 PolarHBondContact O-N 3.24Å; Q249-K251 VanDerWaalsContact C-N 3.35Å; Q249-K251 PolarHBondContact O-N 3.12Å; K251-S255 WeakPolarHBondContact O-CB 3.39Å; K251-S255 PolarHBondContact O-N 3.25Å; K251-S255 PolarHBondContact O-OG 3.36Å
252K78.5Confident76.4Confident127 Ų127114.8 Ų114.855%0.55255%0.549SS*.Hα-helixtrans-65.9-49.2173.4-78.3172.7179.81720111E248 Q249 K250 E254 S255 M256E248-K252 WeakPolarHBondContact O-CB 3.4Å; E248-K252 WeakPolarHBondContact O-CG 3.29Å; E248-K252 PolarHBondContact O-N 3.31Å; Q249-K252 CarbonylContact O-C 3.58Å; Q249-K252 WeakPolarHBondContact O-CB 3.42Å; Q249-K252 PolarHBondContact O-N 3.35Å; Q249-K252 VanDerWaalsContact O-N 3.16Å; K250-K252 VanDerWaalsContact C-N 3.31Å; K250-K252 PolarHBondContact O-N 3.04Å; K252-E254 VanDerWaalsContact C-N 3.31Å; K252-E254 PolarHBondContact O-N 3.46Å; K252-S255 WeakPolarHBondContact CA-OG 3.31Å; K252-S255 CarbonylContact O-C 3.59Å; K252-S255 PolarHBondContact O-N 3.02Å; K252-S255 PolarHBondContact O-OG 2.9Å; K252-M256 WeakPolarHBondContact O-CB 3.2Å; K252-M256 WeakPolarHBondContact O-CG 3.38Å; K252-M256 PolarHBondContact O-N 3.42Å
253E76.9Confident76.3Confident104 Ų104114.1 Ų114.149%0.48655%0.547SS..Hα-helixtrans-57.1-41.9174.3-72.6167.2-16300112.2Q249 K250 M256 K257Q249-E253 WeakPolarHBondContact O-CG 3.32Å; Q249-E253 PolarHBondContact O-N 2.89Å; K250-E253 PolarHBondContact O-N 3.41Å; E253-M256 PolarHBondContact O-N 2.84Å; E253-K257 WeakPolarHBondContact O-CG 3.35Å; E253-K257 PolarHBondContact O-N 3.27Å
254E70.3Confident76Confident120 Ų120111.7 Ų111.756%0.56154%0.537SS*.Hα-helixtrans-65.4-35.4174-74.5168.5-177.600112.9K250 K252K250-E254 WeakPolarHBondContact O-CB 3.45Å; K250-E254 VanDerWaalsContact O-CG 3.29Å; K250-E254 WeakPolarHBondContact O-CG 3.26Å; K250-E254 PolarHBondContact O-N 2.86Å; K252-E254 VanDerWaalsContact C-N 3.31Å; K252-E254 PolarHBondContact O-N 3.46Å
255S63.4Low76.4Confident92 Ų92111 Ų11164%0.64354%0.54SS*.Hα-helixtrans-78.1-22.4173.5710000114.3K251 K252K251-S255 WeakPolarHBondContact O-CB 3.39Å; K251-S255 PolarHBondContact O-N 3.25Å; K251-S255 PolarHBondContact O-OG 3.36Å; K252-S255 WeakPolarHBondContact CA-OG 3.31Å; K252-S255 CarbonylContact O-C 3.59Å; K252-S255 PolarHBondContact O-N 3.02Å; K252-S255 PolarHBondContact O-OG 2.9Å
256M64Low76.2Confident155 Ų155112.1 Ų112.176%0.76454%0.543SS*.Hα-helixtrans-84.4-18.7177.2-72.7-78.9-170.700112.4K252 E253 S258K252-M256 WeakPolarHBondContact O-CB 3.2Å; K252-M256 WeakPolarHBondContact O-CG 3.38Å; K252-M256 PolarHBondContact O-N 3.42Å; E253-M256 PolarHBondContact O-N 2.84Å; M256-S258 PolarHBondContact O-N 2.96Å
257K67.6Low75.9Confident111 Ų111114.4 Ų114.448%0.48355%0.551SS.*SBendtrans-59112166.8-74.3166-165.9167.60108E253 I262E253-K257 WeakPolarHBondContact O-CG 3.35Å; E253-K257 PolarHBondContact O-N 3.27Å; K257-I262 HydrophobicContact CB-CD1 4.2Å; K257-I262 HydrophobicContact CB-CG1 4.15Å
258S66.8Low75.7Confident45 Ų45110.6 Ų110.632%0.31555%0.545SS..  trans-61.3150-179.774.70000109.2M256 S260 D261 I262M256-S258 PolarHBondContact O-N 2.96Å; S258-S260 WeakPolarHBondContact CB-OG 3.45Å; S258-S260 PolarHBondContact O-N 3.35Å; S258-S260 VanDerWaalsContact O-N 3.1Å; S258-S260 PolarHBondContact OG-OG 2.82Å; S258-D261 WeakPolarHBondContact CB-OD2 3.23Å; S258-D261 PolarHBondContact N-OD2 3.48Å; S258-D261 VanDerWaalsContact N-OD2 3.13Å; S258-D261 PolarHBondContact O-N 3.43Å; S258-D261 PolarHBondContact OG-N 2.83Å; S258-D261 PolarHBondContact OG-OD2 2.85Å; S258-I262 PolarHBondContact O-N 2.89Å
259K66.3Low75.3Confident177 Ų177110.1 Ų110.177%0.7755%0.545SS*.Hα-helixtrans-55.3-33177.9-66.8178.2180175.10111.3I262 E263K259-I262 PolarHBondContact O-N 2.91Å; K259-E263 WeakPolarHBondContact O-CB 3.32Å; K259-E263 WeakPolarHBondContact O-CG 3.32Å; K259-E263 PolarHBondContact O-N 3.35Å
260S68.9Low75.1Confident70 Ų70109 Ų10949%0.4954%0.539SS..Hα-helixtrans-58.8-42.1171.422.50000114.1S258 E263 M264S258-S260 WeakPolarHBondContact CB-OG 3.45Å; S258-S260 PolarHBondContact O-N 3.35Å; S258-S260 VanDerWaalsContact O-N 3.1Å; S258-S260 PolarHBondContact OG-OG 2.82Å; S260-E263 PolarHBondContact O-N 2.97Å; S260-M264 WeakPolarHBondContact O-CB 3.18Å; S260-M264 WeakPolarHBondContact O-CG 3.42Å; S260-M264 PolarHBondContact O-N 3.42Å
261D75.8Confident74.8Confident87 Ų87109.6 Ų109.647%0.46554%0.541SS..Hα-helixtrans-68.4-41.4179.8-58.9-47.4000111.2S258 M264 V265S258-D261 WeakPolarHBondContact CB-OD2 3.23Å; S258-D261 PolarHBondContact N-OD2 3.48Å; S258-D261 VanDerWaalsContact N-OD2 3.13Å; S258-D261 PolarHBondContact O-N 3.43Å; S258-D261 PolarHBondContact OG-N 2.83Å; S258-D261 PolarHBondContact OG-OD2 2.85Å; D261-M264 PolarHBondContact O-N 3.06Å; D261-V265 WeakPolarHBondContact O-CG2 3.38Å; D261-V265 PolarHBondContact O-N 3.1Å
262I75.3Confident74.3Confident96 Ų96109.2 Ų109.249%0.49254%0.542SS..Hα-helixtrans-65-42.7176.8-60171.5000110K257 S258 K259 H266K257-I262 HydrophobicContact CB-CD1 4.2Å; K257-I262 HydrophobicContact CB-CG1 4.15Å; S258-I262 PolarHBondContact O-N 2.89Å; K259-I262 PolarHBondContact O-N 2.91Å; I262-H266 VanDerWaalsContact O-CB 3.31Å; I262-H266 WeakPolarHBondContact O-CB 3.39Å; I262-H266 PolarHBondContact O-N 3.06Å
263E79.3Confident74.1Confident99 Ų99108.9 Ų108.946%0.46354%0.542SS..Hα-helixtrans-64.4-38.3173.4-81-172.6-147.600113.3K259 S260 H266 K267K259-E263 WeakPolarHBondContact O-CB 3.32Å; K259-E263 WeakPolarHBondContact O-CG 3.32Å; K259-E263 PolarHBondContact O-N 3.35Å; S260-E263 PolarHBondContact O-N 2.97Å; E263-H266 PolarHBondContact O-N 2.7Å; E263-K267 WeakPolarHBondContact O-CB 3.49Å; E263-K267 WeakPolarHBondContact O-CD 3.48Å; E263-K267 WeakPolarHBondContact O-CG 3.26Å; E263-K267 PolarHBondContact O-N 3.37Å; E263-K267 IonicContact OE2-NZ 2.82Å; E263-K267 PolarHBondContact OE2-NZ 3.47Å
264M80.4Confident73.9Confident122 Ų122108.7 Ų108.760%0.60154%0.541SS*.Hα-helixtrans-63.1-47.9176.7-77.9-85.1-76.700111.1S260 D261 H266 K267 L268S260-M264 WeakPolarHBondContact O-CB 3.18Å; S260-M264 WeakPolarHBondContact O-CG 3.42Å; S260-M264 PolarHBondContact O-N 3.42Å; D261-M264 PolarHBondContact O-N 3.06Å; M264-H266 PolarHBondContact O-N 3.42Å; M264-K267 PolarHBondContact O-N 3.05Å; M264-L268 PolarHBondContact O-N 2.95Å
265V83.4Confident73.8Confident100 Ų100107.9 Ų107.961%0.60654%0.541SS*.Hα-helixtrans-60.7-44.2175.5171.70000111D261 L268 L269D261-V265 WeakPolarHBondContact O-CG2 3.38Å; D261-V265 PolarHBondContact O-N 3.1Å; V265-L268 WeakPolarHBondContact O-CB 3.5Å; V265-L268 PolarHBondContact O-N 3.07Å; V265-L269 PolarHBondContact O-N 3.39Å
266H79.3Confident74.1Confident102 Ų102106.8 Ų106.847%0.47253%0.531SS..Hα-helixtrans-66.7-36.8178.5-177.5-126.2000112.9I262 E263 M264 L269 K270I262-H266 VanDerWaalsContact O-CB 3.31Å; I262-H266 WeakPolarHBondContact O-CB 3.39Å; I262-H266 PolarHBondContact O-N 3.06Å; E263-H266 PolarHBondContact O-N 2.7Å; M264-H266 PolarHBondContact O-N 3.42Å; H266-L269 PolarHBondContact O-N 2.92Å; H266-K270 WeakPolarHBondContact O-CG 3.25Å; H266-K270 PolarHBondContact O-N 3.37Å
267K80.7Confident74.2Confident111 Ų111104.9 Ų104.948%0.48352%0.521SS..Hα-helixtrans-67.4-35.7173.3-74163.2-169.3161.40112E263 M264 K271E263-K267 WeakPolarHBondContact O-CB 3.49Å; E263-K267 WeakPolarHBondContact O-CD 3.48Å; E263-K267 WeakPolarHBondContact O-CG 3.26Å; E263-K267 PolarHBondContact O-N 3.37Å; E263-K267 IonicContact OE2-NZ 2.82Å; E263-K267 PolarHBondContact OE2-NZ 3.47Å; M264-K267 PolarHBondContact O-N 3.05Å; K267-K271 WeakPolarHBondContact O-CG 3.28Å; K267-K271 PolarHBondContact O-N 2.92Å
268L81.3Confident74Confident120 Ų120105.1 Ų105.163%0.62854%0.535SS*.Hα-helixtrans-66.9-44.9173.1-98.9148.3000112M264 V265 K271 Q272M264-L268 PolarHBondContact O-N 2.95Å; V265-L268 WeakPolarHBondContact O-CB 3.5Å; V265-L268 PolarHBondContact O-N 3.07Å; L268-K271 PolarHBondContact O-N 2.91Å; L268-Q272 PolarHBondContact O-N 3.22Å
269L77.8Confident74Confident86 Ų86110.8 Ų110.845%0.4555%0.554SS.*Hα-helixtrans-61.6-46.1178.1-158.377.9000111.5V265 H266 K271 Q272 E273V265-L269 PolarHBondContact O-N 3.39Å; H266-L269 PolarHBondContact O-N 2.92Å; L269-K271 PolarHBondContact O-N 2.97Å; L269-Q272 WeakPolarHBondContact O-CB 3.22Å; L269-Q272 PolarHBondContact O-N 3.29Å; L269-Q272 VanDerWaalsContact O-N 3.16Å; L269-E273 PolarHBondContact O-N 3.36Å
270K77.9Confident74.6Confident95 Ų95108.7 Ų108.741%0.41355%0.545SS..Hα-helixtrans-58.1-44.8176.4-80.1-171.5169-165.80113.3H266 Q272 E273 E274H266-K270 WeakPolarHBondContact O-CG 3.25Å; H266-K270 PolarHBondContact O-N 3.37Å; K270-Q272 VanDerWaalsContact C-N 3.28Å; K270-Q272 PolarHBondContact O-N 3.45Å; K270-E273 CarbonylContact O-C 3.58Å; K270-E273 PolarHBondContact O-N 3.46Å; K270-E273 VanDerWaalsContact O-N 3.1Å; K270-E274 WeakPolarHBondContact O-CB 3.45Å; K270-E274 WeakPolarHBondContact O-CG 3.47Å; K270-E274 PolarHBondContact O-N 3.5Å
271K76.5Confident75Confident134 Ų134114.5 Ų114.558%0.58356%0.561SS**Hα-helixtrans-59.6-40.4176.5-73.8177.4177.3-170.80112.2K267 L268 L269 E273 E274 D275K267-K271 WeakPolarHBondContact O-CG 3.28Å; K267-K271 PolarHBondContact O-N 2.92Å; L268-K271 PolarHBondContact O-N 2.91Å; L269-K271 PolarHBondContact O-N 2.97Å; K271-E273 VanDerWaalsContact C-N 3.29Å; K271-E273 PolarHBondContact O-N 3.05Å; K271-E274 PolarHBondContact O-N 2.92Å; K271-D275 PolarHBondContact O-N 2.91Å
272Q70.9Confident75.1Confident140 Ų140119.3 Ų119.365%0.65458%0.578SS**Hα-helixtrans-65.8-31176.9-169.5177.110.900112.8L268 L269 K270 P276L268-Q272 PolarHBondContact O-N 3.22Å; L269-Q272 WeakPolarHBondContact O-CB 3.22Å; L269-Q272 PolarHBondContact O-N 3.29Å; L269-Q272 VanDerWaalsContact O-N 3.16Å; K270-Q272 VanDerWaalsContact C-N 3.28Å; K270-Q272 PolarHBondContact O-N 3.45Å; Q272-P276 VanDerWaalsContact O-CD 3.26Å; Q272-P276 WeakPolarHBondContact O-CD 3.41Å
273E74.3Confident75.4Confident121 Ų121124.8 Ų124.857%0.56559%0.593SS**Hα-helixtrans-79.9-35.4173.9-68.8176.517000112.5L269 K270 K271 P276 E277L269-E273 PolarHBondContact O-N 3.36Å; K270-E273 CarbonylContact O-C 3.58Å; K270-E273 PolarHBondContact O-N 3.46Å; K270-E273 VanDerWaalsContact O-N 3.1Å; K271-E273 VanDerWaalsContact C-N 3.29Å; K271-E273 PolarHBondContact O-N 3.05Å; E273-P276 WeakPolarHBondContact O-CD 3.31Å; E273-P276 VanDerWaalsContact O-CG 3.23Å; E273-P276 WeakPolarHBondContact O-CG 3.43Å; E273-E277 WeakPolarHBondContact O-CG 3.49Å
274E72.8Confident75.6Confident99 Ų99124 Ų12446%0.46360%0.604SS.*Hα-helixtrans-71.7-35.7-179.8-72.7161.8-167.500112.9K270 K271 E277 C278K270-E274 WeakPolarHBondContact O-CB 3.45Å; K270-E274 WeakPolarHBondContact O-CG 3.47Å; K270-E274 PolarHBondContact O-N 3.5Å; K271-E274 PolarHBondContact O-N 2.92Å; E274-E277 PolarHBondContact O-N 2.79Å; E274-C278 PolarHBondContact O-N 3.44Å; E274-C278 PolarHBondContact O-SG 3.48Å
275D68.3Low75.8Confident103 Ų103125.5 Ų125.555%0.55161%0.614SS**Hα-helixtrans-54.5-39.2179.2-83.6-26.9000116.3K271 K279K271-D275 PolarHBondContact O-N 2.91Å; D275-K279 WeakPolarHBondContact O-CD 3.18Å; D275-K279 VanDerWaalsContact O-CE 3.25Å; D275-K279 WeakPolarHBondContact O-CE 3.43Å; D275-K279 PolarHBondContact O-NZ 2.97Å
276P67.9Low75.9Confident69 Ų69126.4 Ų126.445%0.44862%0.622SS.*Hα-helixtrans-81.4-21.5170.330-36.7000113.9Q272 E273Q272-P276 VanDerWaalsContact O-CD 3.26Å; Q272-P276 WeakPolarHBondContact O-CD 3.41Å; E273-P276 WeakPolarHBondContact O-CD 3.31Å; E273-P276 VanDerWaalsContact O-CG 3.23Å; E273-P276 WeakPolarHBondContact O-CG 3.43Å
277E67.3Low76Confident115 Ų115125.7 Ų125.754%0.53763%0.625SS.*Hα-helixtrans-79.2-40.7179.9-59.9-138123.300112.4E273 E274 K279 K280E273-E277 WeakPolarHBondContact O-CG 3.49Å; E274-E277 PolarHBondContact O-N 2.79Å; E277-K279 PolarHBondContact O-N 3.21Å; E277-K280 WeakPolarHBondContact O-CB 3.37Å; E277-K280 PolarHBondContact O-N 3.35Å; E277-K280 IonicContact OE1-NZ 3.73Å; E277-K280 PolarHBondContact OE1-NZ 2.65Å
278C62.3Low76.3Confident117 Ų117124.4 Ų124.479%0.79163%0.627SS**THydrogen-bonded Turntrans-59.6-14.4174.1-70.10000113.8E274E274-C278 PolarHBondContact O-N 3.44Å; E274-C278 PolarHBondContact O-SG 3.48Å
279K68.5Low76.1Confident163 Ų163122.2 Ų122.271%0.70963%0.627SS**THydrogen-bonded Turntrans-90.1-12.3175.7-65.7167.8-172.4154.80113.2D275 E277 K281D275-K279 WeakPolarHBondContact O-CD 3.18Å; D275-K279 VanDerWaalsContact O-CE 3.25Å; D275-K279 WeakPolarHBondContact O-CE 3.43Å; D275-K279 PolarHBondContact O-NZ 2.97Å; E277-K279 PolarHBondContact O-N 3.21Å; K279-K281 PolarHBondContact O-N 2.97Å
280K78.3Confident76.2Confident133 Ų133121.6 Ų121.658%0.57863%0.63SS**SBendtrans-80.5109.6178.2-61.2172.4-170.3167.10109.6E277 F282E277-K280 WeakPolarHBondContact O-CB 3.37Å; E277-K280 PolarHBondContact O-N 3.35Å; E277-K280 IonicContact OE1-NZ 3.73Å; E277-K280 PolarHBondContact OE1-NZ 2.65Å; K280-F282 PolarHBondContact O-N 3.23Å
281K77.7Confident76.3Confident192 Ų192121.9 Ų121.984%0.83564%0.639SS**  trans-68.5106170.3-66.1-178.7-178178.70108.9K279 R283K279-K281 PolarHBondContact O-N 2.97Å; K281-R283 PolarHBondContact O-N 3.4Å
282F77.9Confident76.4Confident188 Ų188122.7 Ų122.783%0.82564%0.643SS**  trans-52.8125.3-177.5-178.2-99.1000111.7K280K280-F282 PolarHBondContact O-N 3.23Å
283R81.1Confident76.9Confident211 Ų211121.2 Ų121.280%0.79664%0.639SS**  trans-128.3136.4170-66.2-62.4-172.7174.51.2107K281K281-R283 PolarHBondContact O-N 3.4Å
284A83.4Confident77.3Confident84 Ų84120.9 Ų120.969%0.69465%0.648SS**PPolyproline II helixtrans-64.9136.617600000110
285N83.4Confident77.9Confident153 Ų153120 Ų12082%0.81865%0.645SS**PPolyproline II helixtrans-63.9137.1170.9-68.6-14.4000109
286P86.1Confident78.8Confident118 Ų118122.8 Ų122.877%0.76665%0.649SS**PPolyproline II helixtrans-62.3151.8177.527.4-34.6000110.8
287V81.5Confident79.7Confident88 Ų88126.3 Ų126.353%0.53366%0.66SS.*PPolyproline II helixtrans-58.7130.5-179.5-179.30000109.7V291 F292V287-V291 HydrophobicContact CG1-CB 3.72Å; V287-V291 HydrophobicContact CG1-CG1 3.98Å; V287-V291 HydrophobicContact CG1-CG2 3.67Å; V287-F292 HydrophobicContact CB-CE2 4.06Å; V287-F292 HydrophobicContact CB-CZ 4.2Å; V287-F292 HydrophobicContact CG1-CE2 4.12Å; V287-F292 HydrophobicContact CG1-CZ 4.37Å
288P86.9Confident80.7Confident83 Ų83125.1 Ų125.154%0.53966%0.657SS.*PPolyproline II helixtrans-55.7140.8-179.4-28.435.9000113.3S290 V291P288-S290 PolarHBondContact O-N 3.33Å; P288-V291 WeakPolarHBondContact O-CB 3.39Å; P288-V291 PolarHBondContact O-N 2.79Å
289A78.4Confident82Confident74 Ų74123.6 Ų123.661%0.61264%0.64SS**G310 helixtrans-54.2-29.1-17800000113.8V291 F292A289-V291 PolarHBondContact O-N 2.97Å; A289-F292 PolarHBondContact O-N 3.37Å
290S78.5Confident83.2Confident74 Ų74118 Ų11852%0.51762%0.62SS.*G310 helixtrans-61.3-20176.752.40000114.7P288 F292P288-S290 PolarHBondContact O-N 3.33Å; S290-F292 VanDerWaalsContact C-N 3.33Å
291V80.6Confident84Confident101 Ų101117.8 Ų117.861%0.61262%0.619SS**G310 helixtrans-76.1-23.9175.1-177.30000111.6V287 P288 A289V287-V291 HydrophobicContact CG1-CB 3.72Å; V287-V291 HydrophobicContact CG1-CG1 3.98Å; V287-V291 HydrophobicContact CG1-CG2 3.67Å; P288-V291 WeakPolarHBondContact O-CB 3.39Å; P288-V291 PolarHBondContact O-N 2.79Å; A289-V291 PolarHBondContact O-N 2.97Å
292F78.9Confident84.7Confident151 Ų151113.6 Ų113.666%0.66260%0.602SS**SBendtrans-91.9-6.3-178.9-59-79.6000113.7V287 A289 S290V287-F292 HydrophobicContact CB-CE2 4.06Å; V287-F292 HydrophobicContact CB-CZ 4.2Å; V287-F292 HydrophobicContact CG1-CE2 4.12Å; V287-F292 HydrophobicContact CG1-CZ 4.37Å; A289-F292 PolarHBondContact O-N 3.37Å; S290-F292 VanDerWaalsContact C-N 3.33Å
293L81.8Confident85.4Confident108 Ų108110.5 Ų110.557%0.56559%0.588SS**SBendtrans-101.9121.3-178.4-63.4179.7000111.5L295L293-L295 VanDerWaalsContact C-N 3.27Å; L293-L295 HydrophobicContact CB-CD2 4.19Å; L293-L295 HydrophobicContact CB-CG 4.25Å; L293-L295 PolarHBondContact O-N 3.48Å
294P81.8Confident86Confident115 Ų115104.6 Ų104.675%0.74757%0.57SS**  trans-71.467.6175.6-22.936.4000114.9Y296P294-Y296 PolarHBondContact O-N 2.81Å
295L85.4Confident86.6Confident79 Ų79105.2 Ų105.241%0.41456%0.558SS.*THydrogen-bonded Turntrans-635.5-174.8-62.1174.5000116.4L293 H297 L299L293-L295 VanDerWaalsContact C-N 3.27Å; L293-L295 HydrophobicContact CB-CD2 4.19Å; L293-L295 HydrophobicContact CB-CG 4.25Å; L293-L295 PolarHBondContact O-N 3.48Å; L295-H297 PolarHBondContact O-N 2.93Å; L295-L299 HydrophobicContact CB-CD1 4.39Å; L295-L299 WeakPolarHBondContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CG 3.4Å; L295-L299 PolarHBondContact O-N 3.49Å; L295-L299 VanDerWaalsContact O-N 3.09Å
296Y87.3Confident87.1Confident162 Ų162104.5 Ų104.564%0.63554%0.544SS*.Hα-helixtrans-62.6-43.4-174.3178.7-101.7000112.8P294 L299 V300P294-Y296 PolarHBondContact O-N 2.81Å; Y296-L299 PolarHBondContact O-N 3.27Å; Y296-V300 HydrophobicContact CD1-CG2 4.28Å; Y296-V300 HydrophobicContact CD2-CG2 4.48Å; Y296-V300 HydrophobicContact CE1-CG2 3.82Å; Y296-V300 HydrophobicContact CE2-CG2 4.05Å; Y296-V300 WeakPolarHBondContact O-CG2 3.44Å; Y296-V300 PolarHBondContact O-N 2.94Å
297H87.6Confident87.5Confident144 Ų144106.9 Ų106.967%0.66754%0.538SS*.Hα-helixtrans-66.4-40.5-177.9-68.6-73.3000112.2L295 V300 K301L295-H297 PolarHBondContact O-N 2.93Å; H297-V300 PolarHBondContact O-N 3.11Å; H297-K301 WeakPolarHBondContact O-CB 3.4Å; H297-K301 PolarHBondContact O-N 3.41Å
298D87.4Confident88.1Confident90 Ų90109.5 Ų109.548%0.48154%0.538SS..Hα-helixtrans-66-41.7176.1-58-40.4000111.6V300 K301 Q302D298-V300 VanDerWaalsContact C-N 3.31Å; D298-V300 PolarHBondContact O-N 3.48Å; D298-K301 PolarHBondContact O-N 3.16Å; D298-Q302 WeakPolarHBondContact O-CB 3.28Å; D298-Q302 WeakPolarHBondContact O-CG 3.47Å; D298-Q302 PolarHBondContact O-N 3.43Å
299L90.3Very high88.5Confident84 Ų84107.8 Ų107.844%0.4453%0.528SS..Hα-helixtrans-62.4-35.7174.4-78.2166.8000112.8L295 Y296 K303L295-L299 HydrophobicContact CB-CD1 4.39Å; L295-L299 WeakPolarHBondContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CG 3.4Å; L295-L299 PolarHBondContact O-N 3.49Å; L295-L299 VanDerWaalsContact O-N 3.09Å; Y296-L299 PolarHBondContact O-N 3.27Å; L299-K303 WeakPolarHBondContact O-CB 3.43Å; L299-K303 WeakPolarHBondContact O-CD 3.35Å; L299-K303 WeakPolarHBondContact O-CG 3.36Å; L299-K303 PolarHBondContact O-N 3.06Å
300V93.8Very high89.3Confident47 Ų47109.6 Ų109.629%0.28553%0.527SS..Hα-helixtrans-70.1-47.4174.1170.40000110.4Y296 H297 D298 Q302 K303 E304Y296-V300 HydrophobicContact CD1-CG2 4.28Å; Y296-V300 HydrophobicContact CD2-CG2 4.48Å; Y296-V300 HydrophobicContact CE1-CG2 3.82Å; Y296-V300 HydrophobicContact CE2-CG2 4.05Å; Y296-V300 WeakPolarHBondContact O-CG2 3.44Å; Y296-V300 PolarHBondContact O-N 2.94Å; H297-V300 PolarHBondContact O-N 3.11Å; D298-V300 VanDerWaalsContact C-N 3.31Å; D298-V300 PolarHBondContact O-N 3.48Å; V300-Q302 PolarHBondContact O-N 3.42Å; V300-K303 WeakPolarHBondContact O-CB 3.48Å; V300-K303 PolarHBondContact O-N 3.49Å; V300-K303 VanDerWaalsContact O-N 3.09Å; V300-E304 PolarHBondContact O-N 2.94Å
301K93.6Very high90.1Very high128 Ų128112.1 Ų112.156%0.55753%0.529SS*.Hα-helixtrans-57.2-49.5178.3-173.5178.8175.9-174.60112H297 D298 K303 E304 E305H297-K301 WeakPolarHBondContact O-CB 3.4Å; H297-K301 PolarHBondContact O-N 3.41Å; D298-K301 PolarHBondContact O-N 3.16Å; K301-K303 VanDerWaalsContact C-N 3.29Å; K301-K303 PolarHBondContact O-N 2.95Å; K301-E304 PolarHBondContact O-N 2.75Å; K301-E304 VanDerWaalsContact O-N 3.11Å; K301-E305 WeakPolarHBondContact CE-OE1 3.46Å; K301-E305 WeakPolarHBondContact CG-OE1 3.46Å; K301-E305 WeakPolarHBondContact O-CG 3.27Å; K301-E305 PolarHBondContact O-N 3.31Å
302Q92.8Very high90.8Very high104 Ų104112.9 Ų112.949%0.48653%0.525SS..Hα-helixtrans-63.6-29.7175.9-71-179.75.200113.7D298 V300 R306D298-Q302 WeakPolarHBondContact O-CB 3.28Å; D298-Q302 WeakPolarHBondContact O-CG 3.47Å; D298-Q302 PolarHBondContact O-N 3.43Å; V300-Q302 PolarHBondContact O-N 3.42Å; Q302-R306 WeakPolarHBondContact O-CB 3.34Å; Q302-R306 WeakPolarHBondContact O-CG 3.23Å; Q302-R306 PolarHBondContact O-N 2.8Å; Q302-R306 PolarHBondContact O-NE 3.32Å; Q302-R306 VanDerWaalsContact O-NE 3.1Å
303K93.1Very high91.6Very high122 Ų122110.9 Ų110.953%0.5352%0.517SS..Hα-helixtrans-72.4-38173.4-77.9169.7-175.6176.50111.2L299 V300 K301 R307L299-K303 WeakPolarHBondContact O-CB 3.43Å; L299-K303 WeakPolarHBondContact O-CD 3.35Å; L299-K303 WeakPolarHBondContact O-CG 3.36Å; L299-K303 PolarHBondContact O-N 3.06Å; V300-K303 WeakPolarHBondContact O-CB 3.48Å; V300-K303 PolarHBondContact O-N 3.49Å; V300-K303 VanDerWaalsContact O-N 3.09Å; K301-K303 VanDerWaalsContact C-N 3.29Å; K301-K303 PolarHBondContact O-N 2.95Å; K303-R307 WeakPolarHBondContact O-CB 3.41Å; K303-R307 PolarHBondContact O-N 2.81Å
304E94.4Very high92.2Very high88 Ų88110.4 Ų110.441%0.41151%0.514SS..Hα-helixtrans-67.3-44.4174.2-75.2-162.9-159.600112.7V300 K301 R306 R307 R308V300-E304 PolarHBondContact O-N 2.94Å; K301-E304 PolarHBondContact O-N 2.75Å; K301-E304 VanDerWaalsContact O-N 3.11Å; E304-R306 VanDerWaalsContact C-N 3.34Å; E304-R306 PolarHBondContact O-N 3.16Å; E304-R307 CarbonylContact O-C 3.6Å; E304-R307 WeakPolarHBondContact O-CA 3.5Å; E304-R307 WeakPolarHBondContact O-CB 3.09Å; E304-R307 PolarHBondContact O-N 3.15Å; E304-R308 VanDerWaalsContact O-CG 3.3Å; E304-R308 WeakPolarHBondContact O-CG 3.27Å; E304-R308 PolarHBondContact O-N 2.88Å; E304-R308 IonicContact OE2-CZ 3.1Å; E304-R308 IonicContact OE2-NE 2.68Å; E304-R308 IonicContact OE2-NH2 3.29Å; E304-R308 PolarHBondContact OE2-NH2 3.38Å
305E94.8Very high92.8Very high96 Ų96111.6 Ų111.645%0.44951%0.508SS..Hα-helixtrans-61.1-42.3177.4-72.1165.4177.800111.4K301 R307 R308 S309K301-E305 WeakPolarHBondContact CE-OE1 3.46Å; K301-E305 WeakPolarHBondContact CG-OE1 3.46Å; K301-E305 WeakPolarHBondContact O-CG 3.27Å; K301-E305 PolarHBondContact O-N 3.31Å; E305-R307 PolarHBondContact O-N 2.94Å; E305-R308 PolarHBondContact O-N 3.26Å; E305-S309 PolarHBondContact O-N 3.36Å; E305-S309 PolarHBondContact O-OG 3.44Å
306R93.7Very high93.2Very high139 Ų139113.9 Ų113.953%0.52552%0.517SS..Hα-helixtrans-61.7-40.2169.5-76.3-177.2-70.8152.8-15.6112.8Q302 E304 R308 S309 L310Q302-R306 WeakPolarHBondContact O-CB 3.34Å; Q302-R306 WeakPolarHBondContact O-CG 3.23Å; Q302-R306 PolarHBondContact O-N 2.8Å; Q302-R306 PolarHBondContact O-NE 3.32Å; Q302-R306 VanDerWaalsContact O-NE 3.1Å; E304-R306 VanDerWaalsContact C-N 3.34Å; E304-R306 PolarHBondContact O-N 3.16Å; R306-R308 VanDerWaalsContact C-N 3.34Å; R306-R308 PolarHBondContact O-N 3.23Å; R306-S309 WeakPolarHBondContact CA-OG 3.27Å; R306-S309 PolarHBondContact O-OG 2.83Å; R306-L310 WeakPolarHBondContact O-CB 3.4Å; R306-L310 VanDerWaalsContact O-CG 3.25Å; R306-L310 WeakPolarHBondContact O-CG 3.43Å; R306-L310 PolarHBondContact O-N 3.24Å
307R94.6Very high93.5Very high168 Ų168109 Ų10963%0.63451%0.51SS*.Hα-helixtrans-67.2-32.1176.3-171.4-178.8-177.6-156.72.4112.7K303 E304 E305 K311K303-R307 WeakPolarHBondContact O-CB 3.41Å; K303-R307 PolarHBondContact O-N 2.81Å; E304-R307 CarbonylContact O-C 3.6Å; E304-R307 WeakPolarHBondContact O-CA 3.5Å; E304-R307 WeakPolarHBondContact O-CB 3.09Å; E304-R307 PolarHBondContact O-N 3.15Å; E305-R307 PolarHBondContact O-N 2.94Å; R307-K311 WeakPolarHBondContact O-CD 3.32Å; R307-K311 VanDerWaalsContact O-CG 3.26Å; R307-K311 WeakPolarHBondContact O-CG 3.33Å; R307-K311 PolarHBondContact O-N 3.1Å
308R95.5Very high93.5Very high143 Ų143107.2 Ų107.254%0.5451%0.505SS..Hα-helixtrans-73.9-54.3177.1-68.8170.3-161.4-164.66.4110.5E304 E305 R306 L310 K311 E312E304-R308 VanDerWaalsContact O-CG 3.3Å; E304-R308 WeakPolarHBondContact O-CG 3.27Å; E304-R308 PolarHBondContact O-N 2.88Å; E304-R308 IonicContact OE2-CZ 3.1Å; E304-R308 IonicContact OE2-NE 2.68Å; E304-R308 IonicContact OE2-NH2 3.29Å; E304-R308 PolarHBondContact OE2-NH2 3.38Å; E305-R308 PolarHBondContact O-N 3.26Å; R306-R308 VanDerWaalsContact C-N 3.34Å; R306-R308 PolarHBondContact O-N 3.23Å; R308-L310 VanDerWaalsContact C-N 3.33Å; R308-L310 PolarHBondContact O-N 2.96Å; R308-K311 WeakPolarHBondContact O-CA 3.35Å; R308-K311 WeakPolarHBondContact O-CB 3.48Å; R308-K311 PolarHBondContact O-N 3.18Å; R308-E312 PolarHBondContact O-N 2.86Å
309S94.3Very high93.5Very high46 Ų46107.7 Ų107.732%0.32251%0.507SS..Hα-helixtrans-59.2-37.7178.453.20000113.6E305 R306 E312 K313E305-S309 PolarHBondContact O-N 3.36Å; E305-S309 PolarHBondContact O-OG 3.44Å; R306-S309 WeakPolarHBondContact CA-OG 3.27Å; R306-S309 PolarHBondContact O-OG 2.83Å; S309-E312 PolarHBondContact O-N 3.01Å; S309-K313 WeakPolarHBondContact O-CB 3.38Å; S309-K313 WeakPolarHBondContact O-CG 3.44Å; S309-K313 PolarHBondContact O-N 3.18Å
310L95.3Very high93.3Very high113 Ų113108 Ų10859%0.59252%0.522SS*.Hα-helixtrans-65.7-35.7173.4-75.1171.7000113R306 R308 N314R306-L310 WeakPolarHBondContact O-CB 3.4Å; R306-L310 VanDerWaalsContact O-CG 3.25Å; R306-L310 WeakPolarHBondContact O-CG 3.43Å; R306-L310 PolarHBondContact O-N 3.24Å; R308-L310 VanDerWaalsContact C-N 3.33Å; R308-L310 PolarHBondContact O-N 2.96Å; L310-N314 VanDerWaalsContact O-CB 3.25Å; L310-N314 WeakPolarHBondContact O-CB 3.32Å; L310-N314 PolarHBondContact O-N 3.41Å; L310-N314 VanDerWaalsContact O-N 3.09Å
311K95.6Very high92.7Very high127 Ų127109.8 Ų109.855%0.55254%0.536SS*.Hα-helixtrans-68.9-39.5174.6-75.9172.6175.4-172.10111.7R307 R308 N314 K315R307-K311 WeakPolarHBondContact O-CD 3.32Å; R307-K311 VanDerWaalsContact O-CG 3.26Å; R307-K311 WeakPolarHBondContact O-CG 3.33Å; R307-K311 PolarHBondContact O-N 3.1Å; R308-K311 WeakPolarHBondContact O-CA 3.35Å; R308-K311 WeakPolarHBondContact O-CB 3.48Å; R308-K311 PolarHBondContact O-N 3.18Å; K311-N314 PolarHBondContact O-N 3.27Å; K311-K315 WeakPolarHBondContact O-CB 3.28Å; K311-K315 PolarHBondContact O-N 2.87Å
312E95.7Very high92.2Very high116 Ų116109.5 Ų109.554%0.54254%0.537SS..Hα-helixtrans-66.2-52177.9-73.2163.9175.900110.9R308 S309 N314 K315 E316R308-E312 PolarHBondContact O-N 2.86Å; S309-E312 PolarHBondContact O-N 3.01Å; E312-N314 VanDerWaalsContact C-N 3.26Å; E312-N314 PolarHBondContact O-N 3.1Å; E312-K315 WeakPolarHBondContact O-CB 3.37Å; E312-K315 PolarHBondContact O-N 3.42Å; E312-K315 VanDerWaalsContact O-N 3.07Å; E312-E316 WeakPolarHBondContact O-CG 3.39Å; E312-E316 PolarHBondContact O-N 2.62Å
313K95.1Very high91.5Very high110 Ų110113.8 Ų113.848%0.47855%0.553SS.*Hα-helixtrans-54.7-40.2173.6-73.2178.8177.2-176.50112.8S309 A317S309-K313 WeakPolarHBondContact O-CB 3.38Å; S309-K313 WeakPolarHBondContact O-CG 3.44Å; S309-K313 PolarHBondContact O-N 3.18Å; K313-A317 WeakPolarHBondContact O-CB 3.43Å; K313-A317 PolarHBondContact O-N 2.97Å
314N93.8Very high90.9Very high97 Ų97111.4 Ų111.452%0.51955%0.55SS.*Hα-helixtrans-68.3-44.2176.8-168.6-32.5000111.4L310 K311 E312 E316 A317 L318L310-N314 VanDerWaalsContact O-CB 3.25Å; L310-N314 WeakPolarHBondContact O-CB 3.32Å; L310-N314 PolarHBondContact O-N 3.41Å; L310-N314 VanDerWaalsContact O-N 3.09Å; K311-N314 PolarHBondContact O-N 3.27Å; E312-N314 VanDerWaalsContact C-N 3.26Å; E312-N314 PolarHBondContact O-N 3.1Å; N314-E316 VanDerWaalsContact C-N 3.34Å; N314-E316 PolarHBondContact O-N 3.06Å; N314-A317 PolarHBondContact O-N 3.33Å; N314-L318 WeakPolarHBondContact O-CB 3.48Å; N314-L318 WeakPolarHBondContact O-CG 3.33Å; N314-L318 PolarHBondContact O-N 3.37Å; N314-L318 WeakPolarHBondContact OD1-CD1 3.14Å
315K95.4Very high89.9Confident141 Ų141113 Ų11361%0.61356%0.556SS**Hα-helixtrans-59-43.3173.9-175.9-174.2176.8-170.20111.9K311 E312 L318 L319K311-K315 WeakPolarHBondContact O-CB 3.28Å; K311-K315 PolarHBondContact O-N 2.87Å; E312-K315 WeakPolarHBondContact O-CB 3.37Å; E312-K315 PolarHBondContact O-N 3.42Å; E312-K315 VanDerWaalsContact O-N 3.07Å; K315-L318 PolarHBondContact O-N 3.08Å; K315-L319 HydrophobicContact CG-CD1 4.24Å; K315-L319 WeakPolarHBondContact O-CB 3.34Å; K315-L319 VanDerWaalsContact O-CG 3.29Å; K315-L319 WeakPolarHBondContact O-CG 3.29Å; K315-L319 PolarHBondContact O-N 2.94Å
316E94.3Very high89.1Confident127 Ų127117.5 Ų117.559%0.59357%0.574SS**Hα-helixtrans-64.4-44.5175.9-72.4172.7179.500111.9E312 N314 L318 L319 A320E312-E316 WeakPolarHBondContact O-CG 3.39Å; E312-E316 PolarHBondContact O-N 2.62Å; N314-E316 VanDerWaalsContact C-N 3.34Å; N314-E316 PolarHBondContact O-N 3.06Å; E316-L318 VanDerWaalsContact C-N 3.34Å; E316-L318 PolarHBondContact O-N 2.92Å; E316-L319 PolarHBondContact O-N 3.28Å; E316-A320 WeakPolarHBondContact O-CB 3.39Å; E316-A320 PolarHBondContact O-N 3.21Å
317A91.6Very high88.2Confident60 Ų60116.8 Ų116.850%0.49658%0.575SS.*Hα-helixtrans-62-40.7175.500000112.3K313 N314 A320 S321K313-A317 WeakPolarHBondContact O-CB 3.43Å; K313-A317 PolarHBondContact O-N 2.97Å; N314-A317 PolarHBondContact O-N 3.33Å; A317-A320 PolarHBondContact O-N 2.91Å; A317-S321 WeakPolarHBondContact O-CB 3.39Å; A317-S321 PolarHBondContact O-N 3.35Å; A317-S321 PolarHBondContact O-OG 3.41Å
318L88.7Confident87.6Confident106 Ų106111 Ų11156%0.55556%0.556SS**Hα-helixtrans-62.6-47.4174.1-72.4172.1000111.3N314 K315 E316 A320 S321 Q322N314-L318 WeakPolarHBondContact O-CB 3.48Å; N314-L318 WeakPolarHBondContact O-CG 3.33Å; N314-L318 PolarHBondContact O-N 3.37Å; N314-L318 WeakPolarHBondContact OD1-CD1 3.14Å; K315-L318 PolarHBondContact O-N 3.08Å; E316-L318 VanDerWaalsContact C-N 3.34Å; E316-L318 PolarHBondContact O-N 2.92Å; L318-A320 PolarHBondContact O-N 2.98Å; L318-S321 PolarHBondContact O-N 2.92Å; L318-S321 PolarHBondContact O-OG 3.01Å; L318-Q322 PolarHBondContact O-N 3.39Å
319L87.4Confident86.9Confident100 Ų100105.9 Ų105.952%0.52454%0.544SS..Hα-helixtrans-62.6-39.9176.3-71.2170.2000112.5K315 E316 S321 Q322K315-L319 HydrophobicContact CG-CD1 4.24Å; K315-L319 WeakPolarHBondContact O-CB 3.34Å; K315-L319 VanDerWaalsContact O-CG 3.29Å; K315-L319 WeakPolarHBondContact O-CG 3.29Å; K315-L319 PolarHBondContact O-N 2.94Å; E316-L319 PolarHBondContact O-N 3.28Å; L319-S321 VanDerWaalsContact C-N 3.34Å; L319-S321 PolarHBondContact O-N 2.93Å; L319-Q322 WeakPolarHBondContact O-CB 3.45Å; L319-Q322 PolarHBondContact O-N 3.44Å
320A86.2Confident86.2Confident91 Ų91111.4 Ų111.475%0.75256%0.558SS**Hα-helixtrans-67.8-32.5175.700000112.7E316 A317 L318E316-A320 WeakPolarHBondContact O-CB 3.39Å; E316-A320 PolarHBondContact O-N 3.21Å; A317-A320 PolarHBondContact O-N 2.91Å; L318-A320 PolarHBondContact O-N 2.98Å
321S81.6Confident85.7Confident83 Ų83109 Ų10958%0.5854%0.544SS*.Hα-helixtrans-76.5-23.1174.678.40000113.3A317 L318 L319 K323A317-S321 WeakPolarHBondContact O-CB 3.39Å; A317-S321 PolarHBondContact O-N 3.35Å; A317-S321 PolarHBondContact O-OG 3.41Å; L318-S321 PolarHBondContact O-N 2.92Å; L318-S321 PolarHBondContact O-OG 3.01Å; L319-S321 VanDerWaalsContact C-N 3.34Å; L319-S321 PolarHBondContact O-N 2.93Å; S321-K323 PolarHBondContact O-N 3.4Å
322Q83.3Confident85.3Confident123 Ų123108.5 Ų108.558%0.57554%0.544SS*.  trans-70.294.8178.4-173.5-179.88.700110L318 L319 P324L318-Q322 PolarHBondContact O-N 3.39Å; L319-Q322 WeakPolarHBondContact O-CB 3.45Å; L319-Q322 PolarHBondContact O-N 3.44Å; Q322-P324 WeakPolarHBondContact O-CD 3.24Å; Q322-P324 VanDerWaalsContact O-N 3.17Å
323K77.9Confident84.7Confident193 Ų193109.6 Ų109.684%0.83955%0.549SS*.  trans-66.4111.6168.3-66.5-178.6-179.2179.20108.4S321 F325S321-K323 PolarHBondContact O-N 3.4Å; K323-F325 PolarHBondContact O-N 3.21Å
324P79.4Confident84.3Confident72 Ų72110.8 Ų110.847%0.46855%0.554SS.*  trans-60.3135.6176.125-32.9000108.7Q322 I328Q322-P324 WeakPolarHBondContact O-CD 3.24Å; Q322-P324 VanDerWaalsContact O-N 3.17Å; P324-I328 HydrophobicContact CB-CB 3.96Å; P324-I328 HydrophobicContact CB-CD1 4.48Å; P324-I328 HydrophobicContact CB-CG2 3.57Å
325F74.2Confident84Confident123 Ų123113.2 Ų113.254%0.53956%0.556SS.*  trans-59.3150.517651.5-113000109.6K323 F327 I328K323-F325 PolarHBondContact O-N 3.21Å; F325-F327 HydrophobicContact CD2-CB 3.56Å; F325-F327 HydrophobicContact CD2-CD1 4.34Å; F325-F327 HydrophobicContact CD2-CG 4.45Å; F325-F327 HydrophobicContact CE2-CB 3.69Å; F325-F327 AromaticContact CE2-CD1 3.6Å; F325-F327 HydrophobicContact CE2-CD1 3.6Å; F325-F327 HydrophobicContact CE2-CG 4.11Å; F325-F327 HydrophobicContact CZ-CD1 4.4Å; F325-F327 PolarHBondContact O-N 3.24Å; F325-I328 HydrophobicContact CD1-CD1 3.96Å; F325-I328 HydrophobicContact CD2-CB 4.05Å; F325-I328 HydrophobicContact CD2-CD1 4.17Å; F325-I328 HydrophobicContact CD2-CG1 4.03Å; F325-I328 HydrophobicContact CE1-CD1 3.45Å; F325-I328 VanDerWaalsContact CE1-CD1 3.45Å; F325-I328 HydrophobicContact CE1-CG1 4.1Å; F325-I328 HydrophobicContact CE2-CB 3.82Å; F325-I328 HydrophobicContact CE2-CD1 3.69Å; F325-I328 HydrophobicContact CE2-CG1 3.37Å; F325-I328 HydrophobicContact CG-CD1 4.31Å; F325-I328 HydrophobicContact CZ-CB 4.34Å; F325-I328 HydrophobicContact CZ-CD1 3.31Å; F325-I328 HydrophobicContact CZ-CG1 3.43Å; F325-I328 VanDerWaalsContact CZ-CG1 3.43Å; F325-I328 PolarHBondContact O-N 2.92Å
326K77.1Confident83.7Confident190 Ų190108.5 Ų108.583%0.82654%0.543SS*.Hα-helixtrans-54.4-21.3-174.8-65.3-176.2178.9-178.60113.8R330K326-R330 WeakPolarHBondContact O-CB 3.45Å; K326-R330 PolarHBondContact O-N 3.5Å
327F74.9Confident83.4Confident124 Ų124104.7 Ų104.754%0.54453%0.533SS..Hα-helixtrans-75-33.6172.8-178-112.6000114.6F325 R330 E331F325-F327 HydrophobicContact CD2-CB 3.56Å; F325-F327 HydrophobicContact CD2-CD1 4.34Å; F325-F327 HydrophobicContact CD2-CG 4.45Å; F325-F327 HydrophobicContact CE2-CB 3.69Å; F325-F327 AromaticContact CE2-CD1 3.6Å; F325-F327 HydrophobicContact CE2-CD1 3.6Å; F325-F327 HydrophobicContact CE2-CG 4.11Å; F325-F327 HydrophobicContact CZ-CD1 4.4Å; F325-F327 PolarHBondContact O-N 3.24Å; F327-R330 PolarHBondContact O-N 2.79Å; F327-E331 VanDerWaalsContact O-CB 3.27Å; F327-E331 WeakPolarHBondContact O-CB 3.33Å; F327-E331 PolarHBondContact O-N 3.01Å
328I82.1Confident83.1Confident46 Ų46106.7 Ų106.724%0.23653%0.532CS..Hα-helixtrans-66.8-52173.5-91.3155.1000109P324 F325 R330 E331 E332P324-I328 HydrophobicContact CB-CB 3.96Å; P324-I328 HydrophobicContact CB-CD1 4.48Å; P324-I328 HydrophobicContact CB-CG2 3.57Å; F325-I328 HydrophobicContact CD1-CD1 3.96Å; F325-I328 HydrophobicContact CD2-CB 4.05Å; F325-I328 HydrophobicContact CD2-CD1 4.17Å; F325-I328 HydrophobicContact CD2-CG1 4.03Å; F325-I328 HydrophobicContact CE1-CD1 3.45Å; F325-I328 VanDerWaalsContact CE1-CD1 3.45Å; F325-I328 HydrophobicContact CE1-CG1 4.1Å; F325-I328 HydrophobicContact CE2-CB 3.82Å; F325-I328 HydrophobicContact CE2-CD1 3.69Å; F325-I328 HydrophobicContact CE2-CG1 3.37Å; F325-I328 HydrophobicContact CG-CD1 4.31Å; F325-I328 HydrophobicContact CZ-CB 4.34Å; F325-I328 HydrophobicContact CZ-CD1 3.31Å; F325-I328 HydrophobicContact CZ-CG1 3.43Å; F325-I328 VanDerWaalsContact CZ-CG1 3.43Å; F325-I328 PolarHBondContact O-N 2.92Å; I328-R330 PolarHBondContact O-N 3.37Å; I328-E331 CarbonylContact O-C 3.59Å; I328-E331 PolarHBondContact O-N 3.23Å; I328-E332 HydrophobicContact CG2-CG 4.21Å; I328-E332 WeakPolarHBondContact O-CB 3.47Å; I328-E332 WeakPolarHBondContact O-CG 3.29Å; I328-E332 PolarHBondContact O-N 2.94Å
329A80.5Confident83.1Confident35 Ų35106.4 Ų106.429%0.28953%0.528SS..Hα-helixtrans-59-37.2179.400000111.6Q333A329-Q333 VanDerWaalsContact O-CB 3.27Å; A329-Q333 WeakPolarHBondContact O-CB 3.31Å; A329-Q333 WeakPolarHBondContact O-CG 3.4Å; A329-Q333 PolarHBondContact O-N 2.9Å
330R80.9Confident82.9Confident163 Ų163108.5 Ų108.562%0.61553%0.533SS*.Hα-helixtrans-67.5-40.3172.8-178.5-171.9-65.9168.7-3.8112.6K326 F327 I328 K334K326-R330 WeakPolarHBondContact O-CB 3.45Å; K326-R330 PolarHBondContact O-N 3.5Å; F327-R330 PolarHBondContact O-N 2.79Å; I328-R330 PolarHBondContact O-N 3.37Å; R330-K334 WeakPolarHBondContact O-CB 3.49Å; R330-K334 PolarHBondContact O-N 3.24Å
331E84.6Confident82.7Confident63 Ų63109.8 Ų109.829%0.29452%0.523SS..Hα-helixtrans-72.7-40.2180-161.2-170.8160.500111.4F327 I328 K334 R335F327-E331 VanDerWaalsContact O-CB 3.27Å; F327-E331 WeakPolarHBondContact O-CB 3.33Å; F327-E331 PolarHBondContact O-N 3.01Å; I328-E331 CarbonylContact O-C 3.59Å; I328-E331 PolarHBondContact O-N 3.23Å; E331-K334 CarbonylContact O-C 3.57Å; E331-K334 WeakPolarHBondContact O-CB 3.08Å; E331-K334 PolarHBondContact O-N 3.46Å; E331-R335 WeakPolarHBondContact O-CB 3.4Å; E331-R335 VanDerWaalsContact O-CG 3.27Å; E331-R335 WeakPolarHBondContact O-CG 3.42Å; E331-R335 PolarHBondContact O-N 3.03Å; E331-R335 IonicContact OE1-CZ 2.62Å; E331-R335 VanDerWaalsContact OE1-CZ 3.29Å; E331-R335 IonicContact OE1-NE 2.68Å; E331-R335 PolarHBondContact OE1-NE 2.98Å; E331-R335 VanDerWaalsContact OE1-NE 3.11Å; E331-R335 IonicContact OE1-NH2 2.72Å; E331-R335 PolarHBondContact OE1-NH2 3.03Å; E331-R335 IonicContact OE2-NH2 3.14Å
332E86.5Confident82.6Confident116 Ų116110.4 Ų110.454%0.54252%0.52SS..Hα-helixtrans-61.2-44.8170.1-72.9175.6169.600111.2I328 K334 R335 A336I328-E332 HydrophobicContact CG2-CG 4.21Å; I328-E332 WeakPolarHBondContact O-CB 3.47Å; I328-E332 WeakPolarHBondContact O-CG 3.29Å; I328-E332 PolarHBondContact O-N 2.94Å; E332-K334 VanDerWaalsContact C-N 3.3Å; E332-K334 PolarHBondContact O-N 2.66Å; E332-R335 PolarHBondContact O-N 3.18Å; E332-A336 WeakPolarHBondContact O-CB 3.32Å; E332-A336 PolarHBondContact O-N 3.16Å
333Q83.9Confident82.4Confident138 Ų138111.6 Ų111.665%0.64552%0.519SS*.Hα-helixtrans-60.4-39.4171.8-77.2170.24.500112A329 A337A329-Q333 VanDerWaalsContact O-CB 3.27Å; A329-Q333 WeakPolarHBondContact O-CB 3.31Å; A329-Q333 WeakPolarHBondContact O-CG 3.4Å; A329-Q333 PolarHBondContact O-N 2.9Å; Q333-A337 WeakPolarHBondContact O-CB 3.43Å; Q333-A337 PolarHBondContact O-N 3.46Å
334K87.1Confident82.2Confident136 Ų136106.1 Ų106.159%0.59150%0.499SS*.Hα-helixtrans-67.5-42.5175.9-173.8-177.8178.1-174.50111.9R330 E331 E332 A337 Q338R330-K334 WeakPolarHBondContact O-CB 3.49Å; R330-K334 PolarHBondContact O-N 3.24Å; E331-K334 CarbonylContact O-C 3.57Å; E331-K334 WeakPolarHBondContact O-CB 3.08Å; E331-K334 PolarHBondContact O-N 3.46Å; E332-K334 VanDerWaalsContact C-N 3.3Å; E332-K334 PolarHBondContact O-N 2.66Å; K334-A337 PolarHBondContact O-N 3.14Å; K334-Q338 WeakPolarHBondContact O-CB 3.33Å; K334-Q338 WeakPolarHBondContact O-CG 3.47Å; K334-Q338 PolarHBondContact O-N 2.95Å
335R87.2Confident81.6Confident148 Ų148108.2 Ų108.256%0.55850%0.501SS*.Hα-helixtrans-65.8-43.5175.5-71.7173.9-171.7-168.95.2110.9E331 E332 Q338 E339E331-R335 WeakPolarHBondContact O-CB 3.4Å; E331-R335 VanDerWaalsContact O-CG 3.27Å; E331-R335 WeakPolarHBondContact O-CG 3.42Å; E331-R335 PolarHBondContact O-N 3.03Å; E331-R335 IonicContact OE1-CZ 2.62Å; E331-R335 VanDerWaalsContact OE1-CZ 3.29Å; E331-R335 IonicContact OE1-NE 2.68Å; E331-R335 PolarHBondContact OE1-NE 2.98Å; E331-R335 VanDerWaalsContact OE1-NE 3.11Å; E331-R335 IonicContact OE1-NH2 2.72Å; E331-R335 PolarHBondContact OE1-NH2 3.03Å; E331-R335 IonicContact OE2-NH2 3.14Å; E332-R335 PolarHBondContact O-N 3.18Å; R335-Q338 CarbonylContact O-C 3.58Å; R335-Q338 WeakPolarHBondContact O-CB 3.37Å; R335-Q338 PolarHBondContact O-N 3.47Å; R335-E339 PolarHBondContact O-N 3.12Å
336A89.1Confident81Confident41 Ų41109.6 Ų109.634%0.33951%0.507SS..Hα-helixtrans-67.8-34.7175.500000112.3E332 E339 K340E332-A336 WeakPolarHBondContact O-CB 3.32Å; E332-A336 PolarHBondContact O-N 3.16Å; A336-E339 PolarHBondContact O-N 3.21Å; A336-K340 VanDerWaalsContact O-CB 3.32Å; A336-K340 WeakPolarHBondContact O-CB 3.37Å; A336-K340 VanDerWaalsContact O-CG 3.23Å; A336-K340 WeakPolarHBondContact O-CG 3.41Å; A336-K340 PolarHBondContact O-N 3.35Å
337A86.9Confident80.3Confident47 Ų47108.2 Ų108.239%0.38850%0.501SS..Hα-helixtrans-66.8-41.8170.800000111.4Q333 K334 Q341Q333-A337 WeakPolarHBondContact O-CB 3.43Å; Q333-A337 PolarHBondContact O-N 3.46Å; K334-A337 PolarHBondContact O-N 3.14Å; A337-Q341 WeakPolarHBondContact O-CB 3.15Å; A337-Q341 VanDerWaalsContact O-CG 3.32Å; A337-Q341 WeakPolarHBondContact O-CG 3.15Å; A337-Q341 PolarHBondContact O-N 3.35Å
338Q86.3Confident79.5Confident102 Ų102106.1 Ų106.148%0.47750%0.502SS..Hα-helixtrans-64.2-41.3172.2-77.2-179.8-22.500112.2K334 R335 Q341 L342K334-Q338 WeakPolarHBondContact O-CB 3.33Å; K334-Q338 WeakPolarHBondContact O-CG 3.47Å; K334-Q338 PolarHBondContact O-N 2.95Å; R335-Q338 CarbonylContact O-C 3.58Å; R335-Q338 WeakPolarHBondContact O-CB 3.37Å; R335-Q338 PolarHBondContact O-N 3.47Å; Q338-Q341 PolarHBondContact O-N 3.02Å; Q338-L342 WeakPolarHBondContact O-CB 3.44Å; Q338-L342 VanDerWaalsContact O-CG 3.25Å; Q338-L342 WeakPolarHBondContact O-CG 3.38Å; Q338-L342 PolarHBondContact O-N 2.78Å
339E87.3Confident78.1Confident101 Ų101109.3 Ų109.347%0.47251%0.514SS..Hα-helixtrans-66.6-44.4176.7-163.6-161.3150.900110.8R335 A336 L342 R343R335-E339 PolarHBondContact O-N 3.12Å; A336-E339 PolarHBondContact O-N 3.21Å; E339-L342 CarbonylContact O-C 3.6Å; E339-L342 PolarHBondContact O-N 2.93Å; E339-R343 HydrophobicContact CG-CG 4.38Å; E339-R343 WeakPolarHBondContact O-CB 3.28Å; E339-R343 WeakPolarHBondContact O-CG 3.47Å; E339-R343 PolarHBondContact O-N 2.8Å; E339-R343 IonicContact OE1-CZ 3.68Å; E339-R343 IonicContact OE1-NE 3.16Å; E339-R343 PolarHBondContact OE1-NE 2.93Å; E339-R343 VanDerWaalsContact OE1-NE 3.16Å; E339-R343 IonicContact OE1-NH2 2.72Å; E339-R343 PolarHBondContact OE1-NH2 3.18Å
340K84.3Confident77.2Confident143 Ų143116.8 Ų116.862%0.62254%0.54SS*.Hα-helixtrans-58.5-48.7172.9-75.6174.1-179.4-177.20111.1A336 L342 R343 D344A336-K340 VanDerWaalsContact O-CB 3.32Å; A336-K340 WeakPolarHBondContact O-CB 3.37Å; A336-K340 VanDerWaalsContact O-CG 3.23Å; A336-K340 WeakPolarHBondContact O-CG 3.41Å; A336-K340 PolarHBondContact O-N 3.35Å; K340-L342 VanDerWaalsContact C-N 3.32Å; K340-L342 PolarHBondContact O-N 2.89Å; K340-R343 WeakPolarHBondContact O-CB 3.3Å; K340-R343 PolarHBondContact O-N 3.11Å; K340-D344 WeakPolarHBondContact O-CB 3.31Å; K340-D344 PolarHBondContact O-N 3.41Å
341Q81.4Confident76.3Confident118 Ų118118.6 Ų118.655%0.55155%0.552SS**Hα-helixtrans-58.1-42.6173.9-77.8-177-7.500112.1A337 Q338 D344 F345A337-Q341 WeakPolarHBondContact O-CB 3.15Å; A337-Q341 VanDerWaalsContact O-CG 3.32Å; A337-Q341 WeakPolarHBondContact O-CG 3.15Å; A337-Q341 PolarHBondContact O-N 3.35Å; Q338-Q341 PolarHBondContact O-N 3.02Å; Q341-D344 PolarHBondContact O-N 3.42Å; Q341-F345 HydrophobicContact CB-CD2 4.47Å; Q341-F345 VanDerWaalsContact O-CB 3.29Å; Q341-F345 WeakPolarHBondContact O-CB 3.45Å; Q341-F345 WeakPolarHBondContact O-CD2 3.5Å; Q341-F345 PolarHBondContact O-N 3.26Å
342L79.4Confident75.2Confident96 Ų96120.8 Ų120.850%0.50357%0.57SS.*Hα-helixtrans-63.5-48.1175.8-75.8169.7000111.5Q338 E339 K340 D344 F345 F346Q338-L342 WeakPolarHBondContact O-CB 3.44Å; Q338-L342 VanDerWaalsContact O-CG 3.25Å; Q338-L342 WeakPolarHBondContact O-CG 3.38Å; Q338-L342 PolarHBondContact O-N 2.78Å; E339-L342 CarbonylContact O-C 3.6Å; E339-L342 PolarHBondContact O-N 2.93Å; K340-L342 VanDerWaalsContact C-N 3.32Å; K340-L342 PolarHBondContact O-N 2.89Å; L342-D344 VanDerWaalsContact C-N 3.28Å; L342-D344 PolarHBondContact O-N 2.84Å; L342-F345 CarbonylContact O-C 3.56Å; L342-F345 WeakPolarHBondContact O-CB 3.43Å; L342-F345 PolarHBondContact O-N 3.34Å; L342-F346 HydrophobicContact CB-CE2 4.47Å; L342-F346 WeakPolarHBondContact O-CD2 3.33Å; L342-F346 PolarHBondContact O-N 3.34Å
343R78.6Confident74.1Confident149 Ų149123.1 Ų123.156%0.56259%0.586SS**Hα-helixtrans-55.8-44.5174.9-67.6-84.8-165.2-173.14.2110.8E339 K340 F346 K347E339-R343 HydrophobicContact CG-CG 4.38Å; E339-R343 WeakPolarHBondContact O-CB 3.28Å; E339-R343 WeakPolarHBondContact O-CG 3.47Å; E339-R343 PolarHBondContact O-N 2.8Å; E339-R343 IonicContact OE1-CZ 3.68Å; E339-R343 IonicContact OE1-NE 3.16Å; E339-R343 PolarHBondContact OE1-NE 2.93Å; E339-R343 VanDerWaalsContact OE1-NE 3.16Å; E339-R343 IonicContact OE1-NH2 2.72Å; E339-R343 PolarHBondContact OE1-NH2 3.18Å; K340-R343 WeakPolarHBondContact O-CB 3.3Å; K340-R343 PolarHBondContact O-N 3.11Å; R343-F346 CarbonylContact O-C 3.49Å; R343-F346 PolarHBondContact O-N 3.37Å; R343-F346 VanDerWaalsContact O-N 3.15Å; R343-K347 WeakPolarHBondContact O-CG 3.48Å; R343-K347 PolarHBondContact O-N 3.43Å
344D75.3Confident73Confident77 Ų77126.6 Ų126.641%0.41259%0.593SS.*Hα-helixtrans-75.7-30.4-179.2-62.1-25.4000111.7K340 Q341 L342 F346 K347 S348K340-D344 WeakPolarHBondContact O-CB 3.31Å; K340-D344 PolarHBondContact O-N 3.41Å; Q341-D344 PolarHBondContact O-N 3.42Å; L342-D344 VanDerWaalsContact C-N 3.28Å; L342-D344 PolarHBondContact O-N 2.84Å; D344-F346 VanDerWaalsContact C-N 3.32Å; D344-K347 PolarHBondContact O-N 3.03Å; D344-K347 IonicContact OD1-NZ 2.83Å; D344-K347 PolarHBondContact OD1-NZ 3.19Å; D344-S348 WeakPolarHBondContact O-CB 3.42Å; D344-S348 PolarHBondContact O-N 2.88Å; D344-S348 PolarHBondContact O-OG 3.17Å
345F65.8Low72.4Confident116 Ų116129.3 Ų129.351%0.50961%0.606SS.*Hα-helixtrans-67.2-27.3164.8-87.5-60.9000113Q341 L342 K349Q341-F345 HydrophobicContact CB-CD2 4.47Å; Q341-F345 VanDerWaalsContact O-CB 3.29Å; Q341-F345 WeakPolarHBondContact O-CB 3.45Å; Q341-F345 WeakPolarHBondContact O-CD2 3.5Å; Q341-F345 PolarHBondContact O-N 3.26Å; L342-F345 CarbonylContact O-C 3.56Å; L342-F345 WeakPolarHBondContact O-CB 3.43Å; L342-F345 PolarHBondContact O-N 3.34Å; F345-K349 WeakPolarHBondContact O-CB 3.32Å; F345-K349 WeakPolarHBondContact O-CD 3.25Å; F345-K349 WeakPolarHBondContact O-CE 3.39Å; F345-K349 WeakPolarHBondContact O-CG 3.32Å; F345-K349 PolarHBondContact O-N 2.89Å
346F61.7Low71.7Confident153 Ų153131.2 Ų131.267%0.67162%0.618SS**Hα-helixtrans-79.7-32.5172.2-77-65.5000112L342 R343 D344L342-F346 HydrophobicContact CB-CE2 4.47Å; L342-F346 WeakPolarHBondContact O-CD2 3.33Å; L342-F346 PolarHBondContact O-N 3.34Å; R343-F346 CarbonylContact O-C 3.49Å; R343-F346 PolarHBondContact O-N 3.37Å; R343-F346 VanDerWaalsContact O-N 3.15Å; D344-F346 VanDerWaalsContact C-N 3.32Å
347K62.9Low71.1Confident160 Ų160132.7 Ų132.770%0.69663%0.63SS**Hα-helixtrans-73.8-37.3172.3-66.5169-165.8160.90113.4R343 D344R343-K347 WeakPolarHBondContact O-CG 3.48Å; R343-K347 PolarHBondContact O-N 3.43Å; D344-K347 PolarHBondContact O-N 3.03Å; D344-K347 IonicContact OD1-NZ 2.83Å; D344-K347 PolarHBondContact OD1-NZ 3.19Å
348S58.9Low70.7Confident81 Ų81142 Ų14257%0.56666%0.655SS**SBendtrans-90.6-4.7-173.360.20000115D344 K350D344-S348 WeakPolarHBondContact O-CB 3.42Å; D344-S348 PolarHBondContact O-N 2.88Å; D344-S348 PolarHBondContact O-OG 3.17Å; S348-K350 VanDerWaalsContact C-N 3.28Å; S348-K350 PolarHBondContact O-N 2.95Å
349K51.9Low70.3Confident113 Ų113142.8 Ų142.849%0.49167%0.669SS.*  trans-73.479.5175-86.3168.3-165.6163.20112.2F345 K351F345-K349 WeakPolarHBondContact O-CB 3.32Å; F345-K349 WeakPolarHBondContact O-CD 3.25Å; F345-K349 WeakPolarHBondContact O-CE 3.39Å; F345-K349 WeakPolarHBondContact O-CG 3.32Å; F345-K349 PolarHBondContact O-N 2.89Å; K349-K351 PolarHBondContact O-N 3.4Å
350K61.4Low69.7Low191 Ų191143.2 Ų143.283%0.8367%0.674SS**  trans-49.9129.1134.6-71.8-175.3177.7-1790106.8S348 T352S348-K350 VanDerWaalsContact C-N 3.28Å; S348-K350 PolarHBondContact O-N 2.95Å; K350-T352 PolarHBondContact O-N 3.33Å
351K61.2Low69.5Low201 Ų201140.4 Ų140.487%0.87467%0.67SS**  trans-62.895.5-168.1-64175.7-176.4172.80110.9K349K349-K351 PolarHBondContact O-N 3.4Å
352T61.4Low68.9Low109 Ų109145.7 Ų145.767%0.66969%0.685SS**  trans-74.4125.8166.447.70000108.9K350 R354K350-T352 PolarHBondContact O-N 3.33Å; T352-R354 VanDerWaalsContact C-N 3.26Å; T352-R354 PolarHBondContact O-N 2.78Å
353N63.8Low68.5Low166 Ų166145.4 Ų145.489%0.88869%0.691SS**  trans-71.678.9-176.4-71.4-33.3000111
354R60.8Low68Low210 Ų210141.8 Ų141.879%0.79269%0.685SS**  trans-80.5133.6164.6-84.9177.157.1179-3.2109.8T352 K356T352-R354 VanDerWaalsContact C-N 3.26Å; T352-R354 PolarHBondContact O-N 2.78Å; R354-K356 PolarHBondContact O-N 2.97Å
355F74.6Confident67.7Low193 Ų193146.2 Ų146.285%0.84670%0.698SS**  trans-42.6118.9172.5177-102.9000111.4
356K72.1Confident68Low188 Ų188141.6 Ų141.682%0.81768%0.682SS**  trans-92.6112.9172.5-66.9-80.7-173.6166.50106.9R354R354-K356 PolarHBondContact O-N 2.97Å
357A76.9Confident68.4Low72 Ų72138.2 Ų138.260%0.59568%0.677SS**PPolyproline II helixtrans-56.6147.9165.400000109.4
358R79.3Confident68.9Low243 Ų243135 Ų13592%0.91767%0.672SS**PPolyproline II helixtrans-56.4128173.3-70.7-177.6175-177.4-2108I360R358-I360 PolarHBondContact O-N 3.46Å
359P77.1Confident69.7Low119 Ų119133.7 Ų133.777%0.77366%0.66SS**PPolyproline II helixtrans-60.4141.5177.926.3-33.7000109.1
360I74.3Confident71Confident110 Ų110131.8 Ų131.856%0.56466%0.655SS**PPolyproline II helixtrans-56.2133.9174.3-55.9177000107.5R358 R362 T364R358-I360 PolarHBondContact O-N 3.46Å; I360-R362 PolarHBondContact O-N 2.89Å; I360-T364 HydrophobicContact CG2-CG2 3.53Å; I360-T364 WeakPolarHBondContact CG2-OG1 3.44Å
361P80.6Confident72Confident83 Ų83125.6 Ų125.654%0.53963%0.631SS.*PPolyproline II helixtrans-51.4136-176.9-29.536.2000112.1S363 T364P361-S363 WeakPolarHBondContact CB-OG 3.47Å; P361-S363 PolarHBondContact O-N 2.96Å; P361-T364 PolarHBondContact O-N 3.02Å; P361-T364 PolarHBondContact O-OG1 3.23Å; P361-T364 VanDerWaalsContact O-OG1 3.08Å
362R69.1Low73.1Confident230 Ų230122.7 Ų122.787%0.86862%0.619SS**G310 helixtrans-55.5-19.6-178.8-79-176.2170.5-173.9-3.6113.7I360 T364 Y365 G366I360-R362 PolarHBondContact O-N 2.89Å; R362-T364 PolarHBondContact O-N 3.5Å; R362-Y365 CarbonylContact O-C 3.56Å; R362-Y365 PolarHBondContact O-N 3.36Å; R362-Y365 VanDerWaalsContact O-N 3.08Å; R362-G366 PolarHBondContact O-N 3.29Å
363S70.2Confident74.2Confident90 Ų90122.2 Ų122.263%0.62961%0.612SS**G310 helixtrans-60.8-24.3172.449.90000114.5P361 Y365 G366P361-S363 WeakPolarHBondContact CB-OG 3.47Å; P361-S363 PolarHBondContact O-N 2.96Å; S363-Y365 PolarHBondContact O-N 3.19Å; S363-G366 PolarHBondContact O-N 2.79Å; S363-G366 VanDerWaalsContact O-N 3.17Å
364T67.9Low75.2Confident72 Ų72119.8 Ų119.844%0.44259%0.593SS.*G310 helixtrans-71.1-23.3173.263.20000112.7I360 P361 R362 T369I360-T364 HydrophobicContact CG2-CG2 3.53Å; I360-T364 WeakPolarHBondContact CG2-OG1 3.44Å; P361-T364 PolarHBondContact O-N 3.02Å; P361-T364 PolarHBondContact O-OG1 3.23Å; P361-T364 VanDerWaalsContact O-OG1 3.08Å; R362-T364 PolarHBondContact O-N 3.5Å; T364-T369 PolarHBondContact O-OG1 2.94Å; T364-T369 VanDerWaalsContact O-OG1 3.11Å
365Y69.9Low76.5Confident171 Ų171114.7 Ų114.767%0.67158%0.578SS**G310 helixtrans-100.420.7172.1-60.9-81.5000111.8R362 S363R362-Y365 CarbonylContact O-C 3.56Å; R362-Y365 PolarHBondContact O-N 3.36Å; R362-Y365 VanDerWaalsContact O-N 3.08Å; S363-Y365 PolarHBondContact O-N 3.19Å
366G71.3Confident77.3Confident18 Ų18110 Ų11019%0.18656%0.559CS.*  trans-56.7145.5173.500000111.1R362 S363 T368 T369 N370R362-G366 PolarHBondContact O-N 3.29Å; S363-G366 PolarHBondContact O-N 2.79Å; S363-G366 VanDerWaalsContact O-N 3.17Å; G366-T368 PolarHBondContact O-N 3.45Å; G366-T369 PolarHBondContact O-N 2.83Å; G366-T369 VanDerWaalsContact O-N 3.13Å; G366-T369 PolarHBondContact O-OG1 2.83Å; G366-N370 PolarHBondContact O-N 3.37Å; G366-N370 PolarHBondContact O-ND2 2.92Å
367S70.9Confident78.2Confident82 Ų82107 Ų10757%0.57355%0.548SS*.Hα-helixtrans-51.7-48.3172.7430000110.4T369 N370 D371S367-T369 PolarHBondContact O-N 3.17Å; S367-N370 PolarHBondContact O-N 3.11Å; S367-D371 VanDerWaalsContact C-OD2 3.27Å; S367-D371 WeakPolarHBondContact O-CB 3.46Å; S367-D371 PolarHBondContact O-N 2.97Å
368T73.6Confident79Confident94 Ų94109 Ų10958%0.57755%0.548SS*.Hα-helixtrans-56.5-21.7178.961.40000115.8G366 K372G366-T368 PolarHBondContact O-N 3.45Å; T368-K372 WeakPolarHBondContact O-CD 3.42Å; T368-K372 VanDerWaalsContact O-CG 3.22Å; T368-K372 WeakPolarHBondContact O-CG 3.44Å
369T75.7Confident79.5Confident53 Ų53105 Ų10533%0.32553%0.534SS..Hα-helixtrans-89.8-38173.156.90000111.9T364 G366 S367 L373T364-T369 PolarHBondContact O-OG1 2.94Å; T364-T369 VanDerWaalsContact O-OG1 3.11Å; G366-T369 PolarHBondContact O-N 2.83Å; G366-T369 VanDerWaalsContact O-N 3.13Å; G366-T369 PolarHBondContact O-OG1 2.83Å; S367-T369 PolarHBondContact O-N 3.17Å; T369-L373 WeakPolarHBondContact O-CG 3.48Å; T369-L373 PolarHBondContact O-N 2.84Å; T369-L373 VanDerWaalsContact O-N 3.14Å
370N79.5Confident80.3Confident72 Ų72106.9 Ų106.939%0.38553%0.526SS..Hα-helixtrans-65.6-39.2172.8-79.5-78000112.1G366 S367 L373 K374G366-N370 PolarHBondContact O-N 3.37Å; G366-N370 PolarHBondContact O-ND2 2.92Å; S367-N370 PolarHBondContact O-N 3.11Å; N370-L373 PolarHBondContact O-N 3.09Å; N370-K374 WeakPolarHBondContact O-CG 3.43Å; N370-K374 PolarHBondContact O-N 3.47Å
371D83Confident81.1Confident62 Ų62106.5 Ų106.533%0.33253%0.525SS..Hα-helixtrans-69.7-38.4-179.1-60.1-33.1000110.6S367 L373 K374 E375S367-D371 VanDerWaalsContact C-OD2 3.27Å; S367-D371 WeakPolarHBondContact O-CB 3.46Å; S367-D371 PolarHBondContact O-N 2.97Å; D371-L373 VanDerWaalsContact C-N 3.33Å; D371-L373 PolarHBondContact O-N 3.37Å; D371-K374 PolarHBondContact O-N 3.06Å; D371-K374 IonicContact OD1-NZ 2.91Å; D371-K374 PolarHBondContact OD1-NZ 3.27Å; D371-E375 WeakPolarHBondContact O-CB 3.35Å; D371-E375 WeakPolarHBondContact O-CG 3.49Å; D371-E375 PolarHBondContact O-N 3.32Å
372K83.8Confident81.7Confident139 Ų139106.8 Ų106.860%0.60452%0.522SS*.Hα-helixtrans-60.2-36.7168.4-76.2175.4-176-175.40113.8T368 E376T368-K372 WeakPolarHBondContact O-CD 3.42Å; T368-K372 VanDerWaalsContact O-CG 3.22Å; T368-K372 WeakPolarHBondContact O-CG 3.44Å; K372-E376 PolarHBondContact O-N 3.37Å
373L83.6Confident82.8Confident100 Ų100104.8 Ų104.852%0.52451%0.514SS..Hα-helixtrans-68.7-42.8176.1-72.5170.8000111.4T369 N370 D371 E375 E376 E377T369-L373 WeakPolarHBondContact O-CG 3.48Å; T369-L373 PolarHBondContact O-N 2.84Å; T369-L373 VanDerWaalsContact O-N 3.14Å; N370-L373 PolarHBondContact O-N 3.09Å; D371-L373 VanDerWaalsContact C-N 3.33Å; D371-L373 PolarHBondContact O-N 3.37Å; L373-E375 VanDerWaalsContact C-N 3.35Å; L373-E376 PolarHBondContact O-N 3.48Å; L373-E377 WeakPolarHBondContact O-CG 3.32Å; L373-E377 PolarHBondContact O-N 3.22Å
374K86.1Confident83.8Confident115 Ų115104.8 Ų104.850%0.551%0.51SS..Hα-helixtrans-61.6-42.5172.9-64.6168.7-164.11590111.4N370 D371 E377 L378N370-K374 WeakPolarHBondContact O-CG 3.43Å; N370-K374 PolarHBondContact O-N 3.47Å; D371-K374 PolarHBondContact O-N 3.06Å; D371-K374 IonicContact OD1-NZ 2.91Å; D371-K374 PolarHBondContact OD1-NZ 3.27Å; K374-E377 PolarHBondContact O-N 3.28Å; K374-L378 WeakPolarHBondContact O-CG 3.45Å; K374-L378 PolarHBondContact O-N 3.05Å
375E88.1Confident84.8Confident102 Ų102107.6 Ų107.648%0.47752%0.519SS..Hα-helixtrans-59-46.3173.2-75170.3-164.200111.1D371 L373 E377 L378 Y379D371-E375 WeakPolarHBondContact O-CB 3.35Å; D371-E375 WeakPolarHBondContact O-CG 3.49Å; D371-E375 PolarHBondContact O-N 3.32Å; L373-E375 VanDerWaalsContact C-N 3.35Å; E375-E377 VanDerWaalsContact C-N 3.34Å; E375-E377 PolarHBondContact O-N 3.1Å; E375-L378 WeakPolarHBondContact O-CB 3.25Å; E375-L378 PolarHBondContact O-N 3.22Å; E375-Y379 HydrophobicContact CB-CD2 4.44Å; E375-Y379 HydrophobicContact CB-CE2 4.22Å; E375-Y379 WeakPolarHBondContact O-CD2 3.34Å; E375-Y379 PolarHBondContact O-N 3.19Å
376E90.4Very high85.7Confident95 Ų95104.1 Ų104.144%0.44451%0.511SS..Hα-helixtrans-62.5-38.5176.6-160.6-166.9140.500112.2K372 L373 Y379 R380K372-E376 PolarHBondContact O-N 3.37Å; L373-E376 PolarHBondContact O-N 3.48Å; E376-Y379 PolarHBondContact O-N 3.48Å; E376-R380 WeakPolarHBondContact O-CB 3.43Å; E376-R380 VanDerWaalsContact O-CG 3.3Å; E376-R380 WeakPolarHBondContact O-CG 3.36Å; E376-R380 PolarHBondContact O-N 3.14Å; E376-R380 IonicContact OE1-CZ 3.81Å; E376-R380 IonicContact OE1-NE 3.45Å; E376-R380 PolarHBondContact OE1-NE 3.4Å; E376-R380 IonicContact OE1-NH2 3.11Å; E376-R380 PolarHBondContact OE1-NH2 3.29Å
377E91.9Very high86.5Confident124 Ų124109.7 Ų109.758%0.57953%0.527SS*.Hα-helixtrans-61.8-43.6172.4-73.2178175.200111.9L373 K374 E375 R380 N381L373-E377 WeakPolarHBondContact O-CG 3.32Å; L373-E377 PolarHBondContact O-N 3.22Å; K374-E377 PolarHBondContact O-N 3.28Å; E375-E377 VanDerWaalsContact C-N 3.34Å; E375-E377 PolarHBondContact O-N 3.1Å; E377-R380 PolarHBondContact O-N 3.31Å; E377-N381 WeakPolarHBondContact O-CB 3.36Å; E377-N381 PolarHBondContact O-N 2.89Å; E377-N381 PolarHBondContact O-ND2 2.94Å
378L93.1Very high87.2Confident116 Ų116108.5 Ų108.561%0.60752%0.521SS*.Hα-helixtrans-62.2-44173.9-68.5172.3000111.8K374 E375 R380 N381 L382K374-L378 WeakPolarHBondContact O-CG 3.45Å; K374-L378 PolarHBondContact O-N 3.05Å; E375-L378 WeakPolarHBondContact O-CB 3.25Å; E375-L378 PolarHBondContact O-N 3.22Å; L378-R380 PolarHBondContact O-N 3.36Å; L378-N381 PolarHBondContact O-N 3.44Å; L378-L382 WeakPolarHBondContact O-CB 3.45Å; L378-L382 PolarHBondContact O-N 3.45Å
379Y90.3Very high87.8Confident159 Ų159109.1 Ų109.162%0.62452%0.518SS*.Hα-helixtrans-64.4-37175.1-73-61.7000112.4E375 E376 R383E375-Y379 HydrophobicContact CB-CD2 4.44Å; E375-Y379 HydrophobicContact CB-CE2 4.22Å; E375-Y379 WeakPolarHBondContact O-CD2 3.34Å; E375-Y379 PolarHBondContact O-N 3.19Å; E376-Y379 PolarHBondContact O-N 3.48Å; Y379-R383 VanDerWaalsContact O-CB 3.27Å; Y379-R383 WeakPolarHBondContact O-CB 3.24Å; Y379-R383 PolarHBondContact O-N 3.39Å
380R92.4Very high88.2Confident158 Ų158112 Ų11260%0.59653%0.527SS*.Hα-helixtrans-65.1-41.4173-77.7175.5178.4-120.31.6111.9E376 E377 L378 R383 T384E376-R380 WeakPolarHBondContact O-CB 3.43Å; E376-R380 VanDerWaalsContact O-CG 3.3Å; E376-R380 WeakPolarHBondContact O-CG 3.36Å; E376-R380 PolarHBondContact O-N 3.14Å; E376-R380 IonicContact OE1-CZ 3.81Å; E376-R380 IonicContact OE1-NE 3.45Å; E376-R380 PolarHBondContact OE1-NE 3.4Å; E376-R380 IonicContact OE1-NH2 3.11Å; E376-R380 PolarHBondContact OE1-NH2 3.29Å; E377-R380 PolarHBondContact O-N 3.31Å; L378-R380 PolarHBondContact O-N 3.36Å; R380-R383 PolarHBondContact O-N 3.3Å; R380-T384 WeakPolarHBondContact O-CB 3.25Å; R380-T384 PolarHBondContact O-N 2.91Å; R380-T384 PolarHBondContact O-OG1 3.45Å
381N91.1Very high88.1Confident102 Ų102116.8 Ų116.855%0.54554%0.54SS..Hα-helixtrans-64.8-48.6176.9-70.1-22.8000110.8E377 L378 R383 T384 Q385E377-N381 WeakPolarHBondContact O-CB 3.36Å; E377-N381 PolarHBondContact O-N 2.89Å; E377-N381 PolarHBondContact O-ND2 2.94Å; L378-N381 PolarHBondContact O-N 3.44Å; N381-R383 VanDerWaalsContact C-N 3.34Å; N381-R383 PolarHBondContact O-N 3.3Å; N381-T384 WeakPolarHBondContact O-CB 3.43Å; N381-T384 PolarHBondContact O-N 2.93Å; N381-T384 VanDerWaalsContact O-N 3.09Å; N381-Q385 PolarHBondContact O-N 3.09Å
382L93.4Very high87.8Confident89 Ų89120 Ų12047%0.46656%0.556SS.*Hα-helixtrans-57.7-44.8175.6-176.765.1000111.9L378 T384 Q385 L386L378-L382 WeakPolarHBondContact O-CB 3.45Å; L378-L382 PolarHBondContact O-N 3.45Å; L382-T384 VanDerWaalsContact C-N 3.3Å; L382-T384 PolarHBondContact O-N 2.88Å; L382-Q385 PolarHBondContact O-N 2.9Å; L382-L386 HydrophobicContact CG-CD1 4.33Å; L382-L386 WeakPolarHBondContact O-CG 3.22Å; L382-L386 PolarHBondContact O-N 3.42Å
383R92.6Very high87.2Confident187 Ų187120.1 Ų120.171%0.70656%0.559SS**Hα-helixtrans-66.4-31.2177.3-164.8174.1-169.8176.23.5112.7Y379 R380 N381 R387Y379-R383 VanDerWaalsContact O-CB 3.27Å; Y379-R383 WeakPolarHBondContact O-CB 3.24Å; Y379-R383 PolarHBondContact O-N 3.39Å; R380-R383 PolarHBondContact O-N 3.3Å; N381-R383 VanDerWaalsContact C-N 3.34Å; N381-R383 PolarHBondContact O-N 3.3Å; R383-R387 WeakPolarHBondContact O-CB 3.45Å; R383-R387 PolarHBondContact O-N 3.31Å; R383-R387 VanDerWaalsContact O-N 3.14Å
384T90.1Very high86.7Confident91 Ų91121.1 Ų121.156%0.55857%0.565SS**Hα-helixtrans-72.6-41.3174.6-58.60000111.2R380 N381 L382 R387 A388R380-T384 WeakPolarHBondContact O-CB 3.25Å; R380-T384 PolarHBondContact O-N 2.91Å; R380-T384 PolarHBondContact O-OG1 3.45Å; N381-T384 WeakPolarHBondContact O-CB 3.43Å; N381-T384 PolarHBondContact O-N 2.93Å; N381-T384 VanDerWaalsContact O-N 3.09Å; L382-T384 VanDerWaalsContact C-N 3.3Å; L382-T384 PolarHBondContact O-N 2.88Å; T384-R387 PolarHBondContact O-N 3.1Å; T384-A388 PolarHBondContact O-N 2.93Å
385Q89.6Confident85.5Confident131 Ų131119 Ų11961%0.61257%0.565SS**Hα-helixtrans-63.7-45.8175.1-171.3177.99.600111.7N381 L382 R387 A388 Q389N381-Q385 PolarHBondContact O-N 3.09Å; L382-Q385 PolarHBondContact O-N 2.9Å; Q385-R387 VanDerWaalsContact C-N 3.34Å; Q385-R387 PolarHBondContact O-N 2.68Å; Q385-A388 WeakPolarHBondContact O-CB 3.36Å; Q385-A388 PolarHBondContact O-N 3.14Å; Q385-A388 VanDerWaalsContact O-N 3.12Å; Q385-Q389 PolarHBondContact O-N 3.26Å
386L88.8Confident84.1Confident98 Ų98119 Ų11951%0.51358%0.576SS.*Hα-helixtrans-59.9-42.2174.7-73.9170.6000112L382 A388 Q389 E390L382-L386 HydrophobicContact CG-CD1 4.33Å; L382-L386 WeakPolarHBondContact O-CG 3.22Å; L382-L386 PolarHBondContact O-N 3.42Å; L386-A388 VanDerWaalsContact C-N 3.33Å; L386-A388 PolarHBondContact O-N 3.28Å; L386-Q389 PolarHBondContact O-N 3.23Å; L386-E390 VanDerWaalsContact O-CB 3.29Å; L386-E390 WeakPolarHBondContact O-CB 3.17Å; L386-E390 PolarHBondContact O-N 2.83Å
387R88.3Confident82.4Confident135 Ų135120 Ų12051%0.50959%0.591SS.*Hα-helixtrans-64.6-34.9174.2-178-177.6-69.8-171.9-4.3112.7R383 T384 Q385 R391R383-R387 WeakPolarHBondContact O-CB 3.45Å; R383-R387 PolarHBondContact O-N 3.31Å; R383-R387 VanDerWaalsContact O-N 3.14Å; T384-R387 PolarHBondContact O-N 3.1Å; Q385-R387 VanDerWaalsContact C-N 3.34Å; Q385-R387 PolarHBondContact O-N 2.68Å; R387-R391 WeakPolarHBondContact O-CG 3.44Å; R387-R391 PolarHBondContact O-N 2.9Å; R387-R391 VanDerWaalsContact O-N 3.1Å
388A85.9Confident80.4Confident56 Ų56121.6 Ų121.646%0.46360%0.603SS.*Hα-helixtrans-69.4-42.6175.600000111.3T384 Q385 L386 R391 L392T384-A388 PolarHBondContact O-N 2.93Å; Q385-A388 WeakPolarHBondContact O-CB 3.36Å; Q385-A388 PolarHBondContact O-N 3.14Å; Q385-A388 VanDerWaalsContact O-N 3.12Å; L386-A388 VanDerWaalsContact C-N 3.33Å; L386-A388 PolarHBondContact O-N 3.28Å; A388-R391 PolarHBondContact O-N 2.88Å; A388-L392 PolarHBondContact O-N 3.03Å
389Q85.4Confident77.8Confident108 Ų108122 Ų12251%0.50561%0.612SS.*Hα-helixtrans-64.8-43.3174.9-173.5177.72.400111.9Q385 L386 R391 L392 Q393Q385-Q389 PolarHBondContact O-N 3.26Å; L386-Q389 PolarHBondContact O-N 3.23Å; Q389-R391 VanDerWaalsContact C-N 3.33Å; Q389-R391 PolarHBondContact O-N 2.97Å; Q389-L392 WeakPolarHBondContact O-CB 3.3Å; Q389-L392 PolarHBondContact O-N 2.96Å; Q389-L392 VanDerWaalsContact O-N 3.14Å; Q389-Q393 WeakPolarHBondContact O-CG 3.46Å; Q389-Q393 PolarHBondContact O-N 3.26Å
390E84.2Confident75.2Confident113 Ų113119.9 Ų119.953%0.52862%0.619SS.*Hα-helixtrans-57.1-44.9173.4178.2-177.2-161.200111.3L386 L392 Q393 N394L386-E390 VanDerWaalsContact O-CB 3.29Å; L386-E390 WeakPolarHBondContact O-CB 3.17Å; L386-E390 PolarHBondContact O-N 2.83Å; E390-L392 VanDerWaalsContact C-N 3.33Å; E390-L392 PolarHBondContact O-N 3.5Å; E390-Q393 PolarHBondContact O-N 3.41Å; E390-N394 WeakPolarHBondContact CG-ND2 3.44Å; E390-N394 VanDerWaalsContact O-CB 3.27Å; E390-N394 WeakPolarHBondContact O-CB 3.46Å; E390-N394 PolarHBondContact O-N 3.27Å; E390-N394 PolarHBondContact O-ND2 3.1Å
391R77.9Confident72.7Confident173 Ų173124 Ų12465%0.65364%0.635SS**Hα-helixtrans-62.7-37.3174.8-77.2171.8172.7162.8-6.3113.2R387 A388 Q389 S395R387-R391 WeakPolarHBondContact O-CG 3.44Å; R387-R391 PolarHBondContact O-N 2.9Å; R387-R391 VanDerWaalsContact O-N 3.1Å; A388-R391 PolarHBondContact O-N 2.88Å; Q389-R391 VanDerWaalsContact C-N 3.33Å; Q389-R391 PolarHBondContact O-N 2.97Å; R391-S395 PolarHBondContact O-N 3.15Å; R391-S395 VanDerWaalsContact O-N 3.13Å; R391-S395 PolarHBondContact O-OG 2.72Å
392L76Confident70.1Confident128 Ų128124 Ų12467%0.6764%0.642SS**Hα-helixtrans-69.9-33.5176.7-168.374.3000112.5A388 Q389 E390 S395A388-L392 PolarHBondContact O-N 3.03Å; Q389-L392 WeakPolarHBondContact O-CB 3.3Å; Q389-L392 PolarHBondContact O-N 2.96Å; Q389-L392 VanDerWaalsContact O-N 3.14Å; E390-L392 VanDerWaalsContact C-N 3.33Å; E390-L392 PolarHBondContact O-N 3.5Å; L392-S395 PolarHBondContact O-OG 3.22Å
393Q72.1Confident67.1Low143 Ų143124.3 Ų124.367%0.66866%0.658SS**Hα-helixtrans-78-34.3175.4-65.9-65.5-24.400112Q389 E390 S395Q389-Q393 WeakPolarHBondContact O-CG 3.46Å; Q389-Q393 PolarHBondContact O-N 3.26Å; E390-Q393 PolarHBondContact O-N 3.41Å; Q393-S395 VanDerWaalsContact C-N 3.33Å
394N72.3Confident64.4Low121 Ų121127.8 Ų127.865%0.64767%0.671SS**Hα-helixtrans-79.5-11.4178.7-69.2-18.4000113.5E390 S396E390-N394 WeakPolarHBondContact CG-ND2 3.44Å; E390-N394 VanDerWaalsContact O-CB 3.27Å; E390-N394 WeakPolarHBondContact O-CB 3.46Å; E390-N394 PolarHBondContact O-N 3.27Å; E390-N394 PolarHBondContact O-ND2 3.1Å; N394-S396 PolarHBondContact O-N 2.68Å
395S61.2Low61.7Low70 Ų70127 Ų12749%0.4968%0.681SS.*SBendtrans-77.296.3168.954.70000111R391 L392 Q393R391-S395 PolarHBondContact O-N 3.15Å; R391-S395 VanDerWaalsContact O-N 3.13Å; R391-S395 PolarHBondContact O-OG 2.72Å; L392-S395 PolarHBondContact O-OG 3.22Å; Q393-S395 VanDerWaalsContact C-N 3.33Å
396S59.8Low59Low103 Ų103131.9 Ų131.972%0.7269%0.694SS**PPolyproline II helixtrans-59.4135.3172.5-175.70000111.4N394 L398N394-S396 PolarHBondContact O-N 2.68Å; S396-L398 PolarHBondContact O-N 3.02Å
397P55Low56.4Low115 Ų115138.9 Ų138.975%0.74771%0.714SS**PPolyproline II helixtrans-67.6121.7173.8-13.827.8000110.5
398L48.8Very low54Low158 Ų158138.9 Ų138.983%0.82772%0.724SS**PPolyproline II helixtrans-64.6142162.4-68.6174.7000109.2S396 C400S396-L398 PolarHBondContact O-N 3.02Å; L398-C400 VanDerWaalsContact C-N 3.34Å; L398-C400 PolarHBondContact O-N 3.46Å
399P38.5Very low51.9Low123 Ų123141.9 Ų141.980%0.79974%0.739SS**  trans-72.387.9-177.629.4-34.8000110.8R401P399-R401 PolarHBondContact O-N 2.97Å
400C36.3Very low49.4Very low116 Ų116148.4 Ų148.478%0.78476%0.759SS**  trans-63.8114.9169-171.30000108.9L398 S402L398-C400 VanDerWaalsContact C-N 3.34Å; L398-C400 PolarHBondContact O-N 3.46Å; C400-S402 PolarHBondContact O-N 3.41Å
401R38.4Very low47Very low245 Ų245148.7 Ų148.793%0.92577%0.772SS**  trans-67.795.4175.1-69.9-179.3-179.2-108.52.3108.8P399 A403P399-R401 PolarHBondContact O-N 2.97Å; R401-A403 PolarHBondContact O-N 3.4Å
402S36.8Very low45.3Very low100 Ų100146.4 Ų146.470%0.69978%0.78SS**  trans-71.1114.9177.246.40000111C400C400-S402 PolarHBondContact O-N 3.41Å
403A31.9Very low43.2Very low96 Ų96148.9 Ų148.979%0.79379%0.788SS**  trans-66.3141.3160.200000109.2R401R401-A403 PolarHBondContact O-N 3.4Å
404W34.3Very low41.5Very low260 Ų260151.6 Ų151.699%0.98580%0.8SS**  trans-78.8131.9-171-67.664.4000111
405G33.9Very low39.8Very low75 Ų75150 Ų15077%0.77380%0.804SS**  trans176.447.8-178.100000115.8
406R32.9Very low38.6Very low234 Ų234153 Ų15388%0.88382%0.819SS**  trans-71.3132.6171.1-66.6-170.2-167.8-83.81.9110.6
407R35.5Very low37.9Very low244 Ų244157 Ų15792%0.92182%0.824SS**  trans-140.6121.2150.8-148.1176-80.9-175.1-3.5107.9
408N36Very low37.1Very low135 Ų135159.6 Ų159.672%0.72283%0.83SS**PPolyproline II helixtrans-82.8147.1-165-50-38000112.1
409P43.7Very low36.6Very low120 Ų120161 Ų16178%0.77983%0.83SS**PPolyproline II helixtrans-85.7134.6145.131.9-25.5000109.9
410R32.5Very low36.3Very low245 Ų245160.9 Ų160.993%0.92583%0.83SS**PPolyproline II helixtrans-83.9133.3167-70.5177.4176.4169.3-2.3108.7
411C33Very low36.4Very low119 Ų119164 Ų16480%0.80483%0.83SS**  trans-124.9150158.5-74.90000108.9
412P42.7Very low36.3Very low125 Ų125160.8 Ų160.881%0.81283%0.825SS**  trans-81.7135.8-169.831.6-33.8000113.4
413E31.1Very low36.4Very low180 Ų180165.7 Ų165.784%0.84183%0.834SS**  trans17.8109.3139.7-166.9159.5-145.900119.3
414Q36.4Very low36.4Very low199 Ų199167.3 Ų167.393%0.9383%0.834SS**  trans-147.7123.8135.6-114.4168.857.700110.2
415A36.8Very low36.4Very low87 Ų87166.9 Ų166.972%0.71983%0.832SS**  trans-98.1117.1-172.700000111.5
416V37.1Very low36.5Very low135 Ų135169 Ų16982%0.81883%0.834SS**  trans-124.3108.9159.8-176.30000109.4
417K44.7Very low36.6Very low187 Ų187169.3 Ų169.381%0.81384%0.835SS**  trans-76.3118.7177-63.4161.7-178.9164.60109
418L38.4Very low36.6Very low168 Ų168163.8 Ų163.888%0.8883%0.829SS**  trans-122122.2156.1-73.5179000110.5
419K37Very low36.9Very low189 Ų189162.7 Ų162.782%0.82283%0.829SS**  trans-87.3118.1-175.3-60.9165.8-178.81680108.6
420C32.8Very low36.8Very low119 Ų119163.5 Ų163.580%0.80483%0.827SS**  trans-116.7111.7157.5-168.50000108.8
421K38Very low37.2Very low181 Ų181161.2 Ų161.279%0.78782%0.824SS**  trans-93.5120.1176.4-68.6-177.5177.5-179.70108.7
422H37.1Very low38.1Very low178 Ų178164 Ų16482%0.82483%0.825SS**  trans-121117.6153.6-95.278.7000108.9
423K38.3Very low38.6Very low203 Ų203165.2 Ų165.288%0.88383%0.825SS**  trans-82.8116.5175.7-74.1176.9174.4177.30108.4
424V32.5Very low39.5Very low131 Ų131162.7 Ų162.779%0.79482%0.817SS**  trans-116.8121.5156.4178.80000107.2C426V424-C426 PolarHBondContact O-N 2.97Å
425R34.9Very low40.3Very low250 Ų250158.9 Ų158.994%0.94381%0.809SS**  trans-75115.4173.2-86.2-178162.5-169.2-3108.8
426C35.7Very low41.1Very low121 Ų121161.3 Ų161.382%0.81881%0.806SS**  trans-127.3139.5147.9-79.60000108V424V424-C426 PolarHBondContact O-N 2.97Å
427R33.3Very low41.7Very low240 Ų240164.1 Ų164.191%0.90680%0.801SS**PPolyproline II helixtrans-72.3143.5-174.2-67.4176.6171.4-171.2-3.6110.7P429R427-P429 WeakPolarHBondContact O-CD 3.36Å
428T37.2Very low41.9Very low128 Ų128165.2 Ų165.279%0.78580%0.802SS**PPolyproline II helixtrans-72.2128.3156.3-20.40000108.9
429P41.8Very low42.5Very low112 Ų112165 Ų16573%0.72780%0.797SS**PPolyproline II helixtrans-89.7116147.2-3.824.4000106.9R427R427-P429 WeakPolarHBondContact O-CD 3.36Å
430D41.6Very low43.1Very low136 Ų136163 Ų16373%0.72779%0.788SS**  trans-96114.4172.1-164.815.1000107
431F40.8Very low43.7Very low197 Ų197164.2 Ų164.286%0.86478%0.781SS**  trans-148.7117.3167.7-82.6-67.9000109
432E52.2Low44.2Very low178 Ų178162.7 Ų162.783%0.83278%0.781SS**  trans-61.9175.5161.9-56.9-174135.600110.4
433D52.6Low44.8Very low150 Ų150158 Ų15880%0.80277%0.768SS**  trans71.593.5-177.4-59.9-26.6000117.9
434L51Low45.2Very low128 Ų128155.9 Ų155.967%0.6776%0.761SS**  -178.788.7129.9-99.6155.1000113.6R437L434-R437 HydrophobicContact CD2-CG 3.96Å
435P52.5Low45.9Very low119 Ų119158 Ų15877%0.77376%0.762SS**SBendtrans-116.229.5172.340.3-30.5000115.1
436E52.9Low46.5Very low138 Ų138154.7 Ų154.765%0.64576%0.755SS**SBendtrans-120-25.9-179.8-74.5-156.5140.100116.6Y438E436-Y438 PolarHBondContact O-N 3.43Å
437R51Low46.6Very low193 Ų193153.6 Ų153.673%0.72875%0.748SS**THydrogen-bonded Turntrans-77.7-16.7-168.3-67-171.5179.9-172.71115L434L434-R437 HydrophobicContact CD2-CG 3.96Å
438Y48.9Very low47.3Very low211 Ų211147.9 Ų147.983%0.82774%0.742SS**THydrogen-bonded Turntrans-94.7-13.6-177.2-72.4-76000115E436E436-Y438 PolarHBondContact O-N 3.43Å
439Q50.3Low48Very low164 Ų164151 Ų15177%0.76675%0.745SS**THydrogen-bonded Turntrans-83-22.2-178.6-163.3164.61.300113.2
440K49.3Very low48.1Very low147 Ų147153.1 Ų153.164%0.63975%0.75SS**G310 helixtrans-79-18.3-175.6-66.5-177.6179.6174.20114.8S443K440-S443 PolarHBondContact O-OG 3Å
441H45.8Very low48.5Very low144 Ų144154.7 Ų154.767%0.66776%0.757SS**G310 helixtrans-87.6-0.6-179.6-76.6-66.3000115.2
442L47.7Very low48.6Very low148 Ų148151.4 Ų151.478%0.77575%0.753SS**G310 helixtrans-101.2-5.9-179.5-70.1174.9000114.5
443S50.9Low48.5Very low80 Ų80149.3 Ų149.356%0.55975%0.752SS**SBendtrans-88.6-25.9-179.237.90000114.6K440 H445K440-S443 PolarHBondContact O-OG 3Å; S443-H445 PolarHBondContact O-N 3.27Å
444E47.1Very low48.4Very low158 Ų158147.8 Ų147.874%0.73875%0.752SS**THydrogen-bonded Turntrans-83.9-11.1-166.4-63.1-175.5157.900115
445H46.4Very low48.8Very low177 Ų177150.7 Ų150.782%0.81976%0.759SS**THydrogen-bonded Turntrans-97.221.4179.2-74.5-53000115S443S443-H445 PolarHBondContact O-N 3.27Å
446K46.8Very low48.9Very low179 Ų179150.3 Ų150.378%0.77876%0.757SS**  trans-99.568.8173.2-69.4-174.5-179.4177.80112.1
447S39Very low48.9Very low98 Ų98151.5 Ų151.569%0.68576%0.76SS**  trans-71.1132161.156.20000109.8K449S447-K449 PolarHBondContact O-N 3.18Å
448P46.9Very low48.8Very low120 Ų120148.8 Ų148.878%0.77976%0.76SS**  trans-68.4115.9174.727.3-32.3000109L450P448-L450 PolarHBondContact O-N 2.88Å; P448-L450 VanDerWaalsContact O-N 3.15Å
449K53.1Low48.8Very low194 Ų194146.1 Ų146.184%0.84376%0.759SS**  trans-66.6113.9169.1-68.1-179.9-178.7177.70107.7S447 L451S447-K449 PolarHBondContact O-N 3.18Å; K449-L451 PolarHBondContact O-N 2.72Å
450L43.3Very low48.6Very low157 Ų157146.1 Ų146.182%0.82276%0.759SS**  trans-51.6135.5173.8-66.2168.9000109.6P448 T452P448-L450 PolarHBondContact O-N 2.88Å; P448-L450 VanDerWaalsContact O-N 3.15Å; L450-T452 PolarHBondContact O-N 3.47Å
451L50Low48.9Very low168 Ų168144 Ų14488%0.8877%0.769SS**  trans-65.299.2173.7-82.689.2000109.3K449 V453K449-L451 PolarHBondContact O-N 2.72Å; L451-V453 PolarHBondContact O-N 3.05Å
452T43Very low49.1Very low128 Ų128140.2 Ų140.279%0.78576%0.759SS**  trans-67.599.2161.742.80000108.5L450 C454L450-T452 PolarHBondContact O-N 3.47Å; T452-C454 PolarHBondContact O-N 3.5Å
453V49.6Very low49.6Very low134 Ų134137.3 Ų137.381%0.81275%0.749SS**  trans-53.9122.1168.3175.70000108.5L451 K455L451-V453 PolarHBondContact O-N 3.05Å; V453-K455 PolarHBondContact O-N 2.97Å
454C51.6Low49.7Very low119 Ų119139.4 Ų139.480%0.80475%0.749SS**  trans-65.6105.4173.8-69.10000109.3T452T452-C454 PolarHBondContact O-N 3.5Å
455K59.3Low50.2Low189 Ų189134.7 Ų134.782%0.82274%0.737SS**PPolyproline II helixtrans-62126.9163-156.1176.4-172.6-177.30107V453 F457V453-K455 PolarHBondContact O-N 2.97Å; K455-F457 PolarHBondContact O-N 2.99Å
456P54Low50.9Low110 Ų110129 Ų12971%0.71472%0.718SS**PPolyproline II helixtrans-58.6134.5179.223.8-32.9000109.4
457F52.1Low51.8Low163 Ų163124.7 Ų124.772%0.71570%0.702SS**PPolyproline II helixtrans-94.9118.5178.256.3-87.9000109K455 L459K455-F457 PolarHBondContact O-N 2.99Å; F457-L459 HydrophobicContact CD2-CD2 3.95Å; F457-L459 HydrophobicContact CD2-CG 3.97Å; F457-L459 HydrophobicContact CE2-CD1 4.13Å; F457-L459 HydrophobicContact CE2-CD2 3.82Å; F457-L459 HydrophobicContact CE2-CG 3.83Å; F457-L459 PolarHBondContact O-N 2.89Å
458D50.2Low53.3Low137 Ų137127 Ų12773%0.73370%0.7SS**PPolyproline II helixtrans-70.5119.4175.9-64.5-49.1000109.9H460D458-H460 PolarHBondContact O-N 2.92Å
459L48.8Very low54.6Low155 Ų155130.3 Ų130.381%0.81270%0.697SS**  trans-78.132.6177.5-77.6174.8000113.4F457F457-L459 HydrophobicContact CD2-CD2 3.95Å; F457-L459 HydrophobicContact CD2-CG 3.97Å; F457-L459 HydrophobicContact CE2-CD1 4.13Å; F457-L459 HydrophobicContact CE2-CD2 3.82Å; F457-L459 HydrophobicContact CE2-CG 3.83Å; F457-L459 PolarHBondContact O-N 2.89Å
460H46Very low55.8Low164 Ų164127 Ų12776%0.75969%0.685SS**SBendtrans-84.3126.2160.3-67.4-68.9000108.1D458 S462D458-H460 PolarHBondContact O-N 2.92Å; H460-S462 PolarHBondContact O-N 3.38Å
461A55.3Low57.6Low103 Ų103126.1 Ų126.185%0.85167%0.674SS**  trans-54.799-169.100000112.4
462S50Low59Low64 Ų64123 Ų12345%0.44866%0.657SS.*  trans-62.4129.8177.9179.20000110.1H460 H464 A465H460-S462 PolarHBondContact O-N 3.38Å; S462-H464 PolarHBondContact O-N 3.46Å; S462-A465 PolarHBondContact O-N 3.18Å
463P57.2Low61Low87 Ų87122.4 Ų122.457%0.56565%0.648SS**THydrogen-bonded Turntrans-55.1-19176.7-27.735.6000114.1A465 S466 I467P463-A465 PolarHBondContact O-N 2.91Å; P463-S466 PolarHBondContact O-N 3.45Å; P463-S466 PolarHBondContact O-OG 2.91Å; P463-I467 WeakPolarHBondContact O-CG1 3.46Å; P463-I467 PolarHBondContact O-N 3.11Å; P463-I467 VanDerWaalsContact O-N 3.1Å
464H53.8Low62.6Low124 Ų124118.4 Ų118.457%0.57463%0.629SS**Hα-helixtrans-66-17.4174.8-62.1-46.5000114.2S462 K468S462-H464 PolarHBondContact O-N 3.46Å; H464-K468 WeakPolarHBondContact O-CB 3.26Å; H464-K468 VanDerWaalsContact O-CG 3.24Å; H464-K468 WeakPolarHBondContact O-CG 3.46Å; H464-K468 PolarHBondContact O-N 3.19Å; H464-K468 VanDerWaalsContact O-N 3.15Å
465A58.7Low64.1Low58 Ų58117 Ų11748%0.47961%0.614SS.*Hα-helixtrans-75.9-36.2173.700000112.6S462 P463 R469S462-A465 PolarHBondContact O-N 3.18Å; P463-A465 PolarHBondContact O-N 2.91Å; A465-R469 WeakPolarHBondContact O-CG 3.22Å; A465-R469 PolarHBondContact O-N 2.91Å
466S60.9Low65Low59 Ų59112.1 Ų112.141%0.41360%0.596SS.*Hα-helixtrans-72.1-44.7171.552.50000110.8P463 K468 R469 E470P463-S466 PolarHBondContact O-N 3.45Å; P463-S466 PolarHBondContact O-OG 2.91Å; S466-K468 VanDerWaalsContact C-N 3.26Å; S466-K468 PolarHBondContact O-N 3.41Å; S466-R469 CarbonylContact O-C 3.42Å; S466-R469 WeakPolarHBondContact O-CA 3.18Å; S466-R469 WeakPolarHBondContact O-CB 3.48Å; S466-R469 PolarHBondContact O-N 2.87Å; S466-E470 PolarHBondContact O-N 3.45Å
467I64.3Low66.2Low87 Ų87113.5 Ų113.545%0.44659%0.593SS.*Hα-helixtrans-56.7-38.4177.5-65.4163.3000111.8P463 K471P463-I467 WeakPolarHBondContact O-CG1 3.46Å; P463-I467 PolarHBondContact O-N 3.11Å; P463-I467 VanDerWaalsContact O-N 3.1Å; I467-K471 VanDerWaalsContact O-CB 3.32Å; I467-K471 WeakPolarHBondContact O-CB 3.4Å; I467-K471 PolarHBondContact O-N 3.15Å
468K70.9Confident67.4Low148 Ų148106.8 Ų106.864%0.64357%0.568SS**Hα-helixtrans-67.3-37.5174.4-77173.6-177.4-1790112.8H464 S466 I472H464-K468 WeakPolarHBondContact O-CB 3.26Å; H464-K468 VanDerWaalsContact O-CG 3.24Å; H464-K468 WeakPolarHBondContact O-CG 3.46Å; H464-K468 PolarHBondContact O-N 3.19Å; H464-K468 VanDerWaalsContact O-N 3.15Å; S466-K468 VanDerWaalsContact C-N 3.26Å; S466-K468 PolarHBondContact O-N 3.41Å; K468-I472 WeakPolarHBondContact O-CD1 3.33Å; K468-I472 VanDerWaalsContact O-CG1 3.25Å; K468-I472 WeakPolarHBondContact O-CG1 3.47Å; K468-I472 PolarHBondContact O-N 3.27Å; K468-I472 VanDerWaalsContact O-N 3.12Å
469R74.8Confident68.5Low188 Ų188104.8 Ų104.871%0.70956%0.557SS**Hα-helixtrans-70.4-44.5175.8-72.6176.2177.1178.2-0.6111.6A465 S466 K471 I472 L473A465-R469 WeakPolarHBondContact O-CG 3.22Å; A465-R469 PolarHBondContact O-N 2.91Å; S466-R469 CarbonylContact O-C 3.42Å; S466-R469 WeakPolarHBondContact O-CA 3.18Å; S466-R469 WeakPolarHBondContact O-CB 3.48Å; S466-R469 PolarHBondContact O-N 2.87Å; R469-K471 VanDerWaalsContact C-N 3.31Å; R469-K471 PolarHBondContact O-N 3.05Å; R469-I472 PolarHBondContact O-N 3.01Å; R469-L473 WeakPolarHBondContact O-CG 3.3Å; R469-L473 PolarHBondContact O-N 3.44Å
470E77.6Confident69.6Low126 Ų126102.7 Ų102.759%0.58954%0.543SS*.Hα-helixtrans-59.3-42174-73175.1147.800111.3S466 I472 L473 A474S466-E470 PolarHBondContact O-N 3.45Å; E470-I472 PolarHBondContact O-N 2.92Å; E470-L473 PolarHBondContact O-N 3.12Å; E470-A474 VanDerWaalsContact O-CB 3.32Å; E470-A474 WeakPolarHBondContact O-CB 3.45Å; E470-A474 PolarHBondContact O-N 3.33Å
471K82.4Confident70.6Confident138 Ų138100 Ų10060%0.653%0.53SS*.Hα-helixtrans-63.6-41.4175.7-169.4173.9-178.3-178.80112.7I467 R469 A474 D475I467-K471 VanDerWaalsContact O-CB 3.32Å; I467-K471 WeakPolarHBondContact O-CB 3.4Å; I467-K471 PolarHBondContact O-N 3.15Å; R469-K471 VanDerWaalsContact C-N 3.31Å; R469-K471 PolarHBondContact O-N 3.05Å; K471-A474 PolarHBondContact O-N 3.36Å; K471-D475 WeakPolarHBondContact O-CB 3.3Å; K471-D475 PolarHBondContact O-N 3.21Å
472I79.2Confident71.3Confident103 Ų103102.3 Ų102.353%0.52852%0.521SS..Hα-helixtrans-63.8-42175.1-69.1162.3000110.9K468 R469 E470 D475 I476K468-I472 WeakPolarHBondContact O-CD1 3.33Å; K468-I472 VanDerWaalsContact O-CG1 3.25Å; K468-I472 WeakPolarHBondContact O-CG1 3.47Å; K468-I472 PolarHBondContact O-N 3.27Å; K468-I472 VanDerWaalsContact O-N 3.12Å; R469-I472 PolarHBondContact O-N 3.01Å; E470-I472 PolarHBondContact O-N 2.92Å; I472-D475 PolarHBondContact O-N 3.11Å; I472-I476 HydrophobicContact CG2-CD1 3.93Å; I472-I476 WeakPolarHBondContact O-CD1 3.32Å; I472-I476 VanDerWaalsContact O-CG1 3.25Å; I472-I476 WeakPolarHBondContact O-CG1 3.31Å; I472-I476 PolarHBondContact O-N 2.91Å
473L84.1Confident72.1Confident114 Ų114104.4 Ų104.460%0.59753%0.527SS*.Hα-helixtrans-65.5-39.5176.4-68.8170.8000111.9R469 E470 I476 E477R469-L473 WeakPolarHBondContact O-CG 3.3Å; R469-L473 PolarHBondContact O-N 3.44Å; E470-L473 PolarHBondContact O-N 3.12Å; L473-I476 PolarHBondContact O-N 2.87Å; L473-E477 WeakPolarHBondContact O-CB 3.43Å; L473-E477 PolarHBondContact O-N 3.17Å
474A84.1Confident72.2Confident50 Ų50109.5 Ų109.541%0.41354%0.54SS..Hα-helixtrans-69.4-35.9176.300000113E470 K471 A478E470-A474 VanDerWaalsContact O-CB 3.32Å; E470-A474 WeakPolarHBondContact O-CB 3.45Å; E470-A474 PolarHBondContact O-N 3.33Å; K471-A474 PolarHBondContact O-N 3.36Å; A474-A478 WeakPolarHBondContact O-CB 3.36Å; A474-A478 PolarHBondContact O-N 3.05Å
475D82.3Confident72.6Confident90 Ų90106.3 Ų106.348%0.48153%0.526SS..Hα-helixtrans-66.7-40.4172.7-76.7-23.6000110.6K471 I472 A478 D479K471-D475 WeakPolarHBondContact O-CB 3.3Å; K471-D475 PolarHBondContact O-N 3.21Å; I472-D475 PolarHBondContact O-N 3.11Å; D475-A478 PolarHBondContact O-N 3.34Å; D475-D479 PolarHBondContact O-N 3.43Å
476I78.7Confident72.7Confident86 Ų86110.3 Ų110.344%0.44154%0.544SS..Hα-helixtrans-62.5-47173.5-68.2163.7000111.3I472 L473 A478 D479 E480I472-I476 HydrophobicContact CG2-CD1 3.93Å; I472-I476 WeakPolarHBondContact O-CD1 3.32Å; I472-I476 VanDerWaalsContact O-CG1 3.25Å; I472-I476 WeakPolarHBondContact O-CG1 3.31Å; I472-I476 PolarHBondContact O-N 2.91Å; L473-I476 PolarHBondContact O-N 2.87Å; I476-A478 VanDerWaalsContact C-N 3.32Å; I476-A478 PolarHBondContact O-N 2.94Å; I476-D479 PolarHBondContact O-N 2.8Å; I476-E480 PolarHBondContact O-N 3.36Å
477E78.6Confident72.8Confident140 Ų140112.9 Ų112.965%0.65455%0.545SS*.Hα-helixtrans-61.7-40176.7-175.8173-157.900111.5L473 E480 E481L473-E477 WeakPolarHBondContact O-CB 3.43Å; L473-E477 PolarHBondContact O-N 3.17Å; E477-E480 PolarHBondContact O-N 2.86Å; E477-E481 VanDerWaalsContact O-CB 3.32Å; E477-E481 WeakPolarHBondContact O-CB 3.46Å; E477-E481 PolarHBondContact O-N 3.28Å
478A77.7Confident71.9Confident22 Ų22119.8 Ų119.818%0.18257%0.565CS.*Hα-helixtrans-66.6-36.6176.500000113A474 D475 I476 E481 K482A474-A478 WeakPolarHBondContact O-CB 3.36Å; A474-A478 PolarHBondContact O-N 3.05Å; D475-A478 PolarHBondContact O-N 3.34Å; I476-A478 VanDerWaalsContact C-N 3.32Å; I476-A478 PolarHBondContact O-N 2.94Å; A478-E481 PolarHBondContact O-N 2.91Å; A478-K482 VanDerWaalsContact O-CB 3.3Å; A478-K482 WeakPolarHBondContact O-CB 3.25Å; A478-K482 WeakPolarHBondContact O-CD 3.49Å; A478-K482 VanDerWaalsContact O-CG 3.22Å; A478-K482 WeakPolarHBondContact O-CG 3.32Å; A478-K482 PolarHBondContact O-N 3.03Å
479D73.3Confident71.2Confident95 Ų95117.2 Ų117.251%0.50856%0.564SS.*Hα-helixtrans-69.5-40.7175.1-84.5-8.4000111.6D475 I476 E481 K482 L483D475-D479 PolarHBondContact O-N 3.43Å; I476-D479 PolarHBondContact O-N 2.8Å; D479-E481 VanDerWaalsContact C-N 3.27Å; D479-E481 PolarHBondContact O-N 3.39Å; D479-K482 PolarHBondContact O-N 3.13Å; D479-L483 HydrophobicContact CB-CD1 4.1Å; D479-L483 VanDerWaalsContact O-CB 3.31Å; D479-L483 WeakPolarHBondContact O-CB 3.3Å; D479-L483 WeakPolarHBondContact O-CG 3.44Å; D479-L483 PolarHBondContact O-N 2.83Å
480E71.4Confident70.1Confident111 Ų111116.4 Ų116.452%0.51956%0.562SS.*Hα-helixtrans-64.4-29.7172-71.4-170175.100113.1I476 E477I476-E480 PolarHBondContact O-N 3.36Å; E477-E480 PolarHBondContact O-N 2.86Å
481E67.6Low69.2Low106 Ų106118.7 Ų118.750%0.49558%0.577SS.*Hα-helixtrans-76.7-40.6176.4153.5138.4-82.200113.4E477 A478 D479 R495E477-E481 VanDerWaalsContact O-CB 3.32Å; E477-E481 WeakPolarHBondContact O-CB 3.46Å; E477-E481 PolarHBondContact O-N 3.28Å; A478-E481 PolarHBondContact O-N 2.91Å; D479-E481 VanDerWaalsContact C-N 3.27Å; D479-E481 PolarHBondContact O-N 3.39Å; E481-R495 PolarHBondContact O-NH2 2.99Å; E481-R495 IonicContact OE1-CZ 2.99Å; E481-R495 IonicContact OE1-NH1 2.92Å; E481-R495 PolarHBondContact OE1-NH1 3.44Å; E481-R495 IonicContact OE1-NH2 2.82Å; E481-R495 PolarHBondContact OE1-NH2 3.14Å
482K69.8Low68Low152 Ų152115 Ų11566%0.66157%0.569SS**Hα-helixtrans-95.7-31.8-169-68.4168.9-172.1166.70114.3A478 D479A478-K482 VanDerWaalsContact O-CB 3.3Å; A478-K482 WeakPolarHBondContact O-CB 3.25Å; A478-K482 WeakPolarHBondContact O-CD 3.49Å; A478-K482 VanDerWaalsContact O-CG 3.22Å; A478-K482 WeakPolarHBondContact O-CG 3.32Å; A478-K482 PolarHBondContact O-N 3.03Å; D479-K482 PolarHBondContact O-N 3.13Å
483L66.4Low66.9Low109 Ų109114.8 Ų114.857%0.57157%0.574SS**PPolyproline II helixtrans-86.5134.5-173.4-60177000112D479D479-L483 HydrophobicContact CB-CD1 4.1Å; D479-L483 VanDerWaalsContact O-CB 3.31Å; D479-L483 WeakPolarHBondContact O-CB 3.3Å; D479-L483 WeakPolarHBondContact O-CG 3.44Å; D479-L483 PolarHBondContact O-N 2.83Å
484K59.6Low65.7Low194 Ų194116 Ų11684%0.84357%0.571SS**PPolyproline II helixtrans-85.7138.6174.8-65.8-178.5-178.21770110T486K484-T486 PolarHBondContact O-N 3.11Å
485E62.6Low64.3Low57 Ų57119.5 Ų119.527%0.26657%0.574SS.*PPolyproline II helixtrans-72.3117.4-177.6-171.9132-110.800111.7R487 R494E485-R487 VanDerWaalsContact C-N 3.35Å; E485-R487 HydrophobicContact CG-CB 4.37Å; E485-R487 PolarHBondContact O-N 3.19Å; E485-R494 HydrophobicContact CB-CB 4.44Å; E485-R494 IonicContact OE1-CZ 2.61Å; E485-R494 IonicContact OE1-NE 3.21Å; E485-R494 PolarHBondContact OE1-NE 2.87Å; E485-R494 IonicContact OE1-NH2 2.65Å; E485-R494 PolarHBondContact OE1-NH2 3.37Å
486T60Low62.8Low142 Ų142124.7 Ų124.787%0.87159%0.592SS**  trans-89.710-173.75.40000114.5K484K484-T486 PolarHBondContact O-N 3.11Å
487R62.9Low61.2Low113 Ų113125.5 Ų125.543%0.42661%0.605SS.*  trans-107.7109.2-163.9-155.6169.3177122.1-14.4112.1H74 E485H74-R487 VanDerWaalsContact C-NH2 3.35Å; H74-R487 PolarHBondContact CD2-NH1 3.49Å; H74-R487 PolarHBondContact O-NH2 2.93Å; E485-R487 VanDerWaalsContact C-N 3.35Å; E485-R487 HydrophobicContact CG-CB 4.37Å; E485-R487 PolarHBondContact O-N 3.19Å
488W45.8Very low59.7Low231 Ų231123.6 Ų123.688%0.87561%0.605SS**THydrogen-bonded Turntrans-57.9146.7170.2-89.878.8000111.2
489P55.6Low58Low94 Ų94129.1 Ų129.161%0.6164%0.636SS**THydrogen-bonded Turncis-107.321.612.340.9-34.7000115.3
490Y52.7Low56.4Low172 Ų172135.5 Ų135.568%0.67565%0.653SS**  trans-117.9117-178.3-62-73.3000112.2S492Y490-S492 PolarHBondContact O-N 3.41Å; Y490-S492 VanDerWaalsContact O-N 3.07Å
491L58.1Low55.4Low173 Ų173141.8 Ų141.891%0.90667%0.672SS**  trans-82.246.5169.7-69.4172.3000111.7
492S57.3Low54.2Low60 Ų60139.7 Ų139.742%0.4267%0.673SS.*  trans-89.7136.317246.20000110.3Y490Y490-S492 PolarHBondContact O-N 3.41Å; Y490-S492 VanDerWaalsContact O-N 3.07Å
493P56.6Low53Low100 Ų100136.3 Ų136.365%0.64968%0.681SS**  trans-58.3139.8163.7-20.933000110.1R495P493-R495 PolarHBondContact O-N 3.44Å
494R58.2Low52.1Low140 Ų140136.7 Ų136.753%0.52869%0.688SS.*SBendtrans-60-17.8-177.5-176.2173.3-76-177.9-1.6113.9E485 K496E485-R494 HydrophobicContact CB-CB 4.44Å; E485-R494 IonicContact OE1-CZ 2.61Å; E485-R494 IonicContact OE1-NE 3.21Å; E485-R494 PolarHBondContact OE1-NE 2.87Å; E485-R494 IonicContact OE1-NH2 2.65Å; E485-R494 PolarHBondContact OE1-NH2 3.37Å; R494-K496 PolarHBondContact O-N 3.43Å
495R54.8Low51.6Low123 Ų123136.5 Ų136.546%0.46469%0.687SS.*SBendtrans-55.4127.5172.9-60.1-167.9-166.8-120.311.1110.6E481 P493 S497E481-R495 PolarHBondContact O-NH2 2.99Å; E481-R495 IonicContact OE1-CZ 2.99Å; E481-R495 IonicContact OE1-NH1 2.92Å; E481-R495 PolarHBondContact OE1-NH1 3.44Å; E481-R495 IonicContact OE1-NH2 2.82Å; E481-R495 PolarHBondContact OE1-NH2 3.14Å; P493-R495 PolarHBondContact O-N 3.44Å; R495-S497 PolarHBondContact O-N 2.97Å
496K51.6Low51Low198 Ų198138.9 Ų138.986%0.86171%0.708SS**PPolyproline II helixtrans-47.9116.8141.8-64.3-78.2-177173.90105.2R494 P498R494-K496 PolarHBondContact O-N 3.43Å; K496-P498 WeakPolarHBondContact O-CD 3.41Å
497S45.7Very low50.7Low104 Ų104138 Ų13873%0.72770%0.701SS**PPolyproline II helixtrans-56.4121.3170.149.60000106.3R495 V499R495-S497 PolarHBondContact O-N 2.97Å; S497-V499 PolarHBondContact O-N 3.29Å
498P46.2Very low49.9Very low100 Ų100137.5 Ų137.565%0.64971%0.713SS**PPolyproline II helixtrans-53.5132.4160.2-16.430000104.4K496 R500K496-P498 WeakPolarHBondContact O-CD 3.41Å; P498-R500 PolarHBondContact O-N 3.31Å
499V42.1Very low50Low137 Ų137130.4 Ų130.483%0.8370%0.698SS**  trans-46114.7166.5170.80000105.2S497 R501S497-V499 PolarHBondContact O-N 3.29Å; V499-R501 PolarHBondContact O-N 3.48Å
500R40.4Very low49.9Very low230 Ų230133.1 Ų133.187%0.86871%0.707SS**  trans-63.190-175.9-106.6-169.7177.8-165.12.2106.9P498 A502P498-R500 PolarHBondContact O-N 3.31Å; R500-A502 PolarHBondContact O-N 2.82Å
501R49.2Very low50.3Low242 Ų242134.2 Ų134.291%0.91371%0.712SS**  trans-64.786.8139.8-72.2-152.4-78.8-152.6-1.9104.3V499 G503V499-R501 PolarHBondContact O-N 3.48Å; R501-G503 VanDerWaalsContact C-N 3.28Å; R501-G503 PolarHBondContact O-N 3.43Å
502A43.3Very low50.7Low62 Ų62130.9 Ų130.951%0.51270%0.703SS.*  trans-59.699.9169.800000106.2R500 V504R500-A502 PolarHBondContact O-N 2.82Å; A502-V504 PolarHBondContact O-N 3.09Å; A502-V504 VanDerWaalsContact O-N 3.17Å; A502-V504 VanDerWaalsContact O-O 3.06Å
503G45.1Very low51.3Low81 Ų81133.4 Ų133.484%0.83572%0.718SS**  trans-72.38.4175.100000113.3R501 K505R501-G503 VanDerWaalsContact C-N 3.28Å; R501-G503 PolarHBondContact O-N 3.43Å; G503-K505 PolarHBondContact O-N 3.05Å
504V47.4Very low51.9Low118 Ų118134.6 Ų134.672%0.71573%0.725SS**SBendtrans-70.8109.4153.2-1770000105A502 P506A502-V504 PolarHBondContact O-N 3.09Å; A502-V504 VanDerWaalsContact O-N 3.17Å; A502-V504 VanDerWaalsContact O-O 3.06Å; V504-P506 WeakPolarHBondContact O-CD 3.35Å
505K49Very low52.8Low189 Ų189133.2 Ų133.282%0.82273%0.732SS**PPolyproline II helixtrans-48.2116.3166.2-69.1179.7-179.6178.80106.5G503 V507G503-K505 PolarHBondContact O-N 3.05Å; K505-V507 PolarHBondContact O-N 3.25Å
506P48.8Very low53.8Low108 Ų108130 Ų13070%0.70173%0.727SS**PPolyproline II helixtrans-56.7132.6163.9-15.529.6000105.2V504V504-P506 WeakPolarHBondContact O-CD 3.35Å
507V54.7Low55.4Low122 Ų122125.6 Ų125.674%0.73972%0.717SS**PPolyproline II helixtrans-47.5128.2152172.60000105.1K505 C509K505-V507 PolarHBondContact O-N 3.25Å; V507-C509 PolarHBondContact O-N 2.92Å
508P45Very low57.4Low103 Ų103126.7 Ų126.767%0.66972%0.719SS**  trans-67.483.5-178.526.9-33.7000108.8N510P508-N510 VanDerWaalsContact C-N 3.33Å; P508-N510 PolarHBondContact O-N 2.86Å
509C47.9Very low59.4Low83 Ų83125.8 Ų125.856%0.56172%0.715SS**  trans-61.2103.7158.2-87.50000105.7V507 Y511V507-C509 PolarHBondContact O-N 2.92Å; C509-Y511 HydrophobicContact CB-CD2 3.52Å; C509-Y511 HydrophobicContact CB-CE2 3.95Å; C509-Y511 HydrophobicContact CB-CG 4.28Å; C509-Y511 PolarHBondContact O-N 2.95Å; C509-Y511 VanDerWaalsContact SG-CE2 3.57Å
510N53.6Low61.6Low151 Ų151120.9 Ų120.981%0.80769%0.687SS**  trans-69.538.3170.8-62.5-42.1000111.2P508 S512P508-N510 VanDerWaalsContact C-N 3.33Å; P508-N510 PolarHBondContact O-N 2.86Å; N510-S512 PolarHBondContact O-N 3.18Å
511Y60.4Low63.7Low195 Ų195115.9 Ų115.977%0.76567%0.668SS**  trans-86.9106.1171-61.6-45000107.5C509C509-Y511 HydrophobicContact CB-CD2 3.52Å; C509-Y511 HydrophobicContact CB-CE2 3.95Å; C509-Y511 HydrophobicContact CB-CG 4.28Å; C509-Y511 PolarHBondContact O-N 2.95Å; C509-Y511 VanDerWaalsContact SG-CE2 3.57Å
512S66.8Low65.7Low103 Ų103106 Ų10672%0.7264%0.642SS**  trans-44.2135.8164.3-570000109.6N510N510-S512 PolarHBondContact O-N 3.18Å
513P69.9Low68Low113 Ų113110.8 Ų110.873%0.73465%0.646SS**PPolyproline II helixtrans-49.3134.7175.6-2734.3000110.1V515P513-V515 PolarHBondContact O-N 3.15Å; P513-V515 VanDerWaalsContact O-N 3.1Å
514P70.3Confident70.1Confident124 Ų124110.3 Ų110.381%0.80562%0.622SS**PPolyproline II helixtrans-54.8123.5-174.421.7-33000109.1P516P514-P516 WeakPolarHBondContact O-CD 3.45Å
515V76.3Confident72.2Confident112 Ų112109.6 Ų109.668%0.67961%0.611SS**PPolyproline II helixtrans-54.1118.4-171-178.80000108.3P513 T517P513-V515 PolarHBondContact O-N 3.15Å; P513-V515 VanDerWaalsContact O-N 3.1Å; V515-T517 PolarHBondContact O-N 3.08Å
516P76.4Confident74.2Confident54 Ų54103.3 Ų103.335%0.35159%0.594SS.*PPolyproline II helixtrans-62.3119.8-171.320.1-30.7000109P514 R521P514-P516 WeakPolarHBondContact O-CD 3.45Å; P516-R521 HydrophobicContact CB-CG 4.08Å; P516-R521 HydrophobicContact CG-CG 4.11Å; P516-R521 WeakPolarHBondContact O-CG 3.41Å; P516-R521 PolarHBondContact O-NE 3.44Å
517T85.4Confident76.4Confident106 Ų106102.8 Ų102.865%0.6559%0.589SS**PPolyproline II helixtrans-52.9151.2178.5-39.20000109.8V515 S519 S520 R521V515-T517 PolarHBondContact O-N 3.08Å; T517-S519 PolarHBondContact O-N 3.25Å; T517-S520 WeakPolarHBondContact O-CA 3.44Å; T517-S520 WeakPolarHBondContact O-CB 3.32Å; T517-S520 PolarHBondContact O-N 3.2Å; T517-R521 PolarHBondContact O-N 3.29Å
518V86.3Confident78.3Confident128 Ų128103 Ų10378%0.77658%0.577SS**Hα-helixtrans-49.4-40.2-178.5-177.60000112.2S520 R521 G522V518-S520 PolarHBondContact O-N 3.19Å; V518-R521 PolarHBondContact O-N 2.86Å; V518-G522 PolarHBondContact O-N 3.02Å
519S88.8Confident80.6Confident81 Ų81105.5 Ų105.557%0.56657%0.573SS**Hα-helixtrans-60.9-41173.3179.50000113.7T517 G522 R523T517-S519 PolarHBondContact O-N 3.25Å; S519-G522 PolarHBondContact O-N 3.24Å; S519-R523 WeakPolarHBondContact O-CG 3.15Å; S519-R523 PolarHBondContact O-N 3.18Å
520S87.8Confident82.8Confident33 Ų33103.7 Ų103.723%0.23156%0.561CS.*Hα-helixtrans-66.5-44.5176.4-153.50000111.5T517 V518 G522 R523 E524T517-S520 WeakPolarHBondContact O-CA 3.44Å; T517-S520 WeakPolarHBondContact O-CB 3.32Å; T517-S520 PolarHBondContact O-N 3.2Å; V518-S520 PolarHBondContact O-N 3.19Å; S520-G522 VanDerWaalsContact C-N 3.32Å; S520-G522 PolarHBondContact O-N 3.01Å; S520-R523 PolarHBondContact O-N 2.91Å; S520-E524 WeakPolarHBondContact O-CG 3.41Å; S520-E524 PolarHBondContact O-N 3.02Å
521R86.4Confident84.7Confident126 Ų126100.7 Ų100.748%0.47555%0.545SS..Hα-helixtrans-59-43.4175-62.5-175.4-175.6-144.3-2.7111.7P516 T517 V518 E524 Q525P516-R521 HydrophobicContact CB-CG 4.08Å; P516-R521 HydrophobicContact CG-CG 4.11Å; P516-R521 WeakPolarHBondContact O-CG 3.41Å; P516-R521 PolarHBondContact O-NE 3.44Å; T517-R521 PolarHBondContact O-N 3.29Å; V518-R521 PolarHBondContact O-N 2.86Å; R521-E524 PolarHBondContact O-N 3.26Å; R521-Q525 WeakPolarHBondContact O-CB 3.41Å; R521-Q525 WeakPolarHBondContact O-CG 3.48Å; R521-Q525 PolarHBondContact O-N 3.48Å
522G91.2Very high86.3Confident35 Ų3596.5 Ų96.536%0.36153%0.532SS..Hα-helixtrans-61.9-43.617600000113V518 S519 S520 Q525 A526V518-G522 PolarHBondContact O-N 3.02Å; S519-G522 PolarHBondContact O-N 3.24Å; S520-G522 VanDerWaalsContact C-N 3.32Å; S520-G522 PolarHBondContact O-N 3.01Å; G522-Q525 PolarHBondContact O-N 2.86Å; G522-A526 WeakPolarHBondContact O-CB 3.27Å; G522-A526 PolarHBondContact O-N 3.44Å
523R91.1Very high87.6Confident161 Ų16197.2 Ų97.261%0.60852%0.524SS*.Hα-helixtrans-62.8-44.7174.3-71.2-177.6-56.6-175.75.8112S519 S520 A526 V527S519-R523 WeakPolarHBondContact O-CG 3.15Å; S519-R523 PolarHBondContact O-N 3.18Å; S520-R523 PolarHBondContact O-N 2.91Å; R523-A526 PolarHBondContact O-N 2.84Å; R523-V527 WeakPolarHBondContact O-CG2 3.46Å; R523-V527 PolarHBondContact O-N 3.35Å
524E88.6Confident88.6Confident72 Ų7298.4 Ų98.434%0.33652%0.517SS..Hα-helixtrans-64.6-40177-68.4173.2-141.500112.5S520 R521 A526 V527 R528S520-E524 WeakPolarHBondContact O-CG 3.41Å; S520-E524 PolarHBondContact O-N 3.02Å; R521-E524 PolarHBondContact O-N 3.26Å; E524-A526 VanDerWaalsContact C-N 3.35Å; E524-V527 PolarHBondContact O-N 3.35Å; E524-R528 VanDerWaalsContact CB-NH1 3.28Å; E524-R528 WeakPolarHBondContact O-CG 3.48Å; E524-R528 PolarHBondContact O-N 2.94Å; E524-R528 IonicContact OE2-CZ 2.79Å; E524-R528 IonicContact OE2-NH1 2.65Å; E524-R528 PolarHBondContact OE2-NH1 3.36Å; E524-R528 VanDerWaalsContact OE2-NH1 3.1Å; E524-R528 IonicContact OE2-NH2 2.79Å; E524-R528 PolarHBondContact OE2-NH2 3.14Å
525Q91Very high89.8Confident102 Ų10298.1 Ų98.148%0.47750%0.504SS..Hα-helixtrans-63.5-40.2174.9-75.6177.2-6.400111.7R521 G522 R528 R529R521-Q525 WeakPolarHBondContact O-CB 3.41Å; R521-Q525 WeakPolarHBondContact O-CG 3.48Å; R521-Q525 PolarHBondContact O-N 3.48Å; G522-Q525 PolarHBondContact O-N 2.86Å; Q525-R528 PolarHBondContact O-N 3.12Å; Q525-R529 WeakPolarHBondContact O-CG 3.44Å; Q525-R529 PolarHBondContact O-N 3.1Å
526A92.7Very high90.6Very high57 Ų5797.5 Ų97.547%0.47150%0.495SS..Hα-helixtrans-63.9-38.6173.200000112.3G522 R523 E524 S530G522-A526 WeakPolarHBondContact O-CB 3.27Å; G522-A526 PolarHBondContact O-N 3.44Å; R523-A526 PolarHBondContact O-N 2.84Å; E524-A526 VanDerWaalsContact C-N 3.35Å; A526-S530 VanDerWaalsContact O-CB 3.31Å; A526-S530 WeakPolarHBondContact O-CB 3.38Å; A526-S530 PolarHBondContact O-N 2.9Å
527V94.2Very high91.4Very high97 Ų9799.1 Ų99.159%0.58850%0.5SS*.Hα-helixtrans-66.6-41.9174.51700000111.7R523 E524 S530 L531R523-V527 WeakPolarHBondContact O-CG2 3.46Å; R523-V527 PolarHBondContact O-N 3.35Å; E524-V527 PolarHBondContact O-N 3.35Å; V527-S530 PolarHBondContact O-N 3.46Å; V527-L531 WeakPolarHBondContact O-CB 3.34Å; V527-L531 PolarHBondContact O-N 2.88Å
528R93.5Very high91.8Very high127 Ų12799.6 Ų99.648%0.47950%0.495SS..Hα-helixtrans-60.9-51.9175.6-72.3175.9-172.4106.38.6111E524 Q525 S530 L531 E532E524-R528 VanDerWaalsContact CB-NH1 3.28Å; E524-R528 WeakPolarHBondContact O-CG 3.48Å; E524-R528 PolarHBondContact O-N 2.94Å; E524-R528 IonicContact OE2-CZ 2.79Å; E524-R528 IonicContact OE2-NH1 2.65Å; E524-R528 PolarHBondContact OE2-NH1 3.36Å; E524-R528 VanDerWaalsContact OE2-NH1 3.1Å; E524-R528 IonicContact OE2-NH2 2.79Å; E524-R528 PolarHBondContact OE2-NH2 3.14Å; Q525-R528 PolarHBondContact O-N 3.12Å; R528-S530 PolarHBondContact O-N 3.15Å; R528-L531 WeakPolarHBondContact O-CB 3.38Å; R528-L531 PolarHBondContact O-N 3.49Å; R528-E532 WeakPolarHBondContact O-CG 3.27Å; R528-E532 PolarHBondContact O-N 3.48Å
529R93.7Very high92.2Very high155 Ų15597.5 Ų97.559%0.58548%0.476SS*.Hα-helixtrans-57-46.2175.6-70.8176-175.41661.9112.6Q525 L531 E532 E533Q525-R529 WeakPolarHBondContact O-CG 3.44Å; Q525-R529 PolarHBondContact O-N 3.1Å; R529-L531 PolarHBondContact O-N 2.95Å; R529-E532 PolarHBondContact O-N 3.25Å; R529-E533 WeakPolarHBondContact O-CB 3.26Å; R529-E533 VanDerWaalsContact O-CG 3.31Å; R529-E533 WeakPolarHBondContact O-CG 3.38Å; R529-E533 PolarHBondContact O-N 3.43Å
530S94.6Very high92.5Very high46 Ų4698.3 Ų98.332%0.32247%0.471SS..Hα-helixtrans-64.8-27.5177.7-173.50000113.4A526 V527 R528 K534A526-S530 VanDerWaalsContact O-CB 3.31Å; A526-S530 WeakPolarHBondContact O-CB 3.38Å; A526-S530 PolarHBondContact O-N 2.9Å; V527-S530 PolarHBondContact O-N 3.46Å; R528-S530 PolarHBondContact O-N 3.15Å; S530-K534 WeakPolarHBondContact O-CD 3.42Å; S530-K534 VanDerWaalsContact O-CG 3.23Å; S530-K534 WeakPolarHBondContact O-CG 3.3Å; S530-K534 PolarHBondContact O-N 2.89Å
531L93.7Very high92.8Very high88 Ų88104.7 Ų104.746%0.46149%0.49SS..Hα-helixtrans-77-40.9174.7-165.6159.5000110.9V527 R528 R529 K534 K535V527-L531 WeakPolarHBondContact O-CB 3.34Å; V527-L531 PolarHBondContact O-N 2.88Å; R528-L531 WeakPolarHBondContact O-CB 3.38Å; R528-L531 PolarHBondContact O-N 3.49Å; R529-L531 PolarHBondContact O-N 2.95Å; L531-K534 PolarHBondContact O-N 3.28Å; L531-K535 HydrophobicContact CD2-CD 3.93Å; L531-K535 HydrophobicContact CD2-CG 4.28Å; L531-K535 WeakPolarHBondContact O-CG 3.5Å; L531-K535 PolarHBondContact O-N 2.88Å
532E93.6Very high93.2Very high107 Ų107102.8 Ų102.850%0.549%0.489SS..Hα-helixtrans-61.2-48.6172.9-70.8152.4-161.800111.5R528 R529 K534 K535 M536R528-E532 WeakPolarHBondContact O-CG 3.27Å; R528-E532 PolarHBondContact O-N 3.48Å; R529-E532 PolarHBondContact O-N 3.25Å; E532-K534 VanDerWaalsContact C-N 3.31Å; E532-K534 PolarHBondContact O-N 3.14Å; E532-K535 WeakPolarHBondContact O-CB 3.36Å; E532-K535 PolarHBondContact O-N 2.89Å; E532-K535 VanDerWaalsContact O-N 3.1Å; E532-M536 WeakPolarHBondContact O-CG 3.49Å; E532-M536 PolarHBondContact O-N 3.01Å
533E93.8Very high93.4Very high117 Ų117107.7 Ų107.755%0.54750%0.497SS..Hα-helixtrans-54.9-43.6173.3-73.8165.5-165.500112.2R529 M536 L537R529-E533 WeakPolarHBondContact O-CB 3.26Å; R529-E533 VanDerWaalsContact O-CG 3.31Å; R529-E533 WeakPolarHBondContact O-CG 3.38Å; R529-E533 PolarHBondContact O-N 3.43Å; E533-M536 PolarHBondContact O-N 3.35Å; E533-L537 VanDerWaalsContact O-CG 3.32Å; E533-L537 WeakPolarHBondContact O-CG 3.32Å; E533-L537 PolarHBondContact O-N 3.02Å
534K92.6Very high93.7Very high138 Ų138104.5 Ų104.560%0.649%0.491SS*.Hα-helixtrans-64-40.4176.6-78.1170-175.3172.60112.4S530 L531 E532 L537 E538S530-K534 WeakPolarHBondContact O-CD 3.42Å; S530-K534 VanDerWaalsContact O-CG 3.23Å; S530-K534 WeakPolarHBondContact O-CG 3.3Å; S530-K534 PolarHBondContact O-N 2.89Å; L531-K534 PolarHBondContact O-N 3.28Å; E532-K534 VanDerWaalsContact C-N 3.31Å; E532-K534 PolarHBondContact O-N 3.14Å; K534-L537 PolarHBondContact O-N 3.07Å; K534-E538 WeakPolarHBondContact O-CB 3.29Å; K534-E538 PolarHBondContact O-N 2.91Å
535K94.2Very high94Very high119 Ų119104.9 Ų104.952%0.51750%0.495SS..Hα-helixtrans-62.6-46.8175.1-76.2177169.8-179.90111.3L531 E532 L537 E538 E539L531-K535 HydrophobicContact CD2-CD 3.93Å; L531-K535 HydrophobicContact CD2-CG 4.28Å; L531-K535 WeakPolarHBondContact O-CG 3.5Å; L531-K535 PolarHBondContact O-N 2.88Å; E532-K535 WeakPolarHBondContact O-CB 3.36Å; E532-K535 PolarHBondContact O-N 2.89Å; E532-K535 VanDerWaalsContact O-N 3.1Å; K535-L537 VanDerWaalsContact C-N 3.35Å; K535-L537 PolarHBondContact O-N 3.27Å; K535-E538 PolarHBondContact O-N 3.42Å; K535-E538 VanDerWaalsContact O-N 3.11Å; K535-E539 WeakPolarHBondContact O-CG 3.39Å; K535-E539 PolarHBondContact O-N 2.88Å
536M92.9Very high94.3Very high99 Ų99103.5 Ų103.549%0.48849%0.494SS..Hα-helixtrans-58.4-46.3177.1-65.8-56.7-63.200111.5E532 E533 E538 E539 E540E532-M536 WeakPolarHBondContact O-CG 3.49Å; E532-M536 PolarHBondContact O-N 3.01Å; E533-M536 PolarHBondContact O-N 3.35Å; M536-E538 VanDerWaalsContact C-N 3.31Å; M536-E538 PolarHBondContact O-N 3.44Å; M536-E539 PolarHBondContact O-N 2.93Å; M536-E540 WeakPolarHBondContact O-CG 3.19Å; M536-E540 PolarHBondContact O-N 3.24Å
537L92.9Very high94.5Very high87 Ų87106.9 Ų106.946%0.45550%0.498SS..Hα-helixtrans-65.2-31.1176.5-69.5171.2000113.2E533 K534 K535 R541E533-L537 VanDerWaalsContact O-CG 3.32Å; E533-L537 WeakPolarHBondContact O-CG 3.32Å; E533-L537 PolarHBondContact O-N 3.02Å; K534-L537 PolarHBondContact O-N 3.07Å; K535-L537 VanDerWaalsContact C-N 3.35Å; K535-L537 PolarHBondContact O-N 3.27Å; L537-R541 WeakPolarHBondContact O-CD 3.29Å; L537-R541 WeakPolarHBondContact O-CG 3.45Å; L537-R541 PolarHBondContact O-N 3.38Å; L537-R541 VanDerWaalsContact O-N 3.12Å
538E94Very high94.5Very high116 Ų116107.5 Ų107.554%0.54249%0.494SS..Hα-helixtrans-73.7-41174.6-174.4168.3-169.300111.7K534 K535 M536 R541 N542K534-E538 WeakPolarHBondContact O-CB 3.29Å; K534-E538 PolarHBondContact O-N 2.91Å; K535-E538 PolarHBondContact O-N 3.42Å; K535-E538 VanDerWaalsContact O-N 3.11Å; M536-E538 VanDerWaalsContact C-N 3.31Å; M536-E538 PolarHBondContact O-N 3.44Å; E538-R541 PolarHBondContact O-N 3.49Å; E538-N542 WeakPolarHBondContact O-CB 3.44Å; E538-N542 VanDerWaalsContact O-CG 3.29Å; E538-N542 PolarHBondContact O-N 3.24Å; E538-N542 PolarHBondContact O-ND2 3.17Å; E538-N542 VanDerWaalsContact O-ND2 3.15Å
539E95.3Very high94.7Very high84 Ų84107.4 Ų107.439%0.39350%0.497SS..Hα-helixtrans-61.2-44.3171.1-74.9-176.3-14900112.1K535 M536 R541 N542 R543K535-E539 WeakPolarHBondContact O-CG 3.39Å; K535-E539 PolarHBondContact O-N 2.88Å; M536-E539 PolarHBondContact O-N 2.93Å; E539-R541 PolarHBondContact O-N 2.93Å; E539-N542 CarbonylContact O-C 3.24Å; E539-N542 PolarHBondContact O-N 3.21Å; E539-R543 WeakPolarHBondContact O-CB 3.33Å; E539-R543 VanDerWaalsContact O-CG 3.25Å; E539-R543 WeakPolarHBondContact O-CG 3.46Å; E539-R543 PolarHBondContact O-N 2.84Å; E539-R543 IonicContact OE2-NH2 2.75Å; E539-R543 PolarHBondContact OE2-NH2 3.07Å; E539-R543 VanDerWaalsContact OE2-NH2 3.13Å
540E94.9Very high94.8Very high98 Ų98105.3 Ų105.346%0.45849%0.494SS..Hα-helixtrans-59.4-45.4174.6-76.8175.5-175.900111.9M536 N542 R543 I544M536-E540 WeakPolarHBondContact O-CG 3.19Å; M536-E540 PolarHBondContact O-N 3.24Å; E540-N542 VanDerWaalsContact C-N 3.31Å; E540-N542 PolarHBondContact O-N 2.8Å; E540-R543 PolarHBondContact O-N 2.91Å; E540-I544 VanDerWaalsContact O-CG1 3.3Å; E540-I544 WeakPolarHBondContact O-CG1 3.28Å; E540-I544 PolarHBondContact O-N 2.96Å
541R93.3Very high94.9Very high168 Ų168111.7 Ų111.763%0.63451%0.511SS*.Hα-helixtrans-58.7-44173.4-73.3164.8-175.3-176.62.2111.3L537 E538 E539 I544 L545L537-R541 WeakPolarHBondContact O-CD 3.29Å; L537-R541 WeakPolarHBondContact O-CG 3.45Å; L537-R541 PolarHBondContact O-N 3.38Å; L537-R541 VanDerWaalsContact O-N 3.12Å; E538-R541 PolarHBondContact O-N 3.49Å; E539-R541 PolarHBondContact O-N 2.93Å; R541-I544 PolarHBondContact O-N 3.47Å; R541-L545 WeakPolarHBondContact O-CB 3.45Å; R541-L545 VanDerWaalsContact O-CG 3.29Å; R541-L545 WeakPolarHBondContact O-CG 3.35Å; R541-L545 PolarHBondContact O-N 3.3Å
542N95.7Very high95Very high85 Ų85113.4 Ų113.446%0.45552%0.518SS..Hα-helixtrans-64.2-41177-73.6-34.6000111.9E538 E539 E540 I544 L545 T546E538-N542 WeakPolarHBondContact O-CB 3.44Å; E538-N542 VanDerWaalsContact O-CG 3.29Å; E538-N542 PolarHBondContact O-N 3.24Å; E538-N542 PolarHBondContact O-ND2 3.17Å; E538-N542 VanDerWaalsContact O-ND2 3.15Å; E539-N542 CarbonylContact O-C 3.24Å; E539-N542 PolarHBondContact O-N 3.21Å; E540-N542 VanDerWaalsContact C-N 3.31Å; E540-N542 PolarHBondContact O-N 2.8Å; N542-I544 VanDerWaalsContact C-N 3.35Å; N542-I544 PolarHBondContact O-N 3.22Å; N542-L545 PolarHBondContact O-N 3.41Å; N542-T546 WeakPolarHBondContact O-CG2 3.47Å; N542-T546 PolarHBondContact O-N 2.75Å; N542-T546 PolarHBondContact O-OG1 3.28Å
543R96.3Very high95.2Very high139 Ų139114.5 Ų114.553%0.52552%0.521SS..Hα-helixtrans-63-37173.3-68.7170.3-164-161.57.9112.2E539 E540 T546 K547E539-R543 WeakPolarHBondContact O-CB 3.33Å; E539-R543 VanDerWaalsContact O-CG 3.25Å; E539-R543 WeakPolarHBondContact O-CG 3.46Å; E539-R543 PolarHBondContact O-N 2.84Å; E539-R543 IonicContact OE2-NH2 2.75Å; E539-R543 PolarHBondContact OE2-NH2 3.07Å; E539-R543 VanDerWaalsContact OE2-NH2 3.13Å; E540-R543 PolarHBondContact O-N 2.91Å; R543-T546 WeakPolarHBondContact CA-OG1 3.48Å; R543-T546 PolarHBondContact O-OG1 2.89Å; R543-K547 WeakPolarHBondContact O-CB 3.44Å; R543-K547 VanDerWaalsContact O-CG 3.28Å; R543-K547 WeakPolarHBondContact O-CG 3.49Å; R543-K547 PolarHBondContact O-N 2.67Å; R543-K547 VanDerWaalsContact O-N 3.14Å
544I96.3Very high95.4Very high94 Ų94114 Ų11448%0.48252%0.519SS..Hα-helixtrans-68.7-44.1174.3-68.4163.3000110.4E540 R541 N542 T546 K547 Q548E540-I544 VanDerWaalsContact O-CG1 3.3Å; E540-I544 WeakPolarHBondContact O-CG1 3.28Å; E540-I544 PolarHBondContact O-N 2.96Å; R541-I544 PolarHBondContact O-N 3.47Å; N542-I544 VanDerWaalsContact C-N 3.35Å; N542-I544 PolarHBondContact O-N 3.22Å; I544-T546 PolarHBondContact O-N 3.09Å; I544-K547 PolarHBondContact O-N 3.39Å; I544-Q548 HydrophobicContact CG2-CG 4.49Å; I544-Q548 WeakPolarHBondContact O-CB 3.5Å; I544-Q548 WeakPolarHBondContact O-CG 3.35Å; I544-Q548 PolarHBondContact O-N 2.9Å
545L95.8Very high95.6Very high79 Ų79112.3 Ų112.341%0.41452%0.516SS..Hα-helixtrans-64.4-37.6177.8-72.4170.6000112.6R541 N542 K549R541-L545 WeakPolarHBondContact O-CB 3.45Å; R541-L545 VanDerWaalsContact O-CG 3.29Å; R541-L545 WeakPolarHBondContact O-CG 3.35Å; R541-L545 PolarHBondContact O-N 3.3Å; N542-L545 PolarHBondContact O-N 3.41Å; L545-K549 WeakPolarHBondContact O-CB 3.43Å; L545-K549 VanDerWaalsContact O-CG 3.27Å; L545-K549 WeakPolarHBondContact O-CG 3.5Å; L545-K549 PolarHBondContact O-N 2.86Å
546T96.1Very high95.7Very high74 Ų74112.6 Ų112.645%0.45452%0.519SS..Hα-helixtrans-68.4-43.5174.5540000111.5N542 R543 I544 Q548 K549 Q550N542-T546 WeakPolarHBondContact O-CG2 3.47Å; N542-T546 PolarHBondContact O-N 2.75Å; N542-T546 PolarHBondContact O-OG1 3.28Å; R543-T546 WeakPolarHBondContact CA-OG1 3.48Å; R543-T546 PolarHBondContact O-OG1 2.89Å; I544-T546 PolarHBondContact O-N 3.09Å; T546-Q548 VanDerWaalsContact C-N 3.34Å; T546-Q548 PolarHBondContact O-N 2.94Å; T546-K549 PolarHBondContact O-N 3.12Å; T546-Q550 WeakPolarHBondContact O-CG 3.38Å; T546-Q550 PolarHBondContact O-N 2.8Å
547K97Very high95.8Very high128 Ų128114.8 Ų114.856%0.55753%0.526SS*.Hα-helixtrans-59-41.7172.8-74.1176.7179.2-173.80112.3R543 I544 Q550 R551R543-K547 WeakPolarHBondContact O-CB 3.44Å; R543-K547 VanDerWaalsContact O-CG 3.28Å; R543-K547 WeakPolarHBondContact O-CG 3.49Å; R543-K547 PolarHBondContact O-N 2.67Å; R543-K547 VanDerWaalsContact O-N 3.14Å; I544-K547 PolarHBondContact O-N 3.39Å; K547-Q550 PolarHBondContact O-N 3.3Å; K547-R551 WeakPolarHBondContact O-CG 3.34Å; K547-R551 PolarHBondContact O-N 3.18Å
548Q95.1Very high96Very high110 Ų110116.2 Ų116.251%0.51453%0.533SS..Hα-helixtrans-63.5-44.3173.7-74.6177.2-0.900112.1I544 T546 Q550 R551 M552I544-Q548 HydrophobicContact CG2-CG 4.49Å; I544-Q548 WeakPolarHBondContact O-CB 3.5Å; I544-Q548 WeakPolarHBondContact O-CG 3.35Å; I544-Q548 PolarHBondContact O-N 2.9Å; T546-Q548 VanDerWaalsContact C-N 3.34Å; T546-Q548 PolarHBondContact O-N 2.94Å; Q548-Q550 VanDerWaalsContact C-N 3.32Å; Q548-Q550 PolarHBondContact O-N 3.43Å; Q548-R551 PolarHBondContact O-N 3.49Å; Q548-M552 WeakPolarHBondContact O-CB 3.25Å; Q548-M552 PolarHBondContact O-N 3.34Å
549K96.7Very high96Very high124 Ų124115.8 Ų115.854%0.53953%0.534SS..Hα-helixtrans-63-35175.5-74.4170.6-179177.70112.6L545 T546 K553L545-K549 WeakPolarHBondContact O-CB 3.43Å; L545-K549 VanDerWaalsContact O-CG 3.27Å; L545-K549 WeakPolarHBondContact O-CG 3.5Å; L545-K549 PolarHBondContact O-N 2.86Å; T546-K549 PolarHBondContact O-N 3.12Å; K549-K553 VanDerWaalsContact O-CG 3.3Å; K549-K553 WeakPolarHBondContact O-CG 3.19Å; K549-K553 PolarHBondContact O-N 2.89Å; K549-K553 VanDerWaalsContact O-N 3.11Å
550Q97.2Very high95.8Very high111 Ų111114.8 Ų114.852%0.51953%0.534SS..Hα-helixtrans-65.4-54.6173.7-74.8166.7-26.800111T546 K547 Q548 M552 K553 E554T546-Q550 WeakPolarHBondContact O-CG 3.38Å; T546-Q550 PolarHBondContact O-N 2.8Å; K547-Q550 PolarHBondContact O-N 3.3Å; Q548-Q550 VanDerWaalsContact C-N 3.32Å; Q548-Q550 PolarHBondContact O-N 3.43Å; Q550-M552 VanDerWaalsContact C-N 3.27Å; Q550-M552 PolarHBondContact O-N 3.26Å; Q550-K553 WeakPolarHBondContact O-CA 3.34Å; Q550-K553 WeakPolarHBondContact O-CB 3.44Å; Q550-K553 PolarHBondContact O-N 3.23Å; Q550-E554 PolarHBondContact O-N 3.43Å
551R96.5Very high95.6Very high180 Ų180114.2 Ų114.268%0.67954%0.537SS*.Hα-helixtrans-54.8-40.8176.4-70.8174.6178.8-173.2-1.7112.6K547 Q548 E554 L555K547-R551 WeakPolarHBondContact O-CG 3.34Å; K547-R551 PolarHBondContact O-N 3.18Å; Q548-R551 PolarHBondContact O-N 3.49Å; R551-E554 PolarHBondContact O-N 2.97Å; R551-L555 WeakPolarHBondContact O-CB 3.41Å; R551-L555 PolarHBondContact O-N 3.13Å
552M95.8Very high95.4Very high124 Ų124113.7 Ų113.761%0.61154%0.535SS*.Hα-helixtrans-65.5-39.7176.1-175175.466.900112.5Q548 Q550 Q556Q548-M552 WeakPolarHBondContact O-CB 3.25Å; Q548-M552 PolarHBondContact O-N 3.34Å; Q550-M552 VanDerWaalsContact C-N 3.27Å; Q550-M552 PolarHBondContact O-N 3.26Å; M552-Q556 WeakPolarHBondContact O-CB 3.43Å; M552-Q556 PolarHBondContact O-N 2.87Å
553K97.3Very high95Very high130 Ų130112.5 Ų112.557%0.56554%0.537SS*.Hα-helixtrans-67.3-37.4174.4-75.3173.7178.7-175.70112.2K549 Q550 Q556 K557K549-K553 VanDerWaalsContact O-CG 3.3Å; K549-K553 WeakPolarHBondContact O-CG 3.19Å; K549-K553 PolarHBondContact O-N 2.89Å; K549-K553 VanDerWaalsContact O-N 3.11Å; Q550-K553 WeakPolarHBondContact O-CA 3.34Å; Q550-K553 WeakPolarHBondContact O-CB 3.44Å; Q550-K553 PolarHBondContact O-N 3.23Å; K553-Q556 PolarHBondContact O-N 3.48Å; K553-K557 VanDerWaalsContact O-CG 3.3Å; K553-K557 WeakPolarHBondContact O-CG 3.48Å; K553-K557 PolarHBondContact O-N 2.82Å
554E96.9Very high94.5Very high107 Ų107111.1 Ų111.150%0.554%0.535SS..Hα-helixtrans-65.1-47.9174.7-73.1160-172.700111.1Q550 R551 Q556 K557 L558Q550-E554 PolarHBondContact O-N 3.43Å; R551-E554 PolarHBondContact O-N 2.97Å; E554-Q556 VanDerWaalsContact C-N 3.32Å; E554-Q556 PolarHBondContact O-N 2.97Å; E554-K557 WeakPolarHBondContact O-CB 3.36Å; E554-K557 PolarHBondContact O-N 2.77Å; E554-K557 VanDerWaalsContact O-N 3.15Å; E554-L558 WeakPolarHBondContact O-CG 3.43Å; E554-L558 PolarHBondContact O-N 2.92Å
555L96.7Very high93.8Very high102 Ų102110.7 Ų110.753%0.53455%0.546SS..Hα-helixtrans-58.4-43.8173.1-178.761.1000111.6R551 K557 L558 L559R551-L555 WeakPolarHBondContact O-CB 3.41Å; R551-L555 PolarHBondContact O-N 3.13Å; L555-K557 VanDerWaalsContact C-N 3.35Å; L555-K557 PolarHBondContact O-N 3.22Å; L555-L558 PolarHBondContact O-N 3.29Å; L555-L559 HydrophobicContact CD1-CD1 4.28Å; L555-L559 HydrophobicContact CD1-CG 4.25Å; L555-L559 HydrophobicContact CG-CD1 4.07Å; L555-L559 HydrophobicContact CG-CG 4.46Å; L555-L559 WeakPolarHBondContact O-CB 3.45Å; L555-L559 VanDerWaalsContact O-CG 3.32Å; L555-L559 WeakPolarHBondContact O-CG 3.36Å; L555-L559 PolarHBondContact O-N 2.73Å
556Q96.4Very high93.2Very high125 Ų125115 Ų11558%0.58456%0.558SS**Hα-helixtrans-61.1-41.3175.6-172.1-177.11700111.9M552 K553 E554 T560M552-Q556 WeakPolarHBondContact O-CB 3.43Å; M552-Q556 PolarHBondContact O-N 2.87Å; K553-Q556 PolarHBondContact O-N 3.48Å; E554-Q556 VanDerWaalsContact C-N 3.32Å; E554-Q556 PolarHBondContact O-N 2.97Å; Q556-T560 VanDerWaalsContact O-CB 3.3Å; Q556-T560 WeakPolarHBondContact O-CB 3.35Å; Q556-T560 PolarHBondContact O-N 3.47Å; Q556-T560 PolarHBondContact O-OG1 3.43Å
557K96.4Very high92.5Very high146 Ų146115.3 Ų115.364%0.63556%0.556SS**Hα-helixtrans-60.9-49.1173.9-74.9171.1179.7-178.10111K553 E554 L555 L559 T560 T561K553-K557 VanDerWaalsContact O-CG 3.3Å; K553-K557 WeakPolarHBondContact O-CG 3.48Å; K553-K557 PolarHBondContact O-N 2.82Å; E554-K557 WeakPolarHBondContact O-CB 3.36Å; E554-K557 PolarHBondContact O-N 2.77Å; E554-K557 VanDerWaalsContact O-N 3.15Å; L555-K557 VanDerWaalsContact C-N 3.35Å; L555-K557 PolarHBondContact O-N 3.22Å; K557-L559 PolarHBondContact O-N 3.43Å; K557-T560 CarbonylContact O-C 3.45Å; K557-T560 WeakPolarHBondContact O-CB 3.18Å; K557-T560 PolarHBondContact O-N 3.32Å; K557-T560 VanDerWaalsContact O-N 3.14Å; K557-T561 PolarHBondContact O-N 3.46Å; K557-T561 PolarHBondContact O-OG1 3.43Å
558L95.8Very high91.6Very high116 Ų116114 Ų11461%0.60756%0.564SS**Hα-helixtrans-62.5-41.3179.9-69.8172.2000112.7E554 L555 T560 T561 R562E554-L558 WeakPolarHBondContact O-CG 3.43Å; E554-L558 PolarHBondContact O-N 2.92Å; L555-L558 PolarHBondContact O-N 3.29Å; L558-T560 VanDerWaalsContact C-N 3.34Å; L558-T561 WeakPolarHBondContact CA-OG1 3.27Å; L558-T561 PolarHBondContact O-OG1 3.5Å; L558-R562 VanDerWaalsContact O-CB 3.26Å; L558-R562 WeakPolarHBondContact O-CB 3.44Å; L558-R562 PolarHBondContact O-N 3.48Å
559L94.6Very high90.5Very high107 Ų107115.7 Ų115.756%0.5657%0.571SS**Hα-helixtrans-65-39.4173.2-69.7172.9000111.2L555 K557 A563L555-L559 HydrophobicContact CD1-CD1 4.28Å; L555-L559 HydrophobicContact CD1-CG 4.25Å; L555-L559 HydrophobicContact CG-CD1 4.07Å; L555-L559 HydrophobicContact CG-CG 4.46Å; L555-L559 WeakPolarHBondContact O-CB 3.45Å; L555-L559 VanDerWaalsContact O-CG 3.32Å; L555-L559 WeakPolarHBondContact O-CG 3.36Å; L555-L559 PolarHBondContact O-N 2.73Å; K557-L559 PolarHBondContact O-N 3.43Å; L559-A563 VanDerWaalsContact O-CB 3.24Å; L559-A563 WeakPolarHBondContact O-CB 3.3Å; L559-A563 PolarHBondContact O-N 2.98Å
560T92Very high89.6Confident64 Ų64116.2 Ų116.239%0.39358%0.575SS.*Hα-helixtrans-67.9-41.3177.8-56.70000112.3Q556 K557 L558 K564Q556-T560 VanDerWaalsContact O-CB 3.3Å; Q556-T560 WeakPolarHBondContact O-CB 3.35Å; Q556-T560 PolarHBondContact O-N 3.47Å; Q556-T560 PolarHBondContact O-OG1 3.43Å; K557-T560 CarbonylContact O-C 3.45Å; K557-T560 WeakPolarHBondContact O-CB 3.18Å; K557-T560 PolarHBondContact O-N 3.32Å; K557-T560 VanDerWaalsContact O-N 3.14Å; L558-T560 VanDerWaalsContact C-N 3.34Å; T560-K564 HydrophobicContact CG2-CD 4.28Å; T560-K564 WeakPolarHBondContact O-CB 3.25Å; T560-K564 VanDerWaalsContact O-CG 3.25Å; T560-K564 WeakPolarHBondContact O-CG 3.5Å; T560-K564 PolarHBondContact O-N 3.4Å
561T89Confident88.7Confident86 Ų86113.1 Ų113.153%0.52857%0.566SS.*Hα-helixtrans-68.6-42.9176.352.20000111.1K557 L558 K564 A565K557-T561 PolarHBondContact O-N 3.46Å; K557-T561 PolarHBondContact O-OG1 3.43Å; L558-T561 WeakPolarHBondContact CA-OG1 3.27Å; L558-T561 PolarHBondContact O-OG1 3.5Å; T561-K564 PolarHBondContact O-N 2.95Å; T561-A565 PolarHBondContact O-N 3.4Å
562R90.3Very high87.8Confident156 Ų156111.5 Ų111.559%0.58957%0.57SS**Hα-helixtrans-62.5-43.8175.7-173171.2-174.8-167.5-3.7112.2L558 A565 Y566L558-R562 VanDerWaalsContact O-CB 3.26Å; L558-R562 WeakPolarHBondContact O-CB 3.44Å; L558-R562 PolarHBondContact O-N 3.48Å; R562-A565 PolarHBondContact O-N 3.41Å; R562-Y566 HydrophobicContact CG-CD2 4.1Å; R562-Y566 HydrophobicContact CG-CE2 3.62Å; R562-Y566 PolarHBondContact NH2-OH 3.19Å; R562-Y566 WeakPolarHBondContact O-CD2 3.29Å; R562-Y566 PolarHBondContact O-N 2.83Å
563A86.9Confident87.2Confident60 Ų60108.2 Ų108.250%0.49656%0.563SS.*Hα-helixtrans-61-44.4175.400000111.9L559 A565 Y566 D567L559-A563 VanDerWaalsContact O-CB 3.24Å; L559-A563 WeakPolarHBondContact O-CB 3.3Å; L559-A563 PolarHBondContact O-N 2.98Å; A563-A565 VanDerWaalsContact C-N 3.29Å; A563-A565 PolarHBondContact O-N 2.66Å; A563-Y566 PolarHBondContact O-N 3.02Å; A563-D567 PolarHBondContact O-N 3.35Å; A563-D567 VanDerWaalsContact O-N 3.1Å
564K85.1Confident86.5Confident110 Ų110105.8 Ų105.848%0.47855%0.553SS.*Hα-helixtrans-63.5-29.9174.8-75.3173.2175.7-175.30113.9T560 T561 Y566 D567T560-K564 HydrophobicContact CG2-CD 4.28Å; T560-K564 WeakPolarHBondContact O-CB 3.25Å; T560-K564 VanDerWaalsContact O-CG 3.25Å; T560-K564 WeakPolarHBondContact O-CG 3.5Å; T560-K564 PolarHBondContact O-N 3.4Å; T561-K564 PolarHBondContact O-N 2.95Å; K564-Y566 VanDerWaalsContact C-N 3.33Å; K564-D567 PolarHBondContact O-N 3.11Å
565A82.2Confident86Confident85 Ų85104.1 Ų104.170%0.70255%0.547SS*.Hα-helixtrans-73.8-25177.300000112.9T561 R562 A563T561-A565 PolarHBondContact O-N 3.4Å; R562-A565 PolarHBondContact O-N 3.41Å; A563-A565 VanDerWaalsContact C-N 3.29Å; A563-A565 PolarHBondContact O-N 2.66Å
566Y82.9Confident85.4Confident171 Ų171102 Ų10267%0.67154%0.541SS*.Hα-helixtrans-88.9-18.1172.4-68.1-63.4000113.5R562 A563 K564 S568R562-Y566 HydrophobicContact CG-CD2 4.1Å; R562-Y566 HydrophobicContact CG-CE2 3.62Å; R562-Y566 PolarHBondContact NH2-OH 3.19Å; R562-Y566 WeakPolarHBondContact O-CD2 3.29Å; R562-Y566 PolarHBondContact O-N 2.83Å; A563-Y566 PolarHBondContact O-N 3.02Å; K564-Y566 VanDerWaalsContact C-N 3.33Å; Y566-S568 PolarHBondContact O-N 2.95Å
567D81.5Confident85.2Confident79 Ų79102.8 Ų102.842%0.42254%0.542SS..  trans-81.9100.4174.7-174.34.1000110.7A563 K564 H569A563-D567 PolarHBondContact O-N 3.35Å; A563-D567 VanDerWaalsContact O-N 3.1Å; K564-D567 PolarHBondContact O-N 3.11Å; D567-H569 PolarHBondContact O-N 3.46Å; D567-H569 PolarHBondContact OD1-N 3.1Å; D567-H569 VanDerWaalsContact OD1-O 3.11Å
568S78Confident84.9Confident102 Ų10298.5 Ų98.571%0.71353%0.531SS*.SBendtrans-67.5-11.1177.460.20000113.8Y566Y566-S568 PolarHBondContact O-N 2.95Å
569H73.1Confident84.7Confident144 Ų144101.6 Ų101.667%0.66754%0.535SS*.SBendtrans-123.393.6-174.9-62.9-60.1000110.9D567 S571D567-H569 PolarHBondContact O-N 3.46Å; D567-H569 PolarHBondContact OD1-N 3.1Å; D567-H569 VanDerWaalsContact OD1-O 3.11Å; H569-S571 PolarHBondContact O-N 3.33Å
570Q77.1Confident84.7Confident135 Ų13599.8 Ų99.863%0.63153%0.528SS*.  trans-49.7112.8170.8-66.9-174.229.300110.4L572 I575Q570-L572 PolarHBondContact O-N 2.84Å; Q570-I575 HydrophobicContact CB-CD1 4.02Å; Q570-I575 HydrophobicContact CB-CG1 3.91Å; Q570-I575 VanDerWaalsContact O-CD1 3.3Å; Q570-I575 WeakPolarHBondContact O-CD1 3.44Å
571S77.8Confident84.9Confident47 Ų47103.6 Ų103.633%0.32954%0.539SS..  trans-50.4138.2-179620000111.7H569 A573 Q574 I575H569-S571 PolarHBondContact O-N 3.33Å; S571-A573 PolarHBondContact O-N 3.27Å; S571-Q574 WeakPolarHBondContact O-CA 3.34Å; S571-Q574 WeakPolarHBondContact O-CB 3.5Å; S571-Q574 PolarHBondContact O-N 3.39Å; S571-Q574 VanDerWaalsContact OG-CG 3.28Å; S571-Q574 WeakPolarHBondContact OG-CG 3.36Å; S571-Q574 PolarHBondContact OG-NE2 3.02Å; S571-I575 PolarHBondContact O-N 2.86Å
572L78.1Confident85.2Confident145 Ų145103.2 Ų103.276%0.75954%0.539SS*.Hα-helixtrans-52.8-32.6-177.8-178.162000112.8Q570 Q574 I575 S576Q570-L572 PolarHBondContact O-N 2.84Å; L572-Q574 VanDerWaalsContact C-N 3.35Å; L572-Q574 PolarHBondContact O-N 3.48Å; L572-I575 PolarHBondContact O-N 3.29Å; L572-S576 WeakPolarHBondContact O-CB 3.42Å; L572-S576 PolarHBondContact O-N 2.89Å; L572-S576 PolarHBondContact O-OG 3.42Å
573A82.9Confident85.5Confident55 Ų55100.7 Ų100.746%0.45554%0.537SS..Hα-helixtrans-71.9-19.8176.200000114.7S571 S576 K577S571-A573 PolarHBondContact O-N 3.27Å; A573-S576 PolarHBondContact O-OG 3.18Å; A573-K577 WeakPolarHBondContact O-CD 3.43Å; A573-K577 WeakPolarHBondContact O-CE 3.32Å; A573-K577 WeakPolarHBondContact O-CG 3.43Å
574Q83.5Confident86Confident79 Ų79105.6 Ų105.637%0.36954%0.542SS..Hα-helixtrans-82.2-43.6169.2-72.9177.94700110.6S571 L572 S576 K577 S578S571-Q574 WeakPolarHBondContact O-CA 3.34Å; S571-Q574 WeakPolarHBondContact O-CB 3.5Å; S571-Q574 PolarHBondContact O-N 3.39Å; S571-Q574 VanDerWaalsContact OG-CG 3.28Å; S571-Q574 WeakPolarHBondContact OG-CG 3.36Å; S571-Q574 PolarHBondContact OG-NE2 3.02Å; L572-Q574 VanDerWaalsContact C-N 3.35Å; L572-Q574 PolarHBondContact O-N 3.48Å; Q574-S576 PolarHBondContact O-N 3.36Å; Q574-K577 PolarHBondContact O-N 3.25Å; Q574-S578 PolarHBondContact O-N 3.29Å; Q574-S578 PolarHBondContact O-OG 3.39Å
575I84.9Confident86.5Confident73 Ų73106.8 Ų106.837%0.37455%0.547SS..Hα-helixtrans-62.5-42.9178.1-58.2174.5000111.3Q570 S571 L572 K577 S578 R579Q570-I575 HydrophobicContact CB-CD1 4.02Å; Q570-I575 HydrophobicContact CB-CG1 3.91Å; Q570-I575 VanDerWaalsContact O-CD1 3.3Å; Q570-I575 WeakPolarHBondContact O-CD1 3.44Å; S571-I575 PolarHBondContact O-N 2.86Å; L572-I575 PolarHBondContact O-N 3.29Å; I575-K577 VanDerWaalsContact C-N 3.32Å; I575-K577 PolarHBondContact O-N 2.92Å; I575-S578 PolarHBondContact O-N 2.85Å; I575-S578 PolarHBondContact O-OG 3.18Å; I575-R579 VanDerWaalsContact O-CB 3.32Å; I575-R579 WeakPolarHBondContact O-CB 3.44Å; I575-R579 PolarHBondContact O-N 3.37Å
576S85.4Confident87.2Confident58 Ų58104.5 Ų104.541%0.40653%0.526SS..Hα-helixtrans-64.8-37.2176.5640000112.1L572 A573 Q574 V580L572-S576 WeakPolarHBondContact O-CB 3.42Å; L572-S576 PolarHBondContact O-N 2.89Å; L572-S576 PolarHBondContact O-OG 3.42Å; A573-S576 PolarHBondContact O-OG 3.18Å; Q574-S576 PolarHBondContact O-N 3.36Å; S576-V580 WeakPolarHBondContact O-CB 3.3Å; S576-V580 VanDerWaalsContact O-CG2 3.27Å; S576-V580 WeakPolarHBondContact O-CG2 3.42Å; S576-V580 PolarHBondContact O-N 3.47Å
577K91.6Very high87.8Confident140 Ų140101.4 Ų101.461%0.60952%0.518SS*.Hα-helixtrans-69.1-37.3176.2-73.4173.4-168.3174.40113A573 Q574 I575 K581A573-K577 WeakPolarHBondContact O-CD 3.43Å; A573-K577 WeakPolarHBondContact O-CE 3.32Å; A573-K577 WeakPolarHBondContact O-CG 3.43Å; Q574-K577 PolarHBondContact O-N 3.25Å; I575-K577 VanDerWaalsContact C-N 3.32Å; I575-K577 PolarHBondContact O-N 2.92Å; K577-K581 WeakPolarHBondContact O-CG 3.5Å; K577-K581 PolarHBondContact O-N 2.95Å
578S89.2Confident88.6Confident56 Ų56104.1 Ų104.139%0.39253%0.526SS..Hα-helixtrans-69.4-47.5173.355.70000110.7Q574 I575 V580 K581 C582Q574-S578 PolarHBondContact O-N 3.29Å; Q574-S578 PolarHBondContact O-OG 3.39Å; I575-S578 PolarHBondContact O-N 2.85Å; I575-S578 PolarHBondContact O-OG 3.18Å; S578-V580 PolarHBondContact O-N 3.01Å; S578-K581 CarbonylContact O-C 3.56Å; S578-K581 WeakPolarHBondContact O-CA 3.38Å; S578-K581 WeakPolarHBondContact O-CB 3.01Å; S578-K581 PolarHBondContact O-N 2.81Å; S578-C582 PolarHBondContact O-N 3.37Å; S578-C582 PolarHBondContact O-SG 3.01Å; S578-C582 VanDerWaalsContact O-SG 3.35Å
579R92.7Very high89.5Confident182 Ų182103.2 Ų103.269%0.68751%0.511SS*.Hα-helixtrans-56.7-45.2177.8-171.2172.1-178.1165.11.3112.9I575 K581 C582 L583I575-R579 VanDerWaalsContact O-CB 3.32Å; I575-R579 WeakPolarHBondContact O-CB 3.44Å; I575-R579 PolarHBondContact O-N 3.37Å; R579-K581 VanDerWaalsContact C-N 3.3Å; R579-K581 PolarHBondContact O-N 3.17Å; R579-C582 PolarHBondContact O-N 3.45Å; R579-L583 HydrophobicContact CG-CD1 4.48Å; R579-L583 WeakPolarHBondContact O-CG 3.48Å; R579-L583 PolarHBondContact O-N 2.86Å
580V94.7Very high90.6Very high69 Ų69103.6 Ų103.642%0.41851%0.506SS..Hα-helixtrans-63.4-34175.1169.30000112.1S576 S578 R584S576-V580 WeakPolarHBondContact O-CB 3.3Å; S576-V580 VanDerWaalsContact O-CG2 3.27Å; S576-V580 WeakPolarHBondContact O-CG2 3.42Å; S576-V580 PolarHBondContact O-N 3.47Å; S578-V580 PolarHBondContact O-N 3.01Å; V580-R584 VanDerWaalsContact O-CG 3.29Å; V580-R584 WeakPolarHBondContact O-CG 3.46Å; V580-R584 PolarHBondContact O-N 2.79Å
581K95.5Very high91.5Very high144 Ų144102 Ų10263%0.62650%0.5SS*.Hα-helixtrans-69.3-40.6173.5-75176177.8-172.30112.2K577 S578 R579 R584 K585K577-K581 WeakPolarHBondContact O-CG 3.5Å; K577-K581 PolarHBondContact O-N 2.95Å; S578-K581 CarbonylContact O-C 3.56Å; S578-K581 WeakPolarHBondContact O-CA 3.38Å; S578-K581 WeakPolarHBondContact O-CB 3.01Å; S578-K581 PolarHBondContact O-N 2.81Å; R579-K581 VanDerWaalsContact C-N 3.3Å; R579-K581 PolarHBondContact O-N 3.17Å; K581-R584 PolarHBondContact O-N 2.92Å; K581-K585 PolarHBondContact O-N 3.06Å
582C95.4Very high92.4Very high78 Ų78105.9 Ų105.953%0.52751%0.507SS..Hα-helixtrans-63.2-45.8176.3-61.20000111.1S578 R579 R584 K585 S586S578-C582 PolarHBondContact O-N 3.37Å; S578-C582 PolarHBondContact O-SG 3.01Å; S578-C582 VanDerWaalsContact O-SG 3.35Å; R579-C582 PolarHBondContact O-N 3.45Å; C582-R584 VanDerWaalsContact C-N 3.31Å; C582-R584 PolarHBondContact O-N 3.29Å; C582-K585 WeakPolarHBondContact O-CA 3.15Å; C582-K585 WeakPolarHBondContact O-CB 3.35Å; C582-K585 PolarHBondContact O-N 3.4Å; C582-S586 PolarHBondContact O-N 2.95Å; C582-S586 PolarHBondContact O-OG 2.92Å
583L96.5Very high93.3Very high103 Ų103103.1 Ų103.154%0.53949%0.49SS..Hα-helixtrans-57.2-42.8175.4-69.4171.3000112.4R579 K585 S586 E587R579-L583 HydrophobicContact CG-CD1 4.48Å; R579-L583 WeakPolarHBondContact O-CG 3.48Å; R579-L583 PolarHBondContact O-N 2.86Å; L583-K585 VanDerWaalsContact C-N 3.28Å; L583-K585 PolarHBondContact O-N 3.02Å; L583-S586 WeakPolarHBondContact CA-OG 3.38Å; L583-S586 PolarHBondContact O-N 3.46Å; L583-S586 PolarHBondContact O-OG 3.24Å; L583-E587 VanDerWaalsContact O-CB 3.27Å; L583-E587 WeakPolarHBondContact O-CB 3.23Å; L583-E587 PolarHBondContact O-N 3.21Å
584R97Very high94Very high163 Ų163106.4 Ų106.462%0.61549%0.492SS*.Hα-helixtrans-68-22.5175.1-71.3173.3-176.9-166.90.7114.1V580 K581 C582 K588V580-R584 VanDerWaalsContact O-CG 3.29Å; V580-R584 WeakPolarHBondContact O-CG 3.46Å; V580-R584 PolarHBondContact O-N 2.79Å; K581-R584 PolarHBondContact O-N 2.92Å; C582-R584 VanDerWaalsContact C-N 3.31Å; C582-R584 PolarHBondContact O-N 3.29Å; R584-K588 VanDerWaalsContact O-CG 3.31Å; R584-K588 WeakPolarHBondContact O-CG 3.33Å
585K96.8Very high94.6Very high134 Ų134107.7 Ų107.758%0.58350%0.498SS*.Hα-helixtrans-77.2-53.4171.9-77.2-174.9170.2-163.50110K581 C582 L583 E587 K588 E589K581-K585 PolarHBondContact O-N 3.06Å; C582-K585 WeakPolarHBondContact O-CA 3.15Å; C582-K585 WeakPolarHBondContact O-CB 3.35Å; C582-K585 PolarHBondContact O-N 3.4Å; L583-K585 VanDerWaalsContact C-N 3.28Å; L583-K585 PolarHBondContact O-N 3.02Å; K585-E587 PolarHBondContact O-N 2.99Å; K585-K588 CarbonylContact O-C 3.56Å; K585-K588 WeakPolarHBondContact O-CA 3.31Å; K585-K588 WeakPolarHBondContact O-CB 3.31Å; K585-K588 PolarHBondContact O-N 3.24Å; K585-E589 VanDerWaalsContact O-CD 3.29Å; K585-E589 PolarHBondContact O-N 3.3Å
586S96.1Very high95.2Very high37 Ų37111.4 Ų111.426%0.25951%0.507SS..Hα-helixtrans-58.9-34.9178.559.60000112.7C582 L583 E589 R590C582-S586 PolarHBondContact O-N 2.95Å; C582-S586 PolarHBondContact O-OG 2.92Å; L583-S586 WeakPolarHBondContact CA-OG 3.38Å; L583-S586 PolarHBondContact O-N 3.46Å; L583-S586 PolarHBondContact O-OG 3.24Å; S586-E589 WeakPolarHBondContact CA-OE2 3.35Å; S586-E589 PolarHBondContact N-OE2 2.84Å; S586-E589 PolarHBondContact O-N 3.35Å; S586-R590 WeakPolarHBondContact O-CG 3.45Å; S586-R590 PolarHBondContact O-N 2.85Å
587E96.7Very high95.8Very high107 Ų107112.8 Ų112.850%0.551%0.507SS..Hα-helixtrans-64.5-41.6173.1-174.9171.9-13200112.3L583 K585 M591L583-E587 VanDerWaalsContact O-CB 3.27Å; L583-E587 WeakPolarHBondContact O-CB 3.23Å; L583-E587 PolarHBondContact O-N 3.21Å; K585-E587 PolarHBondContact O-N 2.99Å; E587-M591 VanDerWaalsContact O-CG 3.3Å; E587-M591 WeakPolarHBondContact O-CG 3.47Å; E587-M591 PolarHBondContact O-N 2.91Å
588K97.1Very high96Very high135 Ų135109.5 Ų109.559%0.58750%0.496SS*.Hα-helixtrans-68.7-36.1174-71.7177.4177.6-162.60112.7R584 K585 M591 R592R584-K588 VanDerWaalsContact O-CG 3.31Å; R584-K588 WeakPolarHBondContact O-CG 3.33Å; K585-K588 CarbonylContact O-C 3.56Å; K585-K588 WeakPolarHBondContact O-CA 3.31Å; K585-K588 WeakPolarHBondContact O-CB 3.31Å; K585-K588 PolarHBondContact O-N 3.24Å; K588-M591 PolarHBondContact O-N 2.82Å; K588-R592 WeakPolarHBondContact O-CG 3.47Å; K588-R592 PolarHBondContact O-N 2.93Å; K588-R592 VanDerWaalsContact O-N 3.08Å
589E96.4Very high96.3Very high84 Ų84112.5 Ų112.539%0.39350%0.504SS..Hα-helixtrans-61.8-52174.6-77.6132-147.500110.8K585 S586 M591 R592 E593K585-E589 VanDerWaalsContact O-CD 3.29Å; K585-E589 PolarHBondContact O-N 3.3Å; S586-E589 WeakPolarHBondContact CA-OE2 3.35Å; S586-E589 PolarHBondContact N-OE2 2.84Å; S586-E589 PolarHBondContact O-N 3.35Å; E589-M591 VanDerWaalsContact C-N 3.3Å; E589-M591 PolarHBondContact O-N 3.34Å; E589-R592 PolarHBondContact O-N 3.45Å; E589-E593 PolarHBondContact O-N 3.48Å
590R97.8Very high96.5Very high151 Ų151108.5 Ų108.557%0.5749%0.493SS*.Hα-helixtrans-57.3-38.9174.2-68.8-177.4-54.2-179.38.9113.4S586 R592 E593 Y594S586-R590 WeakPolarHBondContact O-CG 3.45Å; S586-R590 PolarHBondContact O-N 2.85Å; R590-R592 VanDerWaalsContact C-N 3.35Å; R590-R592 PolarHBondContact O-N 3.27Å; R590-E593 WeakPolarHBondContact CA-OE2 3.41Å; R590-E593 PolarHBondContact O-N 2.99Å; R590-Y594 WeakPolarHBondContact O-CB 3.39Å; R590-Y594 PolarHBondContact O-N 3.39Å
591M96.1Very high96.5Very high102 Ų102111 Ų11150%0.50250%0.495SS..Hα-helixtrans-65.3-35.9175.5-73.7-58.9-56.600112.8E587 K588 E589 Q595E587-M591 VanDerWaalsContact O-CG 3.3Å; E587-M591 WeakPolarHBondContact O-CG 3.47Å; E587-M591 PolarHBondContact O-N 2.91Å; K588-M591 PolarHBondContact O-N 2.82Å; E589-M591 VanDerWaalsContact C-N 3.3Å; E589-M591 PolarHBondContact O-N 3.34Å; M591-Q595 VanDerWaalsContact O-CG 3.28Å; M591-Q595 WeakPolarHBondContact O-CG 3.33Å; M591-Q595 PolarHBondContact O-N 3.28Å
592R96.9Very high96.5Very high128 Ų128109.1 Ų109.148%0.48349%0.488SS..Hα-helixtrans-73.1-34.9174.2-67.7-173.7-149.3100.7-12.7112.4K588 E589 R590 R596K588-R592 WeakPolarHBondContact O-CG 3.47Å; K588-R592 PolarHBondContact O-N 2.93Å; K588-R592 VanDerWaalsContact O-N 3.08Å; E589-R592 PolarHBondContact O-N 3.45Å; R590-R592 VanDerWaalsContact C-N 3.35Å; R590-R592 PolarHBondContact O-N 3.27Å; R592-R596 WeakPolarHBondContact O-CG 3.45Å; R592-R596 PolarHBondContact O-N 3.23Å
593E96.9Very high96.4Very high87 Ų87110 Ų11041%0.40748%0.484SS..Hα-helixtrans-61-52.2171.7-75.8158.4-177.300110.5E589 R590 Q595 R596 E597E589-E593 PolarHBondContact O-N 3.48Å; R590-E593 WeakPolarHBondContact CA-OE2 3.41Å; R590-E593 PolarHBondContact O-N 2.99Å; E593-Q595 VanDerWaalsContact C-N 3.31Å; E593-Q595 PolarHBondContact O-N 3.36Å; E593-R596 PolarHBondContact O-N 2.94Å; E593-R596 VanDerWaalsContact O-N 3.1Å; E593-E597 PolarHBondContact O-N 3.27Å
594Y97.3Very high96.3Very high125 Ų125109.8 Ų109.849%0.4948%0.479SS..Hα-helixtrans-55.5-43.2175.9179-107.9000112.9R590 E597 L598R590-Y594 WeakPolarHBondContact O-CB 3.39Å; R590-Y594 PolarHBondContact O-N 3.39Å; Y594-E597 PolarHBondContact O-N 3.1Å; Y594-L598 HydrophobicContact CD1-CD1 4.24Å; Y594-L598 HydrophobicContact CE1-CD1 3.61Å; Y594-L598 HydrophobicContact CE1-CG 4.24Å; Y594-L598 HydrophobicContact CE2-CD2 4.47Å; Y594-L598 HydrophobicContact CE2-CG 4.43Å; Y594-L598 WeakPolarHBondContact O-CG 3.44Å; Y594-L598 PolarHBondContact O-N 3.1Å
595Q96.6Very high96Very high105 Ų105107.4 Ų107.449%0.49148%0.478SS..Hα-helixtrans-60.9-47.5174.5-76.7172.7-2900112.4M591 E593 E597 L598 E599M591-Q595 VanDerWaalsContact O-CG 3.28Å; M591-Q595 WeakPolarHBondContact O-CG 3.33Å; M591-Q595 PolarHBondContact O-N 3.28Å; E593-Q595 VanDerWaalsContact C-N 3.31Å; E593-Q595 PolarHBondContact O-N 3.36Å; Q595-E597 VanDerWaalsContact C-N 3.31Å; Q595-E597 PolarHBondContact O-N 2.92Å; Q595-L598 WeakPolarHBondContact O-CB 3.44Å; Q595-L598 PolarHBondContact O-N 2.9Å; Q595-L598 VanDerWaalsContact O-N 3.12Å; Q595-E599 WeakPolarHBondContact O-CG 3.47Å; Q595-E599 PolarHBondContact O-N 3.41Å
596R96.7Very high95.6Very high152 Ų152108.3 Ų108.357%0.57448%0.482SS*.Hα-helixtrans-60.7-38.4176-74-176-65.6162.6-1112.5R592 E593 L598 E599 E600R592-R596 WeakPolarHBondContact O-CG 3.45Å; R592-R596 PolarHBondContact O-N 3.23Å; E593-R596 PolarHBondContact O-N 2.94Å; E593-R596 VanDerWaalsContact O-N 3.1Å; R596-L598 VanDerWaalsContact C-N 3.35Å; R596-E599 PolarHBondContact O-N 2.84Å; R596-E600 WeakPolarHBondContact O-CB 3.46Å; R596-E600 PolarHBondContact O-N 2.81Å
597E96.9Very high95.2Very high87 Ų87113.6 Ų113.641%0.40750%0.501SS..Hα-helixtrans-68.6-32.1175.5-61.1-174.8-167.400113E593 Y594 Q595 R601E593-E597 PolarHBondContact O-N 3.27Å; Y594-E597 PolarHBondContact O-N 3.1Å; Q595-E597 VanDerWaalsContact C-N 3.31Å; Q595-E597 PolarHBondContact O-N 2.92Å; E597-R601 WeakPolarHBondContact O-CB 3.47Å; E597-R601 VanDerWaalsContact O-CG 3.22Å; E597-R601 WeakPolarHBondContact O-CG 3.37Å; E597-R601 PolarHBondContact O-N 3.32Å; E597-R601 IonicContact OE2-CZ 2.8Å; E597-R601 IonicContact OE2-NH1 2.73Å; E597-R601 PolarHBondContact OE2-NH1 2.96Å; E597-R601 IonicContact OE2-NH2 3.13Å; E597-R601 PolarHBondContact OE2-NH2 2.97Å
598L96.9Very high94.9Very high70 Ų70116.2 Ų116.237%0.36651%0.506SS..Hα-helixtrans-67-45.6172.7-71.3-178.2000110.6Y594 Q595 R596 E600 R601 E602Y594-L598 HydrophobicContact CD1-CD1 4.24Å; Y594-L598 HydrophobicContact CE1-CD1 3.61Å; Y594-L598 HydrophobicContact CE1-CG 4.24Å; Y594-L598 HydrophobicContact CE2-CD2 4.47Å; Y594-L598 HydrophobicContact CE2-CG 4.43Å; Y594-L598 WeakPolarHBondContact O-CG 3.44Å; Y594-L598 PolarHBondContact O-N 3.1Å; Q595-L598 WeakPolarHBondContact O-CB 3.44Å; Q595-L598 PolarHBondContact O-N 2.9Å; Q595-L598 VanDerWaalsContact O-N 3.12Å; R596-L598 VanDerWaalsContact C-N 3.35Å; L598-E600 PolarHBondContact O-N 3.47Å; L598-R601 PolarHBondContact O-N 3.4Å; L598-E602 PolarHBondContact O-N 2.68Å
599E96.1Very high94.6Very high120 Ų120111.8 Ų111.856%0.56149%0.491SS*.Hα-helixtrans-58.1-45.2174.6-70.1167.3179.500111.5Q595 R596 R601 E602 E603Q595-E599 WeakPolarHBondContact O-CG 3.47Å; Q595-E599 PolarHBondContact O-N 3.41Å; R596-E599 PolarHBondContact O-N 2.84Å; E599-R601 PolarHBondContact O-N 3.23Å; E599-E602 WeakPolarHBondContact O-CB 3.39Å; E599-E602 PolarHBondContact O-N 3.14Å; E599-E603 PolarHBondContact O-N 2.76Å
600E96.7Very high94.4Very high97 Ų97112.7 Ų112.745%0.45350%0.498SS..Hα-helixtrans-64.7-39.4177.5-160.8-150.4-174.400112.2R596 L598 E603 K604R596-E600 WeakPolarHBondContact O-CB 3.46Å; R596-E600 PolarHBondContact O-N 2.81Å; L598-E600 PolarHBondContact O-N 3.47Å; E600-E603 PolarHBondContact O-N 3.33Å; E600-K604 VanDerWaalsContact CD-CE 3.43Å; E600-K604 HydrophobicContact CG-CD 4.44Å; E600-K604 WeakPolarHBondContact O-CB 3.43Å; E600-K604 VanDerWaalsContact O-CG 3.27Å; E600-K604 WeakPolarHBondContact O-CG 3.34Å; E600-K604 PolarHBondContact O-N 3.44Å; E600-K604 WeakPolarHBondContact OE1-CE 3.43Å; E600-K604 IonicContact OE1-NZ 2.65Å; E600-K604 PolarHBondContact OE1-NZ 2.92Å; E600-K604 IonicContact OE2-NZ 3.42Å; E600-K604 PolarHBondContact OE2-NZ 2.86Å
601R94.6Very high94.1Very high123 Ų123112 Ų11246%0.46451%0.505SS..Hα-helixtrans-65.2-42.3173.9-74.6175.5-172.6107.33.9111.2E597 L598 E599 K604 L605E597-R601 WeakPolarHBondContact O-CB 3.47Å; E597-R601 VanDerWaalsContact O-CG 3.22Å; E597-R601 WeakPolarHBondContact O-CG 3.37Å; E597-R601 PolarHBondContact O-N 3.32Å; E597-R601 IonicContact OE2-CZ 2.8Å; E597-R601 IonicContact OE2-NH1 2.73Å; E597-R601 PolarHBondContact OE2-NH1 2.96Å; E597-R601 IonicContact OE2-NH2 3.13Å; E597-R601 PolarHBondContact OE2-NH2 2.97Å; L598-R601 PolarHBondContact O-N 3.4Å; E599-R601 PolarHBondContact O-N 3.23Å; R601-K604 PolarHBondContact O-N 3.48Å; R601-L605 VanDerWaalsContact O-CG 3.31Å; R601-L605 WeakPolarHBondContact O-CG 3.31Å; R601-L605 PolarHBondContact O-N 3.21Å
602E94.4Very high94.1Very high103 Ų103114.3 Ų114.348%0.48151%0.512SS..Hα-helixtrans-62.1-43.2173.5-79-166.5-161.900112.5L598 E599 L605 K606L598-E602 PolarHBondContact O-N 2.68Å; E599-E602 WeakPolarHBondContact O-CB 3.39Å; E599-E602 PolarHBondContact O-N 3.14Å; E602-L605 PolarHBondContact O-N 2.8Å; E602-K606 WeakPolarHBondContact O-CB 3.27Å; E602-K606 VanDerWaalsContact O-CG 3.26Å; E602-K606 WeakPolarHBondContact O-CG 3.22Å; E602-K606 PolarHBondContact O-N 3.29Å; E602-K606 IonicContact OE2-NZ 2.81Å; E602-K606 PolarHBondContact OE2-NZ 2.99Å
603E94.1Very high93.9Very high96 Ų96111.9 Ų111.945%0.44951%0.507SS..Hα-helixtrans-61.8-44.4174.5-80.9-163.6-16200112E599 E600 L605 K606 K607E599-E603 PolarHBondContact O-N 2.76Å; E600-E603 PolarHBondContact O-N 3.33Å; E603-L605 PolarHBondContact O-N 2.92Å; E603-K606 PolarHBondContact O-N 3.43Å; E603-K607 WeakPolarHBondContact O-CB 3.24Å; E603-K607 VanDerWaalsContact O-CG 3.23Å; E603-K607 WeakPolarHBondContact O-CG 3.33Å; E603-K607 PolarHBondContact O-N 3.39Å; E603-K607 WeakPolarHBondContact OE2-CE 3.22Å; E603-K607 IonicContact OE2-NZ 3.42Å; E603-K607 PolarHBondContact OE2-NZ 2.87Å
604K94.4Very high93.7Very high99 Ų99113.4 Ų113.443%0.4351%0.509SS..Hα-helixtrans-60.5-34.3175.2-76.1167.8-179.6167.80111.6E600 R601 R608E600-K604 VanDerWaalsContact CD-CE 3.43Å; E600-K604 HydrophobicContact CG-CD 4.44Å; E600-K604 WeakPolarHBondContact O-CB 3.43Å; E600-K604 VanDerWaalsContact O-CG 3.27Å; E600-K604 WeakPolarHBondContact O-CG 3.34Å; E600-K604 PolarHBondContact O-N 3.44Å; E600-K604 WeakPolarHBondContact OE1-CE 3.43Å; E600-K604 IonicContact OE1-NZ 2.65Å; E600-K604 PolarHBondContact OE1-NZ 2.92Å; E600-K604 IonicContact OE2-NZ 3.42Å; E600-K604 PolarHBondContact OE2-NZ 2.86Å; R601-K604 PolarHBondContact O-N 3.48Å; K604-R608 WeakPolarHBondContact O-CD 3.22Å; K604-R608 VanDerWaalsContact O-CG 3.22Å; K604-R608 WeakPolarHBondContact O-CG 3.45Å; K604-R608 PolarHBondContact O-N 3.26Å
605L90.6Very high93.6Very high114 Ų114110.9 Ų110.960%0.59751%0.506SS*.Hα-helixtrans-72.1-44.8173.1-70.5169.7000112R601 E602 E603 K607 R608R601-L605 VanDerWaalsContact O-CG 3.31Å; R601-L605 WeakPolarHBondContact O-CG 3.31Å; R601-L605 PolarHBondContact O-N 3.21Å; E602-L605 PolarHBondContact O-N 2.8Å; E603-L605 PolarHBondContact O-N 2.92Å; L605-K607 VanDerWaalsContact C-N 3.31Å; L605-K607 PolarHBondContact O-N 3.46Å; L605-R608 PolarHBondContact O-N 2.83Å
606K88.8Confident93.6Very high153 Ų153108.5 Ų108.567%0.66550%0.504SS*.Hα-helixtrans-62.1-34.9176.6-70.2161.9-169.4160.50112.5E602 E603E602-K606 WeakPolarHBondContact O-CB 3.27Å; E602-K606 VanDerWaalsContact O-CG 3.26Å; E602-K606 WeakPolarHBondContact O-CG 3.22Å; E602-K606 PolarHBondContact O-N 3.29Å; E602-K606 IonicContact OE2-NZ 2.81Å; E602-K606 PolarHBondContact OE2-NZ 2.99Å; E603-K606 PolarHBondContact O-N 3.43Å
607K88.3Confident93.5Very high148 Ų148105.4 Ų105.464%0.64350%0.496SS*.THydrogen-bonded Turntrans-78.6-12.7177.9-69.2166.5-170.6168.10113.9E603 L605 P609E603-K607 WeakPolarHBondContact O-CB 3.24Å; E603-K607 VanDerWaalsContact O-CG 3.23Å; E603-K607 WeakPolarHBondContact O-CG 3.33Å; E603-K607 PolarHBondContact O-N 3.39Å; E603-K607 WeakPolarHBondContact OE2-CE 3.22Å; E603-K607 IonicContact OE2-NZ 3.42Å; E603-K607 PolarHBondContact OE2-NZ 2.87Å; L605-K607 VanDerWaalsContact C-N 3.31Å; L605-K607 PolarHBondContact O-N 3.46Å; K607-P609 WeakPolarHBondContact O-CD 3.39Å
608R89.4Confident93.4Very high161 Ų161108.3 Ų108.361%0.60851%0.508SS*.SBendtrans-85.5114.7178.5-82.4167.7176.3-167.4-1.3109.6K604 L605K604-R608 WeakPolarHBondContact O-CD 3.22Å; K604-R608 VanDerWaalsContact O-CG 3.22Å; K604-R608 WeakPolarHBondContact O-CG 3.45Å; K604-R608 PolarHBondContact O-N 3.26Å; L605-R608 PolarHBondContact O-N 2.83Å
609P90.3Very high93.4Very high43 Ų43109.8 Ų109.828%0.27952%0.516SS..  trans-62.7143.4179.925.1-33.7000110.9K607 E613 R614K607-P609 WeakPolarHBondContact O-CD 3.39Å; P609-E613 WeakPolarHBondContact CA-OE2 3.23Å; P609-E613 HydrophobicContact CB-CB 4.48Å; P609-E613 HydrophobicContact CB-CG 4.43Å; P609-E613 VanDerWaalsContact CB-OE2 3.25Å; P609-E613 WeakPolarHBondContact CB-OE2 3.43Å; P609-R614 HydrophobicContact CB-CG 4.12Å; P609-R614 HydrophobicContact CG-CG 3.96Å; P609-R614 VanDerWaalsContact O-CZ 3.29Å; P609-R614 PolarHBondContact O-NE 2.88Å; P609-R614 PolarHBondContact O-NH2 2.99Å
610L91.9Very high93.3Very high102 Ų102107 Ų10753%0.53451%0.513SS..  trans-71.8159-176.3-68.6164.7000111F612 E613 R614L610-F612 VanDerWaalsContact C-N 3.33Å; L610-F612 HydrophobicContact CB-CD1 3.98Å; L610-F612 HydrophobicContact CB-CE1 3.54Å; L610-F612 HydrophobicContact CB-CE2 4.3Å; L610-F612 HydrophobicContact CB-CZ 3.72Å; L610-F612 HydrophobicContact CD1-CE1 3.65Å; L610-F612 HydrophobicContact CD1-CE2 4.39Å; L610-F612 HydrophobicContact CD1-CZ 3.39Å; L610-F612 HydrophobicContact CG-CE1 4.13Å; L610-F612 HydrophobicContact CG-CZ 4.17Å; L610-F612 PolarHBondContact O-N 3.02Å; L610-E613 HydrophobicContact CB-CB 4.3Å; L610-E613 PolarHBondContact N-OE2 3.24Å; L610-E613 WeakPolarHBondContact O-CA 3.39Å; L610-E613 VanDerWaalsContact O-CB 3.32Å; L610-E613 WeakPolarHBondContact O-CB 3.36Å; L610-E613 PolarHBondContact O-N 2.87Å; L610-R614 WeakPolarHBondContact O-CG 3.48Å; L610-R614 PolarHBondContact O-N 3.31Å
611L93.5Very high93.3Very high136 Ų136110.8 Ų110.871%0.71252%0.523SS*.Hα-helixtrans-59.7-43.8-173.7-174.865.2000112.2E613 R614 V615L611-E613 VanDerWaalsContact C-N 3.29Å; L611-E613 PolarHBondContact O-N 3.18Å; L611-R614 PolarHBondContact O-N 3.24Å; L611-V615 WeakPolarHBondContact O-CG2 3.37Å; L611-V615 PolarHBondContact O-N 3.29Å
612F94.4Very high93.3Very high152 Ų152109.4 Ų109.467%0.66752%0.523SS*.Hα-helixtrans-64.1-33.9175.661.2-98.6000112.4L610 V615 A616L610-F612 VanDerWaalsContact C-N 3.33Å; L610-F612 HydrophobicContact CB-CD1 3.98Å; L610-F612 HydrophobicContact CB-CE1 3.54Å; L610-F612 HydrophobicContact CB-CE2 4.3Å; L610-F612 HydrophobicContact CB-CZ 3.72Å; L610-F612 HydrophobicContact CD1-CE1 3.65Å; L610-F612 HydrophobicContact CD1-CE2 4.39Å; L610-F612 HydrophobicContact CD1-CZ 3.39Å; L610-F612 HydrophobicContact CG-CE1 4.13Å; L610-F612 HydrophobicContact CG-CZ 4.17Å; L610-F612 PolarHBondContact O-N 3.02Å; F612-V615 PolarHBondContact O-N 3.3Å; F612-A616 WeakPolarHBondContact O-CB 3.39Å; F612-A616 PolarHBondContact O-N 3.06Å
613E92.8Very high93.3Very high77 Ų77107.2 Ų107.236%0.3652%0.523SS..Hα-helixtrans-68.8-43.7176.9-165.3-162156.600110.7P609 L610 L611 V615 A616 Q617P609-E613 WeakPolarHBondContact CA-OE2 3.23Å; P609-E613 HydrophobicContact CB-CB 4.48Å; P609-E613 HydrophobicContact CB-CG 4.43Å; P609-E613 VanDerWaalsContact CB-OE2 3.25Å; P609-E613 WeakPolarHBondContact CB-OE2 3.43Å; L610-E613 HydrophobicContact CB-CB 4.3Å; L610-E613 PolarHBondContact N-OE2 3.24Å; L610-E613 WeakPolarHBondContact O-CA 3.39Å; L610-E613 VanDerWaalsContact O-CB 3.32Å; L610-E613 WeakPolarHBondContact O-CB 3.36Å; L610-E613 PolarHBondContact O-N 2.87Å; L611-E613 VanDerWaalsContact C-N 3.29Å; L611-E613 PolarHBondContact O-N 3.18Å; E613-V615 VanDerWaalsContact C-N 3.31Å; E613-V615 PolarHBondContact O-N 3.04Å; E613-A616 PolarHBondContact O-N 2.77Å; E613-Q617 WeakPolarHBondContact O-CB 3.27Å; E613-Q617 VanDerWaalsContact O-CG 3.28Å; E613-Q617 WeakPolarHBondContact O-CG 3.2Å; E613-Q617 PolarHBondContact O-N 3Å; E613-Q617 PolarHBondContact OE1-NE2 2.98Å
614R93.3Very high93.4Very high119 Ų119105.7 Ų105.745%0.44953%0.526SS..Hα-helixtrans-60.9-39.9173-63.7178.7-154.8-172.15.5111.9P609 L610 L611 K618P609-R614 HydrophobicContact CB-CG 4.12Å; P609-R614 HydrophobicContact CG-CG 3.96Å; P609-R614 VanDerWaalsContact O-CZ 3.29Å; P609-R614 PolarHBondContact O-NE 2.88Å; P609-R614 PolarHBondContact O-NH2 2.99Å; L610-R614 WeakPolarHBondContact O-CG 3.48Å; L610-R614 PolarHBondContact O-N 3.31Å; L611-R614 PolarHBondContact O-N 3.24Å; R614-K618 WeakPolarHBondContact O-CB 3.42Å; R614-K618 WeakPolarHBondContact O-CG 3.4Å; R614-K618 PolarHBondContact O-N 3.49Å
615V96Very high93.4Very high71 Ų71106 Ų10643%0.4353%0.529SS..Hα-helixtrans-66.1-43.9175.4171.10000110.7L611 F612 E613 K618 N619L611-V615 WeakPolarHBondContact O-CG2 3.37Å; L611-V615 PolarHBondContact O-N 3.29Å; F612-V615 PolarHBondContact O-N 3.3Å; E613-V615 VanDerWaalsContact C-N 3.31Å; E613-V615 PolarHBondContact O-N 3.04Å; V615-K618 PolarHBondContact O-N 3.43Å; V615-N619 WeakPolarHBondContact O-CB 3.27Å; V615-N619 PolarHBondContact O-N 3.06Å; V615-N619 PolarHBondContact O-ND2 3.11Å; V615-N619 PolarHBondContact O-OD1 2.91Å
616A95.8Very high93.5Very high56 Ų56106.6 Ų106.646%0.46353%0.527SS..Hα-helixtrans-61.6-45.317500000112.1F612 E613 N619 A620F612-A616 WeakPolarHBondContact O-CB 3.39Å; F612-A616 PolarHBondContact O-N 3.06Å; E613-A616 PolarHBondContact O-N 2.77Å; A616-N619 PolarHBondContact O-N 2.97Å; A616-A620 VanDerWaalsContact O-CB 3.31Å; A616-A620 WeakPolarHBondContact O-CB 3.36Å; A616-A620 PolarHBondContact O-N 3.13Å
617Q94.1Very high93.8Very high87 Ų87105.6 Ų105.641%0.40753%0.525SS..Hα-helixtrans-61.3-44.3175.4-71.6175.214.100112E613 A620 R621E613-Q617 WeakPolarHBondContact O-CB 3.27Å; E613-Q617 VanDerWaalsContact O-CG 3.28Å; E613-Q617 WeakPolarHBondContact O-CG 3.2Å; E613-Q617 PolarHBondContact O-N 3Å; E613-Q617 PolarHBondContact OE1-NE2 2.98Å; Q617-A620 PolarHBondContact O-N 3.02Å; Q617-R621 WeakPolarHBondContact O-CG 3.42Å; Q617-R621 PolarHBondContact O-N 3.3Å
618K95.3Very high94Very high148 Ų148104 Ų10464%0.64352%0.515SS*.Hα-helixtrans-62.2-46.5174.3-78.8-175.5176.6-170.50111.6R614 V615 A620 R621 M622R614-K618 WeakPolarHBondContact O-CB 3.42Å; R614-K618 WeakPolarHBondContact O-CG 3.4Å; R614-K618 PolarHBondContact O-N 3.49Å; V615-K618 PolarHBondContact O-N 3.43Å; K618-A620 VanDerWaalsContact C-N 3.33Å; K618-A620 PolarHBondContact O-N 2.92Å; K618-R621 PolarHBondContact O-N 3.37Å; K618-M622 WeakPolarHBondContact O-CB 3.45Å; K618-M622 VanDerWaalsContact O-CG 3.3Å; K618-M622 WeakPolarHBondContact O-CG 3.12Å; K618-M622 PolarHBondContact O-N 3.11Å
619N96.1Very high94.1Very high101 Ų10197.1 Ų97.154%0.5449%0.492SS..Hα-helixtrans-63.2-39.7178.9-70.7-9.9000111.7V615 A616 A623V615-N619 WeakPolarHBondContact O-CB 3.27Å; V615-N619 PolarHBondContact O-N 3.06Å; V615-N619 PolarHBondContact O-ND2 3.11Å; V615-N619 PolarHBondContact O-OD1 2.91Å; A616-N619 PolarHBondContact O-N 2.97Å; N619-A623 VanDerWaalsContact O-CB 3.3Å; N619-A623 WeakPolarHBondContact O-CB 3.34Å; N619-A623 PolarHBondContact O-N 3.22Å
620A95.3Very high94.2Very high60 Ų6099.7 Ų99.750%0.49650%0.503SS..Hα-helixtrans-65.1-43.517500000112.3A616 Q617 K618 A623 A624A616-A620 VanDerWaalsContact O-CB 3.31Å; A616-A620 WeakPolarHBondContact O-CB 3.36Å; A616-A620 PolarHBondContact O-N 3.13Å; Q617-A620 PolarHBondContact O-N 3.02Å; K618-A620 VanDerWaalsContact C-N 3.33Å; K618-A620 PolarHBondContact O-N 2.92Å; A620-A623 PolarHBondContact O-N 2.76Å; A620-A624 WeakPolarHBondContact O-CB 3.49Å; A620-A624 PolarHBondContact O-N 3.18Å
621R95.5Very high94.3Very high177 Ų17797.6 Ų97.667%0.66850%0.495SS*.Hα-helixtrans-59.8-51.7172.5-76.1-175.2-178.2-176.80.9111.6Q617 K618 A623 A624 E625Q617-R621 WeakPolarHBondContact O-CG 3.42Å; Q617-R621 PolarHBondContact O-N 3.3Å; K618-R621 PolarHBondContact O-N 3.37Å; R621-A623 PolarHBondContact O-N 3.41Å; R621-A624 PolarHBondContact O-N 2.89Å; R621-A624 VanDerWaalsContact O-N 3.07Å; R621-E625 WeakPolarHBondContact O-CB 3.33Å; R621-E625 WeakPolarHBondContact O-CG 3.37Å; R621-E625 PolarHBondContact O-N 2.94Å
622M94.3Very high94.1Very high94 Ų9491.9 Ų91.946%0.46347%0.465SS..Hα-helixtrans-59.3-34.6177.5-69.4-59.8-53.400112.5K618 K626K618-M622 WeakPolarHBondContact O-CB 3.45Å; K618-M622 VanDerWaalsContact O-CG 3.3Å; K618-M622 WeakPolarHBondContact O-CG 3.12Å; K618-M622 PolarHBondContact O-N 3.11Å; M622-K626 VanDerWaalsContact O-CB 3.27Å; M622-K626 WeakPolarHBondContact O-CB 3.36Å; M622-K626 WeakPolarHBondContact O-CD 3.46Å; M622-K626 WeakPolarHBondContact O-CG 3.3Å; M622-K626 PolarHBondContact O-N 2.75Å
623A96.2Very high93.9Very high58 Ų5891.1 Ų91.148%0.47946%0.461SS..Hα-helixtrans-69.4-42.5174.600000112N619 A620 R621 K626 H627N619-A623 VanDerWaalsContact O-CB 3.3Å; N619-A623 WeakPolarHBondContact O-CB 3.34Å; N619-A623 PolarHBondContact O-N 3.22Å; A620-A623 PolarHBondContact O-N 2.76Å; R621-A623 PolarHBondContact O-N 3.41Å; A623-K626 PolarHBondContact O-N 3.39Å; A623-H627 WeakPolarHBondContact O-CB 3.49Å; A623-H627 PolarHBondContact O-N 2.84Å
624A95.1Very high93.9Very high63 Ų6391.8 Ų91.852%0.52148%0.48SS..Hα-helixtrans-66.1-41.9175.600000112.4A620 R621 H627 Y628A620-A624 WeakPolarHBondContact O-CB 3.49Å; A620-A624 PolarHBondContact O-N 3.18Å; R621-A624 PolarHBondContact O-N 2.89Å; R621-A624 VanDerWaalsContact O-N 3.07Å; A624-H627 WeakPolarHBondContact O-CB 3.2Å; A624-H627 PolarHBondContact O-N 3.03Å; A624-Y628 WeakPolarHBondContact O-CB 3.25Å; A624-Y628 PolarHBondContact O-N 2.97Å
625E93.8Very high93.8Very high105 Ų10592.1 Ų92.149%0.49149%0.49SS..Hα-helixtrans-65.3-41175.3-71.9165.4-159.900111.9R621 Y628 S629R621-E625 WeakPolarHBondContact O-CB 3.33Å; R621-E625 WeakPolarHBondContact O-CG 3.37Å; R621-E625 PolarHBondContact O-N 2.94Å; E625-Y628 PolarHBondContact O-N 2.84Å; E625-S629 WeakPolarHBondContact O-CB 3.32Å; E625-S629 PolarHBondContact O-N 3.3Å; E625-S629 PolarHBondContact O-OG 2.94Å
626K93.8Very high93.4Very high127 Ų12792.2 Ų92.255%0.55251%0.505SS*.Hα-helixtrans-62.2-42.8170.7-78.1173.2-179.1-176.70111.7M622 A623 S629 N630M622-K626 VanDerWaalsContact O-CB 3.27Å; M622-K626 WeakPolarHBondContact O-CB 3.36Å; M622-K626 WeakPolarHBondContact O-CD 3.46Å; M622-K626 WeakPolarHBondContact O-CG 3.3Å; M622-K626 PolarHBondContact O-N 2.75Å; A623-K626 PolarHBondContact O-N 3.39Å; K626-S629 PolarHBondContact O-OG 2.91Å; K626-N630 WeakPolarHBondContact O-CB 3.46Å; K626-N630 PolarHBondContact O-N 3.16Å; K626-N630 PolarHBondContact O-ND2 3.17Å
627H94.1Very high93Very high132 Ų13292.7 Ų92.761%0.61150%0.499SS*.Hα-helixtrans-62.1-48.8175.8-174.2-81.9000111.1A623 A624 N630 T631A623-H627 WeakPolarHBondContact O-CB 3.49Å; A623-H627 PolarHBondContact O-N 2.84Å; A624-H627 WeakPolarHBondContact O-CB 3.2Å; A624-H627 PolarHBondContact O-N 3.03Å; H627-N630 PolarHBondContact O-N 3.48Å; H627-T631 WeakPolarHBondContact O-CG2 3.16Å; H627-T631 PolarHBondContact O-N 3.19Å; H627-T631 PolarHBondContact O-OG1 3.47Å
628Y93.1Very high92.5Very high115 Ų11591.8 Ų91.845%0.45150%0.502SS..Hα-helixtrans-57.6-55.5178176.2-105.5000112.5A624 E625 N630 T631 L632 V642A624-Y628 WeakPolarHBondContact O-CB 3.25Å; A624-Y628 PolarHBondContact O-N 2.97Å; E625-Y628 PolarHBondContact O-N 2.84Å; Y628-N630 VanDerWaalsContact C-N 3.3Å; Y628-N630 PolarHBondContact O-N 3.44Å; Y628-T631 WeakPolarHBondContact CA-OG1 3.42Å; Y628-T631 PolarHBondContact O-N 3.08Å; Y628-T631 PolarHBondContact O-OG1 2.76Å; Y628-L632 HydrophobicContact CD1-CD1 4.14Å; Y628-L632 HydrophobicContact CE1-CD1 3.48Å; Y628-L632 VanDerWaalsContact CE1-CD1 3.48Å; Y628-L632 HydrophobicContact CE1-CG 4.32Å; Y628-L632 HydrophobicContact CE2-CD1 4.17Å; Y628-L632 HydrophobicContact CE2-CG 4.33Å; Y628-L632 PolarHBondContact O-N 2.88Å; Y628-V642 WeakPolarHBondContact OH-CG1 3.37Å
629S90.8Very high92Very high16 Ų1687.5 Ų87.511%0.11249%0.487CS..Hα-helixtrans-62.1-35.2178.557.60000112.5E625 K626 K633 D639E625-S629 WeakPolarHBondContact O-CB 3.32Å; E625-S629 PolarHBondContact O-N 3.3Å; E625-S629 PolarHBondContact O-OG 2.94Å; K626-S629 PolarHBondContact O-OG 2.91Å; S629-K633 WeakPolarHBondContact O-CB 3.32Å; S629-K633 WeakPolarHBondContact O-CD 3.23Å; S629-K633 WeakPolarHBondContact O-CG 3.5Å; S629-K633 PolarHBondContact O-N 3.32Å; S629-D639 WeakPolarHBondContact CB-OD2 3.34Å
630N92.4Very high91.4Very high98 Ų9888.6 Ų88.652%0.52449%0.489SS..Hα-helixtrans-66.5-40.1172.2-72.4-14.7000112.2K626 H627 Y628 K633 A634K626-N630 WeakPolarHBondContact O-CB 3.46Å; K626-N630 PolarHBondContact O-N 3.16Å; K626-N630 PolarHBondContact O-ND2 3.17Å; H627-N630 PolarHBondContact O-N 3.48Å; Y628-N630 VanDerWaalsContact C-N 3.3Å; Y628-N630 PolarHBondContact O-N 3.44Å; N630-K633 PolarHBondContact O-N 2.83Å; N630-A634 WeakPolarHBondContact O-CB 3.1Å; N630-A634 PolarHBondContact O-N 2.91Å
631T94Very high90.9Very high57 Ų5791.8 Ų91.835%0.3549%0.492SS..Hα-helixtrans-66.5-39.2175.154.10000112.5H627 Y628 A634 L635H627-T631 WeakPolarHBondContact O-CG2 3.16Å; H627-T631 PolarHBondContact O-N 3.19Å; H627-T631 PolarHBondContact O-OG1 3.47Å; Y628-T631 WeakPolarHBondContact CA-OG1 3.42Å; Y628-T631 PolarHBondContact O-N 3.08Å; Y628-T631 PolarHBondContact O-OG1 2.76Å; T631-A634 PolarHBondContact O-N 3.18Å; T631-L635 WeakPolarHBondContact O-CG 3.29Å; T631-L635 PolarHBondContact O-N 2.79Å; T631-L635 VanDerWaalsContact O-N 3.1Å
632L90.8Very high90.4Very high17 Ų1785.8 Ų85.89%0.08947%0.474CS..Hα-helixtrans-64.6-45.2174.4-71.5-174.9000111.8Y628 A634 L635 G636 I637 D639 V642Y628-L632 HydrophobicContact CD1-CD1 4.14Å; Y628-L632 HydrophobicContact CE1-CD1 3.48Å; Y628-L632 VanDerWaalsContact CE1-CD1 3.48Å; Y628-L632 HydrophobicContact CE1-CG 4.32Å; Y628-L632 HydrophobicContact CE2-CD1 4.17Å; Y628-L632 HydrophobicContact CE2-CG 4.33Å; Y628-L632 PolarHBondContact O-N 2.88Å; L632-A634 VanDerWaalsContact C-N 3.33Å; L632-A634 PolarHBondContact O-N 2.77Å; L632-L635 CarbonylContact O-C 3.49Å; L632-L635 WeakPolarHBondContact O-CA 3.23Å; L632-L635 PolarHBondContact O-N 3.43Å; L632-G636 PolarHBondContact O-N 3.26Å; L632-G636 VanDerWaalsContact O-N 3.07Å; L632-I637 CarbonylContact C-O 3.52Å; L632-I637 VanDerWaalsContact C-O 3.24Å; L632-I637 HydrophobicContact CD2-CB 4.47Å; L632-I637 HydrophobicContact CD2-CG2 4.49Å; L632-I637 PolarHBondContact O-N 3.43Å; L632-I637 VanDerWaalsContact O-O 3.11Å; L632-D639 HydrophobicContact CD1-CB 4.44Å; L632-D639 WeakPolarHBondContact CD1-OD1 3.36Å; L632-V642 HydrophobicContact CD1-CG2 3.87Å; L632-V642 HydrophobicContact CD2-CG2 4.06Å
633K90.1Very high89.8Confident136 Ų13684.6 Ų84.659%0.59148%0.475SS*.Hα-helixtrans-59.3-41.3174.1-73.4166.9-173.7168.50112.5S629 N630 L635 G636S629-K633 WeakPolarHBondContact O-CB 3.32Å; S629-K633 WeakPolarHBondContact O-CD 3.23Å; S629-K633 WeakPolarHBondContact O-CG 3.5Å; S629-K633 PolarHBondContact O-N 3.32Å; N630-K633 PolarHBondContact O-N 2.83Å; K633-L635 PolarHBondContact O-N 2.87Å; K633-G636 PolarHBondContact O-N 3.08Å
634A91.9Very high89.2Confident90 Ų9088 Ų8874%0.74448%0.479SS*.Hα-helixtrans-64.5-28.4175.600000112.9N630 T631 L632N630-A634 WeakPolarHBondContact O-CB 3.1Å; N630-A634 PolarHBondContact O-N 2.91Å; T631-A634 PolarHBondContact O-N 3.18Å; L632-A634 VanDerWaalsContact C-N 3.33Å; L632-A634 PolarHBondContact O-N 2.77Å
635L91.6Very high88.5Confident127 Ų12791.7 Ų91.767%0.66548%0.484SS*.THydrogen-bonded Turntrans-87.70.7173.2-65171.3000113.5T631 L632 K633 I637T631-L635 WeakPolarHBondContact O-CG 3.29Å; T631-L635 PolarHBondContact O-N 2.79Å; T631-L635 VanDerWaalsContact O-N 3.1Å; L632-L635 CarbonylContact O-C 3.49Å; L632-L635 WeakPolarHBondContact O-CA 3.23Å; L632-L635 PolarHBondContact O-N 3.43Å; K633-L635 PolarHBondContact O-N 2.87Å; L635-I637 VanDerWaalsContact C-N 3.3Å; L635-I637 HydrophobicContact CB-CD1 4.4Å; L635-I637 HydrophobicContact CB-CG1 4.48Å; L635-I637 PolarHBondContact O-N 3.49Å
636G87.8Confident87.5Confident73 Ų7389 Ų8975%0.75348%0.484SS*.THydrogen-bonded Turntrans72.815.8-178.700000115.1L632 K633L632-G636 PolarHBondContact O-N 3.26Å; L632-G636 VanDerWaalsContact O-N 3.07Å; K633-G636 PolarHBondContact O-N 3.08Å
637I86.5Confident86.2Confident66 Ų6689.8 Ų89.834%0.33849%0.49SS..  trans-105.7142.3-178.2-57.8172.9000109.3L632 L635 F641 V642L632-I637 CarbonylContact C-O 3.52Å; L632-I637 VanDerWaalsContact C-O 3.24Å; L632-I637 HydrophobicContact CD2-CB 4.47Å; L632-I637 HydrophobicContact CD2-CG2 4.49Å; L632-I637 PolarHBondContact O-N 3.43Å; L632-I637 VanDerWaalsContact O-O 3.11Å; L635-I637 VanDerWaalsContact C-N 3.3Å; L635-I637 HydrophobicContact CB-CD1 4.4Å; L635-I637 HydrophobicContact CB-CG1 4.48Å; L635-I637 PolarHBondContact O-N 3.49Å; I637-F641 HydrophobicContact CG2-CD1 3.85Å; I637-V642 HydrophobicContact CG2-CG2 3.73Å
638S84.9Confident84.6Confident67 Ų6787.1 Ų87.147%0.46949%0.486SS..  trans-92.7143.3175.165.20000113E640 F641 V642S638-E640 PolarHBondContact O-N 2.86Å; S638-F641 WeakPolarHBondContact O-CB 3Å; S638-F641 PolarHBondContact O-N 3.24Å; S638-F641 WeakPolarHBondContact OG-CB 3.33Å; S638-F641 PolarHBondContact OG-N 2.75Å; S638-V642 PolarHBondContact O-N 3.27Å
639D83.9Confident83Confident59 Ų5984.2 Ų84.232%0.31649%0.491SS..Hα-helixtrans-55.4-35.6176.7-55.35.4000111.8S629 L632 V642 S643S629-D639 WeakPolarHBondContact CB-OD2 3.34Å; L632-D639 HydrophobicContact CD1-CB 4.44Å; L632-D639 WeakPolarHBondContact CD1-OD1 3.36Å; D639-V642 PolarHBondContact O-N 2.93Å; D639-S643 WeakPolarHBondContact O-CB 3.49Å; D639-S643 PolarHBondContact O-N 3.37Å; D639-S643 PolarHBondContact O-OG 3.15Å
640E83Confident81.4Confident124 Ų12490.2 Ų90.258%0.57952%0.515SS*.Hα-helixtrans-62.8-40.5173.2-75.1-167.3-15100113.3S638 S643 K644S638-E640 PolarHBondContact O-N 2.86Å; E640-S643 PolarHBondContact O-N 3.05Å; E640-K644 WeakPolarHBondContact O-CB 3.39Å; E640-K644 WeakPolarHBondContact O-CD 3.15Å; E640-K644 VanDerWaalsContact O-CG 3.26Å; E640-K644 WeakPolarHBondContact O-CG 3.48Å; E640-K644 PolarHBondContact O-N 3.13Å; E640-K644 IonicContact OE2-NZ 3.32Å; E640-K644 PolarHBondContact OE2-NZ 2.95Å
641F84.6Confident79.5Confident127 Ų12791.6 Ų91.656%0.55753%0.527SS*.Hα-helixtrans-64.6-43.2-179.9176.5-94.4000110.6I637 S638 K645I637-F641 HydrophobicContact CG2-CD1 3.85Å; S638-F641 WeakPolarHBondContact O-CB 3Å; S638-F641 PolarHBondContact O-N 3.24Å; S638-F641 WeakPolarHBondContact OG-CB 3.33Å; S638-F641 PolarHBondContact OG-N 2.75Å; F641-K645 VanDerWaalsContact O-CB 3.28Å; F641-K645 WeakPolarHBondContact O-CB 3.11Å; F641-K645 PolarHBondContact O-N 3.2Å
642V85.1Confident77.5Confident50 Ų5096.5 Ų96.530%0.30355%0.55SS..Hα-helixtrans-65.5-42.4175.6-173.80000111Y628 L632 I637 S638 D639 K645 G646Y628-V642 WeakPolarHBondContact OH-CG1 3.37Å; L632-V642 HydrophobicContact CD1-CG2 3.87Å; L632-V642 HydrophobicContact CD2-CG2 4.06Å; I637-V642 HydrophobicContact CG2-CG2 3.73Å; S638-V642 PolarHBondContact O-N 3.27Å; D639-V642 PolarHBondContact O-N 2.93Å; V642-K645 PolarHBondContact O-N 3.48Å; V642-G646 PolarHBondContact O-N 3.39Å
643S83.2Confident75.6Confident70 Ų70101.9 Ų101.949%0.4958%0.575SS.*Hα-helixtrans-61.7-48.2177.4-59.20000112.3D639 E640 K645 G646 Q647D639-S643 WeakPolarHBondContact O-CB 3.49Å; D639-S643 PolarHBondContact O-N 3.37Å; D639-S643 PolarHBondContact O-OG 3.15Å; E640-S643 PolarHBondContact O-N 3.05Å; S643-K645 PolarHBondContact O-N 2.75Å; S643-G646 PolarHBondContact O-N 3.39Å; S643-Q647 WeakPolarHBondContact O-CG 3.21Å; S643-Q647 PolarHBondContact O-N 2.83Å; S643-Q647 VanDerWaalsContact O-N 3.11Å
644K82.9Confident73.7Confident129 Ų129104.8 Ų104.856%0.56158%0.583SS**Hα-helixtrans-63.2-40.8177.4-73163.3177.5164.40111.2E640 S648E640-K644 WeakPolarHBondContact O-CB 3.39Å; E640-K644 WeakPolarHBondContact O-CD 3.15Å; E640-K644 VanDerWaalsContact O-CG 3.26Å; E640-K644 WeakPolarHBondContact O-CG 3.48Å; E640-K644 PolarHBondContact O-N 3.13Å; E640-K644 IonicContact OE2-NZ 3.32Å; E640-K644 PolarHBondContact OE2-NZ 2.95Å; K644-S648 PolarHBondContact O-N 2.81Å
645K80.4Confident71.6Confident141 Ų141109.6 Ų109.661%0.61359%0.588SS**Hα-helixtrans-71.5-39.2178.2-166.864.8-179.9169.90112.4F641 V642 S643 Q647 S648F641-K645 VanDerWaalsContact O-CB 3.28Å; F641-K645 WeakPolarHBondContact O-CB 3.11Å; F641-K645 PolarHBondContact O-N 3.2Å; V642-K645 PolarHBondContact O-N 3.48Å; S643-K645 PolarHBondContact O-N 2.75Å; K645-Q647 PolarHBondContact O-N 3.49Å; K645-S648 PolarHBondContact O-N 3.38Å; K645-S648 VanDerWaalsContact O-N 3.16Å; K645-S648 PolarHBondContact O-OG 2.81Å
646G72.9Confident69.4Low48 Ų48110.9 Ų110.950%0.49560%0.595SS.*Hα-helixtrans-62.5-38.217600000113.2V642 S643 S648 G649V642-G646 PolarHBondContact O-N 3.39Å; S643-G646 PolarHBondContact O-N 3.39Å; G646-S648 VanDerWaalsContact C-N 3.33Å; G646-S648 PolarHBondContact O-N 2.88Å; G646-G649 PolarHBondContact O-N 3.24Å
647Q67.1Low67.3Low144 Ų144113.6 Ų113.667%0.67359%0.592SS**Hα-helixtrans-62.8-37.7172.7-73.5179.4-6.500112.5S643 K645 G649 K650S643-Q647 WeakPolarHBondContact O-CG 3.21Å; S643-Q647 PolarHBondContact O-N 2.83Å; S643-Q647 VanDerWaalsContact O-N 3.11Å; K645-Q647 PolarHBondContact O-N 3.49Å; Q647-G649 PolarHBondContact O-N 2.63Å; Q647-G649 VanDerWaalsContact O-N 3.14Å; Q647-K650 PolarHBondContact O-N 2.82Å
648S59.6Low65.3Low75 Ų75119.4 Ų119.452%0.52462%0.618SS.*THydrogen-bonded Turntrans-66.1-12.3177.574.50000114.7K644 K645 G646K644-S648 PolarHBondContact O-N 2.81Å; K645-S648 PolarHBondContact O-N 3.38Å; K645-S648 VanDerWaalsContact O-N 3.16Å; K645-S648 PolarHBondContact O-OG 2.81Å; G646-S648 VanDerWaalsContact C-N 3.33Å; G646-S648 PolarHBondContact O-N 2.88Å
649G59.2Low63.2Low55 Ų55124.4 Ų124.457%0.56763%0.634SS**THydrogen-bonded Turntrans-88.9-9.6176.300000115.5G646 Q647 V651G646-G649 PolarHBondContact O-N 3.24Å; Q647-G649 PolarHBondContact O-N 2.63Å; Q647-G649 VanDerWaalsContact O-N 3.14Å; G649-V651 PolarHBondContact O-N 3.37Å
650K56.7Low61.2Low141 Ų141128.5 Ų128.561%0.61366%0.661SS**THydrogen-bonded Turntrans-7527-171.4-74-164.3166.9-1620116.1Q647Q647-K650 PolarHBondContact O-N 2.82Å
651V54.5Low59Low128 Ų128132.4 Ų132.478%0.77668%0.677SS**THydrogen-bonded Turntrans-86.4-16.8173.2-178.30000111.7G649G649-V651 PolarHBondContact O-N 3.37Å
652L51.7Low56.5Low159 Ų159131.8 Ų131.883%0.83269%0.688SS**SBendtrans-109.829.3-174.6-155.171.7000114.9
653E50.6Low54Low131 Ų131136 Ų13661%0.61271%0.713SS**  trans-109.821176.3-106.1-177.9168.900114
654Y49.2Very low51.9Low197 Ų197138 Ų13877%0.77372%0.723SS**SBendtrans-87.6-1.9178-91.7-81.4000115.6
655F47.6Very low49.7Very low191 Ų191139.8 Ų139.884%0.83873%0.733SS**SBendtrans-108.7-4.1-174.3-91.1-75.8000116.7
656N45.5Very low47.4Very low154 Ų154141.4 Ų141.482%0.82475%0.748SS**SBendtrans-102.97.6-180-107.16.8000114.9Q658N656-Q658 VanDerWaalsContact C-N 3.28Å; N656-Q658 PolarHBondContact O-N 3.36Å
657N43.6Very low46.1Very low129 Ų129148.5 Ų148.569%0.6977%0.766SS**  trans-90.834.3-178-67.2-35.5000113.5
658Q44.3Very low44.4Very low188 Ų188150.5 Ų150.588%0.87978%0.775SS**SBendtrans-116.220.1-179.6-151.7165.130.700114.4N656N656-Q658 VanDerWaalsContact C-N 3.28Å; N656-Q658 PolarHBondContact O-N 3.36Å
659E42.3Very low43.2Very low173 Ų173151.2 Ų151.281%0.80878%0.78SS**SBendtrans-140148.3158.4-105.5165.9-158.600109.3
660T41.3Very low41.7Very low144 Ų144158.1 Ų158.188%0.88380%0.795SS**  trans72.771.5-174.171.80000117.2
661K36.4Very low40.6Very low207 Ų207158.1 Ų158.190%0.980%0.802SS**  trans-107.497.7155.9-90.1-169.2177.1-178.10112.2
662S33.3Very low39.6Very low114 Ų114161.2 Ų161.280%0.79781%0.808SS**  trans179.1136.1142.745.40000105.3
663V32.6Very low39.2Very low137 Ų137163 Ų16383%0.8381%0.812SS**  cis-133.3148.733.3167.80000111
664T37.4Very low38.3Very low113 Ų113166.3 Ų166.369%0.69383%0.827SS**  trans-72131.7173.242.10000112.3
665E37.6Very low37.6Very low167 Ų167165.8 Ų165.878%0.7883%0.829SS**  47115.2126.2-55.1-178.6152.600119.2
666D32.2Very low37.1Very low174 Ų174164.1 Ų164.193%0.9383%0.827SS**  -133.8136.8122.8-89.7-41.8000108
667K45Very low36.5Very low198 Ų198165.9 Ų165.986%0.86183%0.831SS**  trans-135.6123176.9-81.7-163.5179.8-174.20110.1
668E31.9Very low36.3Very low185 Ų185168.6 Ų168.686%0.86484%0.839SS**  trans-157.8110.3151-98.2171177.900104.5
669S35.3Very low35.7Very low91 Ų91171.2 Ų171.264%0.63684%0.841SS**  66.7101.871.776.20000114.3
670F27.4Very low35.3Very low200 Ų200170.3 Ų170.388%0.87784%0.836SS**  -174.2165.5101.3-117-97.9000111.4
671N34.2Very low34.8Very low140 Ų140171 Ų17175%0.74984%0.835SS**  trans-69149169.5-65.5-29.4000110.5
672E32.6Very low34.6Very low194 Ų194164.1 Ų164.191%0.90782%0.823SS**  -167.4156.4101.3-103.5170.9171.600112.2
673E43.2Very low34.6Very low197 Ų197168 Ų16892%0.92183%0.829SS**  trans-82.6121.2177.9-65167.9107.700109.6
674E31.3Very low34.9Very low199 Ų199169.5 Ų169.593%0.9383%0.827SS**  trans-100.8102.3169.3-159.7167.8-141.400110.8
675K34.2Very low34.5Very low187 Ų187171.4 Ų171.481%0.81383%0.832SS**  trans-73.9128157.5-78.2176.5177.7170.90108.4
676I38.8Very low34.3Very low155 Ų155172.7 Ų172.780%0.79583%0.832SS**  trans19.1113137.1-50.5168000115.3
677E31.8Very low34.5Very low192 Ų192173.5 Ų173.590%0.89783%0.827SS**  -158.7152.4122.2-115.1170.9-149.400112.9
678E38.9Very low34Very low186 Ų186171.1 Ų171.187%0.86982%0.822SS**  trans-88.3133.5-179.3-53.5171.513900110.1
679R31.3Very low34.4Very low243 Ų243169.3 Ų169.392%0.91782%0.819SS**  trans-166.1160.9139.4-117172.2-177.4-159.4-2.8117
680E35.6Very low34.3Very low153 Ų153170.8 Ų170.872%0.71582%0.824SS**  trans-73.6172.2-176.9-60.1165.7111.800114.7
681N29.6Very low34.7Very low158 Ų158168.5 Ų168.585%0.84582%0.821SS**  trans77.8141.7170.3-41.4-62.8000113.3
682G33.4Very low34.8Very low64 Ų64167.3 Ų167.366%0.6682%0.824SS**  cis147.8156.48.700000108.1
683E32.7Very low35.2Very low196 Ų196166.8 Ų166.892%0.91682%0.821SS**  trans75.2101.4172.9-55.3-176.6176.500117.7
684E37.8Very low34.7Very low168 Ų168165.1 Ų165.179%0.78582%0.819SS**  trans-2.3138.8135.4-52.2176.817500118
685N30.8Very low34.8Very low152 Ų152160.2 Ų160.281%0.81381%0.806SS**  -162115.2129-105.8-56000115.3
686Y32.7Very low34.7Very low195 Ų195161.9 Ų161.977%0.76581%0.809SS**  trans27122.4145.4-78.6-92.9000123
687F37.2Very low34.5Very low191 Ų191163.5 Ų163.584%0.83881%0.81SS**  trans-60.1140.4146.3-95.9-108.8000111.5
688I33.4Very low34.5Very low147 Ų147162.8 Ų162.875%0.75481%0.807SS**  trans-129115152.4-63.3-176.8000108.4T690I688-T690 HydrophobicContact CG2-CG2 4.25Å
689D39.3Very low34.4Very low148 Ų148163 Ų16379%0.79181%0.805SS**  trans-74.2127.3169.3-102-38.5000110.5
690T33.9Very low34.5Very low121 Ų121158.9 Ų158.974%0.74280%0.801SS**  trans-13388.6162.356.70000112I688I688-T690 HydrophobicContact CG2-CG2 4.25Å
691N36.3Very low34.6Very low153 Ų153160.4 Ų160.482%0.81881%0.808SS**  trans15.2114.8134-178.535.4000117.2
692S35.6Very low34.9Very low115 Ų115157.4 Ų157.480%0.80481%0.805SS**  trans-137.9147153.7-168.90000110.8
693Q41.5Very low34.9Very low182 Ų182162 Ų16285%0.8582%0.815SS**  trans-78139.2-173.1-60.1165.6-100.800111.3
694D33.3Very low35.2Very low163 Ų163161.2 Ų161.287%0.87281%0.811SS**  trans-109.8134.8168.6-122.1-29.1000113.2
695S33.5Very low35.2Very low95 Ų95162.2 Ų162.266%0.66482%0.816SS**  trans-92.2124.6-171.562.70000111.7K697S695-K697 PolarHBondContact O-N 3.18Å
696Y31Very low35.4Very low223 Ų223160.3 Ų160.388%0.87581%0.814SS**  trans-65.6114.9171.6-95.5-97.4000110.8
697K36.1Very low35.6Very low188 Ų188160.1 Ų160.182%0.81782%0.82SS**  trans-102.3105.7155.7-77.8-172.7178.4177.10108.9S695S695-K697 PolarHBondContact O-N 3.18Å
698E30.3Very low35.6Very low178 Ų178160.1 Ų160.183%0.83282%0.823SS**  trans-67.9125.3170.2-162.5161.7-147.400108.4
699K36.4Very low35.8Very low190 Ų190162.2 Ų162.283%0.82683%0.83SS**  trans-110.5118.3167.1-81.8-170.8175.7-176.70107.7E701K699-E701 PolarHBondContact O-N 2.81Å
700D33.9Very low35.5Very low157 Ų157164.9 Ų164.984%0.8483%0.834SS**PPolyproline II helixtrans-72.5118.4167.1-65.6-59.1000109
701E38.9Very low35.7Very low184 Ų184164.7 Ų164.786%0.8684%0.838SS**PPolyproline II helixtrans-99.5121.9164.3-78.5-175.817300109.6K699K699-E701 PolarHBondContact O-N 2.81Å
702A35.9Very low35.7Very low96 Ų96163.7 Ų163.779%0.79384%0.837SS**PPolyproline II helixtrans-72.9139.1175.200000110.1E704A702-E704 PolarHBondContact O-N 2.85Å
703N33.3Very low35.9Very low160 Ų160167.7 Ų167.786%0.85684%0.843SS**  trans-91.693.9-178.8-177.499.9000109.5
704E38.9Very low36Very low179 Ų179167.1 Ų167.184%0.83684%0.84SS**  trans-90.3160.9167-73.6-166.7167.400112A702A702-E704 PolarHBondContact O-N 2.85Å
705E37.5Very low36.3Very low190 Ų190164.1 Ų164.189%0.88883%0.832SS**  trans-86.6155.9-163.2-60.5170.2129.100113
706S35.1Very low36.7Very low111 Ų111172.2 Ų172.278%0.77686%0.859SS**  trans-142.4116.314963.30000109.7
707E35.5Very low36.9Very low191 Ų191169.7 Ų169.789%0.89386%0.858SS**  trans-63.6142.1164.8-58.9175.4118.700109.2
708E37.5Very low37Very low192 Ų192168.7 Ų168.790%0.89786%0.86SS**  trans-126.2147.5164.1-95.2-170.3165.200110.4
709E37.6Very low37.4Very low191 Ų191168.2 Ų168.289%0.89386%0.862SS**PPolyproline II helixtrans-87.2163.9-150.7-59.7-177.4124.100114.7S711E709-S711 PolarHBondContact O-N 2.84Å
710K33.8Very low37.4Very low204 Ų204166.9 Ų166.989%0.88786%0.864SS**PPolyproline II helixtrans-74.6116.5165.9-67.2170.6178.4171.10109.8
711S38.1Very low37.6Very low117 Ų117167.5 Ų167.582%0.81887%0.865SS**PPolyproline II helixtrans-89.9128.2152.349.70000110E709E709-S711 PolarHBondContact O-N 2.84Å
712V35.4Very low37.6Very low132 Ų132166.4 Ų166.480%0.887%0.866SS**PPolyproline II helixtrans-94.3130167.4170.50000106.8
713E39.7Very low37.7Very low198 Ų198171.4 Ų171.493%0.92587%0.871SS**  trans-137.6118170.1-138.2166.6-153.600108.6
714E44.4Very low38Very low170 Ų170172.3 Ų172.379%0.79487%0.872SS**  trans-134.2138.6-177.4-173.8175.4-139.600108.2
715S40.5Very low37.9Very low101 Ų101171.8 Ų171.871%0.70688%0.875SS**  trans71.6100174.5-52.80000118.4
716H40.1Very low38Very low264 Ų264170.1 Ų170.1100%1.22287%0.874SS**  -151.6099.4-110.3-50.1000113.3

Retrieved 716 of 716 residues in 227.6 ms (Link to these results)