A0A3Q0KTM0_SCHMA Loading...

Coiled-coil domain-containing protein 40

AlphaFold DB , UniProt , Accession A0A3Q0KTM0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 933 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
1M37.6Very low36.5Very low241 Ų241160 Ų160100%1.18784%0.843SS**  0113.70-74.1-174.6-172.300106.5
2N35.5Very low36.4Very low159 Ų159158.4 Ų158.485%0.8584%0.836SS**  trans-87.8124.7169-84.5-1.2000107.8
3F38.9Very low36.4Very low208 Ų208161.7 Ų161.791%0.91284%0.844SS**  trans-165.5153.6158-91.4-62.7000108.5
4P41Very low36.4Very low94 Ų94159.6 Ų159.661%0.6183%0.834SS**  -131.8-179.5-123.730.9-7.2000114.1
5E34.8Very low36.5Very low167 Ų167160.4 Ų160.478%0.7884%0.84SS**  trans71.1106.3147.3-79.2163.7-167.200120.9
6D34.7Very low36.5Very low140 Ų140161.3 Ų161.375%0.74984%0.838SS**  61110.4123.6-71.5-9.9000121.4
7P40.6Very low36.4Very low136 Ų136163.4 Ų163.488%0.88384%0.843SS**  trans-93.894.1149.533-19.9000109.1
8N34.1Very low36.3Very low146 Ų146163.3 Ų163.378%0.78184%0.843SS**  trans-104.6115168.8-159.39.1000107.8
9L34Very low35.9Very low167 Ų167164.6 Ų164.687%0.87485%0.845SS**  trans168.790.2159-93.3151.8000109.6
10Q34.7Very low36Very low199 Ų199162.3 Ų162.393%0.9384%0.841SS**  trans-151.7104.5144.8-111.4170.510.500109.1
11S35.8Very low36Very low103 Ų103160.3 Ų160.372%0.7284%0.839SS**  trans-67.2128.7-176.847.50000113.6
12D35.7Very low36.3Very low141 Ų141154.4 Ų154.475%0.75482%0.818SS**  trans24.2110130.2-59.2-23.7000118.3
13Q36Very low36.1Very low201 Ų201154 Ų15494%0.93982%0.816SS**  trans-119.896.4146.5-76.8-173.6-11.200108.2
14N36.5Very low35.9Very low133 Ų133150.6 Ų150.671%0.71181%0.807SS**  trans-64.8130.3164.2-73.1-32000109.6
15N37Very low35.2Very low171 Ų171152.5 Ų152.591%0.91482%0.817SS**  trans-127.2102.7153.6-93.3-18.8000106.9
16E37Very low35Very low174 Ų174154.1 Ų154.181%0.81382%0.822SS**PPolyproline II helixtrans-70126.5172.1-70.2169.5137.200110.1
17E34.7Very low34.6Very low197 Ų197156.2 Ų156.292%0.92183%0.828SS**PPolyproline II helixtrans-96.1117160.6-92.6-179.1156.800108.8
18L34.1Very low34Very low162 Ų162158.1 Ų158.185%0.84883%0.827SS**PPolyproline II helixtrans-64.3134.8-174.9-83.280.3000113.6
19Q30.3Very low33.7Very low188 Ų188157.8 Ų157.888%0.87983%0.825SS**PPolyproline II helixtrans-86.7136.6158.9-82.3175.2-29.400110.7
20P36.9Very low33.4Very low118 Ų118158.7 Ų158.777%0.76683%0.825SS**PPolyproline II helixtrans-86.3148.3175.533.5-30.7000112.2
21P36.9Very low33Very low122 Ų122157.1 Ų157.179%0.79282%0.818SS**PPolyproline II helixtrans-87.5156.4-170.335.8-34.4000113.3
22P42.5Very low32.7Very low116 Ų116161.7 Ų161.775%0.75383%0.827SS**PPolyproline II helixtrans-95.5140.6173.536.2-27.4000110.9
23D32.6Very low32.2Very low152 Ų152158.3 Ų158.381%0.81383%0.826SS**  trans-155114.6157.9-105.9-15.7000111.7
24D33.6Very low31.9Very low135 Ų135156.9 Ų156.972%0.72282%0.823SS**  trans47.8103.1137.8-67.9-8.1000121.5F26D24-F26 PolarHBondContact O-N 3.23Å
25T27.7Very low31.4Very low134 Ų134155.9 Ų155.982%0.82282%0.821SS**  trans-34.8118.1144.144.20000114.2
26F29.2Very low31Very low202 Ų202155 Ų15589%0.88682%0.816SS**  trans-117.5114.5152.1-106.9-89.5000109.1D24D24-F26 PolarHBondContact O-N 3.23Å
27E26.2Very low30.5Very low184 Ų184152 Ų15286%0.8680%0.804SS**  trans-65.1128.1166.1-68.5172.5148.900109.6
28M29.7Very low30.3Very low175 Ų175150.7 Ų150.786%0.86280%0.804SS**  trans-136.1110.5149.9-89.7-163.369.700108.5
29D26.4Very low30.1Very low139 Ų139147.7 Ų147.774%0.74380%0.796SS**  trans-48132.7161.3-74.8-50.5000111.4
30E29Very low29.9Very low187 Ų187150.2 Ų150.287%0.87480%0.798SS**  trans-152126.5140.6-116174.8-158.500111.4
31Q25.1Very low29.4Very low166 Ų166155.7 Ų155.778%0.77680%0.803SS**  trans-92.8121.3-167.7-61.7168.2-700110.3
32H29Very low28.8Very low199 Ų199156.5 Ų156.592%0.92180%0.801SS**  trans-159.1115.5154.2-78.9-58.5000105.7
33G25.1Very low28Very low70 Ų70160.4 Ų160.472%0.72281%0.809SS**  cis110.173.247.700000108.8
34I30.5Very low27.6Very low171 Ų171159.3 Ų159.388%0.87781%0.808SS**  trans-132.6101158-59.6-178.7000108.7
35V25.9Very low27.3Very low112 Ų112159.7 Ų159.768%0.67981%0.81SS**  trans-74.5117.9165.61710000107.3I37V35-I37 HydrophobicContact CG1-CD1 3.62Å; V35-I37 HydrophobicContact CG1-CG1 3.59Å
36D28.4Very low27.2Very low153 Ų153159.7 Ų159.782%0.81881%0.809SS**  trans-130.186150.2-147.43.9000110.4N38D36-N38 PolarHBondContact O-N 2.98Å
37I26.7Very low26.8Very low109 Ų109152.9 Ų152.956%0.55980%0.796SS**  trans-15.4108.1147.3-64.6148.7000113.1V35 S39V35-I37 HydrophobicContact CG1-CD1 3.62Å; V35-I37 HydrophobicContact CG1-CG1 3.59Å; I37-S39 WeakPolarHBondContact CG2-OG 3.07Å
38N30.2Very low26.8Very low171 Ų171150.1 Ų150.191%0.91479%0.787SS**  trans-107.3101.2133.4-106.3-33.6000108.7D36D36-N38 PolarHBondContact O-N 2.98Å
39S29.4Very low26.6Very low98 Ų98149.5 Ų149.569%0.68578%0.782SS**  trans-44.7128-177.7-690000114.5I37I37-S39 WeakPolarHBondContact CG2-OG 3.07Å
40R26Very low26.6Very low241 Ų241151.8 Ų151.891%0.90979%0.788SS**  trans-35136.4148.8-73.3171.1166.9172.9-4.6112.9
41R28Very low26.6Very low234 Ų234149.1 Ų149.188%0.88378%0.78SS**  trans-144.8104132.5-118.1178.5-176.6-1791110
42N24.2Very low27Very low138 Ų138148.5 Ų148.574%0.73878%0.782SS**  trans46.2110141.9-56.7-5.9000118.3
43E26.1Very low27.4Very low198 Ų198146.9 Ų146.993%0.92578%0.78SS**  -157.6131.3107.3-104.8167-161.700109.9
44V23.8Very low28.2Very low129 Ų129149.4 Ų149.478%0.78278%0.78SS**  trans-84.7122.7171.8174.20000105.8
45D25.8Very low29.2Very low143 Ų143147.6 Ų147.677%0.76578%0.777SS**  -176.5112.5127.3-101.5-20000112.9
46V25.9Very low30.5Very low135 Ų135146.6 Ų146.682%0.81877%0.767SS**  trans37.4105.5132.4-167.60000119.2
47G22.4Very low32Very low59 Ų59144.3 Ų144.361%0.60876%0.755SS**  trans54.9110.6132.500000121
48N24.9Very low33.5Very low126 Ų126143.2 Ų143.267%0.67476%0.755SS**  172.9122.3111.6-89.1-7.7000113.7
49E26Very low34.8Very low161 Ų161141.9 Ų141.975%0.75275%0.748SS**  trans39.9106.5134.5-64.1175.8171.100121
50Q26Very low36.4Very low188 Ų188140.5 Ų140.588%0.87973%0.731SS**  31.9102.5127.4-71.1167.3-21.300118.4
51N29.8Very low38.1Very low130 Ų130134.2 Ų134.270%0.69572%0.721SS**  trans-110.6101.1163-85.3-36.4000109.9
52D33.3Very low39.9Very low154 Ų154127.8 Ų127.882%0.82470%0.704SS**  trans-65.1125.7172-82.7-33.4000111.6V54D52-V54 PolarHBondContact O-N 3Å
53L36.4Very low42Very low165 Ų165124.3 Ų124.386%0.86468%0.684SS**  trans-75.9102.4-175.9-74.3106.4000112V55L53-V55 PolarHBondContact O-N 2.64Å
54V43.3Very low44Very low122 Ų122124.6 Ų124.674%0.73968%0.677SS**  trans-78110170.6-179.10000109.9D52D52-V54 PolarHBondContact O-N 3Å
55V50.5Low45.9Very low133 Ų133128.3 Ų128.381%0.80668%0.676SS**PPolyproline II helixtrans-80.2120.7-178.1179.30000110.5L53L53-V55 PolarHBondContact O-N 2.64Å
56L53.3Low48.1Very low91 Ų91125.4 Ų125.448%0.47666%0.657SS.*PPolyproline II helixtrans-82.5141.3175.9-87.579.7000112.2
57D59.4Low50.5Low105 Ų105123.1 Ų123.156%0.56164%0.638SS**PPolyproline II helixtrans-60.8137.9-175.8-167.7-46.8000113.6N59 H60D57-N59 PolarHBondContact O-N 3.47Å; D57-N59 PolarHBondContact OD1-N 3.31Å; D57-N59 VanDerWaalsContact OD1-N 3.16Å; D57-H60 WeakPolarHBondContact O-CB 3.45Å; D57-H60 PolarHBondContact O-N 2.77Å
58P59.8Low53Low87 Ų87128 Ų12857%0.56565%0.645SS**THydrogen-bonded Turntrans-53.1-23.5178.9-29.635000117Q67P58-Q67 PolarHBondContact O-NE2 3.05Å
59N55.9Low55.3Low143 Ų143124.5 Ų124.577%0.76563%0.63SS**THydrogen-bonded Turntrans-933.5176.5-67.9-36.9000113.3D57D57-N59 PolarHBondContact O-N 3.47Å; D57-N59 PolarHBondContact OD1-N 3.31Å; D57-N59 VanDerWaalsContact OD1-N 3.16Å
60H64.5Low57.6Low69 Ų69120.2 Ų120.232%0.31961%0.612SS.*SBendtrans-58.6134.5178.4-166.2-89.9000110D57 L62 M63D57-H60 WeakPolarHBondContact O-CB 3.45Å; D57-H60 PolarHBondContact O-N 2.77Å; H60-L62 VanDerWaalsContact CE1-CD1 3.4Å; H60-L62 WeakPolarHBondContact CE1-CD1 3.32Å; H60-L62 WeakPolarHBondContact ND1-CB 3.47Å; H60-L62 WeakPolarHBondContact ND1-CG 3.34Å; H60-L62 PolarHBondContact ND1-N 3.13Å; H60-L62 PolarHBondContact O-N 3.17Å; H60-M63 WeakPolarHBondContact O-CB 3.39Å; H60-M63 PolarHBondContact O-N 3.33Å
61P61.8Low60Low109 Ų109120.9 Ų120.971%0.70861%0.606SS**G310 helixtrans-53.3-26.8-174.7-27.933.8000114.3M63P61-M63 VanDerWaalsContact C-N 3.26Å; P61-M63 PolarHBondContact O-N 3.43Å
62L64.2Low62.2Low99 Ų99118.7 Ų118.752%0.51860%0.601SS.*G310 helixtrans-70.4-7.3176.5-60.4173000114.7H60 I733H60-L62 VanDerWaalsContact CE1-CD1 3.4Å; H60-L62 WeakPolarHBondContact CE1-CD1 3.32Å; H60-L62 WeakPolarHBondContact ND1-CB 3.47Å; H60-L62 WeakPolarHBondContact ND1-CG 3.34Å; H60-L62 PolarHBondContact ND1-N 3.13Å; H60-L62 PolarHBondContact O-N 3.17Å; L62-I733 HydrophobicContact CD1-CG2 4.33Å
63M69.4Low64.3Low65 Ų65113.2 Ų113.232%0.3257%0.571SS.*G310 helixtrans-108-12.3-170.3-70.9-64.1-72.300116.8H60 P61 R65 F66H60-M63 WeakPolarHBondContact O-CB 3.39Å; H60-M63 PolarHBondContact O-N 3.33Å; P61-M63 VanDerWaalsContact C-N 3.26Å; P61-M63 PolarHBondContact O-N 3.43Å; M63-R65 PolarHBondContact O-N 2.92Å; M63-F66 HydrophobicContact CE-CD1 3.76Å; M63-F66 HydrophobicContact CE-CE1 4.23Å; M63-F66 WeakPolarHBondContact O-CB 3.2Å; M63-F66 PolarHBondContact O-N 2.79Å
64R66.8Low66.2Low204 Ų204109.9 Ų109.977%0.7755%0.554SS**Hα-helixtrans-59-42.3-171.7-104.3-177.8-167138.75114.7F66 Q67R64-F66 PolarHBondContact O-N 3.4Å; R64-F66 VanDerWaalsContact O-N 3.13Å; R64-Q67 PolarHBondContact O-N 3.26Å; R64-Q67 VanDerWaalsContact O-N 3.14Å
65R65.4Low68Low206 Ų206108.2 Ų108.278%0.77754%0.544SS*.Hα-helixtrans-65.2-19.2-174.5-63.8-176.971.4-1653.4113.2M63M63-R65 PolarHBondContact O-N 2.92Å
66F70.7Confident69.3Low82 Ų82109.9 Ų109.936%0.3654%0.54SS..Hα-helixtrans-77.2-29177.5170-122.5000113.3M63 R64 S69 V740M63-F66 HydrophobicContact CE-CD1 3.76Å; M63-F66 HydrophobicContact CE-CE1 4.23Å; M63-F66 WeakPolarHBondContact O-CB 3.2Å; M63-F66 PolarHBondContact O-N 2.79Å; R64-F66 PolarHBondContact O-N 3.4Å; R64-F66 VanDerWaalsContact O-N 3.13Å; F66-S69 PolarHBondContact O-OG 3.45Å; F66-V740 HydrophobicContact CD2-CB 3.88Å; F66-V740 HydrophobicContact CD2-CG1 3.48Å; F66-V740 VanDerWaalsContact CD2-CG1 3.48Å; F66-V740 HydrophobicContact CD2-CG2 3.18Å; F66-V740 HydrophobicContact CE2-CB 4.03Å; F66-V740 HydrophobicContact CE2-CG1 3.62Å; F66-V740 HydrophobicContact CE2-CG2 3.28Å; F66-V740 HydrophobicContact CG-CG2 4.29Å; F66-V740 HydrophobicContact CZ-CG2 4.46Å
67Q77.4Confident70.3Confident87 Ų87108.7 Ų108.741%0.40753%0.532SS..Hα-helixtrans-81.6-34.1-167.2-66.3-177.5-5.200114.3P58 R64 L70P58-Q67 PolarHBondContact O-NE2 3.05Å; R64-Q67 PolarHBondContact O-N 3.26Å; R64-Q67 VanDerWaalsContact O-N 3.14Å; Q67-L70 VanDerWaalsContact O-CB 3.32Å; Q67-L70 WeakPolarHBondContact O-CB 3.16Å; Q67-L70 PolarHBondContact O-N 2.76Å
68E74.5Confident71.3Confident162 Ų162108 Ų10876%0.75753%0.527SS*.Hα-helixtrans-72.8-39.6-176.4-84.1172.2154.500113.4L70 R71E68-L70 PolarHBondContact O-N 3.49Å; E68-L70 VanDerWaalsContact O-N 3.16Å; E68-R71 PolarHBondContact O-N 2.7Å
69S72.6Confident72.3Confident52 Ų52109 Ų10936%0.36453%0.528SS..Hα-helixtrans-60.1-25.7174.151.50000112.4F66F66-S69 PolarHBondContact O-OG 3.45Å
70L74.5Confident73.4Confident72 Ų72104.9 Ų104.938%0.37751%0.511SS..Hα-helixtrans-73-37.3-177.1-160.773.2000112.6Q67 E68 L74Q67-L70 VanDerWaalsContact O-CB 3.32Å; Q67-L70 WeakPolarHBondContact O-CB 3.16Å; Q67-L70 PolarHBondContact O-N 2.76Å; E68-L70 PolarHBondContact O-N 3.49Å; E68-L70 VanDerWaalsContact O-N 3.16Å; L70-L74 WeakPolarHBondContact O-CG 3.07Å
71R77.3Confident73.8Confident201 Ų201105.3 Ų105.376%0.75852%0.518SS*.Hα-helixtrans-70.6-43-172.1-75.1-174.2179.3-174.10.4114E68 M73 L74E68-R71 PolarHBondContact O-N 2.7Å; R71-M73 VanDerWaalsContact C-N 3.31Å; R71-M73 PolarHBondContact O-N 3.47Å; R71-L74 WeakPolarHBondContact O-CB 3.36Å; R71-L74 PolarHBondContact O-N 3.3Å; R71-L74 VanDerWaalsContact O-N 3.14Å
72S76.3Confident74.8Confident84 Ų84105.9 Ų105.959%0.58751%0.511SS*.Hα-helixtrans-63.1-38.1-177.3179.90000112.5L74 T75S72-L74 VanDerWaalsContact C-N 3.3Å; S72-L74 PolarHBondContact O-N 2.9Å; S72-T75 PolarHBondContact O-OG1 2.7Å
73M77.2Confident75.6Confident40 Ų40106.6 Ų106.620%0.19752%0.515CS..Hα-helixtrans-57-43173.8-175.9-150-69.100111.3R71 T75 H77 D744R71-M73 VanDerWaalsContact C-N 3.31Å; R71-M73 PolarHBondContact O-N 3.47Å; M73-T75 PolarHBondContact O-N 3.36Å; M73-H77 PolarHBondContact O-CD2 3.3Å; M73-D744 HydrophobicContact CE-CB 4.25Å; M73-D744 VanDerWaalsContact CE-OD1 3.23Å; M73-D744 WeakPolarHBondContact CE-OD1 3.41Å
74L76.3Confident76Confident94 Ų94108.4 Ų108.449%0.49252%0.522SS..Hα-helixtrans-65.1-42-170.6-68167.7000113.6L70 R71 S72 K76 H77 I78L70-L74 WeakPolarHBondContact O-CG 3.07Å; R71-L74 WeakPolarHBondContact O-CB 3.36Å; R71-L74 PolarHBondContact O-N 3.3Å; R71-L74 VanDerWaalsContact O-N 3.14Å; S72-L74 VanDerWaalsContact C-N 3.3Å; S72-L74 PolarHBondContact O-N 2.9Å; L74-K76 PolarHBondContact O-N 3.31Å; L74-H77 WeakPolarHBondContact O-CB 3.31Å; L74-H77 PolarHBondContact O-N 3.44Å; L74-I78 PolarHBondContact O-N 3.39Å
75T79.4Confident76.4Confident88 Ų88103.8 Ų103.854%0.5451%0.512SS..Hα-helixtrans-62.8-39.9-176.212.20000113.8S72 M73 H77 I78S72-T75 PolarHBondContact O-OG1 2.7Å; M73-T75 PolarHBondContact O-N 3.36Å; T75-H77 PolarHBondContact O-N 3.34Å; T75-I78 PolarHBondContact O-N 3.43Å; T75-I78 VanDerWaalsContact O-N 3.17Å
76K77.8Confident77.2Confident167 Ų167103.3 Ų103.373%0.72651%0.51SS*.Hα-helixtrans-68-26.3177.9-73.1-178.8178.2176.50113L74 I78L74-K76 PolarHBondContact O-N 3.31Å; K76-I78 VanDerWaalsContact C-N 3.34Å
77H75.9Confident77.8Confident66 Ų66104.7 Ų104.731%0.30652%0.518SS..Hα-helixtrans-71.9-30.7175-76.9-68.1000111.8M73 L74 T75 T81M73-H77 PolarHBondContact O-CD2 3.3Å; L74-H77 WeakPolarHBondContact O-CB 3.31Å; L74-H77 PolarHBondContact O-N 3.44Å; T75-H77 PolarHBondContact O-N 3.34Å; H77-T81 WeakPolarHBondContact O-CG2 3Å; H77-T81 PolarHBondContact O-N 3.46Å; H77-T81 VanDerWaalsContact O-N 3.07Å; H77-T81 PolarHBondContact O-OG1 3.41Å
78I80.5Confident77.9Confident90 Ų90106.3 Ų106.346%0.46252%0.524SS..Hα-helixtrans-64.7-50.5-177.4-64.9170.5000111.5L74 T75 K76 S80 T81 E82L74-I78 PolarHBondContact O-N 3.39Å; T75-I78 PolarHBondContact O-N 3.43Å; T75-I78 VanDerWaalsContact O-N 3.17Å; K76-I78 VanDerWaalsContact C-N 3.34Å; I78-S80 VanDerWaalsContact C-N 3.33Å; I78-S80 PolarHBondContact O-N 2.79Å; I78-T81 WeakPolarHBondContact CA-OG1 3.44Å; I78-T81 WeakPolarHBondContact O-CA 3.48Å; I78-T81 PolarHBondContact O-N 3.06Å; I78-T81 PolarHBondContact O-OG1 3Å; I78-E82 PolarHBondContact O-N 3.43Å; I78-E82 VanDerWaalsContact O-N 3.15Å
79D79.9Confident78.3Confident108 Ų108101.8 Ų101.858%0.57850%0.504SS*.Hα-helixtrans-65.1-37.9-177.1-61-16.8000112.5T81 E82D79-T81 VanDerWaalsContact C-N 3.26Å; D79-T81 PolarHBondContact O-N 3.33Å; D79-E82 PolarHBondContact O-N 3.42Å
80S78.5Confident78.8Confident57 Ų57103.5 Ų103.540%0.39951%0.507SS..Hα-helixtrans-61.9-37.1172.8165.90000111.4I78 H84I78-S80 VanDerWaalsContact C-N 3.33Å; I78-S80 PolarHBondContact O-N 2.79Å; S80-H84 PolarHBondContact O-CD2 3.34Å; S80-H84 PolarHBondContact O-N 3Å
81T73.3Confident79.1Confident78 Ų78104.3 Ų104.348%0.47951%0.509SS..Hα-helixtrans-71.2-31.6179.754.10000113.3H77 I78 D79 H84 L85H77-T81 WeakPolarHBondContact O-CG2 3Å; H77-T81 PolarHBondContact O-N 3.46Å; H77-T81 VanDerWaalsContact O-N 3.07Å; H77-T81 PolarHBondContact O-OG1 3.41Å; I78-T81 WeakPolarHBondContact CA-OG1 3.44Å; I78-T81 WeakPolarHBondContact O-CA 3.48Å; I78-T81 PolarHBondContact O-N 3.06Å; I78-T81 PolarHBondContact O-OG1 3Å; D79-T81 VanDerWaalsContact C-N 3.26Å; D79-T81 PolarHBondContact O-N 3.33Å; T81-H84 PolarHBondContact O-N 3.41Å; T81-L85 WeakPolarHBondContact O-CB 3.39Å; T81-L85 PolarHBondContact O-N 2.94Å
82E82.6Confident79.1Confident121 Ų12198.4 Ų98.457%0.56549%0.491SS*.Hα-helixtrans-67.3-39.6179.5-75.1-169.4162.600113.6I78 D79 L85 R86I78-E82 PolarHBondContact O-N 3.43Å; I78-E82 VanDerWaalsContact O-N 3.15Å; D79-E82 PolarHBondContact O-N 3.42Å; E82-L85 WeakPolarHBondContact O-CB 3.45Å; E82-L85 PolarHBondContact O-N 3.47Å; E82-R86 PolarHBondContact O-N 3.42Å
83I80.5Confident79.5Confident115 Ų115100.2 Ų100.259%0.5949%0.488SS*.Hα-helixtrans-65.6-45.2177.4-65.6173.6000110.1L85 R86 E87I83-L85 PolarHBondContact O-N 3.39Å; I83-R86 PolarHBondContact O-N 3.42Å; I83-E87 PolarHBondContact O-N 2.84Å
84H78.2Confident79.8Confident103 Ų103105.8 Ų105.848%0.47751%0.507SS..Hα-helixtrans-61.1-33.5174-75.7-49.9000112.4S80 T81 E87 K88S80-H84 PolarHBondContact O-CD2 3.34Å; S80-H84 PolarHBondContact O-N 3Å; T81-H84 PolarHBondContact O-N 3.41Å; H84-E87 IonicContact ND1-OE2 3.59Å; H84-E87 PolarHBondContact O-N 2.72Å; H84-K88 WeakPolarHBondContact O-CB 3.18Å; H84-K88 WeakPolarHBondContact O-CG 3.43Å; H84-K88 PolarHBondContact O-N 2.69Å
85L74.8Confident80.1Confident107 Ų107108 Ų10856%0.5652%0.515SS*.Hα-helixtrans-64-42.6178.8-153.1129.8000111.7T81 E82 I83 K88 D89T81-L85 WeakPolarHBondContact O-CB 3.39Å; T81-L85 PolarHBondContact O-N 2.94Å; E82-L85 WeakPolarHBondContact O-CB 3.45Å; E82-L85 PolarHBondContact O-N 3.47Å; I83-L85 PolarHBondContact O-N 3.39Å; L85-K88 PolarHBondContact O-N 2.8Å; L85-D89 PolarHBondContact O-N 3.33Å
86R82Confident80.4Confident195 Ų195109.4 Ų109.474%0.73651%0.513SS*.Hα-helixtrans-66.3-40.9177.6-71.4-172.9-175.5165.34.7113.6E82 I83 K88 D89 E90E82-R86 PolarHBondContact O-N 3.42Å; I83-R86 PolarHBondContact O-N 3.42Å; R86-K88 VanDerWaalsContact C-N 3.28Å; R86-K88 PolarHBondContact O-N 3.31Å; R86-D89 PolarHBondContact O-N 2.91Å; R86-E90 PolarHBondContact O-N 3.35Å
87E83.3Confident80.8Confident111 Ų111104.5 Ų104.552%0.51950%0.5SS..Hα-helixtrans-62-41.6175.1-68.9178.7156.400110.6I83 H84 D89 E90 E91I83-E87 PolarHBondContact O-N 2.84Å; H84-E87 IonicContact ND1-OE2 3.59Å; H84-E87 PolarHBondContact O-N 2.72Å; E87-D89 VanDerWaalsContact C-N 3.34Å; E87-D89 PolarHBondContact O-N 2.89Å; E87-E90 PolarHBondContact O-N 3.41Å; E87-E91 WeakPolarHBondContact O-CG 3.45Å; E87-E91 PolarHBondContact O-N 3.44Å
88K79.5Confident81.1Confident122 Ų122103.5 Ų103.553%0.5350%0.503SS..Hα-helixtrans-66.3-34.1176.2-69.2-71.8158.3-152.40112.7H84 L85 R86 E91 M92H84-K88 WeakPolarHBondContact O-CB 3.18Å; H84-K88 WeakPolarHBondContact O-CG 3.43Å; H84-K88 PolarHBondContact O-N 2.69Å; L85-K88 PolarHBondContact O-N 2.8Å; R86-K88 VanDerWaalsContact C-N 3.28Å; R86-K88 PolarHBondContact O-N 3.31Å; K88-E91 IonicContact NZ-OE1 3.8Å; K88-E91 IonicContact NZ-OE2 2.97Å; K88-E91 PolarHBondContact NZ-OE2 2.71Å; K88-M92 WeakPolarHBondContact O-CB 3.46Å; K88-M92 PolarHBondContact O-N 2.69Å
89D83.8Confident81.1Confident66 Ų66108.8 Ų108.835%0.35352%0.517SS..Hα-helixtrans-67-41176.5-76.4-28.9000112.8L85 R86 E87 M92 K93L85-D89 PolarHBondContact O-N 3.33Å; R86-D89 PolarHBondContact O-N 2.91Å; E87-D89 VanDerWaalsContact C-N 3.34Å; E87-D89 PolarHBondContact O-N 2.89Å; D89-M92 PolarHBondContact O-N 2.92Å; D89-K93 WeakPolarHBondContact O-CG 3.45Å; D89-K93 PolarHBondContact O-N 3.21Å
90E82.9Confident81.4Confident89 Ų89109 Ų10942%0.41652%0.517SS..Hα-helixtrans-71.1-38.7176.1-77.8-64.4132.700112.3R86 E87 M92 K93 R94R86-E90 PolarHBondContact O-N 3.35Å; E87-E90 PolarHBondContact O-N 3.41Å; E90-M92 VanDerWaalsContact C-N 3.32Å; E90-K93 PolarHBondContact O-N 3.49Å; E90-K93 IonicContact OE1-NZ 2.64Å; E90-K93 PolarHBondContact OE1-NZ 3.37Å; E90-R94 PolarHBondContact O-N 3.26Å
91E80Confident81.8Confident88 Ų88112.7 Ų112.741%0.41153%0.528SS..Hα-helixtrans-58-46.4168-75.9179.4172.600110.8E87 K88 K93 R94 E95E87-E91 WeakPolarHBondContact O-CG 3.45Å; E87-E91 PolarHBondContact O-N 3.44Å; K88-E91 IonicContact NZ-OE1 3.8Å; K88-E91 IonicContact NZ-OE2 2.97Å; K88-E91 PolarHBondContact NZ-OE2 2.71Å; E91-K93 VanDerWaalsContact C-N 3.32Å; E91-K93 PolarHBondContact O-N 3.37Å; E91-R94 PolarHBondContact O-N 3.16Å; E91-R94 VanDerWaalsContact O-N 3.16Å; E91-E95 WeakPolarHBondContact O-CB 3.22Å; E91-E95 PolarHBondContact O-N 2.87Å
92M77.3Confident82.3Confident77 Ų77112.8 Ų112.838%0.37953%0.528SS..Hα-helixtrans-64.3-33.1-179.3-172.9-108.2-65.600112.8K88 D89 E90 K96K88-M92 WeakPolarHBondContact O-CB 3.46Å; K88-M92 PolarHBondContact O-N 2.69Å; D89-M92 PolarHBondContact O-N 2.92Å; E90-M92 VanDerWaalsContact C-N 3.32Å; M92-K96 VanDerWaalsContact O-CB 3.3Å; M92-K96 WeakPolarHBondContact O-CB 3.28Å; M92-K96 VanDerWaalsContact O-CG 3.25Å; M92-K96 WeakPolarHBondContact O-CG 3.19Å; M92-K96 PolarHBondContact O-N 3.41Å; M92-K96 HydrophobicContact SD-CD 3.65Å; M92-K96 WeakPolarHBondContact SD-CE 3.45Å; M92-K96 HydrophobicContact SD-CG 4.39Å; M92-K96 PolarHBondContact SD-NZ 3.25Å
93K86.4Confident82.5Confident123 Ų123108.7 Ų108.754%0.53552%0.518SS..Hα-helixtrans-65.3-44.7171.7-76.2179.5-168.51630112.4D89 E90 E91 K96 S97D89-K93 WeakPolarHBondContact O-CG 3.45Å; D89-K93 PolarHBondContact O-N 3.21Å; E90-K93 PolarHBondContact O-N 3.49Å; E90-K93 IonicContact OE1-NZ 2.64Å; E90-K93 PolarHBondContact OE1-NZ 3.37Å; E91-K93 VanDerWaalsContact C-N 3.32Å; E91-K93 PolarHBondContact O-N 3.37Å; K93-K96 WeakPolarHBondContact O-CB 3.14Å; K93-K96 PolarHBondContact O-N 3.36Å; K93-S97 PolarHBondContact O-N 3.26Å; K93-S97 PolarHBondContact O-OG 2.7Å
94R83.8Confident82.7Confident157 Ų157106.4 Ų106.459%0.59251%0.512SS*.Hα-helixtrans-65.6-40.6176.9-64.6-174.5-149.9119.47.3111.6E90 E91 K96 S97 A98E90-R94 PolarHBondContact O-N 3.26Å; E91-R94 PolarHBondContact O-N 3.16Å; E91-R94 VanDerWaalsContact O-N 3.16Å; R94-K96 VanDerWaalsContact C-N 3.31Å; R94-K96 PolarHBondContact O-N 2.87Å; R94-S97 WeakPolarHBondContact CA-OG 3.11Å; R94-S97 PolarHBondContact O-N 2.87Å; R94-S97 PolarHBondContact O-OG 3.08Å; R94-A98 WeakPolarHBondContact O-CB 3.46Å; R94-A98 PolarHBondContact O-N 2.72Å
95E82.3Confident83.2Confident140 Ų140106.5 Ų106.565%0.65452%0.516SS*.Hα-helixtrans-64.8-37.6176-144.475.7-172.400110.9E91 R99E91-E95 WeakPolarHBondContact O-CB 3.22Å; E91-E95 PolarHBondContact O-N 2.87Å; E95-R99 WeakPolarHBondContact O-CB 3.1Å; E95-R99 PolarHBondContact O-N 3.05Å
96K85.1Confident83.6Confident118 Ų118106.3 Ų106.351%0.51352%0.515SS..Hα-helixtrans-64.9-44.2174.3-83.8175.3171.7173.20112.4M92 K93 R94 R99 I100M92-K96 VanDerWaalsContact O-CB 3.3Å; M92-K96 WeakPolarHBondContact O-CB 3.28Å; M92-K96 VanDerWaalsContact O-CG 3.25Å; M92-K96 WeakPolarHBondContact O-CG 3.19Å; M92-K96 PolarHBondContact O-N 3.41Å; M92-K96 HydrophobicContact SD-CD 3.65Å; M92-K96 WeakPolarHBondContact SD-CE 3.45Å; M92-K96 HydrophobicContact SD-CG 4.39Å; M92-K96 PolarHBondContact SD-NZ 3.25Å; K93-K96 WeakPolarHBondContact O-CB 3.14Å; K93-K96 PolarHBondContact O-N 3.36Å; R94-K96 VanDerWaalsContact C-N 3.31Å; R94-K96 PolarHBondContact O-N 2.87Å; K96-R99 PolarHBondContact O-N 3.31Å; K96-I100 VanDerWaalsContact O-CG1 3.27Å; K96-I100 WeakPolarHBondContact O-CG1 3.19Å; K96-I100 PolarHBondContact O-N 3.18Å
97S86Confident83.9Confident63 Ų63103.5 Ų103.544%0.44151%0.505SS..Hα-helixtrans-64.6-44.6176.851.30000111.6K93 R94 R99 I100 E101K93-S97 PolarHBondContact O-N 3.26Å; K93-S97 PolarHBondContact O-OG 2.7Å; R94-S97 WeakPolarHBondContact CA-OG 3.11Å; R94-S97 PolarHBondContact O-N 2.87Å; R94-S97 PolarHBondContact O-OG 3.08Å; S97-R99 VanDerWaalsContact C-N 3.32Å; S97-R99 PolarHBondContact O-N 3.21Å; S97-I100 PolarHBondContact O-N 2.77Å; S97-I100 VanDerWaalsContact O-N 3.15Å; S97-E101 PolarHBondContact O-N 2.77Å
98A82.2Confident84Confident45 Ų45102.3 Ų102.337%0.37250%0.502SS..Hα-helixtrans-62.4-39.1174.900000111.8R94 I100 E101 V102R94-A98 WeakPolarHBondContact O-CB 3.46Å; R94-A98 PolarHBondContact O-N 2.72Å; A98-I100 VanDerWaalsContact C-N 3.34Å; A98-I100 PolarHBondContact O-N 3.4Å; A98-E101 PolarHBondContact O-N 3.3Å; A98-V102 WeakPolarHBondContact O-CB 3.2Å; A98-V102 VanDerWaalsContact O-CG2 3.28Å; A98-V102 WeakPolarHBondContact O-CG2 3.06Å; A98-V102 PolarHBondContact O-N 3.27Å
99R80.8Confident84.4Confident202 Ų202101.5 Ų101.576%0.76250%0.503SS*.Hα-helixtrans-64.3-35.5174.3-178.8179.3175.3176.4-0.1112.6E95 K96 S97 G103E95-R99 WeakPolarHBondContact O-CB 3.1Å; E95-R99 PolarHBondContact O-N 3.05Å; K96-R99 PolarHBondContact O-N 3.31Å; S97-R99 VanDerWaalsContact C-N 3.32Å; S97-R99 PolarHBondContact O-N 3.21Å; R99-G103 WeakPolarHBondContact O-CA 3.4Å; R99-G103 PolarHBondContact O-N 2.65Å
100I85.5Confident84.5Confident112 Ų112104.7 Ų104.757%0.57452%0.516SS*.Hα-helixtrans-68.7-44.8176.2-69.2163000110.1K96 S97 A98 G103 C104K96-I100 VanDerWaalsContact O-CG1 3.27Å; K96-I100 WeakPolarHBondContact O-CG1 3.19Å; K96-I100 PolarHBondContact O-N 3.18Å; S97-I100 PolarHBondContact O-N 2.77Å; S97-I100 VanDerWaalsContact O-N 3.15Å; A98-I100 VanDerWaalsContact C-N 3.34Å; A98-I100 PolarHBondContact O-N 3.4Å; I100-G103 CarbonylContact O-C 3.59Å; I100-G103 PolarHBondContact O-N 3.36Å; I100-C104 PolarHBondContact O-N 2.94Å; I100-C104 PolarHBondContact O-SG 3.49Å; I100-C104 VanDerWaalsContact O-SG 3.32Å
101E86.7Confident84.7Confident135 Ų135104.6 Ų104.663%0.63152%0.516SS*.Hα-helixtrans-60.2-51.6175.6-72.8176.4176.700111.4S97 A98 G103 C104 D105S97-E101 PolarHBondContact O-N 2.77Å; A98-E101 PolarHBondContact O-N 3.3Å; E101-G103 PolarHBondContact O-N 3.08Å; E101-C104 WeakPolarHBondContact O-CB 3.48Å; E101-C104 PolarHBondContact O-N 3.14Å; E101-C104 VanDerWaalsContact O-N 3.13Å; E101-D105 PolarHBondContact O-N 3.07Å
102V84.1Confident85Confident80 Ų80105.6 Ų105.649%0.48552%0.52SS..Hα-helixtrans-60.4-34.4174.8173.70000111.4A98 D105 L106A98-V102 WeakPolarHBondContact O-CB 3.2Å; A98-V102 VanDerWaalsContact O-CG2 3.28Å; A98-V102 WeakPolarHBondContact O-CG2 3.06Å; A98-V102 PolarHBondContact O-N 3.27Å; V102-D105 PolarHBondContact O-N 2.64Å; V102-L106 HydrophobicContact CG1-CD1 3.9Å; V102-L106 HydrophobicContact CG1-CG 4.25Å; V102-L106 VanDerWaalsContact O-CB 3.27Å; V102-L106 WeakPolarHBondContact O-CB 3.27Å; V102-L106 WeakPolarHBondContact O-CG 3.29Å; V102-L106 PolarHBondContact O-N 3.5Å
103G86.4Confident85.5Confident34 Ų34106.1 Ų106.135%0.35152%0.524SS..Hα-helixtrans-67-40.8175.600000113.1R99 I100 E101 Y107R99-G103 WeakPolarHBondContact O-CA 3.4Å; R99-G103 PolarHBondContact O-N 2.65Å; I100-G103 CarbonylContact O-C 3.59Å; I100-G103 PolarHBondContact O-N 3.36Å; E101-G103 PolarHBondContact O-N 3.08Å; G103-Y107 VanDerWaalsContact O-CB 3.31Å; G103-Y107 WeakPolarHBondContact O-CB 3.5Å; G103-Y107 PolarHBondContact O-N 3.25Å
104C86.7Confident85.5Confident68 Ų68102.6 Ų102.646%0.45952%0.518SS..Hα-helixtrans-64.7-43.8173.4-70.80000111.1I100 E101 Y107 N108I100-C104 PolarHBondContact O-N 2.94Å; I100-C104 PolarHBondContact O-SG 3.49Å; I100-C104 VanDerWaalsContact O-SG 3.32Å; E101-C104 WeakPolarHBondContact O-CB 3.48Å; E101-C104 PolarHBondContact O-N 3.14Å; E101-C104 VanDerWaalsContact O-N 3.13Å; C104-Y107 PolarHBondContact O-N 3.14Å; C104-N108 VanDerWaalsContact O-CG 3.29Å; C104-N108 PolarHBondContact O-N 3.32Å; C104-N108 PolarHBondContact O-ND2 3.13Å
105D86.8Confident85.7Confident104 Ų104101.6 Ų101.656%0.55652%0.518SS*.Hα-helixtrans-63.6-45.8176.6-69.1-18.8000111.3E101 V102 Y107 N108 L109E101-D105 PolarHBondContact O-N 3.07Å; V102-D105 PolarHBondContact O-N 2.64Å; D105-Y107 VanDerWaalsContact C-N 3.33Å; D105-Y107 PolarHBondContact O-N 2.77Å; D105-N108 PolarHBondContact O-N 3.47Å; D105-L109 WeakPolarHBondContact O-CB 3.27Å; D105-L109 PolarHBondContact O-N 3.49Å
106L83.6Confident85.9Confident104 Ų104101.3 Ų101.355%0.54552%0.515SS..Hα-helixtrans-62.1-39175.4-78172.1000112.2V102 L109 Q110V102-L106 HydrophobicContact CG1-CD1 3.9Å; V102-L106 HydrophobicContact CG1-CG 4.25Å; V102-L106 VanDerWaalsContact O-CB 3.27Å; V102-L106 WeakPolarHBondContact O-CB 3.27Å; V102-L106 WeakPolarHBondContact O-CG 3.29Å; V102-L106 PolarHBondContact O-N 3.5Å; L106-L109 PolarHBondContact O-N 2.88Å; L106-Q110 WeakPolarHBondContact O-CB 3.24Å; L106-Q110 PolarHBondContact O-N 3.35Å
107Y87.9Confident86Confident136 Ų136100.9 Ų100.953%0.53352%0.515SS..Hα-helixtrans-65.6-42.2177.1-177.3-104.6000111.5G103 C104 D105 Q110 Q111G103-Y107 VanDerWaalsContact O-CB 3.31Å; G103-Y107 WeakPolarHBondContact O-CB 3.5Å; G103-Y107 PolarHBondContact O-N 3.25Å; C104-Y107 PolarHBondContact O-N 3.14Å; D105-Y107 VanDerWaalsContact C-N 3.33Å; D105-Y107 PolarHBondContact O-N 2.77Å; Y107-Q110 PolarHBondContact O-N 2.89Å; Y107-Q111 HydrophobicContact CE1-CG 4.29Å; Y107-Q111 WeakPolarHBondContact O-CG 3.22Å; Y107-Q111 PolarHBondContact O-N 3.07Å; Y107-Q111 PolarHBondContact OH-NE2 3.33Å; Y107-Q111 VanDerWaalsContact OH-NE2 3.07Å
108N87.3Confident86.1Confident85 Ų85103 Ų10346%0.45552%0.521SS..Hα-helixtrans-63.6-46174.1-68.7-25.7000111.2C104 D105 Q110 Q111 E112C104-N108 VanDerWaalsContact O-CG 3.29Å; C104-N108 PolarHBondContact O-N 3.32Å; C104-N108 PolarHBondContact O-ND2 3.13Å; D105-N108 PolarHBondContact O-N 3.47Å; N108-Q110 VanDerWaalsContact C-N 3.26Å; N108-Q110 PolarHBondContact O-N 2.85Å; N108-Q111 PolarHBondContact O-N 3.35Å; N108-Q111 VanDerWaalsContact O-N 3.17Å; N108-E112 PolarHBondContact O-N 3.16Å
109L86.1Confident86.5Confident106 Ų106106.2 Ų106.256%0.55553%0.528SS*.Hα-helixtrans-60.2-38.4175.4-134.491.3000111.4D105 L106 E112 L113D105-L109 WeakPolarHBondContact O-CB 3.27Å; D105-L109 PolarHBondContact O-N 3.49Å; L106-L109 PolarHBondContact O-N 2.88Å; L109-E112 PolarHBondContact O-N 2.83Å; L109-L113 WeakPolarHBondContact O-CB 3.49Å; L109-L113 PolarHBondContact O-N 3.35Å
110Q86.3Confident86.7Confident133 Ų133101.4 Ų101.462%0.62152%0.517SS*.Hα-helixtrans-69.2-35.9177.9-170.5173.26.100111.7L106 Y107 N108 A114L106-Q110 WeakPolarHBondContact O-CB 3.24Å; L106-Q110 PolarHBondContact O-N 3.35Å; Y107-Q110 PolarHBondContact O-N 2.89Å; N108-Q110 VanDerWaalsContact C-N 3.26Å; N108-Q110 PolarHBondContact O-N 2.85Å; Q110-A114 VanDerWaalsContact O-CB 3.26Å; Q110-A114 WeakPolarHBondContact O-CB 3.49Å; Q110-A114 PolarHBondContact O-N 3.16Å
111Q87.1Confident86.9Confident87 Ų87100.3 Ų100.341%0.40751%0.512SS..Hα-helixtrans-67.6-40.1172-72.6-165.41.100112.4Y107 N108 K115Y107-Q111 HydrophobicContact CE1-CG 4.29Å; Y107-Q111 WeakPolarHBondContact O-CG 3.22Å; Y107-Q111 PolarHBondContact O-N 3.07Å; Y107-Q111 PolarHBondContact OH-NE2 3.33Å; Y107-Q111 VanDerWaalsContact OH-NE2 3.07Å; N108-Q111 PolarHBondContact O-N 3.35Å; N108-Q111 VanDerWaalsContact O-N 3.17Å; Q111-K115 WeakPolarHBondContact O-CG 3.23Å; Q111-K115 PolarHBondContact O-N 2.7Å
112E87.9Confident87.1Confident109 Ų10997.6 Ų97.651%0.50950%0.502SS..Hα-helixtrans-64.6-44.7173.6-71.4-178.8174.800111.3N108 L109 A114 K115 F116N108-E112 PolarHBondContact O-N 3.16Å; L109-E112 PolarHBondContact O-N 2.83Å; E112-A114 PolarHBondContact O-N 3.36Å; E112-K115 WeakPolarHBondContact O-CB 3.43Å; E112-K115 PolarHBondContact O-N 3.17Å; E112-F116 HydrophobicContact CB-CE2 4.41Å; E112-F116 WeakPolarHBondContact O-CD2 3.25Å; E112-F116 PolarHBondContact O-N 3.07Å
113L87.3Confident87.3Confident87 Ų8799.8 Ų99.846%0.45551%0.505SS..Hα-helixtrans-63.8-40.8177.6-162155.3000111.3L109 K115 F116 Q117L109-L113 WeakPolarHBondContact O-CB 3.49Å; L109-L113 PolarHBondContact O-N 3.35Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 3.01Å; L113-F116 PolarHBondContact O-N 3.02Å; L113-Q117 HydrophobicContact CD2-CG 3.81Å; L113-Q117 VanDerWaalsContact CD2-NE2 3.29Å; L113-Q117 WeakPolarHBondContact O-CB 3.31Å; L113-Q117 WeakPolarHBondContact O-CG 3.29Å; L113-Q117 PolarHBondContact O-N 3.13Å
114A86.2Confident87.3Confident50 Ų50103.3 Ų103.341%0.41351%0.512SS..Hα-helixtrans-63.3-38.1173.900000112.2Q110 E112 Q117 L118Q110-A114 VanDerWaalsContact O-CB 3.26Å; Q110-A114 WeakPolarHBondContact O-CB 3.49Å; Q110-A114 PolarHBondContact O-N 3.16Å; E112-A114 PolarHBondContact O-N 3.36Å; A114-Q117 PolarHBondContact O-N 3.42Å; A114-L118 WeakPolarHBondContact O-CB 3.39Å; A114-L118 PolarHBondContact O-N 3.2Å
115K87.2Confident87.4Confident135 Ų135104.8 Ų104.859%0.58752%0.515SS*.Hα-helixtrans-64.5-43.1172.4-74.7174.1-177.7173.30111.5Q111 E112 L113 L118 Q119Q111-K115 WeakPolarHBondContact O-CG 3.23Å; Q111-K115 PolarHBondContact O-N 2.7Å; E112-K115 WeakPolarHBondContact O-CB 3.43Å; E112-K115 PolarHBondContact O-N 3.17Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 3.01Å; K115-L118 PolarHBondContact O-N 3.26Å; K115-Q119 WeakPolarHBondContact O-CB 3.12Å; K115-Q119 VanDerWaalsContact O-CG 3.29Å; K115-Q119 WeakPolarHBondContact O-CG 3.25Å; K115-Q119 PolarHBondContact O-N 3Å
116F86.9Confident87.6Confident134 Ų134103.8 Ų103.859%0.58851%0.507SS*.Hα-helixtrans-67.4-39.1176.8-71.6-53.3000112.3E112 L113 Q119 L120E112-F116 HydrophobicContact CB-CE2 4.41Å; E112-F116 WeakPolarHBondContact O-CD2 3.25Å; E112-F116 PolarHBondContact O-N 3.07Å; L113-F116 PolarHBondContact O-N 3.02Å; F116-Q119 PolarHBondContact O-N 2.81Å; F116-L120 WeakPolarHBondContact O-CB 3.35Å; F116-L120 PolarHBondContact O-N 2.8Å
117Q87.2Confident87.8Confident109 Ų109105.9 Ų105.951%0.50951%0.509SS..Hα-helixtrans-62-47.3173.1-79.2178.3-23.300111.3L113 A114 Q119 L120 D121L113-Q117 HydrophobicContact CD2-CG 3.81Å; L113-Q117 VanDerWaalsContact CD2-NE2 3.29Å; L113-Q117 WeakPolarHBondContact O-CB 3.31Å; L113-Q117 WeakPolarHBondContact O-CG 3.29Å; L113-Q117 PolarHBondContact O-N 3.13Å; A114-Q117 PolarHBondContact O-N 3.42Å; Q117-Q119 VanDerWaalsContact C-N 3.29Å; Q117-Q119 PolarHBondContact O-N 2.9Å; Q117-L120 CarbonylContact O-C 3.6Å; Q117-L120 WeakPolarHBondContact O-CB 3.43Å; Q117-L120 PolarHBondContact O-N 3.41Å; Q117-L120 VanDerWaalsContact O-N 3.08Å; Q117-D121 WeakPolarHBondContact O-CB 3.42Å; Q117-D121 PolarHBondContact O-N 3.14Å
118L89.2Confident87.9Confident108 Ų108102.1 Ų102.157%0.56551%0.506SS*.Hα-helixtrans-59.5-40.5175.4-168.485000111.8A114 K115 N122A114-L118 WeakPolarHBondContact O-CB 3.39Å; A114-L118 PolarHBondContact O-N 3.2Å; K115-L118 PolarHBondContact O-N 3.26Å; L118-N122 WeakPolarHBondContact O-CB 3.38Å; L118-N122 PolarHBondContact O-N 3.34Å; L118-N122 PolarHBondContact O-ND2 3.45Å
119Q88.9Confident88Confident113 Ų113104 Ų10453%0.52851%0.512SS..Hα-helixtrans-65.7-40.1174.7-74.5175.82.900112K115 F116 Q117 N122 K123K115-Q119 WeakPolarHBondContact O-CB 3.12Å; K115-Q119 VanDerWaalsContact O-CG 3.29Å; K115-Q119 WeakPolarHBondContact O-CG 3.25Å; K115-Q119 PolarHBondContact O-N 3Å; F116-Q119 PolarHBondContact O-N 2.81Å; Q117-Q119 VanDerWaalsContact C-N 3.29Å; Q117-Q119 PolarHBondContact O-N 2.9Å; Q119-N122 PolarHBondContact O-N 2.84Å; Q119-K123 WeakPolarHBondContact O-CB 3.45Å; Q119-K123 VanDerWaalsContact O-CG 3.25Å; Q119-K123 WeakPolarHBondContact O-CG 3.43Å; Q119-K123 PolarHBondContact O-N 3.43Å
120L86.8Confident88.1Confident101 Ų101106.6 Ų106.653%0.52952%0.516SS..Hα-helixtrans-67.5-42.2177.8-154.8106.4000111.3F116 Q117 K123 H124F116-L120 WeakPolarHBondContact O-CB 3.35Å; F116-L120 PolarHBondContact O-N 2.8Å; Q117-L120 CarbonylContact O-C 3.6Å; Q117-L120 WeakPolarHBondContact O-CB 3.43Å; Q117-L120 PolarHBondContact O-N 3.41Å; Q117-L120 VanDerWaalsContact O-N 3.08Å; L120-K123 CarbonylContact O-C 3.6Å; L120-K123 PolarHBondContact O-N 2.84Å; L120-H124 WeakPolarHBondContact O-CB 3.31Å; L120-H124 PolarHBondContact O-N 3.28Å
121D88.1Confident88.1Confident89 Ų89104.1 Ų104.148%0.47650%0.504SS..Hα-helixtrans-63.9-42.5175.4-72.7-17.9000110.9Q117 K123 H124 N125Q117-D121 WeakPolarHBondContact O-CB 3.42Å; Q117-D121 PolarHBondContact O-N 3.14Å; D121-K123 VanDerWaalsContact C-N 3.32Å; D121-K123 PolarHBondContact O-N 3.41Å; D121-H124 PolarHBondContact O-N 3.27Å; D121-N125 WeakPolarHBondContact O-CB 3.2Å; D121-N125 PolarHBondContact O-N 3.24Å; D121-N125 PolarHBondContact O-ND2 3.39Å
122N91.4Very high88.2Confident78 Ų78101.3 Ų101.342%0.41750%0.498SS..Hα-helixtrans-61-41.8172.6-72.1-21.1000111.4L118 Q119 N125 E126L118-N122 WeakPolarHBondContact O-CB 3.38Å; L118-N122 PolarHBondContact O-N 3.34Å; L118-N122 PolarHBondContact O-ND2 3.45Å; Q119-N122 PolarHBondContact O-N 2.84Å; N122-N125 PolarHBondContact O-N 2.92Å; N122-E126 WeakPolarHBondContact O-CB 3.13Å; N122-E126 WeakPolarHBondContact O-CG 3.27Å; N122-E126 PolarHBondContact O-N 3.3Å
123K88.7Confident88.4Confident126 Ų126102 Ų10255%0.54850%0.5SS..Hα-helixtrans-67.9-35.9175.7-70.9-72.9159.5-151.40112.6Q119 L120 D121 E126 Y127Q119-K123 WeakPolarHBondContact O-CB 3.45Å; Q119-K123 VanDerWaalsContact O-CG 3.25Å; Q119-K123 WeakPolarHBondContact O-CG 3.43Å; Q119-K123 PolarHBondContact O-N 3.43Å; L120-K123 CarbonylContact O-C 3.6Å; L120-K123 PolarHBondContact O-N 2.84Å; D121-K123 VanDerWaalsContact C-N 3.32Å; D121-K123 PolarHBondContact O-N 3.41Å; K123-E126 IonicContact NZ-OE1 2.86Å; K123-E126 IonicContact NZ-OE2 3.35Å; K123-E126 PolarHBondContact NZ-OE2 2.8Å; K123-Y127 WeakPolarHBondContact O-CB 3.49Å; K123-Y127 PolarHBondContact O-N 3.11Å
124H87Confident88.4Confident108 Ų108104.2 Ų104.250%0.550%0.503SS..Hα-helixtrans-68.4-39.6173.5-87.5-48.4000111.9L120 D121 Y127 A128L120-H124 WeakPolarHBondContact O-CB 3.31Å; L120-H124 PolarHBondContact O-N 3.28Å; D121-H124 PolarHBondContact O-N 3.27Å; H124-Y127 PolarHBondContact O-N 2.94Å; H124-A128 VanDerWaalsContact O-CB 3.28Å; H124-A128 WeakPolarHBondContact O-CB 3.45Å; H124-A128 PolarHBondContact O-N 3.3Å
125N88.7Confident88.5Confident98 Ų98104.8 Ų104.852%0.52450%0.499SS..Hα-helixtrans-65.1-45.5174-71.5-24000111D121 N122 Y127 A128 E129D121-N125 WeakPolarHBondContact O-CB 3.2Å; D121-N125 PolarHBondContact O-N 3.24Å; D121-N125 PolarHBondContact O-ND2 3.39Å; N122-N125 PolarHBondContact O-N 2.92Å; N125-Y127 VanDerWaalsContact C-N 3.33Å; N125-Y127 PolarHBondContact O-N 3.31Å; N125-A128 PolarHBondContact O-N 3.38Å; N125-E129 WeakPolarHBondContact O-CG 3.27Å; N125-E129 PolarHBondContact O-N 3.08Å
126E89.8Confident88.6Confident84 Ų84103 Ų10339%0.39350%0.496SS..Hα-helixtrans-56.3-48.3172-75.4173.2-16700110.7N122 K123 E129 Y130N122-E126 WeakPolarHBondContact O-CB 3.13Å; N122-E126 WeakPolarHBondContact O-CG 3.27Å; N122-E126 PolarHBondContact O-N 3.3Å; K123-E126 IonicContact NZ-OE1 2.86Å; K123-E126 IonicContact NZ-OE2 3.35Å; K123-E126 PolarHBondContact NZ-OE2 2.8Å; E126-E129 PolarHBondContact O-N 3.22Å; E126-Y130 WeakPolarHBondContact O-CD2 3.41Å; E126-Y130 PolarHBondContact O-N 2.8Å
127Y89.3Confident88.6Confident148 Ų14899.4 Ų99.458%0.5849%0.491SS*.Hα-helixtrans-61.6-44.5177.5-178.3-92.4000112.2K123 H124 N125 E129 Y130 H131K123-Y127 WeakPolarHBondContact O-CB 3.49Å; K123-Y127 PolarHBondContact O-N 3.11Å; H124-Y127 PolarHBondContact O-N 2.94Å; N125-Y127 VanDerWaalsContact C-N 3.33Å; N125-Y127 PolarHBondContact O-N 3.31Å; Y127-E129 VanDerWaalsContact C-N 3.35Å; Y127-E129 PolarHBondContact O-N 2.87Å; Y127-Y130 PolarHBondContact O-N 2.86Å; Y127-H131 HydrophobicContact CD1-CB 4.47Å; Y127-H131 HydrophobicContact CE1-CB 4.25Å; Y127-H131 WeakPolarHBondContact O-CB 3.32Å; Y127-H131 PolarHBondContact O-N 3.39Å
128A88.3Confident88.6Confident57 Ų5797.8 Ų97.847%0.47148%0.483SS..Hα-helixtrans-64.1-38.317800000111.8H124 N125 G132H124-A128 VanDerWaalsContact O-CB 3.28Å; H124-A128 WeakPolarHBondContact O-CB 3.45Å; H124-A128 PolarHBondContact O-N 3.3Å; N125-A128 PolarHBondContact O-N 3.38Å; A128-G132 PolarHBondContact O-N 3.17Å
129E89.1Confident88.7Confident124 Ų12497 Ų9758%0.57948%0.48SS*.Hα-helixtrans-64.8-45.5172.3-76.3-171-175.300112.2N125 E126 Y127 K133N125-E129 WeakPolarHBondContact O-CG 3.27Å; N125-E129 PolarHBondContact O-N 3.08Å; E126-E129 PolarHBondContact O-N 3.22Å; Y127-E129 VanDerWaalsContact C-N 3.35Å; Y127-E129 PolarHBondContact O-N 2.87Å; E129-K133 WeakPolarHBondContact O-CB 3.46Å; E129-K133 VanDerWaalsContact O-CG 3.26Å; E129-K133 WeakPolarHBondContact O-CG 3.44Å; E129-K133 PolarHBondContact O-N 3.35Å
130Y88.7Confident88.7Confident161 Ų16198.7 Ų98.763%0.63149%0.485SS*.Hα-helixtrans-65.6-39.9176.6-78.8-64.1000111.8E126 Y127 K133 Y134E126-Y130 WeakPolarHBondContact O-CD2 3.41Å; E126-Y130 PolarHBondContact O-N 2.8Å; Y127-Y130 PolarHBondContact O-N 2.86Å; Y130-K133 PolarHBondContact O-N 3.15Å; Y130-Y134 WeakPolarHBondContact O-CB 3.48Å; Y130-Y134 PolarHBondContact O-N 3.44Å
131H87.4Confident88.6Confident81 Ų8197.3 Ų97.338%0.37548%0.478SS..Hα-helixtrans-68.3-43.5177.7-163.742.8000111Y127 K133 Y134 D135Y127-H131 HydrophobicContact CD1-CB 4.47Å; Y127-H131 HydrophobicContact CE1-CB 4.25Å; Y127-H131 WeakPolarHBondContact O-CB 3.32Å; Y127-H131 PolarHBondContact O-N 3.39Å; H131-K133 VanDerWaalsContact C-N 3.32Å; H131-K133 PolarHBondContact O-N 2.81Å; H131-Y134 CarbonylContact O-C 3.56Å; H131-Y134 WeakPolarHBondContact O-CA 3.4Å; H131-Y134 WeakPolarHBondContact O-CB 3.42Å; H131-Y134 PolarHBondContact O-N 3.41Å; H131-Y134 VanDerWaalsContact O-N 3.09Å; H131-D135 IonicContact CD2-OD2 3.77Å; H131-D135 IonicContact CE1-OD1 3.61Å; H131-D135 IonicContact CE1-OD2 2.76Å; H131-D135 IonicContact NE2-OD2 2.75Å; H131-D135 WeakPolarHBondContact O-CB 3.29Å; H131-D135 PolarHBondContact O-N 2.7Å
132G89Confident88.6Confident28 Ų2895.6 Ų95.629%0.28947%0.471SS..Hα-helixtrans-62.5-36172.800000113.1A128 N136A128-G132 PolarHBondContact O-N 3.17Å; G132-N136 VanDerWaalsContact O-CB 3.23Å; G132-N136 WeakPolarHBondContact O-CB 3.49Å; G132-N136 VanDerWaalsContact O-CG 3.24Å; G132-N136 PolarHBondContact O-N 3.11Å; G132-N136 PolarHBondContact O-ND2 3.04Å
133K90.6Very high88.5Confident123 Ų12394.9 Ų94.954%0.53547%0.469SS..Hα-helixtrans-66.6-41.2170.9-74.7167.6-173.9161.20111.7E129 Y130 H131 A137E129-K133 WeakPolarHBondContact O-CB 3.46Å; E129-K133 VanDerWaalsContact O-CG 3.26Å; E129-K133 WeakPolarHBondContact O-CG 3.44Å; E129-K133 PolarHBondContact O-N 3.35Å; Y130-K133 PolarHBondContact O-N 3.15Å; H131-K133 VanDerWaalsContact C-N 3.32Å; H131-K133 PolarHBondContact O-N 2.81Å; K133-A137 WeakPolarHBondContact O-CB 3.46Å; K133-A137 PolarHBondContact O-N 3.4Å
134Y88.9Confident88.4Confident134 Ų13494.7 Ų94.753%0.52547%0.474SS..Hα-helixtrans-63.1-49.5176176.1-93.3000111.5Y130 H131 N136 A137 Q138Y130-Y134 WeakPolarHBondContact O-CB 3.48Å; Y130-Y134 PolarHBondContact O-N 3.44Å; H131-Y134 CarbonylContact O-C 3.56Å; H131-Y134 WeakPolarHBondContact O-CA 3.4Å; H131-Y134 WeakPolarHBondContact O-CB 3.42Å; H131-Y134 PolarHBondContact O-N 3.41Å; H131-Y134 VanDerWaalsContact O-N 3.09Å; Y134-N136 PolarHBondContact O-N 3.43Å; Y134-A137 CarbonylContact O-C 3.55Å; Y134-A137 WeakPolarHBondContact O-CB 3.23Å; Y134-A137 PolarHBondContact O-N 2.69Å; Y134-A137 VanDerWaalsContact O-N 3.12Å; Y134-Q138 WeakPolarHBondContact O-CB 3.29Å; Y134-Q138 PolarHBondContact O-N 2.99Å
135D88Confident88.5Confident62 Ų6297.2 Ų97.233%0.33248%0.479SS..Hα-helixtrans-63.5-40.9178.1-72-15.6000111.3H131 A137 Q138 N139H131-D135 IonicContact CD2-OD2 3.77Å; H131-D135 IonicContact CE1-OD1 3.61Å; H131-D135 IonicContact CE1-OD2 2.76Å; H131-D135 IonicContact NE2-OD2 2.75Å; H131-D135 WeakPolarHBondContact O-CB 3.29Å; H131-D135 PolarHBondContact O-N 2.7Å; D135-A137 VanDerWaalsContact C-N 3.34Å; D135-A137 PolarHBondContact O-N 2.83Å; D135-Q138 PolarHBondContact O-N 3.02Å; D135-N139 VanDerWaalsContact O-CB 3.24Å; D135-N139 WeakPolarHBondContact O-CB 3.33Å; D135-N139 PolarHBondContact O-N 3.07Å; D135-N139 PolarHBondContact O-ND2 2.99Å
136N89.3Confident88.6Confident98 Ų9897.9 Ų97.952%0.52448%0.479SS..Hα-helixtrans-62.1-40.5172.9-82.1-40.2000112.4G132 Y134 K140G132-N136 VanDerWaalsContact O-CB 3.23Å; G132-N136 WeakPolarHBondContact O-CB 3.49Å; G132-N136 VanDerWaalsContact O-CG 3.24Å; G132-N136 PolarHBondContact O-N 3.11Å; G132-N136 PolarHBondContact O-ND2 3.04Å; Y134-N136 PolarHBondContact O-N 3.43Å; N136-K140 WeakPolarHBondContact O-CB 3.35Å; N136-K140 WeakPolarHBondContact O-CG 3.35Å; N136-K140 PolarHBondContact O-N 3.47Å
137A86.8Confident88.6Confident57 Ų57101.1 Ų101.147%0.47149%0.492SS..Hα-helixtrans-68.3-39.2175.700000111.7K133 Y134 D135 K140 L141K133-A137 WeakPolarHBondContact O-CB 3.46Å; K133-A137 PolarHBondContact O-N 3.4Å; Y134-A137 CarbonylContact O-C 3.55Å; Y134-A137 WeakPolarHBondContact O-CB 3.23Å; Y134-A137 PolarHBondContact O-N 2.69Å; Y134-A137 VanDerWaalsContact O-N 3.12Å; D135-A137 VanDerWaalsContact C-N 3.34Å; D135-A137 PolarHBondContact O-N 2.83Å; A137-K140 PolarHBondContact O-N 3.28Å; A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 PolarHBondContact O-N 3.46Å
138Q87.5Confident88.4Confident75 Ų75100.1 Ų100.135%0.3549%0.492SS..Hα-helixtrans-67.7-42.4177.5-166.472.2-12.700111.3Y134 D135 L141 T142Y134-Q138 WeakPolarHBondContact O-CB 3.29Å; Y134-Q138 PolarHBondContact O-N 2.99Å; D135-Q138 PolarHBondContact O-N 3.02Å; Q138-L141 CarbonylContact O-C 3.54Å; Q138-L141 WeakPolarHBondContact O-CA 3.07Å; Q138-L141 WeakPolarHBondContact O-CB 3.39Å; Q138-L141 PolarHBondContact O-N 3.5Å; Q138-L141 VanDerWaalsContact O-N 3.11Å; Q138-T142 WeakPolarHBondContact O-CG2 3.46Å; Q138-T142 PolarHBondContact O-N 2.9Å; Q138-T142 PolarHBondContact O-OG1 3.44Å
139N90.2Very high88.6Confident93 Ų93102.8 Ų102.850%0.49750%0.495SS..Hα-helixtrans-65.1-38.8173.9-71.9-21000111.7D135 L141 T142 T143D135-N139 VanDerWaalsContact O-CB 3.24Å; D135-N139 WeakPolarHBondContact O-CB 3.33Å; D135-N139 PolarHBondContact O-N 3.07Å; D135-N139 PolarHBondContact O-ND2 2.99Å; N139-L141 VanDerWaalsContact C-N 3.32Å; N139-T142 VanDerWaalsContact CA-OG1 3.31Å; N139-T142 WeakPolarHBondContact CA-OG1 3.45Å; N139-T142 PolarHBondContact O-OG1 2.88Å; N139-T143 WeakPolarHBondContact O-CB 3.39Å; N139-T143 VanDerWaalsContact O-CG2 3.25Å; N139-T143 WeakPolarHBondContact O-CG2 3.49Å; N139-T143 PolarHBondContact O-N 2.76Å; N139-T143 PolarHBondContact O-OG1 2.6Å
140K89.1Confident88.7Confident148 Ų148102 Ų10264%0.64349%0.493SS*.Hα-helixtrans-62.3-40.7169.9-76.3172.5-175.9179.60111.1N136 A137 T143 L144N136-K140 WeakPolarHBondContact O-CB 3.35Å; N136-K140 WeakPolarHBondContact O-CG 3.35Å; N136-K140 PolarHBondContact O-N 3.47Å; A137-K140 PolarHBondContact O-N 3.28Å; K140-T143 WeakPolarHBondContact CA-OG1 3.08Å; K140-T143 PolarHBondContact O-OG1 3.19Å; K140-L144 WeakPolarHBondContact O-CB 3.32Å; K140-L144 PolarHBondContact O-N 3.15Å
141L84.9Confident88.6Confident72 Ų7297.6 Ų97.638%0.37749%0.486SS..Hα-helixtrans-67-43.6177.9-168.982.8000112.2A137 Q138 N139 L144 R145A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 PolarHBondContact O-N 3.46Å; Q138-L141 CarbonylContact O-C 3.54Å; Q138-L141 WeakPolarHBondContact O-CA 3.07Å; Q138-L141 WeakPolarHBondContact O-CB 3.39Å; Q138-L141 PolarHBondContact O-N 3.5Å; Q138-L141 VanDerWaalsContact O-N 3.11Å; N139-L141 VanDerWaalsContact C-N 3.32Å; L141-L144 PolarHBondContact O-N 3Å; L141-R145 WeakPolarHBondContact O-CB 3.29Å; L141-R145 VanDerWaalsContact O-CG 3.31Å; L141-R145 WeakPolarHBondContact O-CG 3.4Å; L141-R145 PolarHBondContact O-N 3.17Å
142T88.5Confident88.6Confident52 Ų5296.5 Ų96.532%0.31949%0.485SS..Hα-helixtrans-64.6-48.7177.652.60000110.9Q138 N139 L144 R145 E146Q138-T142 WeakPolarHBondContact O-CG2 3.46Å; Q138-T142 PolarHBondContact O-N 2.9Å; Q138-T142 PolarHBondContact O-OG1 3.44Å; N139-T142 VanDerWaalsContact CA-OG1 3.31Å; N139-T142 WeakPolarHBondContact CA-OG1 3.45Å; N139-T142 PolarHBondContact O-OG1 2.88Å; T142-L144 VanDerWaalsContact C-N 3.28Å; T142-L144 PolarHBondContact O-N 3.36Å; T142-R145 WeakPolarHBondContact O-CB 3.29Å; T142-R145 PolarHBondContact O-N 3.42Å; T142-R145 VanDerWaalsContact O-N 3.12Å; T142-E146 WeakPolarHBondContact O-CG 3.48Å; T142-E146 PolarHBondContact O-N 2.88Å
143T88.9Confident88.6Confident63 Ų63100.7 Ų100.739%0.38750%0.495SS..Hα-helixtrans-60.8-35.9175.953.70000112.5N139 K140 K147N139-T143 WeakPolarHBondContact O-CB 3.39Å; N139-T143 VanDerWaalsContact O-CG2 3.25Å; N139-T143 WeakPolarHBondContact O-CG2 3.49Å; N139-T143 PolarHBondContact O-N 2.76Å; N139-T143 PolarHBondContact O-OG1 2.6Å; K140-T143 WeakPolarHBondContact CA-OG1 3.08Å; K140-T143 PolarHBondContact O-OG1 3.19Å; T143-K147 WeakPolarHBondContact O-CB 3.4Å; T143-K147 VanDerWaalsContact O-CG 3.25Å; T143-K147 WeakPolarHBondContact O-CG 3.45Å; T143-K147 PolarHBondContact O-N 3.04Å
144L86.6Confident88.5Confident123 Ų12397.8 Ų97.864%0.64449%0.488SS*.Hα-helixtrans-71-37.1176.2-148.4132.6000111.9K140 L141 T142 H148K140-L144 WeakPolarHBondContact O-CB 3.32Å; K140-L144 PolarHBondContact O-N 3.15Å; L141-L144 PolarHBondContact O-N 3Å; T142-L144 VanDerWaalsContact C-N 3.28Å; T142-L144 PolarHBondContact O-N 3.36Å; L144-H148 VanDerWaalsContact O-CB 3.29Å; L144-H148 WeakPolarHBondContact O-CB 3.27Å; L144-H148 PolarHBondContact O-N 2.75Å
145R89.3Confident88.3Confident160 Ų16096.4 Ų96.460%0.60449%0.487SS*.Hα-helixtrans-65.4-43172.2-76.9175.6177.2175.50.3112L141 T142 H148 Q149L141-R145 WeakPolarHBondContact O-CB 3.29Å; L141-R145 VanDerWaalsContact O-CG 3.31Å; L141-R145 WeakPolarHBondContact O-CG 3.4Å; L141-R145 PolarHBondContact O-N 3.17Å; T142-R145 WeakPolarHBondContact O-CB 3.29Å; T142-R145 PolarHBondContact O-N 3.42Å; T142-R145 VanDerWaalsContact O-N 3.12Å; R145-H148 PolarHBondContact O-N 2.93Å; R145-Q149 WeakPolarHBondContact O-CB 3.15Å; R145-Q149 PolarHBondContact O-N 3.25Å
146E90.7Very high88.3Confident113 Ų11397.7 Ų97.753%0.52849%0.494SS..Hα-helixtrans-63.2-47.7175.7-73.9171-179.100111.1T142 H148 Q149 I150T142-E146 WeakPolarHBondContact O-CG 3.48Å; T142-E146 PolarHBondContact O-N 2.88Å; E146-H148 VanDerWaalsContact C-N 3.32Å; E146-H148 PolarHBondContact O-N 3.07Å; E146-Q149 PolarHBondContact O-N 2.81Å; E146-Q149 VanDerWaalsContact O-N 3.16Å; E146-I150 VanDerWaalsContact O-CG1 3.29Å; E146-I150 WeakPolarHBondContact O-CG1 3.35Å; E146-I150 PolarHBondContact O-N 3.41Å
147K89.4Confident88.3Confident152 Ų15298.1 Ų98.166%0.66149%0.493SS*.Hα-helixtrans-58.5-42.8174.1-76.1177.5-179.3-1770112T143 I150 S151T143-K147 WeakPolarHBondContact O-CB 3.4Å; T143-K147 VanDerWaalsContact O-CG 3.25Å; T143-K147 WeakPolarHBondContact O-CG 3.45Å; T143-K147 PolarHBondContact O-N 3.04Å; K147-I150 PolarHBondContact O-N 2.62Å; K147-S151 WeakPolarHBondContact O-CB 3.4Å; K147-S151 PolarHBondContact O-N 3.41Å
148H86.1Confident88.2Confident126 Ų126100.3 Ų100.358%0.58349%0.493SS*.Hα-helixtrans-63.8-43.4175.6-177.265.6000111.5L144 R145 E146 S151 V152L144-H148 VanDerWaalsContact O-CB 3.29Å; L144-H148 WeakPolarHBondContact O-CB 3.27Å; L144-H148 PolarHBondContact O-N 2.75Å; R145-H148 PolarHBondContact O-N 2.93Å; E146-H148 VanDerWaalsContact C-N 3.32Å; E146-H148 PolarHBondContact O-N 3.07Å; H148-S151 WeakPolarHBondContact O-CB 3.4Å; H148-S151 PolarHBondContact O-N 2.86Å; H148-V152 VanDerWaalsContact O-CG2 3.3Å; H148-V152 WeakPolarHBondContact O-CG2 3.37Å; H148-V152 PolarHBondContact O-N 3.45Å
149Q91.5Very high88.1Confident114 Ų11498.9 Ų98.953%0.53349%0.489SS..Hα-helixtrans-65.9-39.8178.3-168.3175.812.300112.2R145 E146 V152 K153R145-Q149 WeakPolarHBondContact O-CB 3.15Å; R145-Q149 PolarHBondContact O-N 3.25Å; E146-Q149 PolarHBondContact O-N 2.81Å; E146-Q149 VanDerWaalsContact O-N 3.16Å; Q149-V152 PolarHBondContact O-N 2.8Å; Q149-K153 WeakPolarHBondContact O-CG 3.16Å; Q149-K153 PolarHBondContact O-N 2.87Å
150I90.9Very high88.1Confident106 Ų106101.8 Ų101.854%0.54450%0.498SS..Hα-helixtrans-61.5-48.6171.9-67.4164.8000109.4E146 K147 V152 K153 T154E146-I150 VanDerWaalsContact O-CG1 3.29Å; E146-I150 WeakPolarHBondContact O-CG1 3.35Å; E146-I150 PolarHBondContact O-N 3.41Å; K147-I150 PolarHBondContact O-N 2.62Å; I150-V152 VanDerWaalsContact C-N 3.28Å; I150-V152 PolarHBondContact O-N 2.9Å; I150-K153 WeakPolarHBondContact O-CB 3.35Å; I150-K153 PolarHBondContact O-N 3.29Å; I150-K153 VanDerWaalsContact O-N 3.11Å; I150-T154 HydrophobicContact CG2-CG2 4.25Å; I150-T154 WeakPolarHBondContact O-CG2 3.2Å; I150-T154 PolarHBondContact O-N 2.81Å; I150-T154 PolarHBondContact O-OG1 3.38Å
151S86.6Confident88Confident69 Ų6999.7 Ų99.748%0.48349%0.489SS..Hα-helixtrans-59.6-36.1177.7-177.50000113.2K147 H148 T154 M155K147-S151 WeakPolarHBondContact O-CB 3.4Å; K147-S151 PolarHBondContact O-N 3.41Å; H148-S151 WeakPolarHBondContact O-CB 3.4Å; H148-S151 PolarHBondContact O-N 2.86Å; S151-T154 WeakPolarHBondContact CA-OG1 3.37Å; S151-T154 PolarHBondContact O-OG1 2.94Å; S151-M155 VanDerWaalsContact O-CB 3.29Å; S151-M155 WeakPolarHBondContact O-CB 3.5Å; S151-M155 PolarHBondContact O-N 3.46Å
152V88.4Confident88.1Confident59 Ų59100.9 Ų100.936%0.35849%0.494SS..Hα-helixtrans-70.8-41.7175.1170.10000110.7H148 Q149 I150 M155 L156H148-V152 VanDerWaalsContact O-CG2 3.3Å; H148-V152 WeakPolarHBondContact O-CG2 3.37Å; H148-V152 PolarHBondContact O-N 3.45Å; Q149-V152 PolarHBondContact O-N 2.8Å; I150-V152 VanDerWaalsContact C-N 3.28Å; I150-V152 PolarHBondContact O-N 2.9Å; V152-M155 PolarHBondContact O-N 3.43Å; V152-L156 HydrophobicContact CG1-CD1 4.13Å; V152-L156 WeakPolarHBondContact O-CB 3.23Å; V152-L156 WeakPolarHBondContact O-CG 3.38Å; V152-L156 PolarHBondContact O-N 3.13Å
153K89.4Confident88.1Confident116 Ų116103.2 Ų103.250%0.50450%0.501SS..Hα-helixtrans-62.5-47.3175.2-76.1178.8179.8-179.40111.7Q149 I150 M155 L156 E157Q149-K153 WeakPolarHBondContact O-CG 3.16Å; Q149-K153 PolarHBondContact O-N 2.87Å; I150-K153 WeakPolarHBondContact O-CB 3.35Å; I150-K153 PolarHBondContact O-N 3.29Å; I150-K153 VanDerWaalsContact O-N 3.11Å; K153-M155 VanDerWaalsContact C-N 3.33Å; K153-M155 PolarHBondContact O-N 3.5Å; K153-L156 CarbonylContact O-C 3.59Å; K153-L156 WeakPolarHBondContact O-CB 3.46Å; K153-L156 PolarHBondContact O-N 3.4Å; K153-L156 VanDerWaalsContact O-N 3.12Å; K153-E157 WeakPolarHBondContact O-CG 3.11Å; K153-E157 PolarHBondContact O-N 2.74Å
154T87.3Confident88Confident62 Ų62102.7 Ų102.738%0.3850%0.499SS..Hα-helixtrans-62.9-40.417757.30000111I150 S151 L156 E157 E158I150-T154 HydrophobicContact CG2-CG2 4.25Å; I150-T154 WeakPolarHBondContact O-CG2 3.2Å; I150-T154 PolarHBondContact O-N 2.81Å; I150-T154 PolarHBondContact O-OG1 3.38Å; S151-T154 WeakPolarHBondContact CA-OG1 3.37Å; S151-T154 PolarHBondContact O-OG1 2.94Å; T154-L156 VanDerWaalsContact C-N 3.34Å; T154-L156 PolarHBondContact O-N 3.46Å; T154-E157 PolarHBondContact O-N 3.31Å; T154-E158 WeakPolarHBondContact O-CB 2.99Å; T154-E158 VanDerWaalsContact O-CG 3.32Å; T154-E158 WeakPolarHBondContact O-CG 3.39Å; T154-E158 PolarHBondContact O-N 2.61Å
155M84.4Confident87.9Confident104 Ų104102.2 Ų102.251%0.51250%0.495SS..Hα-helixtrans-62.8-39173.5-168.8-135.973.500111.9S151 V152 K153 T159S151-M155 VanDerWaalsContact O-CB 3.29Å; S151-M155 WeakPolarHBondContact O-CB 3.5Å; S151-M155 PolarHBondContact O-N 3.46Å; V152-M155 PolarHBondContact O-N 3.43Å; K153-M155 VanDerWaalsContact C-N 3.33Å; K153-M155 PolarHBondContact O-N 3.5Å; M155-T159 HydrophobicContact CE-CG2 4.29Å; M155-T159 WeakPolarHBondContact O-CB 3.41Å; M155-T159 VanDerWaalsContact O-CG2 3.23Å; M155-T159 WeakPolarHBondContact O-CG2 3.35Å; M155-T159 PolarHBondContact O-N 2.96Å; M155-T159 PolarHBondContact O-OG1 3.43Å
156L88.9Confident87.7Confident90 Ų90101.9 Ų101.947%0.47149%0.494SS..Hα-helixtrans-68-36.6175-75.4171.3000112.7V152 K153 T154 T159 K160V152-L156 HydrophobicContact CG1-CD1 4.13Å; V152-L156 WeakPolarHBondContact O-CB 3.23Å; V152-L156 WeakPolarHBondContact O-CG 3.38Å; V152-L156 PolarHBondContact O-N 3.13Å; K153-L156 CarbonylContact O-C 3.59Å; K153-L156 WeakPolarHBondContact O-CB 3.46Å; K153-L156 PolarHBondContact O-N 3.4Å; K153-L156 VanDerWaalsContact O-N 3.12Å; T154-L156 VanDerWaalsContact C-N 3.34Å; T154-L156 PolarHBondContact O-N 3.46Å; L156-T159 VanDerWaalsContact C-OG1 3.31Å; L156-T159 VanDerWaalsContact CA-OG1 3.23Å; L156-T159 WeakPolarHBondContact CA-OG1 3.46Å; L156-T159 PolarHBondContact O-OG1 3.09Å; L156-K160 WeakPolarHBondContact O-CB 3.39Å; L156-K160 VanDerWaalsContact O-CG 3.31Å; L156-K160 WeakPolarHBondContact O-CG 3.1Å; L156-K160 PolarHBondContact O-N 3.31Å
157E88.9Confident87.6Confident106 Ų106101.5 Ų101.550%0.49550%0.496SS..Hα-helixtrans-69.9-45.6175.1-74.3171.1-171.900111.6K153 T154 T159 K160 K161K153-E157 WeakPolarHBondContact O-CG 3.11Å; K153-E157 PolarHBondContact O-N 2.74Å; T154-E157 PolarHBondContact O-N 3.31Å; E157-T159 VanDerWaalsContact C-N 3.33Å; E157-T159 PolarHBondContact O-N 3.4Å; E157-K160 WeakPolarHBondContact O-CB 3.38Å; E157-K160 PolarHBondContact O-N 3.31Å; E157-K161 WeakPolarHBondContact O-CG 3.34Å; E157-K161 PolarHBondContact O-N 3.28Å
158E85.4Confident87.4Confident104 Ų10499.6 Ų99.649%0.48649%0.489SS..Hα-helixtrans-64.8-36.6175.3-70.9-53.5134.300111.8T154 K161 M162T154-E158 WeakPolarHBondContact O-CB 2.99Å; T154-E158 VanDerWaalsContact O-CG 3.32Å; T154-E158 WeakPolarHBondContact O-CG 3.39Å; T154-E158 PolarHBondContact O-N 2.61Å; E158-K161 PolarHBondContact O-N 2.92Å; E158-K161 IonicContact OE1-NZ 3.91Å; E158-K161 PolarHBondContact OE1-NZ 2.97Å; E158-M162 VanDerWaalsContact O-CB 3.23Å; E158-M162 WeakPolarHBondContact O-CB 3.38Å; E158-M162 PolarHBondContact O-N 3.26Å
159T85Confident87.4Confident44 Ų4497.4 Ų97.427%0.2748%0.484SS..Hα-helixtrans-66.5-41.5171.449.80000111.4M155 L156 E157 M162 H163M155-T159 HydrophobicContact CE-CG2 4.29Å; M155-T159 WeakPolarHBondContact O-CB 3.41Å; M155-T159 VanDerWaalsContact O-CG2 3.23Å; M155-T159 WeakPolarHBondContact O-CG2 3.35Å; M155-T159 PolarHBondContact O-N 2.96Å; M155-T159 PolarHBondContact O-OG1 3.43Å; L156-T159 VanDerWaalsContact C-OG1 3.31Å; L156-T159 VanDerWaalsContact CA-OG1 3.23Å; L156-T159 WeakPolarHBondContact CA-OG1 3.46Å; L156-T159 PolarHBondContact O-OG1 3.09Å; E157-T159 VanDerWaalsContact C-N 3.33Å; E157-T159 PolarHBondContact O-N 3.4Å; T159-M162 PolarHBondContact O-N 2.85Å; T159-H163 PolarHBondContact O-N 3.5Å; T159-H163 PolarHBondContact O-ND1 3.28Å
160K89.4Confident87.1Confident154 Ų15496.2 Ų96.267%0.6748%0.482SS*.Hα-helixtrans-62-44.5173.5-77.9175.3-178.5-179.50112.7L156 E157 M162 H163 S164L156-K160 WeakPolarHBondContact O-CB 3.39Å; L156-K160 VanDerWaalsContact O-CG 3.31Å; L156-K160 WeakPolarHBondContact O-CG 3.1Å; L156-K160 PolarHBondContact O-N 3.31Å; E157-K160 WeakPolarHBondContact O-CB 3.38Å; E157-K160 PolarHBondContact O-N 3.31Å; K160-M162 VanDerWaalsContact C-N 3.31Å; K160-M162 PolarHBondContact O-N 2.8Å; K160-H163 PolarHBondContact O-N 2.89Å; K160-S164 PolarHBondContact O-N 3.03Å
161K86.7Confident86.8Confident105 Ų10593.9 Ų93.946%0.45748%0.478SS..Hα-helixtrans-60.8-41.6173.8-71.8177.5-168.3166.50111E157 E158 H163 S164 M165E157-K161 WeakPolarHBondContact O-CG 3.34Å; E157-K161 PolarHBondContact O-N 3.28Å; E158-K161 PolarHBondContact O-N 2.92Å; E158-K161 IonicContact OE1-NZ 3.91Å; E158-K161 PolarHBondContact OE1-NZ 2.97Å; K161-H163 VanDerWaalsContact C-N 3.32Å; K161-H163 PolarHBondContact O-N 3.28Å; K161-S164 WeakPolarHBondContact CA-OG 3.41Å; K161-S164 PolarHBondContact O-N 2.95Å; K161-S164 PolarHBondContact O-OG 3.41Å; K161-M165 VanDerWaalsContact O-CB 3.27Å; K161-M165 WeakPolarHBondContact O-CB 3.13Å; K161-M165 WeakPolarHBondContact O-CG 2.95Å; K161-M165 PolarHBondContact O-N 3.35Å
162M88.8Confident86.7Confident97 Ų9795.1 Ų95.148%0.47848%0.479SS..Hα-helixtrans-62-40.9175.2-179.3-86.9-70.900111.4E158 T159 K160 R166E158-M162 VanDerWaalsContact O-CB 3.23Å; E158-M162 WeakPolarHBondContact O-CB 3.38Å; E158-M162 PolarHBondContact O-N 3.26Å; T159-M162 PolarHBondContact O-N 2.85Å; K160-M162 VanDerWaalsContact C-N 3.31Å; K160-M162 PolarHBondContact O-N 2.8Å; M162-R166 WeakPolarHBondContact O-CB 3.27Å; M162-R166 PolarHBondContact O-N 3.25Å
163H87.4Confident86.4Confident101 Ų10195.5 Ų95.547%0.46848%0.483SS..Hα-helixtrans-67-43.2173.7-71.982.3000112T159 K160 K161 R166 D167T159-H163 PolarHBondContact O-N 3.5Å; T159-H163 PolarHBondContact O-ND1 3.28Å; K160-H163 PolarHBondContact O-N 2.89Å; K161-H163 VanDerWaalsContact C-N 3.32Å; K161-H163 PolarHBondContact O-N 3.28Å; H163-R166 CarbonylContact O-C 3.58Å; H163-R166 WeakPolarHBondContact O-CB 2.88Å; H163-R166 PolarHBondContact O-N 3.33Å; H163-R166 VanDerWaalsContact O-N 3.17Å; H163-D167 VanDerWaalsContact O-CG 3.24Å; H163-D167 PolarHBondContact O-N 3.22Å
164S87.8Confident86.1Confident51 Ų5194.6 Ų94.636%0.35748%0.483SS..Hα-helixtrans-66.3-40177.869.10000112.2K160 K161 R166 D167 E168K160-S164 PolarHBondContact O-N 3.03Å; K161-S164 WeakPolarHBondContact CA-OG 3.41Å; K161-S164 PolarHBondContact O-N 2.95Å; K161-S164 PolarHBondContact O-OG 3.41Å; S164-R166 VanDerWaalsContact C-N 3.28Å; S164-R166 PolarHBondContact O-N 3.49Å; S164-D167 PolarHBondContact O-N 3.3Å; S164-E168 WeakPolarHBondContact O-CB 3.29Å; S164-E168 WeakPolarHBondContact O-CG 3.48Å; S164-E168 PolarHBondContact O-N 3.32Å
165M83.6Confident86Confident113 Ų113100.3 Ų100.356%0.55750%0.498SS*.Hα-helixtrans-65.9-34.5173.5-68.2-68.6-87.200110.7K161 V169K161-M165 VanDerWaalsContact O-CB 3.27Å; K161-M165 WeakPolarHBondContact O-CB 3.13Å; K161-M165 WeakPolarHBondContact O-CG 2.95Å; K161-M165 PolarHBondContact O-N 3.35Å; M165-V169 VanDerWaalsContact O-CB 3.28Å; M165-V169 WeakPolarHBondContact O-CB 3.08Å; M165-V169 WeakPolarHBondContact O-CG2 3.48Å; M165-V169 PolarHBondContact O-N 2.9Å
166R84.7Confident85.7Confident154 Ų154100 Ų10058%0.58150%0.498SS*.Hα-helixtrans-67.7-43.2172.9-172.5173.3-174167.52.4111.6M162 H163 S164 E168 V169 D170M162-R166 WeakPolarHBondContact O-CB 3.27Å; M162-R166 PolarHBondContact O-N 3.25Å; H163-R166 CarbonylContact O-C 3.58Å; H163-R166 WeakPolarHBondContact O-CB 2.88Å; H163-R166 PolarHBondContact O-N 3.33Å; H163-R166 VanDerWaalsContact O-N 3.17Å; S164-R166 VanDerWaalsContact C-N 3.28Å; S164-R166 PolarHBondContact O-N 3.49Å; R166-E168 VanDerWaalsContact C-N 3.34Å; R166-V169 CarbonylContact O-C 3.59Å; R166-V169 PolarHBondContact O-N 3.15Å; R166-D170 WeakPolarHBondContact O-CB 3.21Å; R166-D170 VanDerWaalsContact O-CG 3.24Å; R166-D170 PolarHBondContact O-N 3.34Å
167D88.4Confident85.3Confident105 Ų105102 Ų10256%0.56150%0.5SS*.Hα-helixtrans-64.9-38.4175.1-67.1-22.6000111.3H163 S164 D170 A171H163-D167 VanDerWaalsContact O-CG 3.24Å; H163-D167 PolarHBondContact O-N 3.22Å; S164-D167 PolarHBondContact O-N 3.3Å; D167-D170 PolarHBondContact O-N 3.32Å; D167-A171 WeakPolarHBondContact O-CB 3.22Å; D167-A171 PolarHBondContact O-N 2.97Å
168E85.7Confident84.9Confident111 Ų111104 Ų10452%0.51950%0.504SS..Hα-helixtrans-66.3-43172.7-79179.7-162.400111.4S164 R166 D170 A171 L172S164-E168 WeakPolarHBondContact O-CB 3.29Å; S164-E168 WeakPolarHBondContact O-CG 3.48Å; S164-E168 PolarHBondContact O-N 3.32Å; R166-E168 VanDerWaalsContact C-N 3.34Å; E168-D170 VanDerWaalsContact C-N 3.33Å; E168-A171 PolarHBondContact O-N 2.51Å; E168-L172 WeakPolarHBondContact O-CB 3.39Å; E168-L172 WeakPolarHBondContact O-CG 3.42Å; E168-L172 PolarHBondContact O-N 2.68Å
169V85.2Confident84.6Confident80 Ų80104.4 Ų104.449%0.48551%0.509SS..Hα-helixtrans-62.2-42.7173.3165.80000110.2M165 R166 L172 C173M165-V169 VanDerWaalsContact O-CB 3.28Å; M165-V169 WeakPolarHBondContact O-CB 3.08Å; M165-V169 WeakPolarHBondContact O-CG2 3.48Å; M165-V169 PolarHBondContact O-N 2.9Å; R166-V169 CarbonylContact O-C 3.59Å; R166-V169 PolarHBondContact O-N 3.15Å; V169-L172 CarbonylContact O-C 3.57Å; V169-L172 PolarHBondContact O-N 2.88Å; V169-C173 VanDerWaalsContact O-CB 3.23Å; V169-C173 WeakPolarHBondContact O-CB 3.17Å; V169-C173 PolarHBondContact O-N 3.11Å; V169-C173 PolarHBondContact O-SG 2.84Å
170D86.1Confident84.1Confident90 Ų90105.8 Ų105.848%0.48152%0.515SS..Hα-helixtrans-67.2-39.8177.5-73.8-19.1000110.8R166 D167 E168 C173 L174R166-D170 WeakPolarHBondContact O-CB 3.21Å; R166-D170 VanDerWaalsContact O-CG 3.24Å; R166-D170 PolarHBondContact O-N 3.34Å; D167-D170 PolarHBondContact O-N 3.32Å; E168-D170 VanDerWaalsContact C-N 3.33Å; D170-C173 CarbonylContact O-C 3.54Å; D170-C173 WeakPolarHBondContact O-CB 3.42Å; D170-C173 PolarHBondContact O-N 3.46Å; D170-L174 WeakPolarHBondContact O-CB 3.39Å; D170-L174 PolarHBondContact O-N 2.99Å
171A85.2Confident83.5Confident56 Ų56103.2 Ų103.246%0.46350%0.504SS..Hα-helixtrans-67.6-40174.200000111.9D167 E168 L174 R175D167-A171 WeakPolarHBondContact O-CB 3.22Å; D167-A171 PolarHBondContact O-N 2.97Å; E168-A171 PolarHBondContact O-N 2.51Å; A171-L174 PolarHBondContact O-N 3.44Å; A171-R175 VanDerWaalsContact O-CB 3.26Å; A171-R175 WeakPolarHBondContact O-CB 2.98Å; A171-R175 PolarHBondContact O-N 2.86Å
172L84.2Confident82.9Confident96 Ų96100.8 Ų100.850%0.50350%0.503SS..Hα-helixtrans-67.2-37.6172.7-74.6172.6000110.7E168 V169 R175 L176E168-L172 WeakPolarHBondContact O-CB 3.39Å; E168-L172 WeakPolarHBondContact O-CG 3.42Å; E168-L172 PolarHBondContact O-N 2.68Å; V169-L172 CarbonylContact O-C 3.57Å; V169-L172 PolarHBondContact O-N 2.88Å; L172-R175 PolarHBondContact O-N 2.64Å; L172-L176 WeakPolarHBondContact O-CA 3.11Å; L172-L176 WeakPolarHBondContact O-CB 2.91Å; L172-L176 VanDerWaalsContact O-CG 3.23Å; L172-L176 WeakPolarHBondContact O-CG 3.36Å; L172-L176 PolarHBondContact O-N 3.35Å
173C82Confident81.9Confident67 Ų67102.3 Ų102.345%0.45351%0.507SS..Hα-helixtrans-65.8-39.6172.9-74.80000110.9V169 D170 Y177V169-C173 VanDerWaalsContact O-CB 3.23Å; V169-C173 WeakPolarHBondContact O-CB 3.17Å; V169-C173 PolarHBondContact O-N 3.11Å; V169-C173 PolarHBondContact O-SG 2.84Å; D170-C173 CarbonylContact O-C 3.54Å; D170-C173 WeakPolarHBondContact O-CB 3.42Å; D170-C173 PolarHBondContact O-N 3.46Å; C173-Y177 VanDerWaalsContact O-CB 3.23Å; C173-Y177 WeakPolarHBondContact O-CB 3.36Å; C173-Y177 PolarHBondContact O-N 3.35Å
174L84Confident80.8Confident97 Ų97102.8 Ų102.851%0.50851%0.51SS..Hα-helixtrans-67.3-41.9174.3-16185.6000111.1D170 A171 Y177 Y178D170-L174 WeakPolarHBondContact O-CB 3.39Å; D170-L174 PolarHBondContact O-N 2.99Å; A171-L174 PolarHBondContact O-N 3.44Å; L174-Y177 WeakPolarHBondContact O-CB 3.15Å; L174-Y177 PolarHBondContact O-N 3Å; L174-Y178 HydrophobicContact CD1-CE2 4.4Å; L174-Y178 HydrophobicContact CD2-CD2 4.43Å; L174-Y178 HydrophobicContact CD2-CE2 3.72Å; L174-Y178 HydrophobicContact CG-CD2 4.11Å; L174-Y178 HydrophobicContact CG-CE2 3.64Å; L174-Y178 WeakPolarHBondContact O-CD2 3.22Å; L174-Y178 PolarHBondContact O-N 2.67Å
175R83.9Confident79.8Confident182 Ų182105.6 Ų105.669%0.68752%0.521SS*.Hα-helixtrans-68.1-43177.4-151.2175.9-162-170.74.6110.7A171 L172 Y177 Y178 L179A171-R175 VanDerWaalsContact O-CB 3.26Å; A171-R175 WeakPolarHBondContact O-CB 2.98Å; A171-R175 PolarHBondContact O-N 2.86Å; L172-R175 PolarHBondContact O-N 2.64Å; R175-Y177 VanDerWaalsContact C-N 3.29Å; R175-Y177 PolarHBondContact O-N 3.11Å; R175-Y178 PolarHBondContact O-N 2.63Å; R175-L179 WeakPolarHBondContact O-CB 3.39Å; R175-L179 PolarHBondContact O-N 3.43Å
176L78.1Confident78.8Confident97 Ų97105.8 Ų105.851%0.50853%0.528SS..Hα-helixtrans-61.4-37.5169.7-80.3170000110.9L172 N180L172-L176 WeakPolarHBondContact O-CA 3.11Å; L172-L176 WeakPolarHBondContact O-CB 2.91Å; L172-L176 VanDerWaalsContact O-CG 3.23Å; L172-L176 WeakPolarHBondContact O-CG 3.36Å; L172-L176 PolarHBondContact O-N 3.35Å; L176-N180 WeakPolarHBondContact O-CA 3.39Å; L176-N180 WeakPolarHBondContact O-CB 3.21Å; L176-N180 PolarHBondContact O-N 3.06Å; L176-N180 PolarHBondContact O-ND2 2.84Å
177Y81.4Confident77.5Confident133 Ų13399.2 Ų99.252%0.52251%0.506SS..Hα-helixtrans-63.6-47.3174.2174.1-94.5000111.1C173 L174 R175 K181C173-Y177 VanDerWaalsContact O-CB 3.23Å; C173-Y177 WeakPolarHBondContact O-CB 3.36Å; C173-Y177 PolarHBondContact O-N 3.35Å; L174-Y177 WeakPolarHBondContact O-CB 3.15Å; L174-Y177 PolarHBondContact O-N 3Å; R175-Y177 VanDerWaalsContact C-N 3.29Å; R175-Y177 PolarHBondContact O-N 3.11Å; Y177-K181 HydrophobicContact CE1-CD 4.27Å; Y177-K181 VanDerWaalsContact O-CB 3.27Å; Y177-K181 WeakPolarHBondContact O-CB 3.38Å; Y177-K181 PolarHBondContact O-N 3.44Å
178Y80.1Confident76Confident146 Ų14695.1 Ų95.157%0.57349%0.488SS*.Hα-helixtrans-67.3-38.8176.6-73.2-60000113L174 R175 K181 A182L174-Y178 HydrophobicContact CD1-CE2 4.4Å; L174-Y178 HydrophobicContact CD2-CD2 4.43Å; L174-Y178 HydrophobicContact CD2-CE2 3.72Å; L174-Y178 HydrophobicContact CG-CD2 4.11Å; L174-Y178 HydrophobicContact CG-CE2 3.64Å; L174-Y178 WeakPolarHBondContact O-CD2 3.22Å; L174-Y178 PolarHBondContact O-N 2.67Å; R175-Y178 PolarHBondContact O-N 2.63Å; Y178-K181 PolarHBondContact O-N 3.21Å; Y178-A182 WeakPolarHBondContact O-CB 3.36Å; Y178-A182 PolarHBondContact O-N 3.5Å
179L78.3Confident74.7Confident113 Ų11396.6 Ų96.659%0.59250%0.5SS*.Hα-helixtrans-74.1-34.6179.6-150.7137.1000110.9R175 K183R175-L179 WeakPolarHBondContact O-CB 3.39Å; R175-L179 PolarHBondContact O-N 3.43Å; L179-K183 WeakPolarHBondContact O-CA 3.35Å; L179-K183 WeakPolarHBondContact O-CB 3.26Å; L179-K183 PolarHBondContact O-N 3.28Å
180N75.7Confident72.9Confident73 Ų7398 Ų9839%0.3950%0.504SS..Hα-helixtrans-68.5-34.5167.3-78.9-26000111.2L176 K183 E184L176-N180 WeakPolarHBondContact O-CA 3.39Å; L176-N180 WeakPolarHBondContact O-CB 3.21Å; L176-N180 PolarHBondContact O-N 3.06Å; L176-N180 PolarHBondContact O-ND2 2.84Å; N180-K183 CarbonylContact O-C 3.55Å; N180-K183 PolarHBondContact O-N 3.49Å; N180-E184 WeakPolarHBondContact O-CA 3.37Å; N180-E184 WeakPolarHBondContact O-CB 3.23Å; N180-E184 WeakPolarHBondContact O-CG 3.23Å; N180-E184 PolarHBondContact O-N 2.65Å
181K76.1Confident71.4Confident100 Ų10095.2 Ų95.244%0.43549%0.489SS..Hα-helixtrans-68.1-43.9174.8-167.4144.3-176.5169.60111.5Y177 Y178 E184 D185Y177-K181 HydrophobicContact CE1-CD 4.27Å; Y177-K181 VanDerWaalsContact O-CB 3.27Å; Y177-K181 WeakPolarHBondContact O-CB 3.38Å; Y177-K181 PolarHBondContact O-N 3.44Å; Y178-K181 PolarHBondContact O-N 3.21Å; K181-E184 CarbonylContact O-C 3.57Å; K181-E184 PolarHBondContact O-N 3.26Å; K181-D185 VanDerWaalsContact O-CG 3.28Å; K181-D185 PolarHBondContact O-N 2.67Å
182A73.3Confident70Confident55 Ų5598.3 Ų98.346%0.45550%0.502SS..Hα-helixtrans-65.4-39.1172.500000112.1Y178 D185 V186Y178-A182 WeakPolarHBondContact O-CB 3.36Å; Y178-A182 PolarHBondContact O-N 3.5Å; A182-D185 PolarHBondContact O-N 3.46Å; A182-V186 WeakPolarHBondContact O-CG2 3.13Å; A182-V186 PolarHBondContact O-N 2.7Å
183K68.5Low68.4Low128 Ų128100.9 Ų100.956%0.55752%0.515SS*.Hα-helixtrans-67.2-37.6171.7-177-173.3171.2-172.70110.5L179 N180 D185 V186 S187L179-K183 WeakPolarHBondContact O-CA 3.35Å; L179-K183 WeakPolarHBondContact O-CB 3.26Å; L179-K183 PolarHBondContact O-N 3.28Å; N180-K183 CarbonylContact O-C 3.55Å; N180-K183 PolarHBondContact O-N 3.49Å; K183-D185 VanDerWaalsContact C-N 3.31Å; K183-V186 PolarHBondContact O-N 2.69Å; K183-S187 VanDerWaalsContact O-CA 3.23Å; K183-S187 WeakPolarHBondContact O-CA 3.14Å; K183-S187 WeakPolarHBondContact O-CB 3.17Å; K183-S187 PolarHBondContact O-N 2.75Å; K183-S187 PolarHBondContact O-OG 3.41Å
184E65.5Low66.9Low111 Ų111102.4 Ų102.452%0.51952%0.516SS..Hα-helixtrans-74.3-22.2177.7-82.3178.9168.200111.7N180 K181 G188N180-E184 WeakPolarHBondContact O-CA 3.37Å; N180-E184 WeakPolarHBondContact O-CB 3.23Å; N180-E184 WeakPolarHBondContact O-CG 3.23Å; N180-E184 PolarHBondContact O-N 2.65Å; K181-E184 CarbonylContact O-C 3.57Å; K181-E184 PolarHBondContact O-N 3.26Å; E184-G188 WeakPolarHBondContact O-CA 3.39Å; E184-G188 PolarHBondContact O-N 2.67Å
185D65.9Low65.4Low110 Ų110104.9 Ų104.959%0.58852%0.518SS*.Hα-helixtrans-74.2-47.7168.1-70-23.8000109.6K181 A182 K183 G188K181-D185 VanDerWaalsContact O-CG 3.28Å; K181-D185 PolarHBondContact O-N 2.67Å; A182-D185 PolarHBondContact O-N 3.46Å; K183-D185 VanDerWaalsContact C-N 3.31Å; D185-G188 PolarHBondContact O-N 3.45Å
186V62.3Low64.1Low117 Ų117100.5 Ų100.571%0.70952%0.521SS*.Hα-helixtrans-74.1-36.9179.6175.30000112.9A182 K183A182-V186 WeakPolarHBondContact O-CG2 3.13Å; A182-V186 PolarHBondContact O-N 2.7Å; K183-V186 PolarHBondContact O-N 2.69Å
187S57.3Low63.1Low16 Ų16101.2 Ų101.211%0.11253%0.529CS..Hα-helixtrans-89.9-11.9175.375.30000111.3K183 D189 L190 L191K183-S187 VanDerWaalsContact O-CA 3.23Å; K183-S187 WeakPolarHBondContact O-CA 3.14Å; K183-S187 WeakPolarHBondContact O-CB 3.17Å; K183-S187 PolarHBondContact O-N 2.75Å; K183-S187 PolarHBondContact O-OG 3.41Å; S187-D189 PolarHBondContact O-N 3.14Å; S187-L190 CarbonylContact O-C 3.5Å; S187-L190 PolarHBondContact O-N 3.02Å; S187-L190 VanDerWaalsContact O-N 3.13Å; S187-L191 VanDerWaalsContact O-CA 3.28Å; S187-L191 WeakPolarHBondContact O-CA 3.44Å; S187-L191 WeakPolarHBondContact O-CB 3.27Å; S187-L191 WeakPolarHBondContact O-CD1 3.06Å; S187-L191 WeakPolarHBondContact O-CG 3.46Å; S187-L191 PolarHBondContact O-N 3.36Å; S187-L191 WeakPolarHBondContact OG-CD1 3.42Å
188G57.9Low62Low19 Ų19100.3 Ų100.320%0.19653%0.53CS..Hα-helixtrans-61.3-42167.600000109.9E184 D185 L190 V192E184-G188 WeakPolarHBondContact O-CA 3.39Å; E184-G188 PolarHBondContact O-N 2.67Å; D185-G188 PolarHBondContact O-N 3.45Å; G188-L190 VanDerWaalsContact C-N 3.31Å; G188-L190 PolarHBondContact O-N 3.14Å; G188-V192 WeakPolarHBondContact O-CG2 3.49Å; G188-V192 PolarHBondContact O-N 3.29Å
189D56.9Low61.4Low143 Ų143100.2 Ų100.277%0.76553%0.532SS*.Hα-helixtrans-68.7-27.7173.5-70.1-14.1000112.8S187S187-D189 PolarHBondContact O-N 3.14Å
190L48.6Very low60.6Low108 Ų108100.1 Ų100.157%0.56554%0.536SS*.Hα-helixtrans-91.9-29178.3-147.796.5000114.1S187 G188 L193 Q194S187-L190 CarbonylContact O-C 3.5Å; S187-L190 PolarHBondContact O-N 3.02Å; S187-L190 VanDerWaalsContact O-N 3.13Å; G188-L190 VanDerWaalsContact C-N 3.31Å; G188-L190 PolarHBondContact O-N 3.14Å; L190-L193 WeakPolarHBondContact O-CB 3.43Å; L190-L193 PolarHBondContact O-N 3.37Å; L190-Q194 PolarHBondContact O-N 3.38Å
191L54Low60.4Low33 Ų33101.9 Ų101.917%0.17355%0.546CS..Hα-helixtrans-89.7-14.4-172.3-76.3164.5000112.1S187 L193 Q194 R195S187-L191 VanDerWaalsContact O-CA 3.28Å; S187-L191 WeakPolarHBondContact O-CA 3.44Å; S187-L191 WeakPolarHBondContact O-CB 3.27Å; S187-L191 WeakPolarHBondContact O-CD1 3.06Å; S187-L191 WeakPolarHBondContact O-CG 3.46Å; S187-L191 PolarHBondContact O-N 3.36Å; S187-L191 WeakPolarHBondContact OG-CD1 3.42Å; L191-L193 PolarHBondContact O-N 3.06Å; L191-Q194 HydrophobicContact CD2-CB 4.26Å; L191-Q194 PolarHBondContact O-N 3.41Å; L191-R195 HydrophobicContact CB-CG 4.23Å; L191-R195 HydrophobicContact CD2-CG 4.49Å; L191-R195 WeakPolarHBondContact O-CB 3.2Å; L191-R195 VanDerWaalsContact O-CG 3.26Å; L191-R195 WeakPolarHBondContact O-CG 3.24Å; L191-R195 PolarHBondContact O-N 2.94Å
192V55.2Low60.3Low121 Ų12199.8 Ų99.873%0.73354%0.543SS*.Hα-helixtrans-59.7-29.6160.2173.80000109.9G188G188-V192 WeakPolarHBondContact O-CG2 3.49Å; G188-V192 PolarHBondContact O-N 3.29Å
193L52.5Low60.5Low149 Ų149100 Ų10078%0.7854%0.537SS*.Hα-helixtrans-85.1-28.9176.3-110.6119.1000114.4L190 L191L190-L193 WeakPolarHBondContact O-CB 3.43Å; L190-L193 PolarHBondContact O-N 3.37Å; L191-L193 PolarHBondContact O-N 3.06Å
194Q50Low60.7Low99 Ų9999 Ų9946%0.46354%0.537SS..Hα-helixtrans-100.7-21.3-176.7-74.6-179.6-24.800115.3L190 L191 A196 V197L190-Q194 PolarHBondContact O-N 3.38Å; L191-Q194 HydrophobicContact CD2-CB 4.26Å; L191-Q194 PolarHBondContact O-N 3.41Å; Q194-A196 PolarHBondContact O-N 2.83Å; Q194-V197 PolarHBondContact O-N 2.87Å
195R52Low61.4Low149 Ų14996.5 Ų96.556%0.56253%0.532SS*.THydrogen-bonded Turntrans-63.5-9.9177.4-83175173.4145.9-0.8114.8L191 V197L191-R195 HydrophobicContact CB-CG 4.23Å; L191-R195 HydrophobicContact CD2-CG 4.49Å; L191-R195 WeakPolarHBondContact O-CB 3.2Å; L191-R195 VanDerWaalsContact O-CG 3.26Å; L191-R195 WeakPolarHBondContact O-CG 3.24Å; L191-R195 PolarHBondContact O-N 2.94Å; R195-V197 VanDerWaalsContact C-N 3.34Å
196A56.5Low62Low90 Ų9097.3 Ų97.374%0.74453%0.53SS*.THydrogen-bonded Turntrans-74-22.617100000113.2Q194Q194-A196 PolarHBondContact O-N 2.83Å
197V56.4Low62.8Low113 Ų11398.1 Ų98.169%0.68552%0.524SS*.THydrogen-bonded Turntrans-105.8-34.8-170.8-178.70000113.2Q194 R195Q194-V197 PolarHBondContact O-N 2.87Å; R195-V197 VanDerWaalsContact C-N 3.34Å
198E59.6Low64Low113 Ų113103 Ų10353%0.52855%0.545SS..THydrogen-bonded Turntrans-83.8-11.8-172-69-177.1161.200115.8V200 N201 S202E198-V200 PolarHBondContact O-N 2.71Å; E198-N201 PolarHBondContact O-N 3.33Å; E198-N201 VanDerWaalsContact O-N 3.14Å; E198-S202 PolarHBondContact O-N 3.47Å
199K67.4Low65.3Low144 Ų144106.3 Ų106.363%0.62656%0.559SS**Hα-helixtrans-60.5-31.3-176.8-172162.2-179.2174.90113.1S202 D203K199-S202 PolarHBondContact O-OG 2.89Å; K199-S202 VanDerWaalsContact O-OG 3.08Å; K199-D203 VanDerWaalsContact O-CG 3.24Å; K199-D203 PolarHBondContact O-N 3.29Å
200V61.7Low66.6Low112 Ų112104.4 Ų104.468%0.67955%0.545SS*.Hα-helixtrans-71.2-38.1179179.70000111.8E198 L204E198-V200 PolarHBondContact O-N 2.71Å; V200-L204 PolarHBondContact O-N 2.83Å
201N70.3Confident68.4Low110 Ų110104.8 Ų104.859%0.58854%0.542SS*.Hα-helixtrans-74.7-37.1-178.1-69.7-18000112.3E198 D203 L204 S205E198-N201 PolarHBondContact O-N 3.33Å; E198-N201 VanDerWaalsContact O-N 3.14Å; N201-D203 VanDerWaalsContact C-N 3.29Å; N201-D203 PolarHBondContact O-N 3.45Å; N201-L204 PolarHBondContact O-N 3.46Å; N201-S205 PolarHBondContact O-N 3.36Å
202S74.8Confident69.9Low55 Ų55108 Ų10839%0.38556%0.56SS.*Hα-helixtrans-66.7-33176.5620000112.7E198 K199 K206E198-S202 PolarHBondContact O-N 3.47Å; K199-S202 PolarHBondContact O-OG 2.89Å; K199-S202 VanDerWaalsContact O-OG 3.08Å; S202-K206 WeakPolarHBondContact O-CG 3.06Å; S202-K206 PolarHBondContact O-N 2.73Å
203D76.2Confident71.4Confident61 Ų61111.2 Ų111.233%0.32656%0.558SS.*Hα-helixtrans-72.6-39.3177.9-69.4-13.1000110.1K199 N201 S205 K206 F207K199-D203 VanDerWaalsContact O-CG 3.24Å; K199-D203 PolarHBondContact O-N 3.29Å; N201-D203 VanDerWaalsContact C-N 3.29Å; N201-D203 PolarHBondContact O-N 3.45Å; D203-S205 PolarHBondContact O-N 2.88Å; D203-K206 PolarHBondContact O-N 2.73Å; D203-F207 HydrophobicContact CB-CE2 4.34Å; D203-F207 WeakPolarHBondContact O-CD2 3.41Å; D203-F207 PolarHBondContact O-N 2.68Å; D203-F207 VanDerWaalsContact O-N 3.08Å
204L74Confident73.1Confident106 Ų106108.7 Ų108.756%0.55554%0.542SS*.Hα-helixtrans-59.1-48.3176.2-16478.9000112.7V200 N201 K206 F207 E208V200-L204 PolarHBondContact O-N 2.83Å; N201-L204 PolarHBondContact O-N 3.46Å; L204-K206 VanDerWaalsContact C-N 3.34Å; L204-K206 PolarHBondContact O-N 3.37Å; L204-F207 PolarHBondContact O-N 2.96Å; L204-F207 VanDerWaalsContact O-N 3.16Å; L204-E208 PolarHBondContact O-N 3.4Å
205S79.2Confident75.1Confident59 Ų59108.3 Ų108.341%0.41354%0.544SS..Hα-helixtrans-64.5-35.8179.9171.60000112.8N201 D203 E208 D209N201-S205 PolarHBondContact O-N 3.36Å; D203-S205 PolarHBondContact O-N 2.88Å; S205-E208 PolarHBondContact O-N 3.16Å; S205-D209 PolarHBondContact O-N 3.24Å
206K79.2Confident76.8Confident127 Ų127106.5 Ų106.555%0.55254%0.544SS*.Hα-helixtrans-65-40.4173.3-73.3175-177.5173.40111.9S202 D203 L204 E208 D209 E210S202-K206 WeakPolarHBondContact O-CG 3.06Å; S202-K206 PolarHBondContact O-N 2.73Å; D203-K206 PolarHBondContact O-N 2.73Å; L204-K206 VanDerWaalsContact C-N 3.34Å; L204-K206 PolarHBondContact O-N 3.37Å; K206-E208 VanDerWaalsContact C-N 3.3Å; K206-E208 PolarHBondContact O-N 3.42Å; K206-D209 PolarHBondContact O-N 2.66Å; K206-E210 WeakPolarHBondContact O-CB 3.12Å; K206-E210 WeakPolarHBondContact O-CG 3.32Å; K206-E210 PolarHBondContact O-N 3.41Å
207F79.3Confident78.4Confident133 Ų133107 Ų10758%0.58353%0.534SS*.Hα-helixtrans-64.8-34.1175-73.8-58.9000112.3D203 L204 K211D203-F207 HydrophobicContact CB-CE2 4.34Å; D203-F207 WeakPolarHBondContact O-CD2 3.41Å; D203-F207 PolarHBondContact O-N 2.68Å; D203-F207 VanDerWaalsContact O-N 3.08Å; L204-F207 PolarHBondContact O-N 2.96Å; L204-F207 VanDerWaalsContact O-N 3.16Å; F207-K211 WeakPolarHBondContact O-CB 3.27Å; F207-K211 WeakPolarHBondContact O-CG 3.43Å; F207-K211 PolarHBondContact O-N 2.68Å
208E82.5Confident80.1Confident118 Ų118105.9 Ų105.955%0.55153%0.527SS*.Hα-helixtrans-67-46.2174.3-71.4175.1166.700112.4L204 S205 K206 E210 K211 L212L204-E208 PolarHBondContact O-N 3.4Å; S205-E208 PolarHBondContact O-N 3.16Å; K206-E208 VanDerWaalsContact C-N 3.3Å; K206-E208 PolarHBondContact O-N 3.42Å; E208-E210 VanDerWaalsContact C-N 3.34Å; E208-E210 PolarHBondContact O-N 2.67Å; E208-K211 WeakPolarHBondContact O-CB 3.33Å; E208-K211 PolarHBondContact O-N 2.81Å; E208-K211 VanDerWaalsContact O-N 3.13Å; E208-L212 PolarHBondContact O-N 3.49Å
209D84.6Confident81.6Confident90 Ų90105.4 Ų105.448%0.48153%0.528SS..Hα-helixtrans-63.2-40.4176.8-78.4-20.8000112.1S205 K206 K211 L212 R213S205-D209 PolarHBondContact O-N 3.24Å; K206-D209 PolarHBondContact O-N 2.66Å; D209-K211 VanDerWaalsContact C-N 3.32Å; D209-L212 PolarHBondContact O-N 2.79Å; D209-R213 WeakPolarHBondContact O-CG 2.96Å; D209-R213 PolarHBondContact O-N 3.14Å
210E84.2Confident82.7Confident103 Ų103107.7 Ų107.748%0.48153%0.533SS..Hα-helixtrans-65.1-37.1173.6-74.6179.3-178.800111.6K206 E208 R213 Q214K206-E210 WeakPolarHBondContact O-CB 3.12Å; K206-E210 WeakPolarHBondContact O-CG 3.32Å; K206-E210 PolarHBondContact O-N 3.41Å; E208-E210 VanDerWaalsContact C-N 3.34Å; E208-E210 PolarHBondContact O-N 2.67Å; E210-R213 PolarHBondContact O-N 3.43Å; E210-Q214 VanDerWaalsContact O-CG 3.31Å; E210-Q214 WeakPolarHBondContact O-CG 3.42Å; E210-Q214 PolarHBondContact O-N 2.64Å
211K86.5Confident84.1Confident115 Ų115108 Ų10850%0.553%0.528SS..Hα-helixtrans-65.4-45.4174.2-89.2-73.9166.7-152.50112.4F207 E208 D209 R213 Q214 D215F207-K211 WeakPolarHBondContact O-CB 3.27Å; F207-K211 WeakPolarHBondContact O-CG 3.43Å; F207-K211 PolarHBondContact O-N 2.68Å; E208-K211 WeakPolarHBondContact O-CB 3.33Å; E208-K211 PolarHBondContact O-N 2.81Å; E208-K211 VanDerWaalsContact O-N 3.13Å; D209-K211 VanDerWaalsContact C-N 3.32Å; K211-R213 VanDerWaalsContact C-N 3.33Å; K211-R213 PolarHBondContact O-N 3.33Å; K211-Q214 CarbonylContact O-C 3.58Å; K211-Q214 WeakPolarHBondContact O-CA 3.36Å; K211-Q214 WeakPolarHBondContact O-CB 3.45Å; K211-Q214 PolarHBondContact O-N 2.67Å; K211-Q214 VanDerWaalsContact O-N 3.12Å; K211-D215 VanDerWaalsContact O-CG 3.24Å; K211-D215 PolarHBondContact O-N 3.04Å
212L86.5Confident85.2Confident102 Ų102107 Ų10753%0.53452%0.52SS..Hα-helixtrans-60.5-42.4176.5-177.565.5000111.8E208 D209 Q214 D215 I216E208-L212 PolarHBondContact O-N 3.49Å; D209-L212 PolarHBondContact O-N 2.79Å; L212-Q214 VanDerWaalsContact C-N 3.34Å; L212-D215 PolarHBondContact O-N 3.26Å; L212-I216 HydrophobicContact CD1-CD1 4.47Å; L212-I216 HydrophobicContact CG-CD1 4.21Å; L212-I216 WeakPolarHBondContact O-CG1 3.29Å; L212-I216 PolarHBondContact O-N 2.97Å
213R86.5Confident86Confident188 Ų188107.4 Ų107.471%0.70952%0.52SS*.Hα-helixtrans-63.8-39.6174.6-74.7179.5-176.5165.94.2112.3D209 E210 K211 L217D209-R213 WeakPolarHBondContact O-CG 2.96Å; D209-R213 PolarHBondContact O-N 3.14Å; E210-R213 PolarHBondContact O-N 3.43Å; K211-R213 VanDerWaalsContact C-N 3.33Å; K211-R213 PolarHBondContact O-N 3.33Å; R213-L217 WeakPolarHBondContact O-CB 3.16Å; R213-L217 PolarHBondContact O-N 3.17Å; R213-L217 VanDerWaalsContact O-N 3.16Å
214Q87.2Confident86.8Confident95 Ų95109.5 Ų109.544%0.44453%0.526SS..Hα-helixtrans-61.3-46172.9-76.7175.56.600110.8E210 K211 L212 I216 L217 V218E210-Q214 VanDerWaalsContact O-CG 3.31Å; E210-Q214 WeakPolarHBondContact O-CG 3.42Å; E210-Q214 PolarHBondContact O-N 2.64Å; K211-Q214 CarbonylContact O-C 3.58Å; K211-Q214 WeakPolarHBondContact O-CA 3.36Å; K211-Q214 WeakPolarHBondContact O-CB 3.45Å; K211-Q214 PolarHBondContact O-N 2.67Å; K211-Q214 VanDerWaalsContact O-N 3.12Å; L212-Q214 VanDerWaalsContact C-N 3.34Å; Q214-I216 PolarHBondContact O-N 3.48Å; Q214-L217 PolarHBondContact O-N 3.32Å; Q214-V218 VanDerWaalsContact O-CG2 3.26Å; Q214-V218 WeakPolarHBondContact O-CG2 3.3Å; Q214-V218 PolarHBondContact O-N 2.87Å
215D92.3Very high87.6Confident92 Ų92107.4 Ų107.449%0.49252%0.518SS..Hα-helixtrans-65.1-41.6-177-67.2-19000112.1K211 L212 L217 V218 D219K211-D215 VanDerWaalsContact O-CG 3.24Å; K211-D215 PolarHBondContact O-N 3.04Å; L212-D215 PolarHBondContact O-N 3.26Å; D215-L217 VanDerWaalsContact C-N 3.33Å; D215-L217 PolarHBondContact O-N 3.45Å; D215-V218 PolarHBondContact O-N 2.81Å; D215-D219 WeakPolarHBondContact O-CB 3.18Å; D215-D219 PolarHBondContact O-N 2.73Å
216I88.9Confident88.3Confident110 Ų110107.6 Ų107.656%0.56451%0.514SS*.Hα-helixtrans-63-40.6174.5-67167.6000111.2L212 Q214 D219 R220L212-I216 HydrophobicContact CD1-CD1 4.47Å; L212-I216 HydrophobicContact CG-CD1 4.21Å; L212-I216 WeakPolarHBondContact O-CG1 3.29Å; L212-I216 PolarHBondContact O-N 2.97Å; Q214-I216 PolarHBondContact O-N 3.48Å; I216-D219 PolarHBondContact O-N 3.36Å; I216-R220 PolarHBondContact O-N 2.84Å
217L89Confident89Confident101 Ų101106.5 Ų106.553%0.52951%0.511SS..Hα-helixtrans-66.1-41.3176.8-17764.8000111R213 Q214 D215 R220 M221R213-L217 WeakPolarHBondContact O-CB 3.16Å; R213-L217 PolarHBondContact O-N 3.17Å; R213-L217 VanDerWaalsContact O-N 3.16Å; Q214-L217 PolarHBondContact O-N 3.32Å; D215-L217 VanDerWaalsContact C-N 3.33Å; D215-L217 PolarHBondContact O-N 3.45Å; L217-R220 PolarHBondContact O-N 3.18Å; L217-M221 HydrophobicContact CD1-CE 4.33Å; L217-M221 WeakPolarHBondContact O-CB 3.1Å; L217-M221 VanDerWaalsContact O-CG 3.26Å; L217-M221 WeakPolarHBondContact O-CG 3.25Å; L217-M221 PolarHBondContact O-N 3.27Å
218V91.3Very high89.6Confident89 Ų89104.2 Ų104.254%0.53951%0.505SS..Hα-helixtrans-62.5-44.9175.8169.90000110.6Q214 D215 R220 M221 Q222Q214-V218 VanDerWaalsContact O-CG2 3.26Å; Q214-V218 WeakPolarHBondContact O-CG2 3.3Å; Q214-V218 PolarHBondContact O-N 2.87Å; D215-V218 PolarHBondContact O-N 2.81Å; V218-R220 PolarHBondContact O-N 2.89Å; V218-M221 CarbonylContact O-C 3.57Å; V218-M221 PolarHBondContact O-N 3.12Å; V218-Q222 VanDerWaalsContact O-CB 3.3Å; V218-Q222 WeakPolarHBondContact O-CB 3.5Å; V218-Q222 PolarHBondContact O-N 2.71Å
219D92Very high90.1Very high104 Ų104103.9 Ų103.956%0.55650%0.501SS*.Hα-helixtrans-62.6-42.9178.3-173.459.4000112.3D215 I216 M221 Q222 T223D215-D219 WeakPolarHBondContact O-CB 3.18Å; D215-D219 PolarHBondContact O-N 2.73Å; I216-D219 PolarHBondContact O-N 3.36Å; D219-M221 VanDerWaalsContact C-N 3.33Å; D219-M221 PolarHBondContact O-N 2.69Å; D219-Q222 PolarHBondContact O-N 3.32Å; D219-T223 WeakPolarHBondContact O-CG2 3.25Å; D219-T223 PolarHBondContact O-N 2.71Å; D219-T223 PolarHBondContact O-OG1 3Å
220R91.6Very high90.6Very high191 Ų191105 Ų10572%0.72151%0.508SS*.Hα-helixtrans-63.7-37.8174.5-170.8177.8178.7173.51112.5I216 L217 V218 T223 K224I216-R220 PolarHBondContact O-N 2.84Å; L217-R220 PolarHBondContact O-N 3.18Å; V218-R220 PolarHBondContact O-N 2.89Å; R220-T223 WeakPolarHBondContact CA-OG1 3.19Å; R220-T223 PolarHBondContact O-OG1 3.35Å; R220-K224 WeakPolarHBondContact O-CB 3.22Å; R220-K224 PolarHBondContact O-N 2.82Å
221M90.8Very high91.1Very high120 Ų120103.8 Ų103.859%0.59150%0.504SS*.Hα-helixtrans-69.7-40174.8-71.2-67-176.500111L217 V218 D219 K224 V225L217-M221 HydrophobicContact CD1-CE 4.33Å; L217-M221 WeakPolarHBondContact O-CB 3.1Å; L217-M221 VanDerWaalsContact O-CG 3.26Å; L217-M221 WeakPolarHBondContact O-CG 3.25Å; L217-M221 PolarHBondContact O-N 3.27Å; V218-M221 CarbonylContact O-C 3.57Å; V218-M221 PolarHBondContact O-N 3.12Å; D219-M221 VanDerWaalsContact C-N 3.33Å; D219-M221 PolarHBondContact O-N 2.69Å; M221-K224 PolarHBondContact O-N 3.34Å; M221-V225 WeakPolarHBondContact O-CB 3.47Å; M221-V225 VanDerWaalsContact O-CG2 3.26Å; M221-V225 WeakPolarHBondContact O-CG2 3.25Å; M221-V225 PolarHBondContact O-N 3.35Å
222Q92.9Very high91.3Very high88 Ų88102.8 Ų102.841%0.41150%0.503SS..Hα-helixtrans-65.6-48.2-180-170.961.435.100111.4V218 D219 K224 V225 D226V218-Q222 VanDerWaalsContact O-CB 3.3Å; V218-Q222 WeakPolarHBondContact O-CB 3.5Å; V218-Q222 PolarHBondContact O-N 2.71Å; D219-Q222 PolarHBondContact O-N 3.32Å; Q222-K224 VanDerWaalsContact C-N 3.26Å; Q222-K224 PolarHBondContact O-N 3.47Å; Q222-V225 WeakPolarHBondContact O-CB 3.2Å; Q222-V225 PolarHBondContact O-N 2.71Å; Q222-V225 VanDerWaalsContact O-N 3.1Å; Q222-D226 PolarHBondContact NE2-OD1 3.36Å; Q222-D226 VanDerWaalsContact O-CG 3.3Å; Q222-D226 PolarHBondContact O-N 3.47Å
223T91Very high91.5Very high64 Ų64100.2 Ų100.239%0.39350%0.497SS..Hα-helixtrans-58.5-37.6173.747.50000112.2D219 R220 D226 Q227D219-T223 WeakPolarHBondContact O-CG2 3.25Å; D219-T223 PolarHBondContact O-N 2.71Å; D219-T223 PolarHBondContact O-OG1 3Å; R220-T223 WeakPolarHBondContact CA-OG1 3.19Å; R220-T223 PolarHBondContact O-OG1 3.35Å; T223-D226 PolarHBondContact O-N 3.15Å; T223-Q227 WeakPolarHBondContact O-CG 3.48Å; T223-Q227 PolarHBondContact O-N 2.79Å
224K93Very high91.8Very high104 Ų10495.7 Ų95.745%0.45249%0.486SS..Hα-helixtrans-71.1-36.8175.3-166.950.7170.8168.40112.8R220 M221 Q222 D226 L228R220-K224 WeakPolarHBondContact O-CB 3.22Å; R220-K224 PolarHBondContact O-N 2.82Å; M221-K224 PolarHBondContact O-N 3.34Å; Q222-K224 VanDerWaalsContact C-N 3.26Å; Q222-K224 PolarHBondContact O-N 3.47Å; K224-D226 VanDerWaalsContact C-N 3.34Å; K224-L228 HydrophobicContact CG-CD1 4.4Å; K224-L228 WeakPolarHBondContact O-CB 3.47Å; K224-L228 VanDerWaalsContact O-CG 3.27Å; K224-L228 WeakPolarHBondContact O-CG 3.5Å; K224-L228 PolarHBondContact O-N 2.94Å
225V91.5Very high92.1Very high63 Ų6398 Ų9838%0.38249%0.492SS..Hα-helixtrans-62.8-42.2173164.90000110.6M221 Q222 L228 K229M221-V225 WeakPolarHBondContact O-CB 3.47Å; M221-V225 VanDerWaalsContact O-CG2 3.26Å; M221-V225 WeakPolarHBondContact O-CG2 3.25Å; M221-V225 PolarHBondContact O-N 3.35Å; Q222-V225 WeakPolarHBondContact O-CB 3.2Å; Q222-V225 PolarHBondContact O-N 2.71Å; Q222-V225 VanDerWaalsContact O-N 3.1Å; V225-L228 PolarHBondContact O-N 3.39Å; V225-K229 HydrophobicContact CG1-CD 4.24Å; V225-K229 WeakPolarHBondContact O-CG 3.5Å; V225-K229 PolarHBondContact O-N 3.03Å
226D93.1Very high92.2Very high63 Ų6399.5 Ų99.534%0.33750%0.496SS..Hα-helixtrans-69.7-41.9-179.4-64.8-26.2000111.4Q222 T223 K224 L228 K229 D230Q222-D226 PolarHBondContact NE2-OD1 3.36Å; Q222-D226 VanDerWaalsContact O-CG 3.3Å; Q222-D226 PolarHBondContact O-N 3.47Å; T223-D226 PolarHBondContact O-N 3.15Å; K224-D226 VanDerWaalsContact C-N 3.34Å; D226-L228 VanDerWaalsContact C-N 3.33Å; D226-L228 PolarHBondContact O-N 3.42Å; D226-K229 WeakPolarHBondContact O-CB 3.41Å; D226-K229 PolarHBondContact O-N 2.99Å; D226-K229 VanDerWaalsContact O-N 3.16Å; D226-K229 IonicContact OD1-NZ 2.81Å; D226-K229 PolarHBondContact OD1-NZ 2.85Å; D226-D230 PolarHBondContact O-N 2.66Å
227Q93.8Very high92.3Very high103 Ų10398.6 Ų98.648%0.48150%0.496SS..Hα-helixtrans-55.8-45.8169.9-74.6174.31.700112.5T223 K229 D230 D231T223-Q227 WeakPolarHBondContact O-CG 3.48Å; T223-Q227 PolarHBondContact O-N 2.79Å; Q227-K229 VanDerWaalsContact C-N 3.32Å; Q227-K229 PolarHBondContact O-N 3.11Å; Q227-D230 PolarHBondContact O-N 3.49Å; Q227-D231 PolarHBondContact O-N 3.2Å
228L93.7Very high92.4Very high86 Ų8698.2 Ų98.245%0.4549%0.491SS..Hα-helixtrans-67.5-32.7179.4-73171.2000112.2K224 V225 D226 I232K224-L228 HydrophobicContact CG-CD1 4.4Å; K224-L228 WeakPolarHBondContact O-CB 3.47Å; K224-L228 VanDerWaalsContact O-CG 3.27Å; K224-L228 WeakPolarHBondContact O-CG 3.5Å; K224-L228 PolarHBondContact O-N 2.94Å; V225-L228 PolarHBondContact O-N 3.39Å; D226-L228 VanDerWaalsContact C-N 3.33Å; D226-L228 PolarHBondContact O-N 3.42Å; L228-I232 WeakPolarHBondContact O-CB 3.48Å; L228-I232 WeakPolarHBondContact O-CD1 3.06Å; L228-I232 WeakPolarHBondContact O-CG1 3.04Å; L228-I232 PolarHBondContact O-N 2.84Å
229K92.8Very high92.4Very high110 Ų11098.4 Ų98.448%0.47849%0.488SS..Hα-helixtrans-67.3-42.2173.3-75.6171.8-175.41640111.7V225 D226 Q227 I232 A233V225-K229 HydrophobicContact CG1-CD 4.24Å; V225-K229 WeakPolarHBondContact O-CG 3.5Å; V225-K229 PolarHBondContact O-N 3.03Å; D226-K229 WeakPolarHBondContact O-CB 3.41Å; D226-K229 PolarHBondContact O-N 2.99Å; D226-K229 VanDerWaalsContact O-N 3.16Å; D226-K229 IonicContact OD1-NZ 2.81Å; D226-K229 PolarHBondContact OD1-NZ 2.85Å; Q227-K229 VanDerWaalsContact C-N 3.32Å; Q227-K229 PolarHBondContact O-N 3.11Å; K229-I232 PolarHBondContact O-N 3.39Å; K229-A233 WeakPolarHBondContact O-CB 3.15Å; K229-A233 PolarHBondContact O-N 3.44Å
230D93.3Very high92.4Very high115 Ų11595.6 Ų95.662%0.61548%0.479SS*.Hα-helixtrans-63.2-44.2176.3-70.8-15.8000110.6D226 Q227 I232 A233 L234D226-D230 PolarHBondContact O-N 2.66Å; Q227-D230 PolarHBondContact O-N 3.49Å; D230-I232 PolarHBondContact O-N 2.92Å; D230-A233 PolarHBondContact O-N 2.81Å; D230-L234 WeakPolarHBondContact O-CB 3.49Å; D230-L234 PolarHBondContact O-N 2.85Å
231D94.6Very high92.4Very high76 Ų7688.8 Ų88.841%0.40646%0.464SS..Hα-helixtrans-59.7-46.3174.2-72.9-21000111.4Q227 L234 Y235Q227-D231 PolarHBondContact O-N 3.2Å; D231-L234 PolarHBondContact O-N 3.48Å; D231-Y235 HydrophobicContact CB-CD2 4.49Å; D231-Y235 HydrophobicContact CB-CE2 4.24Å; D231-Y235 WeakPolarHBondContact O-CD2 3.24Å; D231-Y235 PolarHBondContact O-N 3.44Å
232I90.7Very high92.4Very high95 Ų9589 Ų8949%0.48746%0.464SS..Hα-helixtrans-59.1-48.5176.6-72.6163.4000110.6L228 K229 D230 L234 Y235 E236L228-I232 WeakPolarHBondContact O-CB 3.48Å; L228-I232 WeakPolarHBondContact O-CD1 3.06Å; L228-I232 WeakPolarHBondContact O-CG1 3.04Å; L228-I232 PolarHBondContact O-N 2.84Å; K229-I232 PolarHBondContact O-N 3.39Å; D230-I232 PolarHBondContact O-N 2.92Å; I232-L234 VanDerWaalsContact C-N 3.28Å; I232-L234 PolarHBondContact O-N 3.07Å; I232-Y235 PolarHBondContact O-N 3.3Å; I232-E236 HydrophobicContact CG2-CG 4.34Å; I232-E236 WeakPolarHBondContact O-CB 3.19Å; I232-E236 WeakPolarHBondContact O-CG 3.41Å; I232-E236 PolarHBondContact O-N 3.38Å
233A92.3Very high92.3Very high47 Ų4790.1 Ų90.139%0.38847%0.469SS..Hα-helixtrans-60.5-39.4178.600000111.6K229 D230 E236 T237K229-A233 WeakPolarHBondContact O-CB 3.15Å; K229-A233 PolarHBondContact O-N 3.44Å; D230-A233 PolarHBondContact O-N 2.81Å; A233-E236 PolarHBondContact O-N 3.29Å; A233-T237 WeakPolarHBondContact O-CG2 3.32Å; A233-T237 PolarHBondContact O-N 2.74Å; A233-T237 PolarHBondContact O-OG1 3.5Å
234L92.3Very high92.4Very high94 Ų9492.4 Ų92.449%0.49248%0.477SS..Hα-helixtrans-65.8-45.3177.5-147.5155.9000111D230 D231 I232 E236 T237 Q238D230-L234 WeakPolarHBondContact O-CB 3.49Å; D230-L234 PolarHBondContact O-N 2.85Å; D231-L234 PolarHBondContact O-N 3.48Å; I232-L234 VanDerWaalsContact C-N 3.28Å; I232-L234 PolarHBondContact O-N 3.07Å; L234-E236 PolarHBondContact O-N 2.92Å; L234-T237 PolarHBondContact O-N 3.33Å; L234-T237 PolarHBondContact O-OG1 3.41Å; L234-Q238 HydrophobicContact CD2-CG 4.35Å; L234-Q238 WeakPolarHBondContact O-CG 3.37Å; L234-Q238 PolarHBondContact O-N 3.17Å
235Y94Very high92.1Very high143 Ų14393.7 Ų93.756%0.56149%0.485SS*.Hα-helixtrans-64.6-37.9174.7-70.2-56.6000112.8D231 I232 T237 Q238 I239D231-Y235 HydrophobicContact CB-CD2 4.49Å; D231-Y235 HydrophobicContact CB-CE2 4.24Å; D231-Y235 WeakPolarHBondContact O-CD2 3.24Å; D231-Y235 PolarHBondContact O-N 3.44Å; I232-Y235 PolarHBondContact O-N 3.3Å; Y235-T237 PolarHBondContact O-N 2.79Å; Y235-Q238 PolarHBondContact O-N 3.35Å; Y235-I239 VanDerWaalsContact O-CG1 3.27Å; Y235-I239 WeakPolarHBondContact O-CG1 3.08Å; Y235-I239 PolarHBondContact O-N 2.78Å
236E93.6Very high91.9Very high123 Ų12395.9 Ų95.958%0.57549%0.493SS*.Hα-helixtrans-60.8-43.4174-76.3177.8172.700111.6I232 A233 L234 Q238 I239 A240I232-E236 HydrophobicContact CG2-CG 4.34Å; I232-E236 WeakPolarHBondContact O-CB 3.19Å; I232-E236 WeakPolarHBondContact O-CG 3.41Å; I232-E236 PolarHBondContact O-N 3.38Å; A233-E236 PolarHBondContact O-N 3.29Å; L234-E236 PolarHBondContact O-N 2.92Å; E236-Q238 VanDerWaalsContact C-N 3.34Å; E236-Q238 PolarHBondContact O-N 3.04Å; E236-I239 PolarHBondContact O-N 3.41Å; E236-A240 WeakPolarHBondContact O-CB 3.26Å; E236-A240 PolarHBondContact O-N 3.3Å
237T91.2Very high91.9Very high92 Ų9296.8 Ų96.856%0.56450%0.497SS*.Hα-helixtrans-65-36.6175.561.60000112.8A233 L234 Y235 A241A233-T237 WeakPolarHBondContact O-CG2 3.32Å; A233-T237 PolarHBondContact O-N 2.74Å; A233-T237 PolarHBondContact O-OG1 3.5Å; L234-T237 PolarHBondContact O-N 3.33Å; L234-T237 PolarHBondContact O-OG1 3.41Å; Y235-T237 PolarHBondContact O-N 2.79Å; T237-A241 WeakPolarHBondContact O-CB 3.34Å; T237-A241 PolarHBondContact O-N 2.76Å
238Q91Very high91.8Very high92 Ų9295.6 Ų95.643%0.4350%0.497SS..Hα-helixtrans-67.1-44.1175.4-74.4-178.5-3.400112.1L234 Y235 E236 A241 Q242L234-Q238 HydrophobicContact CD2-CG 4.35Å; L234-Q238 WeakPolarHBondContact O-CG 3.37Å; L234-Q238 PolarHBondContact O-N 3.17Å; Y235-Q238 PolarHBondContact O-N 3.35Å; E236-Q238 VanDerWaalsContact C-N 3.34Å; E236-Q238 PolarHBondContact O-N 3.04Å; Q238-A241 PolarHBondContact O-N 3.33Å; Q238-Q242 WeakPolarHBondContact O-CG 3.45Å; Q238-Q242 PolarHBondContact O-N 2.75Å
239I90.8Very high91.5Very high93 Ų9394.8 Ų94.848%0.47750%0.499SS..Hα-helixtrans-60.8-46.6177-69.3165.9000109.9Y235 E236 A241 Q242 E243Y235-I239 VanDerWaalsContact O-CG1 3.27Å; Y235-I239 WeakPolarHBondContact O-CG1 3.08Å; Y235-I239 PolarHBondContact O-N 2.78Å; E236-I239 PolarHBondContact O-N 3.41Å; I239-A241 VanDerWaalsContact C-N 3.34Å; I239-A241 PolarHBondContact O-N 2.84Å; I239-Q242 PolarHBondContact O-N 2.75Å; I239-E243 HydrophobicContact CG2-CG 4.49Å; I239-E243 WeakPolarHBondContact O-CG 3.38Å; I239-E243 PolarHBondContact O-N 2.86Å
240A93Very high91.5Very high45 Ų4593.2 Ų93.237%0.37249%0.493SS..Hα-helixtrans-60.8-41.1177.600000112.6E236 E243 I244E236-A240 WeakPolarHBondContact O-CB 3.26Å; E236-A240 PolarHBondContact O-N 3.3Å; A240-E243 PolarHBondContact O-N 2.99Å; A240-I244 WeakPolarHBondContact O-CG1 3.29Å; A240-I244 PolarHBondContact O-N 3.45Å; A240-I244 VanDerWaalsContact O-N 3.14Å
241A91.2Very high91.4Very high49 Ų4992.8 Ų92.841%0.40549%0.491SS..Hα-helixtrans-63.9-44.2175.500000112T237 Q238 I239 E243 I244 E245T237-A241 WeakPolarHBondContact O-CB 3.34Å; T237-A241 PolarHBondContact O-N 2.76Å; Q238-A241 PolarHBondContact O-N 3.33Å; I239-A241 VanDerWaalsContact C-N 3.34Å; I239-A241 PolarHBondContact O-N 2.84Å; A241-E243 PolarHBondContact O-N 3.29Å; A241-I244 PolarHBondContact O-N 3.12Å; A241-E245 PolarHBondContact O-N 3.22Å
242Q90.3Very high91.2Very high125 Ų12595.4 Ų95.458%0.58450%0.504SS*.Hα-helixtrans-65.1-36.4177.4-73.3177.7-4.300112.5Q238 I239 E245 M246Q238-Q242 WeakPolarHBondContact O-CG 3.45Å; Q238-Q242 PolarHBondContact O-N 2.75Å; I239-Q242 PolarHBondContact O-N 2.75Å; Q242-E245 PolarHBondContact O-N 3.49Å; Q242-M246 VanDerWaalsContact O-CB 3.3Å; Q242-M246 WeakPolarHBondContact O-CB 3.42Å; Q242-M246 PolarHBondContact O-N 3.13Å
243E91.9Very high91.2Very high111 Ų11196.4 Ų96.452%0.51951%0.51SS..Hα-helixtrans-64.1-39.5173.5-76.7-177.617100112I239 A240 A241 M246 N247I239-E243 HydrophobicContact CG2-CG 4.49Å; I239-E243 WeakPolarHBondContact O-CG 3.38Å; I239-E243 PolarHBondContact O-N 2.86Å; A240-E243 PolarHBondContact O-N 2.99Å; A241-E243 PolarHBondContact O-N 3.29Å; E243-M246 PolarHBondContact O-N 2.82Å; E243-N247 VanDerWaalsContact O-CB 3.31Å; E243-N247 WeakPolarHBondContact O-CB 3.27Å; E243-N247 VanDerWaalsContact O-CG 3.26Å; E243-N247 PolarHBondContact O-N 3.08Å; E243-N247 PolarHBondContact O-ND2 3.13Å; E243-N247 VanDerWaalsContact O-ND2 3.09Å
244I91.7Very high91.2Very high111 Ų111100.1 Ų100.157%0.56952%0.515SS*.Hα-helixtrans-65-44.3174.6-66.3165.5000110.5A240 A241 N247 T248A240-I244 WeakPolarHBondContact O-CG1 3.29Å; A240-I244 PolarHBondContact O-N 3.45Å; A240-I244 VanDerWaalsContact O-N 3.14Å; A241-I244 PolarHBondContact O-N 3.12Å; I244-N247 PolarHBondContact O-N 2.68Å; I244-T248 WeakPolarHBondContact O-CB 3.31Å; I244-T248 WeakPolarHBondContact O-CG2 3.12Å; I244-T248 PolarHBondContact O-N 3.45Å; I244-T248 PolarHBondContact O-OG1 2.55Å
245E87.8Confident91.1Very high131 Ų13197.7 Ų97.761%0.61251%0.508SS*.Hα-helixtrans-64.5-39.8176.2-74.8-171.7166.900112.7A241 Q242 T248 S249A241-E245 PolarHBondContact O-N 3.22Å; Q242-E245 PolarHBondContact O-N 3.49Å; E245-T248 VanDerWaalsContact CA-OG1 3.3Å; E245-T248 WeakPolarHBondContact CA-OG1 3.49Å; E245-T248 PolarHBondContact O-OG1 3.4Å; E245-S249 VanDerWaalsContact O-CB 3.27Å; E245-S249 WeakPolarHBondContact O-CB 3.38Å; E245-S249 PolarHBondContact O-N 3.06Å; E245-S249 PolarHBondContact O-OG 2.95Å
246M87.9Confident90.9Very high110 Ų11092.9 Ų92.954%0.54250%0.498SS..Hα-helixtrans-64.3-46.7175.8-171.5-171.274.500110.8Q242 E243 S249 Q250Q242-M246 VanDerWaalsContact O-CB 3.3Å; Q242-M246 WeakPolarHBondContact O-CB 3.42Å; Q242-M246 PolarHBondContact O-N 3.13Å; E243-M246 PolarHBondContact O-N 2.82Å; M246-S249 PolarHBondContact O-N 3.47Å; M246-Q250 VanDerWaalsContact O-CB 3.31Å; M246-Q250 WeakPolarHBondContact O-CB 3.28Å; M246-Q250 PolarHBondContact O-N 3.44Å
247N92.3Very high90.8Very high82 Ų8292.7 Ų92.744%0.43950%0.497SS..Hα-helixtrans-63.6-42.4178.4-78.3-34.8000112.3E243 I244 Q250 N251E243-N247 VanDerWaalsContact O-CB 3.31Å; E243-N247 WeakPolarHBondContact O-CB 3.27Å; E243-N247 VanDerWaalsContact O-CG 3.26Å; E243-N247 PolarHBondContact O-N 3.08Å; E243-N247 PolarHBondContact O-ND2 3.13Å; E243-N247 VanDerWaalsContact O-ND2 3.09Å; I244-N247 PolarHBondContact O-N 2.68Å; N247-Q250 PolarHBondContact O-N 2.91Å; N247-N251 WeakPolarHBondContact O-CB 3.48Å; N247-N251 VanDerWaalsContact O-CG 3.26Å; N247-N251 PolarHBondContact O-N 2.75Å; N247-N251 PolarHBondContact O-ND2 2.78Å
248T91Very high90.8Very high78 Ų7892.4 Ų92.448%0.47950%0.496SS..Hα-helixtrans-65.5-41.4175.949.30000111.8I244 E245 N251 L252I244-T248 WeakPolarHBondContact O-CB 3.31Å; I244-T248 WeakPolarHBondContact O-CG2 3.12Å; I244-T248 PolarHBondContact O-N 3.45Å; I244-T248 PolarHBondContact O-OG1 2.55Å; E245-T248 VanDerWaalsContact CA-OG1 3.3Å; E245-T248 WeakPolarHBondContact CA-OG1 3.49Å; E245-T248 PolarHBondContact O-OG1 3.4Å; T248-N251 PolarHBondContact O-N 3.42Å; T248-L252 WeakPolarHBondContact O-CB 3.21Å; T248-L252 PolarHBondContact O-N 2.61Å
249S88.1Confident90.7Very high69 Ų6994 Ų9448%0.48350%0.503SS..Hα-helixtrans-63.4-41.4174.8-61.50000112.1E245 M246 L252 L253E245-S249 VanDerWaalsContact O-CB 3.27Å; E245-S249 WeakPolarHBondContact O-CB 3.38Å; E245-S249 PolarHBondContact O-N 3.06Å; E245-S249 PolarHBondContact O-OG 2.95Å; M246-S249 PolarHBondContact O-N 3.47Å; S249-L252 WeakPolarHBondContact O-CB 3.44Å; S249-L252 PolarHBondContact O-N 3.28Å; S249-L253 WeakPolarHBondContact O-CG 3.44Å; S249-L253 PolarHBondContact O-N 2.71Å
250Q92.3Very high90.7Very high76 Ų7695.7 Ų95.736%0.35551%0.511SS..Hα-helixtrans-65.9-40.9177.1-172.8165.1-3.900111.9M246 N247 L252 L253 Y254M246-Q250 VanDerWaalsContact O-CB 3.31Å; M246-Q250 WeakPolarHBondContact O-CB 3.28Å; M246-Q250 PolarHBondContact O-N 3.44Å; N247-Q250 PolarHBondContact O-N 2.91Å; Q250-L252 VanDerWaalsContact C-N 3.29Å; Q250-L252 PolarHBondContact O-N 2.83Å; Q250-L253 PolarHBondContact O-N 2.61Å; Q250-Y254 HydrophobicContact CG-CD2 4.07Å; Q250-Y254 HydrophobicContact CG-CE2 3.55Å; Q250-Y254 PolarHBondContact NE2-OH 3.21Å; Q250-Y254 VanDerWaalsContact NE2-OH 3.12Å; Q250-Y254 VanDerWaalsContact O-CD2 3.24Å; Q250-Y254 WeakPolarHBondContact O-CD2 3.43Å; Q250-Y254 PolarHBondContact O-N 3.2Å
251N92.2Very high90.7Very high107 Ų10797.7 Ų97.757%0.57252%0.518SS*.Hα-helixtrans-62-37.6171.8-73-28.1000112.3N247 T248 Y254 A255N247-N251 WeakPolarHBondContact O-CB 3.48Å; N247-N251 VanDerWaalsContact O-CG 3.26Å; N247-N251 PolarHBondContact O-N 2.75Å; N247-N251 PolarHBondContact O-ND2 2.78Å; T248-N251 PolarHBondContact O-N 3.42Å; N251-Y254 PolarHBondContact O-N 2.86Å; N251-A255 WeakPolarHBondContact O-CB 3.14Å; N251-A255 PolarHBondContact O-N 2.7Å
252L89.9Confident90.7Very high131 Ų13199 Ų9969%0.68652%0.521SS*.Hα-helixtrans-67.9-38.7177.6-150125.9000111.6T248 S249 Q250 A255 A256T248-L252 WeakPolarHBondContact O-CB 3.21Å; T248-L252 PolarHBondContact O-N 2.61Å; S249-L252 WeakPolarHBondContact O-CB 3.44Å; S249-L252 PolarHBondContact O-N 3.28Å; Q250-L252 VanDerWaalsContact C-N 3.29Å; Q250-L252 PolarHBondContact O-N 2.83Å; L252-A255 PolarHBondContact O-N 3.31Å; L252-A256 WeakPolarHBondContact O-CB 3.27Å; L252-A256 PolarHBondContact O-N 2.87Å
253L89.8Confident90.7Very high115 Ų11598 Ų9860%0.60252%0.518SS*.Hα-helixtrans-63.6-45.8172-72.6172.9000111.6S249 Q250 A255 A256 E257S249-L253 WeakPolarHBondContact O-CG 3.44Å; S249-L253 PolarHBondContact O-N 2.71Å; Q250-L253 PolarHBondContact O-N 2.61Å; L253-A255 VanDerWaalsContact C-N 3.31Å; L253-A255 PolarHBondContact O-N 2.71Å; L253-A256 PolarHBondContact O-N 2.72Å; L253-A256 VanDerWaalsContact O-N 3.15Å; L253-E257 WeakPolarHBondContact O-CG 3.45Å; L253-E257 PolarHBondContact O-N 3.49Å
254Y92.5Very high90.7Very high125 Ų12597.5 Ų97.549%0.4952%0.519SS..Hα-helixtrans-61.6-38.7175.3-72.1-45.6000112.6Q250 N251 E257 T258Q250-Y254 HydrophobicContact CG-CD2 4.07Å; Q250-Y254 HydrophobicContact CG-CE2 3.55Å; Q250-Y254 PolarHBondContact NE2-OH 3.21Å; Q250-Y254 VanDerWaalsContact NE2-OH 3.12Å; Q250-Y254 VanDerWaalsContact O-CD2 3.24Å; Q250-Y254 WeakPolarHBondContact O-CD2 3.43Å; Q250-Y254 PolarHBondContact O-N 3.2Å; N251-Y254 PolarHBondContact O-N 2.86Å; Y254-E257 PolarHBondContact O-N 3.38Å; Y254-T258 PolarHBondContact O-N 2.77Å; Y254-T258 PolarHBondContact O-OG1 2.8Å
255A90.3Very high90.8Very high43 Ų4397.1 Ų97.136%0.35552%0.518SS..Hα-helixtrans-64.2-39.5174.200000112N251 L252 L253 T258 Q259N251-A255 WeakPolarHBondContact O-CB 3.14Å; N251-A255 PolarHBondContact O-N 2.7Å; L252-A255 PolarHBondContact O-N 3.31Å; L253-A255 VanDerWaalsContact C-N 3.31Å; L253-A255 PolarHBondContact O-N 2.71Å; A255-T258 VanDerWaalsContact CA-OG1 3.3Å; A255-T258 WeakPolarHBondContact CA-OG1 3.4Å; A255-T258 PolarHBondContact O-OG1 3.27Å; A255-T258 VanDerWaalsContact O-OG1 3.06Å; A255-Q259 VanDerWaalsContact O-CG 3.29Å; A255-Q259 WeakPolarHBondContact O-CG 3.05Å; A255-Q259 PolarHBondContact O-N 3.32Å
256A90.4Very high91Very high43 Ų4395.1 Ų95.136%0.35551%0.511SS..Hα-helixtrans-67.9-43175.700000112L252 L253 T258 Q259 M260L252-A256 WeakPolarHBondContact O-CB 3.27Å; L252-A256 PolarHBondContact O-N 2.87Å; L253-A256 PolarHBondContact O-N 2.72Å; L253-A256 VanDerWaalsContact O-N 3.15Å; A256-T258 PolarHBondContact O-N 2.76Å; A256-Q259 PolarHBondContact O-N 3.35Å; A256-M260 WeakPolarHBondContact O-CG 3.41Å; A256-M260 PolarHBondContact O-N 3.38Å
257E90.7Very high91.2Very high118 Ų11896.1 Ų96.155%0.55151%0.512SS*.Hα-helixtrans-59.9-44.7174.5-76.2-177.6167.100111.5L253 Y254 Q259 M260 V261L253-E257 WeakPolarHBondContact O-CG 3.45Å; L253-E257 PolarHBondContact O-N 3.49Å; Y254-E257 PolarHBondContact O-N 3.38Å; E257-Q259 PolarHBondContact O-N 2.78Å; E257-M260 PolarHBondContact O-N 3.48Å; E257-V261 WeakPolarHBondContact O-CG2 3.36Å; E257-V261 PolarHBondContact O-N 3.46Å
258T91.4Very high91.2Very high87 Ų8794.8 Ų94.853%0.53451%0.513SS..Hα-helixtrans-62.6-42.8175.325.90000111.9Y254 A255 A256 M260 V261 T262Y254-T258 PolarHBondContact O-N 2.77Å; Y254-T258 PolarHBondContact O-OG1 2.8Å; A255-T258 VanDerWaalsContact CA-OG1 3.3Å; A255-T258 WeakPolarHBondContact CA-OG1 3.4Å; A255-T258 PolarHBondContact O-OG1 3.27Å; A255-T258 VanDerWaalsContact O-OG1 3.06Å; A256-T258 PolarHBondContact O-N 2.76Å; T258-M260 PolarHBondContact O-N 2.81Å; T258-V261 PolarHBondContact O-N 2.79Å; T258-T262 PolarHBondContact O-N 3.47Å; T258-T262 PolarHBondContact O-OG1 2.97Å
259Q90.3Very high91.3Very high125 Ų12596.2 Ų96.258%0.58451%0.514SS*.Hα-helixtrans-61-41.3174.6-74.5175.921.600112.5A255 A256 E257 V261 T262 I263A255-Q259 VanDerWaalsContact O-CG 3.29Å; A255-Q259 WeakPolarHBondContact O-CG 3.05Å; A255-Q259 PolarHBondContact O-N 3.32Å; A256-Q259 PolarHBondContact O-N 3.35Å; E257-Q259 PolarHBondContact O-N 2.78Å; Q259-V261 VanDerWaalsContact C-N 3.33Å; Q259-V261 PolarHBondContact O-N 2.98Å; Q259-T262 PolarHBondContact O-N 2.81Å; Q259-I263 VanDerWaalsContact O-CG1 3.29Å; Q259-I263 WeakPolarHBondContact O-CG1 3.35Å; Q259-I263 PolarHBondContact O-N 3.3Å
260M89Confident91.6Very high129 Ų12998 Ų9864%0.63552%0.517SS*.Hα-helixtrans-62.6-40175.7-73.1-171.885.600111.9A256 E257 T258 I263 N264A256-M260 WeakPolarHBondContact O-CG 3.41Å; A256-M260 PolarHBondContact O-N 3.38Å; E257-M260 PolarHBondContact O-N 3.48Å; T258-M260 PolarHBondContact O-N 2.81Å; M260-I263 PolarHBondContact O-N 2.94Å; M260-N264 WeakPolarHBondContact O-CB 3.33Å; M260-N264 PolarHBondContact O-N 3.28Å; M260-N264 PolarHBondContact O-ND2 3.48Å
261V93.1Very high91.6Very high86 Ų8698.5 Ų98.552%0.52152%0.522SS..Hα-helixtrans-62.8-45.6174.2173.20000110.8E257 T258 Q259 N264 I265E257-V261 WeakPolarHBondContact O-CG2 3.36Å; E257-V261 PolarHBondContact O-N 3.46Å; T258-V261 PolarHBondContact O-N 2.79Å; Q259-V261 VanDerWaalsContact C-N 3.33Å; Q259-V261 PolarHBondContact O-N 2.98Å; V261-N264 PolarHBondContact O-N 3.3Å; V261-I265 HydrophobicContact CG1-CD1 3.98Å; V261-I265 WeakPolarHBondContact O-CG1 3.4Å; V261-I265 PolarHBondContact O-N 2.83Å
262T91.8Very high91.6Very high76 Ų7697.3 Ų97.347%0.46652%0.519SS..Hα-helixtrans-60-47176.8-52.70000111.9T258 Q259 N264 I265 D266T258-T262 PolarHBondContact O-N 3.47Å; T258-T262 PolarHBondContact O-OG1 2.97Å; Q259-T262 PolarHBondContact O-N 2.81Å; T262-N264 VanDerWaalsContact C-N 3.29Å; T262-N264 PolarHBondContact O-N 2.82Å; T262-I265 WeakPolarHBondContact O-CB 3.29Å; T262-I265 PolarHBondContact O-N 3.48Å; T262-I265 VanDerWaalsContact O-N 3.12Å; T262-D266 PolarHBondContact O-N 3.18Å
263I89.8Confident91.7Very high104 Ų10495.7 Ų95.753%0.53351%0.508SS..Hα-helixtrans-60-40.2177.6-69.4166.2000111.3Q259 M260 I265 D266 K267Q259-I263 VanDerWaalsContact O-CG1 3.29Å; Q259-I263 WeakPolarHBondContact O-CG1 3.35Å; Q259-I263 PolarHBondContact O-N 3.3Å; M260-I263 PolarHBondContact O-N 2.94Å; I263-I265 VanDerWaalsContact C-N 3.35Å; I263-D266 PolarHBondContact O-N 3.2Å; I263-K267 WeakPolarHBondContact O-CB 3.48Å; I263-K267 PolarHBondContact O-N 3.45Å
264N92.5Very high91.9Very high101 Ų10197.3 Ų97.354%0.5451%0.506SS..Hα-helixtrans-65.4-38.5177.1-79.8-31.5000112.2M260 V261 T262 A268M260-N264 WeakPolarHBondContact O-CB 3.33Å; M260-N264 PolarHBondContact O-N 3.28Å; M260-N264 PolarHBondContact O-ND2 3.48Å; V261-N264 PolarHBondContact O-N 3.3Å; T262-N264 VanDerWaalsContact C-N 3.29Å; T262-N264 PolarHBondContact O-N 2.82Å; N264-A268 WeakPolarHBondContact O-CB 3.4Å; N264-A268 PolarHBondContact O-N 3.06Å
265I93.7Very high91.8Very high104 Ų10497.6 Ų97.653%0.53351%0.51SS..Hα-helixtrans-63.8-46.2173.8-67166000110.3V261 T262 I263 K267 A268 H269V261-I265 HydrophobicContact CG1-CD1 3.98Å; V261-I265 WeakPolarHBondContact O-CG1 3.4Å; V261-I265 PolarHBondContact O-N 2.83Å; T262-I265 WeakPolarHBondContact O-CB 3.29Å; T262-I265 PolarHBondContact O-N 3.48Å; T262-I265 VanDerWaalsContact O-N 3.12Å; I263-I265 VanDerWaalsContact C-N 3.35Å; I265-K267 VanDerWaalsContact C-N 3.35Å; I265-K267 PolarHBondContact O-N 2.97Å; I265-A268 WeakPolarHBondContact O-CB 3.43Å; I265-A268 PolarHBondContact O-N 2.66Å; I265-H269 PolarHBondContact O-N 3.39Å
266D92.6Very high92Very high88 Ų8899.8 Ų99.847%0.47152%0.519SS..Hα-helixtrans-62.6-41.3178.7-71.2-17.6000111.9T262 I263 A268 H269 L270T262-D266 PolarHBondContact O-N 3.18Å; I263-D266 PolarHBondContact O-N 3.2Å; D266-A268 PolarHBondContact O-N 3.48Å; D266-H269 WeakPolarHBondContact O-CB 3.41Å; D266-H269 PolarHBondContact O-N 3.02Å; D266-L270 WeakPolarHBondContact O-CB 3.26Å; D266-L270 WeakPolarHBondContact O-CG 3.18Å; D266-L270 PolarHBondContact O-N 3.4Å
267K91.1Very high91.9Very high132 Ų132101 Ų10157%0.57452%0.524SS*.Hα-helixtrans-61.5-43.6174.6-175.6-179.9177.7-178.70111.6I263 I265 H269 L270 L271I263-K267 WeakPolarHBondContact O-CB 3.48Å; I263-K267 PolarHBondContact O-N 3.45Å; I265-K267 VanDerWaalsContact C-N 3.35Å; I265-K267 PolarHBondContact O-N 2.97Å; K267-H269 VanDerWaalsContact C-N 3.31Å; K267-L270 PolarHBondContact O-N 3.23Å; K267-L271 HydrophobicContact CG-CD1 4.34Å; K267-L271 WeakPolarHBondContact O-CB 3.44Å; K267-L271 WeakPolarHBondContact O-CG 3.44Å; K267-L271 PolarHBondContact O-N 3.45Å
268A93.2Very high91.8Very high54 Ų5499.5 Ų99.545%0.44652%0.52SS..Hα-helixtrans-63.5-39.2175.300000111.4N264 I265 D266 T272N264-A268 WeakPolarHBondContact O-CB 3.4Å; N264-A268 PolarHBondContact O-N 3.06Å; I265-A268 WeakPolarHBondContact O-CB 3.43Å; I265-A268 PolarHBondContact O-N 2.66Å; D266-A268 PolarHBondContact O-N 3.48Å; A268-T272 WeakPolarHBondContact O-CB 3.17Å; A268-T272 PolarHBondContact O-N 2.92Å; A268-T272 PolarHBondContact O-OG1 3.28Å
269H92.1Very high91.7Very high108 Ų108100 Ų10050%0.552%0.519SS..Hα-helixtrans-64.5-48177-170.562.2000111.9I265 D266 K267 L271 T272 Q273I265-H269 PolarHBondContact O-N 3.39Å; D266-H269 WeakPolarHBondContact O-CB 3.41Å; D266-H269 PolarHBondContact O-N 3.02Å; K267-H269 VanDerWaalsContact C-N 3.31Å; H269-L271 PolarHBondContact O-N 2.91Å; H269-T272 WeakPolarHBondContact O-CB 3.33Å; H269-T272 PolarHBondContact O-N 3.41Å; H269-T272 VanDerWaalsContact O-N 3.12Å; H269-Q273 PolarHBondContact CD2-NE2 3.31Å; H269-Q273 VanDerWaalsContact CD2-NE2 3.31Å; H269-Q273 PolarHBondContact NE2-NE2 3.11Å; H269-Q273 WeakPolarHBondContact O-CG 3.41Å; H269-Q273 PolarHBondContact O-N 3.46Å
270L93.9Very high91.8Very high106 Ų10695 Ų9556%0.55550%0.501SS*.Hα-helixtrans-61.8-42176.6-76.1169.8000112.4D266 K267 T272 Q273 W274D266-L270 WeakPolarHBondContact O-CB 3.26Å; D266-L270 WeakPolarHBondContact O-CG 3.18Å; D266-L270 PolarHBondContact O-N 3.4Å; K267-L270 PolarHBondContact O-N 3.23Å; L270-T272 VanDerWaalsContact C-N 3.27Å; L270-T272 PolarHBondContact O-N 3.36Å; L270-Q273 PolarHBondContact O-N 2.82Å; L270-W274 VanDerWaalsContact O-CB 3.29Å; L270-W274 WeakPolarHBondContact O-CB 3.23Å; L270-W274 PolarHBondContact O-N 2.83Å
271L93.3Very high91.7Very high87 Ų8793.6 Ų93.646%0.45550%0.495SS..Hα-helixtrans-61.7-37.2173.9-80169.1000112K267 H269 K275K267-L271 HydrophobicContact CG-CD1 4.34Å; K267-L271 WeakPolarHBondContact O-CB 3.44Å; K267-L271 WeakPolarHBondContact O-CG 3.44Å; K267-L271 PolarHBondContact O-N 3.45Å; H269-L271 PolarHBondContact O-N 2.91Å; L271-K275 WeakPolarHBondContact O-CB 3.28Å; L271-K275 WeakPolarHBondContact O-CG 3.36Å; L271-K275 PolarHBondContact O-N 3.12Å
272T92.8Very high91.5Very high82 Ų8294.4 Ų94.450%0.50349%0.493SS..Hα-helixtrans-67.5-49.2175.9-53.10000110.6A268 H269 L270 W274 K275 T276A268-T272 WeakPolarHBondContact O-CB 3.17Å; A268-T272 PolarHBondContact O-N 2.92Å; A268-T272 PolarHBondContact O-OG1 3.28Å; H269-T272 WeakPolarHBondContact O-CB 3.33Å; H269-T272 PolarHBondContact O-N 3.41Å; H269-T272 VanDerWaalsContact O-N 3.12Å; L270-T272 VanDerWaalsContact C-N 3.27Å; L270-T272 PolarHBondContact O-N 3.36Å; T272-W274 VanDerWaalsContact C-N 3.3Å; T272-W274 PolarHBondContact O-N 2.85Å; T272-K275 PolarHBondContact O-N 3.41Å; T272-T276 PolarHBondContact O-N 3.35Å; T272-T276 PolarHBondContact O-OG1 2.92Å
273Q92Very high91.4Very high97 Ų9799.5 Ų99.545%0.45350%0.504SS..Hα-helixtrans-57.6-43.1175.4-70.4-174.2-1.100111.8H269 L270 T276 S277H269-Q273 PolarHBondContact CD2-NE2 3.31Å; H269-Q273 VanDerWaalsContact CD2-NE2 3.31Å; H269-Q273 PolarHBondContact NE2-NE2 3.11Å; H269-Q273 WeakPolarHBondContact O-CG 3.41Å; H269-Q273 PolarHBondContact O-N 3.46Å; L270-Q273 PolarHBondContact O-N 2.82Å; Q273-T276 PolarHBondContact O-N 3.25Å; Q273-S277 WeakPolarHBondContact O-CB 3.44Å; Q273-S277 PolarHBondContact O-N 2.88Å
274W92.3Very high91.4Very high148 Ų148102.8 Ų102.856%0.56151%0.51SS*.Hα-helixtrans-61.4-47.4177.2-179.867.6000111.5L270 T272 T276 S277 L278L270-W274 VanDerWaalsContact O-CB 3.29Å; L270-W274 WeakPolarHBondContact O-CB 3.23Å; L270-W274 PolarHBondContact O-N 2.83Å; T272-W274 VanDerWaalsContact C-N 3.3Å; T272-W274 PolarHBondContact O-N 2.85Å; W274-T276 VanDerWaalsContact C-N 3.33Å; W274-T276 PolarHBondContact O-N 2.94Å; W274-S277 PolarHBondContact O-N 2.82Å; W274-S277 VanDerWaalsContact O-N 3.16Å; W274-S277 PolarHBondContact O-OG 2.97Å; W274-L278 HydrophobicContact CZ2-CD1 4.09Å; W274-L278 PolarHBondContact O-N 2.78Å
275K92.5Very high91.3Very high132 Ų132102.6 Ų102.657%0.57451%0.509SS*.Hα-helixtrans-58.1-42.7173.6-78.2178.6179.4-179.70112.4L271 T272 S277 L278 L279L271-K275 WeakPolarHBondContact O-CB 3.28Å; L271-K275 WeakPolarHBondContact O-CG 3.36Å; L271-K275 PolarHBondContact O-N 3.12Å; T272-K275 PolarHBondContact O-N 3.41Å; K275-S277 VanDerWaalsContact C-N 3.35Å; K275-L278 PolarHBondContact O-N 3.31Å; K275-L279 WeakPolarHBondContact O-CG 3.47Å; K275-L279 PolarHBondContact O-N 2.98Å
276T92.7Very high91.1Very high89 Ų89102.4 Ų102.455%0.54651%0.506SS..Hα-helixtrans-64.4-39.7176.2-50.30000111.7T272 Q273 W274 L279 G280T272-T276 PolarHBondContact O-N 3.35Å; T272-T276 PolarHBondContact O-OG1 2.92Å; Q273-T276 PolarHBondContact O-N 3.25Å; W274-T276 VanDerWaalsContact C-N 3.33Å; W274-T276 PolarHBondContact O-N 2.94Å; T276-L279 PolarHBondContact O-N 2.97Å; T276-G280 PolarHBondContact O-N 3.48Å
277S88.6Confident91Very high68 Ų68100.9 Ų100.948%0.47651%0.506SS..Hα-helixtrans-64.8-39.6176.478.20000111.9Q273 W274 K275 G280 L281Q273-S277 WeakPolarHBondContact O-CB 3.44Å; Q273-S277 PolarHBondContact O-N 2.88Å; W274-S277 PolarHBondContact O-N 2.82Å; W274-S277 VanDerWaalsContact O-N 3.16Å; W274-S277 PolarHBondContact O-OG 2.97Å; K275-S277 VanDerWaalsContact C-N 3.35Å; S277-G280 PolarHBondContact O-N 3.16Å; S277-L281 PolarHBondContact O-N 3.4Å
278L89.3Confident90.9Very high87 Ų87102.1 Ų102.146%0.45551%0.508SS..Hα-helixtrans-65.5-45.5177.4-147.295.1000111W274 K275 G280 L281 Q282W274-L278 HydrophobicContact CZ2-CD1 4.09Å; W274-L278 PolarHBondContact O-N 2.78Å; K275-L278 PolarHBondContact O-N 3.31Å; L278-G280 VanDerWaalsContact C-N 3.3Å; L278-G280 PolarHBondContact O-N 2.97Å; L278-L281 WeakPolarHBondContact O-CB 3.5Å; L278-L281 PolarHBondContact O-N 3.39Å; L278-Q282 WeakPolarHBondContact O-CB 3.13Å; L278-Q282 PolarHBondContact O-N 3.39Å
279L89.6Confident90.8Very high97 Ų97102 Ų10251%0.50851%0.507SS..Hα-helixtrans-60.9-39.9173.2-77165.2000111.7K275 T276 L281 Q282 R283K275-L279 WeakPolarHBondContact O-CG 3.47Å; K275-L279 PolarHBondContact O-N 2.98Å; T276-L279 PolarHBondContact O-N 2.97Å; L279-L281 VanDerWaalsContact C-N 3.35Å; L279-Q282 PolarHBondContact O-N 3.12Å; L279-R283 WeakPolarHBondContact O-CG 3.16Å; L279-R283 PolarHBondContact O-N 2.83Å
280G91.2Very high90.7Very high21 Ų21102.5 Ų102.522%0.21651%0.513CS..Hα-helixtrans-65.4-36.317500000113T276 S277 L278 R284T276-G280 PolarHBondContact O-N 3.48Å; S277-G280 PolarHBondContact O-N 3.16Å; L278-G280 VanDerWaalsContact C-N 3.3Å; L278-G280 PolarHBondContact O-N 2.97Å; G280-R284 WeakPolarHBondContact O-CG 3.28Å; G280-R284 PolarHBondContact O-N 2.98Å; G280-R284 VanDerWaalsContact O-N 3.16Å; G280-R284 PolarHBondContact O-NH1 3.38Å
281L88.5Confident90.5Very high98 Ų98103.4 Ų103.451%0.51352%0.518SS..Hα-helixtrans-69.1-44174.3-166.975.9000110.9S277 L278 L279 R283 R284 N285S277-L281 PolarHBondContact O-N 3.4Å; L278-L281 WeakPolarHBondContact O-CB 3.5Å; L278-L281 PolarHBondContact O-N 3.39Å; L279-L281 VanDerWaalsContact C-N 3.35Å; L281-R283 PolarHBondContact O-N 2.95Å; L281-R284 PolarHBondContact O-N 2.97Å; L281-N285 VanDerWaalsContact O-CG 3.29Å; L281-N285 PolarHBondContact O-N 2.77Å
282Q88.9Confident90.4Very high103 Ų103102.8 Ų102.848%0.48152%0.515SS..Hα-helixtrans-59.4-47.7177.3-171.4-179-15.500111.6L278 L279 R284 N285 E286L278-Q282 WeakPolarHBondContact O-CB 3.13Å; L278-Q282 PolarHBondContact O-N 3.39Å; L279-Q282 PolarHBondContact O-N 3.12Å; Q282-R284 VanDerWaalsContact C-N 3.32Å; Q282-R284 PolarHBondContact O-N 3.46Å; Q282-N285 WeakPolarHBondContact O-CB 3.14Å; Q282-N285 PolarHBondContact O-N 3.27Å; Q282-N285 VanDerWaalsContact O-N 3.15Å; Q282-E286 PolarHBondContact NE2-OE1 2.8Å; Q282-E286 WeakPolarHBondContact O-CG 3.2Å; Q282-E286 PolarHBondContact O-N 2.82Å
283R89.5Confident90.3Very high184 Ų184101.3 Ų101.369%0.69451%0.511SS*.Hα-helixtrans-61.9-36.4175.5-73.8179.8177.4176-0.5113.2L279 L281 A287L279-R283 WeakPolarHBondContact O-CG 3.16Å; L279-R283 PolarHBondContact O-N 2.83Å; L281-R283 PolarHBondContact O-N 2.95Å; R283-A287 WeakPolarHBondContact O-CB 3.47Å; R283-A287 PolarHBondContact O-N 3.11Å
284R88.8Confident90.3Very high172 Ų17299.1 Ų99.165%0.64951%0.509SS*.Hα-helixtrans-68.1-39174.4-77.3-175.7-172.296.7-5.6111.8G280 L281 Q282 A287 Y288G280-R284 WeakPolarHBondContact O-CG 3.28Å; G280-R284 PolarHBondContact O-N 2.98Å; G280-R284 VanDerWaalsContact O-N 3.16Å; G280-R284 PolarHBondContact O-NH1 3.38Å; L281-R284 PolarHBondContact O-N 2.97Å; Q282-R284 VanDerWaalsContact C-N 3.32Å; Q282-R284 PolarHBondContact O-N 3.46Å; R284-A287 PolarHBondContact O-N 3.29Å; R284-Y288 VanDerWaalsContact O-CB 3.28Å; R284-Y288 WeakPolarHBondContact O-CB 3.06Å; R284-Y288 PolarHBondContact O-N 3.45Å
285N90.4Very high90.2Very high98 Ų9898.5 Ų98.552%0.52451%0.507SS..Hα-helixtrans-66-40.8175.9-70.8-14.2000111.4L281 Q282 Y288 A289L281-N285 VanDerWaalsContact O-CG 3.29Å; L281-N285 PolarHBondContact O-N 2.77Å; Q282-N285 WeakPolarHBondContact O-CB 3.14Å; Q282-N285 PolarHBondContact O-N 3.27Å; Q282-N285 VanDerWaalsContact O-N 3.15Å; N285-Y288 PolarHBondContact O-N 2.94Å; N285-A289 WeakPolarHBondContact O-CB 3.5Å; N285-A289 PolarHBondContact O-N 3.38Å
286E90.4Very high90.3Very high99 Ų9995.7 Ų95.746%0.46350%0.499SS..Hα-helixtrans-61.1-50.2172.4-73.4166.4-172.700110.8Q282 Y288 A289 D290Q282-E286 PolarHBondContact NE2-OE1 2.8Å; Q282-E286 WeakPolarHBondContact O-CG 3.2Å; Q282-E286 PolarHBondContact O-N 2.82Å; E286-Y288 VanDerWaalsContact C-N 3.29Å; E286-Y288 PolarHBondContact O-N 2.77Å; E286-A289 WeakPolarHBondContact O-CB 3.38Å; E286-A289 PolarHBondContact O-N 3.09Å; E286-A289 VanDerWaalsContact O-N 3.13Å; E286-D290 PolarHBondContact O-N 3.44Å
287A89.3Confident90.2Very high57 Ų5797.9 Ų97.947%0.47150%0.501SS..Hα-helixtrans-60.5-37.7176.300000112.7R283 R284 L291R283-A287 WeakPolarHBondContact O-CB 3.47Å; R283-A287 PolarHBondContact O-N 3.11Å; R284-A287 PolarHBondContact O-N 3.29Å; A287-L291 VanDerWaalsContact O-CB 3.29Å; A287-L291 WeakPolarHBondContact O-CB 3.21Å; A287-L291 PolarHBondContact O-N 2.74Å
288Y88.9Confident90.3Very high158 Ų15899.3 Ų99.362%0.6250%0.503SS*.Hα-helixtrans-67-41.8175.1-179.5-94.5000111.7R284 N285 E286 L291 L292R284-Y288 VanDerWaalsContact O-CB 3.28Å; R284-Y288 WeakPolarHBondContact O-CB 3.06Å; R284-Y288 PolarHBondContact O-N 3.45Å; N285-Y288 PolarHBondContact O-N 2.94Å; E286-Y288 VanDerWaalsContact C-N 3.29Å; E286-Y288 PolarHBondContact O-N 2.77Å; Y288-L291 PolarHBondContact O-N 3.48Å; Y288-L292 HydrophobicContact CE1-CD2 4.36Å; Y288-L292 VanDerWaalsContact O-CB 3.25Å; Y288-L292 WeakPolarHBondContact O-CB 3.47Å; Y288-L292 PolarHBondContact O-N 3.27Å
289A91.3Very high90.4Very high52 Ų52101.1 Ų101.143%0.4351%0.507SS..Hα-helixtrans-63.1-42175.800000111.6N285 E286 L292 A293N285-A289 WeakPolarHBondContact O-CB 3.5Å; N285-A289 PolarHBondContact O-N 3.38Å; E286-A289 WeakPolarHBondContact O-CB 3.38Å; E286-A289 PolarHBondContact O-N 3.09Å; E286-A289 VanDerWaalsContact O-N 3.13Å; A289-L292 PolarHBondContact O-N 2.9Å; A289-A293 WeakPolarHBondContact O-CB 3.01Å; A289-A293 PolarHBondContact O-N 3.44Å
290D91.2Very high90.4Very high118 Ų118102.9 Ų102.963%0.63151%0.512SS*.Hα-helixtrans-63.9-43.1175-72.4-19.8000111.8E286 A293 A294E286-D290 PolarHBondContact O-N 3.44Å; D290-A293 PolarHBondContact O-N 2.87Å; D290-A294 WeakPolarHBondContact O-CB 3.16Å; D290-A294 PolarHBondContact O-N 3.28Å
291L89.7Confident90.5Very high124 Ų124107.1 Ų107.165%0.64953%0.527SS*.Hα-helixtrans-67.3-38.7178-152.1161.1000111A287 Y288 A294 Y295A287-L291 VanDerWaalsContact O-CB 3.29Å; A287-L291 WeakPolarHBondContact O-CB 3.21Å; A287-L291 PolarHBondContact O-N 2.74Å; Y288-L291 PolarHBondContact O-N 3.48Å; L291-A294 PolarHBondContact O-N 3.35Å; L291-Y295 VanDerWaalsContact O-CB 3.31Å; L291-Y295 WeakPolarHBondContact O-CB 3.23Å; L291-Y295 PolarHBondContact O-N 2.77Å
292L91.2Very high90.6Very high75 Ų75107.5 Ų107.539%0.39353%0.529SS..Hα-helixtrans-65.8-41.1174.4-170.469.3000111.4Y288 A289 Y295 N296Y288-L292 HydrophobicContact CE1-CD2 4.36Å; Y288-L292 VanDerWaalsContact O-CB 3.25Å; Y288-L292 WeakPolarHBondContact O-CB 3.47Å; Y288-L292 PolarHBondContact O-N 3.27Å; A289-L292 PolarHBondContact O-N 2.9Å; L292-Y295 PolarHBondContact O-N 3.3Å; L292-N296 WeakPolarHBondContact O-CB 2.98Å; L292-N296 VanDerWaalsContact O-CG 3.25Å; L292-N296 PolarHBondContact O-N 3.41Å; L292-N296 PolarHBondContact O-ND2 2.79Å
293A90.8Very high90.7Very high51 Ų51107.4 Ų107.442%0.42153%0.531SS..Hα-helixtrans-63.6-41.8173.800000111.6A289 D290 N296 K297A289-A293 WeakPolarHBondContact O-CB 3.01Å; A289-A293 PolarHBondContact O-N 3.44Å; D290-A293 PolarHBondContact O-N 2.87Å; A293-N296 PolarHBondContact O-N 3.25Å; A293-K297 PolarHBondContact O-N 3.33Å
294A91.1Very high90.9Very high50 Ų50102.4 Ų102.441%0.41352%0.52SS..Hα-helixtrans-65.4-40.9174.800000112.3D290 L291 K297 L298D290-A294 WeakPolarHBondContact O-CB 3.16Å; D290-A294 PolarHBondContact O-N 3.28Å; L291-A294 PolarHBondContact O-N 3.35Å; A294-K297 PolarHBondContact O-N 2.74Å; A294-L298 PolarHBondContact O-N 2.89Å
295Y90.7Very high90.9Very high135 Ų13598.4 Ų98.453%0.52951%0.511SS..Hα-helixtrans-61.3-45.1174.2173.6-98.4000111.5L291 L292 K297 L298 K299L291-Y295 VanDerWaalsContact O-CB 3.31Å; L291-Y295 WeakPolarHBondContact O-CB 3.23Å; L291-Y295 PolarHBondContact O-N 2.77Å; L292-Y295 PolarHBondContact O-N 3.3Å; Y295-K297 VanDerWaalsContact C-N 3.35Å; Y295-K297 PolarHBondContact O-N 3.22Å; Y295-L298 PolarHBondContact O-N 2.96Å; Y295-K299 HydrophobicContact CE1-CD 4.48Å; Y295-K299 WeakPolarHBondContact O-CB 3.48Å; Y295-K299 PolarHBondContact O-N 3.49Å
296N93.2Very high91Very high74 Ų7499.1 Ų99.140%0.39651%0.512SS..Hα-helixtrans-63.3-40.8176.9-71.6-27.6000111.6L292 A293 K299 E300L292-N296 WeakPolarHBondContact O-CB 2.98Å; L292-N296 VanDerWaalsContact O-CG 3.25Å; L292-N296 PolarHBondContact O-N 3.41Å; L292-N296 PolarHBondContact O-ND2 2.79Å; A293-N296 PolarHBondContact O-N 3.25Å; N296-K299 WeakPolarHBondContact O-CB 3.39Å; N296-K299 PolarHBondContact O-N 2.77Å; N296-E300 WeakPolarHBondContact O-CG 3.09Å; N296-E300 PolarHBondContact O-N 2.97Å
297K92.4Very high91Very high134 Ų13498.9 Ų98.958%0.58351%0.514SS*.Hα-helixtrans-60.5-48172.3-78.1-177.6177.3-178.40112.4A293 A294 Y295 K299 E300 E301A293-K297 PolarHBondContact O-N 3.33Å; A294-K297 PolarHBondContact O-N 2.74Å; Y295-K297 VanDerWaalsContact C-N 3.35Å; Y295-K297 PolarHBondContact O-N 3.22Å; K297-K299 VanDerWaalsContact C-N 3.25Å; K297-K299 PolarHBondContact O-N 3.08Å; K297-E300 PolarHBondContact O-N 3.47Å; K297-E300 VanDerWaalsContact O-N 3.16Å; K297-E301 WeakPolarHBondContact O-CG 3.15Å; K297-E301 PolarHBondContact O-N 2.92Å
298L89.7Confident91Very high98 Ų98100.5 Ų100.551%0.51351%0.511SS..Hα-helixtrans-60.7-36.4176.2-84.3165.2000112A294 Y295 E301 L302A294-L298 PolarHBondContact O-N 2.89Å; Y295-L298 PolarHBondContact O-N 2.96Å; L298-E301 PolarHBondContact O-N 3.18Å; L298-L302 WeakPolarHBondContact O-CB 3.02Å; L298-L302 WeakPolarHBondContact O-CG 3.23Å; L298-L302 PolarHBondContact O-N 2.96Å
299K91.7Very high91Very high126 Ų12698.3 Ų98.355%0.54851%0.507SS..Hα-helixtrans-66.3-41.5175.4-171.8-179.2178.2-1760111.7Y295 N296 K297 L302 L303Y295-K299 HydrophobicContact CE1-CD 4.48Å; Y295-K299 WeakPolarHBondContact O-CB 3.48Å; Y295-K299 PolarHBondContact O-N 3.49Å; N296-K299 WeakPolarHBondContact O-CB 3.39Å; N296-K299 PolarHBondContact O-N 2.77Å; K297-K299 VanDerWaalsContact C-N 3.25Å; K297-K299 PolarHBondContact O-N 3.08Å; K299-L302 PolarHBondContact O-N 2.77Å; K299-L303 WeakPolarHBondContact O-CB 3.15Å; K299-L303 PolarHBondContact O-N 2.81Å
300E90.4Very high91Very high133 Ų13399.3 Ų99.362%0.62151%0.505SS*.Hα-helixtrans-64.7-43.2173.1-72.7175-17900111.5N296 K297 L303 V304N296-E300 WeakPolarHBondContact O-CG 3.09Å; N296-E300 PolarHBondContact O-N 2.97Å; K297-E300 PolarHBondContact O-N 3.47Å; K297-E300 VanDerWaalsContact O-N 3.16Å; E300-L303 WeakPolarHBondContact O-CB 3.49Å; E300-L303 PolarHBondContact O-N 2.85Å; E300-V304 WeakPolarHBondContact O-CG2 3.46Å; E300-V304 PolarHBondContact O-N 3.47Å
301E91.7Very high90.9Very high110 Ų11096.4 Ų96.451%0.51450%0.498SS..Hα-helixtrans-61.6-42.6174.8-73.4173.4-171.300112K297 L298 L303 V304 L305K297-E301 WeakPolarHBondContact O-CG 3.15Å; K297-E301 PolarHBondContact O-N 2.92Å; L298-E301 PolarHBondContact O-N 3.18Å; E301-L303 VanDerWaalsContact C-N 3.33Å; E301-L303 PolarHBondContact O-N 3.5Å; E301-V304 PolarHBondContact O-N 3.34Å; E301-L305 WeakPolarHBondContact O-CB 3.09Å; E301-L305 WeakPolarHBondContact O-CG 3.13Å; E301-L305 PolarHBondContact O-N 3.31Å
302L90.7Very high90.9Very high106 Ų10697.9 Ų97.956%0.55550%0.496SS*.Hα-helixtrans-62-40.9173.7-79.3171.7000111.7L298 K299 V304 L305 E306L298-L302 WeakPolarHBondContact O-CB 3.02Å; L298-L302 WeakPolarHBondContact O-CG 3.23Å; L298-L302 PolarHBondContact O-N 2.96Å; K299-L302 PolarHBondContact O-N 2.77Å; L302-V304 VanDerWaalsContact C-N 3.34Å; L302-L305 PolarHBondContact O-N 3.22Å; L302-E306 WeakPolarHBondContact O-CB 3.15Å; L302-E306 WeakPolarHBondContact O-CG 3.2Å; L302-E306 PolarHBondContact O-N 2.76Å
303L92.3Very high90.9Very high102 Ų10299.8 Ų99.853%0.53450%0.501SS..Hα-helixtrans-64.1-40.3175.9-163.599.9000111.4K299 E300 E301 N307K299-L303 WeakPolarHBondContact O-CB 3.15Å; K299-L303 PolarHBondContact O-N 2.81Å; E300-L303 WeakPolarHBondContact O-CB 3.49Å; E300-L303 PolarHBondContact O-N 2.85Å; E301-L303 VanDerWaalsContact C-N 3.33Å; E301-L303 PolarHBondContact O-N 3.5Å; L303-N307 WeakPolarHBondContact O-CB 3.26Å; L303-N307 PolarHBondContact O-N 2.78Å; L303-N307 PolarHBondContact O-ND2 3.06Å
304V92.2Very high90.9Very high78 Ų78106.3 Ų106.347%0.47351%0.514SS..Hα-helixtrans-63.4-47174173.20000110.4E300 E301 L302 E306 N307 E308E300-V304 WeakPolarHBondContact O-CG2 3.46Å; E300-V304 PolarHBondContact O-N 3.47Å; E301-V304 PolarHBondContact O-N 3.34Å; L302-V304 VanDerWaalsContact C-N 3.34Å; V304-E306 PolarHBondContact O-N 3.27Å; V304-N307 CarbonylContact O-C 3.57Å; V304-N307 WeakPolarHBondContact O-CB 3.36Å; V304-N307 PolarHBondContact O-N 3.18Å; V304-E308 HydrophobicContact CG1-CG 4.48Å; V304-E308 WeakPolarHBondContact O-CG 3.34Å; V304-E308 PolarHBondContact O-N 3.39Å
305L90.3Very high91Very high88 Ų88107 Ų10746%0.46152%0.516SS..Hα-helixtrans-63.5-38.2177.3-74.4169.3000112.7E301 L302 E308 Q309E301-L305 WeakPolarHBondContact O-CB 3.09Å; E301-L305 WeakPolarHBondContact O-CG 3.13Å; E301-L305 PolarHBondContact O-N 3.31Å; L302-L305 PolarHBondContact O-N 3.22Å; L305-E308 PolarHBondContact O-N 2.9Å; L305-Q309 WeakPolarHBondContact O-CB 3.2Å; L305-Q309 WeakPolarHBondContact O-CG 3.27Å; L305-Q309 PolarHBondContact O-N 2.81Å
306E92Very high90.9Very high113 Ų113104.9 Ų104.953%0.52851%0.513SS..Hα-helixtrans-64-42.2173.2-81.5-176.7170.200111.2L302 V304 Q309 N310L302-E306 WeakPolarHBondContact O-CB 3.15Å; L302-E306 WeakPolarHBondContact O-CG 3.2Å; L302-E306 PolarHBondContact O-N 2.76Å; V304-E306 PolarHBondContact O-N 3.27Å; E306-Q309 PolarHBondContact O-N 2.79Å; E306-N310 WeakPolarHBondContact O-CB 3.38Å; E306-N310 PolarHBondContact O-N 2.82Å; E306-N310 PolarHBondContact O-ND2 3.35Å; E306-N310 VanDerWaalsContact O-ND2 3.1Å
307N90Very high90.9Very high94 Ų94105.4 Ų105.450%0.50352%0.516SS..Hα-helixtrans-64.5-40.6174.9-73.6-34.8000111.7L303 V304 N310 A311L303-N307 WeakPolarHBondContact O-CB 3.26Å; L303-N307 PolarHBondContact O-N 2.78Å; L303-N307 PolarHBondContact O-ND2 3.06Å; V304-N307 CarbonylContact O-C 3.57Å; V304-N307 WeakPolarHBondContact O-CB 3.36Å; V304-N307 PolarHBondContact O-N 3.18Å; N307-N310 PolarHBondContact O-N 3.39Å; N307-A311 WeakPolarHBondContact O-CB 3.43Å; N307-A311 PolarHBondContact O-N 3.33Å
308E90.2Very high90.9Very high91 Ų91105.8 Ų105.843%0.42552%0.518SS..Hα-helixtrans-63.4-46.3172.8-74.1178.8178.800111.5V304 L305 N310 A311 Y312V304-E308 HydrophobicContact CG1-CG 4.48Å; V304-E308 WeakPolarHBondContact O-CG 3.34Å; V304-E308 PolarHBondContact O-N 3.39Å; L305-E308 PolarHBondContact O-N 2.9Å; E308-N310 VanDerWaalsContact C-N 3.29Å; E308-N310 PolarHBondContact O-N 2.96Å; E308-A311 CarbonylContact O-C 3.6Å; E308-A311 WeakPolarHBondContact O-CB 3.32Å; E308-A311 PolarHBondContact O-N 2.81Å; E308-A311 VanDerWaalsContact O-N 3.12Å; E308-Y312 HydrophobicContact CB-CD2 4.42Å; E308-Y312 HydrophobicContact CB-CE2 4.31Å; E308-Y312 WeakPolarHBondContact O-CD2 3.39Å; E308-Y312 PolarHBondContact O-N 3.34Å
309Q87.3Confident90.9Very high113 Ų113107.1 Ų107.153%0.52852%0.521SS..Hα-helixtrans-59-41.1174.7-79.1-175.312.400111.8L305 E306 Y312 K313L305-Q309 WeakPolarHBondContact O-CB 3.2Å; L305-Q309 WeakPolarHBondContact O-CG 3.27Å; L305-Q309 PolarHBondContact O-N 2.81Å; E306-Q309 PolarHBondContact O-N 2.79Å; Q309-Y312 PolarHBondContact O-N 3.23Å; Q309-K313 WeakPolarHBondContact O-CB 3.49Å; Q309-K313 VanDerWaalsContact O-CG 3.31Å; Q309-K313 WeakPolarHBondContact O-CG 3.47Å; Q309-K313 PolarHBondContact O-N 3.47Å
310N91.6Very high90.8Very high72 Ų72106.2 Ų106.239%0.38552%0.519SS..Hα-helixtrans-67.1-38.2175.8-72.8-33000111.7E306 N307 E308 K313 R314E306-N310 WeakPolarHBondContact O-CB 3.38Å; E306-N310 PolarHBondContact O-N 2.82Å; E306-N310 PolarHBondContact O-ND2 3.35Å; E306-N310 VanDerWaalsContact O-ND2 3.1Å; N307-N310 PolarHBondContact O-N 3.39Å; E308-N310 VanDerWaalsContact C-N 3.29Å; E308-N310 PolarHBondContact O-N 2.96Å; N310-K313 PolarHBondContact O-N 2.68Å; N310-R314 WeakPolarHBondContact O-CG 3.12Å; N310-R314 PolarHBondContact O-N 2.83Å
311A90.1Very high90.8Very high58 Ų58105.3 Ų105.348%0.47952%0.515SS..Hα-helixtrans-64.1-43.9172.600000111.5N307 E308 R314 S315N307-A311 WeakPolarHBondContact O-CB 3.43Å; N307-A311 PolarHBondContact O-N 3.33Å; E308-A311 CarbonylContact O-C 3.6Å; E308-A311 WeakPolarHBondContact O-CB 3.32Å; E308-A311 PolarHBondContact O-N 2.81Å; E308-A311 VanDerWaalsContact O-N 3.12Å; A311-R314 PolarHBondContact O-N 3.39Å; A311-S315 PolarHBondContact O-N 3.4Å
312Y89.9Confident90.7Very high154 Ų154102.5 Ų102.560%0.60451%0.505SS*.Hα-helixtrans-63.7-42.4174.4-75.8-58.4000112E308 Q309 R314 S315 I316E308-Y312 HydrophobicContact CB-CD2 4.42Å; E308-Y312 HydrophobicContact CB-CE2 4.31Å; E308-Y312 WeakPolarHBondContact O-CD2 3.39Å; E308-Y312 PolarHBondContact O-N 3.34Å; Q309-Y312 PolarHBondContact O-N 3.23Å; Y312-R314 VanDerWaalsContact C-N 3.33Å; Y312-R314 PolarHBondContact O-N 3.31Å; Y312-S315 CarbonylContact O-C 3.59Å; Y312-S315 WeakPolarHBondContact O-CB 3.37Å; Y312-S315 PolarHBondContact O-N 2.88Å; Y312-S315 VanDerWaalsContact O-N 3.12Å; Y312-I316 WeakPolarHBondContact O-CB 3.31Å; Y312-I316 VanDerWaalsContact O-CG1 3.25Å; Y312-I316 WeakPolarHBondContact O-CG1 3.48Å; Y312-I316 PolarHBondContact O-N 2.6Å
313K91.4Very high90.6Very high116 Ų116103.2 Ų103.250%0.50451%0.505SS..Hα-helixtrans-58.3-44.7173.3-77.6173.7-176.5171.50111.6Q309 N310 S315 I316 N317Q309-K313 WeakPolarHBondContact O-CB 3.49Å; Q309-K313 VanDerWaalsContact O-CG 3.31Å; Q309-K313 WeakPolarHBondContact O-CG 3.47Å; Q309-K313 PolarHBondContact O-N 3.47Å; N310-K313 PolarHBondContact O-N 2.68Å; K313-S315 VanDerWaalsContact C-N 3.31Å; K313-S315 PolarHBondContact O-N 2.78Å; K313-I316 PolarHBondContact O-N 3.25Å; K313-N317 WeakPolarHBondContact O-CB 3.48Å; K313-N317 VanDerWaalsContact O-CG 3.32Å; K313-N317 PolarHBondContact O-N 2.78Å; K313-N317 PolarHBondContact O-OD1 3.35Å
314R91.2Very high90.5Very high187 Ų187105.1 Ų105.171%0.70651%0.512SS*.Hα-helixtrans-62.5-39.6174.7-70.7175.2-173.2-161.83111.7N310 A311 Y312 K318N310-R314 WeakPolarHBondContact O-CG 3.12Å; N310-R314 PolarHBondContact O-N 2.83Å; A311-R314 PolarHBondContact O-N 3.39Å; Y312-R314 VanDerWaalsContact C-N 3.33Å; Y312-R314 PolarHBondContact O-N 3.31Å; R314-K318 WeakPolarHBondContact O-CG 3.42Å; R314-K318 PolarHBondContact O-N 3.09Å
315S91.9Very high90.5Very high64 Ų64108 Ų10845%0.44852%0.52SS..Hα-helixtrans-66.6-41.7175.8-164.50000112.1A311 Y312 K313 K318 E319A311-S315 PolarHBondContact O-N 3.4Å; Y312-S315 CarbonylContact O-C 3.59Å; Y312-S315 WeakPolarHBondContact O-CB 3.37Å; Y312-S315 PolarHBondContact O-N 2.88Å; Y312-S315 VanDerWaalsContact O-N 3.12Å; K313-S315 VanDerWaalsContact C-N 3.31Å; K313-S315 PolarHBondContact O-N 2.78Å; S315-K318 PolarHBondContact O-N 2.76Å; S315-E319 PolarHBondContact O-N 2.8Å
316I89.9Confident90.5Very high91 Ų91109.1 Ų109.147%0.46753%0.526SS..Hα-helixtrans-63.9-45176.7-70.8164.2000109.9Y312 K313 K318 E319 Q320Y312-I316 WeakPolarHBondContact O-CB 3.31Å; Y312-I316 VanDerWaalsContact O-CG1 3.25Å; Y312-I316 WeakPolarHBondContact O-CG1 3.48Å; Y312-I316 PolarHBondContact O-N 2.6Å; K313-I316 PolarHBondContact O-N 3.25Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 2.74Å; I316-E319 CarbonylContact O-C 3.54Å; I316-E319 PolarHBondContact O-N 3.17Å; I316-E319 VanDerWaalsContact O-N 3.14Å; I316-Q320 HydrophobicContact CG2-CG 4.29Å; I316-Q320 WeakPolarHBondContact O-CB 3.31Å; I316-Q320 WeakPolarHBondContact O-CG 3.3Å; I316-Q320 PolarHBondContact O-N 2.7Å
317N92.7Very high90.5Very high85 Ų85105.9 Ų105.946%0.45551%0.514SS..Hα-helixtrans-61-42.5176.7-734.6000111.3K313 E319 Q320 E321K313-N317 WeakPolarHBondContact O-CB 3.48Å; K313-N317 VanDerWaalsContact O-CG 3.32Å; K313-N317 PolarHBondContact O-N 2.78Å; K313-N317 PolarHBondContact O-OD1 3.35Å; N317-E319 VanDerWaalsContact C-N 3.34Å; N317-E319 PolarHBondContact O-N 2.89Å; N317-Q320 WeakPolarHBondContact O-CB 3.49Å; N317-Q320 PolarHBondContact O-N 2.83Å; N317-E321 WeakPolarHBondContact O-CG 3.47Å; N317-E321 PolarHBondContact O-N 2.88Å
318K91.7Very high90.5Very high143 Ų143103.3 Ų103.362%0.62251%0.51SS*.Hα-helixtrans-60.9-42.1173.5-75.8-180178.7-175.40112.1R314 S315 I316 Q320 E321 T322R314-K318 WeakPolarHBondContact O-CG 3.42Å; R314-K318 PolarHBondContact O-N 3.09Å; S315-K318 PolarHBondContact O-N 2.76Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 2.74Å; K318-Q320 VanDerWaalsContact C-N 3.32Å; K318-E321 PolarHBondContact O-N 3.22Å; K318-T322 WeakPolarHBondContact O-CG2 3.38Å; K318-T322 PolarHBondContact O-N 3.43Å; K318-T322 PolarHBondContact O-OG1 3.41Å
319E89.6Confident90.5Very high125 Ų125103.8 Ų103.858%0.58451%0.514SS*.Hα-helixtrans-68.9-28.8175.3-75.9-60156.600113.2S315 I316 N317 T322 H323S315-E319 PolarHBondContact O-N 2.8Å; I316-E319 CarbonylContact O-C 3.54Å; I316-E319 PolarHBondContact O-N 3.17Å; I316-E319 VanDerWaalsContact O-N 3.14Å; N317-E319 VanDerWaalsContact C-N 3.34Å; N317-E319 PolarHBondContact O-N 2.89Å; E319-T322 VanDerWaalsContact CA-OG1 3.26Å; E319-T322 WeakPolarHBondContact CA-OG1 3.41Å; E319-T322 PolarHBondContact O-OG1 2.9Å; E319-T322 PolarHBondContact OE2-OG1 2.88Å; E319-H323 WeakPolarHBondContact O-CB 3.49Å; E319-H323 PolarHBondContact O-N 3.19Å
320Q89.3Confident90.7Very high108 Ų108104.1 Ų104.151%0.50552%0.516SS..Hα-helixtrans-71-42.5171.9-75.1176.3-12.500110.9I316 N317 K318 T322 H323 E324I316-Q320 HydrophobicContact CG2-CG 4.29Å; I316-Q320 WeakPolarHBondContact O-CB 3.31Å; I316-Q320 WeakPolarHBondContact O-CG 3.3Å; I316-Q320 PolarHBondContact O-N 2.7Å; N317-Q320 WeakPolarHBondContact O-CB 3.49Å; N317-Q320 PolarHBondContact O-N 2.83Å; K318-Q320 VanDerWaalsContact C-N 3.32Å; Q320-T322 PolarHBondContact O-N 2.9Å; Q320-H323 PolarHBondContact O-N 3.49Å; Q320-E324 WeakPolarHBondContact O-CB 3.37Å; Q320-E324 WeakPolarHBondContact O-CG 3.38Å; Q320-E324 PolarHBondContact O-N 3.5Å
321E90Very high90.7Very high113 Ų113105 Ų10553%0.52852%0.521SS..Hα-helixtrans-60.3-44.1173.8-72.8171-170.200111.3N317 K318 E324 Q325N317-E321 WeakPolarHBondContact O-CG 3.47Å; N317-E321 PolarHBondContact O-N 2.88Å; K318-E321 PolarHBondContact O-N 3.22Å; E321-E324 PolarHBondContact O-N 3.09Å; E321-Q325 VanDerWaalsContact O-CG 3.25Å; E321-Q325 WeakPolarHBondContact O-CG 3.34Å; E321-Q325 PolarHBondContact O-N 2.68Å
322T90.4Very high90.7Very high52 Ų52108.3 Ų108.332%0.31952%0.524SS..Hα-helixtrans-65.8-40.1174.8580000111.4K318 E319 Q320 Q325 L326K318-T322 WeakPolarHBondContact O-CG2 3.38Å; K318-T322 PolarHBondContact O-N 3.43Å; K318-T322 PolarHBondContact O-OG1 3.41Å; E319-T322 VanDerWaalsContact CA-OG1 3.26Å; E319-T322 WeakPolarHBondContact CA-OG1 3.41Å; E319-T322 PolarHBondContact O-OG1 2.9Å; E319-T322 PolarHBondContact OE2-OG1 2.88Å; Q320-T322 PolarHBondContact O-N 2.9Å; T322-Q325 PolarHBondContact O-N 3.25Å; T322-L326 WeakPolarHBondContact O-CB 3.25Å; T322-L326 WeakPolarHBondContact O-CG 3.36Å; T322-L326 PolarHBondContact O-N 2.93Å
323H89.3Confident90.7Very high120 Ų120104.8 Ų104.856%0.55652%0.516SS*.Hα-helixtrans-63.7-42.2175.7-179.1-80.6000112.2E319 Q320 L326 T327E319-H323 WeakPolarHBondContact O-CB 3.49Å; E319-H323 PolarHBondContact O-N 3.19Å; Q320-H323 PolarHBondContact O-N 3.49Å; H323-L326 PolarHBondContact O-N 3.46Å; H323-T327 PolarHBondContact CE1-OG1 3.29Å; H323-T327 PolarHBondContact ND1-OG1 2.88Å; H323-T327 VanDerWaalsContact O-CB 3.25Å; H323-T327 WeakPolarHBondContact O-CB 3.41Å; H323-T327 PolarHBondContact O-N 2.84Å; H323-T327 PolarHBondContact O-OG1 3.39Å
324E89.9Confident90.7Very high143 Ų143104 Ų10467%0.66851%0.514SS*.Hα-helixtrans-62.8-42174.9-77.5-176.117800111.4Q320 E321 T327 G328Q320-E324 WeakPolarHBondContact O-CB 3.37Å; Q320-E324 WeakPolarHBondContact O-CG 3.38Å; Q320-E324 PolarHBondContact O-N 3.5Å; E321-E324 PolarHBondContact O-N 3.09Å; E324-T327 PolarHBondContact O-N 3.38Å; E324-G328 PolarHBondContact O-N 3.04Å
325Q91.2Very high90.6Very high138 Ų13897.9 Ų97.965%0.64550%0.5SS*.Hα-helixtrans-61.6-46.1174.2-71.8171.917.700111.9E321 T322 G328 L329E321-Q325 VanDerWaalsContact O-CG 3.25Å; E321-Q325 WeakPolarHBondContact O-CG 3.34Å; E321-Q325 PolarHBondContact O-N 2.68Å; T322-Q325 PolarHBondContact O-N 3.25Å; Q325-G328 PolarHBondContact O-N 2.9Å; Q325-L329 PolarHBondContact O-N 3.35Å
326L91.2Very high90.6Very high112 Ų11298.3 Ų98.359%0.58650%0.497SS*.Hα-helixtrans-65.7-40.1177.1-74.5172.2000112.1T322 H323 L329 Q330T322-L326 WeakPolarHBondContact O-CB 3.25Å; T322-L326 WeakPolarHBondContact O-CG 3.36Å; T322-L326 PolarHBondContact O-N 2.93Å; H323-L326 PolarHBondContact O-N 3.46Å; L326-L329 WeakPolarHBondContact O-CB 3.36Å; L326-L329 PolarHBondContact O-N 2.83Å; L326-Q330 WeakPolarHBondContact O-CB 3.39Å; L326-Q330 PolarHBondContact O-N 2.8Å
327T91.4Very high90.5Very high45 Ų4598.5 Ų98.528%0.27650%0.499SS..Hα-helixtrans-65-42.8176.1-58.30000110.5H323 E324 L329 Q330 N331H323-T327 PolarHBondContact CE1-OG1 3.29Å; H323-T327 PolarHBondContact ND1-OG1 2.88Å; H323-T327 VanDerWaalsContact O-CB 3.25Å; H323-T327 WeakPolarHBondContact O-CB 3.41Å; H323-T327 PolarHBondContact O-N 2.84Å; H323-T327 PolarHBondContact O-OG1 3.39Å; E324-T327 PolarHBondContact O-N 3.38Å; T327-L329 VanDerWaalsContact C-N 3.33Å; T327-L329 PolarHBondContact O-N 2.91Å; T327-Q330 PolarHBondContact O-N 2.86Å; T327-N331 WeakPolarHBondContact O-CB 3.46Å; T327-N331 VanDerWaalsContact O-CG 3.25Å; T327-N331 PolarHBondContact O-N 2.87Å; T327-N331 PolarHBondContact O-ND2 2.86Å
328G90.5Very high90.5Very high40 Ų4097.6 Ų97.641%0.41249%0.494SS..Hα-helixtrans-58.9-43.6172.500000112.1E324 Q325 K332E324-G328 PolarHBondContact O-N 3.04Å; Q325-G328 PolarHBondContact O-N 2.9Å; G328-K332 WeakPolarHBondContact O-CB 3.25Å; G328-K332 PolarHBondContact O-N 2.94Å
329L90.9Very high90.4Very high100 Ų10094.1 Ų94.152%0.52449%0.485SS..Hα-helixtrans-64.5-42.7175.1-162.592000111.9Q325 L326 T327 K332 N333Q325-L329 PolarHBondContact O-N 3.35Å; L326-L329 WeakPolarHBondContact O-CB 3.36Å; L326-L329 PolarHBondContact O-N 2.83Å; T327-L329 VanDerWaalsContact C-N 3.33Å; T327-L329 PolarHBondContact O-N 2.91Å; L329-K332 PolarHBondContact O-N 2.72Å; L329-N333 WeakPolarHBondContact O-CB 3.22Å; L329-N333 VanDerWaalsContact O-CG 3.25Å; L329-N333 PolarHBondContact O-N 2.88Å; L329-N333 PolarHBondContact O-ND2 3.4Å
330Q89.8Confident90.5Very high121 Ų12192.9 Ų92.957%0.56548%0.482SS*.Hα-helixtrans-62.3-48.5177.4179.6178.6-29.700111L326 T327 K332 N333 E334L326-Q330 WeakPolarHBondContact O-CB 3.39Å; L326-Q330 PolarHBondContact O-N 2.8Å; T327-Q330 PolarHBondContact O-N 2.86Å; Q330-K332 VanDerWaalsContact C-N 3.28Å; Q330-K332 PolarHBondContact O-N 3.25Å; Q330-N333 CarbonylContact O-C 3.54Å; Q330-N333 PolarHBondContact O-N 3.42Å; Q330-E334 WeakPolarHBondContact O-CB 3.38Å; Q330-E334 PolarHBondContact O-N 3.37Å
331N91.8Very high90.6Very high91 Ų9195.7 Ų95.749%0.48749%0.487SS..Hα-helixtrans-60-40.5177.6-71.5-20.3000111.4T327 E334 S335T327-N331 WeakPolarHBondContact O-CB 3.46Å; T327-N331 VanDerWaalsContact O-CG 3.25Å; T327-N331 PolarHBondContact O-N 2.87Å; T327-N331 PolarHBondContact O-ND2 2.86Å; N331-E334 PolarHBondContact O-N 2.95Å; N331-S335 WeakPolarHBondContact O-CB 3.4Å; N331-S335 PolarHBondContact O-N 2.78Å; N331-S335 PolarHBondContact O-OG 3.12Å
332K91.5Very high90.6Very high127 Ų12797.8 Ų97.855%0.55250%0.495SS*.Hα-helixtrans-62.5-50.7174-171.3-178.4176.9-177.10111.2G328 L329 Q330 E334 S335 D336G328-K332 WeakPolarHBondContact O-CB 3.25Å; G328-K332 PolarHBondContact O-N 2.94Å; L329-K332 PolarHBondContact O-N 2.72Å; Q330-K332 VanDerWaalsContact C-N 3.28Å; Q330-K332 PolarHBondContact O-N 3.25Å; K332-E334 VanDerWaalsContact C-N 3.28Å; K332-E334 PolarHBondContact O-N 2.85Å; K332-S335 PolarHBondContact O-N 2.76Å; K332-S335 VanDerWaalsContact O-N 3.16Å; K332-S335 PolarHBondContact O-OG 2.87Å; K332-D336 VanDerWaalsContact O-CG 3.31Å; K332-D336 PolarHBondContact O-N 3.23Å
333N90.1Very high90.7Very high80 Ų80100.9 Ų100.943%0.42851%0.506SS..Hα-helixtrans-60.2-36.7177.4-73.1-21.4000112.5L329 Q330 D336 L337L329-N333 WeakPolarHBondContact O-CB 3.22Å; L329-N333 VanDerWaalsContact O-CG 3.25Å; L329-N333 PolarHBondContact O-N 2.88Å; L329-N333 PolarHBondContact O-ND2 3.4Å; Q330-N333 CarbonylContact O-C 3.54Å; Q330-N333 PolarHBondContact O-N 3.42Å; N333-D336 PolarHBondContact O-N 2.84Å; N333-L337 VanDerWaalsContact O-CB 3.29Å; N333-L337 WeakPolarHBondContact O-CB 3.24Å; N333-L337 WeakPolarHBondContact O-CG 3.31Å; N333-L337 PolarHBondContact O-N 2.75Å
334E90.5Very high90.7Very high98 Ų98100.1 Ų100.146%0.45851%0.505SS..Hα-helixtrans-71-39177.1-169169.2-165.700111.4Q330 N331 K332 L337 N338Q330-E334 WeakPolarHBondContact O-CB 3.38Å; Q330-E334 PolarHBondContact O-N 3.37Å; N331-E334 PolarHBondContact O-N 2.95Å; K332-E334 VanDerWaalsContact C-N 3.28Å; K332-E334 PolarHBondContact O-N 2.85Å; E334-L337 PolarHBondContact O-N 3.25Å; E334-N338 VanDerWaalsContact O-CB 3.31Å; E334-N338 WeakPolarHBondContact O-CB 3.43Å; E334-N338 PolarHBondContact O-N 2.75Å; E334-N338 PolarHBondContact O-ND2 3.2Å
335S89.7Confident90.8Very high59 Ų5998.3 Ų98.341%0.41350%0.499SS..Hα-helixtrans-62.9-42.1171.278.20000111.7N331 K332 N338 T339N331-S335 WeakPolarHBondContact O-CB 3.4Å; N331-S335 PolarHBondContact O-N 2.78Å; N331-S335 PolarHBondContact O-OG 3.12Å; K332-S335 PolarHBondContact O-N 2.76Å; K332-S335 VanDerWaalsContact O-N 3.16Å; K332-S335 PolarHBondContact O-OG 2.87Å; S335-N338 PolarHBondContact O-N 2.99Å; S335-T339 WeakPolarHBondContact O-CB 3.36Å; S335-T339 PolarHBondContact O-N 3.36Å; S335-T339 PolarHBondContact O-OG1 3.08Å
336D91.4Very high90.7Very high74 Ų7496.9 Ų96.940%0.39649%0.493SS..Hα-helixtrans-65.8-45.2176.6-70.1-22.1000110.7K332 N333 N338 T339 L340K332-D336 VanDerWaalsContact O-CG 3.31Å; K332-D336 PolarHBondContact O-N 3.23Å; N333-D336 PolarHBondContact O-N 2.84Å; D336-N338 PolarHBondContact O-N 3.03Å; D336-T339 WeakPolarHBondContact O-CB 3.49Å; D336-T339 PolarHBondContact O-N 3.38Å; D336-L340 WeakPolarHBondContact O-CB 3.23Å; D336-L340 WeakPolarHBondContact O-CG 3.36Å; D336-L340 PolarHBondContact O-N 2.94Å
337L88.4Confident90.6Very high94 Ų9495.2 Ų95.249%0.49249%0.49SS..Hα-helixtrans-60.3-42.5174-86.4171.1000112.3N333 E334 T339 L340 R341N333-L337 VanDerWaalsContact O-CB 3.29Å; N333-L337 WeakPolarHBondContact O-CB 3.24Å; N333-L337 WeakPolarHBondContact O-CG 3.31Å; N333-L337 PolarHBondContact O-N 2.75Å; E334-L337 PolarHBondContact O-N 3.25Å; L337-T339 VanDerWaalsContact C-N 3.31Å; L337-L340 PolarHBondContact O-N 2.79Å; L337-R341 WeakPolarHBondContact O-CB 3.49Å; L337-R341 VanDerWaalsContact O-CG 3.28Å; L337-R341 WeakPolarHBondContact O-CG 3.37Å; L337-R341 PolarHBondContact O-N 3.06Å
338N91.9Very high90.5Very high66 Ų6698.2 Ų98.235%0.35350%0.501SS..Hα-helixtrans-65.7-37.5176.4-76.9-29.6000111.5E334 S335 D336 R341 K342E334-N338 VanDerWaalsContact O-CB 3.31Å; E334-N338 WeakPolarHBondContact O-CB 3.43Å; E334-N338 PolarHBondContact O-N 2.75Å; E334-N338 PolarHBondContact O-ND2 3.2Å; S335-N338 PolarHBondContact O-N 2.99Å; D336-N338 PolarHBondContact O-N 3.03Å; N338-R341 PolarHBondContact O-N 3.18Å; N338-K342 WeakPolarHBondContact O-CG 3.47Å; N338-K342 PolarHBondContact O-N 3.14Å
339T90.5Very high90.5Very high70 Ų70100.1 Ų100.143%0.42951%0.505SS..Hα-helixtrans-66.4-44.8175.1-47.40000110.7S335 D336 L337 K342 Q343S335-T339 WeakPolarHBondContact O-CB 3.36Å; S335-T339 PolarHBondContact O-N 3.36Å; S335-T339 PolarHBondContact O-OG1 3.08Å; D336-T339 WeakPolarHBondContact O-CB 3.49Å; D336-T339 PolarHBondContact O-N 3.38Å; L337-T339 VanDerWaalsContact C-N 3.31Å; T339-K342 PolarHBondContact O-N 3.42Å; T339-Q343 WeakPolarHBondContact O-CG 3.44Å; T339-Q343 PolarHBondContact O-N 2.83Å
340L90.2Very high90.5Very high100 Ų100100.9 Ų100.952%0.52450%0.504SS..Hα-helixtrans-62.7-42174.6-74.2169.9000112D336 L337 K342 Q343 L344D336-L340 WeakPolarHBondContact O-CB 3.23Å; D336-L340 WeakPolarHBondContact O-CG 3.36Å; D336-L340 PolarHBondContact O-N 2.94Å; L337-L340 PolarHBondContact O-N 2.79Å; L340-K342 PolarHBondContact O-N 2.84Å; L340-Q343 PolarHBondContact O-N 3.45Å; L340-L344 VanDerWaalsContact O-CB 3.29Å; L340-L344 WeakPolarHBondContact O-CB 3.28Å; L340-L344 PolarHBondContact O-N 3.25Å
341R91.8Very high90.5Very high166 Ų16699.7 Ų99.763%0.62650%0.501SS*.Hα-helixtrans-60.2-43.3174.4-79.5174.5177.4166.9-1.4111.8L337 N338 L344 L345L337-R341 WeakPolarHBondContact O-CB 3.49Å; L337-R341 VanDerWaalsContact O-CG 3.28Å; L337-R341 WeakPolarHBondContact O-CG 3.37Å; L337-R341 PolarHBondContact O-N 3.06Å; N338-R341 PolarHBondContact O-N 3.18Å; R341-L344 PolarHBondContact O-N 3.35Å; R341-L345 WeakPolarHBondContact O-CB 3.33Å; R341-L345 PolarHBondContact O-N 2.86Å
342K91Very high90.4Very high157 Ų15799.8 Ų99.868%0.68350%0.499SS*.Hα-helixtrans-63-42.9174.9-73.9174.8-178178.40111.5N338 T339 L340 L344 H346N338-K342 WeakPolarHBondContact O-CG 3.47Å; N338-K342 PolarHBondContact O-N 3.14Å; T339-K342 PolarHBondContact O-N 3.42Å; L340-K342 PolarHBondContact O-N 2.84Å; K342-L344 VanDerWaalsContact C-N 3.34Å; K342-H346 WeakPolarHBondContact O-CB 3.44Å; K342-H346 PolarHBondContact O-N 3.21Å
343Q91.9Very high90.3Very high118 Ų11896.3 Ų96.355%0.55149%0.493SS*.Hα-helixtrans-64.7-38.6176-72.1176.9-1.100112.1T339 L340 H346 S347T339-Q343 WeakPolarHBondContact O-CG 3.44Å; T339-Q343 PolarHBondContact O-N 2.83Å; L340-Q343 PolarHBondContact O-N 3.45Å; Q343-H346 WeakPolarHBondContact O-CB 3.37Å; Q343-H346 PolarHBondContact O-N 2.97Å; Q343-S347 WeakPolarHBondContact O-CB 3.37Å; Q343-S347 PolarHBondContact O-N 3.47Å
344L88.5Confident90.4Very high103 Ų10397.8 Ų97.854%0.53950%0.501SS..Hα-helixtrans-69.6-43.8178.6-161.2141000111.1L340 R341 K342 H346 S347 E348L340-L344 VanDerWaalsContact O-CB 3.29Å; L340-L344 WeakPolarHBondContact O-CB 3.28Å; L340-L344 PolarHBondContact O-N 3.25Å; R341-L344 PolarHBondContact O-N 3.35Å; K342-L344 VanDerWaalsContact C-N 3.34Å; L344-H346 VanDerWaalsContact C-N 3.32Å; L344-H346 PolarHBondContact O-N 3.31Å; L344-S347 CarbonylContact O-C 3.58Å; L344-S347 WeakPolarHBondContact O-CA 3.2Å; L344-S347 WeakPolarHBondContact O-CB 3.37Å; L344-S347 PolarHBondContact O-N 2.83Å; L344-S347 VanDerWaalsContact O-N 3.08Å; L344-E348 HydrophobicContact CD2-CG 4.13Å; L344-E348 WeakPolarHBondContact CD2-OE1 3.48Å; L344-E348 WeakPolarHBondContact O-CG 3.48Å; L344-E348 PolarHBondContact O-N 3.36Å
345L91.9Very high90.3Very high105 Ų10597.8 Ų97.855%0.5550%0.5SS..Hα-helixtrans-58.9-42.5171.5-174.777.4000111.6R341 S347 E348 T349R341-L345 WeakPolarHBondContact O-CB 3.33Å; R341-L345 PolarHBondContact O-N 2.86Å; L345-S347 VanDerWaalsContact C-N 3.3Å; L345-S347 PolarHBondContact O-N 3.5Å; L345-E348 PolarHBondContact O-N 3.36Å; L345-T349 WeakPolarHBondContact O-CB 3.48Å; L345-T349 WeakPolarHBondContact O-CG2 3.33Å; L345-T349 PolarHBondContact O-N 3.22Å; L345-T349 PolarHBondContact O-OG1 2.85Å
346H91Very high90.3Very high109 Ų109101 Ų10151%0.50551%0.508SS..Hα-helixtrans-62.8-37.6174.5-174.766.4000112.1K342 Q343 L344 T349 K350K342-H346 WeakPolarHBondContact O-CB 3.44Å; K342-H346 PolarHBondContact O-N 3.21Å; Q343-H346 WeakPolarHBondContact O-CB 3.37Å; Q343-H346 PolarHBondContact O-N 2.97Å; L344-H346 VanDerWaalsContact C-N 3.32Å; L344-H346 PolarHBondContact O-N 3.31Å; H346-T349 WeakPolarHBondContact CA-OG1 3.33Å; H346-T349 PolarHBondContact O-OG1 3.36Å; H346-K350 VanDerWaalsContact NE2-CE 3.31Å; H346-K350 WeakPolarHBondContact NE2-CE 3.49Å; H346-K350 WeakPolarHBondContact O-CB 3.43Å; H346-K350 WeakPolarHBondContact O-CG 3.25Å; H346-K350 PolarHBondContact O-N 3.01Å; H346-K350 VanDerWaalsContact O-N 3.11Å
347S87.9Confident90.1Very high76 Ų7699 Ų9953%0.53150%0.502SS..Hα-helixtrans-69.6-40.6175-169.50000112.3Q343 L344 L345 K350 L351Q343-S347 WeakPolarHBondContact O-CB 3.37Å; Q343-S347 PolarHBondContact O-N 3.47Å; L344-S347 CarbonylContact O-C 3.58Å; L344-S347 WeakPolarHBondContact O-CA 3.2Å; L344-S347 WeakPolarHBondContact O-CB 3.37Å; L344-S347 PolarHBondContact O-N 2.83Å; L344-S347 VanDerWaalsContact O-N 3.08Å; L345-S347 VanDerWaalsContact C-N 3.3Å; L345-S347 PolarHBondContact O-N 3.5Å; S347-K350 PolarHBondContact O-N 3.16Å; S347-L351 WeakPolarHBondContact O-CB 3.16Å; S347-L351 PolarHBondContact O-N 3.41Å
348E90.1Very high90.1Very high109 Ų109102.6 Ų102.651%0.50951%0.51SS..Hα-helixtrans-66.2-45.4176.7-76.8179.3160.200111.8L344 L345 K350 L351 E352L344-E348 HydrophobicContact CD2-CG 4.13Å; L344-E348 WeakPolarHBondContact CD2-OE1 3.48Å; L344-E348 WeakPolarHBondContact O-CG 3.48Å; L344-E348 PolarHBondContact O-N 3.36Å; L345-E348 PolarHBondContact O-N 3.36Å; E348-K350 VanDerWaalsContact C-N 3.31Å; E348-K350 PolarHBondContact O-N 3.27Å; E348-L351 WeakPolarHBondContact O-CB 3.29Å; E348-L351 PolarHBondContact O-N 2.77Å; E348-E352 WeakPolarHBondContact O-CB 3.38Å; E348-E352 PolarHBondContact O-N 3.23Å
349T90.8Very high90.1Very high79 Ų79103.6 Ų103.649%0.48552%0.519SS..Hα-helixtrans-62.3-39.2176.148.50000111.8L345 H346 E352 A353L345-T349 WeakPolarHBondContact O-CB 3.48Å; L345-T349 WeakPolarHBondContact O-CG2 3.33Å; L345-T349 PolarHBondContact O-N 3.22Å; L345-T349 PolarHBondContact O-OG1 2.85Å; H346-T349 WeakPolarHBondContact CA-OG1 3.33Å; H346-T349 PolarHBondContact O-OG1 3.36Å; T349-E352 PolarHBondContact O-N 3.38Å; T349-A353 WeakPolarHBondContact O-CB 3.42Å; T349-A353 PolarHBondContact O-N 3.08Å
350K90.8Very high90Very high117 Ų117103.4 Ų103.451%0.50952%0.518SS..Hα-helixtrans-62.2-48.1170.2-81-177.6171.5-174.50112.4H346 S347 E348 E352 A353 D354H346-K350 VanDerWaalsContact NE2-CE 3.31Å; H346-K350 WeakPolarHBondContact NE2-CE 3.49Å; H346-K350 WeakPolarHBondContact O-CB 3.43Å; H346-K350 WeakPolarHBondContact O-CG 3.25Å; H346-K350 PolarHBondContact O-N 3.01Å; H346-K350 VanDerWaalsContact O-N 3.11Å; S347-K350 PolarHBondContact O-N 3.16Å; E348-K350 VanDerWaalsContact C-N 3.31Å; E348-K350 PolarHBondContact O-N 3.27Å; K350-E352 VanDerWaalsContact C-N 3.28Å; K350-E352 PolarHBondContact O-N 3.08Å; K350-A353 WeakPolarHBondContact O-CB 3.14Å; K350-A353 PolarHBondContact O-N 3.27Å; K350-D354 WeakPolarHBondContact O-CB 2.94Å; K350-D354 VanDerWaalsContact O-CG 3.32Å; K350-D354 PolarHBondContact O-N 3.02Å
351L89.1Confident89.9Confident96 Ų96106.3 Ų106.350%0.50352%0.523SS..Hα-helixtrans-59.2-40.6178.1-170.9101000111.5S347 E348 D354 K355S347-L351 WeakPolarHBondContact O-CB 3.16Å; S347-L351 PolarHBondContact O-N 3.41Å; E348-L351 WeakPolarHBondContact O-CB 3.29Å; E348-L351 PolarHBondContact O-N 2.77Å; L351-D354 PolarHBondContact O-N 2.98Å; L351-K355 WeakPolarHBondContact O-CG 3.32Å; L351-K355 PolarHBondContact O-N 3.49Å
352E89.9Confident89.8Confident93 Ų93100.3 Ų100.344%0.43551%0.507SS..Hα-helixtrans-70.5-38.9179.3-150.464.9-163.600111.7E348 T349 K350 D354 K355 Q356E348-E352 WeakPolarHBondContact O-CB 3.38Å; E348-E352 PolarHBondContact O-N 3.23Å; T349-E352 PolarHBondContact O-N 3.38Å; K350-E352 VanDerWaalsContact C-N 3.28Å; K350-E352 PolarHBondContact O-N 3.08Å; E352-D354 VanDerWaalsContact C-N 3.33Å; E352-K355 PolarHBondContact O-N 3.35Å; E352-K355 IonicContact OE2-NZ 3.66Å; E352-K355 PolarHBondContact OE2-NZ 3.36Å; E352-Q356 WeakPolarHBondContact O-CG 3.41Å; E352-Q356 PolarHBondContact O-N 3.46Å
353A89.3Confident89.7Confident53 Ų5399.6 Ų99.644%0.43850%0.499SS..Hα-helixtrans-61.2-42.2170.400000111.5T349 K350 Q356 A357T349-A353 WeakPolarHBondContact O-CB 3.42Å; T349-A353 PolarHBondContact O-N 3.08Å; K350-A353 WeakPolarHBondContact O-CB 3.14Å; K350-A353 PolarHBondContact O-N 3.27Å; A353-Q356 PolarHBondContact O-N 3.13Å; A353-A357 WeakPolarHBondContact O-CB 3.32Å; A353-A357 PolarHBondContact O-N 2.87Å
354D91Very high89.5Confident111 Ų11197.7 Ų97.759%0.59449%0.492SS*.Hα-helixtrans-67.4-36.8176.7-72-19.5000111.9K350 L351 E352 A357 Y358K350-D354 WeakPolarHBondContact O-CB 2.94Å; K350-D354 VanDerWaalsContact O-CG 3.32Å; K350-D354 PolarHBondContact O-N 3.02Å; L351-D354 PolarHBondContact O-N 2.98Å; E352-D354 VanDerWaalsContact C-N 3.33Å; D354-A357 PolarHBondContact O-N 3.42Å; D354-Y358 WeakPolarHBondContact O-CB 3.22Å; D354-Y358 PolarHBondContact O-N 2.94Å
355K89.7Confident89.5Confident99 Ų9997.4 Ų97.443%0.4349%0.491SS..Hα-helixtrans-64.7-41.2171.4-75.3178.3-163.2158.20111.9L351 E352 Y358 T359L351-K355 WeakPolarHBondContact O-CG 3.32Å; L351-K355 PolarHBondContact O-N 3.49Å; E352-K355 PolarHBondContact O-N 3.35Å; E352-K355 IonicContact OE2-NZ 3.66Å; E352-K355 PolarHBondContact OE2-NZ 3.36Å; K355-Y358 PolarHBondContact O-N 3.01Å; K355-T359 WeakPolarHBondContact O-CG2 3.48Å; K355-T359 PolarHBondContact O-N 2.87Å; K355-T359 PolarHBondContact O-OG1 3.39Å
356Q88.4Confident89.4Confident126 Ų12698.5 Ų98.559%0.58949%0.493SS*.Hα-helixtrans-63.6-44.7174.4-73.6178.911.400110.6E352 A353 Y358 T359 T360E352-Q356 WeakPolarHBondContact O-CG 3.41Å; E352-Q356 PolarHBondContact O-N 3.46Å; A353-Q356 PolarHBondContact O-N 3.13Å; Q356-Y358 PolarHBondContact O-N 2.79Å; Q356-T359 WeakPolarHBondContact CA-OG1 3.33Å; Q356-T359 PolarHBondContact O-N 3.37Å; Q356-T359 PolarHBondContact O-OG1 2.87Å; Q356-T360 VanDerWaalsContact O-CG2 3.3Å; Q356-T360 WeakPolarHBondContact O-CG2 3.37Å; Q356-T360 PolarHBondContact O-N 3.35Å; Q356-T360 PolarHBondContact O-OG1 2.9Å
357A88.7Confident89.3Confident33 Ų3397.6 Ų97.627%0.27349%0.489SS..Hα-helixtrans-58.5-48.2173.200000110.7A353 D354 T359 T360 Y361A353-A357 WeakPolarHBondContact O-CB 3.32Å; A353-A357 PolarHBondContact O-N 2.87Å; D354-A357 PolarHBondContact O-N 3.42Å; A357-T359 PolarHBondContact O-N 2.86Å; A357-T360 WeakPolarHBondContact CA-OG1 3.26Å; A357-T360 PolarHBondContact O-N 3.48Å; A357-T360 PolarHBondContact O-OG1 2.88Å; A357-Y361 HydrophobicContact CB-CD2 4.29Å; A357-Y361 HydrophobicContact CB-CE2 4.05Å; A357-Y361 WeakPolarHBondContact O-CB 3.44Å; A357-Y361 WeakPolarHBondContact O-CD2 3.15Å; A357-Y361 PolarHBondContact O-N 3.47Å
358Y88.4Confident89.2Confident169 Ų16997.3 Ų97.366%0.66348%0.484SS*.Hα-helixtrans-59.9-44.7178-177.4-94.1000112.9D354 K355 Q356 Y361 S362D354-Y358 WeakPolarHBondContact O-CB 3.22Å; D354-Y358 PolarHBondContact O-N 2.94Å; K355-Y358 PolarHBondContact O-N 3.01Å; Q356-Y358 PolarHBondContact O-N 2.79Å; Y358-Y361 PolarHBondContact O-N 2.94Å; Y358-S362 VanDerWaalsContact O-CB 3.25Å; Y358-S362 WeakPolarHBondContact O-CB 2.92Å; Y358-S362 PolarHBondContact O-N 2.99Å
359T90.7Very high89.1Confident86 Ų8697.7 Ų97.753%0.52849%0.486SS..Hα-helixtrans-65.1-39.9177.147.10000111.8K355 Q356 A357 S362 R363K355-T359 WeakPolarHBondContact O-CG2 3.48Å; K355-T359 PolarHBondContact O-N 2.87Å; K355-T359 PolarHBondContact O-OG1 3.39Å; Q356-T359 WeakPolarHBondContact CA-OG1 3.33Å; Q356-T359 PolarHBondContact O-N 3.37Å; Q356-T359 PolarHBondContact O-OG1 2.87Å; A357-T359 PolarHBondContact O-N 2.86Å; T359-S362 PolarHBondContact O-N 3.43Å; T359-R363 PolarHBondContact O-N 3.12Å
360T88.1Confident89Confident67 Ų67102.1 Ų102.141%0.41149%0.494SS..Hα-helixtrans-63.9-45.517360.90000111.9Q356 A357 S362 R363 I364Q356-T360 VanDerWaalsContact O-CG2 3.3Å; Q356-T360 WeakPolarHBondContact O-CG2 3.37Å; Q356-T360 PolarHBondContact O-N 3.35Å; Q356-T360 PolarHBondContact O-OG1 2.9Å; A357-T360 WeakPolarHBondContact CA-OG1 3.26Å; A357-T360 PolarHBondContact O-N 3.48Å; A357-T360 PolarHBondContact O-OG1 2.88Å; T360-S362 VanDerWaalsContact C-N 3.34Å; T360-S362 PolarHBondContact O-N 3.48Å; T360-R363 PolarHBondContact O-N 3.43Å; T360-I364 WeakPolarHBondContact O-CB 3.4Å; T360-I364 VanDerWaalsContact O-CG1 3.24Å; T360-I364 WeakPolarHBondContact O-CG1 3.1Å; T360-I364 PolarHBondContact O-N 2.96Å
361Y88.5Confident88.8Confident160 Ų160101 Ų10163%0.62749%0.494SS*.Hα-helixtrans-63.6-38.3175.9-71.7-51.9000112.4A357 Y358 I364 L365A357-Y361 HydrophobicContact CB-CD2 4.29Å; A357-Y361 HydrophobicContact CB-CE2 4.05Å; A357-Y361 WeakPolarHBondContact O-CB 3.44Å; A357-Y361 WeakPolarHBondContact O-CD2 3.15Å; A357-Y361 PolarHBondContact O-N 3.47Å; Y358-Y361 PolarHBondContact O-N 2.94Å; Y361-I364 PolarHBondContact O-N 3.47Å; Y361-L365 VanDerWaalsContact O-CB 3.27Å; Y361-L365 WeakPolarHBondContact O-CB 3.14Å; Y361-L365 PolarHBondContact O-N 2.96Å
362S90.5Very high88.7Confident41 Ų41101.1 Ų101.129%0.28749%0.494SS..Hα-helixtrans-65.1-42.5175.8-1760000111.6Y358 T359 T360 L365 Q366Y358-S362 VanDerWaalsContact O-CB 3.25Å; Y358-S362 WeakPolarHBondContact O-CB 2.92Å; Y358-S362 PolarHBondContact O-N 2.99Å; T359-S362 PolarHBondContact O-N 3.43Å; T360-S362 VanDerWaalsContact C-N 3.34Å; T360-S362 PolarHBondContact O-N 3.48Å; S362-L365 PolarHBondContact O-N 3.46Å; S362-Q366 WeakPolarHBondContact O-CG 3.28Å; S362-Q366 PolarHBondContact O-N 2.83Å
363R88.9Confident88.7Confident141 Ų141102 Ų10253%0.53250%0.501SS..Hα-helixtrans-62.8-47.3173.9-174.1-179.472.396.5-4.8111.5T359 T360 L365 Q366 E367T359-R363 PolarHBondContact O-N 3.12Å; T360-R363 PolarHBondContact O-N 3.43Å; R363-L365 VanDerWaalsContact C-N 3.29Å; R363-L365 PolarHBondContact O-N 3Å; R363-Q366 PolarHBondContact O-N 3.39Å; R363-E367 IonicContact CZ-OE1 3.52Å; R363-E367 IonicContact NH1-OE1 3.56Å; R363-E367 PolarHBondContact NH1-OE1 3.06Å; R363-E367 IonicContact NH1-OE2 3.46Å; R363-E367 WeakPolarHBondContact O-CB 3.15Å; R363-E367 PolarHBondContact O-N 3.49Å
364I88Confident88.7Confident79 Ų79102.7 Ų102.741%0.40550%0.497SS..Hα-helixtrans-60.1-43.3177.1-67.9164.8000109.7T360 Y361 E367 T368T360-I364 WeakPolarHBondContact O-CB 3.4Å; T360-I364 VanDerWaalsContact O-CG1 3.24Å; T360-I364 WeakPolarHBondContact O-CG1 3.1Å; T360-I364 PolarHBondContact O-N 2.96Å; Y361-I364 PolarHBondContact O-N 3.47Å; I364-E367 PolarHBondContact O-N 3.29Å; I364-T368 HydrophobicContact CG2-CG2 4.23Å; I364-T368 WeakPolarHBondContact O-CB 3.41Å; I364-T368 VanDerWaalsContact O-CG2 3.23Å; I364-T368 WeakPolarHBondContact O-CG2 3.16Å; I364-T368 PolarHBondContact O-N 2.87Å; I364-T368 PolarHBondContact O-OG1 3.13Å
365L88.3Confident88.3Confident97 Ų9799.8 Ų99.851%0.50849%0.489SS..Hα-helixtrans-60.6-50.5177.3-174.867.8000111.2Y361 S362 R363 E367 T368 E369Y361-L365 VanDerWaalsContact O-CB 3.27Å; Y361-L365 WeakPolarHBondContact O-CB 3.14Å; Y361-L365 PolarHBondContact O-N 2.96Å; S362-L365 PolarHBondContact O-N 3.46Å; R363-L365 VanDerWaalsContact C-N 3.29Å; R363-L365 PolarHBondContact O-N 3Å; L365-E367 VanDerWaalsContact C-N 3.33Å; L365-E367 PolarHBondContact O-N 2.93Å; L365-T368 WeakPolarHBondContact CA-OG1 3.09Å; L365-T368 CarbonylContact O-C 3.58Å; L365-T368 PolarHBondContact O-N 3.15Å; L365-T368 VanDerWaalsContact O-N 3.12Å; L365-T368 PolarHBondContact O-OG1 3.36Å; L365-E369 HydrophobicContact CG-CG 4.45Å; L365-E369 WeakPolarHBondContact O-CB 3.27Å; L365-E369 WeakPolarHBondContact O-CG 3.43Å; L365-E369 PolarHBondContact O-N 3.04Å
366Q90.1Very high88.2Confident128 Ų128100.9 Ų100.960%0.59849%0.494SS*.Hα-helixtrans-59.5-41.7176.8-75.9-178.1-5.900112.6S362 R363 E369 R370S362-Q366 WeakPolarHBondContact O-CG 3.28Å; S362-Q366 PolarHBondContact O-N 2.83Å; R363-Q366 PolarHBondContact O-N 3.39Å; Q366-E369 PolarHBondContact O-N 3.49Å; Q366-R370 WeakPolarHBondContact O-CB 3.23Å; Q366-R370 PolarHBondContact O-N 2.82Å
367E87.4Confident88.1Confident89 Ų8998.4 Ų98.442%0.41649%0.488SS..Hα-helixtrans-62.8-43.3174.3-79.1176-172.300111.3R363 I364 L365 R370 N371R363-E367 IonicContact CZ-OE1 3.52Å; R363-E367 IonicContact NH1-OE1 3.56Å; R363-E367 PolarHBondContact NH1-OE1 3.06Å; R363-E367 IonicContact NH1-OE2 3.46Å; R363-E367 WeakPolarHBondContact O-CB 3.15Å; R363-E367 PolarHBondContact O-N 3.49Å; I364-E367 PolarHBondContact O-N 3.29Å; L365-E367 VanDerWaalsContact C-N 3.33Å; L365-E367 PolarHBondContact O-N 2.93Å; E367-R370 PolarHBondContact O-N 3.21Å; E367-N371 WeakPolarHBondContact O-CB 3.39Å; E367-N371 PolarHBondContact O-N 3.39Å; E367-N371 PolarHBondContact O-ND2 3.44Å
368T86.5Confident87.9Confident71 Ų71103.1 Ų103.144%0.43650%0.504SS..Hα-helixtrans-67.1-38.4177.159.40000112.7I364 L365 N371 L372I364-T368 HydrophobicContact CG2-CG2 4.23Å; I364-T368 WeakPolarHBondContact O-CB 3.41Å; I364-T368 VanDerWaalsContact O-CG2 3.23Å; I364-T368 WeakPolarHBondContact O-CG2 3.16Å; I364-T368 PolarHBondContact O-N 2.87Å; I364-T368 PolarHBondContact O-OG1 3.13Å; L365-T368 WeakPolarHBondContact CA-OG1 3.09Å; L365-T368 CarbonylContact O-C 3.58Å; L365-T368 PolarHBondContact O-N 3.15Å; L365-T368 VanDerWaalsContact O-N 3.12Å; L365-T368 PolarHBondContact O-OG1 3.36Å; T368-N371 PolarHBondContact O-N 2.87Å; T368-L372 VanDerWaalsContact O-CB 3.26Å; T368-L372 WeakPolarHBondContact O-CB 2.97Å; T368-L372 PolarHBondContact O-N 2.88Å
369E87.5Confident87.8Confident116 Ų11699.8 Ų99.854%0.54250%0.498SS..Hα-helixtrans-66.3-41.9175.1-75.6-178.416400111.3L365 Q366 L372 L373L365-E369 HydrophobicContact CG-CG 4.45Å; L365-E369 WeakPolarHBondContact O-CB 3.27Å; L365-E369 WeakPolarHBondContact O-CG 3.43Å; L365-E369 PolarHBondContact O-N 3.04Å; Q366-E369 PolarHBondContact O-N 3.49Å; E369-L372 PolarHBondContact O-N 2.95Å; E369-L373 WeakPolarHBondContact O-CB 3.28Å; E369-L373 PolarHBondContact O-N 3.05Å
370R88.4Confident87.7Confident173 Ų173101.2 Ų101.265%0.65350%0.502SS*.Hα-helixtrans-63.5-44.5175.3-163.3-179.398.7133.13.4111.4Q366 E367 L372 L373 N374Q366-R370 WeakPolarHBondContact O-CB 3.23Å; Q366-R370 PolarHBondContact O-N 2.82Å; E367-R370 PolarHBondContact O-N 3.21Å; R370-L372 VanDerWaalsContact C-N 3.34Å; R370-L373 PolarHBondContact O-N 3.04Å; R370-N374 VanDerWaalsContact O-CG 3.28Å; R370-N374 PolarHBondContact O-N 3.41Å
371N88.1Confident87.7Confident94 Ų94102 Ų10250%0.50351%0.507SS..Hα-helixtrans-64.7-39.2176.3-69.9-18000111.5E367 T368 N374 A375E367-N371 WeakPolarHBondContact O-CB 3.39Å; E367-N371 PolarHBondContact O-N 3.39Å; E367-N371 PolarHBondContact O-ND2 3.44Å; T368-N371 PolarHBondContact O-N 2.87Å; N371-N374 PolarHBondContact O-N 2.89Å; N371-A375 VanDerWaalsContact O-CB 3.31Å; N371-A375 WeakPolarHBondContact O-CB 3.41Å; N371-A375 PolarHBondContact O-N 3.27Å
372L86.8Confident87.4Confident97 Ų9796.6 Ų96.651%0.50850%0.495SS..Hα-helixtrans-63.1-42173.9-176.576.3000111.4T368 E369 R370 A375 K376T368-L372 VanDerWaalsContact O-CB 3.26Å; T368-L372 WeakPolarHBondContact O-CB 2.97Å; T368-L372 PolarHBondContact O-N 2.88Å; E369-L372 PolarHBondContact O-N 2.95Å; R370-L372 VanDerWaalsContact C-N 3.34Å; L372-A375 PolarHBondContact O-N 3.46Å; L372-K376 HydrophobicContact CG-CD 4.5Å; L372-K376 WeakPolarHBondContact O-CB 3.23Å; L372-K376 WeakPolarHBondContact O-CG 3.5Å; L372-K376 PolarHBondContact O-N 3.4Å
373L88.7Confident87.2Confident113 Ų11398.8 Ų98.859%0.59250%0.501SS*.Hα-helixtrans-63.7-45.2177.4-161.9111.6000110.8E369 R370 K376 T377E369-L373 WeakPolarHBondContact O-CB 3.28Å; E369-L373 PolarHBondContact O-N 3.05Å; R370-L373 PolarHBondContact O-N 3.04Å; L373-K376 PolarHBondContact O-N 2.84Å; L373-T377 WeakPolarHBondContact O-CG2 3.37Å; L373-T377 PolarHBondContact O-N 3.48Å; L373-T377 PolarHBondContact O-OG1 3.45Å
374N89.3Confident87Confident66 Ų6694.8 Ų94.835%0.35350%0.498SS..Hα-helixtrans-59.7-48.8174.7-69.7-12000111.3R370 N371 K376 T377 E378R370-N374 VanDerWaalsContact O-CG 3.28Å; R370-N374 PolarHBondContact O-N 3.41Å; N371-N374 PolarHBondContact O-N 2.89Å; N374-K376 VanDerWaalsContact C-N 3.31Å; N374-K376 PolarHBondContact O-N 3.18Å; N374-T377 WeakPolarHBondContact CA-OG1 3.34Å; N374-T377 PolarHBondContact O-N 3.3Å; N374-T377 VanDerWaalsContact O-N 3.12Å; N374-T377 PolarHBondContact O-OG1 3.21Å; N374-E378 WeakPolarHBondContact O-CG 3.29Å; N374-E378 PolarHBondContact O-N 2.99Å
375A83.3Confident86.9Confident51 Ų5195.9 Ų95.942%0.42150%0.504SS..Hα-helixtrans-61.9-37.117700000112.3N371 L372 N379N371-A375 VanDerWaalsContact O-CB 3.31Å; N371-A375 WeakPolarHBondContact O-CB 3.41Å; N371-A375 PolarHBondContact O-N 3.27Å; L372-A375 PolarHBondContact O-N 3.46Å; A375-N379 WeakPolarHBondContact O-CB 3.22Å; A375-N379 PolarHBondContact O-N 2.86Å
376K86.9Confident86.7Confident122 Ų12294 Ų9453%0.5350%0.497SS..Hα-helixtrans-64.8-42.7172.8-80.7179.8178.1178.10111.7L372 L373 N374 N379 N380L372-K376 HydrophobicContact CG-CD 4.5Å; L372-K376 WeakPolarHBondContact O-CB 3.23Å; L372-K376 WeakPolarHBondContact O-CG 3.5Å; L372-K376 PolarHBondContact O-N 3.4Å; L373-K376 PolarHBondContact O-N 2.84Å; N374-K376 VanDerWaalsContact C-N 3.31Å; N374-K376 PolarHBondContact O-N 3.18Å; K376-N379 PolarHBondContact O-N 3.42Å; K376-N380 WeakPolarHBondContact O-CB 3.23Å; K376-N380 VanDerWaalsContact O-CG 3.22Å; K376-N380 PolarHBondContact O-N 2.77Å; K376-N380 PolarHBondContact O-ND2 3.2Å
377T87.6Confident86.4Confident74 Ų7491.8 Ų91.845%0.45449%0.489SS..Hα-helixtrans-64.9-43.6176.251.90000111.9L373 N374 N380 T381L373-T377 WeakPolarHBondContact O-CG2 3.37Å; L373-T377 PolarHBondContact O-N 3.48Å; L373-T377 PolarHBondContact O-OG1 3.45Å; N374-T377 WeakPolarHBondContact CA-OG1 3.34Å; N374-T377 PolarHBondContact O-N 3.3Å; N374-T377 VanDerWaalsContact O-N 3.12Å; N374-T377 PolarHBondContact O-OG1 3.21Å; T377-N380 PolarHBondContact O-N 3.26Å; T377-T381 WeakPolarHBondContact O-CG2 3.23Å; T377-T381 PolarHBondContact O-N 2.86Å; T377-T381 PolarHBondContact O-OG1 3.23Å
378E84.9Confident86.5Confident131 Ų13192 Ų9261%0.61249%0.493SS*.Hα-helixtrans-61.7-46.8175-75.1179176.700111.3N374 N380 T381 A382N374-E378 WeakPolarHBondContact O-CG 3.29Å; N374-E378 PolarHBondContact O-N 2.99Å; E378-N380 VanDerWaalsContact C-N 3.33Å; E378-N380 PolarHBondContact O-N 3.16Å; E378-T381 WeakPolarHBondContact CA-OG1 3.47Å; E378-T381 PolarHBondContact O-N 2.99Å; E378-T381 VanDerWaalsContact O-N 3.13Å; E378-T381 PolarHBondContact O-OG1 3.36Å; E378-A382 WeakPolarHBondContact O-CB 3.48Å; E378-A382 PolarHBondContact O-N 2.86Å
379N86.2Confident86.2Confident100 Ų10093.7 Ų93.754%0.53550%0.498SS..Hα-helixtrans-60-42.3177-16916.7000111.7A375 K376 T381 A382 Q383A375-N379 WeakPolarHBondContact O-CB 3.22Å; A375-N379 PolarHBondContact O-N 2.86Å; K376-N379 PolarHBondContact O-N 3.42Å; N379-T381 VanDerWaalsContact C-N 3.34Å; N379-T381 PolarHBondContact O-N 3.22Å; N379-A382 PolarHBondContact O-N 3.06Å; N379-Q383 VanDerWaalsContact O-CB 3.28Å; N379-Q383 WeakPolarHBondContact O-CB 3.23Å; N379-Q383 PolarHBondContact O-N 2.99Å
380N88.3Confident86Confident116 Ų11695.9 Ų95.962%0.6250%0.502SS*.Hα-helixtrans-61.7-41175.4-73.6-17.2000112K376 T377 E378 A384K376-N380 WeakPolarHBondContact O-CB 3.23Å; K376-N380 VanDerWaalsContact O-CG 3.22Å; K376-N380 PolarHBondContact O-N 2.77Å; K376-N380 PolarHBondContact O-ND2 3.2Å; T377-N380 PolarHBondContact O-N 3.26Å; E378-N380 VanDerWaalsContact C-N 3.33Å; E378-N380 PolarHBondContact O-N 3.16Å; N380-A384 PolarHBondContact O-N 2.81Å
381T88.1Confident85.7Confident84 Ų8495.2 Ų95.252%0.51550%0.503SS..Hα-helixtrans-67.7-41.7175.359.80000112.7T377 E378 N379 A384 N385T377-T381 WeakPolarHBondContact O-CG2 3.23Å; T377-T381 PolarHBondContact O-N 2.86Å; T377-T381 PolarHBondContact O-OG1 3.23Å; E378-T381 WeakPolarHBondContact CA-OG1 3.47Å; E378-T381 PolarHBondContact O-N 2.99Å; E378-T381 VanDerWaalsContact O-N 3.13Å; E378-T381 PolarHBondContact O-OG1 3.36Å; N379-T381 VanDerWaalsContact C-N 3.34Å; N379-T381 PolarHBondContact O-N 3.22Å; T381-A384 PolarHBondContact O-N 3.47Å; T381-N385 PolarHBondContact O-N 3.03Å; T381-N385 PolarHBondContact O-ND2 3.18Å
382A82.2Confident85.5Confident45 Ų4596.5 Ų96.537%0.37251%0.507SS..Hα-helixtrans-63.9-41.8176.200000111.2E378 N379 A384 N385 V386E378-A382 WeakPolarHBondContact O-CB 3.48Å; E378-A382 PolarHBondContact O-N 2.86Å; N379-A382 PolarHBondContact O-N 3.06Å; A382-A384 PolarHBondContact O-N 2.94Å; A382-N385 WeakPolarHBondContact O-CB 3.41Å; A382-N385 PolarHBondContact O-N 2.83Å; A382-V386 WeakPolarHBondContact O-CG2 3.43Å; A382-V386 PolarHBondContact O-N 2.85Å
383Q86.4Confident85.2Confident88 Ų8897 Ų9741%0.41151%0.509SS..Hα-helixtrans-64.5-39.4176.6-168.163.829.900111.8N379 N385 V386 N387N379-Q383 VanDerWaalsContact O-CB 3.28Å; N379-Q383 WeakPolarHBondContact O-CB 3.23Å; N379-Q383 PolarHBondContact O-N 2.99Å; Q383-N385 VanDerWaalsContact C-N 3.33Å; Q383-V386 PolarHBondContact O-N 3.39Å; Q383-N387 WeakPolarHBondContact O-CB 3.26Å; Q383-N387 PolarHBondContact O-N 3.5Å; Q383-N387 PolarHBondContact O-ND2 3.34Å
384A85.1Confident84.8Confident57 Ų5798.2 Ų98.247%0.47151%0.512SS..Hα-helixtrans-61.3-41.9172.600000111.7N380 T381 A382 N387 N388N380-A384 PolarHBondContact O-N 2.81Å; T381-A384 PolarHBondContact O-N 3.47Å; A382-A384 PolarHBondContact O-N 2.94Å; A384-N387 PolarHBondContact O-N 2.86Å; A384-N388 PolarHBondContact O-N 3.12Å; A384-N388 VanDerWaalsContact O-N 3.09Å
385N85.9Confident84.5Confident101 Ų101102.3 Ų102.354%0.5453%0.526SS..Hα-helixtrans-65.5-45.2175.7-70.7-20.8000112.4T381 A382 Q383 N387 N388 I389T381-N385 PolarHBondContact O-N 3.03Å; T381-N385 PolarHBondContact O-ND2 3.18Å; A382-N385 WeakPolarHBondContact O-CB 3.41Å; A382-N385 PolarHBondContact O-N 2.83Å; Q383-N385 VanDerWaalsContact C-N 3.33Å; N385-N387 VanDerWaalsContact C-N 3.33Å; N385-N387 PolarHBondContact O-N 3.48Å; N385-N388 WeakPolarHBondContact O-CB 3.3Å; N385-N388 PolarHBondContact O-N 3.27Å; N385-N388 VanDerWaalsContact O-N 3.11Å; N385-I389 WeakPolarHBondContact O-CG1 3.49Å; N385-I389 PolarHBondContact O-N 2.88Å
386V82.7Confident84.4Confident58 Ų58105.9 Ų105.935%0.35253%0.532SS..Hα-helixtrans-60-43.4176.2169.10000110.8A382 Q383 N388 I389 R390A382-V386 WeakPolarHBondContact O-CG2 3.43Å; A382-V386 PolarHBondContact O-N 2.85Å; Q383-V386 PolarHBondContact O-N 3.39Å; V386-N388 VanDerWaalsContact C-N 3.26Å; V386-N388 PolarHBondContact O-N 2.89Å; V386-I389 PolarHBondContact O-N 3.49Å; V386-R390 HydrophobicContact CG1-CG 4.41Å; V386-R390 WeakPolarHBondContact O-CB 3.33Å; V386-R390 WeakPolarHBondContact O-CG 3.34Å; V386-R390 PolarHBondContact O-N 3.3Å
387N84.8Confident84.2Confident82 Ų82103 Ų10344%0.43953%0.525SS..Hα-helixtrans-62.2-35.4176.3-73.3-17.1000111.9Q383 A384 N385 K391Q383-N387 WeakPolarHBondContact O-CB 3.26Å; Q383-N387 PolarHBondContact O-N 3.5Å; Q383-N387 PolarHBondContact O-ND2 3.34Å; A384-N387 PolarHBondContact O-N 2.86Å; N385-N387 VanDerWaalsContact C-N 3.33Å; N385-N387 PolarHBondContact O-N 3.48Å; N387-K391 PolarHBondContact O-N 3Å
388N88.3Confident83.7Confident93 Ų93105 Ų10550%0.49753%0.533SS..Hα-helixtrans-70.1-43.7175.5-15814.4000112A384 N385 V386 K391 Q392A384-N388 PolarHBondContact O-N 3.12Å; A384-N388 VanDerWaalsContact O-N 3.09Å; N385-N388 WeakPolarHBondContact O-CB 3.3Å; N385-N388 PolarHBondContact O-N 3.27Å; N385-N388 VanDerWaalsContact O-N 3.11Å; V386-N388 VanDerWaalsContact C-N 3.26Å; V386-N388 PolarHBondContact O-N 2.89Å; N388-K391 PolarHBondContact O-N 3.43Å; N388-Q392 PolarHBondContact O-N 2.84Å
389I81.5Confident83.7Confident106 Ų106103.4 Ų103.454%0.54453%0.525SS..Hα-helixtrans-64.3-41.6176.7-67170.5000111.3N385 V386 K391 Q392 L393N385-I389 WeakPolarHBondContact O-CG1 3.49Å; N385-I389 PolarHBondContact O-N 2.88Å; V386-I389 PolarHBondContact O-N 3.49Å; I389-K391 VanDerWaalsContact C-N 3.31Å; I389-K391 PolarHBondContact O-N 3.34Å; I389-Q392 WeakPolarHBondContact O-CA 3.39Å; I389-Q392 WeakPolarHBondContact O-CB 3.24Å; I389-Q392 PolarHBondContact O-N 3.41Å; I389-L393 PolarHBondContact O-N 3.1Å
390R81.7Confident83.3Confident162 Ų162103.9 Ų103.961%0.61152%0.522SS*.Hα-helixtrans-58.1-43.2176.5-78.7-177.5176.6-174.5-0.5112V386 Q392 L393 E394V386-R390 HydrophobicContact CG1-CG 4.41Å; V386-R390 WeakPolarHBondContact O-CB 3.33Å; V386-R390 WeakPolarHBondContact O-CG 3.34Å; V386-R390 PolarHBondContact O-N 3.3Å; R390-Q392 VanDerWaalsContact C-N 3.28Å; R390-Q392 PolarHBondContact O-N 2.84Å; R390-L393 PolarHBondContact O-N 2.85Å; R390-E394 PolarHBondContact O-N 3.38Å
391K82.4Confident82.9Confident159 Ų159103.2 Ų103.269%0.69152%0.515SS*.Hα-helixtrans-60.9-35.5173.6-78.9-177.6175.3-179.40112.8N387 N388 I389N387-K391 PolarHBondContact O-N 3Å; N388-K391 PolarHBondContact O-N 3.43Å; I389-K391 VanDerWaalsContact C-N 3.31Å; I389-K391 PolarHBondContact O-N 3.34Å
392Q85.1Confident82.4Confident122 Ų122104.2 Ų104.257%0.5752%0.518SS*.Hα-helixtrans-72.4-39.1175.5-67.1-179.81.100112.3N388 I389 R390 K395 K396N388-Q392 PolarHBondContact O-N 2.84Å; I389-Q392 WeakPolarHBondContact O-CA 3.39Å; I389-Q392 WeakPolarHBondContact O-CB 3.24Å; I389-Q392 PolarHBondContact O-N 3.41Å; R390-Q392 VanDerWaalsContact C-N 3.28Å; R390-Q392 PolarHBondContact O-N 2.84Å; Q392-K395 WeakPolarHBondContact O-CB 3.46Å; Q392-K395 PolarHBondContact O-N 3.46Å; Q392-K396 PolarHBondContact O-N 3.31Å
393L79.5Confident82Confident106 Ų106107.2 Ų107.256%0.55553%0.527SS*.Hα-helixtrans-65.7-43.7179.4-175.867.1000112.1I389 R390 K395 K396 V397I389-L393 PolarHBondContact O-N 3.1Å; R390-L393 PolarHBondContact O-N 2.85Å; L393-K395 PolarHBondContact O-N 3.28Å; L393-K396 PolarHBondContact O-N 3.47Å; L393-V397 HydrophobicContact CD1-CG2 4.44Å; L393-V397 HydrophobicContact CG-CG2 4.33Å; L393-V397 WeakPolarHBondContact O-CG2 3.29Å; L393-V397 PolarHBondContact O-N 3.33Å
394E81Confident81.7Confident140 Ų140107.8 Ų107.865%0.65453%0.53SS*.Hα-helixtrans-55.7-40.1174.6-87.4-179.5155.300111.7R390 K396 V397 L398R390-E394 PolarHBondContact O-N 3.38Å; E394-K396 VanDerWaalsContact C-N 3.33Å; E394-K396 PolarHBondContact O-N 3.03Å; E394-V397 PolarHBondContact O-N 3.37Å; E394-L398 PolarHBondContact O-N 2.95Å
395K82.7Confident81.2Confident151 Ų151111.9 Ų111.966%0.65754%0.537SS*.Hα-helixtrans-62.9-39.2176.1-145.1179-175.6-176.30112Q392 L393Q392-K395 WeakPolarHBondContact O-CB 3.46Å; Q392-K395 PolarHBondContact O-N 3.46Å; L393-K395 PolarHBondContact O-N 3.28Å
396K81.9Confident80.7Confident126 Ų126114 Ų11455%0.54854%0.541SS..Hα-helixtrans-75.6-33.3178.8-71.3-60.9179.7-169.80114.5Q392 L393 E394 L398 E399 K400Q392-K396 PolarHBondContact O-N 3.31Å; L393-K396 PolarHBondContact O-N 3.47Å; E394-K396 VanDerWaalsContact C-N 3.33Å; E394-K396 PolarHBondContact O-N 3.03Å; K396-L398 VanDerWaalsContact C-N 3.32Å; K396-E399 VanDerWaalsContact CD-OE2 3.27Å; K396-E399 WeakPolarHBondContact CD-OE2 3.21Å; K396-E399 IonicContact NZ-OE1 3.76Å; K396-E399 IonicContact NZ-OE2 2.73Å; K396-E399 PolarHBondContact NZ-OE2 3.04Å; K396-E399 PolarHBondContact O-N 2.95Å; K396-K400 PolarHBondContact O-N 3.16Å
397V81.2Confident80Confident63 Ų63116.2 Ų116.238%0.38255%0.55SS..Hα-helixtrans-65.2-38.8176.7170.80000111.1L393 E394 K400 Q401L393-V397 HydrophobicContact CD1-CG2 4.44Å; L393-V397 HydrophobicContact CG-CG2 4.33Å; L393-V397 WeakPolarHBondContact O-CG2 3.29Å; L393-V397 PolarHBondContact O-N 3.33Å; E394-V397 PolarHBondContact O-N 3.37Å; V397-K400 PolarHBondContact O-N 3.2Å; V397-Q401 PolarHBondContact O-N 3.18Å; V397-Q401 VanDerWaalsContact O-N 3.14Å
398L78.9Confident79.5Confident116 Ų116115.3 Ų115.361%0.60755%0.55SS*.Hα-helixtrans-62.2-42.8174.9-72.8167.6000111.9E394 K396 K400 Q401E394-L398 PolarHBondContact O-N 2.95Å; K396-L398 VanDerWaalsContact C-N 3.32Å; L398-K400 VanDerWaalsContact C-N 3.34Å; L398-K400 PolarHBondContact O-N 3.34Å; L398-Q401 PolarHBondContact O-N 3.3Å
399E83.2Confident78.4Confident97 Ų97117.9 Ų117.945%0.45356%0.559SS.*Hα-helixtrans-62.3-38.9175.3-69.3173-17100112.5K396K396-E399 VanDerWaalsContact CD-OE2 3.27Å; K396-E399 WeakPolarHBondContact CD-OE2 3.21Å; K396-E399 IonicContact NZ-OE1 3.76Å; K396-E399 IonicContact NZ-OE2 2.73Å; K396-E399 PolarHBondContact NZ-OE2 3.04Å; K396-E399 PolarHBondContact O-N 2.95Å
400K78.8Confident77.5Confident110 Ų110120.4 Ų120.448%0.47857%0.568SS.*Hα-helixtrans-65.3-44.4179.8-173.7-150.8148.9-168.80112.3K396 V397 L398 D402 L403 E404K396-K400 PolarHBondContact O-N 3.16Å; V397-K400 PolarHBondContact O-N 3.2Å; L398-K400 VanDerWaalsContact C-N 3.34Å; L398-K400 PolarHBondContact O-N 3.34Å; K400-D402 PolarHBondContact O-N 2.95Å; K400-L403 PolarHBondContact O-N 3.46Å; K400-L403 VanDerWaalsContact O-N 3.1Å; K400-E404 WeakPolarHBondContact CE-OE1 3.31Å; K400-E404 VanDerWaalsContact CE-OE2 3.22Å; K400-E404 WeakPolarHBondContact CE-OE2 3.45Å; K400-E404 IonicContact NZ-OE1 2.8Å; K400-E404 PolarHBondContact NZ-OE1 2.86Å; K400-E404 IonicContact NZ-OE2 3.27Å; K400-E404 PolarHBondContact NZ-OE2 2.92Å; K400-E404 PolarHBondContact O-N 2.99Å
401Q80Confident76.5Confident101 Ų101118.2 Ų118.247%0.47257%0.568SS.*Hα-helixtrans-62.8-29.2-176.5-74.8179.6-7.500113V397 L398V397-Q401 PolarHBondContact O-N 3.18Å; V397-Q401 VanDerWaalsContact O-N 3.14Å; L398-Q401 PolarHBondContact O-N 3.3Å
402D77Confident75.3Confident106 Ų106120.3 Ų120.357%0.56757%0.572SS**Hα-helixtrans-74.5-26.9175.8-80.9-17.8000113.4K400K400-D402 PolarHBondContact O-N 2.95Å
403L74.6Confident73.7Confident107 Ų107121 Ų12156%0.5658%0.58SS**Hα-helixtrans-78.5-41.4176.4-75.7171.1000112.3K400 K405 K406K400-L403 PolarHBondContact O-N 3.46Å; K400-L403 VanDerWaalsContact O-N 3.1Å; L403-K405 VanDerWaalsContact C-N 3.27Å; L403-K405 PolarHBondContact O-N 2.89Å; L403-K406 PolarHBondContact O-N 3.32Å; L403-K406 VanDerWaalsContact O-N 3.14Å
404E78.8Confident72.2Confident101 Ų101126.9 Ų126.947%0.47259%0.594SS.*Hα-helixtrans-61-36-178.5-76.7-177.2152.100112.3K400 K406 I407 S408K400-E404 WeakPolarHBondContact CE-OE1 3.31Å; K400-E404 VanDerWaalsContact CE-OE2 3.22Å; K400-E404 WeakPolarHBondContact CE-OE2 3.45Å; K400-E404 IonicContact NZ-OE1 2.8Å; K400-E404 PolarHBondContact NZ-OE1 2.86Å; K400-E404 IonicContact NZ-OE2 3.27Å; K400-E404 PolarHBondContact NZ-OE2 2.92Å; K400-E404 PolarHBondContact O-N 2.99Å; E404-K406 VanDerWaalsContact C-N 3.27Å; E404-K406 PolarHBondContact O-N 3.33Å; E404-I407 PolarHBondContact O-N 2.81Å; E404-S408 PolarHBondContact O-N 3.21Å; E404-S408 PolarHBondContact O-OG 3.48Å; E404-S408 VanDerWaalsContact O-OG 3.12Å
405K75.3Confident70.8Confident143 Ų143127.4 Ų127.462%0.62260%0.601SS**Hα-helixtrans-59.3-35.6176.8-75.3176.8-179.4170.30113.1L403 S408L403-K405 VanDerWaalsContact C-N 3.27Å; L403-K405 PolarHBondContact O-N 2.89Å; K405-S408 PolarHBondContact O-OG 3.46Å
406K74.9Confident68.9Low145 Ų145126.6 Ų126.663%0.6361%0.609SS**Hα-helixtrans-72.8-35.2-178.6-65.1178.4-179.1176.70112.8L403 E404L403-K406 PolarHBondContact O-N 3.32Å; L403-K406 VanDerWaalsContact O-N 3.14Å; E404-K406 VanDerWaalsContact C-N 3.27Å; E404-K406 PolarHBondContact O-N 3.33Å
407I69.4Low67Low105 Ų105124.7 Ų124.754%0.53862%0.616SS.*Hα-helixtrans-72.9-35-176.9-63.4171.5000111.2E404 E409 E410 L411E404-I407 PolarHBondContact O-N 2.81Å; I407-E409 PolarHBondContact O-N 2.76Å; I407-E410 PolarHBondContact O-N 3.35Å; I407-L411 HydrophobicContact CG2-CD1 3.99Å
408S72.9Confident65.3Low62 Ų62130.3 Ų130.343%0.43464%0.639SS.*Hα-helixtrans-66.8-20.4179.534.80000114.9E404 K405E404-S408 PolarHBondContact O-N 3.21Å; E404-S408 PolarHBondContact O-OG 3.48Å; E404-S408 VanDerWaalsContact O-OG 3.12Å; K405-S408 PolarHBondContact O-OG 3.46Å
409E65.8Low63.5Low147 Ų147133.6 Ų133.669%0.68765%0.648SS**Hα-helixtrans-78.9-42.6177.2-74.1174.5161.500111.6I407 L411I407-E409 PolarHBondContact O-N 2.76Å; E409-L411 PolarHBondContact O-N 2.96Å
410E62Low62.1Low160 Ų160133.1 Ų133.175%0.74866%0.661SS**Hα-helixtrans-71.1-30.8-177.5-75-157.2159.300114.7I407 R412I407-E410 PolarHBondContact O-N 3.35Å; E410-R412 PolarHBondContact O-N 3.27Å
411L61.8Low61.1Low116 Ų116131 Ų13161%0.60766%0.664SS**THydrogen-bonded Turntrans-78.1-19.2-172.8-82.2167.6000114.3I407 E409I407-L411 HydrophobicContact CG2-CD1 3.99Å; E409-L411 PolarHBondContact O-N 2.96Å
412R57.4Low60.4Low202 Ų202130.5 Ų130.576%0.76266%0.664SS**THydrogen-bonded Turntrans-78.1-28.7179.4-88.4179.4173.6134.7-2.1113.3E410 R414E410-R412 PolarHBondContact O-N 3.27Å; R412-R414 VanDerWaalsContact C-N 3.34Å; R412-R414 PolarHBondContact O-N 3.38Å
413D49.9Very low59.5Low138 Ų138134.3 Ų134.374%0.73867%0.672SS**THydrogen-bonded Turntrans-74.2-20.8-175.4-72.2-17.3000114.1
414R48.8Very low59Low229 Ų229134.4 Ų134.486%0.86468%0.677SS**THydrogen-bonded Turntrans-93.4-8.7-174.4-93.2-179.9132.1150.6-2.4116R412R412-R414 VanDerWaalsContact C-N 3.34Å; R412-R414 PolarHBondContact O-N 3.38Å
415L51.3Low58.6Low150 Ų150133.7 Ų133.779%0.78568%0.676SS**THydrogen-bonded Turntrans-94.4-1.1-167.1-121.1141.6000115.1
416T43Very low58.6Low135 Ų135134.3 Ų134.383%0.82868%0.679SS**THydrogen-bonded Turntrans-96.55.2-176.130.10000116.4
417A43Very low58.4Low86 Ų86132.8 Ų132.871%0.71168%0.676SS**SBendtrans-127.1129.5177.100000113.6
418Q43.8Very low58.7Low181 Ų181131.8 Ų131.885%0.84667%0.672SS**  trans104.473.2152.4-137163.111.300118.7A420Q418-A420 PolarHBondContact O-N 3.03Å
419K41.9Very low58.8Low184 Ų184132.7 Ų132.780%0.867%0.671SS**G310 helixtrans-74.115.2176.9-101.5176.7176.5174.90117.6
420A53.1Low59.5Low88 Ų88131 Ų13173%0.72767%0.667SS**G310 helixtrans-84.6-13.8176.200000114.1Q418 N422Q418-A420 PolarHBondContact O-N 3.03Å; A420-N422 PolarHBondContact O-N 2.93Å; A420-N422 VanDerWaalsContact O-N 3.11Å
421A58.9Low60.2Low65 Ų65128.4 Ų128.454%0.53766%0.657SS.*G310 helixtrans-64-11.8174.900000114.3Y423A421-Y423 PolarHBondContact O-N 2.95Å
422N64.6Low61Low91 Ų91127.5 Ų127.549%0.48765%0.65SS.*Hα-helixtrans-81.6-13.1-167.8-71-13.4000115.2A420A420-N422 PolarHBondContact O-N 2.93Å; A420-N422 VanDerWaalsContact O-N 3.11Å
423Y59.1Low62.2Low186 Ų186121.1 Ų121.173%0.72963%0.631SS**Hα-helixtrans-82.9-38176.4-159.6-95.6000112.5A421 N425 K426A421-Y423 PolarHBondContact O-N 2.95Å; Y423-N425 VanDerWaalsContact C-N 3.32Å; Y423-N425 PolarHBondContact O-N 3.33Å; Y423-K426 PolarHBondContact O-N 3.26Å
424V64.1Low63.7Low109 Ų109120.7 Ų120.766%0.66162%0.624SS**Hα-helixtrans-66.1-35.4175.9177.20000111.3K426 I427 N428V424-K426 VanDerWaalsContact C-N 3.3Å; V424-K426 PolarHBondContact O-N 3.34Å; V424-I427 PolarHBondContact O-N 2.89Å; V424-N428 PolarHBondContact O-N 3.5Å
425N70.3Confident65.1Low85 Ų85112.8 Ų112.846%0.45560%0.604SS.*Hα-helixtrans-61.4-33.9175.7-92.5-12.2000113.5Y423 I427 N428 I429Y423-N425 VanDerWaalsContact C-N 3.32Å; Y423-N425 PolarHBondContact O-N 3.33Å; N425-I427 PolarHBondContact O-N 3.33Å; N425-N428 PolarHBondContact O-N 2.91Å; N425-I429 WeakPolarHBondContact O-CD1 3.38Å; N425-I429 VanDerWaalsContact O-CG1 3.23Å; N425-I429 WeakPolarHBondContact O-CG1 3.44Å; N425-I429 PolarHBondContact O-N 2.93Å
426K75.5Confident66.5Low157 Ų157113 Ų11368%0.68359%0.594SS**Hα-helixtrans-65.2-38.5-177.2-107.2-175.4176.1-1760113.2Y423 V424Y423-K426 PolarHBondContact O-N 3.26Å; V424-K426 VanDerWaalsContact C-N 3.3Å; V424-K426 PolarHBondContact O-N 3.34Å
427I70.5Confident68.3Low113 Ų113112.7 Ų112.758%0.57958%0.584SS**Hα-helixtrans-71-38.5176.6-62.2177.1000110.2V424 N425 I429 N430V424-I427 PolarHBondContact O-N 2.89Å; N425-I427 PolarHBondContact O-N 3.33Å; I427-I429 VanDerWaalsContact C-N 3.34Å; I427-I429 PolarHBondContact O-N 2.93Å; I427-N430 PolarHBondContact O-N 3.36Å
428N74.3Confident70.2Confident83 Ų83113.8 Ų113.844%0.44458%0.577SS.*Hα-helixtrans-65.8-35.6-179.9-131.3-8000112.6V424 N425 N430 I431 Q432V424-N428 PolarHBondContact O-N 3.5Å; N425-N428 PolarHBondContact O-N 2.91Å; N428-N430 PolarHBondContact O-N 3.47Å; N428-I431 PolarHBondContact O-N 3.49Å; N428-Q432 WeakPolarHBondContact O-CG 3.26Å; N428-Q432 PolarHBondContact O-N 3.15Å; N428-Q432 VanDerWaalsContact O-N 3.07Å
429I76.2Confident71.8Confident82 Ų82109.7 Ų109.742%0.42156%0.561SS.*Hα-helixtrans-61.8-42.6176.2-70.2162000111.1N425 I427 I431 Q432 D433N425-I429 WeakPolarHBondContact O-CD1 3.38Å; N425-I429 VanDerWaalsContact O-CG1 3.23Å; N425-I429 WeakPolarHBondContact O-CG1 3.44Å; N425-I429 PolarHBondContact O-N 2.93Å; I427-I429 VanDerWaalsContact C-N 3.34Å; I427-I429 PolarHBondContact O-N 2.93Å; I429-I431 VanDerWaalsContact C-N 3.34Å; I429-I431 PolarHBondContact O-N 2.89Å; I429-Q432 WeakPolarHBondContact O-CB 3.49Å; I429-Q432 PolarHBondContact O-N 3.32Å; I429-Q432 VanDerWaalsContact O-N 3.13Å; I429-D433 WeakPolarHBondContact CG2-OD2 3.43Å; I429-D433 PolarHBondContact O-N 2.94Å
430N79.5Confident73.8Confident110 Ų110104.5 Ų104.559%0.58854%0.544SS*.Hα-helixtrans-67.2-35.1-175.6-14730000112.6I427 N428 Q434I427-N430 PolarHBondContact O-N 3.36Å; N428-N430 PolarHBondContact O-N 3.47Å; N430-Q434 PolarHBondContact O-N 3.24Å
431I76.5Confident75.2Confident106 Ų106105.3 Ų105.354%0.54453%0.533SS..Hα-helixtrans-70.7-38.7173-66175.6000110.8N428 I429 D433 S435N428-I431 PolarHBondContact O-N 3.49Å; I429-I431 VanDerWaalsContact C-N 3.34Å; I429-I431 PolarHBondContact O-N 2.89Å; I431-D433 VanDerWaalsContact C-N 3.33Å; I431-D433 PolarHBondContact O-N 2.95Å; I431-S435 PolarHBondContact O-N 2.89Å
432Q79.2Confident76.3Confident98 Ų98106.3 Ų106.346%0.45853%0.529SS..Hα-helixtrans-63.8-37.9176.1-78-178.6-1200112.5N428 I429 S435 R436N428-Q432 WeakPolarHBondContact O-CG 3.26Å; N428-Q432 PolarHBondContact O-N 3.15Å; N428-Q432 VanDerWaalsContact O-N 3.07Å; I429-Q432 WeakPolarHBondContact O-CB 3.49Å; I429-Q432 PolarHBondContact O-N 3.32Å; I429-Q432 VanDerWaalsContact O-N 3.13Å; Q432-S435 PolarHBondContact O-N 3Å; Q432-R436 WeakPolarHBondContact O-CB 3.04Å; Q432-R436 WeakPolarHBondContact O-CG 3.25Å; Q432-R436 PolarHBondContact O-N 2.96Å
433D83.1Confident77.1Confident68 Ų68105.4 Ų105.436%0.36453%0.526SS..Hα-helixtrans-68.7-42179.8-70.4-23.7000111.4I429 I431 S435 R436 E437I429-D433 WeakPolarHBondContact CG2-OD2 3.43Å; I429-D433 PolarHBondContact O-N 2.94Å; I431-D433 VanDerWaalsContact C-N 3.33Å; I431-D433 PolarHBondContact O-N 2.95Å; D433-S435 VanDerWaalsContact C-N 3.32Å; D433-S435 PolarHBondContact O-N 3.03Å; D433-R436 PolarHBondContact O-N 3.21Å; D433-R436 VanDerWaalsContact O-N 3.17Å; D433-R436 IonicContact OD1-NH1 3.34Å; D433-E437 PolarHBondContact O-N 3.4Å
434Q81Confident78.4Confident128 Ų128102.3 Ų102.360%0.59852%0.518SS*.Hα-helixtrans-61.2-39.9171.6-71.4-176.7-18.700112.3N430 R436 E437 L438N430-Q434 PolarHBondContact O-N 3.24Å; Q434-R436 VanDerWaalsContact C-N 3.34Å; Q434-R436 PolarHBondContact O-N 3.27Å; Q434-E437 PolarHBondContact O-N 3.45Å; Q434-L438 PolarHBondContact O-N 3.49Å
435S78.1Confident79.1Confident63 Ų63102.6 Ų102.644%0.44151%0.514SS..Hα-helixtrans-64.7-37.1175-178.60000112.5I431 Q432 D433 L439I431-S435 PolarHBondContact O-N 2.89Å; Q432-S435 PolarHBondContact O-N 3Å; D433-S435 VanDerWaalsContact C-N 3.32Å; D433-S435 PolarHBondContact O-N 3.03Å; S435-L439 WeakPolarHBondContact O-CB 3.37Å; S435-L439 WeakPolarHBondContact O-CG 3.39Å; S435-L439 PolarHBondContact O-N 3.47Å
436R80Confident79.6Confident154 Ų154104.1 Ų104.158%0.58152%0.518SS*.Hα-helixtrans-68.7-38.7177.2-78.9171.7173.4174-2.5112Q432 D433 Q434 L439 T440Q432-R436 WeakPolarHBondContact O-CB 3.04Å; Q432-R436 WeakPolarHBondContact O-CG 3.25Å; Q432-R436 PolarHBondContact O-N 2.96Å; D433-R436 PolarHBondContact O-N 3.21Å; D433-R436 VanDerWaalsContact O-N 3.17Å; D433-R436 IonicContact OD1-NH1 3.34Å; Q434-R436 VanDerWaalsContact C-N 3.34Å; Q434-R436 PolarHBondContact O-N 3.27Å; R436-L439 PolarHBondContact O-N 3.32Å; R436-T440 WeakPolarHBondContact O-CB 3.46Å; R436-T440 PolarHBondContact O-N 3.14Å; R436-T440 PolarHBondContact O-OG1 3.08Å
437E81.5Confident80Confident130 Ų130101.6 Ų101.661%0.60751%0.512SS*.Hα-helixtrans-66.7-42.2179.6-160.6153.9-156.500111.2D433 Q434 T440 Q441D433-E437 PolarHBondContact O-N 3.4Å; Q434-E437 PolarHBondContact O-N 3.45Å; E437-T440 PolarHBondContact O-N 3.05Å; E437-Q441 WeakPolarHBondContact O-CG 3.24Å; E437-Q441 PolarHBondContact O-N 3.3Å
438L82.2Confident80.7Confident109 Ų109102.1 Ų102.157%0.57151%0.512SS*.Hα-helixtrans-63.6-42.3171.7-72.6172.7000112.7Q434 T440 Q441 I442Q434-L438 PolarHBondContact O-N 3.49Å; L438-T440 VanDerWaalsContact C-N 3.28Å; L438-T440 PolarHBondContact O-N 3Å; L438-Q441 PolarHBondContact O-N 3.49Å; L438-I442 WeakPolarHBondContact O-CG1 3.25Å; L438-I442 PolarHBondContact O-N 3.3Å
439L78.9Confident81.2Confident95 Ų95102.5 Ų102.550%0.49751%0.513SS..Hα-helixtrans-61.1-38.2174-83.7163.3000112.1S435 R436 I442 V443S435-L439 WeakPolarHBondContact O-CB 3.37Å; S435-L439 WeakPolarHBondContact O-CG 3.39Å; S435-L439 PolarHBondContact O-N 3.47Å; R436-L439 PolarHBondContact O-N 3.32Å; L439-I442 PolarHBondContact O-N 3.01Å; L439-V443 WeakPolarHBondContact O-CG2 3.28Å; L439-V443 PolarHBondContact O-N 2.82Å
440T82.8Confident81.5Confident75 Ų75100.8 Ų100.846%0.4651%0.511SS..Hα-helixtrans-66.7-39.6178.3-51.90000110.9R436 E437 L438 V443 Q444R436-T440 WeakPolarHBondContact O-CB 3.46Å; R436-T440 PolarHBondContact O-N 3.14Å; R436-T440 PolarHBondContact O-OG1 3.08Å; E437-T440 PolarHBondContact O-N 3.05Å; L438-T440 VanDerWaalsContact C-N 3.28Å; L438-T440 PolarHBondContact O-N 3Å; T440-V443 PolarHBondContact O-N 3.49Å; T440-Q444 WeakPolarHBondContact O-CG 3.27Å; T440-Q444 PolarHBondContact O-N 2.89Å
441Q83.7Confident81.8Confident104 Ų104103.4 Ų103.449%0.48652%0.518SS..Hα-helixtrans-64.9-39.1173.7-69.7174.81900112.1E437 L438 Q444 M445E437-Q441 WeakPolarHBondContact O-CG 3.24Å; E437-Q441 PolarHBondContact O-N 3.3Å; L438-Q441 PolarHBondContact O-N 3.49Å; Q441-Q444 PolarHBondContact O-N 2.72Å; Q441-M445 WeakPolarHBondContact O-CG 3.31Å; Q441-M445 PolarHBondContact O-N 3.48Å
442I81.6Confident82.3Confident87 Ų87103.9 Ų103.945%0.44652%0.521SS..Hα-helixtrans-61.2-48.6174.1-69167.3000110.5L438 L439 Q444 M445 E446L438-I442 WeakPolarHBondContact O-CG1 3.25Å; L438-I442 PolarHBondContact O-N 3.3Å; L439-I442 PolarHBondContact O-N 3.01Å; I442-Q444 VanDerWaalsContact C-N 3.28Å; I442-Q444 PolarHBondContact O-N 3.48Å; I442-M445 PolarHBondContact O-N 3.04Å; I442-E446 HydrophobicContact CG2-CG 4.33Å; I442-E446 WeakPolarHBondContact O-CG 3.41Å; I442-E446 PolarHBondContact O-N 3.2Å
443V81.4Confident82.7Confident72 Ų72105.4 Ų105.444%0.43653%0.528SS..Hα-helixtrans-63.4-34.1178.7172.10000111.9L439 T440 N447L439-V443 WeakPolarHBondContact O-CG2 3.28Å; L439-V443 PolarHBondContact O-N 2.82Å; T440-V443 PolarHBondContact O-N 3.49Å; V443-N447 WeakPolarHBondContact O-CB 3.29Å; V443-N447 PolarHBondContact O-N 3.4Å; V443-N447 PolarHBondContact O-ND2 2.85Å
444Q85.3Confident82.8Confident120 Ų120108.1 Ų108.156%0.56154%0.542SS*.Hα-helixtrans-65.7-46.7173.8-75.8174.8-2.100111.4T440 Q441 I442 N447 E448T440-Q444 WeakPolarHBondContact O-CG 3.27Å; T440-Q444 PolarHBondContact O-N 2.89Å; Q441-Q444 PolarHBondContact O-N 2.72Å; I442-Q444 VanDerWaalsContact C-N 3.28Å; I442-Q444 PolarHBondContact O-N 3.48Å; Q444-N447 PolarHBondContact O-N 3.46Å; Q444-E448 PolarHBondContact O-N 2.84Å
445M79.7Confident83.1Confident116 Ų116103.7 Ų103.757%0.57153%0.53SS*.Hα-helixtrans-62.3-41.9175.9-72.3-77.9-68.700112.2Q441 I442 N447 E448 I449Q441-M445 WeakPolarHBondContact O-CG 3.31Å; Q441-M445 PolarHBondContact O-N 3.48Å; I442-M445 PolarHBondContact O-N 3.04Å; M445-N447 VanDerWaalsContact C-N 3.34Å; M445-N447 PolarHBondContact O-N 3.24Å; M445-E448 PolarHBondContact O-N 3.24Å; M445-I449 VanDerWaalsContact O-CG1 3.25Å; M445-I449 WeakPolarHBondContact O-CG1 3.25Å; M445-I449 PolarHBondContact O-N 3.04Å
446E81.2Confident83.5Confident116 Ų116104.5 Ų104.554%0.54253%0.532SS..Hα-helixtrans-63.6-38.9175.7-75178.616500112.1I442 I449 A450I442-E446 HydrophobicContact CG2-CG 4.33Å; I442-E446 WeakPolarHBondContact O-CG 3.41Å; I442-E446 PolarHBondContact O-N 3.2Å; E446-I449 PolarHBondContact O-N 3.16Å; E446-A450 WeakPolarHBondContact O-CB 3.21Å; E446-A450 PolarHBondContact O-N 3.4Å
447N84.3Confident83.8Confident104 Ų10499.8 Ų99.856%0.55653%0.527SS*.Hα-helixtrans-67.9-37.8174.7-83-58.9000112.4V443 Q444 M445 A450 K451V443-N447 WeakPolarHBondContact O-CB 3.29Å; V443-N447 PolarHBondContact O-N 3.4Å; V443-N447 PolarHBondContact O-ND2 2.85Å; Q444-N447 PolarHBondContact O-N 3.46Å; M445-N447 VanDerWaalsContact C-N 3.34Å; M445-N447 PolarHBondContact O-N 3.24Å; N447-A450 PolarHBondContact O-N 2.95Å; N447-K451 VanDerWaalsContact O-CB 3.3Å; N447-K451 WeakPolarHBondContact O-CB 3.48Å; N447-K451 PolarHBondContact O-N 3.35Å
448E84.6Confident84Confident125 Ų125100.4 Ų100.458%0.58453%0.529SS*.Hα-helixtrans-64.5-44.6173.4-73.5-168.4164.600111.3Q444 M445 A450 K451 D452Q444-E448 PolarHBondContact O-N 2.84Å; M445-E448 PolarHBondContact O-N 3.24Å; E448-A450 PolarHBondContact O-N 3.43Å; E448-K451 WeakPolarHBondContact O-CB 3.49Å; E448-K451 PolarHBondContact O-N 3.46Å; E448-D452 PolarHBondContact O-N 2.91Å
449I83.4Confident84.3Confident91 Ų91101.9 Ų101.947%0.46753%0.531SS..Hα-helixtrans-58.7-48.4174.2-68.4165.4000110.8M445 E446 K451 D452 E453M445-I449 VanDerWaalsContact O-CG1 3.25Å; M445-I449 WeakPolarHBondContact O-CG1 3.25Å; M445-I449 PolarHBondContact O-N 3.04Å; E446-I449 PolarHBondContact O-N 3.16Å; I449-K451 VanDerWaalsContact C-N 3.27Å; I449-K451 PolarHBondContact O-N 3.09Å; I449-D452 PolarHBondContact O-N 3.34Å; I449-E453 HydrophobicContact CG2-CG 4.36Å; I449-E453 WeakPolarHBondContact O-CB 3.32Å; I449-E453 WeakPolarHBondContact O-CG 3.33Å; I449-E453 PolarHBondContact O-N 3.23Å
450A83.7Confident84.8Confident46 Ų46104.4 Ų104.438%0.3854%0.538SS..Hα-helixtrans-61.7-36.3178.500000112E446 N447 E448 L454E446-A450 WeakPolarHBondContact O-CB 3.21Å; E446-A450 PolarHBondContact O-N 3.4Å; N447-A450 PolarHBondContact O-N 2.95Å; E448-A450 PolarHBondContact O-N 3.43Å; A450-L454 WeakPolarHBondContact O-CB 3.34Å; A450-L454 PolarHBondContact O-N 2.95Å
451K86.6Confident85.1Confident165 Ų165103.5 Ų103.572%0.71754%0.538SS*.Hα-helixtrans-69.1-39.6177.4-155.5177.1-172.5-178.90111.5N447 E448 I449 L454 G455N447-K451 VanDerWaalsContact O-CB 3.3Å; N447-K451 WeakPolarHBondContact O-CB 3.48Å; N447-K451 PolarHBondContact O-N 3.35Å; E448-K451 WeakPolarHBondContact O-CB 3.49Å; E448-K451 PolarHBondContact O-N 3.46Å; I449-K451 VanDerWaalsContact C-N 3.27Å; I449-K451 PolarHBondContact O-N 3.09Å; K451-L454 PolarHBondContact O-N 3.34Å; K451-G455 PolarHBondContact O-N 3.2Å
452D86.6Confident85.4Confident116 Ų116103.9 Ų103.962%0.6254%0.538SS*.Hα-helixtrans-69.6-39.6174.7-76.8-15.2000112E448 I449 L454 G455 V456E448-D452 PolarHBondContact O-N 2.91Å; I449-D452 PolarHBondContact O-N 3.34Å; D452-L454 PolarHBondContact O-N 2.84Å; D452-G455 CarbonylContact O-C 3.47Å; D452-G455 WeakPolarHBondContact O-CA 3.36Å; D452-G455 PolarHBondContact O-N 2.97Å; D452-G455 VanDerWaalsContact O-N 3.15Å; D452-V456 WeakPolarHBondContact O-CG2 3.45Å; D452-V456 PolarHBondContact O-N 3.05Å
453E86.9Confident85.7Confident130 Ų130104.9 Ų104.961%0.60754%0.544SS*.Hα-helixtrans-61.1-43173-76.6-175.516700111.9I449 G455 V456 A457I449-E453 HydrophobicContact CG2-CG 4.36Å; I449-E453 WeakPolarHBondContact O-CB 3.32Å; I449-E453 WeakPolarHBondContact O-CG 3.33Å; I449-E453 PolarHBondContact O-N 3.23Å; E453-G455 VanDerWaalsContact C-N 3.32Å; E453-G455 PolarHBondContact O-N 2.86Å; E453-V456 PolarHBondContact O-N 3.35Å; E453-A457 WeakPolarHBondContact O-CB 3.3Å; E453-A457 PolarHBondContact O-N 3.38Å
454L84.7Confident86.2Confident125 Ų125107.8 Ų107.865%0.65455%0.551SS**Hα-helixtrans-63.4-40173.7-132.2162.3000110.8A450 K451 D452 A457 H458A450-L454 WeakPolarHBondContact O-CB 3.34Å; A450-L454 PolarHBondContact O-N 2.95Å; K451-L454 PolarHBondContact O-N 3.34Å; D452-L454 PolarHBondContact O-N 2.84Å; L454-A457 PolarHBondContact O-N 2.82Å; L454-H458 WeakPolarHBondContact O-CB 2.98Å; L454-H458 PolarHBondContact O-N 3.09Å
455G88.7Confident86.3Confident34 Ų34108.7 Ų108.735%0.35156%0.555SS.*Hα-helixtrans-59.9-47.6172.800000112.8K451 D452 E453 H458 K459K451-G455 PolarHBondContact O-N 3.2Å; D452-G455 CarbonylContact O-C 3.47Å; D452-G455 WeakPolarHBondContact O-CA 3.36Å; D452-G455 PolarHBondContact O-N 2.97Å; D452-G455 VanDerWaalsContact O-N 3.15Å; E453-G455 VanDerWaalsContact C-N 3.32Å; E453-G455 PolarHBondContact O-N 2.86Å; G455-H458 PolarHBondContact O-N 3.44Å; G455-K459 VanDerWaalsContact O-CG 3.32Å; G455-K459 WeakPolarHBondContact O-CG 3.38Å; G455-K459 PolarHBondContact O-N 3.19Å
456V84.9Confident86.7Confident80 Ų80108.1 Ų108.149%0.48555%0.551SS.*Hα-helixtrans-63.5-43.9176.6170.60000110.9D452 E453 H458 K459 K460D452-V456 WeakPolarHBondContact O-CG2 3.45Å; D452-V456 PolarHBondContact O-N 3.05Å; E453-V456 PolarHBondContact O-N 3.35Å; V456-H458 VanDerWaalsContact C-N 3.34Å; V456-H458 PolarHBondContact O-N 3.31Å; V456-K459 PolarHBondContact O-N 2.94Å; V456-K460 HydrophobicContact CG1-CD 4.22Å; V456-K460 HydrophobicContact CG1-CG 4.46Å; V456-K460 WeakPolarHBondContact O-CB 3.37Å; V456-K460 WeakPolarHBondContact O-CG 3.49Å; V456-K460 PolarHBondContact O-N 2.83Å
457A86.7Confident87.1Confident56 Ų56109.5 Ų109.546%0.46356%0.558SS.*Hα-helixtrans-61.5-43.2176.500000111.4E453 L454 K460 A461E453-A457 WeakPolarHBondContact O-CB 3.3Å; E453-A457 PolarHBondContact O-N 3.38Å; L454-A457 PolarHBondContact O-N 2.82Å; A457-K460 PolarHBondContact O-N 2.87Å; A457-A461 WeakPolarHBondContact O-CB 3.33Å; A457-A461 PolarHBondContact O-N 3.47Å
458H86.9Confident87.3Confident142 Ų142109 Ų10966%0.65755%0.552SS**Hα-helixtrans-66.2-40.3178.2-159.243.9000112L454 G455 V456 A461 K462L454-H458 WeakPolarHBondContact O-CB 2.98Å; L454-H458 PolarHBondContact O-N 3.09Å; G455-H458 PolarHBondContact O-N 3.44Å; V456-H458 VanDerWaalsContact C-N 3.34Å; V456-H458 PolarHBondContact O-N 3.31Å; H458-A461 PolarHBondContact O-N 3.45Å; H458-K462 WeakPolarHBondContact O-CB 3.31Å; H458-K462 PolarHBondContact O-N 3.28Å
459K88.3Confident87.4Confident141 Ų141109 Ų10961%0.61355%0.55SS**Hα-helixtrans-67.1-39.3173.9-67.5-63.9-178.1-179.10112.5G455 V456 K462 N463G455-K459 VanDerWaalsContact O-CG 3.32Å; G455-K459 WeakPolarHBondContact O-CG 3.38Å; G455-K459 PolarHBondContact O-N 3.19Å; V456-K459 PolarHBondContact O-N 2.94Å; K459-K462 PolarHBondContact O-N 3.3Å; K459-N463 PolarHBondContact O-N 2.95Å
460K89.6Confident87.7Confident148 Ų148108.2 Ų108.264%0.64355%0.549SS*.Hα-helixtrans-63-44.4173.7-80.2-177.9178.51780111.9V456 A457 K462 N463 K464V456-K460 HydrophobicContact CG1-CD 4.22Å; V456-K460 HydrophobicContact CG1-CG 4.46Å; V456-K460 WeakPolarHBondContact O-CB 3.37Å; V456-K460 WeakPolarHBondContact O-CG 3.49Å; V456-K460 PolarHBondContact O-N 2.83Å; A457-K460 PolarHBondContact O-N 2.87Å; K460-K462 VanDerWaalsContact C-N 3.34Å; K460-K462 PolarHBondContact O-N 3.27Å; K460-N463 PolarHBondContact O-N 2.99Å; K460-K464 PolarHBondContact O-N 3.4Å
461A88Confident88Confident55 Ų55108.6 Ų108.646%0.45555%0.549SS..Hα-helixtrans-61.4-42.817600000111.7A457 H458 K464 Q465A457-A461 WeakPolarHBondContact O-CB 3.33Å; A457-A461 PolarHBondContact O-N 3.47Å; H458-A461 PolarHBondContact O-N 3.45Å; A461-K464 PolarHBondContact O-N 3.16Å; A461-Q465 PolarHBondContact O-N 3.48Å
462K89.6Confident88Confident112 Ų112105.9 Ų105.949%0.48754%0.539SS..Hα-helixtrans-64.2-43176.3-169.1177-179.9174.90112.6H458 K459 K460 K464 Q465 Q466H458-K462 WeakPolarHBondContact O-CB 3.31Å; H458-K462 PolarHBondContact O-N 3.28Å; K459-K462 PolarHBondContact O-N 3.3Å; K460-K462 VanDerWaalsContact C-N 3.34Å; K460-K462 PolarHBondContact O-N 3.27Å; K462-K464 VanDerWaalsContact C-N 3.34Å; K462-K464 PolarHBondContact O-N 3.24Å; K462-Q465 PolarHBondContact O-N 3.4Å; K462-Q466 PolarHBondContact O-N 3.05Å
463N89Confident88Confident108 Ų108104.5 Ų104.558%0.57853%0.531SS*.Hα-helixtrans-61.9-42.1175-101.3-4.7000111.6K459 K460 Q466 Q467K459-N463 PolarHBondContact O-N 2.95Å; K460-N463 PolarHBondContact O-N 2.99Å; N463-Q466 PolarHBondContact O-N 3.41Å; N463-Q467 WeakPolarHBondContact O-CB 3.34Å; N463-Q467 PolarHBondContact O-N 3.3Å
464K90.9Very high88.1Confident134 Ų134104 Ų10458%0.58353%0.529SS*.Hα-helixtrans-61.8-45.8176.2-170.2179.4177.8-172.80111.6K460 A461 K462 Q466 Q467 E468K460-K464 PolarHBondContact O-N 3.4Å; A461-K464 PolarHBondContact O-N 3.16Å; K462-K464 VanDerWaalsContact C-N 3.34Å; K462-K464 PolarHBondContact O-N 3.24Å; K464-Q466 VanDerWaalsContact C-N 3.33Å; K464-Q466 PolarHBondContact O-N 2.99Å; K464-Q467 PolarHBondContact O-N 3.14Å; K464-E468 VanDerWaalsContact CE-OE1 3.26Å; K464-E468 WeakPolarHBondContact CE-OE1 3.34Å; K464-E468 WeakPolarHBondContact O-CG 3.45Å; K464-E468 PolarHBondContact O-N 3.46Å
465Q88.6Confident88.3Confident138 Ų138106.7 Ų106.765%0.64553%0.53SS*.Hα-helixtrans-58.6-42.7173.8-100.4-174.2-14.600112.5A461 K462 Q467 K469A461-Q465 PolarHBondContact O-N 3.48Å; K462-Q465 PolarHBondContact O-N 3.4Å; Q465-Q467 VanDerWaalsContact C-N 3.34Å; Q465-K469 WeakPolarHBondContact O-CB 3.37Å; Q465-K469 PolarHBondContact O-N 3.22Å
466Q88.5Confident88.2Confident104 Ų104110.6 Ų110.649%0.48654%0.539SS..Hα-helixtrans-67.7-34.9177.4-87.2168.1-55.100112.2K462 N463 K464 K469 V470K462-Q466 PolarHBondContact O-N 3.05Å; N463-Q466 PolarHBondContact O-N 3.41Å; K464-Q466 VanDerWaalsContact C-N 3.33Å; K464-Q466 PolarHBondContact O-N 2.99Å; Q466-K469 WeakPolarHBondContact O-CB 3.43Å; Q466-K469 PolarHBondContact O-N 2.94Å; Q466-V470 VanDerWaalsContact O-CG2 3.26Å; Q466-V470 WeakPolarHBondContact O-CG2 3.41Å; Q466-V470 PolarHBondContact O-N 2.89Å
467Q88.9Confident88.3Confident146 Ų146111.3 Ų111.368%0.68254%0.539SS*.Hα-helixtrans-71.9-38.1177.4-157.71498.200112.1N463 K464 Q465 V470 S471N463-Q467 WeakPolarHBondContact O-CB 3.34Å; N463-Q467 PolarHBondContact O-N 3.3Å; K464-Q467 PolarHBondContact O-N 3.14Å; Q465-Q467 VanDerWaalsContact C-N 3.34Å; Q467-V470 PolarHBondContact O-N 2.67Å; Q467-S471 PolarHBondContact O-N 2.86Å; Q467-S471 PolarHBondContact O-OG 3.47Å
468E88.4Confident88.5Confident92 Ų92113.4 Ų113.443%0.4354%0.543SS..Hα-helixtrans-60.7-46.4169.1-74168.8-177.700110.5K464 V470 S471 E472K464-E468 VanDerWaalsContact CE-OE1 3.26Å; K464-E468 WeakPolarHBondContact CE-OE1 3.34Å; K464-E468 WeakPolarHBondContact O-CG 3.45Å; K464-E468 PolarHBondContact O-N 3.46Å; E468-V470 VanDerWaalsContact C-N 3.34Å; E468-V470 PolarHBondContact O-N 3.3Å; E468-S471 WeakPolarHBondContact CA-OG 3.36Å; E468-S471 PolarHBondContact O-N 3.46Å; E468-S471 VanDerWaalsContact O-N 3.13Å; E468-S471 PolarHBondContact O-OG 2.92Å; E468-E472 PolarHBondContact O-N 3.47Å
469K87.9Confident88.7Confident127 Ų127111.5 Ų111.555%0.55254%0.538SS*.Hα-helixtrans-59.3-41.8176.3-158.879.1-179.11690112.6Q465 Q466 E472 L473Q465-K469 WeakPolarHBondContact O-CB 3.37Å; Q465-K469 PolarHBondContact O-N 3.22Å; Q466-K469 WeakPolarHBondContact O-CB 3.43Å; Q466-K469 PolarHBondContact O-N 2.94Å; K469-E472 PolarHBondContact O-N 3.3Å; K469-L473 VanDerWaalsContact O-CG 3.32Å; K469-L473 WeakPolarHBondContact O-CG 3.33Å; K469-L473 PolarHBondContact O-N 3.19Å
470V87.9Confident88.6Confident74 Ų74108.2 Ų108.245%0.44853%0.529SS..Hα-helixtrans-64.5-43.7175.6168.90000110.4Q466 Q467 E468 E472 L473 E474Q466-V470 VanDerWaalsContact O-CG2 3.26Å; Q466-V470 WeakPolarHBondContact O-CG2 3.41Å; Q466-V470 PolarHBondContact O-N 2.89Å; Q467-V470 PolarHBondContact O-N 2.67Å; E468-V470 VanDerWaalsContact C-N 3.34Å; E468-V470 PolarHBondContact O-N 3.3Å; V470-E472 VanDerWaalsContact C-N 3.33Å; V470-E472 PolarHBondContact O-N 2.83Å; V470-L473 PolarHBondContact O-N 3.25Å; V470-E474 HydrophobicContact CG1-CG 4.4Å; V470-E474 WeakPolarHBondContact O-CG 3.39Å; V470-E474 PolarHBondContact O-N 3.36Å
471S89.9Confident88.5Confident53 Ų53105 Ų10537%0.37152%0.519SS..Hα-helixtrans-66.6-32.1178.2720000113.8Q467 E468 R475Q467-S471 PolarHBondContact O-N 2.86Å; Q467-S471 PolarHBondContact O-OG 3.47Å; E468-S471 WeakPolarHBondContact CA-OG 3.36Å; E468-S471 PolarHBondContact O-N 3.46Å; E468-S471 VanDerWaalsContact O-N 3.13Å; E468-S471 PolarHBondContact O-OG 2.92Å; S471-R475 PolarHBondContact O-N 3.26Å; S471-R475 VanDerWaalsContact O-N 3.11Å
472E88.2Confident88.6Confident108 Ų108107.5 Ų107.551%0.50552%0.524SS..Hα-helixtrans-66-46.5171.4-75.8175.8169.700110.8E468 K469 V470 R475 E476E468-E472 PolarHBondContact O-N 3.47Å; K469-E472 PolarHBondContact O-N 3.3Å; V470-E472 VanDerWaalsContact C-N 3.33Å; V470-E472 PolarHBondContact O-N 2.83Å; E472-R475 WeakPolarHBondContact O-CB 3.35Å; E472-R475 PolarHBondContact O-N 2.96Å; E472-E476 WeakPolarHBondContact O-CG 3.42Å; E472-E476 PolarHBondContact O-N 3.39Å
473L86.5Confident88.6Confident88 Ų88107 Ų10746%0.46153%0.527SS..Hα-helixtrans-64.8-39.6177.9-71.6171000112.4K469 V470 R475 E476 I477K469-L473 VanDerWaalsContact O-CG 3.32Å; K469-L473 WeakPolarHBondContact O-CG 3.33Å; K469-L473 PolarHBondContact O-N 3.19Å; V470-L473 PolarHBondContact O-N 3.25Å; L473-R475 VanDerWaalsContact C-N 3.34Å; L473-E476 PolarHBondContact O-N 3.45Å; L473-I477 VanDerWaalsContact O-CG1 3.25Å; L473-I477 WeakPolarHBondContact O-CG1 3.5Å; L473-I477 PolarHBondContact O-N 2.92Å
474E89.1Confident88.5Confident118 Ų118105.7 Ų105.755%0.55152%0.518SS*.Hα-helixtrans-61.8-42.5173.7-75.7175.3168.500111.3V470 E476 I477 D478V470-E474 HydrophobicContact CG1-CG 4.4Å; V470-E474 WeakPolarHBondContact O-CG 3.39Å; V470-E474 PolarHBondContact O-N 3.36Å; E474-E476 PolarHBondContact O-N 3.46Å; E474-I477 PolarHBondContact O-N 2.9Å; E474-D478 PolarHBondContact O-N 2.95Å
475R88.5Confident88.5Confident183 Ų183103.5 Ų103.569%0.69152%0.517SS*.Hα-helixtrans-63.1-40.5173.5-98.3-175.6167.4136.9-1.6113.2S471 E472 L473 I477 D478 N479S471-R475 PolarHBondContact O-N 3.26Å; S471-R475 VanDerWaalsContact O-N 3.11Å; E472-R475 WeakPolarHBondContact O-CB 3.35Å; E472-R475 PolarHBondContact O-N 2.96Å; L473-R475 VanDerWaalsContact C-N 3.34Å; R475-I477 VanDerWaalsContact C-N 3.35Å; R475-D478 PolarHBondContact O-N 2.85Å; R475-N479 WeakPolarHBondContact O-CB 3.31Å; R475-N479 PolarHBondContact O-N 3.16Å; R475-N479 PolarHBondContact O-ND2 2.91Å; R475-N479 VanDerWaalsContact O-ND2 3.16Å
476E86.2Confident88.4Confident116 Ų116103.7 Ų103.754%0.54252%0.515SS..Hα-helixtrans-62.7-44.2174.9-74.9177.9-177.100110.7E472 L473 E474 N479 T480E472-E476 WeakPolarHBondContact O-CG 3.42Å; E472-E476 PolarHBondContact O-N 3.39Å; L473-E476 PolarHBondContact O-N 3.45Å; E474-E476 PolarHBondContact O-N 3.46Å; E476-N479 PolarHBondContact O-N 3.18Å; E476-T480 VanDerWaalsContact O-CG2 3.3Å; E476-T480 WeakPolarHBondContact O-CG2 3.43Å; E476-T480 PolarHBondContact O-N 3.02Å; E476-T480 PolarHBondContact O-OG1 3.3Å
477I87.5Confident88.3Confident95 Ų95102.6 Ų102.649%0.48751%0.512SS..Hα-helixtrans-59.8-48.8175.4-70165.7000110.5L473 E474 R475 N479 T480 N481L473-I477 VanDerWaalsContact O-CG1 3.25Å; L473-I477 WeakPolarHBondContact O-CG1 3.5Å; L473-I477 PolarHBondContact O-N 2.92Å; E474-I477 PolarHBondContact O-N 2.9Å; R475-I477 VanDerWaalsContact C-N 3.35Å; I477-N479 VanDerWaalsContact C-N 3.35Å; I477-N479 PolarHBondContact O-N 3.29Å; I477-T480 WeakPolarHBondContact CA-OG1 3.38Å; I477-T480 PolarHBondContact O-N 3.17Å; I477-T480 PolarHBondContact O-OG1 3.23Å; I477-N481 WeakPolarHBondContact O-CB 3.43Å; I477-N481 PolarHBondContact O-N 3.3Å; I477-N481 PolarHBondContact O-ND2 3.03Å
478D90.5Very high88.1Confident99 Ų99101.1 Ų101.153%0.52951%0.506SS..Hα-helixtrans-60.9-42.2178.3-74.9-18.4000112.5E474 R475 N481 L482E474-D478 PolarHBondContact O-N 2.95Å; R475-D478 PolarHBondContact O-N 2.85Å; D478-N481 PolarHBondContact O-N 3.22Å; D478-L482 WeakPolarHBondContact O-CG 3.37Å; D478-L482 PolarHBondContact O-N 3.14Å
479N90.1Very high88.1Confident103 Ų10398.2 Ų98.255%0.55150%0.5SS*.Hα-helixtrans-64.8-41.1175.9-73.8-28.8000111.9R475 E476 I477 L482 L483R475-N479 WeakPolarHBondContact O-CB 3.31Å; R475-N479 PolarHBondContact O-N 3.16Å; R475-N479 PolarHBondContact O-ND2 2.91Å; R475-N479 VanDerWaalsContact O-ND2 3.16Å; E476-N479 PolarHBondContact O-N 3.18Å; I477-N479 VanDerWaalsContact C-N 3.35Å; I477-N479 PolarHBondContact O-N 3.29Å; N479-L482 PolarHBondContact O-N 2.93Å; N479-L483 PolarHBondContact O-N 3.36Å
480T86.1Confident88Confident72 Ų7298 Ų9844%0.44250%0.501SS..Hα-helixtrans-66.5-38.8175.557.80000111.8E476 I477 L483 I484E476-T480 VanDerWaalsContact O-CG2 3.3Å; E476-T480 WeakPolarHBondContact O-CG2 3.43Å; E476-T480 PolarHBondContact O-N 3.02Å; E476-T480 PolarHBondContact O-OG1 3.3Å; I477-T480 WeakPolarHBondContact CA-OG1 3.38Å; I477-T480 PolarHBondContact O-N 3.17Å; I477-T480 PolarHBondContact O-OG1 3.23Å; T480-L483 WeakPolarHBondContact O-CB 3.43Å; T480-L483 PolarHBondContact O-N 3.48Å; T480-I484 VanDerWaalsContact O-CG1 3.23Å; T480-I484 WeakPolarHBondContact O-CG1 3.46Å; T480-I484 PolarHBondContact O-N 3.43Å
481N89.3Confident87.8Confident79 Ų7999.1 Ų99.142%0.42250%0.504SS..Hα-helixtrans-64.1-43.8175-74.4-29.3000111.7I477 D478 L483 I484 T485I477-N481 WeakPolarHBondContact O-CB 3.43Å; I477-N481 PolarHBondContact O-N 3.3Å; I477-N481 PolarHBondContact O-ND2 3.03Å; D478-N481 PolarHBondContact O-N 3.22Å; N481-L483 VanDerWaalsContact C-N 3.28Å; N481-L483 PolarHBondContact O-N 3.39Å; N481-I484 PolarHBondContact O-N 3.03Å; N481-T485 PolarHBondContact O-N 3Å; N481-T485 PolarHBondContact O-OG1 3.27Å
482L89.3Confident87.7Confident109 Ų109102.1 Ų102.157%0.57151%0.511SS*.Hα-helixtrans-60-39173.7-79168.5000112.3D478 N479 K486D478-L482 WeakPolarHBondContact O-CG 3.37Å; D478-L482 PolarHBondContact O-N 3.14Å; N479-L482 PolarHBondContact O-N 2.93Å; L482-K486 WeakPolarHBondContact O-CG 3.39Å; L482-K486 PolarHBondContact O-N 2.77Å; L482-K486 VanDerWaalsContact O-N 3.12Å
483L89.3Confident87.5Confident102 Ų102103.3 Ų103.353%0.53452%0.517SS..Hα-helixtrans-67.4-43.1175.1-175.664.2000111.2N479 T480 N481 K486 L487N479-L483 PolarHBondContact O-N 3.36Å; T480-L483 WeakPolarHBondContact O-CB 3.43Å; T480-L483 PolarHBondContact O-N 3.48Å; N481-L483 VanDerWaalsContact C-N 3.28Å; N481-L483 PolarHBondContact O-N 3.39Å; L483-K486 PolarHBondContact O-N 3.42Å; L483-L487 HydrophobicContact CG-CD1 4.1Å; L483-L487 HydrophobicContact CG-CG 4.49Å; L483-L487 WeakPolarHBondContact O-CB 3.23Å; L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.38Å; L483-L487 PolarHBondContact O-N 2.95Å
484I87.6Confident87.4Confident79 Ų79101.5 Ų101.541%0.40551%0.514SS..Hα-helixtrans-59.3-48.6175.5-70.3163.8000110.2T480 N481 K486 L487 E488T480-I484 VanDerWaalsContact O-CG1 3.23Å; T480-I484 WeakPolarHBondContact O-CG1 3.46Å; T480-I484 PolarHBondContact O-N 3.43Å; N481-I484 PolarHBondContact O-N 3.03Å; I484-K486 VanDerWaalsContact C-N 3.29Å; I484-K486 PolarHBondContact O-N 3.17Å; I484-L487 CarbonylContact O-C 3.52Å; I484-L487 PolarHBondContact O-N 3.23Å; I484-L487 VanDerWaalsContact O-N 3.12Å; I484-E488 HydrophobicContact CG2-CG 4.18Å; I484-E488 WeakPolarHBondContact O-CB 3.48Å; I484-E488 WeakPolarHBondContact O-CG 3.44Å; I484-E488 PolarHBondContact O-N 3.47Å
485T89.3Confident87.5Confident89 Ų89100 Ų10055%0.54651%0.51SS..Hα-helixtrans-60.5-37.7178.2-53.20000112.4N481 G489N481-T485 PolarHBondContact O-N 3Å; N481-T485 PolarHBondContact O-OG1 3.27Å; T485-G489 PolarHBondContact O-N 3.14Å
486K88.1Confident87.4Confident141 Ų14193.6 Ų93.661%0.61349%0.489SS*.Hα-helixtrans-64.6-47.1173.4-75.9178-178.2179.40111.7L482 L483 I484 E488 G489 E490L482-K486 WeakPolarHBondContact O-CG 3.39Å; L482-K486 PolarHBondContact O-N 2.77Å; L482-K486 VanDerWaalsContact O-N 3.12Å; L483-K486 PolarHBondContact O-N 3.42Å; I484-K486 VanDerWaalsContact C-N 3.29Å; I484-K486 PolarHBondContact O-N 3.17Å; K486-E488 VanDerWaalsContact C-N 3.34Å; K486-E488 PolarHBondContact O-N 2.94Å; K486-G489 PolarHBondContact O-N 3.11Å; K486-E490 WeakPolarHBondContact O-CG 3.38Å; K486-E490 PolarHBondContact O-N 3.39Å
487L85.4Confident87.5Confident81 Ų8190.7 Ų90.742%0.42448%0.482SS..Hα-helixtrans-64.2-38.1178.4-69.7172.9000111.8L483 I484 E490 I491L483-L487 HydrophobicContact CG-CD1 4.1Å; L483-L487 HydrophobicContact CG-CG 4.49Å; L483-L487 WeakPolarHBondContact O-CB 3.23Å; L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.38Å; L483-L487 PolarHBondContact O-N 2.95Å; I484-L487 CarbonylContact O-C 3.52Å; I484-L487 PolarHBondContact O-N 3.23Å; I484-L487 VanDerWaalsContact O-N 3.12Å; L487-E490 PolarHBondContact O-N 2.92Å; L487-I491 WeakPolarHBondContact O-CB 3.48Å; L487-I491 WeakPolarHBondContact O-CD1 3.41Å; L487-I491 WeakPolarHBondContact O-CG1 3.36Å; L487-I491 PolarHBondContact O-N 3.2Å
488E84.9Confident87.3Confident116 Ų11690.2 Ų90.254%0.54248%0.483SS..Hα-helixtrans-63.1-41.4173.6-74.8176.7160.600111.7I484 K486 I491 H492I484-E488 HydrophobicContact CG2-CG 4.18Å; I484-E488 WeakPolarHBondContact O-CB 3.48Å; I484-E488 WeakPolarHBondContact O-CG 3.44Å; I484-E488 PolarHBondContact O-N 3.47Å; K486-E488 VanDerWaalsContact C-N 3.34Å; K486-E488 PolarHBondContact O-N 2.94Å; E488-I491 PolarHBondContact O-N 2.91Å; E488-H492 WeakPolarHBondContact O-CB 3.47Å; E488-H492 PolarHBondContact O-N 3.37Å
489G87.4Confident86.9Confident31 Ų3192.3 Ų92.332%0.3249%0.49SS..Hα-helixtrans-63.5-43.5173.400000112.7T485 K486 H492 H493T485-G489 PolarHBondContact O-N 3.14Å; K486-G489 PolarHBondContact O-N 3.11Å; G489-H492 PolarHBondContact O-N 3.27Å; G489-H493 PolarHBondContact O-CD2 2.92Å; G489-H493 VanDerWaalsContact O-CD2 3.22Å; G489-H493 PolarHBondContact O-N 3.4Å
490E86.9Confident86.6Confident122 Ų12295.8 Ų95.857%0.5750%0.495SS*.Hα-helixtrans-64.4-42.4175.2-73.3175.5-168.900111.9K486 L487 H492 H493 A494K486-E490 WeakPolarHBondContact O-CG 3.38Å; K486-E490 PolarHBondContact O-N 3.39Å; L487-E490 PolarHBondContact O-N 2.92Å; E490-H492 VanDerWaalsContact C-N 3.35Å; E490-H493 PolarHBondContact O-N 2.85Å; E490-A494 VanDerWaalsContact O-CB 3.24Å; E490-A494 WeakPolarHBondContact O-CB 3.45Å; E490-A494 PolarHBondContact O-N 3.18Å
491I84.2Confident86.5Confident98 Ų9898.6 Ų98.650%0.50350%0.501SS..Hα-helixtrans-63-42.3174.3-71.1164.2000110.2L487 E488 A494 N495L487-I491 WeakPolarHBondContact O-CB 3.48Å; L487-I491 WeakPolarHBondContact O-CD1 3.41Å; L487-I491 WeakPolarHBondContact O-CG1 3.36Å; L487-I491 PolarHBondContact O-N 3.2Å; E488-I491 PolarHBondContact O-N 2.91Å; I491-A494 PolarHBondContact O-N 3.17Å; I491-N495 WeakPolarHBondContact O-CB 3.48Å; I491-N495 PolarHBondContact O-N 3.09Å; I491-N495 PolarHBondContact O-ND2 2.96Å
492H86.8Confident86.1Confident115 Ų11599.1 Ų99.153%0.53250%0.501SS..Hα-helixtrans-63.1-44.7176.6-175.263.4000111.7E488 G489 E490 N495 I496E488-H492 WeakPolarHBondContact O-CB 3.47Å; E488-H492 PolarHBondContact O-N 3.37Å; G489-H492 PolarHBondContact O-N 3.27Å; E490-H492 VanDerWaalsContact C-N 3.35Å; H492-N495 PolarHBondContact O-N 3.46Å; H492-I496 WeakPolarHBondContact O-CG1 3.43Å; H492-I496 PolarHBondContact O-N 3.32Å
493H85.4Confident85.9Confident134 Ų13495.3 Ų95.362%0.6249%0.489SS*.Hα-helixtrans-64.3-39.9173.9-76-47.2000112.8G489 E490 I496 S497G489-H493 PolarHBondContact O-CD2 2.92Å; G489-H493 VanDerWaalsContact O-CD2 3.22Å; G489-H493 PolarHBondContact O-N 3.4Å; E490-H493 PolarHBondContact O-N 2.85Å; H493-I496 PolarHBondContact O-N 2.91Å; H493-S497 WeakPolarHBondContact O-CB 3.38Å; H493-S497 PolarHBondContact O-N 2.92Å
494A84.3Confident85.7Confident49 Ų4995.1 Ų95.141%0.40549%0.488SS..Hα-helixtrans-63.1-43.1174.300000110.8E490 I491 S497 V498E490-A494 VanDerWaalsContact O-CB 3.24Å; E490-A494 WeakPolarHBondContact O-CB 3.45Å; E490-A494 PolarHBondContact O-N 3.18Å; I491-A494 PolarHBondContact O-N 3.17Å; A494-S497 CarbonylContact O-C 3.57Å; A494-S497 WeakPolarHBondContact O-CB 3.48Å; A494-S497 PolarHBondContact O-N 3.43Å; A494-V498 WeakPolarHBondContact O-CB 3.3Å; A494-V498 VanDerWaalsContact O-CG2 3.24Å; A494-V498 WeakPolarHBondContact O-CG2 3.26Å; A494-V498 PolarHBondContact O-N 2.96Å
495N89.3Confident85.4Confident87 Ų8794.8 Ų94.847%0.46549%0.486SS..Hα-helixtrans-62.8-44.4176.5-75-14.9000111.9I491 H492 S497 V498 E499I491-N495 WeakPolarHBondContact O-CB 3.48Å; I491-N495 PolarHBondContact O-N 3.09Å; I491-N495 PolarHBondContact O-ND2 2.96Å; H492-N495 PolarHBondContact O-N 3.46Å; N495-S497 VanDerWaalsContact C-N 3.29Å; N495-S497 PolarHBondContact O-N 2.82Å; N495-V498 CarbonylContact O-C 3.59Å; N495-V498 PolarHBondContact O-N 2.93Å; N495-E499 WeakPolarHBondContact O-CG 3.44Å; N495-E499 PolarHBondContact O-N 3.47Å
496I87.2Confident85Confident48 Ų4894 Ų9425%0.24648%0.479CS..Hα-helixtrans-60.8-40.9173.6-67.5166.5000110.9H492 H493 E499 R500H492-I496 WeakPolarHBondContact O-CG1 3.43Å; H492-I496 PolarHBondContact O-N 3.32Å; H493-I496 PolarHBondContact O-N 2.91Å; I496-E499 PolarHBondContact O-N 2.89Å; I496-R500 VanDerWaalsContact O-CG 3.31Å; I496-R500 WeakPolarHBondContact O-CG 3.47Å; I496-R500 PolarHBondContact O-N 2.93Å
497S88Confident84.9Confident55 Ų5591.8 Ų91.839%0.38547%0.472SS..Hα-helixtrans-65.9-40.5177-170.50000111.7H493 A494 N495 R500 K501H493-S497 WeakPolarHBondContact O-CB 3.38Å; H493-S497 PolarHBondContact O-N 2.92Å; A494-S497 CarbonylContact O-C 3.57Å; A494-S497 WeakPolarHBondContact O-CB 3.48Å; A494-S497 PolarHBondContact O-N 3.43Å; N495-S497 VanDerWaalsContact C-N 3.29Å; N495-S497 PolarHBondContact O-N 2.82Å; S497-R500 PolarHBondContact O-N 3.01Å; S497-K501 WeakPolarHBondContact O-CB 3.26Å; S497-K501 VanDerWaalsContact O-CG 3.3Å; S497-K501 WeakPolarHBondContact O-CG 3.49Å; S497-K501 PolarHBondContact O-N 3.39Å
498V83.5Confident84.7Confident86 Ų8693 Ų9352%0.52148%0.479SS..Hα-helixtrans-65.1-44.9174.5169.30000110.4A494 N495 R500 K501 Q502A494-V498 WeakPolarHBondContact O-CB 3.3Å; A494-V498 VanDerWaalsContact O-CG2 3.24Å; A494-V498 WeakPolarHBondContact O-CG2 3.26Å; A494-V498 PolarHBondContact O-N 2.96Å; N495-V498 CarbonylContact O-C 3.59Å; N495-V498 PolarHBondContact O-N 2.93Å; V498-R500 PolarHBondContact O-N 3.44Å; V498-K501 CarbonylContact O-C 3.6Å; V498-K501 PolarHBondContact O-N 3.49Å; V498-Q502 VanDerWaalsContact O-CB 3.23Å; V498-Q502 WeakPolarHBondContact O-CB 3.43Å; V498-Q502 PolarHBondContact O-N 2.79Å
499E82.6Confident84.5Confident143 Ų14391.1 Ų91.167%0.66847%0.472SS*.Hα-helixtrans-60.9-42.8175.4-78.7-179.5174.600112N495 I496 Q502 G503N495-E499 WeakPolarHBondContact O-CG 3.44Å; N495-E499 PolarHBondContact O-N 3.47Å; I496-E499 PolarHBondContact O-N 2.89Å; E499-Q502 PolarHBondContact O-N 3.31Å; E499-G503 PolarHBondContact O-N 3.03Å
500R83.6Confident84.1Confident175 Ų17595.5 Ų95.566%0.6648%0.483SS*.Hα-helixtrans-63.7-43.1174.4-72.5176.2-173.4176.43.3111.7I496 S497 V498 G503 N504I496-R500 VanDerWaalsContact O-CG 3.31Å; I496-R500 WeakPolarHBondContact O-CG 3.47Å; I496-R500 PolarHBondContact O-N 2.93Å; S497-R500 PolarHBondContact O-N 3.01Å; V498-R500 PolarHBondContact O-N 3.44Å; R500-G503 PolarHBondContact O-N 3.36Å; R500-N504 VanDerWaalsContact O-CG 3.27Å; R500-N504 PolarHBondContact O-N 2.9Å; R500-N504 PolarHBondContact O-ND2 3.14Å
501K83.3Confident83.6Confident132 Ų13295.3 Ų95.357%0.57448%0.48SS*.Hα-helixtrans-66.2-39.3175.8-76.1-179.2-179.3-175.90111.4S497 V498 N504 I505S497-K501 WeakPolarHBondContact O-CB 3.26Å; S497-K501 VanDerWaalsContact O-CG 3.3Å; S497-K501 WeakPolarHBondContact O-CG 3.49Å; S497-K501 PolarHBondContact O-N 3.39Å; V498-K501 CarbonylContact O-C 3.6Å; V498-K501 PolarHBondContact O-N 3.49Å; K501-N504 CarbonylContact O-C 3.58Å; K501-N504 WeakPolarHBondContact O-CB 3.34Å; K501-N504 PolarHBondContact O-N 2.92Å; K501-I505 WeakPolarHBondContact O-CB 3.49Å; K501-I505 WeakPolarHBondContact O-CG1 3.49Å; K501-I505 PolarHBondContact O-N 3.19Å
502Q81.5Confident83Confident89 Ų8995 Ų9542%0.41648%0.479SS..Hα-helixtrans-65.6-44176.6-170.562.140.300110.4V498 E499 N504 I505 D506V498-Q502 VanDerWaalsContact O-CB 3.23Å; V498-Q502 WeakPolarHBondContact O-CB 3.43Å; V498-Q502 PolarHBondContact O-N 2.79Å; E499-Q502 PolarHBondContact O-N 3.31Å; Q502-N504 VanDerWaalsContact C-N 3.32Å; Q502-N504 PolarHBondContact O-N 3.45Å; Q502-I505 CarbonylContact O-C 3.46Å; Q502-I505 WeakPolarHBondContact O-CB 3.4Å; Q502-I505 PolarHBondContact O-N 2.92Å; Q502-I505 VanDerWaalsContact O-N 3.14Å; Q502-D506 PolarHBondContact NE2-OD1 2.97Å; Q502-D506 VanDerWaalsContact NE2-OD1 3.14Å; Q502-D506 PolarHBondContact O-N 2.82Å
503G84.5Confident82.4Confident30 Ų3095.7 Ų95.731%0.30948%0.482SS..Hα-helixtrans-60.8-39.7172.500000112.7E499 R500 D506 I507E499-G503 PolarHBondContact O-N 3.03Å; R500-G503 PolarHBondContact O-N 3.36Å; G503-D506 PolarHBondContact O-N 3.34Å; G503-I507 WeakPolarHBondContact O-CD1 3.4Å; G503-I507 VanDerWaalsContact O-CG1 3.24Å; G503-I507 WeakPolarHBondContact O-CG1 3.3Å; G503-I507 PolarHBondContact O-N 3.41Å
504N85.5Confident81.9Confident97 Ų9797 Ų9752%0.51948%0.482SS..Hα-helixtrans-65.9-40.8172.7-72.3-20.6000112.2R500 K501 Q502 I507 L508R500-N504 VanDerWaalsContact O-CG 3.27Å; R500-N504 PolarHBondContact O-N 2.9Å; R500-N504 PolarHBondContact O-ND2 3.14Å; K501-N504 CarbonylContact O-C 3.58Å; K501-N504 WeakPolarHBondContact O-CB 3.34Å; K501-N504 PolarHBondContact O-N 2.92Å; Q502-N504 VanDerWaalsContact C-N 3.32Å; Q502-N504 PolarHBondContact O-N 3.45Å; N504-I507 PolarHBondContact O-N 3.38Å; N504-L508 WeakPolarHBondContact O-CB 3.35Å; N504-L508 VanDerWaalsContact O-CG 3.26Å; N504-L508 WeakPolarHBondContact O-CG 3.43Å; N504-L508 PolarHBondContact O-N 3.44Å
505I81.6Confident81.2Confident73 Ų7399.6 Ų99.637%0.37449%0.489SS..Hα-helixtrans-62.1-43.5174.2-72163.2000109.9K501 Q502 I507 L508 N509K501-I505 WeakPolarHBondContact O-CB 3.49Å; K501-I505 WeakPolarHBondContact O-CG1 3.49Å; K501-I505 PolarHBondContact O-N 3.19Å; Q502-I505 CarbonylContact O-C 3.46Å; Q502-I505 WeakPolarHBondContact O-CB 3.4Å; Q502-I505 PolarHBondContact O-N 2.92Å; Q502-I505 VanDerWaalsContact O-N 3.14Å; I505-I507 VanDerWaalsContact C-N 3.34Å; I505-I507 PolarHBondContact O-N 2.76Å; I505-L508 CarbonylContact O-C 3.54Å; I505-L508 PolarHBondContact O-N 3.39Å; I505-L508 VanDerWaalsContact O-N 3.16Å; I505-N509 WeakPolarHBondContact CG2-ND2 3.42Å; I505-N509 VanDerWaalsContact O-CB 3.31Å; I505-N509 WeakPolarHBondContact O-CB 3.38Å; I505-N509 VanDerWaalsContact O-CG 3.23Å; I505-N509 PolarHBondContact O-N 3.49Å
506D82.3Confident80.2Confident72 Ų7297.6 Ų97.639%0.38548%0.477SS..Hα-helixtrans-65.7-37.2178.4-65.4-16.5000111.6Q502 G503 K510Q502-D506 PolarHBondContact NE2-OD1 2.97Å; Q502-D506 VanDerWaalsContact NE2-OD1 3.14Å; Q502-D506 PolarHBondContact O-N 2.82Å; G503-D506 PolarHBondContact O-N 3.34Å; D506-K510 WeakPolarHBondContact O-CB 3.47Å; D506-K510 WeakPolarHBondContact O-CG 3.26Å; D506-K510 PolarHBondContact O-N 3.5Å
507I84.8Confident79.3Confident94 Ų94102.4 Ų102.448%0.48250%0.499SS..Hα-helixtrans-64.8-43.3172.2-68.8163.9000110.6G503 N504 I505 K510 K511G503-I507 WeakPolarHBondContact O-CD1 3.4Å; G503-I507 VanDerWaalsContact O-CG1 3.24Å; G503-I507 WeakPolarHBondContact O-CG1 3.3Å; G503-I507 PolarHBondContact O-N 3.41Å; N504-I507 PolarHBondContact O-N 3.38Å; I505-I507 VanDerWaalsContact C-N 3.34Å; I505-I507 PolarHBondContact O-N 2.76Å; I507-K510 PolarHBondContact O-N 3.14Å; I507-K511 WeakPolarHBondContact O-CG 3.43Å; I507-K511 PolarHBondContact O-N 2.96Å
508L80.7Confident78.4Confident106 Ų106105.7 Ų105.756%0.55551%0.512SS*.Hα-helixtrans-68-40.3178-73.5168.5000111.7N504 I505 K511 L512N504-L508 WeakPolarHBondContact O-CB 3.35Å; N504-L508 VanDerWaalsContact O-CG 3.26Å; N504-L508 WeakPolarHBondContact O-CG 3.43Å; N504-L508 PolarHBondContact O-N 3.44Å; I505-L508 CarbonylContact O-C 3.54Å; I505-L508 PolarHBondContact O-N 3.39Å; I505-L508 VanDerWaalsContact O-N 3.16Å; L508-K511 CarbonylContact O-C 3.54Å; L508-K511 WeakPolarHBondContact O-CB 3.35Å; L508-K511 PolarHBondContact O-N 2.93Å; L508-K511 VanDerWaalsContact O-N 3.15Å; L508-L512 WeakPolarHBondContact O-CB 3.34Å; L508-L512 PolarHBondContact O-N 3.4Å
509N80.7Confident77.2Confident77 Ų77103.9 Ų103.941%0.41250%0.502SS..Hα-helixtrans-64.1-43.3174.8-74.8-14.3000110.7I505 K511 L512 E513I505-N509 WeakPolarHBondContact CG2-ND2 3.42Å; I505-N509 VanDerWaalsContact O-CB 3.31Å; I505-N509 WeakPolarHBondContact O-CB 3.38Å; I505-N509 VanDerWaalsContact O-CG 3.23Å; I505-N509 PolarHBondContact O-N 3.49Å; N509-K511 VanDerWaalsContact C-N 3.29Å; N509-K511 PolarHBondContact O-N 3.31Å; N509-L512 CarbonylContact O-C 3.56Å; N509-L512 WeakPolarHBondContact O-CB 3.34Å; N509-L512 PolarHBondContact O-N 3.33Å; N509-L512 VanDerWaalsContact O-N 3.13Å; N509-E513 WeakPolarHBondContact O-CG 3.43Å; N509-E513 PolarHBondContact O-N 3.01Å
510K79.5Confident76.4Confident124 Ų124100.5 Ų100.554%0.53951%0.506SS..Hα-helixtrans-62.3-34.9172-78.3174.7179.8172.90112.7D506 I507 R514D506-K510 WeakPolarHBondContact O-CB 3.47Å; D506-K510 WeakPolarHBondContact O-CG 3.26Å; D506-K510 PolarHBondContact O-N 3.5Å; I507-K510 PolarHBondContact O-N 3.14Å; K510-R514 VanDerWaalsContact O-CG 3.25Å; K510-R514 WeakPolarHBondContact O-CG 3.44Å; K510-R514 PolarHBondContact O-N 2.88Å
511K77Confident75.5Confident118 Ų11894.8 Ų94.851%0.51350%0.501SS..Hα-helixtrans-68.8-40.4172.5-77.5178.9178.4-178.30111.3I507 L508 N509 R514 L515I507-K511 WeakPolarHBondContact O-CG 3.43Å; I507-K511 PolarHBondContact O-N 2.96Å; L508-K511 CarbonylContact O-C 3.54Å; L508-K511 WeakPolarHBondContact O-CB 3.35Å; L508-K511 PolarHBondContact O-N 2.93Å; L508-K511 VanDerWaalsContact O-N 3.15Å; N509-K511 VanDerWaalsContact C-N 3.29Å; N509-K511 PolarHBondContact O-N 3.31Å; K511-R514 PolarHBondContact O-N 2.85Å; K511-L515 WeakPolarHBondContact O-CB 3.27Å; K511-L515 VanDerWaalsContact O-CG 3.26Å; K511-L515 WeakPolarHBondContact O-CG 3.47Å; K511-L515 PolarHBondContact O-N 3.31Å
512L71.7Confident74.2Confident91 Ų9195 Ų9548%0.47650%0.504SS..Hα-helixtrans-63.5-47.4176.6-168.678.3000111L508 N509 R514 L515 I516L508-L512 WeakPolarHBondContact O-CB 3.34Å; L508-L512 PolarHBondContact O-N 3.4Å; N509-L512 CarbonylContact O-C 3.56Å; N509-L512 WeakPolarHBondContact O-CB 3.34Å; N509-L512 PolarHBondContact O-N 3.33Å; N509-L512 VanDerWaalsContact O-N 3.13Å; L512-R514 VanDerWaalsContact C-N 3.33Å; L512-R514 PolarHBondContact O-N 2.97Å; L512-L515 CarbonylContact O-C 3.58Å; L512-L515 WeakPolarHBondContact O-CB 3.43Å; L512-L515 PolarHBondContact O-N 3.24Å; L512-L515 VanDerWaalsContact O-N 3.11Å; L512-I516 HydrophobicContact CD2-CD1 4.22Å; L512-I516 HydrophobicContact CG-CD1 3.93Å; L512-I516 HydrophobicContact CG-CG1 4.48Å; L512-I516 VanDerWaalsContact O-CG1 3.28Å; L512-I516 WeakPolarHBondContact O-CG1 3.4Å; L512-I516 PolarHBondContact O-N 2.85Å
513E74.2Confident73.1Confident129 Ų12999 Ų9960%0.60352%0.523SS*.Hα-helixtrans-59.4-41.9176.1-7717817400112.2N509 I516 H517N509-E513 WeakPolarHBondContact O-CG 3.43Å; N509-E513 PolarHBondContact O-N 3.01Å; E513-I516 PolarHBondContact O-N 3.28Å; E513-H517 WeakPolarHBondContact O-CB 3.29Å; E513-H517 PolarHBondContact O-N 3.15Å
514R73.9Confident71.7Confident161 Ų161100.2 Ų100.261%0.60852%0.522SS*.Hα-helixtrans-61.9-45.3173.1-71.8173.4-158.6171.33.5111.4K510 K511 L512 I516 H517 D518K510-R514 VanDerWaalsContact O-CG 3.25Å; K510-R514 WeakPolarHBondContact O-CG 3.44Å; K510-R514 PolarHBondContact O-N 2.88Å; K511-R514 PolarHBondContact O-N 2.85Å; L512-R514 VanDerWaalsContact C-N 3.33Å; L512-R514 PolarHBondContact O-N 2.97Å; R514-I516 VanDerWaalsContact C-N 3.35Å; R514-I516 PolarHBondContact O-N 3.46Å; R514-H517 PolarHBondContact O-N 3.45Å; R514-D518 WeakPolarHBondContact O-CB 3.43Å; R514-D518 PolarHBondContact O-N 2.88Å
515L69.3Low70.8Confident105 Ų10597.2 Ų97.255%0.5551%0.514SS..Hα-helixtrans-62.7-39.9176.7-71.9167.5000112K511 L512 D518 C519K511-L515 WeakPolarHBondContact O-CB 3.27Å; K511-L515 VanDerWaalsContact O-CG 3.26Å; K511-L515 WeakPolarHBondContact O-CG 3.47Å; K511-L515 PolarHBondContact O-N 3.31Å; L512-L515 CarbonylContact O-C 3.58Å; L512-L515 WeakPolarHBondContact O-CB 3.43Å; L512-L515 PolarHBondContact O-N 3.24Å; L512-L515 VanDerWaalsContact O-N 3.11Å; L515-D518 PolarHBondContact O-N 3.25Å; L515-C519 VanDerWaalsContact O-CB 3.22Å; L515-C519 WeakPolarHBondContact O-CB 3.49Å; L515-C519 PolarHBondContact O-N 3.02Å; L515-C519 PolarHBondContact O-SG 3.23Å
516I68.3Low70.1Confident44 Ų4499.2 Ų99.223%0.22653%0.532CS..Hα-helixtrans-66-43.7176.1-69.2166.4000110.6L512 E513 R514 C519 G520 G521 E523L512-I516 HydrophobicContact CD2-CD1 4.22Å; L512-I516 HydrophobicContact CG-CD1 3.93Å; L512-I516 HydrophobicContact CG-CG1 4.48Å; L512-I516 VanDerWaalsContact O-CG1 3.28Å; L512-I516 WeakPolarHBondContact O-CG1 3.4Å; L512-I516 PolarHBondContact O-N 2.85Å; E513-I516 PolarHBondContact O-N 3.28Å; R514-I516 VanDerWaalsContact C-N 3.35Å; R514-I516 PolarHBondContact O-N 3.46Å; I516-C519 CarbonylContact O-C 3.58Å; I516-C519 PolarHBondContact O-N 3.21Å; I516-G520 PolarHBondContact O-N 3.38Å; I516-G521 PolarHBondContact O-N 2.67Å; I516-E523 HydrophobicContact CD1-CG 4.24Å
517H69.9Low69.6Low150 Ų150102 Ų10269%0.69455%0.546SS*.Hα-helixtrans-61.4-47.4176-179.4-75.4000111.2E513 R514 C519 G520E513-H517 WeakPolarHBondContact O-CB 3.29Å; E513-H517 PolarHBondContact O-N 3.15Å; R514-H517 PolarHBondContact O-N 3.45Å; H517-C519 PolarHBondContact O-N 2.95Å; H517-G520 PolarHBondContact O-N 3.48Å; H517-G520 VanDerWaalsContact O-N 3.11Å
518D67.8Low69Low123 Ų123102.1 Ų102.166%0.65855%0.547SS*.Hα-helixtrans-65.7-27.5178.1-66-16.5000112.1R514 L515R514-D518 WeakPolarHBondContact O-CB 3.43Å; R514-D518 PolarHBondContact O-N 2.88Å; L515-D518 PolarHBondContact O-N 3.25Å
519C59.7Low68.4Low48 Ų4897.8 Ų97.832%0.32453%0.527SS..THydrogen-bonded Turntrans-89.89.9175.5-64.10000114.2L515 I516 H517L515-C519 VanDerWaalsContact O-CB 3.22Å; L515-C519 WeakPolarHBondContact O-CB 3.49Å; L515-C519 PolarHBondContact O-N 3.02Å; L515-C519 PolarHBondContact O-SG 3.23Å; I516-C519 CarbonylContact O-C 3.58Å; I516-C519 PolarHBondContact O-N 3.21Å; H517-C519 PolarHBondContact O-N 2.95Å
520G66.1Low68.2Low72 Ų7299.7 Ų99.774%0.74253%0.534SS*.THydrogen-bonded Turntrans74.425.217400000115I516 H517I516-G520 PolarHBondContact O-N 3.38Å; H517-G520 PolarHBondContact O-N 3.48Å; H517-G520 VanDerWaalsContact O-N 3.11Å
521G63.7Low68.1Low55 Ų5597 Ų9757%0.56753%0.528SS*.THydrogen-bonded Turntrans91.28170.100000116.3I516I516-G521 PolarHBondContact O-N 2.67Å
522Q55.9Low68.2Low136 Ų13694.8 Ų94.864%0.63652%0.521SS*.SBendtrans-113.5135.8174.4-69.8-176.3-3.400111.6I524Q522-I524 VanDerWaalsContact C-N 3.34Å; Q522-I524 HydrophobicContact CB-CD1 4.23Å; Q522-I524 HydrophobicContact CB-CG1 4.16Å; Q522-I524 PolarHBondContact O-N 2.94Å
523E57.9Low68.6Low174 Ų17495.4 Ų95.481%0.81353%0.525SS*.  trans-70.886.1175.9-69.5-177.3173.400110.1I516I516-E523 HydrophobicContact CD1-CG 4.24Å
524I56.3Low68.9Low55 Ų5593.7 Ų93.728%0.28252%0.52SS..  trans-106.6129.6177.4-60.7173.5000107.9Q522 D528Q522-I524 VanDerWaalsContact C-N 3.34Å; Q522-I524 HydrophobicContact CB-CD1 4.23Å; Q522-I524 HydrophobicContact CB-CG1 4.16Å; Q522-I524 PolarHBondContact O-N 2.94Å; I524-D528 HydrophobicContact CG2-CB 3.22Å
525G65Low69.6Low34 Ų3490.3 Ų90.335%0.35151%0.514SS..  trans-59.7155.9-177.600000112.4L527 D528 A529G525-L527 PolarHBondContact O-N 3.3Å; G525-L527 VanDerWaalsContact O-N 3.15Å; G525-D528 CarbonylContact O-C 3.6Å; G525-D528 PolarHBondContact O-N 2.94Å; G525-A529 PolarHBondContact O-N 3.43Å
526P66.7Low70.2Confident116 Ų11692.1 Ų92.175%0.75352%0.517SS*.Hα-helixtrans-58.2-33.8-173.418.8-30.2000113.8Q530P526-Q530 WeakPolarHBondContact O-CB 3.44Å; P526-Q530 PolarHBondContact O-N 2.97Å
527L73.4Confident71.1Confident129 Ų12992.3 Ų92.368%0.67553%0.525SS*.Hα-helixtrans-68.6-44.5173.8-79.6160.2000111.7G525 Q530 V531G525-L527 PolarHBondContact O-N 3.3Å; G525-L527 VanDerWaalsContact O-N 3.15Å; L527-Q530 CarbonylContact O-C 3.53Å; L527-Q530 WeakPolarHBondContact O-CB 3.36Å; L527-Q530 PolarHBondContact O-N 3.42Å; L527-V531 VanDerWaalsContact O-CG2 3.29Å; L527-V531 WeakPolarHBondContact O-CG2 3.34Å; L527-V531 PolarHBondContact O-N 2.92Å
528D71Confident71.9Confident97 Ų9789.1 Ų89.152%0.51951%0.512SS..Hα-helixtrans-70.1-33.2178.5-69.7-30000112I524 G525 Q530 V531 N532I524-D528 HydrophobicContact CG2-CB 3.22Å; G525-D528 CarbonylContact O-C 3.6Å; G525-D528 PolarHBondContact O-N 2.94Å; D528-Q530 VanDerWaalsContact C-N 3.34Å; D528-V531 PolarHBondContact O-N 2.95Å; D528-N532 WeakPolarHBondContact O-CB 3.4Å; D528-N532 VanDerWaalsContact O-CG 3.29Å; D528-N532 PolarHBondContact O-N 3.2Å
529A68.4Low73Confident16 Ų1684.2 Ų84.213%0.13249%0.491CS..Hα-helixtrans-65.4-39.5170.600000111G525 N532 N533G525-A529 PolarHBondContact O-N 3.43Å; A529-N532 PolarHBondContact O-N 3.41Å; A529-N533 WeakPolarHBondContact O-CB 3.39Å; A529-N533 PolarHBondContact O-N 2.92Å
530Q76.1Confident74.4Confident117 Ų11787.1 Ų87.155%0.54750%0.503SS..Hα-helixtrans-66.7-40.4173.2-166.917217.200111.4P526 L527 D528 N533 L534P526-Q530 WeakPolarHBondContact O-CB 3.44Å; P526-Q530 PolarHBondContact O-N 2.97Å; L527-Q530 CarbonylContact O-C 3.53Å; L527-Q530 WeakPolarHBondContact O-CB 3.36Å; L527-Q530 PolarHBondContact O-N 3.42Å; D528-Q530 VanDerWaalsContact C-N 3.34Å; Q530-N533 PolarHBondContact O-N 2.74Å; Q530-L534 HydrophobicContact CG-CD1 4.26Å; Q530-L534 VanDerWaalsContact O-CB 3.31Å; Q530-L534 WeakPolarHBondContact O-CB 3.14Å; Q530-L534 WeakPolarHBondContact O-CG 3.28Å; Q530-L534 PolarHBondContact O-N 2.84Å
531V77.3Confident75.6Confident68 Ų6889 Ų8941%0.41249%0.49SS..Hα-helixtrans-62.9-43.1173.3169.50000110.8L527 D528 L534 N535L527-V531 VanDerWaalsContact O-CG2 3.29Å; L527-V531 WeakPolarHBondContact O-CG2 3.34Å; L527-V531 PolarHBondContact O-N 2.92Å; D528-V531 PolarHBondContact O-N 2.95Å; V531-L534 CarbonylContact O-C 3.55Å; V531-L534 PolarHBondContact O-N 3.42Å; V531-N535 VanDerWaalsContact O-CB 3.32Å; V531-N535 WeakPolarHBondContact O-CB 3.48Å; V531-N535 PolarHBondContact O-N 3.31Å; V531-N535 PolarHBondContact O-ND2 3.39Å
532N79.9Confident76.9Confident71 Ų7192.3 Ų92.338%0.3849%0.491SS..Hα-helixtrans-65.2-40.6176.2-77.8-18.8000112.1D528 A529 N535 K536D528-N532 WeakPolarHBondContact O-CB 3.4Å; D528-N532 VanDerWaalsContact O-CG 3.29Å; D528-N532 PolarHBondContact O-N 3.2Å; A529-N532 PolarHBondContact O-N 3.41Å; N532-N535 PolarHBondContact O-N 2.8Å; N532-K536 WeakPolarHBondContact O-CB 3.32Å; N532-K536 WeakPolarHBondContact O-CG 3.46Å; N532-K536 PolarHBondContact O-N 2.95Å
533N80.1Confident78.6Confident103 Ų10390.9 Ų90.955%0.55149%0.488SS*.Hα-helixtrans-66.6-39.3173.9-78.8-17.5000111.9A529 Q530 K536 A537A529-N533 WeakPolarHBondContact O-CB 3.39Å; A529-N533 PolarHBondContact O-N 2.92Å; Q530-N533 PolarHBondContact O-N 2.74Å; N533-K536 PolarHBondContact O-N 3.26Å; N533-A537 VanDerWaalsContact O-CB 3.26Å; N533-A537 WeakPolarHBondContact O-CB 3.44Å; N533-A537 PolarHBondContact O-N 3.31Å
534L81.4Confident80.2Confident94 Ų9486.7 Ų86.749%0.49247%0.468SS..Hα-helixtrans-66.5-40.4173.8-74.2171.5000111.1Q530 V531 A537 I538Q530-L534 HydrophobicContact CG-CD1 4.26Å; Q530-L534 VanDerWaalsContact O-CB 3.31Å; Q530-L534 WeakPolarHBondContact O-CB 3.14Å; Q530-L534 WeakPolarHBondContact O-CG 3.28Å; Q530-L534 PolarHBondContact O-N 2.84Å; V531-L534 CarbonylContact O-C 3.55Å; V531-L534 PolarHBondContact O-N 3.42Å; L534-A537 CarbonylContact O-C 3.53Å; L534-A537 PolarHBondContact O-N 3.49Å; L534-I538 VanDerWaalsContact O-CB 3.28Å; L534-I538 WeakPolarHBondContact O-CB 3Å; L534-I538 WeakPolarHBondContact O-CD1 3.3Å; L534-I538 WeakPolarHBondContact O-CG1 3.46Å; L534-I538 PolarHBondContact O-N 3.38Å
535N86.6Confident81.8Confident90 Ų9088.4 Ų88.448%0.48148%0.477SS..Hα-helixtrans-65.8-40.9175.5-74.3-23.2000111.5V531 N532 I538 G539V531-N535 VanDerWaalsContact O-CB 3.32Å; V531-N535 WeakPolarHBondContact O-CB 3.48Å; V531-N535 PolarHBondContact O-N 3.31Å; V531-N535 PolarHBondContact O-ND2 3.39Å; N532-N535 PolarHBondContact O-N 2.8Å; N535-I538 PolarHBondContact O-N 3.34Å; N535-G539 PolarHBondContact O-N 3.34Å
536K83.3Confident83.1Confident142 Ų14288.1 Ų88.162%0.61747%0.474SS*.Hα-helixtrans-62.8-43.4171-77.4-180-179.3177.20111.3N532 N533 G539 L540N532-K536 WeakPolarHBondContact O-CB 3.32Å; N532-K536 WeakPolarHBondContact O-CG 3.46Å; N532-K536 PolarHBondContact O-N 2.95Å; N533-K536 PolarHBondContact O-N 3.26Å; K536-G539 PolarHBondContact O-N 3.01Å; K536-L540 WeakPolarHBondContact O-CB 3.39Å; K536-L540 VanDerWaalsContact O-CG 3.29Å; K536-L540 WeakPolarHBondContact O-CG 3.36Å; K536-L540 PolarHBondContact O-N 2.82Å
537A86.4Confident84.3Confident48 Ų4889 Ų8940%0.39747%0.468SS..Hα-helixtrans-66.6-39.317800000112.1N533 L534 K541N533-A537 VanDerWaalsContact O-CB 3.26Å; N533-A537 WeakPolarHBondContact O-CB 3.44Å; N533-A537 PolarHBondContact O-N 3.31Å; L534-A537 CarbonylContact O-C 3.53Å; L534-A537 PolarHBondContact O-N 3.49Å; A537-K541 WeakPolarHBondContact O-CB 3.32Å; A537-K541 VanDerWaalsContact O-CG 3.25Å; A537-K541 WeakPolarHBondContact O-CG 3.5Å; A537-K541 PolarHBondContact O-N 3Å
538I87Confident85.2Confident83 Ų8387.9 Ų87.943%0.42646%0.462SS..Hα-helixtrans-64.4-44.9173.4-71.7163.4000109.6L534 N535 K541 Q542L534-I538 VanDerWaalsContact O-CB 3.28Å; L534-I538 WeakPolarHBondContact O-CB 3Å; L534-I538 WeakPolarHBondContact O-CD1 3.3Å; L534-I538 WeakPolarHBondContact O-CG1 3.46Å; L534-I538 PolarHBondContact O-N 3.38Å; N535-I538 PolarHBondContact O-N 3.34Å; I538-K541 CarbonylContact O-C 3.6Å; I538-K541 PolarHBondContact O-N 2.88Å; I538-Q542 HydrophobicContact CG2-CG 4.32Å; I538-Q542 WeakPolarHBondContact O-CB 3.48Å; I538-Q542 VanDerWaalsContact O-CG 3.27Å; I538-Q542 WeakPolarHBondContact O-CG 3.47Å; I538-Q542 PolarHBondContact O-N 2.93Å
539G90.1Very high86.1Confident20 Ų2089 Ų8921%0.20646%0.464CS..Hα-helixtrans-59.3-49.9175.200000112N535 K536 K541 Q542 D543N535-G539 PolarHBondContact O-N 3.34Å; K536-G539 PolarHBondContact O-N 3.01Å; G539-K541 VanDerWaalsContact C-N 3.28Å; G539-K541 PolarHBondContact O-N 3.3Å; G539-Q542 CarbonylContact O-C 3.59Å; G539-Q542 WeakPolarHBondContact O-CB 3.38Å; G539-Q542 PolarHBondContact O-N 3.45Å; G539-D543 PolarHBondContact O-N 2.97Å
540L90.5Very high87.2Confident110 Ų11094.2 Ų94.258%0.57649%0.486SS*.Hα-helixtrans-58.9-39.1174.5-72171.9000112K536 D543 E544K536-L540 WeakPolarHBondContact O-CB 3.39Å; K536-L540 VanDerWaalsContact O-CG 3.29Å; K536-L540 WeakPolarHBondContact O-CG 3.36Å; K536-L540 PolarHBondContact O-N 2.82Å; L540-D543 PolarHBondContact O-N 2.91Å; L540-E544 WeakPolarHBondContact O-CB 3.49Å; L540-E544 WeakPolarHBondContact O-CG 3.27Å; L540-E544 PolarHBondContact O-N 3.34Å
541K90.2Very high87.9Confident111 Ų11192.9 Ų92.948%0.48348%0.48SS..Hα-helixtrans-70.5-33.5175.1-72.4-65171.9-143.30112.9A537 I538 G539 E544 I545A537-K541 WeakPolarHBondContact O-CB 3.32Å; A537-K541 VanDerWaalsContact O-CG 3.25Å; A537-K541 WeakPolarHBondContact O-CG 3.5Å; A537-K541 PolarHBondContact O-N 3Å; I538-K541 CarbonylContact O-C 3.6Å; I538-K541 PolarHBondContact O-N 2.88Å; G539-K541 VanDerWaalsContact C-N 3.28Å; G539-K541 PolarHBondContact O-N 3.3Å; K541-E544 WeakPolarHBondContact CD-OE2 3.47Å; K541-E544 IonicContact NZ-OE1 2.82Å; K541-E544 PolarHBondContact NZ-OE1 2.84Å; K541-E544 IonicContact NZ-OE2 3.41Å; K541-E544 PolarHBondContact NZ-OE2 3.36Å; K541-I545 WeakPolarHBondContact O-CB 3.36Å; K541-I545 WeakPolarHBondContact O-CD1 3.26Å; K541-I545 WeakPolarHBondContact O-CG1 3.33Å; K541-I545 PolarHBondContact O-N 3.38Å
542Q91.3Very high88.7Confident124 Ų12497 Ų9758%0.57949%0.488SS*.Hα-helixtrans-68.4-39.7173.2-76.2166.6-23.300111.2I538 G539 I545 G546I538-Q542 HydrophobicContact CG2-CG 4.32Å; I538-Q542 WeakPolarHBondContact O-CB 3.48Å; I538-Q542 VanDerWaalsContact O-CG 3.27Å; I538-Q542 WeakPolarHBondContact O-CG 3.47Å; I538-Q542 PolarHBondContact O-N 2.93Å; G539-Q542 CarbonylContact O-C 3.59Å; G539-Q542 WeakPolarHBondContact O-CB 3.38Å; G539-Q542 PolarHBondContact O-N 3.45Å; Q542-I545 PolarHBondContact O-N 3.4Å; Q542-G546 PolarHBondContact O-N 2.95Å
543D90.8Very high89.3Confident107 Ų10798 Ų9857%0.57249%0.493SS*.Hα-helixtrans-63.9-47.5173.6-67.2-23.5000110.6G539 L540 I545 G546 E547G539-D543 PolarHBondContact O-N 2.97Å; L540-D543 PolarHBondContact O-N 2.91Å; D543-I545 VanDerWaalsContact C-N 3.34Å; D543-I545 PolarHBondContact O-N 2.8Å; D543-G546 PolarHBondContact O-N 3.15Å; D543-G546 VanDerWaalsContact O-N 3.15Å; D543-E547 WeakPolarHBondContact O-CG 3.33Å; D543-E547 PolarHBondContact O-N 2.88Å
544E93Very high89.8Confident86 Ų86100.2 Ų100.240%0.40249%0.493SS..Hα-helixtrans-58.1-43.2173.7-77.4176.9-152.400112.1L540 K541 E547 L548L540-E544 WeakPolarHBondContact O-CB 3.49Å; L540-E544 WeakPolarHBondContact O-CG 3.27Å; L540-E544 PolarHBondContact O-N 3.34Å; K541-E544 WeakPolarHBondContact CD-OE2 3.47Å; K541-E544 IonicContact NZ-OE1 2.82Å; K541-E544 PolarHBondContact NZ-OE1 2.84Å; K541-E544 IonicContact NZ-OE2 3.41Å; K541-E544 PolarHBondContact NZ-OE2 3.36Å; E544-E547 PolarHBondContact O-N 3.2Å; E544-L548 WeakPolarHBondContact O-CB 3.44Å; E544-L548 VanDerWaalsContact O-CG 3.27Å; E544-L548 WeakPolarHBondContact O-CG 3.34Å; E544-L548 PolarHBondContact O-N 2.78Å
545I90.2Very high90.3Very high90 Ų90100.6 Ų100.646%0.46249%0.493SS..Hα-helixtrans-62.4-44.7175.6-72.9163.6000110K541 Q542 D543 E547 L548 E549K541-I545 WeakPolarHBondContact O-CB 3.36Å; K541-I545 WeakPolarHBondContact O-CD1 3.26Å; K541-I545 WeakPolarHBondContact O-CG1 3.33Å; K541-I545 PolarHBondContact O-N 3.38Å; Q542-I545 PolarHBondContact O-N 3.4Å; D543-I545 VanDerWaalsContact C-N 3.34Å; D543-I545 PolarHBondContact O-N 2.8Å; I545-E547 VanDerWaalsContact C-N 3.35Å; I545-E547 PolarHBondContact O-N 2.64Å; I545-L548 PolarHBondContact O-N 3.34Å; I545-E549 HydrophobicContact CG2-CG 4.26Å; I545-E549 WeakPolarHBondContact O-CB 3.04Å; I545-E549 WeakPolarHBondContact O-CG 3.43Å; I545-E549 PolarHBondContact O-N 2.79Å
546G92.4Very high90.5Very high28 Ų28100 Ų10029%0.28949%0.487SS..Hα-helixtrans-61.7-40.4177.300000112.9Q542 D543 E549 Q550Q542-G546 PolarHBondContact O-N 2.95Å; D543-G546 PolarHBondContact O-N 3.15Å; D543-G546 VanDerWaalsContact O-N 3.15Å; G546-E549 PolarHBondContact O-N 2.9Å; G546-Q550 WeakPolarHBondContact O-CG 3.48Å; G546-Q550 PolarHBondContact O-N 3.25Å
547E91.8Very high90.8Very high134 Ų13498.3 Ų98.363%0.62649%0.485SS*.Hα-helixtrans-64.3-43.8173.8-73.1-174.917100111.9D543 E544 I545 Q550 Q551D543-E547 WeakPolarHBondContact O-CG 3.33Å; D543-E547 PolarHBondContact O-N 2.88Å; E544-E547 PolarHBondContact O-N 3.2Å; I545-E547 VanDerWaalsContact C-N 3.35Å; I545-E547 PolarHBondContact O-N 2.64Å; E547-Q550 PolarHBondContact O-N 3.44Å; E547-Q551 WeakPolarHBondContact O-CB 3.45Å; E547-Q551 PolarHBondContact O-N 3.4Å
548L92.6Very high91.1Very high107 Ų107101.9 Ų101.956%0.5649%0.493SS*.Hα-helixtrans-66.7-38177.1-73.5171.6000112.2E544 I545 Q551 W552E544-L548 WeakPolarHBondContact O-CB 3.44Å; E544-L548 VanDerWaalsContact O-CG 3.27Å; E544-L548 WeakPolarHBondContact O-CG 3.34Å; E544-L548 PolarHBondContact O-N 2.78Å; I545-L548 PolarHBondContact O-N 3.34Å; L548-Q551 PolarHBondContact O-N 2.83Å; L548-W552 VanDerWaalsContact O-CB 3.24Å; L548-W552 WeakPolarHBondContact O-CB 3.32Å; L548-W552 PolarHBondContact O-N 2.87Å
549E89.9Confident91.3Very high119 Ų119102 Ų10256%0.55649%0.494SS*.Hα-helixtrans-64.7-42.8173.3-76.5179.4173.300111.2I545 G546 W552 L553I545-E549 HydrophobicContact CG2-CG 4.26Å; I545-E549 WeakPolarHBondContact O-CB 3.04Å; I545-E549 WeakPolarHBondContact O-CG 3.43Å; I545-E549 PolarHBondContact O-N 2.79Å; G546-E549 PolarHBondContact O-N 2.9Å; E549-W552 PolarHBondContact O-N 3.02Å; E549-L553 WeakPolarHBondContact O-CB 3.45Å; E549-L553 WeakPolarHBondContact O-CG 3.37Å; E549-L553 PolarHBondContact O-N 3.45Å
550Q89.6Confident91.5Very high127 Ų127104 Ų10459%0.59350%0.503SS*.Hα-helixtrans-65.1-38.8173.6-79-171.88.900112.5G546 E547 R554G546-Q550 WeakPolarHBondContact O-CG 3.48Å; G546-Q550 PolarHBondContact O-N 3.25Å; E547-Q550 PolarHBondContact O-N 3.44Å; Q550-R554 WeakPolarHBondContact O-CB 3.43Å; Q550-R554 WeakPolarHBondContact O-CG 3.33Å; Q550-R554 PolarHBondContact O-N 3.24Å; Q550-R554 PolarHBondContact O-NE 2.84Å
551Q91.2Very high91.6Very high88 Ų88102.4 Ų102.441%0.41150%0.497SS..Hα-helixtrans-64.9-46.9174.6-175.6173.6-4.600110.8E547 L548 L553 R554 E555E547-Q551 WeakPolarHBondContact O-CB 3.45Å; E547-Q551 PolarHBondContact O-N 3.4Å; L548-Q551 PolarHBondContact O-N 2.83Å; Q551-L553 PolarHBondContact O-N 3.34Å; Q551-R554 WeakPolarHBondContact O-CB 3.45Å; Q551-R554 PolarHBondContact O-N 3.43Å; Q551-R554 VanDerWaalsContact O-N 3.14Å; Q551-E555 HydrophobicContact CG-CG 4.48Å; Q551-E555 WeakPolarHBondContact CG-OE1 3.5Å; Q551-E555 PolarHBondContact NE2-OE1 3.15Å; Q551-E555 WeakPolarHBondContact O-CG 3.28Å; Q551-E555 PolarHBondContact O-N 3.48Å
552W95.5Very high91.7Very high156 Ų156101.4 Ų101.459%0.59150%0.497SS*.Hα-helixtrans-59.8-43.3176.6-178.584.6000112L548 E549 R554 E555 Q556L548-W552 VanDerWaalsContact O-CB 3.24Å; L548-W552 WeakPolarHBondContact O-CB 3.32Å; L548-W552 PolarHBondContact O-N 2.87Å; E549-W552 PolarHBondContact O-N 3.02Å; W552-R554 VanDerWaalsContact C-N 3.34Å; W552-R554 PolarHBondContact O-N 3.06Å; W552-E555 PolarHBondContact O-N 2.67Å; W552-Q556 HydrophobicContact CH2-CG 4.35Å; W552-Q556 WeakPolarHBondContact O-CB 3.43Å; W552-Q556 PolarHBondContact O-N 2.99Å
553L90.8Very high91.8Very high92 Ų9298.8 Ų98.848%0.48249%0.486SS..Hα-helixtrans-63.6-37.5175.2-77.3170.5000112.5E549 Q551 N557E549-L553 WeakPolarHBondContact O-CB 3.45Å; E549-L553 WeakPolarHBondContact O-CG 3.37Å; E549-L553 PolarHBondContact O-N 3.45Å; Q551-L553 PolarHBondContact O-N 3.34Å; L553-N557 WeakPolarHBondContact O-CB 3.45Å; L553-N557 VanDerWaalsContact O-CG 3.27Å; L553-N557 PolarHBondContact O-N 3.09Å; L553-N557 PolarHBondContact O-ND2 3.12Å
554R90.3Very high91.9Very high148 Ų14897.7 Ų97.756%0.55848%0.48SS*.Hα-helixtrans-64.6-50.4174.2-78.5-178-73.7174.5-2.7111.2Q550 Q551 W552 Q556 N557 E558Q550-R554 WeakPolarHBondContact O-CB 3.43Å; Q550-R554 WeakPolarHBondContact O-CG 3.33Å; Q550-R554 PolarHBondContact O-N 3.24Å; Q550-R554 PolarHBondContact O-NE 2.84Å; Q551-R554 WeakPolarHBondContact O-CB 3.45Å; Q551-R554 PolarHBondContact O-N 3.43Å; Q551-R554 VanDerWaalsContact O-N 3.14Å; W552-R554 VanDerWaalsContact C-N 3.34Å; W552-R554 PolarHBondContact O-N 3.06Å; R554-Q556 VanDerWaalsContact C-N 3.32Å; R554-Q556 PolarHBondContact O-N 3.4Å; R554-N557 PolarHBondContact O-N 3.06Å; R554-E558 WeakPolarHBondContact O-CG 3.46Å; R554-E558 PolarHBondContact O-N 3.45Å
555E92.3Very high91.8Very high103 Ų10398.5 Ų98.548%0.48148%0.484SS..Hα-helixtrans-62.5-38.6178.3-70.8177.3-167.200111.7Q551 W552 E558 L559Q551-E555 HydrophobicContact CG-CG 4.48Å; Q551-E555 WeakPolarHBondContact CG-OE1 3.5Å; Q551-E555 PolarHBondContact NE2-OE1 3.15Å; Q551-E555 WeakPolarHBondContact O-CG 3.28Å; Q551-E555 PolarHBondContact O-N 3.48Å; W552-E555 PolarHBondContact O-N 2.67Å; E555-E558 PolarHBondContact O-N 2.85Å; E555-L559 VanDerWaalsContact O-CB 3.3Å; E555-L559 WeakPolarHBondContact O-CB 3.36Å; E555-L559 PolarHBondContact O-N 3.44Å
556Q91.2Very high91.9Very high77 Ų77101.7 Ų101.736%0.3649%0.49SS..Hα-helixtrans-66-41.4175-175.663.123.800111.7W552 R554 L559 V560W552-Q556 HydrophobicContact CH2-CG 4.35Å; W552-Q556 WeakPolarHBondContact O-CB 3.43Å; W552-Q556 PolarHBondContact O-N 2.99Å; R554-Q556 VanDerWaalsContact C-N 3.32Å; R554-Q556 PolarHBondContact O-N 3.4Å; Q556-L559 PolarHBondContact O-N 3.18Å; Q556-V560 VanDerWaalsContact O-CG2 3.31Å; Q556-V560 WeakPolarHBondContact O-CG2 3.03Å; Q556-V560 PolarHBondContact O-N 2.75Å
557N90.7Very high92Very high106 Ų106103.3 Ų103.357%0.56749%0.492SS*.Hα-helixtrans-65.3-43.6174.8-79.4-29.5000111.5L553 R554 L559 V560 V561L553-N557 WeakPolarHBondContact O-CB 3.45Å; L553-N557 VanDerWaalsContact O-CG 3.27Å; L553-N557 PolarHBondContact O-N 3.09Å; L553-N557 PolarHBondContact O-ND2 3.12Å; R554-N557 PolarHBondContact O-N 3.06Å; N557-L559 VanDerWaalsContact C-N 3.33Å; N557-L559 PolarHBondContact O-N 2.87Å; N557-V560 PolarHBondContact O-N 2.95Å; N557-V561 WeakPolarHBondContact O-CG2 3.35Å; N557-V561 PolarHBondContact O-N 2.76Å
558E92.3Very high92Very high124 Ų124103.8 Ų103.858%0.57949%0.492SS*.Hα-helixtrans-61.1-41.5174-75.9-178-176.500111.5R554 E555 V560 V561 N562R554-E558 WeakPolarHBondContact O-CG 3.46Å; R554-E558 PolarHBondContact O-N 3.45Å; E555-E558 PolarHBondContact O-N 2.85Å; E558-V560 PolarHBondContact O-N 2.9Å; E558-V561 PolarHBondContact O-N 3.09Å; E558-N562 WeakPolarHBondContact O-CB 3.45Å; E558-N562 PolarHBondContact O-N 3.26Å; E558-N562 PolarHBondContact O-ND2 2.78Å; E558-N562 VanDerWaalsContact O-ND2 3.13Å
559L91.8Very high92Very high86 Ų86104 Ų10445%0.4549%0.493SS..Hα-helixtrans-61.4-42.9174.9-178.462.9000111.6E555 Q556 N557 N562 I563E555-L559 VanDerWaalsContact O-CB 3.3Å; E555-L559 WeakPolarHBondContact O-CB 3.36Å; E555-L559 PolarHBondContact O-N 3.44Å; Q556-L559 PolarHBondContact O-N 3.18Å; N557-L559 VanDerWaalsContact C-N 3.33Å; N557-L559 PolarHBondContact O-N 2.87Å; L559-N562 PolarHBondContact O-N 3.4Å; L559-I563 HydrophobicContact CD1-CD1 4.2Å; L559-I563 HydrophobicContact CD1-CG1 4.37Å; L559-I563 HydrophobicContact CG-CD1 3.91Å; L559-I563 HydrophobicContact CG-CG1 4.49Å; L559-I563 WeakPolarHBondContact O-CB 3.38Å; L559-I563 WeakPolarHBondContact O-CG1 3.38Å; L559-I563 PolarHBondContact O-N 3.49Å
560V93.3Very high92.1Very high62 Ų62100.7 Ų100.738%0.37649%0.487SS..Hα-helixtrans-64.1-41.2175.8170.90000111.3Q556 N557 E558 I563 N564Q556-V560 VanDerWaalsContact O-CG2 3.31Å; Q556-V560 WeakPolarHBondContact O-CG2 3.03Å; Q556-V560 PolarHBondContact O-N 2.75Å; N557-V560 PolarHBondContact O-N 2.95Å; E558-V560 PolarHBondContact O-N 2.9Å; V560-I563 PolarHBondContact O-N 3.15Å; V560-N564 WeakPolarHBondContact O-CB 3.41Å; V560-N564 VanDerWaalsContact O-CG 3.26Å; V560-N564 PolarHBondContact O-N 3.3Å; V560-N564 PolarHBondContact O-ND2 3.29Å
561V92.9Very high92.2Very high76 Ų76101.1 Ų101.146%0.46149%0.489SS..Hα-helixtrans-60.5-48.8173.7171.70000110.4N557 E558 I563 N564 E565N557-V561 WeakPolarHBondContact O-CG2 3.35Å; N557-V561 PolarHBondContact O-N 2.76Å; E558-V561 PolarHBondContact O-N 3.09Å; V561-I563 VanDerWaalsContact C-N 3.35Å; V561-I563 PolarHBondContact O-N 3.28Å; V561-N564 PolarHBondContact O-N 3.32Å; V561-E565 WeakPolarHBondContact O-CG 3.35Å; V561-E565 PolarHBondContact O-N 3.09Å
562N92.9Very high92.3Very high90 Ų9099.2 Ų99.248%0.48149%0.485SS..Hα-helixtrans-62.6-37.6178.5-72.3-33.2000112.6E558 L559 E565 R566E558-N562 WeakPolarHBondContact O-CB 3.45Å; E558-N562 PolarHBondContact O-N 3.26Å; E558-N562 PolarHBondContact O-ND2 2.78Å; E558-N562 VanDerWaalsContact O-ND2 3.13Å; L559-N562 PolarHBondContact O-N 3.4Å; N562-E565 PolarHBondContact O-N 2.97Å; N562-R566 VanDerWaalsContact O-CB 3.26Å; N562-R566 WeakPolarHBondContact O-CB 3.25Å; N562-R566 PolarHBondContact O-N 3.25Å
563I92.5Very high92.1Very high69 Ų6995.4 Ų95.435%0.35448%0.479SS..Hα-helixtrans-65.3-46.2174.4-72166000110.3L559 V560 V561 E565 R566 D567L559-I563 HydrophobicContact CD1-CD1 4.2Å; L559-I563 HydrophobicContact CD1-CG1 4.37Å; L559-I563 HydrophobicContact CG-CD1 3.91Å; L559-I563 HydrophobicContact CG-CG1 4.49Å; L559-I563 WeakPolarHBondContact O-CB 3.38Å; L559-I563 WeakPolarHBondContact O-CG1 3.38Å; L559-I563 PolarHBondContact O-N 3.49Å; V560-I563 PolarHBondContact O-N 3.15Å; V561-I563 VanDerWaalsContact C-N 3.35Å; V561-I563 PolarHBondContact O-N 3.28Å; I563-E565 VanDerWaalsContact C-N 3.32Å; I563-E565 PolarHBondContact O-N 3.43Å; I563-R566 WeakPolarHBondContact O-CB 3.37Å; I563-R566 PolarHBondContact O-N 2.87Å; I563-D567 WeakPolarHBondContact O-CB 3.38Å; I563-D567 VanDerWaalsContact O-CG 3.26Å; I563-D567 PolarHBondContact O-N 3.44Å
564N92.4Very high92.1Very high84 Ų8494.6 Ų94.645%0.44948%0.478SS..Hα-helixtrans-62.8-38.9177.5-72.8-30.9000111.9V560 V561 K568V560-N564 WeakPolarHBondContact O-CB 3.41Å; V560-N564 VanDerWaalsContact O-CG 3.26Å; V560-N564 PolarHBondContact O-N 3.3Å; V560-N564 PolarHBondContact O-ND2 3.29Å; V561-N564 PolarHBondContact O-N 3.32Å; N564-K568 VanDerWaalsContact O-CG 3.3Å; N564-K568 WeakPolarHBondContact O-CG 3.28Å; N564-K568 PolarHBondContact O-N 2.9Å
565E92.5Very high92.2Very high103 Ų10395.8 Ų95.848%0.48148%0.482SS..Hα-helixtrans-66.6-43.7173.6-73.7-176.3178.200111.9V561 N562 I563 D567 K568 L569V561-E565 WeakPolarHBondContact O-CG 3.35Å; V561-E565 PolarHBondContact O-N 3.09Å; N562-E565 PolarHBondContact O-N 2.97Å; I563-E565 VanDerWaalsContact C-N 3.32Å; I563-E565 PolarHBondContact O-N 3.43Å; E565-D567 VanDerWaalsContact C-N 3.3Å; E565-D567 PolarHBondContact O-N 3.43Å; E565-K568 PolarHBondContact O-N 3.28Å; E565-L569 WeakPolarHBondContact O-CB 3.5Å; E565-L569 VanDerWaalsContact O-CG 3.29Å; E565-L569 WeakPolarHBondContact O-CG 3.41Å; E565-L569 PolarHBondContact O-N 2.9Å
566R92.1Very high92.2Very high157 Ų15795.4 Ų95.459%0.59248%0.483SS*.Hα-helixtrans-57.8-43.6174.1-174.6-15673.4162.1-0.3111.3N562 I563 L569 A570N562-R566 VanDerWaalsContact O-CB 3.26Å; N562-R566 WeakPolarHBondContact O-CB 3.25Å; N562-R566 PolarHBondContact O-N 3.25Å; I563-R566 WeakPolarHBondContact O-CB 3.37Å; I563-R566 PolarHBondContact O-N 2.87Å; R566-L569 PolarHBondContact O-N 3.27Å; R566-A570 WeakPolarHBondContact O-CB 3.34Å; R566-A570 PolarHBondContact O-N 3.48Å
567D92.6Very high92.2Very high61 Ų6196.2 Ų96.233%0.32649%0.489SS..Hα-helixtrans-69.2-42-179-69.2-9000111.1I563 E565 L569 A570 E571I563-D567 WeakPolarHBondContact O-CB 3.38Å; I563-D567 VanDerWaalsContact O-CG 3.26Å; I563-D567 PolarHBondContact O-N 3.44Å; E565-D567 VanDerWaalsContact C-N 3.3Å; E565-D567 PolarHBondContact O-N 3.43Å; D567-L569 VanDerWaalsContact C-N 3.34Å; D567-L569 PolarHBondContact O-N 3.26Å; D567-A570 PolarHBondContact O-N 3.47Å; D567-E571 WeakPolarHBondContact O-CG 3.41Å; D567-E571 PolarHBondContact O-N 3.24Å
568K92.6Very high92.2Very high145 Ų14598.1 Ų98.163%0.6349%0.492SS*.Hα-helixtrans-59.3-43.1170.5-74.4173.3-177.3175.40112.3N564 E565 E571 S572N564-K568 VanDerWaalsContact O-CG 3.3Å; N564-K568 WeakPolarHBondContact O-CG 3.28Å; N564-K568 PolarHBondContact O-N 2.9Å; E565-K568 PolarHBondContact O-N 3.28Å; K568-E571 PolarHBondContact O-N 3.08Å; K568-S572 PolarHBondContact O-N 2.87Å
569L91.9Very high92.2Very high111 Ų11196.7 Ų96.758%0.58149%0.486SS*.Hα-helixtrans-65.5-42.3176.5-74172.9000111E565 R566 D567 E571 S572 V573E565-L569 WeakPolarHBondContact O-CB 3.5Å; E565-L569 VanDerWaalsContact O-CG 3.29Å; E565-L569 WeakPolarHBondContact O-CG 3.41Å; E565-L569 PolarHBondContact O-N 2.9Å; R566-L569 PolarHBondContact O-N 3.27Å; D567-L569 VanDerWaalsContact C-N 3.34Å; D567-L569 PolarHBondContact O-N 3.26Å; L569-E571 PolarHBondContact O-N 3.49Å; L569-S572 WeakPolarHBondContact CA-OG 3.32Å; L569-S572 WeakPolarHBondContact O-CB 3.33Å; L569-S572 PolarHBondContact O-N 2.96Å; L569-S572 VanDerWaalsContact O-N 3.15Å; L569-S572 PolarHBondContact O-OG 3.28Å; L569-V573 WeakPolarHBondContact O-CG2 3.5Å; L569-V573 PolarHBondContact O-N 2.92Å
570A92.2Very high92.1Very high50 Ų5097.4 Ų97.441%0.41349%0.49SS..Hα-helixtrans-60.8-44.2175.500000111.6R566 D567 S572 V573 T574R566-A570 WeakPolarHBondContact O-CB 3.34Å; R566-A570 PolarHBondContact O-N 3.48Å; D567-A570 PolarHBondContact O-N 3.47Å; A570-S572 VanDerWaalsContact C-N 3.34Å; A570-S572 PolarHBondContact O-N 3.47Å; A570-V573 PolarHBondContact O-N 3.29Å; A570-T574 WeakPolarHBondContact O-CG2 3.49Å; A570-T574 PolarHBondContact O-N 3.33Å
571E92.5Very high92Very high136 Ų13697.2 Ų97.264%0.63649%0.491SS*.Hα-helixtrans-58.8-44.5172.3-73.6-178.9178.800111.6D567 K568 L569 V573 T574 R575D567-E571 WeakPolarHBondContact O-CG 3.41Å; D567-E571 PolarHBondContact O-N 3.24Å; K568-E571 PolarHBondContact O-N 3.08Å; L569-E571 PolarHBondContact O-N 3.49Å; E571-V573 PolarHBondContact O-N 2.95Å; E571-T574 PolarHBondContact O-N 2.86Å; E571-T574 PolarHBondContact O-OG1 3.2Å; E571-R575 PolarHBondContact O-N 2.96Å
572S93.3Very high92Very high48 Ų4897.9 Ų97.934%0.33649%0.491SS..Hα-helixtrans-62.4-41.2177.181.80000112.5K568 L569 A570 R575 I576K568-S572 PolarHBondContact O-N 2.87Å; L569-S572 WeakPolarHBondContact CA-OG 3.32Å; L569-S572 WeakPolarHBondContact O-CB 3.33Å; L569-S572 PolarHBondContact O-N 2.96Å; L569-S572 VanDerWaalsContact O-N 3.15Å; L569-S572 PolarHBondContact O-OG 3.28Å; A570-S572 VanDerWaalsContact C-N 3.34Å; A570-S572 PolarHBondContact O-N 3.47Å; S572-R575 WeakPolarHBondContact O-CB 3.48Å; S572-R575 PolarHBondContact O-N 3.13Å; S572-I576 WeakPolarHBondContact O-CG1 3.31Å; S572-I576 PolarHBondContact O-N 2.82Å
573V91.3Very high92Very high76 Ų7699 Ų9946%0.46150%0.496SS..Hα-helixtrans-64.6-43.9176.7168.90000110.4L569 A570 E571 R575 I576 N577L569-V573 WeakPolarHBondContact O-CG2 3.5Å; L569-V573 PolarHBondContact O-N 2.92Å; A570-V573 PolarHBondContact O-N 3.29Å; E571-V573 PolarHBondContact O-N 2.95Å; V573-R575 VanDerWaalsContact C-N 3.3Å; V573-R575 PolarHBondContact O-N 2.82Å; V573-I576 PolarHBondContact O-N 3.41Å; V573-N577 WeakPolarHBondContact O-CB 3.16Å; V573-N577 PolarHBondContact O-N 3.4Å; V573-N577 PolarHBondContact O-ND2 3.39Å
574T90.6Very high91.9Very high75 Ų7599.1 Ų99.146%0.4650%0.501SS..Hα-helixtrans-63.3-37.1175.965.40000112A570 E571 K578A570-T574 WeakPolarHBondContact O-CG2 3.49Å; A570-T574 PolarHBondContact O-N 3.33Å; E571-T574 PolarHBondContact O-N 2.86Å; E571-T574 PolarHBondContact O-OG1 3.2Å; T574-K578 VanDerWaalsContact O-CG 3.28Å; T574-K578 WeakPolarHBondContact O-CG 3.29Å; T574-K578 PolarHBondContact O-N 2.83Å
575R91.9Very high91.8Very high173 Ų173100.8 Ų100.865%0.65351%0.506SS*.Hα-helixtrans-65.7-45.3175-176.1177.3176.4156.5-0.4111.7E571 S572 V573 K578 Q579E571-R575 PolarHBondContact O-N 2.96Å; S572-R575 WeakPolarHBondContact O-CB 3.48Å; S572-R575 PolarHBondContact O-N 3.13Å; V573-R575 VanDerWaalsContact C-N 3.3Å; V573-R575 PolarHBondContact O-N 2.82Å; R575-K578 PolarHBondContact O-N 3.47Å; R575-Q579 WeakPolarHBondContact O-CG 3.34Å; R575-Q579 PolarHBondContact O-N 3.43Å
576I92.9Very high91.8Very high95 Ų95101 Ų10149%0.48751%0.505SS..Hα-helixtrans-63.9-42.8177-69167.9000110.4S572 V573 K578 Q579 L580S572-I576 WeakPolarHBondContact O-CG1 3.31Å; S572-I576 PolarHBondContact O-N 2.82Å; V573-I576 PolarHBondContact O-N 3.41Å; I576-K578 VanDerWaalsContact C-N 3.34Å; I576-K578 PolarHBondContact O-N 3.26Å; I576-Q579 CarbonylContact O-C 3.56Å; I576-Q579 WeakPolarHBondContact O-CB 3.5Å; I576-Q579 PolarHBondContact O-N 2.91Å; I576-Q579 VanDerWaalsContact O-N 3.17Å; I576-L580 WeakPolarHBondContact O-CB 3.48Å; I576-L580 PolarHBondContact O-N 2.87Å
577N91.2Very high91.9Very high94 Ų9499.8 Ų99.850%0.50350%0.504SS..Hα-helixtrans-61.9-40.4176.1-76.4-18.7000112.3V573 L580 S581V573-N577 WeakPolarHBondContact O-CB 3.16Å; V573-N577 PolarHBondContact O-N 3.4Å; V573-N577 PolarHBondContact O-ND2 3.39Å; N577-L580 PolarHBondContact O-N 3.48Å; N577-S581 WeakPolarHBondContact O-CB 3.3Å; N577-S581 PolarHBondContact O-N 3.19Å
578K91.4Very high91.8Very high145 Ų145102 Ų10263%0.6352%0.515SS*.Hα-helixtrans-62.1-46.2172.5-73.7171.1-177.3176.60111.3T574 R575 I576 S581 I582T574-K578 VanDerWaalsContact O-CG 3.28Å; T574-K578 WeakPolarHBondContact O-CG 3.29Å; T574-K578 PolarHBondContact O-N 2.83Å; R575-K578 PolarHBondContact O-N 3.47Å; I576-K578 VanDerWaalsContact C-N 3.34Å; I576-K578 PolarHBondContact O-N 3.26Å; K578-S581 PolarHBondContact O-N 3.41Å; K578-I582 VanDerWaalsContact O-CG1 3.28Å; K578-I582 WeakPolarHBondContact O-CG1 3.27Å; K578-I582 PolarHBondContact O-N 3.01Å
579Q92.2Very high91.8Very high94 Ų94101.8 Ų101.844%0.43951%0.511SS..Hα-helixtrans-61.7-42.9176.6-74.3177.6-19.900112.1R575 I576 I582 L583R575-Q579 WeakPolarHBondContact O-CG 3.34Å; R575-Q579 PolarHBondContact O-N 3.43Å; I576-Q579 CarbonylContact O-C 3.56Å; I576-Q579 WeakPolarHBondContact O-CB 3.5Å; I576-Q579 PolarHBondContact O-N 2.91Å; I576-Q579 VanDerWaalsContact O-N 3.17Å; Q579-I582 PolarHBondContact O-N 3.15Å; Q579-L583 WeakPolarHBondContact O-CB 3.37Å; Q579-L583 WeakPolarHBondContact O-CG 3.35Å; Q579-L583 PolarHBondContact O-N 3.1Å
580L90Very high91.8Very high102 Ų102100.9 Ų100.953%0.53451%0.505SS..Hα-helixtrans-62.6-43.7177.3-172.3139.8000111I576 N577 I582 L583 T584I576-L580 WeakPolarHBondContact O-CB 3.48Å; I576-L580 PolarHBondContact O-N 2.87Å; N577-L580 PolarHBondContact O-N 3.48Å; L580-I582 PolarHBondContact O-N 3.24Å; L580-L583 PolarHBondContact O-N 3.33Å; L580-T584 HydrophobicContact CD2-CG2 4.17Å; L580-T584 WeakPolarHBondContact O-CG2 3.47Å; L580-T584 PolarHBondContact O-N 3.35Å; L580-T584 PolarHBondContact O-OG1 3.38Å
581S90.4Very high91.9Very high58 Ų58102 Ų10241%0.40650%0.504SS..Hα-helixtrans-61.4-40.9174.4-173.40000112.8N577 K578 T584 Q585N577-S581 WeakPolarHBondContact O-CB 3.3Å; N577-S581 PolarHBondContact O-N 3.19Å; K578-S581 PolarHBondContact O-N 3.41Å; S581-T584 WeakPolarHBondContact CA-OG1 3.37Å; S581-T584 PolarHBondContact O-OG1 2.88Å; S581-Q585 WeakPolarHBondContact O-CG 3.31Å; S581-Q585 PolarHBondContact O-N 2.98Å; S581-Q585 VanDerWaalsContact O-N 3.09Å
582I91.9Very high91.9Very high90 Ų9099.9 Ų99.946%0.46250%0.497SS..Hα-helixtrans-65.7-43.5175.3-66.7163.2000110.7K578 Q579 L580 Q585 K586K578-I582 VanDerWaalsContact O-CG1 3.28Å; K578-I582 WeakPolarHBondContact O-CG1 3.27Å; K578-I582 PolarHBondContact O-N 3.01Å; Q579-I582 PolarHBondContact O-N 3.15Å; L580-I582 PolarHBondContact O-N 3.24Å; I582-Q585 PolarHBondContact O-N 3.44Å; I582-K586 HydrophobicContact CG2-CD 4.46Å; I582-K586 WeakPolarHBondContact O-CG 3.3Å; I582-K586 PolarHBondContact O-N 3.39Å
583L92.9Very high91.9Very high112 Ų112103.3 Ų103.359%0.58651%0.508SS*.Hα-helixtrans-68.2-38.3179.8-73.6173.4000112.1Q579 L580 K586 K587Q579-L583 WeakPolarHBondContact O-CB 3.37Å; Q579-L583 WeakPolarHBondContact O-CG 3.35Å; Q579-L583 PolarHBondContact O-N 3.1Å; L580-L583 PolarHBondContact O-N 3.33Å; L583-K586 PolarHBondContact O-N 3.04Å; L583-K587 WeakPolarHBondContact O-CB 3.46Å; L583-K587 PolarHBondContact O-N 3.31Å
584T91.1Very high91.8Very high73 Ų73103.6 Ų103.645%0.44851%0.506SS..Hα-helixtrans-65.7-39.5174.649.60000111.7L580 S581 K587 L588L580-T584 HydrophobicContact CD2-CG2 4.17Å; L580-T584 WeakPolarHBondContact O-CG2 3.47Å; L580-T584 PolarHBondContact O-N 3.35Å; L580-T584 PolarHBondContact O-OG1 3.38Å; S581-T584 WeakPolarHBondContact CA-OG1 3.37Å; S581-T584 PolarHBondContact O-OG1 2.88Å; T584-K587 PolarHBondContact O-N 3.46Å; T584-L588 WeakPolarHBondContact O-CB 3.41Å; T584-L588 PolarHBondContact O-N 3.29Å
585Q91Very high91.9Very high119 Ų119102 Ų10256%0.55650%0.5SS*.Hα-helixtrans-65.3-38.6172.3-75.3-176.7-1.300113S581 I582 R589S581-Q585 WeakPolarHBondContact O-CG 3.31Å; S581-Q585 PolarHBondContact O-N 2.98Å; S581-Q585 VanDerWaalsContact O-N 3.09Å; I582-Q585 PolarHBondContact O-N 3.44Å; Q585-R589 PolarHBondContact O-N 2.87Å
586K92.1Very high92Very high107 Ų10797.2 Ų97.247%0.46549%0.487SS..Hα-helixtrans-64.5-44.7173.5-77.6-176.7176.8-172.50111.3I582 L583 L588 R589 I590I582-K586 HydrophobicContact CG2-CD 4.46Å; I582-K586 WeakPolarHBondContact O-CG 3.3Å; I582-K586 PolarHBondContact O-N 3.39Å; L583-K586 PolarHBondContact O-N 3.04Å; K586-L588 PolarHBondContact O-N 3.15Å; K586-R589 PolarHBondContact O-N 3.24Å; K586-I590 WeakPolarHBondContact O-CG1 3.45Å; K586-I590 PolarHBondContact O-N 2.95Å
587K93.5Very high91.9Very high131 Ų13198.1 Ų98.157%0.5749%0.489SS*.Hα-helixtrans-57.1-49.3175.9-172.1-162171.2-1680111L583 T584 R589 I590 D591L583-K587 WeakPolarHBondContact O-CB 3.46Å; L583-K587 PolarHBondContact O-N 3.31Å; T584-K587 PolarHBondContact O-N 3.46Å; K587-R589 VanDerWaalsContact C-N 3.3Å; K587-R589 PolarHBondContact O-N 3.48Å; K587-I590 PolarHBondContact O-N 2.86Å; K587-I590 VanDerWaalsContact O-N 3.14Å; K587-D591 VanDerWaalsContact CE-OD2 3.3Å; K587-D591 WeakPolarHBondContact CE-OD2 3.47Å; K587-D591 WeakPolarHBondContact O-CB 3.5Å; K587-D591 VanDerWaalsContact O-CG 3.32Å; K587-D591 PolarHBondContact O-N 3.46Å
588L91.5Very high91.9Very high107 Ų10799.2 Ų99.256%0.5649%0.491SS*.Hα-helixtrans-61.3-36.9-179.1-167147000112.6T584 K586 N592T584-L588 WeakPolarHBondContact O-CB 3.41Å; T584-L588 PolarHBondContact O-N 3.29Å; K586-L588 PolarHBondContact O-N 3.15Å; L588-N592 WeakPolarHBondContact O-CB 3.42Å; L588-N592 VanDerWaalsContact O-CG 3.25Å; L588-N592 PolarHBondContact O-N 3.24Å; L588-N592 VanDerWaalsContact O-N 3.08Å; L588-N592 PolarHBondContact O-ND2 2.98Å
589R93.1Very high91.9Very high142 Ų14299.7 Ų99.754%0.53649%0.489SS..Hα-helixtrans-64.9-46.8173-76.7-174.7-76.3171.4-8.1112.4Q585 K586 K587 N592 E593Q585-R589 PolarHBondContact O-N 2.87Å; K586-R589 PolarHBondContact O-N 3.24Å; K587-R589 VanDerWaalsContact C-N 3.3Å; K587-R589 PolarHBondContact O-N 3.48Å; R589-N592 PolarHBondContact O-N 2.88Å; R589-E593 WeakPolarHBondContact O-CG 3.27Å; R589-E593 PolarHBondContact O-N 3.07Å
590I91Very high91.8Very high91 Ų9199.5 Ų99.547%0.46749%0.488SS..Hα-helixtrans-64.2-42.4178.5-66.4168.8000110.8K586 K587 N592 E593 I594K586-I590 WeakPolarHBondContact O-CG1 3.45Å; K586-I590 PolarHBondContact O-N 2.95Å; K587-I590 PolarHBondContact O-N 2.86Å; K587-I590 VanDerWaalsContact O-N 3.14Å; I590-N592 VanDerWaalsContact C-N 3.3Å; I590-N592 PolarHBondContact O-N 2.85Å; I590-E593 PolarHBondContact O-N 3.33Å; I590-I594 HydrophobicContact CG2-CD1 3.82Å; I590-I594 HydrophobicContact CG2-CG1 4.35Å; I590-I594 VanDerWaalsContact O-CG1 3.29Å; I590-I594 WeakPolarHBondContact O-CG1 3.37Å; I590-I594 PolarHBondContact O-N 3.1Å
591D94.1Very high91.8Very high75 Ų75100.6 Ų100.640%0.40149%0.489SS..Hα-helixtrans-61.2-39.4176.6-70.4-20000111.2K587 I594 A595K587-D591 VanDerWaalsContact CE-OD2 3.3Å; K587-D591 WeakPolarHBondContact CE-OD2 3.47Å; K587-D591 WeakPolarHBondContact O-CB 3.5Å; K587-D591 VanDerWaalsContact O-CG 3.32Å; K587-D591 PolarHBondContact O-N 3.46Å; D591-I594 PolarHBondContact O-N 3.4Å; D591-A595 WeakPolarHBondContact O-CB 3.38Å; D591-A595 PolarHBondContact O-N 3.46Å
592N92.9Very high92Very high91 Ų91101.8 Ų101.849%0.48749%0.49SS..Hα-helixtrans-66.6-42174.3-75-15.1000112.6L588 R589 I590 A595 I596L588-N592 WeakPolarHBondContact O-CB 3.42Å; L588-N592 VanDerWaalsContact O-CG 3.25Å; L588-N592 PolarHBondContact O-N 3.24Å; L588-N592 VanDerWaalsContact O-N 3.08Å; L588-N592 PolarHBondContact O-ND2 2.98Å; R589-N592 PolarHBondContact O-N 2.88Å; I590-N592 VanDerWaalsContact C-N 3.3Å; I590-N592 PolarHBondContact O-N 2.85Å; N592-A595 PolarHBondContact O-N 3.29Å; N592-I596 WeakPolarHBondContact O-CG1 3.33Å; N592-I596 PolarHBondContact O-N 3.04Å
593E93.3Very high92Very high119 Ų119101.2 Ų101.256%0.55649%0.488SS*.Hα-helixtrans-62.1-43.7174.8-74.2169.4-167.400111.2R589 I590 A595 I596 Q597R589-E593 WeakPolarHBondContact O-CG 3.27Å; R589-E593 PolarHBondContact O-N 3.07Å; I590-E593 PolarHBondContact O-N 3.33Å; E593-A595 VanDerWaalsContact C-N 3.34Å; E593-A595 PolarHBondContact O-N 3.31Å; E593-I596 PolarHBondContact O-N 3.27Å; E593-Q597 WeakPolarHBondContact O-CG 3.28Å; E593-Q597 PolarHBondContact O-N 3.22Å
594I89.6Confident91.9Very high83 Ų83100.7 Ų100.743%0.42649%0.486SS..Hα-helixtrans-59.5-45.5174.1-68.7167.7000110.3I590 D591 I596 Q597 E598I590-I594 HydrophobicContact CG2-CD1 3.82Å; I590-I594 HydrophobicContact CG2-CG1 4.35Å; I590-I594 VanDerWaalsContact O-CG1 3.29Å; I590-I594 WeakPolarHBondContact O-CG1 3.37Å; I590-I594 PolarHBondContact O-N 3.1Å; D591-I594 PolarHBondContact O-N 3.4Å; I594-I596 VanDerWaalsContact C-N 3.28Å; I594-I596 PolarHBondContact O-N 2.94Å; I594-Q597 PolarHBondContact O-N 3.22Å; I594-E598 HydrophobicContact CG2-CG 4.31Å; I594-E598 WeakPolarHBondContact O-CB 3.5Å; I594-E598 WeakPolarHBondContact O-CG 3.5Å; I594-E598 PolarHBondContact O-N 3.45Å
595A92.7Very high91.9Very high40 Ų40102.9 Ų102.933%0.33149%0.489SS..Hα-helixtrans-65.3-28.2178.200000113.6D591 N592 E593 R599D591-A595 WeakPolarHBondContact O-CB 3.38Å; D591-A595 PolarHBondContact O-N 3.46Å; N592-A595 PolarHBondContact O-N 3.29Å; E593-A595 VanDerWaalsContact C-N 3.34Å; E593-A595 PolarHBondContact O-N 3.31Å; A595-R599 WeakPolarHBondContact O-CG 3.29Å; A595-R599 PolarHBondContact O-N 3.27Å; A595-R599 PolarHBondContact O-NE 3.49Å
596I92.9Very high91.8Very high73 Ų73103.5 Ų103.537%0.37449%0.49SS..Hα-helixtrans-71.1-50170.9-68.5163.6000109.7N592 E593 I594 E598 R599 E600N592-I596 WeakPolarHBondContact O-CG1 3.33Å; N592-I596 PolarHBondContact O-N 3.04Å; E593-I596 PolarHBondContact O-N 3.27Å; I594-I596 VanDerWaalsContact C-N 3.28Å; I594-I596 PolarHBondContact O-N 2.94Å; I596-E598 VanDerWaalsContact C-N 3.3Å; I596-E598 PolarHBondContact O-N 3.47Å; I596-R599 WeakPolarHBondContact O-CB 3.48Å; I596-R599 PolarHBondContact O-N 2.9Å; I596-E600 HydrophobicContact CG2-CG 4.49Å; I596-E600 PolarHBondContact O-N 3.5Å
597Q91.6Very high91.8Very high114 Ų114103.9 Ų103.953%0.53349%0.493SS..Hα-helixtrans-61.1-36178.9-69.8-62.3-50.100112.7E593 I594 E600 K601E593-Q597 WeakPolarHBondContact O-CG 3.28Å; E593-Q597 PolarHBondContact O-N 3.22Å; I594-Q597 PolarHBondContact O-N 3.22Å; Q597-E600 PolarHBondContact NE2-OE2 2.99Å; Q597-E600 PolarHBondContact O-N 3.27Å; Q597-K601 VanDerWaalsContact O-CB 3.23Å; Q597-K601 WeakPolarHBondContact O-CB 3.24Å; Q597-K601 PolarHBondContact O-N 3.03Å
598E91.4Very high91.6Very high117 Ų117102.4 Ų102.455%0.54749%0.491SS..Hα-helixtrans-66.7-36.4173.9-76.7-173.6161.400112.7I594 I596 N602I594-E598 HydrophobicContact CG2-CG 4.31Å; I594-E598 WeakPolarHBondContact O-CB 3.5Å; I594-E598 WeakPolarHBondContact O-CG 3.5Å; I594-E598 PolarHBondContact O-N 3.45Å; I596-E598 VanDerWaalsContact C-N 3.3Å; I596-E598 PolarHBondContact O-N 3.47Å; E598-N602 WeakPolarHBondContact O-CB 3.46Å; E598-N602 PolarHBondContact O-N 3.42Å; E598-N602 PolarHBondContact O-ND2 2.88Å; E598-N602 VanDerWaalsContact O-ND2 3.15Å
599R91.4Very high91.6Very high155 Ų155103.8 Ų103.859%0.58549%0.493SS*.Hα-helixtrans-66.5-49.1173-78.6-177.1-77153.3-8.2111.1A595 I596 K601 N602 D603A595-R599 WeakPolarHBondContact O-CG 3.29Å; A595-R599 PolarHBondContact O-N 3.27Å; A595-R599 PolarHBondContact O-NE 3.49Å; I596-R599 WeakPolarHBondContact O-CB 3.48Å; I596-R599 PolarHBondContact O-N 2.9Å; R599-K601 VanDerWaalsContact C-N 3.33Å; R599-K601 PolarHBondContact O-N 2.94Å; R599-N602 WeakPolarHBondContact O-CB 3.31Å; R599-N602 PolarHBondContact O-N 2.8Å; R599-D603 PolarHBondContact O-N 3.14Å
600E90.5Very high91.4Very high91 Ų91103.1 Ų103.143%0.42550%0.495SS..Hα-helixtrans-57.1-45.6176-71174.6-17900111.6I596 Q597 N602 D603 L604I596-E600 HydrophobicContact CG2-CG 4.49Å; I596-E600 PolarHBondContact O-N 3.5Å; Q597-E600 PolarHBondContact NE2-OE2 2.99Å; Q597-E600 PolarHBondContact O-N 3.27Å; E600-N602 VanDerWaalsContact C-N 3.3Å; E600-N602 PolarHBondContact O-N 2.96Å; E600-D603 PolarHBondContact O-N 3.36Å; E600-L604 WeakPolarHBondContact O-CB 3.27Å; E600-L604 WeakPolarHBondContact O-CG 3.47Å; E600-L604 PolarHBondContact O-N 3.33Å
601K89.8Confident91.5Very high125 Ų125103.6 Ų103.654%0.54350%0.498SS..Hα-helixtrans-59.1-39.8174.6179.1-178.81781790112.4Q597 R599 K605Q597-K601 VanDerWaalsContact O-CB 3.23Å; Q597-K601 WeakPolarHBondContact O-CB 3.24Å; Q597-K601 PolarHBondContact O-N 3.03Å; R599-K601 VanDerWaalsContact C-N 3.33Å; R599-K601 PolarHBondContact O-N 2.94Å; K601-K605 WeakPolarHBondContact O-CB 3.48Å; K601-K605 VanDerWaalsContact O-CG 3.31Å; K601-K605 WeakPolarHBondContact O-CG 3.43Å; K601-K605 PolarHBondContact O-N 3.04Å
602N93Very high91.3Very high82 Ų82105.6 Ų105.644%0.43951%0.505SS..Hα-helixtrans-70.1-36.2178.2-74.3-26.2000112E598 R599 E600 K605 K606E598-N602 WeakPolarHBondContact O-CB 3.46Å; E598-N602 PolarHBondContact O-N 3.42Å; E598-N602 PolarHBondContact O-ND2 2.88Å; E598-N602 VanDerWaalsContact O-ND2 3.15Å; R599-N602 WeakPolarHBondContact O-CB 3.31Å; R599-N602 PolarHBondContact O-N 2.8Å; E600-N602 VanDerWaalsContact C-N 3.3Å; E600-N602 PolarHBondContact O-N 2.96Å; N602-K605 PolarHBondContact O-N 3.43Å; N602-K606 WeakPolarHBondContact O-CG 3.4Å; N602-K606 PolarHBondContact O-N 3.38Å; N602-K606 VanDerWaalsContact O-N 3.13Å
603D91.9Very high91.3Very high78 Ų78105.2 Ų105.242%0.41750%0.503SS..Hα-helixtrans-70.6-43.8176.3-66.5-26.8000111.3R599 E600 K605 K606 E607R599-D603 PolarHBondContact O-N 3.14Å; E600-D603 PolarHBondContact O-N 3.36Å; D603-K605 VanDerWaalsContact C-N 3.28Å; D603-K605 PolarHBondContact O-N 2.83Å; D603-K606 WeakPolarHBondContact O-CA 3.41Å; D603-K606 WeakPolarHBondContact O-CB 3.45Å; D603-K606 PolarHBondContact O-N 3.2Å; D603-K606 IonicContact OD1-NZ 2.79Å; D603-K606 PolarHBondContact OD1-NZ 3.46Å; D603-E607 PolarHBondContact O-N 3.21Å
604L91.3Very high91.2Very high102 Ų102102.7 Ų102.753%0.53449%0.493SS..Hα-helixtrans-58.7-37.2171.4-72.1173.3000112.7E600 K606 E607 L608E600-L604 WeakPolarHBondContact O-CB 3.27Å; E600-L604 WeakPolarHBondContact O-CG 3.47Å; E600-L604 PolarHBondContact O-N 3.33Å; L604-K606 VanDerWaalsContact C-N 3.35Å; L604-E607 PolarHBondContact O-N 2.95Å; L604-L608 WeakPolarHBondContact O-CB 3.47Å; L604-L608 PolarHBondContact O-N 3.45Å
605K90.7Very high91.2Very high119 Ų119103.2 Ų103.252%0.51750%0.496SS..Hα-helixtrans-64.1-37.8173.1-82.3177.4176.7-176.30112.5K601 N602 D603 K609K601-K605 WeakPolarHBondContact O-CB 3.48Å; K601-K605 VanDerWaalsContact O-CG 3.31Å; K601-K605 WeakPolarHBondContact O-CG 3.43Å; K601-K605 PolarHBondContact O-N 3.04Å; N602-K605 PolarHBondContact O-N 3.43Å; D603-K605 VanDerWaalsContact C-N 3.28Å; D603-K605 PolarHBondContact O-N 2.83Å; K605-K609 WeakPolarHBondContact O-CB 3.42Å; K605-K609 PolarHBondContact O-N 3.14Å
606K90.6Very high91.2Very high131 Ų131105.2 Ų105.257%0.5750%0.504SS*.Hα-helixtrans-67.8-42.8175.9-67.2168.3-164.4157.70110.7N602 D603 L604 K609 H610N602-K606 WeakPolarHBondContact O-CG 3.4Å; N602-K606 PolarHBondContact O-N 3.38Å; N602-K606 VanDerWaalsContact O-N 3.13Å; D603-K606 WeakPolarHBondContact O-CA 3.41Å; D603-K606 WeakPolarHBondContact O-CB 3.45Å; D603-K606 PolarHBondContact O-N 3.2Å; D603-K606 IonicContact OD1-NZ 2.79Å; D603-K606 PolarHBondContact OD1-NZ 3.46Å; L604-K606 VanDerWaalsContact C-N 3.35Å; K606-K609 PolarHBondContact O-N 2.94Å; K606-H610 PolarHBondContact O-N 3.26Å
607E90.9Very high91.1Very high115 Ų115109.6 Ų109.654%0.53752%0.516SS..Hα-helixtrans-61.8-46.2175.5-71.3178.3-177.800111.7D603 L604 K609 H610 L611D603-E607 PolarHBondContact O-N 3.21Å; L604-E607 PolarHBondContact O-N 2.95Å; E607-K609 VanDerWaalsContact C-N 3.29Å; E607-K609 PolarHBondContact O-N 3.01Å; E607-H610 WeakPolarHBondContact O-CA 3.36Å; E607-H610 WeakPolarHBondContact O-CB 3.42Å; E607-H610 PolarHBondContact O-N 3.03Å; E607-H610 VanDerWaalsContact O-N 3.08Å; E607-L611 PolarHBondContact O-N 3.42Å
608L89.2Confident91Very high100 Ų100108.6 Ų108.652%0.52451%0.513SS..Hα-helixtrans-57.8-41.2173.8-93.4164.8000112.1L604 L611 Q612L604-L608 WeakPolarHBondContact O-CB 3.47Å; L604-L608 PolarHBondContact O-N 3.45Å; L608-L611 PolarHBondContact O-N 3.12Å; L608-Q612 WeakPolarHBondContact O-CB 3.49Å; L608-Q612 VanDerWaalsContact O-CG 3.25Å; L608-Q612 WeakPolarHBondContact O-CG 3.49Å; L608-Q612 PolarHBondContact O-N 3.27Å
609K92.2Very high91Very high137 Ų137107.3 Ų107.360%0.59651%0.51SS*.Hα-helixtrans-66.1-38175.8-169178.3-178.9-178.70111.7K605 K606 E607 N613K605-K609 WeakPolarHBondContact O-CB 3.42Å; K605-K609 PolarHBondContact O-N 3.14Å; K606-K609 PolarHBondContact O-N 2.94Å; E607-K609 VanDerWaalsContact C-N 3.29Å; E607-K609 PolarHBondContact O-N 3.01Å; K609-N613 PolarHBondContact O-N 3.44Å; K609-N613 PolarHBondContact O-ND2 2.91Å; K609-N613 PolarHBondContact O-OD1 3.12Å
610H89.3Confident91Very high128 Ų128103.6 Ų103.659%0.59351%0.505SS*.Hα-helixtrans-62-50.4172.7-109.260.3000111.4K606 E607 Q612 N613 D614K606-H610 PolarHBondContact O-N 3.26Å; E607-H610 WeakPolarHBondContact O-CA 3.36Å; E607-H610 WeakPolarHBondContact O-CB 3.42Å; E607-H610 PolarHBondContact O-N 3.03Å; E607-H610 VanDerWaalsContact O-N 3.08Å; H610-Q612 VanDerWaalsContact C-N 3.33Å; H610-Q612 PolarHBondContact O-N 3.25Å; H610-N613 WeakPolarHBondContact O-CB 3.44Å; H610-N613 PolarHBondContact O-N 3.11Å; H610-N613 VanDerWaalsContact O-N 3.09Å; H610-D614 PolarHBondContact O-N 3.34Å
611L91.5Very high91Very high100 Ų100104.6 Ų104.652%0.52451%0.511SS..Hα-helixtrans-60.1-40.8177.4-77.9161.4000112.4E607 L608 N613 D614 I615E607-L611 PolarHBondContact O-N 3.42Å; L608-L611 PolarHBondContact O-N 3.12Å; L611-N613 VanDerWaalsContact C-N 3.35Å; L611-D614 PolarHBondContact O-N 3.26Å; L611-I615 WeakPolarHBondContact O-CB 3.36Å; L611-I615 VanDerWaalsContact O-CG1 3.24Å; L611-I615 WeakPolarHBondContact O-CG1 3.46Å; L611-I615 PolarHBondContact O-N 2.84Å
612Q89.6Confident91.1Very high117 Ų117102.5 Ų102.555%0.54751%0.505SS..Hα-helixtrans-61-44.1173.8-77.7174.8-11.200111.5L608 H610 D614 I615 T616L608-Q612 WeakPolarHBondContact O-CB 3.49Å; L608-Q612 VanDerWaalsContact O-CG 3.25Å; L608-Q612 WeakPolarHBondContact O-CG 3.49Å; L608-Q612 PolarHBondContact O-N 3.27Å; H610-Q612 VanDerWaalsContact C-N 3.33Å; H610-Q612 PolarHBondContact O-N 3.25Å; Q612-D614 VanDerWaalsContact C-N 3.34Å; Q612-D614 PolarHBondContact O-N 3.03Å; Q612-I615 PolarHBondContact O-N 3.2Å; Q612-T616 WeakPolarHBondContact O-CG2 3.32Å; Q612-T616 PolarHBondContact O-N 3.36Å; Q612-T616 PolarHBondContact O-OG1 3.5Å
613N92.9Very high91Very high83 Ų83101.2 Ų101.244%0.44451%0.506SS..Hα-helixtrans-62.8-42.1175.7-67.9-18.2000111.4K609 H610 L611 T616 R617K609-N613 PolarHBondContact O-N 3.44Å; K609-N613 PolarHBondContact O-ND2 2.91Å; K609-N613 PolarHBondContact O-OD1 3.12Å; H610-N613 WeakPolarHBondContact O-CB 3.44Å; H610-N613 PolarHBondContact O-N 3.11Å; H610-N613 VanDerWaalsContact O-N 3.09Å; L611-N613 VanDerWaalsContact C-N 3.35Å; N613-T616 WeakPolarHBondContact CA-OG1 3.36Å; N613-T616 PolarHBondContact O-N 2.87Å; N613-T616 PolarHBondContact O-OG1 3.41Å; N613-R617 WeakPolarHBondContact O-CB 3.49Å; N613-R617 PolarHBondContact O-N 2.79Å
614D91.8Very high91Very high67 Ų67104.3 Ų104.336%0.35852%0.515SS..Hα-helixtrans-65.7-40.9177.5-71.6-24.3000111.9H610 L611 Q612 T616 R617 I618H610-D614 PolarHBondContact O-N 3.34Å; L611-D614 PolarHBondContact O-N 3.26Å; Q612-D614 VanDerWaalsContact C-N 3.34Å; Q612-D614 PolarHBondContact O-N 3.03Å; D614-T616 VanDerWaalsContact C-N 3.34Å; D614-T616 PolarHBondContact O-N 3.19Å; D614-R617 PolarHBondContact O-N 2.86Å; D614-I618 WeakPolarHBondContact O-CB 3.45Å; D614-I618 VanDerWaalsContact O-CG1 3.26Å; D614-I618 WeakPolarHBondContact O-CG1 3.35Å; D614-I618 PolarHBondContact O-N 2.92Å
615I90.3Very high91Very high94 Ų94105.4 Ų105.448%0.48252%0.518SS..Hα-helixtrans-59.8-45.4172.5-70.8165.1000110.3L611 Q612 R617 I618 N619L611-I615 WeakPolarHBondContact O-CB 3.36Å; L611-I615 VanDerWaalsContact O-CG1 3.24Å; L611-I615 WeakPolarHBondContact O-CG1 3.46Å; L611-I615 PolarHBondContact O-N 2.84Å; Q612-I615 PolarHBondContact O-N 3.2Å; I615-R617 VanDerWaalsContact C-N 3.34Å; I615-R617 PolarHBondContact O-N 3.49Å; I615-I618 PolarHBondContact O-N 3.43Å; I615-N619 VanDerWaalsContact O-CB 3.3Å; I615-N619 WeakPolarHBondContact O-CB 3.38Å; I615-N619 PolarHBondContact O-N 3.25Å; I615-N619 PolarHBondContact O-ND2 2.89Å
616T91.4Very high91.1Very high81 Ų81105.5 Ų105.550%0.49752%0.518SS..Hα-helixtrans-62.5-42176.6600000111.7Q612 N613 D614 N619 T620Q612-T616 WeakPolarHBondContact O-CG2 3.32Å; Q612-T616 PolarHBondContact O-N 3.36Å; Q612-T616 PolarHBondContact O-OG1 3.5Å; N613-T616 WeakPolarHBondContact CA-OG1 3.36Å; N613-T616 PolarHBondContact O-N 2.87Å; N613-T616 PolarHBondContact O-OG1 3.41Å; D614-T616 VanDerWaalsContact C-N 3.34Å; D614-T616 PolarHBondContact O-N 3.19Å; T616-N619 PolarHBondContact O-N 3.02Å; T616-T620 VanDerWaalsContact O-CG2 3.31Å; T616-T620 WeakPolarHBondContact O-CG2 3.34Å; T616-T620 PolarHBondContact O-N 2.98Å; T616-T620 PolarHBondContact O-OG1 3.46Å
617R91.7Very high91Very high165 Ų165103.2 Ų103.262%0.62352%0.515SS*.Hα-helixtrans-62.6-48.5176.7-179.3-176.8-94.8163.4-10.5111.2N613 D614 I615 N619 T620 M621N613-R617 WeakPolarHBondContact O-CB 3.49Å; N613-R617 PolarHBondContact O-N 2.79Å; D614-R617 PolarHBondContact O-N 2.86Å; I615-R617 VanDerWaalsContact C-N 3.34Å; I615-R617 PolarHBondContact O-N 3.49Å; R617-N619 PolarHBondContact O-N 3.49Å; R617-T620 WeakPolarHBondContact CA-OG1 3.44Å; R617-T620 PolarHBondContact O-N 2.8Å; R617-T620 PolarHBondContact O-OG1 3.15Å; R617-M621 WeakPolarHBondContact O-CG 3.44Å; R617-M621 PolarHBondContact O-N 3.41Å
618I90.1Very high91.1Very high93 Ų93100.8 Ų100.848%0.47751%0.508SS..Hα-helixtrans-61-45.5177.8-69.4167000110.3D614 I615 T620 M621 I622D614-I618 WeakPolarHBondContact O-CB 3.45Å; D614-I618 VanDerWaalsContact O-CG1 3.26Å; D614-I618 WeakPolarHBondContact O-CG1 3.35Å; D614-I618 PolarHBondContact O-N 2.92Å; I615-I618 PolarHBondContact O-N 3.43Å; I618-T620 VanDerWaalsContact C-N 3.31Å; I618-T620 PolarHBondContact O-N 2.87Å; I618-M621 CarbonylContact O-C 3.58Å; I618-M621 WeakPolarHBondContact O-CB 3.26Å; I618-M621 PolarHBondContact O-N 3.35Å; I618-I622 HydrophobicContact CG2-CD1 3.68Å; I618-I622 HydrophobicContact CG2-CG1 4.22Å; I618-I622 WeakPolarHBondContact O-CG1 3.38Å; I618-I622 PolarHBondContact O-N 2.84Å
619N90.9Very high91.1Very high91 Ų91102.4 Ų102.449%0.48751%0.513SS..Hα-helixtrans-61.2-38.7176.7-72.8-18.5000112.1I615 T616 R617 M621 I622 A623I615-N619 VanDerWaalsContact O-CB 3.3Å; I615-N619 WeakPolarHBondContact O-CB 3.38Å; I615-N619 PolarHBondContact O-N 3.25Å; I615-N619 PolarHBondContact O-ND2 2.89Å; T616-N619 PolarHBondContact O-N 3.02Å; R617-N619 PolarHBondContact O-N 3.49Å; N619-M621 VanDerWaalsContact C-N 3.34Å; N619-I622 PolarHBondContact O-N 3.39Å; N619-A623 WeakPolarHBondContact O-CB 3.3Å; N619-A623 PolarHBondContact O-N 3.31Å
620T91.1Very high91.1Very high76 Ų76101.6 Ų101.647%0.46651%0.512SS..Hα-helixtrans-66.5-34.8173.460.40000112.8T616 R617 I618 K624T616-T620 VanDerWaalsContact O-CG2 3.31Å; T616-T620 WeakPolarHBondContact O-CG2 3.34Å; T616-T620 PolarHBondContact O-N 2.98Å; T616-T620 PolarHBondContact O-OG1 3.46Å; R617-T620 WeakPolarHBondContact CA-OG1 3.44Å; R617-T620 PolarHBondContact O-N 2.8Å; R617-T620 PolarHBondContact O-OG1 3.15Å; I618-T620 VanDerWaalsContact C-N 3.31Å; I618-T620 PolarHBondContact O-N 2.87Å; T620-K624 WeakPolarHBondContact O-CG 3.43Å; T620-K624 PolarHBondContact O-N 3.4Å; T620-K624 VanDerWaalsContact O-N 3.11Å
621M91.6Very high91.2Very high112 Ų112102.9 Ų102.955%0.55251%0.512SS*.Hα-helixtrans-69-44.1174.2-71.8-17863.600111.5R617 I618 N619 A623 K624 E625R617-M621 WeakPolarHBondContact O-CG 3.44Å; R617-M621 PolarHBondContact O-N 3.41Å; I618-M621 CarbonylContact O-C 3.58Å; I618-M621 WeakPolarHBondContact O-CB 3.26Å; I618-M621 PolarHBondContact O-N 3.35Å; N619-M621 VanDerWaalsContact C-N 3.34Å; M621-A623 VanDerWaalsContact C-N 3.32Å; M621-A623 PolarHBondContact O-N 2.97Å; M621-K624 PolarHBondContact O-N 3.12Å; M621-E625 WeakPolarHBondContact O-CG 3.29Å; M621-E625 PolarHBondContact O-N 2.99Å
622I91.2Very high91.2Very high82 Ų82102.6 Ų102.642%0.42151%0.511SS..Hα-helixtrans-60.4-43.3176-68.2168.9000110.6I618 N619 K624 E625 K626I618-I622 HydrophobicContact CG2-CD1 3.68Å; I618-I622 HydrophobicContact CG2-CG1 4.22Å; I618-I622 WeakPolarHBondContact O-CG1 3.38Å; I618-I622 PolarHBondContact O-N 2.84Å; N619-I622 PolarHBondContact O-N 3.39Å; I622-K624 VanDerWaalsContact C-N 3.34Å; I622-K624 PolarHBondContact O-N 3.01Å; I622-E625 PolarHBondContact O-N 3.47Å; I622-K626 HydrophobicContact CG2-CD 4.33Å; I622-K626 HydrophobicContact CG2-CG 4.45Å; I622-K626 WeakPolarHBondContact O-CB 3.49Å; I622-K626 WeakPolarHBondContact O-CG 3.45Å; I622-K626 PolarHBondContact O-N 2.76Å
623A91.3Very high91.2Very high55 Ų55100.4 Ų100.446%0.45550%0.503SS..Hα-helixtrans-61.8-42.9176.800000111.6N619 M621 K626 T627N619-A623 WeakPolarHBondContact O-CB 3.3Å; N619-A623 PolarHBondContact O-N 3.31Å; M621-A623 VanDerWaalsContact C-N 3.32Å; M621-A623 PolarHBondContact O-N 2.97Å; A623-K626 PolarHBondContact O-N 3.35Å; A623-T627 WeakPolarHBondContact O-CG2 3.43Å; A623-T627 PolarHBondContact O-N 2.86Å; A623-T627 PolarHBondContact O-OG1 2.62Å
624K92.2Very high91.2Very high143 Ų143100.8 Ų100.862%0.62251%0.505SS*.Hα-helixtrans-62.8-47.6175-74.1175.8180-1760112.1T620 M621 I622 K626 T627 T628T620-K624 WeakPolarHBondContact O-CG 3.43Å; T620-K624 PolarHBondContact O-N 3.4Å; T620-K624 VanDerWaalsContact O-N 3.11Å; M621-K624 PolarHBondContact O-N 3.12Å; I622-K624 VanDerWaalsContact C-N 3.34Å; I622-K624 PolarHBondContact O-N 3.01Å; K624-K626 VanDerWaalsContact C-N 3.34Å; K624-K626 PolarHBondContact O-N 2.68Å; K624-T627 WeakPolarHBondContact CA-OG1 3.43Å; K624-T627 PolarHBondContact O-N 3.25Å; K624-T627 VanDerWaalsContact O-N 3.17Å; K624-T627 PolarHBondContact O-OG1 2.76Å; K624-T628 PolarHBondContact O-N 3.07Å; K624-T628 PolarHBondContact O-OG1 3.32Å
625E91.3Very high91.2Very high125 Ų125101.9 Ų101.958%0.58451%0.508SS*.Hα-helixtrans-61.2-41.5178.3-76.8-64160.900112M621 I622 T627 T628 E629M621-E625 WeakPolarHBondContact O-CG 3.29Å; M621-E625 PolarHBondContact O-N 2.99Å; I622-E625 PolarHBondContact O-N 3.47Å; E625-T627 PolarHBondContact O-N 2.86Å; E625-T628 VanDerWaalsContact CA-OG1 3.26Å; E625-T628 WeakPolarHBondContact CA-OG1 3.44Å; E625-T628 PolarHBondContact O-N 2.89Å; E625-T628 PolarHBondContact O-OG1 2.88Å; E625-E629 VanDerWaalsContact O-CB 3.29Å; E625-E629 WeakPolarHBondContact O-CB 3.3Å; E625-E629 PolarHBondContact O-N 2.82Å
626K91Very high91.1Very high120 Ų120101.7 Ų101.752%0.52251%0.508SS..Hα-helixtrans-61.3-43.5173.3-78.3-174.3174.8-169.10112.2I622 A623 K624 T628 E629 E630I622-K626 HydrophobicContact CG2-CD 4.33Å; I622-K626 HydrophobicContact CG2-CG 4.45Å; I622-K626 WeakPolarHBondContact O-CB 3.49Å; I622-K626 WeakPolarHBondContact O-CG 3.45Å; I622-K626 PolarHBondContact O-N 2.76Å; A623-K626 PolarHBondContact O-N 3.35Å; K624-K626 VanDerWaalsContact C-N 3.34Å; K624-K626 PolarHBondContact O-N 2.68Å; K626-T628 VanDerWaalsContact C-N 3.3Å; K626-T628 PolarHBondContact O-N 3.21Å; K626-E629 PolarHBondContact O-N 2.83Å; K626-E630 WeakPolarHBondContact O-CB 3.49Å; K626-E630 WeakPolarHBondContact O-CG 3.38Å; K626-E630 PolarHBondContact O-N 3.46Å
627T89.6Confident91.1Very high83 Ų83102.5 Ų102.551%0.50950%0.504SS..Hα-helixtrans-65.4-34.2177.4550000112.7A623 K624 E625 Y631A623-T627 WeakPolarHBondContact O-CG2 3.43Å; A623-T627 PolarHBondContact O-N 2.86Å; A623-T627 PolarHBondContact O-OG1 2.62Å; K624-T627 WeakPolarHBondContact CA-OG1 3.43Å; K624-T627 PolarHBondContact O-N 3.25Å; K624-T627 VanDerWaalsContact O-N 3.17Å; K624-T627 PolarHBondContact O-OG1 2.76Å; E625-T627 PolarHBondContact O-N 2.86Å; T627-Y631 WeakPolarHBondContact O-CB 3.27Å; T627-Y631 PolarHBondContact O-N 2.9Å
628T92.3Very high91Very high65 Ų65100 Ų10040%0.39950%0.503SS..Hα-helixtrans-74-37.4175460000112K624 E625 K626 Y631 L632K624-T628 PolarHBondContact O-N 3.07Å; K624-T628 PolarHBondContact O-OG1 3.32Å; E625-T628 VanDerWaalsContact CA-OG1 3.26Å; E625-T628 WeakPolarHBondContact CA-OG1 3.44Å; E625-T628 PolarHBondContact O-N 2.89Å; E625-T628 PolarHBondContact O-OG1 2.88Å; K626-T628 VanDerWaalsContact C-N 3.3Å; K626-T628 PolarHBondContact O-N 3.21Å; T628-Y631 PolarHBondContact O-N 2.86Å; T628-L632 WeakPolarHBondContact O-CB 3.36Å; T628-L632 VanDerWaalsContact O-CG 3.32Å; T628-L632 WeakPolarHBondContact O-CG 3.22Å; T628-L632 PolarHBondContact O-N 2.82Å
629E90.6Very high91Very high133 Ų13398.2 Ų98.262%0.62150%0.496SS*.Hα-helixtrans-61.8-48.8173.5-175.4-179.5-176.300110.8E625 K626 Y631 L632 D633E625-E629 VanDerWaalsContact O-CB 3.29Å; E625-E629 WeakPolarHBondContact O-CB 3.3Å; E625-E629 PolarHBondContact O-N 2.82Å; K626-E629 PolarHBondContact O-N 2.83Å; E629-Y631 VanDerWaalsContact C-N 3.32Å; E629-Y631 PolarHBondContact O-N 3.38Å; E629-L632 PolarHBondContact O-N 3.48Å; E629-D633 VanDerWaalsContact O-CB 3.29Å; E629-D633 WeakPolarHBondContact O-CB 3.44Å; E629-D633 PolarHBondContact O-N 3.11Å
630E91.5Very high90.8Very high121 Ų12199.4 Ų99.457%0.56550%0.499SS*.Hα-helixtrans-61.1-39.3175.7-74.1173.4-174.300112.2K626 N634K626-E630 WeakPolarHBondContact O-CB 3.49Å; K626-E630 WeakPolarHBondContact O-CG 3.38Å; K626-E630 PolarHBondContact O-N 3.46Å; E630-N634 WeakPolarHBondContact O-CB 3.47Å; E630-N634 PolarHBondContact O-N 3.32Å; E630-N634 PolarHBondContact O-ND2 2.92Å
631Y90.8Very high90.9Very high154 Ų154100.5 Ų100.560%0.60450%0.501SS*.Hα-helixtrans-63.2-48.7175.6178.4-89.5000111.6T627 T628 E629 N634 E635T627-Y631 WeakPolarHBondContact O-CB 3.27Å; T627-Y631 PolarHBondContact O-N 2.9Å; T628-Y631 PolarHBondContact O-N 2.86Å; E629-Y631 VanDerWaalsContact C-N 3.32Å; E629-Y631 PolarHBondContact O-N 3.38Å; Y631-N634 PolarHBondContact O-N 2.83Å; Y631-E635 WeakPolarHBondContact CE1-OE2 3.36Å; Y631-E635 PolarHBondContact O-N 3.21Å
632L91.2Very high90.8Very high94 Ų9499.9 Ų99.949%0.49250%0.5SS..Hα-helixtrans-66.4-38.9179.1-72.4171000112.3T628 E629 E635 N636T628-L632 WeakPolarHBondContact O-CB 3.36Å; T628-L632 VanDerWaalsContact O-CG 3.32Å; T628-L632 WeakPolarHBondContact O-CG 3.22Å; T628-L632 PolarHBondContact O-N 2.82Å; E629-L632 PolarHBondContact O-N 3.48Å; L632-E635 PolarHBondContact O-N 3.36Å; L632-N636 WeakPolarHBondContact O-CB 3.45Å; L632-N636 VanDerWaalsContact O-CG 3.24Å; L632-N636 PolarHBondContact O-N 3.37Å; L632-N636 PolarHBondContact O-ND2 2.87Å
633D91.2Very high90.6Very high72 Ų72102.8 Ų102.839%0.38551%0.51SS..Hα-helixtrans-65.2-40.2176.4-173.248.8000111.2E629 N636 K637E629-D633 VanDerWaalsContact O-CB 3.29Å; E629-D633 WeakPolarHBondContact O-CB 3.44Å; E629-D633 PolarHBondContact O-N 3.11Å; D633-N636 PolarHBondContact O-N 3.45Å; D633-K637 WeakPolarHBondContact O-CB 3.46Å; D633-K637 VanDerWaalsContact O-CG 3.26Å; D633-K637 WeakPolarHBondContact O-CG 3.17Å; D633-K637 PolarHBondContact O-N 3Å; D633-K637 IonicContact OD1-NZ 3.19Å; D633-K637 VanDerWaalsContact OD2-CE 3.23Å; D633-K637 WeakPolarHBondContact OD2-CE 3.5Å; D633-K637 IonicContact OD2-NZ 3.66Å; D633-K637 PolarHBondContact OD2-NZ 3.35Å
634N91.7Very high90.7Very high91 Ų91104.3 Ų104.349%0.48751%0.509SS..Hα-helixtrans-65.5-40.4173.2-73.2-33.7000112.3E630 Y631 K637 L638E630-N634 WeakPolarHBondContact O-CB 3.47Å; E630-N634 PolarHBondContact O-N 3.32Å; E630-N634 PolarHBondContact O-ND2 2.92Å; Y631-N634 PolarHBondContact O-N 2.83Å; N634-K637 PolarHBondContact O-N 2.99Å; N634-L638 WeakPolarHBondContact O-CB 3.28Å; N634-L638 VanDerWaalsContact O-CG 3.29Å; N634-L638 WeakPolarHBondContact O-CG 3.42Å; N634-L638 PolarHBondContact O-N 2.93Å
635E91.6Very high90.6Very high89 Ų89105 Ų10542%0.41651%0.508SS..Hα-helixtrans-64.8-43.4175.9-168.5174.4-177.500111.5Y631 L632 L638 T639Y631-E635 WeakPolarHBondContact CE1-OE2 3.36Å; Y631-E635 PolarHBondContact O-N 3.21Å; L632-E635 PolarHBondContact O-N 3.36Å; E635-L638 PolarHBondContact O-N 3.26Å; E635-T639 WeakPolarHBondContact O-CG2 3.31Å; E635-T639 PolarHBondContact O-N 3.16Å; E635-T639 PolarHBondContact O-OG1 3.4Å; E635-T639 VanDerWaalsContact O-OG1 3.11Å
636N89.9Confident90.6Very high90 Ų90101.9 Ų101.948%0.48150%0.5SS..Hα-helixtrans-62.9-44.8174.4-73.5-21.9000111.6L632 D633 L638 T639 E640L632-N636 WeakPolarHBondContact O-CB 3.45Å; L632-N636 VanDerWaalsContact O-CG 3.24Å; L632-N636 PolarHBondContact O-N 3.37Å; L632-N636 PolarHBondContact O-ND2 2.87Å; D633-N636 PolarHBondContact O-N 3.45Å; N636-L638 VanDerWaalsContact C-N 3.34Å; N636-L638 PolarHBondContact O-N 2.86Å; N636-T639 WeakPolarHBondContact CA-OG1 3.3Å; N636-T639 PolarHBondContact O-N 2.89Å; N636-T639 PolarHBondContact O-OG1 3.2Å; N636-E640 WeakPolarHBondContact O-CB 3.49Å; N636-E640 WeakPolarHBondContact O-CG 3.36Å; N636-E640 PolarHBondContact O-N 2.88Å
637K90.9Very high90.5Very high98 Ų98101.2 Ų101.243%0.42650%0.501SS..Hα-helixtrans-60.4-42.2175.7-78167.4177.4163.20112.3D633 N634 E640 I641D633-K637 WeakPolarHBondContact O-CB 3.46Å; D633-K637 VanDerWaalsContact O-CG 3.26Å; D633-K637 WeakPolarHBondContact O-CG 3.17Å; D633-K637 PolarHBondContact O-N 3Å; D633-K637 IonicContact OD1-NZ 3.19Å; D633-K637 VanDerWaalsContact OD2-CE 3.23Å; D633-K637 WeakPolarHBondContact OD2-CE 3.5Å; D633-K637 IonicContact OD2-NZ 3.66Å; D633-K637 PolarHBondContact OD2-NZ 3.35Å; N634-K637 PolarHBondContact O-N 2.99Å; K637-E640 PolarHBondContact O-N 2.72Å; K637-I641 WeakPolarHBondContact O-CB 3.37Å; K637-I641 WeakPolarHBondContact O-CD1 3.38Å; K637-I641 WeakPolarHBondContact O-CG1 3.29Å; K637-I641 PolarHBondContact O-N 3.47Å
638L89.7Confident90.6Very high112 Ų112103.2 Ų103.259%0.58650%0.503SS*.Hα-helixtrans-63.8-46.2176.8-74.2169.6000111.2N634 E635 N636 I641 D642N634-L638 WeakPolarHBondContact O-CB 3.28Å; N634-L638 VanDerWaalsContact O-CG 3.29Å; N634-L638 WeakPolarHBondContact O-CG 3.42Å; N634-L638 PolarHBondContact O-N 2.93Å; E635-L638 PolarHBondContact O-N 3.26Å; N636-L638 VanDerWaalsContact C-N 3.34Å; N636-L638 PolarHBondContact O-N 2.86Å; L638-I641 PolarHBondContact O-N 3.25Å; L638-D642 PolarHBondContact O-N 2.81Å
639T89.2Confident90.5Very high56 Ų56105 Ų10534%0.34451%0.507SS..Hα-helixtrans-66.2-38177.855.80000112.4E635 N636 D642 F643E635-T639 WeakPolarHBondContact O-CG2 3.31Å; E635-T639 PolarHBondContact O-N 3.16Å; E635-T639 PolarHBondContact O-OG1 3.4Å; E635-T639 VanDerWaalsContact O-OG1 3.11Å; N636-T639 WeakPolarHBondContact CA-OG1 3.3Å; N636-T639 PolarHBondContact O-N 2.89Å; N636-T639 PolarHBondContact O-OG1 3.2Å; T639-D642 PolarHBondContact O-N 3.34Å; T639-F643 WeakPolarHBondContact O-CD2 3.42Å; T639-F643 WeakPolarHBondContact O-CG 3.47Å; T639-F643 PolarHBondContact O-N 2.85Å
640E87.3Confident90.5Very high116 Ų116104.1 Ų104.154%0.54250%0.501SS..Hα-helixtrans-62.7-43.6172.2-79.2-175.9174.400112N636 K637 D642 F643 I644N636-E640 WeakPolarHBondContact O-CB 3.49Å; N636-E640 WeakPolarHBondContact O-CG 3.36Å; N636-E640 PolarHBondContact O-N 2.88Å; K637-E640 PolarHBondContact O-N 2.72Å; E640-D642 VanDerWaalsContact C-N 3.29Å; E640-D642 PolarHBondContact O-N 3.45Å; E640-F643 PolarHBondContact O-N 2.81Å; E640-I644 WeakPolarHBondContact O-CB 3.33Å; E640-I644 VanDerWaalsContact O-CG1 3.22Å; E640-I644 WeakPolarHBondContact O-CG1 3.48Å; E640-I644 PolarHBondContact O-N 3.43Å
641I92Very high90.3Very high99 Ų99104.4 Ų104.451%0.50850%0.503SS..Hα-helixtrans-60.1-42.5175.4-72.5164.9000110.4K637 L638 I644 R645K637-I641 WeakPolarHBondContact O-CB 3.37Å; K637-I641 WeakPolarHBondContact O-CD1 3.38Å; K637-I641 WeakPolarHBondContact O-CG1 3.29Å; K637-I641 PolarHBondContact O-N 3.47Å; L638-I641 PolarHBondContact O-N 3.25Å; I641-I644 PolarHBondContact O-N 2.95Å; I641-R645 WeakPolarHBondContact O-CB 3.3Å; I641-R645 PolarHBondContact O-N 3.08Å
642D90.3Very high90.2Very high100 Ų100100.9 Ų100.954%0.53550%0.497SS..Hα-helixtrans-65.8-41.5176.9-73.1-21.7000111.8L638 T639 E640 R645 S646L638-D642 PolarHBondContact O-N 2.81Å; T639-D642 PolarHBondContact O-N 3.34Å; E640-D642 VanDerWaalsContact C-N 3.29Å; E640-D642 PolarHBondContact O-N 3.45Å; D642-R645 PolarHBondContact O-N 2.91Å; D642-S646 WeakPolarHBondContact O-CB 3.31Å; D642-S646 PolarHBondContact O-N 3.38Å
643F87.4Confident90.2Very high142 Ų142101 Ų10162%0.62350%0.495SS*.Hα-helixtrans-64.4-44174.3-78.8-55000112.4T639 E640 R645 S646 L647T639-F643 WeakPolarHBondContact O-CD2 3.42Å; T639-F643 WeakPolarHBondContact O-CG 3.47Å; T639-F643 PolarHBondContact O-N 2.85Å; E640-F643 PolarHBondContact O-N 2.81Å; F643-R645 VanDerWaalsContact C-N 3.34Å; F643-S646 PolarHBondContact O-N 3.15Å; F643-L647 WeakPolarHBondContact O-CB 3.45Å; F643-L647 WeakPolarHBondContact O-CG 3.5Å; F643-L647 PolarHBondContact O-N 2.85Å
644I92.7Very high90Very high87 Ų87100.2 Ų100.245%0.44650%0.499SS..Hα-helixtrans-64.1-41.6177-69.7167.7000110.1E640 I641 L647 K648E640-I644 WeakPolarHBondContact O-CB 3.33Å; E640-I644 VanDerWaalsContact O-CG1 3.22Å; E640-I644 WeakPolarHBondContact O-CG1 3.48Å; E640-I644 PolarHBondContact O-N 3.43Å; I641-I644 PolarHBondContact O-N 2.95Å; I644-L647 PolarHBondContact O-N 3.47Å; I644-K648 HydrophobicContact CG2-CD 4.17Å; I644-K648 HydrophobicContact CG2-CG 4.45Å; I644-K648 WeakPolarHBondContact O-CB 3.34Å; I644-K648 WeakPolarHBondContact O-CG 3.45Å; I644-K648 PolarHBondContact O-N 2.78Å
645R89.9Confident89.8Confident159 Ų15998.5 Ų98.560%0.650%0.497SS*.Hα-helixtrans-60.8-47.5174.5179.8-177.7-84.3-177.7-4.8110.5I641 D642 F643 L647 K648 E649I641-R645 WeakPolarHBondContact O-CB 3.3Å; I641-R645 PolarHBondContact O-N 3.08Å; D642-R645 PolarHBondContact O-N 2.91Å; F643-R645 VanDerWaalsContact C-N 3.34Å; R645-L647 VanDerWaalsContact C-N 3.35Å; R645-L647 PolarHBondContact O-N 3.18Å; R645-K648 PolarHBondContact O-N 3.41Å; R645-E649 WeakPolarHBondContact O-CG 3.45Å; R645-E649 PolarHBondContact O-N 2.79Å
646S91.9Very high89.7Confident58 Ų5898.5 Ų98.541%0.40650%0.5SS..Hα-helixtrans-62.5-40.1177.9-178.10000112.6D642 F643 E649 K650D642-S646 WeakPolarHBondContact O-CB 3.31Å; D642-S646 PolarHBondContact O-N 3.38Å; F643-S646 PolarHBondContact O-N 3.15Å; S646-E649 PolarHBondContact O-N 3.32Å; S646-K650 WeakPolarHBondContact O-CG 3.45Å; S646-K650 PolarHBondContact O-N 3.45Å
647L89.4Confident89.7Confident106 Ų10699.3 Ų99.356%0.55550%0.504SS*.Hα-helixtrans-64.2-45.7174.5-82.8164.6000111.4F643 I644 R645 E649 K650 E651F643-L647 WeakPolarHBondContact O-CB 3.45Å; F643-L647 WeakPolarHBondContact O-CG 3.5Å; F643-L647 PolarHBondContact O-N 2.85Å; I644-L647 PolarHBondContact O-N 3.47Å; R645-L647 VanDerWaalsContact C-N 3.35Å; R645-L647 PolarHBondContact O-N 3.18Å; L647-E649 VanDerWaalsContact C-N 3.32Å; L647-E649 PolarHBondContact O-N 3.26Å; L647-K650 CarbonylContact O-C 3.59Å; L647-K650 PolarHBondContact O-N 2.99Å; L647-E651 WeakPolarHBondContact O-CB 3.4Å; L647-E651 WeakPolarHBondContact O-CG 3.34Å; L647-E651 PolarHBondContact O-N 3.37Å
648K90.3Very high89.6Confident126 Ų12699.6 Ų99.655%0.54851%0.507SS..Hα-helixtrans-61.4-39.5175.8-76.8179.9177.4-1790112.2I644 R645 K650 E651 T652I644-K648 HydrophobicContact CG2-CD 4.17Å; I644-K648 HydrophobicContact CG2-CG 4.45Å; I644-K648 WeakPolarHBondContact O-CB 3.34Å; I644-K648 WeakPolarHBondContact O-CG 3.45Å; I644-K648 PolarHBondContact O-N 2.78Å; R645-K648 PolarHBondContact O-N 3.41Å; K648-K650 VanDerWaalsContact C-N 3.31Å; K648-K650 PolarHBondContact O-N 3.42Å; K648-E651 PolarHBondContact O-N 3.11Å; K648-T652 WeakPolarHBondContact O-CB 3.36Å; K648-T652 VanDerWaalsContact O-CG2 3.29Å; K648-T652 WeakPolarHBondContact O-CG2 3.47Å; K648-T652 PolarHBondContact O-N 3.17Å; K648-T652 PolarHBondContact O-OG1 3.48Å
649E91Very high89.6Confident103 Ų10398.8 Ų98.848%0.48150%0.5SS..Hα-helixtrans-61.4-40.8172.7-75.4172.4-172.300111.1R645 S646 L647 T652 E653R645-E649 WeakPolarHBondContact O-CG 3.45Å; R645-E649 PolarHBondContact O-N 2.79Å; S646-E649 PolarHBondContact O-N 3.32Å; L647-E649 VanDerWaalsContact C-N 3.32Å; L647-E649 PolarHBondContact O-N 3.26Å; E649-T652 WeakPolarHBondContact CA-OG1 3.47Å; E649-T652 PolarHBondContact O-OG1 2.92Å; E649-E653 WeakPolarHBondContact O-CG 3.48Å; E649-E653 PolarHBondContact O-N 2.88Å
650K90.6Very high89.6Confident113 Ų113102.7 Ų102.749%0.49151%0.512SS..Hα-helixtrans-72.5-37176.5-68.1-70156.9-149.20113.7S646 L647 K648 E653 A654S646-K650 WeakPolarHBondContact O-CG 3.45Å; S646-K650 PolarHBondContact O-N 3.45Å; L647-K650 CarbonylContact O-C 3.59Å; L647-K650 PolarHBondContact O-N 2.99Å; K648-K650 VanDerWaalsContact C-N 3.31Å; K648-K650 PolarHBondContact O-N 3.42Å; K650-E653 VanDerWaalsContact NZ-CD 3.27Å; K650-E653 IonicContact NZ-OE1 3.04Å; K650-E653 PolarHBondContact NZ-OE1 3.16Å; K650-E653 IonicContact NZ-OE2 2.69Å; K650-E653 PolarHBondContact NZ-OE2 3.38Å; K650-E653 PolarHBondContact O-N 3.19Å; K650-A654 WeakPolarHBondContact O-CB 3.4Å; K650-A654 PolarHBondContact O-N 3.15Å
651E86.5Confident89.5Confident128 Ų128100.7 Ų100.760%0.59851%0.508SS*.Hα-helixtrans-65.5-41.2174.3-75.517816700111.2L647 K648 A654 A655L647-E651 WeakPolarHBondContact O-CB 3.4Å; L647-E651 WeakPolarHBondContact O-CG 3.34Å; L647-E651 PolarHBondContact O-N 3.37Å; K648-E651 PolarHBondContact O-N 3.11Å; E651-A654 PolarHBondContact O-N 2.87Å; E651-A655 VanDerWaalsContact O-CB 3.29Å; E651-A655 WeakPolarHBondContact O-CB 3.5Å; E651-A655 PolarHBondContact O-N 3.43Å
652T90Very high89.4Confident79 Ų7999.8 Ų99.849%0.48550%0.504SS..Hα-helixtrans-66.4-43174.748.40000111.6K648 E649 A654 A655 D656K648-T652 WeakPolarHBondContact O-CB 3.36Å; K648-T652 VanDerWaalsContact O-CG2 3.29Å; K648-T652 WeakPolarHBondContact O-CG2 3.47Å; K648-T652 PolarHBondContact O-N 3.17Å; K648-T652 PolarHBondContact O-OG1 3.48Å; E649-T652 WeakPolarHBondContact CA-OG1 3.47Å; E649-T652 PolarHBondContact O-OG1 2.92Å; T652-A654 VanDerWaalsContact C-N 3.31Å; T652-A654 PolarHBondContact O-N 3.38Å; T652-A655 PolarHBondContact O-N 2.87Å; T652-D656 WeakPolarHBondContact O-CB 3.49Å; T652-D656 VanDerWaalsContact O-CG 3.26Å; T652-D656 PolarHBondContact O-N 2.82Å
653E89.8Confident89.2Confident96 Ų96100.3 Ų100.345%0.44950%0.501SS..Hα-helixtrans-57.6-42.1171.2-76.9175-164.600112.4E649 K650 L657E649-E653 WeakPolarHBondContact O-CG 3.48Å; E649-E653 PolarHBondContact O-N 2.88Å; K650-E653 VanDerWaalsContact NZ-CD 3.27Å; K650-E653 IonicContact NZ-OE1 3.04Å; K650-E653 PolarHBondContact NZ-OE1 3.16Å; K650-E653 IonicContact NZ-OE2 2.69Å; K650-E653 PolarHBondContact NZ-OE2 3.38Å; K650-E653 PolarHBondContact O-N 3.19Å; E653-L657 WeakPolarHBondContact O-CG 3.44Å; E653-L657 PolarHBondContact O-N 2.88Å; E653-L657 VanDerWaalsContact O-N 3.08Å
654A87.2Confident89.1Confident56 Ų5696.3 Ų96.346%0.46350%0.495SS..Hα-helixtrans-69.4-40.7178.500000112.2K650 E651 T652 L657 Q658K650-A654 WeakPolarHBondContact O-CB 3.4Å; K650-A654 PolarHBondContact O-N 3.15Å; E651-A654 PolarHBondContact O-N 2.87Å; T652-A654 VanDerWaalsContact C-N 3.31Å; T652-A654 PolarHBondContact O-N 3.38Å; A654-L657 PolarHBondContact O-N 3.36Å; A654-Q658 WeakPolarHBondContact O-CB 3.39Å; A654-Q658 PolarHBondContact O-N 2.79Å
655A88.3Confident88.8Confident56 Ų5696.4 Ų96.446%0.46350%0.496SS..Hα-helixtrans-63.4-43.5175.100000111.2E651 T652 L657 Q658 E659E651-A655 VanDerWaalsContact O-CB 3.29Å; E651-A655 WeakPolarHBondContact O-CB 3.5Å; E651-A655 PolarHBondContact O-N 3.43Å; T652-A655 PolarHBondContact O-N 2.87Å; A655-L657 VanDerWaalsContact C-N 3.29Å; A655-L657 PolarHBondContact O-N 2.85Å; A655-Q658 PolarHBondContact O-N 3.21Å; A655-E659 WeakPolarHBondContact O-CB 3.43Å; A655-E659 PolarHBondContact O-N 2.99Å
656D90.1Very high88.7Confident88 Ų8894.9 Ų94.947%0.47149%0.494SS..Hα-helixtrans-61.9-37175.6-75.5-6.7000111.9T652 K660T652-D656 WeakPolarHBondContact O-CB 3.49Å; T652-D656 VanDerWaalsContact O-CG 3.26Å; T652-D656 PolarHBondContact O-N 2.82Å; D656-K660 VanDerWaalsContact O-CG 3.27Å; D656-K660 WeakPolarHBondContact O-CG 3.27Å; D656-K660 PolarHBondContact O-N 2.74Å; D656-K660 VanDerWaalsContact O-N 3.13Å
657L88.3Confident88.3Confident108 Ų10896.8 Ų96.857%0.56550%0.499SS*.Hα-helixtrans-70.2-42.4174.8-75.4171.7000111.8E653 A654 A655 K660 V661E653-L657 WeakPolarHBondContact O-CG 3.44Å; E653-L657 PolarHBondContact O-N 2.88Å; E653-L657 VanDerWaalsContact O-N 3.08Å; A654-L657 PolarHBondContact O-N 3.36Å; A655-L657 VanDerWaalsContact C-N 3.29Å; A655-L657 PolarHBondContact O-N 2.85Å; L657-K660 WeakPolarHBondContact O-CB 3.2Å; L657-K660 PolarHBondContact O-N 2.8Å; L657-V661 WeakPolarHBondContact O-CG2 3.37Å; L657-V661 PolarHBondContact O-N 3.34Å
658Q89.3Confident88Confident103 Ų10397.7 Ų97.748%0.48150%0.499SS..Hα-helixtrans-63.6-42.6176-171.661.637.200110.8A654 A655 K660 V661 D662A654-Q658 WeakPolarHBondContact O-CB 3.39Å; A654-Q658 PolarHBondContact O-N 2.79Å; A655-Q658 PolarHBondContact O-N 3.21Å; Q658-K660 VanDerWaalsContact C-N 3.28Å; Q658-K660 PolarHBondContact O-N 3.39Å; Q658-V661 PolarHBondContact O-N 3.31Å; Q658-V661 VanDerWaalsContact O-N 3.07Å; Q658-D662 PolarHBondContact NE2-OD1 2.9Å; Q658-D662 WeakPolarHBondContact O-CB 3.24Å; Q658-D662 VanDerWaalsContact O-CG 3.26Å; Q658-D662 PolarHBondContact O-N 3.27Å
659E89.4Confident87.7Confident96 Ų9697.6 Ų97.645%0.44950%0.5SS..Hα-helixtrans-61-38175.9-165.9-168.9163.700111.3A655 K663A655-E659 WeakPolarHBondContact O-CB 3.43Å; A655-E659 PolarHBondContact O-N 2.99Å; E659-K663 HydrophobicContact CG-CD 4.47Å; E659-K663 VanDerWaalsContact O-CB 3.31Å; E659-K663 WeakPolarHBondContact O-CB 3.4Å; E659-K663 VanDerWaalsContact O-CG 3.27Å; E659-K663 WeakPolarHBondContact O-CG 3.34Å; E659-K663 PolarHBondContact O-N 3.16Å; E659-K663 WeakPolarHBondContact OE1-CE 3.47Å; E659-K663 IonicContact OE1-NZ 2.64Å; E659-K663 PolarHBondContact OE1-NZ 2.78Å
660K89Confident87.3Confident138 Ų13896 Ų9660%0.650%0.495SS*.Hα-helixtrans-65.7-38.8173.5-74.2168-173.1167.20112.5D656 L657 Q658 A664D656-K660 VanDerWaalsContact O-CG 3.27Å; D656-K660 WeakPolarHBondContact O-CG 3.27Å; D656-K660 PolarHBondContact O-N 2.74Å; D656-K660 VanDerWaalsContact O-N 3.13Å; L657-K660 WeakPolarHBondContact O-CB 3.2Å; L657-K660 PolarHBondContact O-N 2.8Å; Q658-K660 VanDerWaalsContact C-N 3.28Å; Q658-K660 PolarHBondContact O-N 3.39Å; K660-A664 WeakPolarHBondContact O-CB 3.47Å; K660-A664 PolarHBondContact O-N 3.29Å
661V86.7Confident86.7Confident73 Ų7396 Ų9644%0.44250%0.499SS..Hα-helixtrans-67.6-45.8176.41710000110.7L657 Q658 K663 A664 L665L657-V661 WeakPolarHBondContact O-CG2 3.37Å; L657-V661 PolarHBondContact O-N 3.34Å; Q658-V661 PolarHBondContact O-N 3.31Å; Q658-V661 VanDerWaalsContact O-N 3.07Å; V661-K663 VanDerWaalsContact C-N 3.35Å; V661-K663 PolarHBondContact O-N 3.5Å; V661-A664 PolarHBondContact O-N 2.81Å; V661-A664 VanDerWaalsContact O-N 3.14Å; V661-L665 HydrophobicContact CG1-CD1 4.11Å; V661-L665 HydrophobicContact CG1-CG 4.44Å; V661-L665 WeakPolarHBondContact O-CG 3.4Å; V661-L665 PolarHBondContact O-N 3.39Å
662D88.6Confident86.4Confident81 Ų8194.2 Ų94.243%0.43349%0.493SS..Hα-helixtrans-64-41.4179-67.5-14.4000110.7Q658 A664 L665 K666Q658-D662 PolarHBondContact NE2-OD1 2.9Å; Q658-D662 WeakPolarHBondContact O-CB 3.24Å; Q658-D662 VanDerWaalsContact O-CG 3.26Å; Q658-D662 PolarHBondContact O-N 3.27Å; D662-A664 PolarHBondContact O-N 3.35Å; D662-L665 PolarHBondContact O-N 3.4Å; D662-K666 WeakPolarHBondContact O-CB 3.33Å; D662-K666 PolarHBondContact O-N 2.98Å
663K87.4Confident85.9Confident110 Ų11093.3 Ų93.348%0.47849%0.49SS..Hα-helixtrans-58.2-46.3170.6-79.4173.9-175.8164.20111.5E659 V661 L665 K666 D667E659-K663 HydrophobicContact CG-CD 4.47Å; E659-K663 VanDerWaalsContact O-CB 3.31Å; E659-K663 WeakPolarHBondContact O-CB 3.4Å; E659-K663 VanDerWaalsContact O-CG 3.27Å; E659-K663 WeakPolarHBondContact O-CG 3.34Å; E659-K663 PolarHBondContact O-N 3.16Å; E659-K663 WeakPolarHBondContact OE1-CE 3.47Å; E659-K663 IonicContact OE1-NZ 2.64Å; E659-K663 PolarHBondContact OE1-NZ 2.78Å; V661-K663 VanDerWaalsContact C-N 3.35Å; V661-K663 PolarHBondContact O-N 3.5Å; K663-L665 PolarHBondContact O-N 2.98Å; K663-K666 PolarHBondContact O-N 3.37Å; K663-D667 WeakPolarHBondContact O-CB 3.49Å; K663-D667 PolarHBondContact O-N 3.4Å
664A85.2Confident85.4Confident59 Ų5994 Ų9449%0.48849%0.494SS..Hα-helixtrans-66.6-36.1179.100000113.4K660 V661 D662 K668K660-A664 WeakPolarHBondContact O-CB 3.47Å; K660-A664 PolarHBondContact O-N 3.29Å; V661-A664 PolarHBondContact O-N 2.81Å; V661-A664 VanDerWaalsContact O-N 3.14Å; D662-A664 PolarHBondContact O-N 3.35Å; A664-K668 WeakPolarHBondContact O-CB 3.46Å; A664-K668 PolarHBondContact O-N 2.81Å
665L85.9Confident84.9Confident89 Ų8996.3 Ų96.347%0.46650%0.498SS..Hα-helixtrans-68.5-42.2174.5-75.3175.3000111.2V661 D662 K663 K668 E669V661-L665 HydrophobicContact CG1-CD1 4.11Å; V661-L665 HydrophobicContact CG1-CG 4.44Å; V661-L665 WeakPolarHBondContact O-CG 3.4Å; V661-L665 PolarHBondContact O-N 3.39Å; D662-L665 PolarHBondContact O-N 3.4Å; K663-L665 PolarHBondContact O-N 2.98Å; L665-K668 WeakPolarHBondContact O-CB 3.4Å; L665-K668 PolarHBondContact O-N 3.44Å; L665-E669 WeakPolarHBondContact O-CG 3.39Å; L665-E669 PolarHBondContact O-N 2.76Å
666K87.4Confident84.6Confident127 Ų12798 Ų9855%0.55250%0.502SS*.Hα-helixtrans-66-45.4176.6-166.9164.9-174.2171.20111.4D662 K663 K668 E669 D670D662-K666 WeakPolarHBondContact O-CB 3.33Å; D662-K666 PolarHBondContact O-N 2.98Å; K663-K666 PolarHBondContact O-N 3.37Å; K666-K668 PolarHBondContact O-N 3.13Å; K666-E669 CarbonylContact O-C 3.58Å; K666-E669 PolarHBondContact O-N 2.98Å; K666-E669 VanDerWaalsContact O-N 3.08Å; K666-D670 VanDerWaalsContact O-CB 3.25Å; K666-D670 WeakPolarHBondContact O-CB 3.12Å; K666-D670 PolarHBondContact O-N 3.14Å
667D84.6Confident83.9Confident97 Ų9799.6 Ų99.652%0.51951%0.506SS..Hα-helixtrans-57.4-37.8173.2-69.3-14.6000111.2K663 L671K663-D667 WeakPolarHBondContact O-CB 3.49Å; K663-D667 PolarHBondContact O-N 3.4Å; D667-L671 VanDerWaalsContact O-CB 3.23Å; D667-L671 WeakPolarHBondContact O-CB 3.29Å; D667-L671 WeakPolarHBondContact O-CD1 3.46Å; D667-L671 WeakPolarHBondContact O-CG 3.42Å; D667-L671 PolarHBondContact O-N 2.71Å
668K82.4Confident83.3Confident126 Ų12698.2 Ų98.255%0.54850%0.503SS..Hα-helixtrans-67.4-45.4174.4177.8-165.2166.6-169.40112.1A664 L665 K666 L671 L672A664-K668 WeakPolarHBondContact O-CB 3.46Å; A664-K668 PolarHBondContact O-N 2.81Å; L665-K668 WeakPolarHBondContact O-CB 3.4Å; L665-K668 PolarHBondContact O-N 3.44Å; K666-K668 PolarHBondContact O-N 3.13Å; K668-L671 PolarHBondContact O-N 2.94Å; K668-L672 HydrophobicContact CG-CD1 4.26Å; K668-L672 WeakPolarHBondContact O-CB 3.49Å; K668-L672 VanDerWaalsContact O-CG 3.31Å; K668-L672 WeakPolarHBondContact O-CG 3.48Å; K668-L672 PolarHBondContact O-N 3.14Å
669E83.4Confident82.4Confident124 Ų12499.8 Ų99.858%0.57951%0.51SS*.Hα-helixtrans-66-40.1177.9-77.2-178.5174.300111.8L665 K666 L672 S673L665-E669 WeakPolarHBondContact O-CG 3.39Å; L665-E669 PolarHBondContact O-N 2.76Å; K666-E669 CarbonylContact O-C 3.58Å; K666-E669 PolarHBondContact O-N 2.98Å; K666-E669 VanDerWaalsContact O-N 3.08Å; E669-L672 PolarHBondContact O-N 2.92Å; E669-S673 VanDerWaalsContact O-CB 3.25Å; E669-S673 WeakPolarHBondContact O-CB 3.4Å; E669-S673 PolarHBondContact O-N 2.94Å; E669-S673 PolarHBondContact O-OG 2.77Å
670D83.4Confident81.6Confident70 Ų70103.4 Ų103.437%0.37452%0.519SS..Hα-helixtrans-65.3-45.6175.3-71.1-15.4000109.3K666 L672 S673 E674K666-D670 VanDerWaalsContact O-CB 3.25Å; K666-D670 WeakPolarHBondContact O-CB 3.12Å; K666-D670 PolarHBondContact O-N 3.14Å; D670-L672 VanDerWaalsContact C-N 3.35Å; D670-L672 PolarHBondContact O-N 3.22Å; D670-S673 CarbonylContact O-C 3.56Å; D670-S673 PolarHBondContact O-N 3.36Å; D670-E674 VanDerWaalsContact O-CB 3.27Å; D670-E674 WeakPolarHBondContact O-CB 3.25Å; D670-E674 VanDerWaalsContact O-CG 3.27Å; D670-E674 WeakPolarHBondContact O-CG 3.37Å; D670-E674 PolarHBondContact O-N 2.9Å
671L78.8Confident80.9Confident111 Ų11199.6 Ų99.658%0.58151%0.508SS*.Hα-helixtrans-63.5-36.4174.3-76.1169.2000113.2D667 K668 L675D667-L671 VanDerWaalsContact O-CB 3.23Å; D667-L671 WeakPolarHBondContact O-CB 3.29Å; D667-L671 WeakPolarHBondContact O-CD1 3.46Å; D667-L671 WeakPolarHBondContact O-CG 3.42Å; D667-L671 PolarHBondContact O-N 2.71Å; K668-L671 PolarHBondContact O-N 2.94Å; L671-L675 VanDerWaalsContact O-CB 3.29Å; L671-L675 WeakPolarHBondContact O-CB 3.33Å; L671-L675 PolarHBondContact O-N 2.79Å
672L79.5Confident80.2Confident91 Ų91100.7 Ų100.748%0.47651%0.51SS..Hα-helixtrans-69.9-39.7174.5-77.5170.5000111.3K668 E669 D670 L675 V676K668-L672 HydrophobicContact CG-CD1 4.26Å; K668-L672 WeakPolarHBondContact O-CB 3.49Å; K668-L672 VanDerWaalsContact O-CG 3.31Å; K668-L672 WeakPolarHBondContact O-CG 3.48Å; K668-L672 PolarHBondContact O-N 3.14Å; E669-L672 PolarHBondContact O-N 2.92Å; D670-L672 VanDerWaalsContact C-N 3.35Å; D670-L672 PolarHBondContact O-N 3.22Å; L672-L675 PolarHBondContact O-N 3.34Å; L672-V676 VanDerWaalsContact O-CG2 3.29Å; L672-V676 WeakPolarHBondContact O-CG2 3.29Å; L672-V676 PolarHBondContact O-N 2.91Å
673S79.4Confident79.6Confident60 Ų60103.3 Ų103.342%0.4252%0.521SS..Hα-helixtrans-67.7-44.9176.3-61.10000110.3E669 D670 L675 V676 E677E669-S673 VanDerWaalsContact O-CB 3.25Å; E669-S673 WeakPolarHBondContact O-CB 3.4Å; E669-S673 PolarHBondContact O-N 2.94Å; E669-S673 PolarHBondContact O-OG 2.77Å; D670-S673 CarbonylContact O-C 3.56Å; D670-S673 PolarHBondContact O-N 3.36Å; S673-L675 VanDerWaalsContact C-N 3.3Å; S673-L675 PolarHBondContact O-N 2.87Å; S673-V676 CarbonylContact O-C 3.58Å; S673-V676 PolarHBondContact O-N 3.39Å; S673-E677 WeakPolarHBondContact O-CB 3.44Å; S673-E677 VanDerWaalsContact O-CG 3.24Å; S673-E677 WeakPolarHBondContact O-CG 3.44Å; S673-E677 PolarHBondContact O-N 2.82Å
674E78.8Confident78.8Confident112 Ų112102.7 Ų102.752%0.52352%0.523SS..Hα-helixtrans-59.2-39.4171.7-76.9-178.3-178.200111D670 E677 V678D670-E674 VanDerWaalsContact O-CB 3.27Å; D670-E674 WeakPolarHBondContact O-CB 3.25Å; D670-E674 VanDerWaalsContact O-CG 3.27Å; D670-E674 WeakPolarHBondContact O-CG 3.37Å; D670-E674 PolarHBondContact O-N 2.9Å; E674-E677 PolarHBondContact O-N 3.32Å; E674-V678 WeakPolarHBondContact O-CB 3.33Å; E674-V678 WeakPolarHBondContact O-CG2 3.46Å; E674-V678 PolarHBondContact O-N 3.13Å
675L77.9Confident77.7Confident104 Ų104107.8 Ų107.855%0.54553%0.529SS..Hα-helixtrans-64.7-47.2174.8-175.269.2000111.5L671 L672 S673 E677 V678 E679L671-L675 VanDerWaalsContact O-CB 3.29Å; L671-L675 WeakPolarHBondContact O-CB 3.33Å; L671-L675 PolarHBondContact O-N 2.79Å; L672-L675 PolarHBondContact O-N 3.34Å; S673-L675 VanDerWaalsContact C-N 3.3Å; S673-L675 PolarHBondContact O-N 2.87Å; L675-E677 VanDerWaalsContact C-N 3.32Å; L675-E677 PolarHBondContact O-N 3.24Å; L675-V678 PolarHBondContact O-N 3.39Å; L675-E679 PolarHBondContact O-N 3.39Å
676V80.2Confident76.7Confident90 Ų90109.7 Ų109.755%0.54554%0.536SS..Hα-helixtrans-63.5-40.7176.7170.40000110.7L672 S673 E679 R680L672-V676 VanDerWaalsContact O-CG2 3.29Å; L672-V676 WeakPolarHBondContact O-CG2 3.29Å; L672-V676 PolarHBondContact O-N 2.91Å; S673-V676 CarbonylContact O-C 3.58Å; S673-V676 PolarHBondContact O-N 3.39Å; V676-E679 PolarHBondContact O-N 3.17Å; V676-R680 WeakPolarHBondContact O-CB 3.49Å; V676-R680 PolarHBondContact O-N 2.95Å
677E76.8Confident75.7Confident122 Ų122109.6 Ų109.657%0.5754%0.536SS*.Hα-helixtrans-71.5-35.7178.1-75.5-171.7172.400111.8S673 E674 L675 R680 T681S673-E677 WeakPolarHBondContact O-CB 3.44Å; S673-E677 VanDerWaalsContact O-CG 3.24Å; S673-E677 WeakPolarHBondContact O-CG 3.44Å; S673-E677 PolarHBondContact O-N 2.82Å; E674-E677 PolarHBondContact O-N 3.32Å; L675-E677 VanDerWaalsContact C-N 3.32Å; L675-E677 PolarHBondContact O-N 3.24Å; E677-R680 PolarHBondContact O-N 3.5Å; E677-T681 WeakPolarHBondContact O-CA 3.26Å; E677-T681 WeakPolarHBondContact O-CB 3.41Å; E677-T681 WeakPolarHBondContact O-CG2 3.27Å; E677-T681 PolarHBondContact O-N 2.97Å; E677-T681 PolarHBondContact O-OG1 2.78Å
678V74.2Confident74.5Confident80 Ų80110.8 Ų110.849%0.48554%0.536SS..Hα-helixtrans-64.2-43.7171168.40000109.8E674 L675 T681 I682E674-V678 WeakPolarHBondContact O-CB 3.33Å; E674-V678 WeakPolarHBondContact O-CG2 3.46Å; E674-V678 PolarHBondContact O-N 3.13Å; L675-V678 PolarHBondContact O-N 3.39Å; V678-T681 VanDerWaalsContact CA-OG1 3.28Å; V678-T681 WeakPolarHBondContact CA-OG1 3.25Å; V678-T681 PolarHBondContact O-N 3.41Å; V678-T681 PolarHBondContact O-OG1 3.15Å; V678-I682 HydrophobicContact CG1-CD1 3.93Å; V678-I682 WeakPolarHBondContact O-CB 3.36Å; V678-I682 WeakPolarHBondContact O-CD1 3.28Å; V678-I682 WeakPolarHBondContact O-CG1 3.44Å; V678-I682 PolarHBondContact O-N 2.97Å
679E71.4Confident73.4Confident135 Ų135108.7 Ų108.763%0.63153%0.534SS*.Hα-helixtrans-63.7-44.3173.6-74.9-157165.500112.4L675 V676 T681 I682 M683L675-E679 PolarHBondContact O-N 3.39Å; V676-E679 PolarHBondContact O-N 3.17Å; E679-T681 VanDerWaalsContact C-N 3.33Å; E679-T681 PolarHBondContact O-N 3.47Å; E679-I682 PolarHBondContact O-N 3.21Å; E679-M683 PolarHBondContact O-N 2.89Å
680R73.4Confident72.3Confident173 Ų173108.6 Ų108.665%0.65353%0.533SS*.Hα-helixtrans-66.4-38.1179.5-151.1178.7-162.5179.94.7110.8V676 E677 M683 L684V676-R680 WeakPolarHBondContact O-CB 3.49Å; V676-R680 PolarHBondContact O-N 2.95Å; E677-R680 PolarHBondContact O-N 3.5Å; R680-M683 PolarHBondContact O-N 3.45Å; R680-L684 HydrophobicContact CG-CD1 4.16Å; R680-L684 WeakPolarHBondContact O-CB 3.49Å; R680-L684 WeakPolarHBondContact O-CD1 3.36Å; R680-L684 WeakPolarHBondContact O-CG 3.36Å; R680-L684 PolarHBondContact O-N 2.69Å
681T74.3Confident70.9Confident58 Ų58109.1 Ų109.136%0.35654%0.536SS..Hα-helixtrans-72.1-37176.154.10000111.1E677 V678 E679 M683 L684 W685E677-T681 WeakPolarHBondContact O-CA 3.26Å; E677-T681 WeakPolarHBondContact O-CB 3.41Å; E677-T681 WeakPolarHBondContact O-CG2 3.27Å; E677-T681 PolarHBondContact O-N 2.97Å; E677-T681 PolarHBondContact O-OG1 2.78Å; V678-T681 VanDerWaalsContact CA-OG1 3.28Å; V678-T681 WeakPolarHBondContact CA-OG1 3.25Å; V678-T681 PolarHBondContact O-N 3.41Å; V678-T681 PolarHBondContact O-OG1 3.15Å; E679-T681 VanDerWaalsContact C-N 3.33Å; E679-T681 PolarHBondContact O-N 3.47Å; T681-M683 VanDerWaalsContact C-N 3.33Å; T681-M683 PolarHBondContact O-N 3.45Å; T681-L684 PolarHBondContact O-N 2.97Å; T681-W685 WeakPolarHBondContact O-CB 3.42Å; T681-W685 PolarHBondContact O-N 3.22Å
682I71.1Confident69.5Low95 Ų95106.9 Ų106.949%0.48753%0.528SS..Hα-helixtrans-56.4-50.7169.8-71.3162.6000109.5V678 E679 L684 W685 E686V678-I682 HydrophobicContact CG1-CD1 3.93Å; V678-I682 WeakPolarHBondContact O-CB 3.36Å; V678-I682 WeakPolarHBondContact O-CD1 3.28Å; V678-I682 WeakPolarHBondContact O-CG1 3.44Å; V678-I682 PolarHBondContact O-N 2.97Å; E679-I682 PolarHBondContact O-N 3.21Å; I682-L684 PolarHBondContact O-N 2.79Å; I682-W685 PolarHBondContact O-N 2.86Å; I682-E686 WeakPolarHBondContact O-CG 3.49Å; I682-E686 PolarHBondContact O-N 3Å
683M75.2Confident68.4Low136 Ų136108.8 Ų108.867%0.6754%0.535SS*.Hα-helixtrans-64.4-40.2179.9-158.2-156.3-159.700112.7E679 R680 T681 K687E679-M683 PolarHBondContact O-N 2.89Å; R680-M683 PolarHBondContact O-N 3.45Å; T681-M683 VanDerWaalsContact C-N 3.33Å; T681-M683 PolarHBondContact O-N 3.45Å; M683-K687 WeakPolarHBondContact O-CB 3.24Å; M683-K687 PolarHBondContact O-N 3.45Å
684L72.1Confident66.8Low98 Ų98111.9 Ų111.951%0.51354%0.543SS..Hα-helixtrans-72.6-35.1178.1-73.5168.8000111.5R680 T681 I682 K687 K688R680-L684 HydrophobicContact CG-CD1 4.16Å; R680-L684 WeakPolarHBondContact O-CB 3.49Å; R680-L684 WeakPolarHBondContact O-CD1 3.36Å; R680-L684 WeakPolarHBondContact O-CG 3.36Å; R680-L684 PolarHBondContact O-N 2.69Å; T681-L684 PolarHBondContact O-N 2.97Å; I682-L684 PolarHBondContact O-N 2.79Å; L684-K687 CarbonylContact O-C 3.59Å; L684-K687 PolarHBondContact O-N 3.48Å; L684-K688 WeakPolarHBondContact O-CA 3.33Å; L684-K688 WeakPolarHBondContact O-CB 3.37Å; L684-K688 PolarHBondContact O-N 3.34Å
685W62.4Low65.6Low165 Ų165110.6 Ų110.663%0.62554%0.543SS*.Hα-helixtrans-69.8-37.2174.3-81.6111.2000110.8T681 I682 K687 K688 V689T681-W685 WeakPolarHBondContact O-CB 3.42Å; T681-W685 PolarHBondContact O-N 3.22Å; I682-W685 PolarHBondContact O-N 2.86Å; W685-K687 VanDerWaalsContact C-N 3.33Å; W685-K687 PolarHBondContact O-N 3.34Å; W685-K688 PolarHBondContact O-N 2.9Å; W685-V689 VanDerWaalsContact O-CB 3.31Å; W685-V689 WeakPolarHBondContact O-CB 3.26Å; W685-V689 WeakPolarHBondContact O-CG2 3.36Å; W685-V689 PolarHBondContact O-N 3.33Å
686E63.6Low64Low129 Ų129114.9 Ų114.960%0.60356%0.557SS**Hα-helixtrans-59-44.1169.6-74.2175.8163.800111.6I682 Q690I682-E686 WeakPolarHBondContact O-CG 3.49Å; I682-E686 PolarHBondContact O-N 3Å; E686-Q690 PolarHBondContact O-N 2.93Å
687K66.8Low62.5Low126 Ų126119.5 Ų119.555%0.54857%0.57SS.*Hα-helixtrans-76-30.6179.3-162.9166.1-174.91740113.7M683 L684 W685 Q690 L691M683-K687 WeakPolarHBondContact O-CB 3.24Å; M683-K687 PolarHBondContact O-N 3.45Å; L684-K687 CarbonylContact O-C 3.59Å; L684-K687 PolarHBondContact O-N 3.48Å; W685-K687 VanDerWaalsContact C-N 3.33Å; W685-K687 PolarHBondContact O-N 3.34Å; K687-Q690 WeakPolarHBondContact O-CB 3.43Å; K687-Q690 PolarHBondContact O-N 3.16Å; K687-L691 HydrophobicContact CG-CD1 4.24Å; K687-L691 WeakPolarHBondContact O-CB 3.38Å; K687-L691 WeakPolarHBondContact O-CG 3.4Å; K687-L691 PolarHBondContact O-N 3.42Å
688K59.2Low60.9Low121 Ų121117.5 Ų117.553%0.52657%0.569SS.*Hα-helixtrans-81.9-27.5178.7-160.9173.5-172.1-179.50111L684 W685 L691 C692L684-K688 WeakPolarHBondContact O-CA 3.33Å; L684-K688 WeakPolarHBondContact O-CB 3.37Å; L684-K688 PolarHBondContact O-N 3.34Å; W685-K688 PolarHBondContact O-N 2.9Å; K688-L691 PolarHBondContact O-N 3.27Å; K688-C692 WeakPolarHBondContact O-CA 3.28Å; K688-C692 WeakPolarHBondContact O-CB 3.22Å; K688-C692 PolarHBondContact O-N 2.85Å; K688-C692 PolarHBondContact O-SG 2.84Å
689V58.5Low59.1Low82 Ų82119.5 Ų119.550%0.49758%0.581SS.*Hα-helixtrans-62.9-44.3164.7168.60000109.8W685 E693W685-V689 VanDerWaalsContact O-CB 3.31Å; W685-V689 WeakPolarHBondContact O-CB 3.26Å; W685-V689 WeakPolarHBondContact O-CG2 3.36Å; W685-V689 PolarHBondContact O-N 3.33Å; V689-E693 WeakPolarHBondContact O-CG 3.43Å; V689-E693 PolarHBondContact O-N 3.43Å
690Q62Low57.2Low122 Ų122120.9 Ų120.957%0.5759%0.593SS**Hα-helixtrans-60-50.9172.1-81.3179.6-17.500112.6E686 K687 C692 E693 E694E686-Q690 PolarHBondContact O-N 2.93Å; K687-Q690 WeakPolarHBondContact O-CB 3.43Å; K687-Q690 PolarHBondContact O-N 3.16Å; Q690-C692 PolarHBondContact O-N 3Å; Q690-E693 PolarHBondContact O-N 2.93Å; Q690-E694 WeakPolarHBondContact O-CG 3.38Å; Q690-E694 PolarHBondContact O-N 3.36Å; Q690-E694 VanDerWaalsContact O-N 3.13Å
691L54.4Low55.4Low82 Ų82118.2 Ų118.243%0.42960%0.6SS.*Hα-helixtrans-72.6-28-177.1-73.7165.4000113.1K687 K688 E694 T695K687-L691 HydrophobicContact CG-CD1 4.24Å; K687-L691 WeakPolarHBondContact O-CB 3.38Å; K687-L691 WeakPolarHBondContact O-CG 3.4Å; K687-L691 PolarHBondContact O-N 3.42Å; K688-L691 PolarHBondContact O-N 3.27Å; L691-E694 PolarHBondContact O-N 3.3Å; L691-T695 VanDerWaalsContact O-CB 3.32Å; L691-T695 WeakPolarHBondContact O-CB 3.5Å; L691-T695 WeakPolarHBondContact O-CG2 3.28Å; L691-T695 PolarHBondContact O-N 3.48Å; L691-T695 PolarHBondContact O-OG1 3.31Å
692C49.4Very low53.5Low63 Ų63122.9 Ų122.943%0.42662%0.622SS.*Hα-helixtrans-77.2-28173.1-73.40000112.2K688 Q690 E694 T695 K696K688-C692 WeakPolarHBondContact O-CA 3.28Å; K688-C692 WeakPolarHBondContact O-CB 3.22Å; K688-C692 PolarHBondContact O-N 2.85Å; K688-C692 PolarHBondContact O-SG 2.84Å; Q690-C692 PolarHBondContact O-N 3Å; C692-E694 VanDerWaalsContact C-N 3.26Å; C692-T695 WeakPolarHBondContact CA-OG1 3.2Å; C692-K696 WeakPolarHBondContact O-CB 3.43Å; C692-K696 PolarHBondContact O-N 3.22Å
693E54.7Low52.1Low131 Ų131126.7 Ų126.761%0.61264%0.642SS**Hα-helixtrans-65.2-32.1165-79.3-175.7158.900112V689 Q690V689-E693 WeakPolarHBondContact O-CG 3.43Å; V689-E693 PolarHBondContact O-N 3.43Å; Q690-E693 PolarHBondContact O-N 2.93Å
694E47.5Very low50.4Low125 Ų125123.6 Ų123.658%0.58465%0.645SS**Hα-helixtrans-83-40.1179.1-70.4175.4173.700113.4Q690 L691 C692Q690-E694 WeakPolarHBondContact O-CG 3.38Å; Q690-E694 PolarHBondContact O-N 3.36Å; Q690-E694 VanDerWaalsContact O-N 3.13Å; L691-E694 PolarHBondContact O-N 3.3Å; C692-E694 VanDerWaalsContact C-N 3.26Å
695T52.6Low49Very low85 Ų85127.7 Ų127.752%0.52166%0.662SS.*Hα-helixtrans-86.1-28.7-176.751.40000113.3L691 C692 K697 S698L691-T695 VanDerWaalsContact O-CB 3.32Å; L691-T695 WeakPolarHBondContact O-CB 3.5Å; L691-T695 WeakPolarHBondContact O-CG2 3.28Å; L691-T695 PolarHBondContact O-N 3.48Å; L691-T695 PolarHBondContact O-OG1 3.31Å; C692-T695 WeakPolarHBondContact CA-OG1 3.2Å; T695-K697 PolarHBondContact O-N 3.34Å; T695-S698 CarbonylContact O-C 3.49Å; T695-S698 PolarHBondContact O-N 2.78Å
696K43.8Very low48.4Very low194 Ų194123 Ų12384%0.84367%0.665SS**THydrogen-bonded Turntrans-66.1-19.1169.4-165.9176.9178179.30112.4C692C692-K696 WeakPolarHBondContact O-CB 3.43Å; C692-K696 PolarHBondContact O-N 3.22Å
697K49.8Very low47.7Very low187 Ų187125.2 Ų125.281%0.81368%0.675SS**THydrogen-bonded Turntrans-83.2-8.6171-75.5179.9-179.4169.50113.9T695T695-K697 PolarHBondContact O-N 3.34Å
698S43.4Very low46.4Very low81 Ų81125.2 Ų125.257%0.56668%0.679SS**SBendtrans-140.282.5-169.2178.40000112T695T695-S698 CarbonylContact O-C 3.49Å; T695-S698 PolarHBondContact O-N 2.78Å
699V36.4Very low46.1Very low121 Ų121125 Ų12573%0.73368%0.683SS**  trans105.481.4158-169.40000114.5
700D31.5Very low45.9Very low164 Ų164126.9 Ų126.988%0.87769%0.694SS**  -77121.2128.6-78.4-37.7000107.8
701C34.5Very low45.1Very low117 Ų117127.8 Ų127.879%0.79170%0.701SS**  trans176.1109.5144.7-90.50000110.6
702D35.4Very low44.7Very low156 Ų156132.7 Ų132.783%0.83471%0.713SS**  trans-58.7147.1166.1-61-54.6000112.8
703I40Very low44.9Very low175 Ų175137.4 Ų137.490%0.89773%0.729SS**  trans-161.3116.9144.3-85.2128.2000109.9
704G40Very low45.3Very low72 Ų72137.4 Ų137.474%0.74273%0.729SS**  trans-135.6124.1154.400000107.9
705Q42.6Very low45.3Very low184 Ų184138 Ų13886%0.8674%0.735SS**  trans-168.831.8166.9-114.4-178.927.800114.4
706G50.5Low45.1Very low67 Ų67141.2 Ų141.269%0.69174%0.743SS**  trans-85-17177.500000115.6M708G706-M708 PolarHBondContact O-N 2.75Å
707E47.9Very low46Very low175 Ų175141.8 Ų141.882%0.81874%0.74SS**THydrogen-bonded Turntrans-84.7-6-167.4-64.9-176.1162.100114.7
708M40.2Very low46.6Very low126 Ų126139.6 Ų139.662%0.62174%0.735SS**THydrogen-bonded Turntrans-87.1-7.6-178.2-86.9178.965.300116G706G706-M708 PolarHBondContact O-N 2.75Å
709N52.2Low46.9Very low116 Ų116143 Ų14362%0.6274%0.742SS**SBendtrans-96.8-13.7-178.1-79.2-18.8000115.2
710V54.2Low47.8Very low121 Ų121142.8 Ų142.873%0.73374%0.74SS**G310 helixtrans-75.8-31.7179.1179.70000111.9R712V710-R712 VanDerWaalsContact C-N 3.27Å; V710-R712 PolarHBondContact O-N 2.77Å
711M45.9Very low49.4Very low142 Ų142143.7 Ų143.770%0.773%0.731SS**G310 helixtrans-69.6-12.1-176.6-80.8-174.9-87.100115.6
712R46.2Very low50.4Low184 Ų184146.9 Ų146.969%0.69473%0.732SS**G310 helixtrans-86.7-11.8-176-86.2-169.8-93.9-131.4-0.6116.3V710V710-R712 VanDerWaalsContact C-N 3.27Å; V710-R712 PolarHBondContact O-N 2.77Å
713H53.2Low51.2Low162 Ų162144.3 Ų144.375%0.7573%0.726SS**SBendtrans-92.9-17.9-174.8-76.980.8000115.5
714E63.8Low52.3Low132 Ų132140.5 Ų140.562%0.61772%0.715SS**G310 helixtrans-77.9-24.8-172.8-168.558.2-158.400113.8H716E714-H716 VanDerWaalsContact C-N 3.32Å; E714-H716 PolarHBondContact O-N 3.32Å
715I47.8Very low53.4Low138 Ų138142.7 Ų142.771%0.70871%0.709SS**G310 helixtrans-71.7-22.6-173-65.6176.8000112.7R717I715-R717 PolarHBondContact O-N 3.45Å
716H48.5Very low53.9Low151 Ų151140.9 Ų140.970%0.69970%0.704SS**G310 helixtrans-81.2-12.2-174.4-162.341.9000115E714E714-H716 VanDerWaalsContact C-N 3.32Å; E714-H716 PolarHBondContact O-N 3.32Å
717R62.2Low54.2Low206 Ų206145.8 Ų145.878%0.77771%0.709SS**G310 helixtrans-82.8-22.1-170-149.9177.1-176.4-170.51.1114.7I715I715-R717 PolarHBondContact O-N 3.45Å
718M61.5Low55.1Low142 Ų142143.1 Ų143.170%0.770%0.697SS**SBendtrans-88-17.8-169.5-72.9-71-87.500114.6V720M718-V720 VanDerWaalsContact C-N 3.35Å; M718-V720 PolarHBondContact O-N 2.84Å
719E50.7Low55.9Low152 Ų152143.8 Ų143.871%0.7170%0.699SS**G310 helixtrans-75.3-18.6-174.2-67-179.1147.800114
720V55.9Low56.6Low117 Ų117145.7 Ų145.771%0.70970%0.704SS**G310 helixtrans-83.5-17.5-174.6178.40000114M718 K722M718-V720 VanDerWaalsContact C-N 3.35Å; M718-V720 PolarHBondContact O-N 2.84Å; V720-K722 PolarHBondContact O-N 3.49Å
721R64.7Low57.3Low182 Ų182149.4 Ų149.469%0.68771%0.705SS**G310 helixtrans-74.8-19-172.5-145.8174.7-154.11400.7115
722K55.8Low58.3Low185 Ų185148.6 Ų148.680%0.80470%0.702SS**G310 helixtrans-76.3-26-169.3-173.7176.7175-179.70114.8V720V720-K722 PolarHBondContact O-N 3.49Å
723S52.5Low59.2Low102 Ų102143.6 Ų143.671%0.71369%0.689SS**G310 helixtrans-80.5-16.1-17263.70000114.9
724S63.2Low59.9Low95 Ų95142.6 Ų142.666%0.66468%0.684SS**G310 helixtrans-80.6-19.6-173.1-179.80000115.5
725L62Low60.2Low118 Ų118139.3 Ų139.362%0.61868%0.68SS**G310 helixtrans-81.1-21.6-168.3-87.5153.2000114.8Q727L725-Q727 PolarHBondContact O-N 3.26Å
726L54.2Low61.2Low145 Ų145138.4 Ų138.476%0.75968%0.676SS**G310 helixtrans-76-18.1-172-77.6166.4000115.4
727Q56.4Low61.9Low170 Ų170136.7 Ų136.779%0.79467%0.668SS**G310 helixtrans-84.2-8.5-177-81.5-176.7-5.300115.1L725L725-Q727 PolarHBondContact O-N 3.26Å
728Q66.3Low62.2Low119 Ų119135 Ų13556%0.55666%0.662SS**SBendtrans-82.6-19.6-175.4-81.1-180-1500114.8
729Q57.5Low62.6Low141 Ų141131.2 Ų131.266%0.65965%0.649SS**G310 helixtrans-73.2-34.1-168.2-126.6172.1-5.700114.7R731Q729-R731 VanDerWaalsContact C-N 3.34Å; Q729-R731 PolarHBondContact O-N 3.48Å
730E65.9Low63.4Low156 Ų156125.4 Ų125.473%0.72962%0.624SS**G310 helixtrans-70.8-24.2-173-15468.2-159.100113.9L732E730-L732 VanDerWaalsContact C-N 3.34Å; E730-L732 PolarHBondContact O-N 2.84Å
731R68.4Low63.9Low199 Ų199123.6 Ų123.675%0.75162%0.617SS**G310 helixtrans-74.2-19.9-176.3-76.7-173.1178.3110.8-2.8114.1Q729Q729-R731 VanDerWaalsContact C-N 3.34Å; Q729-R731 PolarHBondContact O-N 3.48Å
732L67.6Low64.1Low124 Ų124121.5 Ų121.565%0.64961%0.613SS**THydrogen-bonded Turntrans-79.4-28.7-171.4-75.7162.7000113.7E730 A735E730-L732 VanDerWaalsContact C-N 3.34Å; E730-L732 PolarHBondContact O-N 2.84Å; L732-A735 WeakPolarHBondContact O-CB 3.13Å; L732-A735 PolarHBondContact O-N 2.84Å
733I64.4Low64.6Low79 Ų79121.3 Ų121.341%0.40561%0.607SS.*Hα-helixtrans-71.6-36.7-172.8-64.1175.5000112.3L62 A735 L736L62-I733 HydrophobicContact CD1-CG2 4.33Å; I733-A735 PolarHBondContact O-N 2.8Å; I733-L736 PolarHBondContact O-N 3.46Å
734Q69.3Low65.1Low141 Ų141118.7 Ų118.766%0.65959%0.585SS**Hα-helixtrans-67.8-15.5178.8-70.2-178.28.100113.9
735A69.4Low65.4Low64 Ų64118 Ų11853%0.52958%0.576SS.*Hα-helixtrans-77.7-27.9178.500000113L732 I733L732-A735 WeakPolarHBondContact O-CB 3.13Å; L732-A735 PolarHBondContact O-N 2.84Å; I733-A735 PolarHBondContact O-N 2.8Å
736L69.6Low65.4Low119 Ų119117.4 Ų117.462%0.62357%0.573SS**Hα-helixtrans-72.4-41.3-172.7-80.6163.7000113.4I733 R738 S739I733-L736 PolarHBondContact O-N 3.46Å; L736-R738 VanDerWaalsContact C-N 3.26Å; L736-R738 PolarHBondContact O-N 3.37Å; L736-S739 WeakPolarHBondContact O-CB 3.31Å; L736-S739 PolarHBondContact O-N 2.79Å; L736-S739 VanDerWaalsContact O-N 3.08Å; L736-S739 PolarHBondContact O-OG 3.32Å
737E62.4Low66Low115 Ų115112 Ų11254%0.53755%0.546SS..Hα-helixtrans-62.4-32.6-178.1-67.9-171.7144.200113S739E737-S739 PolarHBondContact O-N 2.98Å
738R68.8Low66.2Low171 Ų171108.3 Ų108.365%0.64553%0.532SS*.Hα-helixtrans-74-14.4179.1-61.5-176.1-166.8172.15.4113.4L736 S741 K742L736-R738 VanDerWaalsContact C-N 3.26Å; L736-R738 PolarHBondContact O-N 3.37Å; R738-S741 PolarHBondContact O-OG 3.37Å; R738-K742 WeakPolarHBondContact O-CG 3.32Å
739S69.3Low65.6Low61 Ų61108.6 Ų108.643%0.42753%0.533SS..Hα-helixtrans-77.1-28.7-178.374.10000112.7L736 E737 R743L736-S739 WeakPolarHBondContact O-CB 3.31Å; L736-S739 PolarHBondContact O-N 2.79Å; L736-S739 VanDerWaalsContact O-N 3.08Å; L736-S739 PolarHBondContact O-OG 3.32Å; E737-S739 PolarHBondContact O-N 2.98Å; S739-R743 PolarHBondContact O-N 3.03Å; S739-R743 VanDerWaalsContact O-N 3.07Å
740V67.6Low65.6Low31 Ų31104.2 Ų104.219%0.18852%0.518CS..Hα-helixtrans-78.4-46.5-172.8-177.70000111F66 K742 R743 D744F66-V740 HydrophobicContact CD2-CB 3.88Å; F66-V740 HydrophobicContact CD2-CG1 3.48Å; F66-V740 VanDerWaalsContact CD2-CG1 3.48Å; F66-V740 HydrophobicContact CD2-CG2 3.18Å; F66-V740 HydrophobicContact CE2-CB 4.03Å; F66-V740 HydrophobicContact CE2-CG1 3.62Å; F66-V740 HydrophobicContact CE2-CG2 3.28Å; F66-V740 HydrophobicContact CG-CG2 4.29Å; F66-V740 HydrophobicContact CZ-CG2 4.46Å; V740-K742 PolarHBondContact O-N 2.86Å; V740-R743 WeakPolarHBondContact O-CB 3.49Å; V740-R743 PolarHBondContact O-N 2.9Å; V740-D744 PolarHBondContact O-N 3.2Å; V740-D744 VanDerWaalsContact O-N 3.17Å
741S66.4Low65.1Low79 Ų79100 Ų10055%0.55250%0.5SS*.Hα-helixtrans-63.5-32175.253.30000111.7R738 T745R738-S741 PolarHBondContact O-OG 3.37Å; S741-T745 PolarHBondContact O-N 3.1Å; S741-T745 PolarHBondContact O-OG1 3.36Å
742K69.4Low64.2Low138 Ų13895 Ų9560%0.649%0.491SS*.Hα-helixtrans-65-41.7168.6-80.4-178177.3-177.60112.3R738 V740 D744 T745 I746R738-K742 WeakPolarHBondContact O-CG 3.32Å; V740-K742 PolarHBondContact O-N 2.86Å; K742-D744 VanDerWaalsContact C-N 3.34Å; K742-D744 PolarHBondContact O-N 2.91Å; K742-T745 WeakPolarHBondContact CA-OG1 3.48Å; K742-T745 PolarHBondContact O-N 2.86Å; K742-T745 PolarHBondContact O-OG1 3.23Å; K742-T745 VanDerWaalsContact O-OG1 3.11Å; K742-I746 HydrophobicContact CB-CD1 4.44Å; K742-I746 VanDerWaalsContact O-CB 3.29Å; K742-I746 WeakPolarHBondContact O-CB 3.45Å; K742-I746 VanDerWaalsContact O-CD1 3.29Å; K742-I746 WeakPolarHBondContact O-CD1 3.41Å; K742-I746 WeakPolarHBondContact O-CG1 3.36Å; K742-I746 PolarHBondContact O-N 3.2Å
743R66.7Low63.4Low180 Ų18093.3 Ų93.368%0.67948%0.483SS*.Hα-helixtrans-62.3-42179.9-166.6177.4-175.1123.8-0.9112S739 V740 I746 V747S739-R743 PolarHBondContact O-N 3.03Å; S739-R743 VanDerWaalsContact O-N 3.07Å; V740-R743 WeakPolarHBondContact O-CB 3.49Å; V740-R743 PolarHBondContact O-N 2.9Å; R743-I746 CarbonylContact O-C 3.58Å; R743-I746 PolarHBondContact O-N 3.38Å; R743-V747 WeakPolarHBondContact O-CG2 3.41Å; R743-V747 PolarHBondContact O-N 3.48Å
744D63.4Low62.8Low48 Ų4893.7 Ų93.726%0.25748%0.483SS..Hα-helixtrans-73.9-34.9-177.6-15016.4000112.4M73 V740 K742 V747 N748M73-D744 HydrophobicContact CE-CB 4.25Å; M73-D744 VanDerWaalsContact CE-OD1 3.23Å; M73-D744 WeakPolarHBondContact CE-OD1 3.41Å; V740-D744 PolarHBondContact O-N 3.2Å; V740-D744 VanDerWaalsContact O-N 3.17Å; K742-D744 VanDerWaalsContact C-N 3.34Å; K742-D744 PolarHBondContact O-N 2.91Å; D744-V747 PolarHBondContact O-N 2.78Å; D744-N748 WeakPolarHBondContact O-CB 3.26Å; D744-N748 PolarHBondContact O-N 3.34Å; D744-N748 PolarHBondContact O-ND2 3.02Å
745T67.5Low61.9Low79 Ų7990.8 Ų90.849%0.48548%0.478SS..Hα-helixtrans-68.7-34.4168.936.50000112.2S741 K742 Q749S741-T745 PolarHBondContact O-N 3.1Å; S741-T745 PolarHBondContact O-OG1 3.36Å; K742-T745 WeakPolarHBondContact CA-OG1 3.48Å; K742-T745 PolarHBondContact O-N 2.86Å; K742-T745 PolarHBondContact O-OG1 3.23Å; K742-T745 VanDerWaalsContact O-OG1 3.11Å; T745-Q749 WeakPolarHBondContact O-CB 3.46Å; T745-Q749 VanDerWaalsContact O-CG 3.27Å; T745-Q749 WeakPolarHBondContact O-CG 3.35Å; T745-Q749 PolarHBondContact O-N 3.12Å
746I63.3Low60.7Low107 Ų10797.2 Ų97.255%0.54949%0.489SS..Hα-helixtrans-67.4-39.2172.6-70.2162.4000111K742 R743 S750K742-I746 HydrophobicContact CB-CD1 4.44Å; K742-I746 VanDerWaalsContact O-CB 3.29Å; K742-I746 WeakPolarHBondContact O-CB 3.45Å; K742-I746 VanDerWaalsContact O-CD1 3.29Å; K742-I746 WeakPolarHBondContact O-CD1 3.41Å; K742-I746 WeakPolarHBondContact O-CG1 3.36Å; K742-I746 PolarHBondContact O-N 3.2Å; R743-I746 CarbonylContact O-C 3.58Å; R743-I746 PolarHBondContact O-N 3.38Å; I746-S750 WeakPolarHBondContact O-CA 3.45Å; I746-S750 WeakPolarHBondContact O-CB 3.31Å; I746-S750 PolarHBondContact O-N 3.05Å
747V65.5Low59.5Low32 Ų3295.9 Ų95.919%0.19448%0.478CS..Hα-helixtrans-70-43.3177.7171.30000111.1R743 D744 S750 N751R743-V747 WeakPolarHBondContact O-CG2 3.41Å; R743-V747 PolarHBondContact O-N 3.48Å; D744-V747 PolarHBondContact O-N 2.78Å; V747-S750 CarbonylContact O-C 3.56Å; V747-S750 WeakPolarHBondContact O-CA 3.42Å; V747-S750 WeakPolarHBondContact O-CB 3.47Å; V747-S750 PolarHBondContact O-N 3.12Å; V747-S750 VanDerWaalsContact O-N 3.15Å; V747-N751 PolarHBondContact O-N 2.91Å
748N62.6Low58.8Low92 Ų9295.3 Ų95.349%0.49248%0.478SS..Hα-helixtrans-71.3-35.9177.2-72.6-40.5000112.5D744 S750 N751 V752D744-N748 WeakPolarHBondContact O-CB 3.26Å; D744-N748 PolarHBondContact O-N 3.34Å; D744-N748 PolarHBondContact O-ND2 3.02Å; N748-S750 VanDerWaalsContact C-N 3.32Å; N748-N751 PolarHBondContact O-N 3.31Å; N748-V752 WeakPolarHBondContact O-CG2 3.35Å; N748-V752 PolarHBondContact O-N 3.26Å
749Q53.6Low57.8Low124 Ų12495.9 Ų95.958%0.57949%0.486SS*.Hα-helixtrans-68.2-32.9167.8-76-179.2-4.800111.4T745 L753T745-Q749 WeakPolarHBondContact O-CB 3.46Å; T745-Q749 VanDerWaalsContact O-CG 3.27Å; T745-Q749 WeakPolarHBondContact O-CG 3.35Å; T745-Q749 PolarHBondContact O-N 3.12Å; Q749-L753 HydrophobicContact CB-CD1 4.44Å; Q749-L753 WeakPolarHBondContact O-CA 3.46Å; Q749-L753 WeakPolarHBondContact O-CB 3.25Å; Q749-L753 WeakPolarHBondContact O-CD1 3.31Å; Q749-L753 WeakPolarHBondContact O-CG 3.29Å; Q749-L753 PolarHBondContact O-N 3.46Å
750S56.6Low56.9Low49 Ų4994.8 Ų94.834%0.34348%0.478SS..Hα-helixtrans-66.4-39.8173.8-174.10000110.9I746 V747 N748 L753 Q754I746-S750 WeakPolarHBondContact O-CA 3.45Å; I746-S750 WeakPolarHBondContact O-CB 3.31Å; I746-S750 PolarHBondContact O-N 3.05Å; V747-S750 CarbonylContact O-C 3.56Å; V747-S750 WeakPolarHBondContact O-CA 3.42Å; V747-S750 WeakPolarHBondContact O-CB 3.47Å; V747-S750 PolarHBondContact O-N 3.12Å; V747-S750 VanDerWaalsContact O-N 3.15Å; N748-S750 VanDerWaalsContact C-N 3.32Å; S750-L753 CarbonylContact O-C 3.53Å; S750-Q754 WeakPolarHBondContact O-CA 3.29Å; S750-Q754 WeakPolarHBondContact O-CB 3.49Å; S750-Q754 VanDerWaalsContact O-CG 3.23Å; S750-Q754 WeakPolarHBondContact O-CG 3.31Å; S750-Q754 PolarHBondContact O-N 2.79Å; S750-Q754 PolarHBondContact O-OE1 3.12Å; S750-Q754 PolarHBondContact OG-OE1 3.43Å
751N55.4Low56.2Low67 Ų6796.7 Ų96.736%0.35849%0.485SS..Hα-helixtrans-73.9-39179.7-70.2-18.8000112.4V747 N748 Q754 S755V747-N751 PolarHBondContact O-N 2.91Å; N748-N751 PolarHBondContact O-N 3.31Å; N751-Q754 PolarHBondContact O-N 3.37Å; N751-S755 PolarHBondContact O-N 2.82Å
752V49.9Very low55.5Low94 Ų9498.5 Ų98.557%0.5749%0.487SS*.Hα-helixtrans-74.4-34.2173.6176.60000111.4N748 Q754 S755 R756N748-V752 WeakPolarHBondContact O-CG2 3.35Å; N748-V752 PolarHBondContact O-N 3.26Å; V752-Q754 VanDerWaalsContact C-N 3.33Å; V752-S755 PolarHBondContact O-OG 3.18Å; V752-R756 PolarHBondContact O-N 3.38Å; V752-R756 VanDerWaalsContact O-N 3.09Å
753L51.2Low54.7Low89 Ų89101 Ų10147%0.46649%0.493SS..Hα-helixtrans-71.9-26.5167.6-70.2164.9000110.8Q749 S750 K757Q749-L753 HydrophobicContact CB-CD1 4.44Å; Q749-L753 WeakPolarHBondContact O-CA 3.46Å; Q749-L753 WeakPolarHBondContact O-CB 3.25Å; Q749-L753 WeakPolarHBondContact O-CD1 3.31Å; Q749-L753 WeakPolarHBondContact O-CG 3.29Å; Q749-L753 PolarHBondContact O-N 3.46Å; S750-L753 CarbonylContact O-C 3.53Å; L753-K757 WeakPolarHBondContact O-CA 3.37Å; L753-K757 WeakPolarHBondContact O-CB 3.48Å; L753-K757 WeakPolarHBondContact O-CG 3.23Å; L753-K757 PolarHBondContact O-N 2.77Å
754Q51.4Low54.3Low87 Ų8795.6 Ų95.641%0.40748%0.477SS..Hα-helixtrans-75.7-34.5174.6-87.6161.5-56.700110.8S750 N751 V752 K757 D758S750-Q754 WeakPolarHBondContact O-CA 3.29Å; S750-Q754 WeakPolarHBondContact O-CB 3.49Å; S750-Q754 VanDerWaalsContact O-CG 3.23Å; S750-Q754 WeakPolarHBondContact O-CG 3.31Å; S750-Q754 PolarHBondContact O-N 2.79Å; S750-Q754 PolarHBondContact O-OE1 3.12Å; S750-Q754 PolarHBondContact OG-OE1 3.43Å; N751-Q754 PolarHBondContact O-N 3.37Å; V752-Q754 VanDerWaalsContact C-N 3.33Å; Q754-K757 CarbonylContact O-C 3.54Å; Q754-K757 VanDerWaalsContact O-C 3.32Å; Q754-K757 PolarHBondContact O-N 2.81Å; Q754-D758 PolarHBondContact O-N 2.75Å
755S49.7Very low54.4Low80 Ų8096 Ų9656%0.55948%0.481SS*.Hα-helixtrans-73.6-27.5172.879.90000113.9N751 V752N751-S755 PolarHBondContact O-N 2.82Å; V752-S755 PolarHBondContact O-OG 3.18Å
756R43.5Very low53.9Low200 Ų20094.2 Ų94.276%0.75547%0.474SS*.Hα-helixtrans-85.4-29.1168.1-76.5-167.4174-161.2-0.3113.4V752 K759V752-R756 PolarHBondContact O-N 3.38Å; V752-R756 VanDerWaalsContact O-N 3.09Å; R756-K759 PolarHBondContact O-N 3.12Å
757K45.6Very low54.1Low90 Ų9092.8 Ų92.839%0.39147%0.465SS..Hα-helixtrans-76.5-5.7169.1-67.4-174.7172.6174.80110.4L753 Q754 K759 S760 Q761L753-K757 WeakPolarHBondContact O-CA 3.37Å; L753-K757 WeakPolarHBondContact O-CB 3.48Å; L753-K757 WeakPolarHBondContact O-CG 3.23Å; L753-K757 PolarHBondContact O-N 2.77Å; Q754-K757 CarbonylContact O-C 3.54Å; Q754-K757 VanDerWaalsContact O-C 3.32Å; Q754-K757 PolarHBondContact O-N 2.81Å; K757-K759 PolarHBondContact O-N 2.89Å; K757-K759 VanDerWaalsContact O-N 3.15Å; K757-S760 WeakPolarHBondContact CA-OG 3.38Å; K757-S760 VanDerWaalsContact CB-OG 3.27Å; K757-S760 WeakPolarHBondContact CB-OG 3.4Å; K757-S760 WeakPolarHBondContact CG-OG 3.3Å; K757-S760 CarbonylContact O-C 3.52Å; K757-S760 VanDerWaalsContact O-C 3.31Å; K757-S760 PolarHBondContact O-N 3.29Å; K757-Q761 WeakPolarHBondContact O-CA 3.2Å; K757-Q761 WeakPolarHBondContact O-CB 3.44Å; K757-Q761 PolarHBondContact O-N 3.02Å
758D48.4Very low54.3Low103 Ų10398 Ų9855%0.55148%0.482SS*.Hα-helixtrans-63.9-24.6165.5-80-26.1000111.4Q754 I762Q754-D758 PolarHBondContact O-N 2.75Å; D758-I762 WeakPolarHBondContact O-CB 3.43Å; D758-I762 VanDerWaalsContact O-CD1 3.27Å; D758-I762 WeakPolarHBondContact O-CD1 3.32Å; D758-I762 WeakPolarHBondContact O-CG1 3.39Å; D758-I762 PolarHBondContact O-N 3.35Å; D758-I762 VanDerWaalsContact O-N 3.14Å
759K47Very low54.7Low184 Ų184100 Ų10080%0.849%0.487SS*.Hα-helixtrans-79-31.6164.5-73-171.9176.6-178.70114.1R756 K757 R763R756-K759 PolarHBondContact O-N 3.12Å; K757-K759 PolarHBondContact O-N 2.89Å; K757-K759 VanDerWaalsContact O-N 3.15Å; K759-R763 WeakPolarHBondContact O-CB 3.39Å; K759-R763 PolarHBondContact O-N 2.88Å
760S50.7Low55.7Low38 Ų3897.6 Ų97.627%0.26648%0.478SS..Hα-helixtrans-93.2-6.6178.489.50000114.7K757 R763 I764K757-S760 WeakPolarHBondContact CA-OG 3.38Å; K757-S760 VanDerWaalsContact CB-OG 3.27Å; K757-S760 WeakPolarHBondContact CB-OG 3.4Å; K757-S760 WeakPolarHBondContact CG-OG 3.3Å; K757-S760 CarbonylContact O-C 3.52Å; K757-S760 VanDerWaalsContact O-C 3.31Å; K757-S760 PolarHBondContact O-N 3.29Å; S760-R763 CarbonylContact O-C 3.44Å; S760-I764 WeakPolarHBondContact O-CA 3.47Å; S760-I764 WeakPolarHBondContact O-CB 3.37Å; S760-I764 VanDerWaalsContact O-CD1 3.22Å; S760-I764 WeakPolarHBondContact O-CD1 3.41Å; S760-I764 WeakPolarHBondContact O-CG1 3.45Å; S760-I764 PolarHBondContact O-N 2.86Å
761Q51.6Low56.7Low71 Ų7198 Ų9833%0.33248%0.476SS..Hα-helixtrans-101.7-28.5177.8-161118.4-14.300106.4K757 T765K757-Q761 WeakPolarHBondContact O-CA 3.2Å; K757-Q761 WeakPolarHBondContact O-CB 3.44Å; K757-Q761 PolarHBondContact O-N 3.02Å; Q761-T765 WeakPolarHBondContact O-CA 3.5Å; Q761-T765 WeakPolarHBondContact O-CB 3.42Å; Q761-T765 VanDerWaalsContact O-CG2 3.27Å; Q761-T765 WeakPolarHBondContact O-CG2 3.39Å; Q761-T765 PolarHBondContact O-N 3.46Å; Q761-T765 PolarHBondContact O-OG1 2.93Å
762I53.4Low57.9Low117 Ų11795.7 Ų95.760%0.647%0.468SS*.Hα-helixtrans-64.6-39.7150.6-67167.7000110.3D758 T765 A766D758-I762 WeakPolarHBondContact O-CB 3.43Å; D758-I762 VanDerWaalsContact O-CD1 3.27Å; D758-I762 WeakPolarHBondContact O-CD1 3.32Å; D758-I762 WeakPolarHBondContact O-CG1 3.39Å; D758-I762 PolarHBondContact O-N 3.35Å; D758-I762 VanDerWaalsContact O-N 3.14Å; I762-T765 WeakPolarHBondContact CA-OG1 3.37Å; I762-T765 PolarHBondContact O-OG1 2.83Å; I762-A766 WeakPolarHBondContact O-CA 3.24Å; I762-A766 WeakPolarHBondContact O-CB 3.33Å; I762-A766 PolarHBondContact O-N 3.02Å
763R51.6Low59.2Low189 Ų18996.5 Ų96.571%0.71347%0.469SS*.Hα-helixtrans-70.3-33.8173.8-154.8-179.5-167.7-1714.6113K759 S760 Q767K759-R763 WeakPolarHBondContact O-CB 3.39Å; K759-R763 PolarHBondContact O-N 2.88Å; S760-R763 CarbonylContact O-C 3.44Å; R763-Q767 WeakPolarHBondContact O-CA 3.47Å; R763-Q767 WeakPolarHBondContact O-CB 3.33Å; R763-Q767 PolarHBondContact O-N 3.24Å
764I58.2Low60.5Low67 Ų6797.6 Ų97.634%0.34447%0.47SS..Hα-helixtrans-85-29.8178.4-72.4159.8000110.8S760 Q767 R768S760-I764 WeakPolarHBondContact O-CA 3.47Å; S760-I764 WeakPolarHBondContact O-CB 3.37Å; S760-I764 VanDerWaalsContact O-CD1 3.22Å; S760-I764 WeakPolarHBondContact O-CD1 3.41Å; S760-I764 WeakPolarHBondContact O-CG1 3.45Å; S760-I764 PolarHBondContact O-N 2.86Å; I764-Q767 CarbonylContact O-C 3.49Å; I764-Q767 PolarHBondContact O-N 3.46Å; I764-R768 HydrophobicContact CG2-CG 4.24Å; I764-R768 WeakPolarHBondContact O-CA 3.44Å; I764-R768 WeakPolarHBondContact O-CB 3.39Å; I764-R768 WeakPolarHBondContact O-CG 3.35Å; I764-R768 PolarHBondContact O-N 2.84Å
765T64.8Low61.8Low57 Ų57101.4 Ų101.435%0.3548%0.481SS..Hα-helixtrans-72.9-39.8166.453.60000109.8Q761 I762 Q767 R768 H769Q761-T765 WeakPolarHBondContact O-CA 3.5Å; Q761-T765 WeakPolarHBondContact O-CB 3.42Å; Q761-T765 VanDerWaalsContact O-CG2 3.27Å; Q761-T765 WeakPolarHBondContact O-CG2 3.39Å; Q761-T765 PolarHBondContact O-N 3.46Å; Q761-T765 PolarHBondContact O-OG1 2.93Å; I762-T765 WeakPolarHBondContact CA-OG1 3.37Å; I762-T765 PolarHBondContact O-OG1 2.83Å; T765-Q767 VanDerWaalsContact C-N 3.31Å; T765-Q767 PolarHBondContact O-N 3.33Å; T765-R768 CarbonylContact O-C 3.57Å; T765-R768 PolarHBondContact O-N 2.75Å; T765-H769 WeakPolarHBondContact O-CA 3.41Å; T765-H769 VanDerWaalsContact O-CB 3.24Å; T765-H769 WeakPolarHBondContact O-CB 3.33Å; T765-H769 PolarHBondContact O-CD2 3.36Å; T765-H769 PolarHBondContact O-N 3.19Å
766A57.4Low63.2Low41 Ų41104.4 Ų104.434%0.33948%0.483SS..Hα-helixtrans-62-39.4168.100000111I762 H769 I770I762-A766 WeakPolarHBondContact O-CA 3.24Å; I762-A766 WeakPolarHBondContact O-CB 3.33Å; I762-A766 PolarHBondContact O-N 3.02Å; A766-H769 CarbonylContact O-C 3.54Å; A766-H769 PolarHBondContact O-N 2.85Å; A766-I770 WeakPolarHBondContact O-CA 3.45Å; A766-I770 WeakPolarHBondContact O-CB 3.42Å; A766-I770 WeakPolarHBondContact O-CD1 3.35Å; A766-I770 WeakPolarHBondContact O-CG1 3.24Å; A766-I770 PolarHBondContact O-N 3.12Å
767Q68.4Low64.9Low77 Ų7799.4 Ų99.436%0.3647%0.471SS..Hα-helixtrans-71.7-33.4175.6-162.472.526.900111.3R763 I764 T765 I770 D771R763-Q767 WeakPolarHBondContact O-CA 3.47Å; R763-Q767 WeakPolarHBondContact O-CB 3.33Å; R763-Q767 PolarHBondContact O-N 3.24Å; I764-Q767 CarbonylContact O-C 3.49Å; I764-Q767 PolarHBondContact O-N 3.46Å; T765-Q767 VanDerWaalsContact C-N 3.31Å; T765-Q767 PolarHBondContact O-N 3.33Å; Q767-I770 CarbonylContact O-C 3.32Å; Q767-I770 PolarHBondContact O-N 3.47Å; Q767-D771 WeakPolarHBondContact O-CA 3.34Å; Q767-D771 WeakPolarHBondContact O-CB 3.43Å; Q767-D771 PolarHBondContact O-N 2.88Å
768R69.9Low66.7Low143 Ų143102.1 Ų102.154%0.5448%0.483SS..Hα-helixtrans-75.2-30.3173.2-77.5179.2-152.3166.36.3111.8I764 T765 G772I764-R768 HydrophobicContact CG2-CG 4.24Å; I764-R768 WeakPolarHBondContact O-CA 3.44Å; I764-R768 WeakPolarHBondContact O-CB 3.39Å; I764-R768 WeakPolarHBondContact O-CG 3.35Å; I764-R768 PolarHBondContact O-N 2.84Å; T765-R768 CarbonylContact O-C 3.57Å; T765-R768 PolarHBondContact O-N 2.75Å; R768-G772 WeakPolarHBondContact O-CA 3.5Å; R768-G772 PolarHBondContact O-N 3.2Å
769H70.9Confident68.4Low133 Ų13399.1 Ų99.162%0.61647%0.473SS*.Hα-helixtrans-73.4-38.6169.5-85.8-74.6000109.6T765 A766 G772 L773T765-H769 WeakPolarHBondContact O-CA 3.41Å; T765-H769 VanDerWaalsContact O-CB 3.24Å; T765-H769 WeakPolarHBondContact O-CB 3.33Å; T765-H769 PolarHBondContact O-CD2 3.36Å; T765-H769 PolarHBondContact O-N 3.19Å; A766-H769 CarbonylContact O-C 3.54Å; A766-H769 PolarHBondContact O-N 2.85Å; H769-G772 CarbonylContact O-C 3.49Å; H769-L773 WeakPolarHBondContact O-CA 3.41Å; H769-L773 WeakPolarHBondContact O-CB 3.4Å; H769-L773 WeakPolarHBondContact O-CD1 3.31Å; H769-L773 WeakPolarHBondContact O-CG 3.36Å; H769-L773 PolarHBondContact O-N 3.45Å
770I73.2Confident70.1Confident74 Ų7495.7 Ų95.738%0.37946%0.462SS..Hα-helixtrans-68.9-40.6172.7-73.3163.2000110.2A766 Q767 L773 K774A766-I770 WeakPolarHBondContact O-CA 3.45Å; A766-I770 WeakPolarHBondContact O-CB 3.42Å; A766-I770 WeakPolarHBondContact O-CD1 3.35Å; A766-I770 WeakPolarHBondContact O-CG1 3.24Å; A766-I770 PolarHBondContact O-N 3.12Å; Q767-I770 CarbonylContact O-C 3.32Å; Q767-I770 PolarHBondContact O-N 3.47Å; I770-L773 CarbonylContact O-C 3.54Å; I770-L773 PolarHBondContact O-N 3.27Å; I770-K774 HydrophobicContact CG2-CD 4.09Å; I770-K774 HydrophobicContact CG2-CG 4.38Å; I770-K774 WeakPolarHBondContact O-CA 3.09Å; I770-K774 VanDerWaalsContact O-CB 3.24Å; I770-K774 WeakPolarHBondContact O-CB 3.4Å; I770-K774 WeakPolarHBondContact O-CG 3.36Å; I770-K774 PolarHBondContact O-N 3.24Å
771D79Confident71.6Confident57 Ų57100.6 Ų100.631%0.30548%0.478SS..Hα-helixtrans-77.9-28.8178.9-69.1-19.5000110.5Q767 K774 R775Q767-D771 WeakPolarHBondContact O-CA 3.34Å; Q767-D771 WeakPolarHBondContact O-CB 3.43Å; Q767-D771 PolarHBondContact O-N 2.88Å; D771-K774 IonicContact OD1-NZ 3.64Å; D771-R775 WeakPolarHBondContact O-CB 3.46Å; D771-R775 VanDerWaalsContact O-CG 3.25Å; D771-R775 WeakPolarHBondContact O-CG 3.25Å; D771-R775 PolarHBondContact O-N 3.37Å; D771-R775 PolarHBondContact O-NE 2.76Å
772G79.4Confident73.2Confident19 Ų19103.3 Ų103.320%0.19649%0.491CS..Hα-helixtrans-72-3916900000110.8R768 H769 R775 K776R768-G772 WeakPolarHBondContact O-CA 3.5Å; R768-G772 PolarHBondContact O-N 3.2Å; H769-G772 CarbonylContact O-C 3.49Å; G772-R775 PolarHBondContact O-N 3.32Å; G772-K776 VanDerWaalsContact O-CB 3.25Å; G772-K776 WeakPolarHBondContact O-CB 3.44Å; G772-K776 VanDerWaalsContact O-CG 3.22Å; G772-K776 WeakPolarHBondContact O-CG 3.15Å; G772-K776 PolarHBondContact O-N 2.8Å
773L77Confident74.6Confident110 Ų110102.3 Ų102.358%0.57649%0.487SS*.Hα-helixtrans-71.6-31.7170.5-76.1170000111H769 I770 K776 L777H769-L773 WeakPolarHBondContact O-CA 3.41Å; H769-L773 WeakPolarHBondContact O-CB 3.4Å; H769-L773 WeakPolarHBondContact O-CD1 3.31Å; H769-L773 WeakPolarHBondContact O-CG 3.36Å; H769-L773 PolarHBondContact O-N 3.45Å; I770-L773 CarbonylContact O-C 3.54Å; I770-L773 PolarHBondContact O-N 3.27Å; L773-K776 CarbonylContact O-C 3.57Å; L773-L777 WeakPolarHBondContact O-CA 3.43Å; L773-L777 WeakPolarHBondContact O-CB 3.41Å; L773-L777 PolarHBondContact O-N 2.86Å
774K79.1Confident75.9Confident112 Ų11296.5 Ų96.549%0.48748%0.475SS..Hα-helixtrans-75.2-34.5172.1-78.4171.2-179.7177.30111.1I770 D771 L777 K778I770-K774 HydrophobicContact CG2-CD 4.09Å; I770-K774 HydrophobicContact CG2-CG 4.38Å; I770-K774 WeakPolarHBondContact O-CA 3.09Å; I770-K774 VanDerWaalsContact O-CB 3.24Å; I770-K774 WeakPolarHBondContact O-CB 3.4Å; I770-K774 WeakPolarHBondContact O-CG 3.36Å; I770-K774 PolarHBondContact O-N 3.24Å; D771-K774 IonicContact OD1-NZ 3.64Å; K774-L777 CarbonylContact O-C 3.31Å; K774-L777 PolarHBondContact O-N 3.5Å; K774-K778 WeakPolarHBondContact O-CA 3.33Å; K774-K778 WeakPolarHBondContact O-CB 3.34Å; K774-K778 PolarHBondContact O-N 2.96Å
775R79.8Confident77.2Confident168 Ų16895.3 Ų95.363%0.63448%0.476SS*.Hα-helixtrans-69.9-41.5170.9-84.3-178.2-84.7151.3-10.5110.5D771 G772 K778 A779D771-R775 WeakPolarHBondContact O-CB 3.46Å; D771-R775 VanDerWaalsContact O-CG 3.25Å; D771-R775 WeakPolarHBondContact O-CG 3.25Å; D771-R775 PolarHBondContact O-N 3.37Å; D771-R775 PolarHBondContact O-NE 2.76Å; G772-R775 PolarHBondContact O-N 3.32Å; R775-K778 PolarHBondContact O-N 2.85Å; R775-A779 WeakPolarHBondContact O-CB 3.45Å; R775-A779 PolarHBondContact O-N 3.19Å
776K79.2Confident78.1Confident142 Ų14294.4 Ų94.462%0.61747%0.471SS*.Hα-helixtrans-64.5-39.3169.6-75.7-179.9179.2-169.80111.2G772 L773 A779 I780G772-K776 VanDerWaalsContact O-CB 3.25Å; G772-K776 WeakPolarHBondContact O-CB 3.44Å; G772-K776 VanDerWaalsContact O-CG 3.22Å; G772-K776 WeakPolarHBondContact O-CG 3.15Å; G772-K776 PolarHBondContact O-N 2.8Å; L773-K776 CarbonylContact O-C 3.57Å; K776-A779 PolarHBondContact O-N 2.91Å; K776-I780 WeakPolarHBondContact O-CA 3.5Å; K776-I780 WeakPolarHBondContact O-CB 3.48Å; K776-I780 WeakPolarHBondContact O-CD1 3.42Å; K776-I780 WeakPolarHBondContact O-CG1 3.39Å; K776-I780 PolarHBondContact O-N 3.14Å
777L78.5Confident79.2Confident96 Ų9695.4 Ų95.450%0.50348%0.475SS..Hα-helixtrans-69.8-35.5175.1-170.489.1000110.7L773 K774 K781L773-L777 WeakPolarHBondContact O-CA 3.43Å; L773-L777 WeakPolarHBondContact O-CB 3.41Å; L773-L777 PolarHBondContact O-N 2.86Å; K774-L777 CarbonylContact O-C 3.31Å; K774-L777 PolarHBondContact O-N 3.5Å; L777-K781 WeakPolarHBondContact O-CA 3.46Å; L777-K781 WeakPolarHBondContact O-CB 3.49Å; L777-K781 WeakPolarHBondContact O-CG 3.31Å; L777-K781 PolarHBondContact O-N 2.91Å
778K83.9Confident80Confident146 Ų14694.9 Ų94.964%0.63548%0.477SS*.Hα-helixtrans-72.4-40.7175.6-171.5179.6-179.3-174.40110.3K774 R775 K781 Q782K774-K778 WeakPolarHBondContact O-CA 3.33Å; K774-K778 WeakPolarHBondContact O-CB 3.34Å; K774-K778 PolarHBondContact O-N 2.96Å; R775-K778 PolarHBondContact O-N 2.85Å; K778-K781 CarbonylContact O-C 3.58Å; K778-K781 PolarHBondContact O-N 3.36Å; K778-Q782 WeakPolarHBondContact O-CA 3.47Å; K778-Q782 WeakPolarHBondContact O-CB 3.38Å; K778-Q782 PolarHBondContact O-N 3.43Å
779A83.7Confident80.7Confident41 Ų4194 Ų9434%0.33948%0.479SS..Hα-helixtrans-66.6-41.6172.400000110.7R775 K776 Q782 N783R775-A779 WeakPolarHBondContact O-CB 3.45Å; R775-A779 PolarHBondContact O-N 3.19Å; K776-A779 PolarHBondContact O-N 2.91Å; A779-Q782 PolarHBondContact O-N 3.47Å; A779-N783 WeakPolarHBondContact O-CA 3.23Å; A779-N783 WeakPolarHBondContact O-CB 3.25Å; A779-N783 PolarHBondContact O-N 3.39Å; A779-N783 PolarHBondContact O-OD1 2.83Å; A779-N783 VanDerWaalsContact O-OD1 3.12Å
780I83.4Confident81.4Confident112 Ų11292.3 Ų92.357%0.57447%0.472SS*.Hα-helixtrans-68-37173.5-70.9163.3000110.3K776 S784K776-I780 WeakPolarHBondContact O-CA 3.5Å; K776-I780 WeakPolarHBondContact O-CB 3.48Å; K776-I780 WeakPolarHBondContact O-CD1 3.42Å; K776-I780 WeakPolarHBondContact O-CG1 3.39Å; K776-I780 PolarHBondContact O-N 3.14Å; I780-S784 WeakPolarHBondContact O-CA 3.2Å; I780-S784 WeakPolarHBondContact O-CB 3.49Å; I780-S784 PolarHBondContact O-N 3.02Å
781K81.3Confident81.9Confident140 Ų14093.6 Ų93.661%0.60948%0.479SS*.Hα-helixtrans-70.2-35.4173.4-84.1-174.1174.8-165.30112.2L777 K778 A785L777-K781 WeakPolarHBondContact O-CA 3.46Å; L777-K781 WeakPolarHBondContact O-CB 3.49Å; L777-K781 WeakPolarHBondContact O-CG 3.31Å; L777-K781 PolarHBondContact O-N 2.91Å; K778-K781 CarbonylContact O-C 3.58Å; K778-K781 PolarHBondContact O-N 3.36Å; K781-A785 WeakPolarHBondContact O-CB 3.36Å; K781-A785 PolarHBondContact O-N 2.95Å
782Q85.6Confident82.3Confident129 Ų12996.9 Ų96.960%0.60349%0.492SS*.Hα-helixtrans-74.6-39.5177-176.2171.2-000110.5K778 A779 S784 A785 S786K778-Q782 WeakPolarHBondContact O-CA 3.47Å; K778-Q782 WeakPolarHBondContact O-CB 3.38Å; K778-Q782 PolarHBondContact O-N 3.43Å; A779-Q782 PolarHBondContact O-N 3.47Å; Q782-S784 VanDerWaalsContact C-N 3.33Å; Q782-A785 CarbonylContact O-C 3.54Å; Q782-A785 PolarHBondContact O-N 3.33Å; Q782-S786 WeakPolarHBondContact O-CB 3.4Å; Q782-S786 PolarHBondContact O-N 3.06Å; Q782-S786 PolarHBondContact O-OG 3.28Å
783N82.8Confident82.7Confident96 Ų96101.1 Ų101.151%0.51351%0.507SS..Hα-helixtrans-69.6-34.5171-68.36.2000110.4A779 S786 C787A779-N783 WeakPolarHBondContact O-CA 3.23Å; A779-N783 WeakPolarHBondContact O-CB 3.25Å; A779-N783 PolarHBondContact O-N 3.39Å; A779-N783 PolarHBondContact O-OD1 2.83Å; A779-N783 VanDerWaalsContact O-OD1 3.12Å; N783-S786 WeakPolarHBondContact CA-OG 3.25Å; N783-S786 PolarHBondContact O-OG 3.5Å; N783-C787 WeakPolarHBondContact O-CB 3.43Å; N783-C787 PolarHBondContact O-N 2.89Å; N783-C787 PolarHBondContact O-SG 3.29Å
784S79Confident83.1Confident66 Ų66101.8 Ų101.846%0.46251%0.506SS..Hα-helixtrans-71.2-36.8174.1-1760000110.2I780 Q782 T788I780-S784 WeakPolarHBondContact O-CA 3.2Å; I780-S784 WeakPolarHBondContact O-CB 3.49Å; I780-S784 PolarHBondContact O-N 3.02Å; Q782-S784 VanDerWaalsContact C-N 3.33Å; S784-T788 WeakPolarHBondContact O-CB 3.49Å; S784-T788 VanDerWaalsContact O-CG2 3.28Å; S784-T788 WeakPolarHBondContact O-CG2 3.26Å; S784-T788 PolarHBondContact O-N 3.16Å; S784-T788 PolarHBondContact O-OG1 3.33Å; S784-T788 VanDerWaalsContact O-OG1 3.08Å
785A85.2Confident83.5Confident43 Ų43102.2 Ų102.236%0.35551%0.51SS..Hα-helixtrans-67.1-42.9173.100000111.3K781 Q782 T788 E789K781-A785 WeakPolarHBondContact O-CB 3.36Å; K781-A785 PolarHBondContact O-N 2.95Å; Q782-A785 CarbonylContact O-C 3.54Å; Q782-A785 PolarHBondContact O-N 3.33Å; A785-T788 VanDerWaalsContact C-OG1 3.31Å; A785-T788 WeakPolarHBondContact CA-OG1 3.38Å; A785-T788 PolarHBondContact O-N 3.4Å; A785-T788 PolarHBondContact O-OG1 3.11Å; A785-E789 WeakPolarHBondContact O-CB 3.45Å; A785-E789 WeakPolarHBondContact O-CG 3.3Å; A785-E789 PolarHBondContact O-N 2.91Å
786S84.4Confident83.9Confident37 Ų3799.6 Ų99.626%0.25950%0.504SS..Hα-helixtrans-68.1-39175.674.40000110.6Q782 N783 T788 E789 E790Q782-S786 WeakPolarHBondContact O-CB 3.4Å; Q782-S786 PolarHBondContact O-N 3.06Å; Q782-S786 PolarHBondContact O-OG 3.28Å; N783-S786 WeakPolarHBondContact CA-OG 3.25Å; N783-S786 PolarHBondContact O-OG 3.5Å; S786-T788 VanDerWaalsContact C-N 3.33Å; S786-T788 PolarHBondContact O-N 3.25Å; S786-E789 PolarHBondContact O-N 2.86Å; S786-E790 VanDerWaalsContact O-CB 3.28Å; S786-E790 WeakPolarHBondContact O-CB 3.42Å; S786-E790 VanDerWaalsContact O-CG 3.23Å; S786-E790 WeakPolarHBondContact O-CG 3.41Å; S786-E790 PolarHBondContact O-N 3.22Å
787C79.9Confident84.3Confident62 Ų6297.3 Ų97.342%0.41950%0.495SS..Hα-helixtrans-65.9-34.1171.8-74.60000111.9N783 L791N783-C787 WeakPolarHBondContact O-CB 3.43Å; N783-C787 PolarHBondContact O-N 2.89Å; N783-C787 PolarHBondContact O-SG 3.29Å; C787-L791 WeakPolarHBondContact O-CB 3.25Å; C787-L791 WeakPolarHBondContact O-CD1 3.36Å; C787-L791 WeakPolarHBondContact O-CG 3.45Å; C787-L791 PolarHBondContact O-N 2.72Å
788T84.4Confident84.5Confident66 Ų6696.2 Ų96.241%0.40549%0.492SS..Hα-helixtrans-71.8-37.8172.649.60000111.9S784 A785 S786 L791 E792S784-T788 WeakPolarHBondContact O-CB 3.49Å; S784-T788 VanDerWaalsContact O-CG2 3.28Å; S784-T788 WeakPolarHBondContact O-CG2 3.26Å; S784-T788 PolarHBondContact O-N 3.16Å; S784-T788 PolarHBondContact O-OG1 3.33Å; S784-T788 VanDerWaalsContact O-OG1 3.08Å; A785-T788 VanDerWaalsContact C-OG1 3.31Å; A785-T788 WeakPolarHBondContact CA-OG1 3.38Å; A785-T788 PolarHBondContact O-N 3.4Å; A785-T788 PolarHBondContact O-OG1 3.11Å; S786-T788 VanDerWaalsContact C-N 3.33Å; S786-T788 PolarHBondContact O-N 3.25Å; T788-L791 PolarHBondContact O-N 3.41Å; T788-E792 WeakPolarHBondContact O-CB 3.39Å; T788-E792 WeakPolarHBondContact O-CG 3.43Å; T788-E792 PolarHBondContact O-N 2.77Å
789E85.4Confident84.7Confident125 Ų12592.9 Ų92.958%0.58449%0.487SS*.Hα-helixtrans-64.8-43.7172.6-77.2173.917600110.9A785 S786 E792 E793A785-E789 WeakPolarHBondContact O-CB 3.45Å; A785-E789 WeakPolarHBondContact O-CG 3.3Å; A785-E789 PolarHBondContact O-N 2.91Å; S786-E789 PolarHBondContact O-N 2.86Å; E789-E792 PolarHBondContact O-N 3.35Å; E789-E793 WeakPolarHBondContact O-CB 3.43Å; E789-E793 WeakPolarHBondContact O-CG 3.45Å; E789-E793 PolarHBondContact O-N 2.9Å
790E86.5Confident84.9Confident97 Ų9798.6 Ų98.645%0.45350%0.5SS..Hα-helixtrans-63-41.6173.5-76.2170.9-161.200111S786 E793 F794S786-E790 VanDerWaalsContact O-CB 3.28Å; S786-E790 WeakPolarHBondContact O-CB 3.42Å; S786-E790 VanDerWaalsContact O-CG 3.23Å; S786-E790 WeakPolarHBondContact O-CG 3.41Å; S786-E790 PolarHBondContact O-N 3.22Å; E790-E793 PolarHBondContact O-N 3.18Å; E790-F794 HydrophobicContact CB-CD2 4.33Å; E790-F794 HydrophobicContact CB-CE2 4.24Å; E790-F794 VanDerWaalsContact O-CB 3.32Å; E790-F794 WeakPolarHBondContact O-CB 3.26Å; E790-F794 WeakPolarHBondContact O-CD2 3.46Å; E790-F794 WeakPolarHBondContact O-CG 3.48Å; E790-F794 PolarHBondContact O-N 3.44Å
791L82.8Confident85Confident101 Ų10198.1 Ų98.153%0.52950%0.498SS..Hα-helixtrans-64.5-42.7174.8-80.1168.2000111.6C787 T788 F794 E795C787-L791 WeakPolarHBondContact O-CB 3.25Å; C787-L791 WeakPolarHBondContact O-CD1 3.36Å; C787-L791 WeakPolarHBondContact O-CG 3.45Å; C787-L791 PolarHBondContact O-N 2.72Å; T788-L791 PolarHBondContact O-N 3.41Å; L791-F794 PolarHBondContact O-N 3.48Å; L791-E795 VanDerWaalsContact O-CB 3.28Å; L791-E795 WeakPolarHBondContact O-CB 3.37Å; L791-E795 VanDerWaalsContact O-CG 3.27Å; L791-E795 WeakPolarHBondContact O-CG 3.35Å; L791-E795 PolarHBondContact O-N 3.03Å
792E86.6Confident85.2Confident126 Ų12697.8 Ų97.859%0.58950%0.499SS*.Hα-helixtrans-63.9-41.5174.5-77.1177.1-176.900111.2T788 E789 E795 E796T788-E792 WeakPolarHBondContact O-CB 3.39Å; T788-E792 WeakPolarHBondContact O-CG 3.43Å; T788-E792 PolarHBondContact O-N 2.77Å; E789-E792 PolarHBondContact O-N 3.35Å; E792-E795 PolarHBondContact O-N 2.88Å; E792-E796 WeakPolarHBondContact O-CB 3.32Å; E792-E796 PolarHBondContact O-N 3.34Å
793E88.1Confident85.3Confident109 Ų10993.2 Ų93.251%0.50949%0.486SS..Hα-helixtrans-63-42.5172.6-82.2-165.4-165.600112E789 E790 K797E789-E793 WeakPolarHBondContact O-CB 3.43Å; E789-E793 WeakPolarHBondContact O-CG 3.45Å; E789-E793 PolarHBondContact O-N 2.9Å; E790-E793 PolarHBondContact O-N 3.18Å; E793-K797 VanDerWaalsContact O-CB 3.31Å; E793-K797 WeakPolarHBondContact O-CB 3.35Å; E793-K797 WeakPolarHBondContact O-CD 3.35Å; E793-K797 WeakPolarHBondContact O-CG 3.31Å; E793-K797 PolarHBondContact O-N 3.36Å; E793-K797 IonicContact OE2-NZ 2.69Å; E793-K797 PolarHBondContact OE2-NZ 3.47Å
794F86.8Confident85.5Confident124 Ų12494.3 Ų94.354%0.54449%0.488SS..Hα-helixtrans-67.5-41.1177.5-77.6-55.2000110.6E790 L791 K797 T798E790-F794 HydrophobicContact CB-CD2 4.33Å; E790-F794 HydrophobicContact CB-CE2 4.24Å; E790-F794 VanDerWaalsContact O-CB 3.32Å; E790-F794 WeakPolarHBondContact O-CB 3.26Å; E790-F794 WeakPolarHBondContact O-CD2 3.46Å; E790-F794 WeakPolarHBondContact O-CG 3.48Å; E790-F794 PolarHBondContact O-N 3.44Å; L791-F794 PolarHBondContact O-N 3.48Å; F794-K797 HydrophobicContact CD1-CD 4.48Å; F794-K797 CarbonylContact O-C 3.47Å; F794-K797 PolarHBondContact O-N 2.86Å; F794-T798 PolarHBondContact O-N 3.25Å; F794-T798 PolarHBondContact O-OG1 2.93Å
795E85.6Confident85.7Confident121 Ų12195.8 Ų95.857%0.56549%0.49SS*.Hα-helixtrans-64.1-39.8174.7-78.2-179.4179.400112.3L791 E792 T798 S799L791-E795 VanDerWaalsContact O-CB 3.28Å; L791-E795 WeakPolarHBondContact O-CB 3.37Å; L791-E795 VanDerWaalsContact O-CG 3.27Å; L791-E795 WeakPolarHBondContact O-CG 3.35Å; L791-E795 PolarHBondContact O-N 3.03Å; E792-E795 PolarHBondContact O-N 2.88Å; E795-T798 VanDerWaalsContact CA-OG1 3.29Å; E795-T798 WeakPolarHBondContact CA-OG1 3.39Å; E795-T798 PolarHBondContact O-OG1 3.4Å; E795-S799 VanDerWaalsContact O-CB 3.24Å; E795-S799 WeakPolarHBondContact O-CB 3.29Å; E795-S799 PolarHBondContact O-N 3.27Å; E795-S799 PolarHBondContact O-OG 3.37Å
796E88.4Confident85.9Confident112 Ų11297.8 Ų97.852%0.52350%0.5SS..Hα-helixtrans-65.1-43.4170.7-86.2-158.3-179.200111.3E792 S799 R800E792-E796 WeakPolarHBondContact O-CB 3.32Å; E792-E796 PolarHBondContact O-N 3.34Å; E796-S799 PolarHBondContact O-N 2.79Å; E796-R800 WeakPolarHBondContact O-CB 3.41Å; E796-R800 VanDerWaalsContact O-CG 3.25Å; E796-R800 WeakPolarHBondContact O-CG 3.47Å; E796-R800 PolarHBondContact O-N 2.67Å; E796-R800 IonicContact OE2-CZ 3.98Å; E796-R800 IonicContact OE2-NE 2.81Å; E796-R800 IonicContact OE2-NH2 3.98Å; E796-R800 PolarHBondContact OE2-NH2 3.42Å
797K87.9Confident86.1Confident95 Ų95102 Ų10241%0.41352%0.519SS..Hα-helixtrans-64.3-43.9177.5-75.2164.9-168155.50110.9E793 F794 R800 L801E793-K797 VanDerWaalsContact O-CB 3.31Å; E793-K797 WeakPolarHBondContact O-CB 3.35Å; E793-K797 WeakPolarHBondContact O-CD 3.35Å; E793-K797 WeakPolarHBondContact O-CG 3.31Å; E793-K797 PolarHBondContact O-N 3.36Å; E793-K797 IonicContact OE2-NZ 2.69Å; E793-K797 PolarHBondContact OE2-NZ 3.47Å; F794-K797 HydrophobicContact CD1-CD 4.48Å; F794-K797 CarbonylContact O-C 3.47Å; F794-K797 PolarHBondContact O-N 2.86Å; K797-R800 PolarHBondContact O-N 2.7Å; K797-L801 WeakPolarHBondContact O-CB 3.48Å; K797-L801 VanDerWaalsContact O-CG 3.25Å; K797-L801 WeakPolarHBondContact O-CG 3.26Å; K797-L801 PolarHBondContact O-N 2.9Å
798T83.6Confident86.4Confident72 Ų72107 Ų10744%0.44253%0.533SS..Hα-helixtrans-64.6-43.1173.825.80000111.2F794 E795 R800 L801 E802F794-T798 PolarHBondContact O-N 3.25Å; F794-T798 PolarHBondContact O-OG1 2.93Å; E795-T798 VanDerWaalsContact CA-OG1 3.29Å; E795-T798 WeakPolarHBondContact CA-OG1 3.39Å; E795-T798 PolarHBondContact O-OG1 3.4Å; T798-R800 VanDerWaalsContact C-N 3.33Å; T798-R800 PolarHBondContact O-N 3.48Å; T798-L801 PolarHBondContact O-N 3.13Å; T798-E802 WeakPolarHBondContact O-CB 3.44Å; T798-E802 VanDerWaalsContact O-CG 3.3Å; T798-E802 WeakPolarHBondContact O-CG 3.42Å; T798-E802 PolarHBondContact O-N 2.95Å
799S87.5Confident86.4Confident77 Ų77110 Ų11054%0.53854%0.541SS..Hα-helixtrans-61.7-40.2176.9-63.60000112.3E795 E796 G803E795-S799 VanDerWaalsContact O-CB 3.24Å; E795-S799 WeakPolarHBondContact O-CB 3.29Å; E795-S799 PolarHBondContact O-N 3.27Å; E795-S799 PolarHBondContact O-OG 3.37Å; E796-S799 PolarHBondContact O-N 2.79Å; S799-G803 PolarHBondContact O-N 3.38Å
800R88.4Confident86.5Confident160 Ų160106.7 Ų106.760%0.60454%0.535SS*.Hα-helixtrans-65.2-47.6173.9-73.4176.5-162.8-175.99.5111.3E796 K797 T798 E802 G803 E804E796-R800 WeakPolarHBondContact O-CB 3.41Å; E796-R800 VanDerWaalsContact O-CG 3.25Å; E796-R800 WeakPolarHBondContact O-CG 3.47Å; E796-R800 PolarHBondContact O-N 2.67Å; E796-R800 IonicContact OE2-CZ 3.98Å; E796-R800 IonicContact OE2-NE 2.81Å; E796-R800 IonicContact OE2-NH2 3.98Å; E796-R800 PolarHBondContact OE2-NH2 3.42Å; K797-R800 PolarHBondContact O-N 2.7Å; T798-R800 VanDerWaalsContact C-N 3.33Å; T798-R800 PolarHBondContact O-N 3.48Å; R800-E802 VanDerWaalsContact C-N 3.35Å; R800-E802 PolarHBondContact O-N 3.47Å; R800-G803 PolarHBondContact O-N 3.39Å; R800-E804 WeakPolarHBondContact O-CG 3.32Å; R800-E804 PolarHBondContact O-N 2.94Å
801L84.9Confident86.6Confident102 Ų102103.8 Ų103.853%0.53453%0.531SS..Hα-helixtrans-62.6-40.1178-75.2172000111.9K797 T798 E804 L805K797-L801 WeakPolarHBondContact O-CB 3.48Å; K797-L801 VanDerWaalsContact O-CG 3.25Å; K797-L801 WeakPolarHBondContact O-CG 3.26Å; K797-L801 PolarHBondContact O-N 2.9Å; T798-L801 PolarHBondContact O-N 3.13Å; L801-E804 PolarHBondContact O-N 3.37Å; L801-L805 WeakPolarHBondContact O-CB 3.47Å; L801-L805 PolarHBondContact O-N 3.05Å
802E84.9Confident86.6Confident134 Ų134101.9 Ų101.963%0.62653%0.529SS*.Hα-helixtrans-64.2-41174-76.7-178.5176.700111.6T798 R800 L805 C806T798-E802 WeakPolarHBondContact O-CB 3.44Å; T798-E802 VanDerWaalsContact O-CG 3.3Å; T798-E802 WeakPolarHBondContact O-CG 3.42Å; T798-E802 PolarHBondContact O-N 2.95Å; R800-E802 VanDerWaalsContact C-N 3.35Å; R800-E802 PolarHBondContact O-N 3.47Å; E802-L805 PolarHBondContact O-N 3.25Å; E802-C806 WeakPolarHBondContact O-CB 3.38Å; E802-C806 PolarHBondContact O-N 3.49Å
803G87.9Confident86.6Confident32 Ų32101.8 Ų101.833%0.3353%0.529SS..Hα-helixtrans-60.5-46.9172.100000112.5S799 R800 L805 C806 I807S799-G803 PolarHBondContact O-N 3.38Å; R800-G803 PolarHBondContact O-N 3.39Å; G803-L805 PolarHBondContact O-N 3.19Å; G803-C806 WeakPolarHBondContact O-CB 3.41Å; G803-C806 PolarHBondContact O-N 2.89Å; G803-I807 VanDerWaalsContact O-CG1 3.32Å; G803-I807 WeakPolarHBondContact O-CG1 3.37Å; G803-I807 PolarHBondContact O-N 3.45Å
804E87.3Confident86.6Confident120 Ų12098.8 Ų98.856%0.56152%0.523SS*.Hα-helixtrans-61.5-42.8174.7-73.6-179.5-173.300111.8R800 L801 C806 I807 K808R800-E804 WeakPolarHBondContact O-CG 3.32Å; R800-E804 PolarHBondContact O-N 2.94Å; L801-E804 PolarHBondContact O-N 3.37Å; E804-C806 VanDerWaalsContact C-N 3.32Å; E804-C806 PolarHBondContact O-N 2.9Å; E804-I807 PolarHBondContact O-N 3.2Å; E804-K808 WeakPolarHBondContact O-CB 3.35Å; E804-K808 WeakPolarHBondContact O-CG 3.38Å; E804-K808 PolarHBondContact O-N 2.87Å
805L83.3Confident86.6Confident96 Ų9698 Ų9850%0.50352%0.521SS..Hα-helixtrans-62.9-39.5176.6-128.5162.7000111.2L801 E802 G803 K808 K809L801-L805 WeakPolarHBondContact O-CB 3.47Å; L801-L805 PolarHBondContact O-N 3.05Å; E802-L805 PolarHBondContact O-N 3.25Å; G803-L805 PolarHBondContact O-N 3.19Å; L805-K808 PolarHBondContact O-N 2.85Å; L805-K809 HydrophobicContact CD2-CD 4.08Å; L805-K809 HydrophobicContact CD2-CG 4.16Å; L805-K809 WeakPolarHBondContact O-CB 3.46Å; L805-K809 WeakPolarHBondContact O-CG 3.37Å; L805-K809 PolarHBondContact O-N 3.33Å
806C88.8Confident86.7Confident85 Ų8597.5 Ų97.557%0.57452%0.519SS*.Hα-helixtrans-64.2-46.7175.4-168.80000111.5E802 G803 E804 K808 K809 A810E802-C806 WeakPolarHBondContact O-CB 3.38Å; E802-C806 PolarHBondContact O-N 3.49Å; G803-C806 WeakPolarHBondContact O-CB 3.41Å; G803-C806 PolarHBondContact O-N 2.89Å; E804-C806 VanDerWaalsContact C-N 3.32Å; E804-C806 PolarHBondContact O-N 2.9Å; C806-K808 PolarHBondContact O-N 3.45Å; C806-K809 PolarHBondContact O-N 2.78Å; C806-A810 WeakPolarHBondContact O-CB 3.28Å; C806-A810 PolarHBondContact O-N 3.02Å
807I88.9Confident86.6Confident127 Ų12798.6 Ų98.665%0.65152%0.522SS*.Hα-helixtrans-62.4-43.4176.3-66.1164.7000110.8G803 E804 A810 G811G803-I807 VanDerWaalsContact O-CG1 3.32Å; G803-I807 WeakPolarHBondContact O-CG1 3.37Å; G803-I807 PolarHBondContact O-N 3.45Å; E804-I807 PolarHBondContact O-N 3.2Å; I807-A810 PolarHBondContact O-N 3.36Å; I807-G811 PolarHBondContact O-N 3.43Å
808K87Confident86.6Confident165 Ų16599.1 Ų99.172%0.71752%0.524SS*.Hα-helixtrans-66.2-40178.2-70.8-72.4-176.4179.70112.1E804 L805 C806 G811 A812E804-K808 WeakPolarHBondContact O-CB 3.35Å; E804-K808 WeakPolarHBondContact O-CG 3.38Å; E804-K808 PolarHBondContact O-N 2.87Å; L805-K808 PolarHBondContact O-N 2.85Å; C806-K808 PolarHBondContact O-N 3.45Å; K808-G811 PolarHBondContact O-N 2.8Å; K808-A812 WeakPolarHBondContact O-CB 3.49Å; K808-A812 PolarHBondContact O-N 3.16Å
809K84.1Confident86.6Confident130 Ų13097.6 Ų97.657%0.56552%0.519SS*.Hα-helixtrans-63-47.2173.2-81.1178.4175.1176.80111.7L805 C806 G811 A812 E813L805-K809 HydrophobicContact CD2-CD 4.08Å; L805-K809 HydrophobicContact CD2-CG 4.16Å; L805-K809 WeakPolarHBondContact O-CB 3.46Å; L805-K809 WeakPolarHBondContact O-CG 3.37Å; L805-K809 PolarHBondContact O-N 3.33Å; C806-K809 PolarHBondContact O-N 2.78Å; K809-G811 VanDerWaalsContact C-N 3.29Å; K809-G811 PolarHBondContact O-N 3.39Å; K809-A812 PolarHBondContact O-N 3.19Å; K809-E813 WeakPolarHBondContact O-CG 3.36Å; K809-E813 PolarHBondContact O-N 2.86Å
810A86.7Confident86.6Confident56 Ų5697 Ų9746%0.46351%0.51SS..Hα-helixtrans-60.8-39.3175.700000111.9C806 I807 A814C806-A810 WeakPolarHBondContact O-CB 3.28Å; C806-A810 PolarHBondContact O-N 3.02Å; I807-A810 PolarHBondContact O-N 3.36Å; A810-A814 WeakPolarHBondContact O-CB 3.43Å; A810-A814 PolarHBondContact O-N 2.67Å
811G89.5Confident86.6Confident35 Ų3595.8 Ų95.836%0.36151%0.511SS..Hα-helixtrans-62.9-44.817300000112.8I807 K808 K809 A814 E815I807-G811 PolarHBondContact O-N 3.43Å; K808-G811 PolarHBondContact O-N 2.8Å; K809-G811 VanDerWaalsContact C-N 3.29Å; K809-G811 PolarHBondContact O-N 3.39Å; G811-A814 PolarHBondContact O-N 3.18Å; G811-E815 WeakPolarHBondContact O-CG 3.34Å; G811-E815 PolarHBondContact O-N 3.34Å
812A83.3Confident86.7Confident61 Ų6196.1 Ų96.150%0.50451%0.512SS..Hα-helixtrans-64.1-41.2176.900000112.3K808 K809 A814 E815 Q816K808-A812 WeakPolarHBondContact O-CB 3.49Å; K808-A812 PolarHBondContact O-N 3.16Å; K809-A812 PolarHBondContact O-N 3.19Å; A812-A814 VanDerWaalsContact C-N 3.35Å; A812-E815 PolarHBondContact O-N 2.98Å; A812-Q816 WeakPolarHBondContact O-CB 3.37Å; A812-Q816 PolarHBondContact O-N 3.47Å
813E86.2Confident86.7Confident125 Ų12595.7 Ų95.758%0.58451%0.512SS*.Hα-helixtrans-64.8-37.5174.6-73.7178.9-172.900112.4K809 Q816 K817K809-E813 WeakPolarHBondContact O-CG 3.36Å; K809-E813 PolarHBondContact O-N 2.86Å; E813-Q816 PolarHBondContact O-N 2.95Å; E813-K817 WeakPolarHBondContact O-CG 3.42Å; E813-K817 PolarHBondContact O-N 2.85Å
814A87.7Confident86.4Confident45 Ų45101.9 Ų101.937%0.37253%0.53SS..Hα-helixtrans-67.1-42.9175.400000111.9A810 G811 A812 K817 K818A810-A814 WeakPolarHBondContact O-CB 3.43Å; A810-A814 PolarHBondContact O-N 2.67Å; G811-A814 PolarHBondContact O-N 3.18Å; A812-A814 VanDerWaalsContact C-N 3.35Å; A814-K817 PolarHBondContact O-N 2.92Å; A814-K818 WeakPolarHBondContact O-CG 3.36Å; A814-K818 PolarHBondContact O-N 2.84Å
815E86.4Confident86.4Confident107 Ų107102.8 Ų102.850%0.553%0.532SS..Hα-helixtrans-67.5-36.6174.9-70.4-55.9139.300112G811 A812 K818 A819G811-E815 WeakPolarHBondContact O-CG 3.34Å; G811-E815 PolarHBondContact O-N 3.34Å; A812-E815 PolarHBondContact O-N 2.98Å; E815-K818 PolarHBondContact O-N 3.43Å; E815-K818 IonicContact OE1-NZ 2.62Å; E815-K818 PolarHBondContact OE1-NZ 2.9Å; E815-A819 WeakPolarHBondContact O-CB 3.4Å; E815-A819 PolarHBondContact O-N 3.38Å
816Q87.4Confident86.3Confident112 Ų112104 Ų10452%0.52354%0.538SS..Hα-helixtrans-62.1-45.1173.2-173.663.734.600111.4A812 E813 K818 A819 D820A812-Q816 WeakPolarHBondContact O-CB 3.37Å; A812-Q816 PolarHBondContact O-N 3.47Å; E813-Q816 PolarHBondContact O-N 2.95Å; Q816-K818 VanDerWaalsContact C-N 3.34Å; Q816-K818 PolarHBondContact O-N 3.36Å; Q816-A819 WeakPolarHBondContact O-CB 3.49Å; Q816-A819 PolarHBondContact O-N 3.49Å; Q816-D820 PolarHBondContact NE2-OD1 3.35Å; Q816-D820 VanDerWaalsContact NE2-OD1 3.12Å; Q816-D820 VanDerWaalsContact O-CG 3.23Å; Q816-D820 PolarHBondContact O-N 3.49Å
817K87.3Confident86.1Confident135 Ų135103.1 Ų103.159%0.58753%0.526SS*.Hα-helixtrans-60.2-42.6175.2-75.6176.3-177.7174.20112E813 A814 D820 E821E813-K817 WeakPolarHBondContact O-CG 3.42Å; E813-K817 PolarHBondContact O-N 2.85Å; A814-K817 PolarHBondContact O-N 2.92Å; K817-D820 PolarHBondContact O-N 3.35Å; K817-E821 WeakPolarHBondContact O-CG 3.31Å; K817-E821 PolarHBondContact O-N 3.48Å
818K87Confident85.8Confident105 Ų105100.2 Ų100.246%0.45752%0.516SS..Hα-helixtrans-63.4-40.9174.6-72.5178.1-168.7165.70112A814 E815 Q816 E821 L822A814-K818 WeakPolarHBondContact O-CG 3.36Å; A814-K818 PolarHBondContact O-N 2.84Å; E815-K818 PolarHBondContact O-N 3.43Å; E815-K818 IonicContact OE1-NZ 2.62Å; E815-K818 PolarHBondContact OE1-NZ 2.9Å; Q816-K818 VanDerWaalsContact C-N 3.34Å; Q816-K818 PolarHBondContact O-N 3.36Å; K818-E821 PolarHBondContact O-N 2.92Å; K818-L822 WeakPolarHBondContact O-CB 3.33Å; K818-L822 VanDerWaalsContact O-CG 3.3Å; K818-L822 WeakPolarHBondContact O-CG 3.44Å; K818-L822 PolarHBondContact O-N 3.46Å
819A84.8Confident85.7Confident41 Ų4197.6 Ų97.634%0.33951%0.51SS..Hα-helixtrans-62.6-44.4176.500000111.2E815 Q816 E821 L822 M823E815-A819 WeakPolarHBondContact O-CB 3.4Å; E815-A819 PolarHBondContact O-N 3.38Å; Q816-A819 WeakPolarHBondContact O-CB 3.49Å; Q816-A819 PolarHBondContact O-N 3.49Å; A819-E821 PolarHBondContact O-N 3.33Å; A819-L822 PolarHBondContact O-N 2.92Å; A819-M823 WeakPolarHBondContact O-CB 3.44Å; A819-M823 WeakPolarHBondContact O-CG 3.34Å; A819-M823 PolarHBondContact O-N 2.99Å
820D87.7Confident85.7Confident65 Ų6594.2 Ų94.235%0.34850%0.502SS..Hα-helixtrans-63.7-39.9176.7-65-20.3000111.8Q816 K817 K824Q816-D820 PolarHBondContact NE2-OD1 3.35Å; Q816-D820 VanDerWaalsContact NE2-OD1 3.12Å; Q816-D820 VanDerWaalsContact O-CG 3.23Å; Q816-D820 PolarHBondContact O-N 3.49Å; K817-D820 PolarHBondContact O-N 3.35Å; D820-K824 WeakPolarHBondContact O-CG 3.25Å; D820-K824 PolarHBondContact O-N 2.78Å
821E88Confident85.6Confident134 Ų13492.4 Ų92.463%0.62649%0.485SS*.Hα-helixtrans-63.9-44.5173.3-76.2175.2-173.800112.1K817 K818 A819 K824 K825K817-E821 WeakPolarHBondContact O-CG 3.31Å; K817-E821 PolarHBondContact O-N 3.48Å; K818-E821 PolarHBondContact O-N 2.92Å; A819-E821 PolarHBondContact O-N 3.33Å; E821-K824 PolarHBondContact O-N 3.38Å; E821-K825 WeakPolarHBondContact O-CB 3.46Å; E821-K825 PolarHBondContact O-N 3.38Å
822L86.6Confident85.5Confident109 Ų10995 Ų9557%0.57149%0.488SS*.Hα-helixtrans-66.2-37.8177.2-74.8173.5000112K818 A819 K825 L826K818-L822 WeakPolarHBondContact O-CB 3.33Å; K818-L822 VanDerWaalsContact O-CG 3.3Å; K818-L822 WeakPolarHBondContact O-CG 3.44Å; K818-L822 PolarHBondContact O-N 3.46Å; A819-L822 PolarHBondContact O-N 2.92Å; L822-K825 PolarHBondContact O-N 2.95Å; L822-L826 WeakPolarHBondContact O-CB 3.39Å; L822-L826 PolarHBondContact O-N 2.8Å
823M84.4Confident85.5Confident124 Ų12499.7 Ų99.761%0.61150%0.497SS*.Hα-helixtrans-62.8-46.5173.3-79.8-172.4-0.600111.5A819 K825 L826 Q827A819-M823 WeakPolarHBondContact O-CB 3.44Å; A819-M823 WeakPolarHBondContact O-CG 3.34Å; A819-M823 PolarHBondContact O-N 2.99Å; M823-K825 PolarHBondContact O-N 3.29Å; M823-L826 PolarHBondContact O-N 2.87Å; M823-Q827 WeakPolarHBondContact O-CB 3.45Å; M823-Q827 PolarHBondContact O-N 3.34Å
824K82.6Confident85.4Confident163 Ų16397.1 Ų97.171%0.70948%0.484SS*.Hα-helixtrans-58.8-39.1174.3-75.8177.6180176.10111.8D820 E821 Q827 S828D820-K824 WeakPolarHBondContact O-CG 3.25Å; D820-K824 PolarHBondContact O-N 2.78Å; E821-K824 PolarHBondContact O-N 3.38Å; K824-Q827 PolarHBondContact O-N 2.84Å; K824-S828 PolarHBondContact O-N 3.42Å; K824-S828 PolarHBondContact O-OG 2.79Å
825K85.9Confident85.4Confident139 Ų13995.6 Ų95.660%0.60447%0.47SS*.Hα-helixtrans-69.9-43.9179-151.3169.4-169.8173.70112E821 L822 M823 Q827 S828 L829E821-K825 WeakPolarHBondContact O-CB 3.46Å; E821-K825 PolarHBondContact O-N 3.38Å; L822-K825 PolarHBondContact O-N 2.95Å; M823-K825 PolarHBondContact O-N 3.29Å; K825-Q827 VanDerWaalsContact C-N 3.3Å; K825-Q827 PolarHBondContact O-N 3.22Å; K825-S828 PolarHBondContact O-N 2.95Å; K825-S828 PolarHBondContact O-OG 2.78Å; K825-L829 WeakPolarHBondContact O-CG 3.47Å; K825-L829 PolarHBondContact O-N 3.5Å
826L82Confident85.3Confident121 Ų12194.3 Ų94.363%0.63447%0.466SS*.Hα-helixtrans-58.6-42.9172.8-85.4167.1000111.5L822 M823 L829 S830L822-L826 WeakPolarHBondContact O-CB 3.39Å; L822-L826 PolarHBondContact O-N 2.8Å; M823-L826 PolarHBondContact O-N 2.87Å; L826-L829 PolarHBondContact O-N 3.15Å; L826-S830 WeakPolarHBondContact O-CB 3.39Å; L826-S830 PolarHBondContact O-N 2.82Å
827Q84.3Confident85.4Confident67 Ų6793.3 Ų93.331%0.31346%0.464SS..Hα-helixtrans-61-52.7176.4-169.760.93300110.9M823 K824 K825 L829 S830 D831M823-Q827 WeakPolarHBondContact O-CB 3.45Å; M823-Q827 PolarHBondContact O-N 3.34Å; K824-Q827 PolarHBondContact O-N 2.84Å; K825-Q827 VanDerWaalsContact C-N 3.3Å; K825-Q827 PolarHBondContact O-N 3.22Å; Q827-L829 PolarHBondContact O-N 2.93Å; Q827-L829 VanDerWaalsContact O-N 3.15Å; Q827-S830 WeakPolarHBondContact O-CA 3.29Å; Q827-S830 VanDerWaalsContact O-CB 3.32Å; Q827-S830 WeakPolarHBondContact O-CB 3.5Å; Q827-S830 PolarHBondContact O-N 3.48Å; Q827-D831 PolarHBondContact NE2-OD1 2.89Å; Q827-D831 VanDerWaalsContact O-CG 3.25Å; Q827-D831 PolarHBondContact O-N 3.34Å
828S83.6Confident85.2Confident65 Ų6590.5 Ų90.546%0.45545%0.452SS..Hα-helixtrans-57.8-33.7178.168.80000113.6K824 K825 Q832K824-S828 PolarHBondContact O-N 3.42Å; K824-S828 PolarHBondContact O-OG 2.79Å; K825-S828 PolarHBondContact O-N 2.95Å; K825-S828 PolarHBondContact O-OG 2.78Å; S828-Q832 WeakPolarHBondContact O-CB 3.43Å; S828-Q832 PolarHBondContact O-N 3.32Å
829L85.3Confident85.1Confident111 Ų11188.9 Ų88.958%0.58145%0.446SS*.Hα-helixtrans-74.5-34.6175.7-73.3171000112.3K825 L826 Q827 K833K825-L829 WeakPolarHBondContact O-CG 3.47Å; K825-L829 PolarHBondContact O-N 3.5Å; L826-L829 PolarHBondContact O-N 3.15Å; Q827-L829 PolarHBondContact O-N 2.93Å; Q827-L829 VanDerWaalsContact O-N 3.15Å; L829-K833 VanDerWaalsContact O-CB 3.28Å; L829-K833 WeakPolarHBondContact O-CB 3.35Å; L829-K833 PolarHBondContact O-N 2.9Å
830S83.2Confident85.1Confident58 Ų5891.2 Ų91.241%0.40645%0.453SS..Hα-helixtrans-64.9-47.3173.4-173.40000110.9L826 Q827 Q832 K833 Q834L826-S830 WeakPolarHBondContact O-CB 3.39Å; L826-S830 PolarHBondContact O-N 2.82Å; Q827-S830 WeakPolarHBondContact O-CA 3.29Å; Q827-S830 VanDerWaalsContact O-CB 3.32Å; Q827-S830 WeakPolarHBondContact O-CB 3.5Å; Q827-S830 PolarHBondContact O-N 3.48Å; S830-Q832 PolarHBondContact O-N 2.93Å; S830-K833 WeakPolarHBondContact O-CB 3.45Å; S830-K833 PolarHBondContact O-N 2.88Å; S830-Q834 PolarHBondContact O-N 3.35Å
831D85.2Confident85Confident18 Ų1892.3 Ų92.310%0.09646%0.456CS..Hα-helixtrans-62.1-45.4178.6-58.7-27.3000110.5Q827 K833 Q834 I835 P902Q827-D831 PolarHBondContact NE2-OD1 2.89Å; Q827-D831 VanDerWaalsContact O-CG 3.25Å; Q827-D831 PolarHBondContact O-N 3.34Å; D831-K833 PolarHBondContact O-N 2.85Å; D831-Q834 PolarHBondContact O-N 3.46Å; D831-I835 WeakPolarHBondContact O-CG1 3.41Å; D831-I835 PolarHBondContact O-N 3.08Å; D831-P902 HydrophobicContact CB-CG 4.02Å
832Q85.7Confident84.8Confident91 Ų9188.3 Ų88.343%0.42545%0.446SS..Hα-helixtrans-61.1-44.1175.2-17362.139.400112.2S828 S830 Q834 I835 D836S828-Q832 WeakPolarHBondContact O-CB 3.43Å; S828-Q832 PolarHBondContact O-N 3.32Å; S830-Q832 PolarHBondContact O-N 2.93Å; Q832-Q834 VanDerWaalsContact C-N 3.26Å; Q832-Q834 PolarHBondContact O-N 2.79Å; Q832-I835 PolarHBondContact O-N 3.42Å; Q832-D836 PolarHBondContact NE2-OD1 2.98Å; Q832-D836 WeakPolarHBondContact O-CB 3.47Å; Q832-D836 PolarHBondContact O-N 3.11Å
833K83.9Confident84.7Confident159 Ų15991 Ų9169%0.69145%0.448SS*.Hα-helixtrans-59.8-38.8176.6179.2-173.4174.1-171.70111.5L829 S830 D831 L837L829-K833 VanDerWaalsContact O-CB 3.28Å; L829-K833 WeakPolarHBondContact O-CB 3.35Å; L829-K833 PolarHBondContact O-N 2.9Å; S830-K833 WeakPolarHBondContact O-CB 3.45Å; S830-K833 PolarHBondContact O-N 2.88Å; D831-K833 PolarHBondContact O-N 2.85Å; K833-L837 WeakPolarHBondContact O-CB 3.3Å; K833-L837 PolarHBondContact O-N 2.89Å
834Q85.5Confident84.7Confident70 Ų7089.9 Ų89.933%0.32744%0.442SS..Hα-helixtrans-69.2-41.5178.5-169168.1-9.600111.3S830 D831 Q832 L837 F838 P902S830-Q834 PolarHBondContact O-N 3.35Å; D831-Q834 PolarHBondContact O-N 3.46Å; Q832-Q834 VanDerWaalsContact C-N 3.26Å; Q832-Q834 PolarHBondContact O-N 2.79Å; Q834-L837 PolarHBondContact O-N 3.33Å; Q834-F838 HydrophobicContact CG-CD2 4.08Å; Q834-F838 HydrophobicContact CG-CE2 3.62Å; Q834-F838 HydrophobicContact CG-CZ 4.47Å; Q834-F838 WeakPolarHBondContact O-CD2 3.36Å; Q834-F838 PolarHBondContact O-N 3Å; Q834-F838 VanDerWaalsContact O-N 3.09Å; Q834-P902 HydrophobicContact CB-CB 4.26Å; Q834-P902 HydrophobicContact CB-CG 4.44Å; Q834-P902 HydrophobicContact CG-CB 4.17Å
835I86.5Confident84.8Confident14 Ų1487.6 Ų87.67%0.07243%0.433CS..Hα-helixtrans-58.7-50.8171.7-67.1164.4000110.6D831 Q832 L837 F838 E839 P902 Y905 L906D831-I835 WeakPolarHBondContact O-CG1 3.41Å; D831-I835 PolarHBondContact O-N 3.08Å; Q832-I835 PolarHBondContact O-N 3.42Å; I835-L837 VanDerWaalsContact C-N 3.29Å; I835-L837 PolarHBondContact O-N 3.21Å; I835-F838 PolarHBondContact O-N 3.5Å; I835-F838 VanDerWaalsContact O-N 3.16Å; I835-E839 PolarHBondContact O-N 3.47Å; I835-P902 HydrophobicContact CG1-CB 4.03Å; I835-Y905 HydrophobicContact CD1-CD1 3.57Å; I835-Y905 HydrophobicContact CD1-CE1 4.08Å; I835-Y905 HydrophobicContact CD1-CG 4.16Å; I835-Y905 HydrophobicContact CG1-CD1 4.15Å; I835-Y905 HydrophobicContact CG2-CD1 4.3Å; I835-Y905 HydrophobicContact CG2-CE1 4.3Å; I835-L906 HydrophobicContact CG2-CD2 4.08Å; I835-L906 HydrophobicContact CG2-CG 4.46Å
836D85.4Confident84.6Confident79 Ų7982.8 Ų82.842%0.42242%0.42SS..Hα-helixtrans-60.9-38.4-179.2-68.7-15.6000111.7Q832 E839 L840Q832-D836 PolarHBondContact NE2-OD1 2.98Å; Q832-D836 WeakPolarHBondContact O-CB 3.47Å; Q832-D836 PolarHBondContact O-N 3.11Å; D836-E839 PolarHBondContact O-N 2.97Å; D836-L840 VanDerWaalsContact O-CB 3.26Å; D836-L840 WeakPolarHBondContact O-CB 3.36Å; D836-L840 PolarHBondContact O-N 2.84Å
837L87.6Confident84.7Confident91 Ų9180.6 Ų80.648%0.47641%0.411SS..Hα-helixtrans-63.8-45.3176-178.964.6000111.5K833 Q834 I835 L840 Q841K833-L837 WeakPolarHBondContact O-CB 3.3Å; K833-L837 PolarHBondContact O-N 2.89Å; Q834-L837 PolarHBondContact O-N 3.33Å; I835-L837 VanDerWaalsContact C-N 3.29Å; I835-L837 PolarHBondContact O-N 3.21Å; L837-L840 PolarHBondContact O-N 3.48Å; L837-Q841 WeakPolarHBondContact O-CG 3.44Å; L837-Q841 PolarHBondContact O-N 3.47Å
838F84.5Confident84.8Confident76 Ų7681.6 Ų81.633%0.33342%0.418SS..Hα-helixtrans-65-40.2176.6-75.2-55.8000112.1Q834 I835 Q841 A842 V903 L906Q834-F838 HydrophobicContact CG-CD2 4.08Å; Q834-F838 HydrophobicContact CG-CE2 3.62Å; Q834-F838 HydrophobicContact CG-CZ 4.47Å; Q834-F838 WeakPolarHBondContact O-CD2 3.36Å; Q834-F838 PolarHBondContact O-N 3Å; Q834-F838 VanDerWaalsContact O-N 3.09Å; I835-F838 PolarHBondContact O-N 3.5Å; I835-F838 VanDerWaalsContact O-N 3.16Å; F838-Q841 PolarHBondContact O-N 3.49Å; F838-A842 WeakPolarHBondContact O-CB 3.49Å; F838-A842 PolarHBondContact O-N 3.45Å; F838-V903 HydrophobicContact CE2-CG2 4.33Å; F838-L906 HydrophobicContact CB-CD1 3.43Å; F838-L906 VanDerWaalsContact CB-CD1 3.43Å; F838-L906 HydrophobicContact CD2-CD1 3.33Å; F838-L906 HydrophobicContact CE2-CD1 4.26Å; F838-L906 HydrophobicContact CG-CD1 3.65Å
839E85Confident84.8Confident72 Ų7283.3 Ų83.334%0.33642%0.415SS..Hα-helixtrans-64.3-41.7174.1-73.6-162.6179.700112.1I835 D836 A842 R843 L906I835-E839 PolarHBondContact O-N 3.47Å; D836-E839 PolarHBondContact O-N 2.97Å; E839-A842 PolarHBondContact O-N 3.18Å; E839-R843 WeakPolarHBondContact O-CG 3.35Å; E839-R843 PolarHBondContact O-N 2.97Å; E839-R843 IonicContact OE2-NH2 3.8Å; E839-R843 PolarHBondContact OE2-NH2 2.97Å; E839-L906 HydrophobicContact CG-CD2 4.22Å
840L84.4Confident84.7Confident90 Ų9086.4 Ų86.447%0.47142%0.419SS..Hα-helixtrans-61.9-45.3176.5-177.565.9000111D836 L837 A842 R843 Q844D836-L840 VanDerWaalsContact O-CB 3.26Å; D836-L840 WeakPolarHBondContact O-CB 3.36Å; D836-L840 PolarHBondContact O-N 2.84Å; L837-L840 PolarHBondContact O-N 3.48Å; L840-A842 VanDerWaalsContact C-N 3.33Å; L840-A842 PolarHBondContact O-N 2.9Å; L840-R843 PolarHBondContact O-N 3.29Å; L840-Q844 WeakPolarHBondContact O-CB 3.47Å; L840-Q844 WeakPolarHBondContact O-CG 3.38Å; L840-Q844 PolarHBondContact O-N 2.81Å
841Q85.9Confident84.7Confident87 Ų8788.2 Ų88.241%0.40742%0.422SS..Hα-helixtrans-60.1-42.5174.8-75.5177.7-13.100111.7L837 F838 R843 Q844 H845L837-Q841 WeakPolarHBondContact O-CG 3.44Å; L837-Q841 PolarHBondContact O-N 3.47Å; F838-Q841 PolarHBondContact O-N 3.49Å; Q841-R843 VanDerWaalsContact C-N 3.33Å; Q841-R843 PolarHBondContact O-N 2.97Å; Q841-Q844 PolarHBondContact O-N 3.34Å; Q841-H845 PolarHBondContact O-CD2 2.87Å; Q841-H845 PolarHBondContact O-N 3.36Å
842A82.5Confident84.7Confident51 Ų5191.1 Ų91.142%0.42143%0.434SS..Hα-helixtrans-62.3-40.8175.800000111.8F838 E839 L840 H845 A846F838-A842 WeakPolarHBondContact O-CB 3.49Å; F838-A842 PolarHBondContact O-N 3.45Å; E839-A842 PolarHBondContact O-N 3.18Å; L840-A842 VanDerWaalsContact C-N 3.33Å; L840-A842 PolarHBondContact O-N 2.9Å; A842-H845 PolarHBondContact O-N 3.48Å; A842-A846 PolarHBondContact O-N 2.83Å
843R85.1Confident84.4Confident165 Ų16590.1 Ų90.162%0.62343%0.432SS*.Hα-helixtrans-67.3-39.7175.1-70.5-178.7-167174.210.7112.2E839 L840 Q841 A846 T847E839-R843 WeakPolarHBondContact O-CG 3.35Å; E839-R843 PolarHBondContact O-N 2.97Å; E839-R843 IonicContact OE2-NH2 3.8Å; E839-R843 PolarHBondContact OE2-NH2 2.97Å; L840-R843 PolarHBondContact O-N 3.29Å; Q841-R843 VanDerWaalsContact C-N 3.33Å; Q841-R843 PolarHBondContact O-N 2.97Å; R843-A846 WeakPolarHBondContact O-CB 3.43Å; R843-A846 PolarHBondContact O-N 3.33Å; R843-T847 PolarHBondContact O-N 3.43Å; R843-T847 PolarHBondContact O-OG1 2.84Å
844Q84.4Confident84.1Confident101 Ų10192.5 Ų92.547%0.47244%0.436SS..Hα-helixtrans-62-43.8174.9-75174.8-8.500111.6L840 Q841 A846 T847 L848L840-Q844 WeakPolarHBondContact O-CB 3.47Å; L840-Q844 WeakPolarHBondContact O-CG 3.38Å; L840-Q844 PolarHBondContact O-N 2.81Å; Q841-Q844 PolarHBondContact O-N 3.34Å; Q844-A846 VanDerWaalsContact C-N 3.34Å; Q844-A846 PolarHBondContact O-N 2.91Å; Q844-T847 VanDerWaalsContact C-OG1 3.31Å; Q844-T847 VanDerWaalsContact CA-OG1 3.28Å; Q844-T847 WeakPolarHBondContact CA-OG1 3.36Å; Q844-T847 PolarHBondContact O-N 2.82Å; Q844-T847 PolarHBondContact O-OG1 3.25Å; Q844-L848 WeakPolarHBondContact O-CG 3.42Å; Q844-L848 PolarHBondContact O-N 2.85Å
845H84.1Confident84.2Confident114 Ų11494.1 Ų94.153%0.52844%0.444SS..Hα-helixtrans-61.3-42.1172.2-89-71.7000112.2Q841 A842 T847 L848 Y849Q841-H845 PolarHBondContact O-CD2 2.87Å; Q841-H845 PolarHBondContact O-N 3.36Å; A842-H845 PolarHBondContact O-N 3.48Å; H845-T847 VanDerWaalsContact C-N 3.34Å; H845-T847 PolarHBondContact O-N 3.39Å; H845-L848 PolarHBondContact O-N 2.89Å; H845-Y849 WeakPolarHBondContact O-CD2 3.33Å; H845-Y849 PolarHBondContact O-N 3.03Å; H845-Y849 VanDerWaalsContact O-N 3.17Å
846A83.4Confident83.9Confident39 Ų39101 Ų10132%0.32248%0.48SS..Hα-helixtrans-61.3-41.617500000111.9A842 R843 Q844 L848 Y849 W850A842-A846 PolarHBondContact O-N 2.83Å; R843-A846 WeakPolarHBondContact O-CB 3.43Å; R843-A846 PolarHBondContact O-N 3.33Å; Q844-A846 VanDerWaalsContact C-N 3.34Å; Q844-A846 PolarHBondContact O-N 2.91Å; A846-L848 VanDerWaalsContact C-N 3.34Å; A846-L848 PolarHBondContact O-N 2.87Å; A846-Y849 WeakPolarHBondContact O-CB 3.43Å; A846-Y849 PolarHBondContact O-N 3.34Å; A846-W850 PolarHBondContact O-N 3.19Å
847T83.6Confident83.8Confident74 Ų74104.2 Ų104.245%0.45449%0.491SS..Hα-helixtrans-63.2-37.7176.348.20000112.8R843 Q844 H845 Y849 W850 E851R843-T847 PolarHBondContact O-N 3.43Å; R843-T847 PolarHBondContact O-OG1 2.84Å; Q844-T847 VanDerWaalsContact C-OG1 3.31Å; Q844-T847 VanDerWaalsContact CA-OG1 3.28Å; Q844-T847 WeakPolarHBondContact CA-OG1 3.36Å; Q844-T847 PolarHBondContact O-N 2.82Å; Q844-T847 PolarHBondContact O-OG1 3.25Å; H845-T847 VanDerWaalsContact C-N 3.34Å; H845-T847 PolarHBondContact O-N 3.39Å; T847-Y849 VanDerWaalsContact C-N 3.29Å; T847-Y849 PolarHBondContact O-N 3.28Å; T847-W850 PolarHBondContact O-N 3.34Å; T847-W850 VanDerWaalsContact O-N 3.16Å; T847-E851 WeakPolarHBondContact O-CG 3.47Å; T847-E851 PolarHBondContact O-N 3.19Å
848L86.7Confident83.5Confident88 Ų88103.8 Ų103.846%0.46148%0.483SS..Hα-helixtrans-61.6-39.8174-69.5172000111.4Q844 H845 A846 E851 Q852Q844-L848 WeakPolarHBondContact O-CG 3.42Å; Q844-L848 PolarHBondContact O-N 2.85Å; H845-L848 PolarHBondContact O-N 2.89Å; A846-L848 VanDerWaalsContact C-N 3.34Å; A846-L848 PolarHBondContact O-N 2.87Å; L848-E851 PolarHBondContact O-N 3.27Å; L848-Q852 WeakPolarHBondContact O-CB 3.35Å; L848-Q852 VanDerWaalsContact O-CG 3.29Å; L848-Q852 WeakPolarHBondContact O-CG 3.42Å; L848-Q852 PolarHBondContact O-N 3.31Å
849Y82.4Confident83.2Confident101 Ų101110.7 Ų110.740%0.39651%0.507SS..Hα-helixtrans-65.7-41.2173.8-66-51.9000112.1H845 A846 T847 E851 Q852 I853 Y858H845-Y849 WeakPolarHBondContact O-CD2 3.33Å; H845-Y849 PolarHBondContact O-N 3.03Å; H845-Y849 VanDerWaalsContact O-N 3.17Å; A846-Y849 WeakPolarHBondContact O-CB 3.43Å; A846-Y849 PolarHBondContact O-N 3.34Å; T847-Y849 VanDerWaalsContact C-N 3.29Å; T847-Y849 PolarHBondContact O-N 3.28Å; Y849-E851 VanDerWaalsContact C-N 3.34Å; Y849-E851 PolarHBondContact O-N 3.03Å; Y849-Q852 PolarHBondContact O-N 2.98Å; Y849-I853 VanDerWaalsContact O-CG1 3.27Å; Y849-I853 WeakPolarHBondContact O-CG1 3.36Å; Y849-I853 PolarHBondContact O-N 3.05Å; Y849-Y858 AromaticContact CD1-CD2 3.98Å; Y849-Y858 HydrophobicContact CD1-CD2 3.98Å; Y849-Y858 AromaticContact CD1-CE2 3.5Å; Y849-Y858 HydrophobicContact CD1-CE2 3.5Å; Y849-Y858 VanDerWaalsContact CD1-CE2 3.5Å; Y849-Y858 HydrophobicContact CE1-CE2 4.16Å; Y849-Y858 HydrophobicContact CG-CE2 4.06Å
850W83Confident82.6Confident176 Ų176116.9 Ų116.967%0.66753%0.528SS*.Hα-helixtrans-62.5-39.1174.6-69.2120.5000112.7A846 T847 I853 R854A846-W850 PolarHBondContact O-N 3.19Å; T847-W850 PolarHBondContact O-N 3.34Å; T847-W850 VanDerWaalsContact O-N 3.16Å; W850-I853 HydrophobicContact CE3-CD1 3.82Å; W850-I853 HydrophobicContact CZ3-CD1 4Å; W850-I853 PolarHBondContact O-N 2.96Å; W850-R854 WeakPolarHBondContact O-CB 3.24Å; W850-R854 PolarHBondContact O-N 2.96Å
851E83.3Confident81.9Confident97 Ų97119 Ų11945%0.45354%0.539SS..Hα-helixtrans-66.9-40.5174.2-75.1-177.8168.400112.3T847 L848 Y849 I853 R854 Q855T847-E851 WeakPolarHBondContact O-CG 3.47Å; T847-E851 PolarHBondContact O-N 3.19Å; L848-E851 PolarHBondContact O-N 3.27Å; Y849-E851 VanDerWaalsContact C-N 3.34Å; Y849-E851 PolarHBondContact O-N 3.03Å; E851-I853 VanDerWaalsContact C-N 3.31Å; E851-I853 PolarHBondContact O-N 3.41Å; E851-R854 PolarHBondContact O-N 3.35Å; E851-Q855 WeakPolarHBondContact O-CB 3.45Å; E851-Q855 VanDerWaalsContact O-CG 3.32Å; E851-Q855 WeakPolarHBondContact O-CG 3.3Å; E851-Q855 PolarHBondContact O-N 3.39Å
852Q84.9Confident81.3Confident78 Ų78116.3 Ų116.336%0.36453%0.529SS..Hα-helixtrans-63.1-37.5174-74.7176.23.800112L848 Y849 Q855 D856 K857 Y858L848-Q852 WeakPolarHBondContact O-CB 3.35Å; L848-Q852 VanDerWaalsContact O-CG 3.29Å; L848-Q852 WeakPolarHBondContact O-CG 3.42Å; L848-Q852 PolarHBondContact O-N 3.31Å; Y849-Q852 PolarHBondContact O-N 2.98Å; Q852-Q855 PolarHBondContact O-N 3.19Å; Q852-D856 PolarHBondContact O-N 2.92Å; Q852-K857 PolarHBondContact O-N 2.82Å; Q852-Y858 HydrophobicContact CB-CD2 4.29Å; Q852-Y858 PolarHBondContact O-N 3.28Å; Q852-Y858 VanDerWaalsContact O-N 3.14Å
853I80.1Confident80.8Confident71 Ų71119.6 Ų119.636%0.36455%0.546SS..Hα-helixtrans-64.9-45.4173.1-68.1165.3000109.5Y849 W850 E851 Q855 D856 Y858Y849-I853 VanDerWaalsContact O-CG1 3.27Å; Y849-I853 WeakPolarHBondContact O-CG1 3.36Å; Y849-I853 PolarHBondContact O-N 3.05Å; W850-I853 HydrophobicContact CE3-CD1 3.82Å; W850-I853 HydrophobicContact CZ3-CD1 4Å; W850-I853 PolarHBondContact O-N 2.96Å; E851-I853 VanDerWaalsContact C-N 3.31Å; E851-I853 PolarHBondContact O-N 3.41Å; I853-Q855 PolarHBondContact O-N 2.71Å; I853-D856 PolarHBondContact O-N 3.35Å; I853-Y858 HydrophobicContact CD1-CD1 4.2Å; I853-Y858 HydrophobicContact CD1-CG 4.31Å; I853-Y858 HydrophobicContact CG1-CD1 3.71Å; I853-Y858 HydrophobicContact CG1-CD2 4.22Å; I853-Y858 HydrophobicContact CG1-CE1 4.48Å; I853-Y858 HydrophobicContact CG1-CG 3.54Å
854R78.7Confident80.4Confident209 Ų209114.5 Ų114.579%0.78954%0.536SS*.Hα-helixtrans-63.2-25.5178.4-157.2-178.781.9-179.62.9113.3W850 E851W850-R854 WeakPolarHBondContact O-CB 3.24Å; W850-R854 PolarHBondContact O-N 2.96Å; E851-R854 PolarHBondContact O-N 3.35Å
855Q87.3Confident80Confident103 Ų103113.7 Ų113.748%0.48155%0.546SS..THydrogen-bonded Turntrans-93.85.3176.3-66.9179.226.200113.4E851 Q852 I853 K857E851-Q855 WeakPolarHBondContact O-CB 3.45Å; E851-Q855 VanDerWaalsContact O-CG 3.32Å; E851-Q855 WeakPolarHBondContact O-CG 3.3Å; E851-Q855 PolarHBondContact O-N 3.39Å; Q852-Q855 PolarHBondContact O-N 3.19Å; I853-Q855 PolarHBondContact O-N 2.71Å; Q855-K857 HydrophobicContact CB-CD 4.17Å; Q855-K857 HydrophobicContact CB-CG 4.22Å; Q855-K857 PolarHBondContact O-N 2.88Å; Q855-K857 VanDerWaalsContact O-N 3.11Å
856D80.3Confident79.9Confident158 Ų158113.1 Ų113.185%0.84555%0.551SS**THydrogen-bonded Turntrans54.223.6-173.1-68-35000114.6Q852 I853Q852-D856 PolarHBondContact O-N 2.92Å; I853-D856 PolarHBondContact O-N 3.35Å
857K83.5Confident79.7Confident147 Ų147113 Ų11364%0.63955%0.548SS*.  trans-97.8-7.2178.5-69.3175.6-171.4165.40113.3Q852 Q855 R859Q852-K857 PolarHBondContact O-N 2.82Å; Q855-K857 HydrophobicContact CB-CD 4.17Å; Q855-K857 HydrophobicContact CB-CG 4.22Å; Q855-K857 PolarHBondContact O-N 2.88Å; Q855-K857 VanDerWaalsContact O-N 3.11Å; K857-R859 PolarHBondContact O-N 2.71Å
858Y80Confident79.3Confident82 Ų82112.3 Ų112.332%0.32255%0.546SS..  trans-72.3112.7-176.1-176.5-104.9000111.8Y849 Q852 I853 R860Y849-Y858 AromaticContact CD1-CD2 3.98Å; Y849-Y858 HydrophobicContact CD1-CD2 3.98Å; Y849-Y858 AromaticContact CD1-CE2 3.5Å; Y849-Y858 HydrophobicContact CD1-CE2 3.5Å; Y849-Y858 VanDerWaalsContact CD1-CE2 3.5Å; Y849-Y858 HydrophobicContact CE1-CE2 4.16Å; Y849-Y858 HydrophobicContact CG-CE2 4.06Å; Q852-Y858 HydrophobicContact CB-CD2 4.29Å; Q852-Y858 PolarHBondContact O-N 3.28Å; Q852-Y858 VanDerWaalsContact O-N 3.14Å; I853-Y858 HydrophobicContact CD1-CD1 4.2Å; I853-Y858 HydrophobicContact CD1-CG 4.31Å; I853-Y858 HydrophobicContact CG1-CD1 3.71Å; I853-Y858 HydrophobicContact CG1-CD2 4.22Å; I853-Y858 HydrophobicContact CG1-CE1 4.48Å; I853-Y858 HydrophobicContact CG1-CG 3.54Å; Y858-R860 HydrophobicContact CE1-CG 4.42Å
859R77.7Confident79Confident222 Ų222112.3 Ų112.384%0.83854%0.544SS*.  trans-87.1118.3172.8-171.1175.9-178.7-175.10.1109.1K857 L861K857-R859 PolarHBondContact O-N 2.71Å; R859-L861 PolarHBondContact O-N 3.31Å; R859-L861 VanDerWaalsContact O-N 3.09Å
860R72.4Confident79Confident202 Ų202112.5 Ų112.576%0.76255%0.552SS**  trans-57.3117.6174.1-69.9-172.8-179.8-157.80.3109.7Y858 C862Y858-R860 HydrophobicContact CE1-CG 4.42Å; R860-C862 VanDerWaalsContact C-N 3.25Å; R860-C862 PolarHBondContact O-N 3.21Å
861L70.3Confident78.8Confident134 Ų134107.2 Ų107.270%0.70253%0.534SS*.SBendtrans-62.9-32.3176.7-76.9154.3000112.1R859R859-L861 PolarHBondContact O-N 3.31Å; R859-L861 VanDerWaalsContact O-N 3.09Å
862C72.8Confident78.7Confident30 Ų30105.1 Ų105.120%0.20352%0.522CS..  trans-116.7111178.3-66.70000110.5R860R860-C862 VanDerWaalsContact C-N 3.25Å; R860-C862 PolarHBondContact O-N 3.21Å
863P72.4Confident78.6Confident120 Ų120104.5 Ų104.578%0.77952%0.524SS*.SBendtrans-71.9-27.8-178.3-19.431.5000114.4
864S76.6Confident78.9Confident59 Ų59108.9 Ų108.941%0.41354%0.536SS..SBendtrans-128.6156.4-177.968.90000111.4T866 S867 S868S864-T866 PolarHBondContact O-N 3.47Å; S864-S867 WeakPolarHBondContact O-CB 3.49Å; S864-S867 PolarHBondContact O-N 2.91Å; S864-S867 VanDerWaalsContact O-N 3.1Å; S864-S867 WeakPolarHBondContact OG-CB 3.32Å; S864-S867 PolarHBondContact OG-N 2.91Å; S864-S867 VanDerWaalsContact OG-N 3.14Å; S864-S868 PolarHBondContact O-N 2.86Å
865A77.3Confident79.1Confident84 Ų84104.5 Ų104.569%0.69452%0.524SS*.Hα-helixtrans-56.2-40.1174.800000111.5S867 S868 E869A865-S867 PolarHBondContact O-N 3.41Å; A865-S868 WeakPolarHBondContact O-CB 3.03Å; A865-S868 PolarHBondContact O-N 3.46Å; A865-S868 VanDerWaalsContact O-N 3.15Å; A865-E869 PolarHBondContact O-N 3.23Å
866T80.6Confident79Confident101 Ų101100.8 Ų100.862%0.6251%0.508SS*.Hα-helixtrans-62.3-40.3175.7-8.10000112.5S864 S868 E869 N870S864-T866 PolarHBondContact O-N 3.47Å; T866-S868 VanDerWaalsContact C-N 3.32Å; T866-E869 PolarHBondContact O-N 3.36Å; T866-N870 VanDerWaalsContact O-CG 3.29Å; T866-N870 PolarHBondContact O-N 2.78Å
867S79.6Confident79.3Confident37 Ų3797.3 Ų97.326%0.25949%0.49SS..Hα-helixtrans-66.6-36.1175.1-170.70000111.8S864 A865 N870 E871S864-S867 WeakPolarHBondContact O-CB 3.49Å; S864-S867 PolarHBondContact O-N 2.91Å; S864-S867 VanDerWaalsContact O-N 3.1Å; S864-S867 WeakPolarHBondContact OG-CB 3.32Å; S864-S867 PolarHBondContact OG-N 2.91Å; S864-S867 VanDerWaalsContact OG-N 3.14Å; A865-S867 PolarHBondContact O-N 3.41Å; S867-N870 PolarHBondContact O-N 3.36Å; S867-E871 PolarHBondContact O-N 2.88Å
868S76.1Confident79.5Confident60 Ų6095.6 Ų95.642%0.4248%0.484SS..Hα-helixtrans-65.1-41.8175.2-169.10000111.6S864 A865 T866 R872S864-S868 PolarHBondContact O-N 2.86Å; A865-S868 WeakPolarHBondContact O-CB 3.03Å; A865-S868 PolarHBondContact O-N 3.46Å; A865-S868 VanDerWaalsContact O-N 3.15Å; T866-S868 VanDerWaalsContact C-N 3.32Å; S868-R872 WeakPolarHBondContact O-CB 3.35Å; S868-R872 PolarHBondContact O-N 3.49Å
869E79.3Confident79.9Confident87 Ų8792.7 Ų92.741%0.40748%0.476SS..Hα-helixtrans-65-40.6176.1-150.968.3-138.300111.4A865 T866 R872 T873A865-E869 PolarHBondContact O-N 3.23Å; T866-E869 PolarHBondContact O-N 3.36Å; E869-R872 PolarHBondContact O-N 3.17Å; E869-R872 IonicContact OE1-NH1 2.72Å; E869-T873 WeakPolarHBondContact O-CB 3.44Å; E869-T873 WeakPolarHBondContact O-CG2 3.49Å; E869-T873 PolarHBondContact O-N 3.25Å; E869-T873 PolarHBondContact O-OG1 3.03Å
870N82.9Confident80.4Confident106 Ų10688.2 Ų88.257%0.56746%0.459SS*.Hα-helixtrans-65.8-43.7177.1-72.9-11.9000112.5T866 S867 T873 R874T866-N870 VanDerWaalsContact O-CG 3.29Å; T866-N870 PolarHBondContact O-N 2.78Å; S867-N870 PolarHBondContact O-N 3.36Å; N870-T873 WeakPolarHBondContact CA-OG1 3.47Å; N870-T873 PolarHBondContact O-OG1 3.34Å; N870-R874 VanDerWaalsContact O-CB 3.31Å; N870-R874 WeakPolarHBondContact O-CB 3.48Å; N870-R874 PolarHBondContact O-N 3.42Å
871E79.7Confident81.2Confident64 Ų6481.7 Ų81.730%0.29944%0.444SS..Hα-helixtrans-68.8-37.2174.9-76.5-63.1159.300111.4S867 R874 H875S867-E871 PolarHBondContact O-N 2.88Å; E871-R874 WeakPolarHBondContact O-CB 3.47Å; E871-R874 PolarHBondContact O-N 2.98Å; E871-R874 IonicContact OE1-NH1 2.79Å; E871-R874 PolarHBondContact OE1-NH1 3.44Å; E871-R874 IonicContact OE2-NH1 3.55Å; E871-H875 PolarHBondContact O-CD2 3.42Å; E871-H875 PolarHBondContact O-N 3.34Å
872R80Confident82Confident53 Ų5378.2 Ų78.220%0.243%0.426CS..Hα-helixtrans-60.2-50.7174.1-175.2-177.4-174.6-1680.4111.7S868 E869 R874 H875 V876 E914S868-R872 WeakPolarHBondContact O-CB 3.35Å; S868-R872 PolarHBondContact O-N 3.49Å; E869-R872 PolarHBondContact O-N 3.17Å; E869-R872 IonicContact OE1-NH1 2.72Å; R872-R874 VanDerWaalsContact C-N 3.29Å; R872-R874 PolarHBondContact O-N 2.87Å; R872-H875 PolarHBondContact O-N 2.8Å; R872-V876 WeakPolarHBondContact O-CG2 3.39Å; R872-V876 PolarHBondContact O-N 2.9Å; R872-E914 IonicContact CZ-OE2 3.58Å; R872-E914 IonicContact NE-OE2 3.74Å; R872-E914 PolarHBondContact NE-OE2 3.3Å; R872-E914 IonicContact NH2-OE2 2.71Å; R872-E914 PolarHBondContact NH2-OE2 3.23Å
873T83.6Confident82.9Confident65 Ų6577.8 Ų77.840%0.39942%0.421SS..Hα-helixtrans-61.1-38.9176.550.60000111.5E869 N870 V876 N877E869-T873 WeakPolarHBondContact O-CB 3.44Å; E869-T873 WeakPolarHBondContact O-CG2 3.49Å; E869-T873 PolarHBondContact O-N 3.25Å; E869-T873 PolarHBondContact O-OG1 3.03Å; N870-T873 WeakPolarHBondContact CA-OG1 3.47Å; N870-T873 PolarHBondContact O-OG1 3.34Å; T873-V876 PolarHBondContact O-N 3.33Å; T873-N877 VanDerWaalsContact O-CB 3.3Å; T873-N877 WeakPolarHBondContact O-CB 3.46Å; T873-N877 PolarHBondContact O-N 2.72Å; T873-N877 PolarHBondContact O-ND2 3.48Å
874R84.8Confident83.6Confident163 Ų16374.9 Ų74.962%0.61541%0.407SS*.Hα-helixtrans-60.2-46.2172.8-172.3-174.1178.7-171.20.2112.2N870 E871 R872 N877 H878N870-R874 VanDerWaalsContact O-CB 3.31Å; N870-R874 WeakPolarHBondContact O-CB 3.48Å; N870-R874 PolarHBondContact O-N 3.42Å; E871-R874 WeakPolarHBondContact O-CB 3.47Å; E871-R874 PolarHBondContact O-N 2.98Å; E871-R874 IonicContact OE1-NH1 2.79Å; E871-R874 PolarHBondContact OE1-NH1 3.44Å; E871-R874 IonicContact OE2-NH1 3.55Å; R872-R874 VanDerWaalsContact C-N 3.29Å; R872-R874 PolarHBondContact O-N 2.87Å; R874-N877 PolarHBondContact O-N 3.41Å; R874-H878 VanDerWaalsContact O-CB 3.28Å; R874-H878 WeakPolarHBondContact O-CB 3.25Å; R874-H878 PolarHBondContact O-N 3.31Å
875H83.1Confident84.1Confident117 Ų11776.3 Ų76.354%0.54241%0.409SS..Hα-helixtrans-67-38.7177.7-76.4-61.8000113.2E871 R872 H878 S879E871-H875 PolarHBondContact O-CD2 3.42Å; E871-H875 PolarHBondContact O-N 3.34Å; R872-H875 PolarHBondContact O-N 2.8Å; H875-H878 PolarHBondContact O-N 3.16Å; H875-S879 WeakPolarHBondContact O-CB 3.23Å; H875-S879 PolarHBondContact O-N 3.07Å; H875-S879 PolarHBondContact O-OG 3.48Å
876V86.9Confident84.6Confident25 Ų2572.9 Ų72.915%0.15238%0.379CS..Hα-helixtrans-64.1-46.8174.3168.40000110.6R872 T873 H878 S879 R880 L911 E914R872-V876 WeakPolarHBondContact O-CG2 3.39Å; R872-V876 PolarHBondContact O-N 2.9Å; T873-V876 PolarHBondContact O-N 3.33Å; V876-H878 PolarHBondContact O-N 2.82Å; V876-S879 PolarHBondContact O-N 3.38Å; V876-R880 WeakPolarHBondContact O-CG 3.27Å; V876-R880 PolarHBondContact O-N 2.95Å; V876-L911 HydrophobicContact CG1-CD2 3.86Å; V876-E914 HydrophobicContact CG2-CB 4.39Å; V876-E914 HydrophobicContact CG2-CG 4.36Å
877N86.3Confident85.1Confident86 Ų8671 Ų7146%0.4637%0.366SS..Hα-helixtrans-62.4-43.6176.6-72.3-21.2000111.3T873 R874 S879 R880 S881T873-N877 VanDerWaalsContact O-CB 3.3Å; T873-N877 WeakPolarHBondContact O-CB 3.46Å; T873-N877 PolarHBondContact O-N 2.72Å; T873-N877 PolarHBondContact O-ND2 3.48Å; R874-N877 PolarHBondContact O-N 3.41Å; N877-S879 VanDerWaalsContact C-N 3.33Å; N877-S879 PolarHBondContact O-N 3.49Å; N877-R880 PolarHBondContact O-N 2.92Å; N877-S881 PolarHBondContact O-N 3.42Å; N877-S881 PolarHBondContact O-OG 2.77Å; N877-S881 VanDerWaalsContact O-OG 3.08Å
878H87.6Confident85.5Confident110 Ų11074.6 Ų74.651%0.50938%0.378SS..Hα-helixtrans-61-42.3175.8-169.865.2000111.9R874 H875 V876 R880 S881 L882R874-H878 VanDerWaalsContact O-CB 3.28Å; R874-H878 WeakPolarHBondContact O-CB 3.25Å; R874-H878 PolarHBondContact O-N 3.31Å; H875-H878 PolarHBondContact O-N 3.16Å; V876-H878 PolarHBondContact O-N 2.82Å; H878-R880 PolarHBondContact O-N 3.45Å; H878-S881 PolarHBondContact O-N 3.31Å; H878-L882 WeakPolarHBondContact O-CG 3.47Å; H878-L882 PolarHBondContact O-N 3.13Å
879S87Confident85.9Confident22 Ų2274.7 Ų74.715%0.15437%0.374CS..Hα-helixtrans-63.3-40.5176.2-56.80000112H875 V876 N877 L882 I883H875-S879 WeakPolarHBondContact O-CB 3.23Å; H875-S879 PolarHBondContact O-N 3.07Å; H875-S879 PolarHBondContact O-OG 3.48Å; V876-S879 PolarHBondContact O-N 3.38Å; N877-S879 VanDerWaalsContact C-N 3.33Å; N877-S879 PolarHBondContact O-N 3.49Å; S879-L882 PolarHBondContact O-N 2.89Å; S879-I883 WeakPolarHBondContact O-CG1 3.36Å; S879-I883 PolarHBondContact O-N 3.33Å
880R88.9Confident86.3Confident128 Ų12871.7 Ų71.748%0.48336%0.361SS..Hα-helixtrans-64.7-42173.8-70.9176.3-177.4166.20.2112V876 N877 H878 L882 I883 A884 L911V876-R880 WeakPolarHBondContact O-CG 3.27Å; V876-R880 PolarHBondContact O-N 2.95Å; N877-R880 PolarHBondContact O-N 2.92Å; H878-R880 PolarHBondContact O-N 3.45Å; R880-L882 VanDerWaalsContact C-N 3.34Å; R880-I883 PolarHBondContact O-N 3.45Å; R880-A884 PolarHBondContact O-N 2.9Å; R880-L911 HydrophobicContact CG-CD1 4.15Å; R880-L911 HydrophobicContact CG-CD2 3.85Å
881S89Confident86.5Confident65 Ų6571.9 Ų71.946%0.45537%0.367SS..Hα-helixtrans-62.4-41.2174.9-61.20000111.8N877 H878 A884 I885N877-S881 PolarHBondContact O-N 3.42Å; N877-S881 PolarHBondContact O-OG 2.77Å; N877-S881 VanDerWaalsContact O-OG 3.08Å; H878-S881 PolarHBondContact O-N 3.31Å; S881-A884 PolarHBondContact O-N 3.44Å; S881-I885 VanDerWaalsContact O-CG1 3.27Å; S881-I885 WeakPolarHBondContact O-CG1 3.32Å; S881-I885 PolarHBondContact O-N 3.42Å
882L88.7Confident87Confident60 Ų6074.2 Ų74.231%0.31438%0.377SS..Hα-helixtrans-64.3-41.3175.7-72.7174.1000112.1H878 S879 R880 A884 I885 I886 L907H878-L882 WeakPolarHBondContact O-CG 3.47Å; H878-L882 PolarHBondContact O-N 3.13Å; S879-L882 PolarHBondContact O-N 2.89Å; R880-L882 VanDerWaalsContact C-N 3.34Å; L882-A884 VanDerWaalsContact C-N 3.35Å; L882-I885 PolarHBondContact O-N 3.26Å; L882-I886 VanDerWaalsContact O-CG1 3.31Å; L882-I886 WeakPolarHBondContact O-CG1 3.33Å; L882-I886 PolarHBondContact O-N 3.39Å; L882-L907 HydrophobicContact CB-CD1 3.83Å; L882-L907 HydrophobicContact CD1-CD2 4.3Å
883I89.9Confident87.2Confident22 Ų2276.7 Ų76.711%0.11339%0.39CS..Hα-helixtrans-61.9-43.7173.1-69.4178.2000110.8S879 R880 I885 I886 D887 L907 E908 L911S879-I883 WeakPolarHBondContact O-CG1 3.36Å; S879-I883 PolarHBondContact O-N 3.33Å; R880-I883 PolarHBondContact O-N 3.45Å; I883-I885 VanDerWaalsContact C-N 3.31Å; I883-I885 PolarHBondContact O-N 2.91Å; I883-I886 WeakPolarHBondContact O-CB 3.46Å; I883-I886 PolarHBondContact O-N 2.78Å; I883-I886 VanDerWaalsContact O-N 3.15Å; I883-D887 PolarHBondContact O-N 3.39Å; I883-L907 HydrophobicContact CD1-CB 3.87Å; I883-L907 HydrophobicContact CG1-CB 3.75Å; I883-L907 HydrophobicContact CG1-CD1 4.04Å; I883-E908 HydrophobicContact CD1-CG 3.91Å; I883-L911 HydrophobicContact CD1-CD1 3.35Å; I883-L911 HydrophobicContact CG1-CD1 4.48Å
884A88.5Confident87.2Confident58 Ų5877.7 Ų77.748%0.47940%0.397SS..Hα-helixtrans-61.8-38.717700000112.4R880 S881 L882 D887 Q888R880-A884 PolarHBondContact O-N 2.9Å; S881-A884 PolarHBondContact O-N 3.44Å; L882-A884 VanDerWaalsContact C-N 3.35Å; A884-D887 PolarHBondContact O-N 3.43Å; A884-Q888 WeakPolarHBondContact O-CB 3.26Å; A884-Q888 PolarHBondContact O-N 2.98Å
885I87.1Confident87Confident89 Ų8978.6 Ų78.646%0.45641%0.408SS..Hα-helixtrans-64.8-43.3173.5-68163.4000110.6S881 L882 I883 Q888 L889S881-I885 VanDerWaalsContact O-CG1 3.27Å; S881-I885 WeakPolarHBondContact O-CG1 3.32Å; S881-I885 PolarHBondContact O-N 3.42Å; L882-I885 PolarHBondContact O-N 3.26Å; I883-I885 VanDerWaalsContact C-N 3.31Å; I883-I885 PolarHBondContact O-N 2.91Å; I885-Q888 PolarHBondContact O-N 2.82Å; I885-L889 HydrophobicContact CG2-CD1 3.94Å; I885-L889 HydrophobicContact CG2-CG 4.36Å; I885-L889 WeakPolarHBondContact O-CB 3.33Å; I885-L889 VanDerWaalsContact O-CG 3.32Å; I885-L889 WeakPolarHBondContact O-CG 3.41Å; I885-L889 PolarHBondContact O-N 3.47Å
886I88.1Confident86.9Confident12 Ų1276 Ų766%0.06240%0.398CS..Hα-helixtrans-60.9-48.1175.6-70.6166.9000110.2L882 I883 Q888 L889 V890 L900 V903 R904 L907L882-I886 VanDerWaalsContact O-CG1 3.31Å; L882-I886 WeakPolarHBondContact O-CG1 3.33Å; L882-I886 PolarHBondContact O-N 3.39Å; I883-I886 WeakPolarHBondContact O-CB 3.46Å; I883-I886 PolarHBondContact O-N 2.78Å; I883-I886 VanDerWaalsContact O-N 3.15Å; I886-Q888 VanDerWaalsContact C-N 3.29Å; I886-Q888 PolarHBondContact O-N 2.72Å; I886-L889 PolarHBondContact O-N 3.12Å; I886-V890 HydrophobicContact CG2-CG2 4.25Å; I886-V890 WeakPolarHBondContact O-CB 3.49Å; I886-V890 VanDerWaalsContact O-CG2 3.27Å; I886-V890 WeakPolarHBondContact O-CG2 3.44Å; I886-V890 PolarHBondContact O-N 3.26Å; I886-L900 HydrophobicContact CG2-CB 4.08Å; I886-L900 HydrophobicContact CG2-CD1 4.33Å; I886-V903 HydrophobicContact CD1-CB 4.41Å; I886-V903 HydrophobicContact CD1-CG1 3.95Å; I886-R904 HydrophobicContact CG2-CB 4.29Å; I886-R904 HydrophobicContact CG2-CG 4.34Å; I886-L907 HydrophobicContact CD1-CD1 3.72Å
887D89.8Confident86.6Confident63 Ų6380.2 Ų80.234%0.33742%0.416SS..Hα-helixtrans-61.8-39.8179.8-70.5-21.1000110.9I883 A884 V890 T891 R904I883-D887 PolarHBondContact O-N 3.39Å; A884-D887 PolarHBondContact O-N 3.43Å; D887-V890 PolarHBondContact O-N 3.28Å; D887-T891 PolarHBondContact O-N 3.41Å; D887-T891 PolarHBondContact O-OG1 3.43Å; D887-R904 IonicContact OD1-CZ 3.98Å; D887-R904 IonicContact OD1-NE 2.78Å; D887-R904 PolarHBondContact OD1-NE 3.02Å; D887-R904 IonicContact OD1-NH2 3.69Å; D887-R904 PolarHBondContact OD1-NH2 2.9Å
888Q88.2Confident86.2Confident112 Ų11282.1 Ų82.152%0.52342%0.422SS..Hα-helixtrans-64-45.1173.6-171175.2-800112.1A884 I885 I886 V890 T891 E892A884-Q888 WeakPolarHBondContact O-CB 3.26Å; A884-Q888 PolarHBondContact O-N 2.98Å; I885-Q888 PolarHBondContact O-N 2.82Å; I886-Q888 VanDerWaalsContact C-N 3.29Å; I886-Q888 PolarHBondContact O-N 2.72Å; Q888-V890 VanDerWaalsContact C-N 3.32Å; Q888-V890 PolarHBondContact O-N 2.95Å; Q888-T891 WeakPolarHBondContact CA-OG1 3.33Å; Q888-T891 PolarHBondContact O-N 3.28Å; Q888-T891 VanDerWaalsContact O-N 3.14Å; Q888-T891 PolarHBondContact O-OG1 3.45Å; Q888-E892 WeakPolarHBondContact CG-OE1 3.37Å; Q888-E892 PolarHBondContact NE2-OE1 2.86Å; Q888-E892 WeakPolarHBondContact O-CG 3.23Å; Q888-E892 PolarHBondContact O-N 2.86Å
889L84.8Confident85.8Confident61 Ų6181.9 Ų81.932%0.31943%0.425SS..Hα-helixtrans-63.3-37.1175.6-76171.3000112.2I885 I886 T891 E892 F893 L900I885-L889 HydrophobicContact CG2-CD1 3.94Å; I885-L889 HydrophobicContact CG2-CG 4.36Å; I885-L889 WeakPolarHBondContact O-CB 3.33Å; I885-L889 VanDerWaalsContact O-CG 3.32Å; I885-L889 WeakPolarHBondContact O-CG 3.41Å; I885-L889 PolarHBondContact O-N 3.47Å; I886-L889 PolarHBondContact O-N 3.12Å; L889-T891 VanDerWaalsContact C-N 3.32Å; L889-E892 PolarHBondContact O-N 3.33Å; L889-F893 HydrophobicContact CD2-CD2 4.32Å; L889-F893 CarbonylContact O-C 3.59Å; L889-F893 WeakPolarHBondContact O-CA 3.46Å; L889-F893 WeakPolarHBondContact O-CB 3.48Å; L889-F893 PolarHBondContact O-N 3.12Å; L889-L900 HydrophobicContact CB-CD1 4.15Å; L889-L900 HydrophobicContact CD1-CD1 4.44Å
890V88.1Confident85.5Confident25 Ų2582.5 Ų82.515%0.15243%0.426CS..Hα-helixtrans-67.8-33.6174.4168.50000111.3I886 D887 Q888 F893 P894 Q897 L900I886-V890 HydrophobicContact CG2-CG2 4.25Å; I886-V890 WeakPolarHBondContact O-CB 3.49Å; I886-V890 VanDerWaalsContact O-CG2 3.27Å; I886-V890 WeakPolarHBondContact O-CG2 3.44Å; I886-V890 PolarHBondContact O-N 3.26Å; D887-V890 PolarHBondContact O-N 3.28Å; Q888-V890 VanDerWaalsContact C-N 3.32Å; Q888-V890 PolarHBondContact O-N 2.95Å; V890-F893 CarbonylContact O-C 3.57Å; V890-P894 WeakPolarHBondContact O-CA 3.49Å; V890-Q897 HydrophobicContact CG1-CB 3.88Å; V890-Q897 HydrophobicContact CG1-CG 3.63Å; V890-Q897 HydrophobicContact CG2-CB 4.09Å; V890-Q897 HydrophobicContact CG2-CG 4.07Å; V890-L900 HydrophobicContact CG2-CD1 4.37Å
891T86.7Confident85.3Confident110 Ų11081.6 Ų81.668%0.67543%0.427SS*.Hα-helixtrans-72.8-41.5174.91.10000112.2D887 Q888 L889D887-T891 PolarHBondContact O-N 3.41Å; D887-T891 PolarHBondContact O-OG1 3.43Å; Q888-T891 WeakPolarHBondContact CA-OG1 3.33Å; Q888-T891 PolarHBondContact O-N 3.28Å; Q888-T891 VanDerWaalsContact O-N 3.14Å; Q888-T891 PolarHBondContact O-OG1 3.45Å; L889-T891 VanDerWaalsContact C-N 3.32Å
892E89.4Confident85Confident112 Ų11278.5 Ų78.552%0.52341%0.406SS..Hα-helixtrans-73.5-34.6178.4-70.4177-16700111.9Q888 L889Q888-E892 WeakPolarHBondContact CG-OE1 3.37Å; Q888-E892 PolarHBondContact NE2-OE1 2.86Å; Q888-E892 WeakPolarHBondContact O-CG 3.23Å; Q888-E892 PolarHBondContact O-N 2.86Å; L889-E892 PolarHBondContact O-N 3.33Å
893F84Confident84.7Confident105 Ų10577.9 Ų77.946%0.46140%0.404SS..  trans-136.581.6-176.3-53.8-80.1000111.6L889 V890 Q895 I896L889-F893 HydrophobicContact CD2-CD2 4.32Å; L889-F893 CarbonylContact O-C 3.59Å; L889-F893 WeakPolarHBondContact O-CA 3.46Å; L889-F893 WeakPolarHBondContact O-CB 3.48Å; L889-F893 PolarHBondContact O-N 3.12Å; V890-F893 CarbonylContact O-C 3.57Å; F893-Q895 PolarHBondContact O-N 3.37Å; F893-I896 HydrophobicContact CB-CB 4.48Å; F893-I896 HydrophobicContact CB-CD1 3.52Å; F893-I896 HydrophobicContact CB-CG1 3.79Å; F893-I896 HydrophobicContact CD2-CD1 4.41Å; F893-I896 HydrophobicContact CG-CD1 3.96Å; F893-I896 PolarHBondContact O-N 2.87Å
894P83.6Confident84.4Confident86 Ų8681.1 Ų81.156%0.55842%0.415SS*.G310 helixtrans-59.3-24.4-177.9-22.731.8000113.8V890 I896 Q897V890-P894 WeakPolarHBondContact O-CA 3.49Å; P894-I896 VanDerWaalsContact C-N 3.26Å; P894-I896 PolarHBondContact O-N 2.84Å; P894-Q897 VanDerWaalsContact O-CB 3.25Å; P894-Q897 WeakPolarHBondContact O-CB 3.31Å; P894-Q897 PolarHBondContact O-N 2.69Å
895Q81.5Confident84.2Confident182 Ų18283.5 Ų83.585%0.8541%0.413SS*.G310 helixtrans-65.5-28.7179-62.3173.94.600112.5F893 Q897F893-Q895 PolarHBondContact O-N 3.37Å; Q895-Q897 VanDerWaalsContact C-N 3.3Å
896I81Confident84Confident64 Ų6480.5 Ų80.533%0.32840%0.397SS..G310 helixtrans-88.3-4.1-176.6-43.7176.9000110.9F893 P894 Q898 D899 L900F893-I896 HydrophobicContact CB-CB 4.48Å; F893-I896 HydrophobicContact CB-CD1 3.52Å; F893-I896 HydrophobicContact CB-CG1 3.79Å; F893-I896 HydrophobicContact CD2-CD1 4.41Å; F893-I896 HydrophobicContact CG-CD1 3.96Å; F893-I896 PolarHBondContact O-N 2.87Å; P894-I896 VanDerWaalsContact C-N 3.26Å; P894-I896 PolarHBondContact O-N 2.84Å; I896-Q898 PolarHBondContact O-N 3.32Å; I896-D899 HydrophobicContact CG2-CB 4.25Å; I896-D899 PolarHBondContact O-N 3.45Å; I896-D899 VanDerWaalsContact O-N 3.16Å; I896-L900 HydrophobicContact CB-CD1 4.49Å; I896-L900 HydrophobicContact CG2-CD1 3.94Å; I896-L900 HydrophobicContact CG2-CG 4.01Å; I896-L900 PolarHBondContact O-N 3.11Å; I896-L900 VanDerWaalsContact O-N 3.14Å
897Q81Confident83.8Confident112 Ų11281 Ų8152%0.52340%0.4SS..Hα-helixtrans-56-36.2179.7-173.1175.6-0.900112.9V890 P894 Q895 E901V890-Q897 HydrophobicContact CG1-CB 3.88Å; V890-Q897 HydrophobicContact CG1-CG 3.63Å; V890-Q897 HydrophobicContact CG2-CB 4.09Å; V890-Q897 HydrophobicContact CG2-CG 4.07Å; P894-Q897 VanDerWaalsContact O-CB 3.25Å; P894-Q897 WeakPolarHBondContact O-CB 3.31Å; P894-Q897 PolarHBondContact O-N 2.69Å; Q895-Q897 VanDerWaalsContact C-N 3.3Å; Q897-E901 PolarHBondContact O-N 3.48Å
898Q76.6Confident83.5Confident127 Ų12780.6 Ų80.659%0.59340%0.396SS*.Hα-helixtrans-69.2-45179-68.3-178.7-3.700111.5I896 L900 E901I896-Q898 PolarHBondContact O-N 3.32Å; Q898-L900 VanDerWaalsContact C-N 3.28Å; Q898-L900 PolarHBondContact O-N 3.29Å; Q898-E901 PolarHBondContact O-N 2.69Å
899D79.4Confident83.3Confident105 Ų10577.7 Ų77.756%0.56138%0.384SS*.Hα-helixtrans-68.4-26-178.7-63.2-25.5000113.3I896I896-D899 HydrophobicContact CG2-CB 4.25Å; I896-D899 PolarHBondContact O-N 3.45Å; I896-D899 VanDerWaalsContact O-N 3.16Å
900L82.2Confident83Confident34 Ų3480.7 Ų80.718%0.17839%0.394CS..Hα-helixtrans-91.5-11.8-179.3-68.4171.3000113.8I886 L889 V890 I896 Q898 V903 R904I886-L900 HydrophobicContact CG2-CB 4.08Å; I886-L900 HydrophobicContact CG2-CD1 4.33Å; L889-L900 HydrophobicContact CB-CD1 4.15Å; L889-L900 HydrophobicContact CD1-CD1 4.44Å; V890-L900 HydrophobicContact CG2-CD1 4.37Å; I896-L900 HydrophobicContact CB-CD1 4.49Å; I896-L900 HydrophobicContact CG2-CD1 3.94Å; I896-L900 HydrophobicContact CG2-CG 4.01Å; I896-L900 PolarHBondContact O-N 3.11Å; I896-L900 VanDerWaalsContact O-N 3.14Å; Q898-L900 VanDerWaalsContact C-N 3.28Å; Q898-L900 PolarHBondContact O-N 3.29Å; L900-V903 PolarHBondContact O-N 2.83Å; L900-R904 WeakPolarHBondContact O-CB 3.38Å; L900-R904 PolarHBondContact O-N 3.49Å
901E83.1Confident82.8Confident109 Ų10980.4 Ų80.451%0.50939%0.392SS..Hα-helixtrans-57.8-43.8-178.8-156.6-160.3-174.100113.3Q897 Q898 V903 R904 Y905Q897-E901 PolarHBondContact O-N 3.48Å; Q898-E901 PolarHBondContact O-N 2.69Å; E901-V903 VanDerWaalsContact C-N 3.29Å; E901-V903 PolarHBondContact O-N 3.38Å; E901-R904 PolarHBondContact O-N 2.85Å; E901-Y905 WeakPolarHBondContact O-CB 3.47Å; E901-Y905 PolarHBondContact O-N 3.13Å
902P82.6Confident82.4Confident1 Ų180.5 Ų80.51%0.00638%0.383CS..Hα-helixtrans-59.2-39.8178.1-25.835.7000112.8D831 Q834 I835 L906D831-P902 HydrophobicContact CB-CG 4.02Å; Q834-P902 HydrophobicContact CB-CB 4.26Å; Q834-P902 HydrophobicContact CB-CG 4.44Å; Q834-P902 HydrophobicContact CG-CB 4.17Å; I835-P902 HydrophobicContact CG1-CB 4.03Å; P902-L906 WeakPolarHBondContact O-CG 3.46Å; P902-L906 PolarHBondContact O-N 3.42Å; P902-L906 VanDerWaalsContact O-N 3.14Å
903V82.8Confident81.8Confident46 Ų4677.9 Ų77.928%0.27938%0.377SS..Hα-helixtrans-71.7-42.6179.8-176.70000110.3F838 I886 L900 E901 L906 L907F838-V903 HydrophobicContact CE2-CG2 4.33Å; I886-V903 HydrophobicContact CD1-CB 4.41Å; I886-V903 HydrophobicContact CD1-CG1 3.95Å; L900-V903 PolarHBondContact O-N 2.83Å; E901-V903 VanDerWaalsContact C-N 3.29Å; E901-V903 PolarHBondContact O-N 3.38Å; V903-L906 PolarHBondContact O-N 2.95Å; V903-L907 HydrophobicContact CG1-CD1 4.08Å; V903-L907 WeakPolarHBondContact O-CG 3.44Å; V903-L907 PolarHBondContact O-N 2.81Å
904R83.4Confident81.2Confident90 Ų9075 Ų7534%0.3437%0.365SS..Hα-helixtrans-59.5-47.3175.7-166.7171-177.7-94.3-11.2110.9I886 D887 L900 E901 L906 L907 E908I886-R904 HydrophobicContact CG2-CB 4.29Å; I886-R904 HydrophobicContact CG2-CG 4.34Å; D887-R904 IonicContact OD1-CZ 3.98Å; D887-R904 IonicContact OD1-NE 2.78Å; D887-R904 PolarHBondContact OD1-NE 3.02Å; D887-R904 IonicContact OD1-NH2 3.69Å; D887-R904 PolarHBondContact OD1-NH2 2.9Å; L900-R904 WeakPolarHBondContact O-CB 3.38Å; L900-R904 PolarHBondContact O-N 3.49Å; E901-R904 PolarHBondContact O-N 2.85Å; R904-L906 PolarHBondContact O-N 3.25Å; R904-L907 PolarHBondContact O-N 3.47Å; R904-E908 IonicContact CZ-OE1 3.89Å; R904-E908 IonicContact NH1-OE1 3.68Å; R904-E908 IonicContact NH2-OE1 2.85Å; R904-E908 WeakPolarHBondContact O-CB 3.36Å; R904-E908 WeakPolarHBondContact O-CG 3.49Å; R904-E908 PolarHBondContact O-N 3.31Å
905Y84.8Confident80.7Confident109 Ų10974.1 Ų74.143%0.42736%0.356SS..Hα-helixtrans-57.9-46177-178.8-98.5000112.5I835 E901 E908 N909I835-Y905 HydrophobicContact CD1-CD1 3.57Å; I835-Y905 HydrophobicContact CD1-CE1 4.08Å; I835-Y905 HydrophobicContact CD1-CG 4.16Å; I835-Y905 HydrophobicContact CG1-CD1 4.15Å; I835-Y905 HydrophobicContact CG2-CD1 4.3Å; I835-Y905 HydrophobicContact CG2-CE1 4.3Å; E901-Y905 WeakPolarHBondContact O-CB 3.47Å; E901-Y905 PolarHBondContact O-N 3.13Å; Y905-E908 PolarHBondContact O-N 3.33Å; Y905-N909 WeakPolarHBondContact CE1-ND2 3.42Å; Y905-N909 WeakPolarHBondContact O-CB 3.43Å; Y905-N909 PolarHBondContact O-N 3.01Å; Y905-N909 PolarHBondContact OH-ND2 3.43Å
906L82.2Confident80.1Confident26 Ų2670.1 Ų70.114%0.13634%0.34CS..Hα-helixtrans-65.2-40.8178.6-77.3166.5000113.1I835 F838 E839 P902 V903 R904 K910I835-L906 HydrophobicContact CG2-CD2 4.08Å; I835-L906 HydrophobicContact CG2-CG 4.46Å; F838-L906 HydrophobicContact CB-CD1 3.43Å; F838-L906 VanDerWaalsContact CB-CD1 3.43Å; F838-L906 HydrophobicContact CD2-CD1 3.33Å; F838-L906 HydrophobicContact CE2-CD1 4.26Å; F838-L906 HydrophobicContact CG-CD1 3.65Å; E839-L906 HydrophobicContact CG-CD2 4.22Å; P902-L906 WeakPolarHBondContact O-CG 3.46Å; P902-L906 PolarHBondContact O-N 3.42Å; P902-L906 VanDerWaalsContact O-N 3.14Å; V903-L906 PolarHBondContact O-N 2.95Å; R904-L906 PolarHBondContact O-N 3.25Å; L906-K910 WeakPolarHBondContact O-CB 3.44Å; L906-K910 WeakPolarHBondContact O-CG 3.46Å; L906-K910 PolarHBondContact O-N 3.32Å
907L83.6Confident79.2Confident21 Ų2174 Ų7411%0.1135%0.351CS..Hα-helixtrans-67.4-42.9177.3-70.7170.4000111.3L882 I883 I886 V903 R904 K910 L911L882-L907 HydrophobicContact CB-CD1 3.83Å; L882-L907 HydrophobicContact CD1-CD2 4.3Å; I883-L907 HydrophobicContact CD1-CB 3.87Å; I883-L907 HydrophobicContact CG1-CB 3.75Å; I883-L907 HydrophobicContact CG1-CD1 4.04Å; I886-L907 HydrophobicContact CD1-CD1 3.72Å; V903-L907 HydrophobicContact CG1-CD1 4.08Å; V903-L907 WeakPolarHBondContact O-CG 3.44Å; V903-L907 PolarHBondContact O-N 2.81Å; R904-L907 PolarHBondContact O-N 3.47Å; L907-K910 PolarHBondContact O-N 3.11Å; L907-L911 WeakPolarHBondContact O-CB 3.35Å; L907-L911 PolarHBondContact O-N 3.04Å
908E85.3Confident78.1Confident55 Ų5572.7 Ų72.726%0.25735%0.347SS..Hα-helixtrans-63.2-43.8175.6-77.4-172.3-171.500112I883 R904 Y905 K910 L911 K912I883-E908 HydrophobicContact CD1-CG 3.91Å; R904-E908 IonicContact CZ-OE1 3.89Å; R904-E908 IonicContact NH1-OE1 3.68Å; R904-E908 IonicContact NH2-OE1 2.85Å; R904-E908 WeakPolarHBondContact O-CB 3.36Å; R904-E908 WeakPolarHBondContact O-CG 3.49Å; R904-E908 PolarHBondContact O-N 3.31Å; Y905-E908 PolarHBondContact O-N 3.33Å; E908-K910 PolarHBondContact O-N 3.44Å; E908-L911 PolarHBondContact O-N 3.39Å; E908-K912 WeakPolarHBondContact O-CB 3.22Å; E908-K912 WeakPolarHBondContact O-CG 3.28Å; E908-K912 PolarHBondContact O-N 3.28Å
909N82.7Confident77Confident51 Ų5173.2 Ų73.227%0.27335%0.349SS..Hα-helixtrans-63.5-40.7176.9-85.4-4.1000112.1Y905 K912 S913Y905-N909 WeakPolarHBondContact CE1-ND2 3.42Å; Y905-N909 WeakPolarHBondContact O-CB 3.43Å; Y905-N909 PolarHBondContact O-N 3.01Å; Y905-N909 PolarHBondContact OH-ND2 3.43Å; N909-K912 PolarHBondContact O-N 3.43Å; N909-S913 WeakPolarHBondContact O-CB 3.27Å; N909-S913 PolarHBondContact O-N 2.82Å; N909-S913 PolarHBondContact O-OG 3.09Å
910K79.6Confident75.9Confident124 Ų12471.8 Ų71.854%0.53934%0.344SS..Hα-helixtrans-60.9-46.5172.9-77.9-178179.71780111.2L906 L907 E908 K912 S913 E914L906-K910 WeakPolarHBondContact O-CB 3.44Å; L906-K910 WeakPolarHBondContact O-CG 3.46Å; L906-K910 PolarHBondContact O-N 3.32Å; L907-K910 PolarHBondContact O-N 3.11Å; E908-K910 PolarHBondContact O-N 3.44Å; K910-K912 PolarHBondContact O-N 2.9Å; K910-S913 PolarHBondContact O-N 3.18Å; K910-S913 PolarHBondContact O-OG 3.38Å; K910-E914 WeakPolarHBondContact O-CG 3.38Å; K910-E914 PolarHBondContact O-N 3.48Å
911L82.7Confident74.4Confident19 Ų1974 Ų7410%0.09936%0.356CS..Hα-helixtrans-63.1-40.7177-81.6159.5000113.2V876 R880 I883 L907 E908 E914 N915V876-L911 HydrophobicContact CG1-CD2 3.86Å; R880-L911 HydrophobicContact CG-CD1 4.15Å; R880-L911 HydrophobicContact CG-CD2 3.85Å; I883-L911 HydrophobicContact CD1-CD1 3.35Å; I883-L911 HydrophobicContact CG1-CD1 4.48Å; L907-L911 WeakPolarHBondContact O-CB 3.35Å; L907-L911 PolarHBondContact O-N 3.04Å; E908-L911 PolarHBondContact O-N 3.39Å; L911-E914 PolarHBondContact O-N 3.46Å; L911-N915 WeakPolarHBondContact O-CB 3.4Å; L911-N915 PolarHBondContact O-N 2.95Å
912K79.1Confident72.9Confident113 Ų11373.1 Ų73.149%0.49136%0.358SS..Hα-helixtrans-62.6-45174.4-75.8173.5-177165.80111.5E908 N909 K910 E914 N915 N916E908-K912 WeakPolarHBondContact O-CB 3.22Å; E908-K912 WeakPolarHBondContact O-CG 3.28Å; E908-K912 PolarHBondContact O-N 3.28Å; N909-K912 PolarHBondContact O-N 3.43Å; K910-K912 PolarHBondContact O-N 2.9Å; K912-E914 VanDerWaalsContact C-N 3.27Å; K912-E914 PolarHBondContact O-N 3.19Å; K912-N915 PolarHBondContact O-N 3.29Å; K912-N916 PolarHBondContact O-N 3.2Å
913S76.3Confident71.4Confident57 Ų5777.1 Ų77.140%0.39938%0.383SS..Hα-helixtrans-63.3-34.3177.874.90000112.6N909 K910 R917N909-S913 WeakPolarHBondContact O-CB 3.27Å; N909-S913 PolarHBondContact O-N 2.82Å; N909-S913 PolarHBondContact O-OG 3.09Å; K910-S913 PolarHBondContact O-N 3.18Å; K910-S913 PolarHBondContact O-OG 3.38Å; S913-R917 WeakPolarHBondContact O-CG 3.49Å; S913-R917 PolarHBondContact O-N 3.34Å
914E72.3Confident69.8Low44 Ų4481.6 Ų81.621%0.20640%0.399CS..Hα-helixtrans-73.7-41.3176.2-75.4-63.6154.400112.4R872 V876 K910 L911 K912 R917 L918R872-E914 IonicContact CZ-OE2 3.58Å; R872-E914 IonicContact NE-OE2 3.74Å; R872-E914 PolarHBondContact NE-OE2 3.3Å; R872-E914 IonicContact NH2-OE2 2.71Å; R872-E914 PolarHBondContact NH2-OE2 3.23Å; V876-E914 HydrophobicContact CG2-CB 4.39Å; V876-E914 HydrophobicContact CG2-CG 4.36Å; K910-E914 WeakPolarHBondContact O-CG 3.38Å; K910-E914 PolarHBondContact O-N 3.48Å; L911-E914 PolarHBondContact O-N 3.46Å; K912-E914 VanDerWaalsContact C-N 3.27Å; K912-E914 PolarHBondContact O-N 3.19Å; E914-R917 PolarHBondContact O-N 2.85Å; E914-R917 IonicContact OE1-NH1 3.99Å; E914-L918 PolarHBondContact O-N 3.38Å
915N72.4Confident68.1Low68 Ų6881.2 Ų81.236%0.36441%0.406SS..Hα-helixtrans-63.2-43.1175-76.2-10.7000111.7L911 K912 R917 L918 E919L911-N915 WeakPolarHBondContact O-CB 3.4Å; L911-N915 PolarHBondContact O-N 2.95Å; K912-N915 PolarHBondContact O-N 3.29Å; N915-R917 VanDerWaalsContact C-N 3.26Å; N915-R917 PolarHBondContact O-N 3.38Å; N915-L918 WeakPolarHBondContact O-CB 3.45Å; N915-L918 PolarHBondContact O-N 3.34Å; N915-L918 VanDerWaalsContact O-N 3.15Å; N915-E919 PolarHBondContact O-N 2.87Å
916N69Low66.4Low98 Ų9883 Ų8352%0.52442%0.418SS..Hα-helixtrans-63.1-32177.3-73.3-0000112.4K912 E919 T920K912-N916 PolarHBondContact O-N 3.2Å; N916-E919 PolarHBondContact O-N 2.89Å; N916-T920 PolarHBondContact O-N 3.01Å; N916-T920 PolarHBondContact O-OG1 2.8Å
917R62.7Low64.8Low146 Ų14685.8 Ų85.855%0.55144%0.436SS*.Hα-helixtrans-67.7-37.1175.3-80.3178.1174.2173.6-2112.4S913 E914 N915 T920 D921S913-R917 WeakPolarHBondContact O-CG 3.49Å; S913-R917 PolarHBondContact O-N 3.34Å; E914-R917 PolarHBondContact O-N 2.85Å; E914-R917 IonicContact OE1-NH1 3.99Å; N915-R917 VanDerWaalsContact C-N 3.26Å; N915-R917 PolarHBondContact O-N 3.38Å; R917-T920 WeakPolarHBondContact CA-OG1 3.48Å; R917-T920 PolarHBondContact O-N 3.03Å; R917-T920 PolarHBondContact O-OG1 3.46Å; R917-D921 PolarHBondContact O-N 3.48Å; R917-D921 VanDerWaalsContact O-N 3.09Å
918L58Low63Low84 Ų8488.9 Ų88.944%0.4446%0.456SS..Hα-helixtrans-63.9-40.2175.7-72.9164.4000111.7E914 N915 T920 D921 V922E914-L918 PolarHBondContact O-N 3.38Å; N915-L918 WeakPolarHBondContact O-CB 3.45Å; N915-L918 PolarHBondContact O-N 3.34Å; N915-L918 VanDerWaalsContact O-N 3.15Å; L918-T920 VanDerWaalsContact C-N 3.32Å; L918-T920 PolarHBondContact O-N 3.28Å; L918-D921 PolarHBondContact O-N 3.31Å; L918-V922 WeakPolarHBondContact O-CG2 3.42Å; L918-V922 PolarHBondContact O-N 3.04Å; L918-V922 VanDerWaalsContact O-N 3.07Å
919E53.4Low61Low137 Ų13793.6 Ų93.664%0.6448%0.478SS*.Hα-helixtrans-63.9-35.8175.5-70.8-177.4173.200112.6N915 N916 T923N915-E919 PolarHBondContact O-N 2.87Å; N916-E919 PolarHBondContact O-N 2.89Å; E919-T923 PolarHBondContact O-N 2.73Å; E919-T923 PolarHBondContact O-OG1 3.06Å
920T55.2Low59.4Low75 Ų7595.2 Ų95.246%0.4649%0.494SS..Hα-helixtrans-73.3-26.6175.855.50000114.2N916 R917 L918 T923 K924N916-T920 PolarHBondContact O-N 3.01Å; N916-T920 PolarHBondContact O-OG1 2.8Å; R917-T920 WeakPolarHBondContact CA-OG1 3.48Å; R917-T920 PolarHBondContact O-N 3.03Å; R917-T920 PolarHBondContact O-OG1 3.46Å; L918-T920 VanDerWaalsContact C-N 3.32Å; L918-T920 PolarHBondContact O-N 3.28Å; T920-T923 WeakPolarHBondContact CA-OG1 3.43Å; T920-T923 PolarHBondContact O-OG1 3.46Å; T920-T923 VanDerWaalsContact O-OG1 3.09Å; T920-K924 PolarHBondContact O-N 3.27Å
921D51.7Low57.7Low81 Ų8196.2 Ų96.243%0.43350%0.504SS..Hα-helixtrans-79.9-37.7176.7-76.8-23.8000111.4R917 L918 T923 K924 V925R917-D921 PolarHBondContact O-N 3.48Å; R917-D921 VanDerWaalsContact O-N 3.09Å; L918-D921 PolarHBondContact O-N 3.31Å; D921-T923 PolarHBondContact O-N 3.34Å; D921-K924 PolarHBondContact O-N 3.44Å; D921-V925 WeakPolarHBondContact O-CG2 2.78Å; D921-V925 PolarHBondContact O-N 3.14Å; D921-V925 VanDerWaalsContact O-N 3.1Å
922V51.2Low55.6Low90 Ų90103.4 Ų103.455%0.54554%0.542SS..Hα-helixtrans-63.1-40.4175176.80000111.6L918 K924 V925 E926L918-V922 WeakPolarHBondContact O-CG2 3.42Å; L918-V922 PolarHBondContact O-N 3.04Å; L918-V922 VanDerWaalsContact O-N 3.07Å; V922-K924 VanDerWaalsContact C-N 3.31Å; V922-K924 PolarHBondContact O-N 3.35Å; V922-V925 PolarHBondContact O-N 3.2Å; V922-E926 PolarHBondContact O-N 3.4Å
923T51.1Low53.5Low85 Ų85105.7 Ų105.752%0.52157%0.572SS.*Hα-helixtrans-68.8-25.7176.746.40000113.7E919 T920 D921 T927E919-T923 PolarHBondContact O-N 2.73Å; E919-T923 PolarHBondContact O-OG1 3.06Å; T920-T923 WeakPolarHBondContact CA-OG1 3.43Å; T920-T923 PolarHBondContact O-OG1 3.46Å; T920-T923 VanDerWaalsContact O-OG1 3.09Å; D921-T923 PolarHBondContact O-N 3.34Å; T923-T927 PolarHBondContact O-OG1 3.29Å
924K48.7Very low52.4Low141 Ų141108.2 Ų108.261%0.61358%0.581SS**Hα-helixtrans-79.8-31173.9-79.4-179.2179.4175.50113.2T920 D921 V922 T927 T928T920-K924 PolarHBondContact O-N 3.27Å; D921-K924 PolarHBondContact O-N 3.44Å; V922-K924 VanDerWaalsContact C-N 3.31Å; V922-K924 PolarHBondContact O-N 3.35Å; K924-T927 WeakPolarHBondContact CA-OG1 3.22Å; K924-T927 PolarHBondContact O-N 3.1Å; K924-T927 PolarHBondContact O-OG1 3.31Å; K924-T928 PolarHBondContact O-N 3.28Å; K924-T928 PolarHBondContact O-OG1 3.49Å
925V48.7Very low51.3Low82 Ų82111.5 Ų111.550%0.49760%0.601SS.*Hα-helixtrans-71-41177.7177.20000111.2D921 V922 T927 T928 E929D921-V925 WeakPolarHBondContact O-CG2 2.78Å; D921-V925 PolarHBondContact O-N 3.14Å; D921-V925 VanDerWaalsContact O-N 3.1Å; V922-V925 PolarHBondContact O-N 3.2Å; V925-T927 PolarHBondContact O-N 3.44Å; V925-T928 PolarHBondContact O-N 3.3Å; V925-T928 VanDerWaalsContact O-N 3.12Å; V925-T928 PolarHBondContact O-OG1 3.12Å; V925-E929 PolarHBondContact O-N 3.4Å
926E48.1Very low50.2Low146 Ų146113.9 Ų113.968%0.68261%0.614SS**Hα-helixtrans-63.3-28.9176-72.3-173.8168.900113.1V922V922-E926 PolarHBondContact O-N 3.4Å
927T48Very low49.1Very low84 Ų84114.9 Ų114.952%0.51562%0.619SS.*Hα-helixtrans-80.2-21.4176.645.70000113.3T923 K924 V925 S930T923-T927 PolarHBondContact O-OG1 3.29Å; K924-T927 WeakPolarHBondContact CA-OG1 3.22Å; K924-T927 PolarHBondContact O-N 3.1Å; K924-T927 PolarHBondContact O-OG1 3.31Å; V925-T927 PolarHBondContact O-N 3.44Å; T927-S930 PolarHBondContact O-OG 3.5Å; T927-S930 VanDerWaalsContact O-OG 3.11Å
928T46.6Very low48.2Very low86 Ų86112.9 Ų112.953%0.52862%0.623SS.*Hα-helixtrans-88.8-26.8179.150.40000114.7K924 V925 S930 L931K924-T928 PolarHBondContact O-N 3.28Å; K924-T928 PolarHBondContact O-OG1 3.49Å; V925-T928 PolarHBondContact O-N 3.3Å; V925-T928 VanDerWaalsContact O-N 3.12Å; V925-T928 PolarHBondContact O-OG1 3.12Å; T928-S930 VanDerWaalsContact C-N 3.26Å; T928-S930 PolarHBondContact O-N 3.14Å; T928-L931 PolarHBondContact O-N 3.31Å
929E44.1Very low47.5Very low155 Ų155114.9 Ų114.972%0.72464%0.635SS**Hα-helixtrans-72.5-19.2173.7-77.2-171.5163.300113.1V925 L931V925-E929 PolarHBondContact O-N 3.4Å; E929-L931 VanDerWaalsContact C-N 3.28Å; E929-L931 PolarHBondContact O-N 2.9Å
930S49.2Very low47.1Very low85 Ų85113.3 Ų113.359%0.59464%0.635SS**THydrogen-bonded Turntrans-79.6-3.4171.467.60000114.9T927 T928T927-S930 PolarHBondContact O-OG 3.5Å; T927-S930 VanDerWaalsContact O-OG 3.11Å; T928-S930 VanDerWaalsContact C-N 3.26Å; T928-S930 PolarHBondContact O-N 3.14Å
931L42.8Very low46.5Very low144 Ų144116.2 Ų116.275%0.75465%0.649SS**THydrogen-bonded Turntrans-115.85.1179.8-82.2166.9000114.5T928 E929T928-L931 PolarHBondContact O-N 3.31Å; E929-L931 VanDerWaalsContact C-N 3.28Å; E929-L931 PolarHBondContact O-N 2.9Å
932L38.5Very low46.1Very low170 Ų170119.2 Ų119.289%0.8967%0.666SS**  trans-127.314.1173.6-85.3163.3000114.6
933S35.9Very low45.6Very low162 Ų162121.8 Ų121.8100%1.13368%0.677SS**  trans-1120153.6-178.60000109.5

Retrieved 933 of 933 residues in 763.1 ms (Link to these results)