A0A077YZG7_TRITR Loading...

Fez family zinc finger protein

AlphaFold DB , UniProt , Accession A0A077YZG7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 388 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M42.8Very low32.1Very low248 Ų248158.5 Ų158.5100%1.22284%0.837SS**  0109.80-74.1-178.215200108.2
2T32.2Very low31.5Very low144 Ų144154 Ų15488%0.88383%0.827SS**  trans-80.7128174.515.30000109.7
3S41.6Very low31.5Very low107 Ų107160 Ų16075%0.74883%0.831SS**  trans-161.7105.1163.8172.10000103.9
4Q29.7Very low31Very low172 Ų172160.5 Ų160.580%0.80483%0.834SS**  cis51.492.549.2-75.2-75.8-13.100112.6
5Q35Very low30.7Very low171 Ų171160 Ų16080%0.79983%0.831SS**  trans166.7136.8146.3-92.7171.77.900106.9
6Q32.7Very low30.3Very low174 Ų174161.7 Ų161.781%0.81383%0.834SS**  cis-167.1142.3-10.2-129.1173.2-17.400105.4
7L23.9Very low30.2Very low167 Ų167158.6 Ų158.687%0.87483%0.826SS**  trans-66.8159169.1-75.7151.9000111.3
8P32Very low29.8Very low107 Ų107158.2 Ų158.270%0.69583%0.825SS**  -124.9126.1128.67.913.2000112.7
9F28.6Very low29.8Very low193 Ų193158.7 Ų158.785%0.84683%0.828SS**  trans64.391.2145.2-60.9-73.2000120.4
10S24.1Very low29.4Very low96 Ų96159.2 Ų159.267%0.67183%0.826SS**  trans-61.1129.3144.7-1710000111.6
11I30.5Very low29.2Very low165 Ų165161.8 Ų161.885%0.84683%0.825SS**  trans-132.990.7141.9-59.4-178.5000107.2
12S25Very low28.5Very low104 Ų104157.3 Ų157.373%0.72780%0.801SS**  trans-79.3122.2155.8-67.30000108.9
13R31.8Very low28.5Very low232 Ų232155.9 Ų155.988%0.87580%0.797SS**  trans-154110.2143.6-101.5-175.1-154.2-118.33.1109.9
14L23.7Very low27.9Very low167 Ų167157.9 Ų157.987%0.87480%0.799SS**  trans-47.4138.2151.6-83.2137000110.3
15I27Very low28.3Very low153 Ų153155 Ų15579%0.78580%0.795SS**  trans-173.8108.7135.3-84.1142.3000107.1
16Q23.5Very low28Very low187 Ų187150.9 Ų150.987%0.87479%0.79SS**  trans-80.4145.6140.7-74.8178.7-41.200106
17P30Very low27.7Very low109 Ų109148.4 Ų148.471%0.70879%0.791SS**  -150.4176.964.436.5-14.1000116.7
18D22.1Very low27.8Very low152 Ų152149.4 Ų149.481%0.81379%0.791SS**  trans-1.3117.9160.1-94.4-65.5000119
19L29.2Very low27.6Very low167 Ų167151.9 Ų151.987%0.87480%0.797SS**  trans-111.990.8158.1-107.1150.4000108.7
20Q23.3Very low27.6Very low169 Ų169148.3 Ų148.379%0.7979%0.79SS**  trans-65.7141.5149.4-73.3176.7-50.600109.8
21R24.5Very low27.5Very low213 Ų213147.6 Ų147.680%0.80479%0.79SS**  trans134129.1161.5-83.4178.7177.2-140.1-0.3108.1
22H28.7Very low27.5Very low154 Ų154145.6 Ų145.671%0.71379%0.788SS**  cis-146.9155.227.9-63.7-94.2000106.8
23S31.9Very low27.5Very low114 Ų114147.5 Ų147.580%0.79779%0.79SS**  cis-166.1136.743.2-54.40000109.7
24N28.4Very low27.3Very low150 Ų150144.7 Ų144.780%0.80279%0.787SS**  trans-79.3177.8153.5-145.316000107.5
25P39.2Very low27.6Very low111 Ų111142 Ų14272%0.72178%0.779SS**  cis-145.5-174.11039.1-15.5000117.4
26A27.9Very low27.8Very low84 Ų84140.5 Ų140.569%0.69478%0.778SS**  trans90.587.4158.300000116.9
27C25.9Very low28Very low123 Ų123138 Ų13883%0.83178%0.775SS**  -174.989.8107.4-90.80000108.9I29C27-I29 PolarHBondContact O-N 2.97Å
28H26Very low27.9Very low187 Ų187138.5 Ų138.587%0.86678%0.777SS**  trans-68.1110.1158.2-91.2-93.7000107.8
29I28.9Very low28.2Very low159 Ų159136.1 Ų136.182%0.81577%0.768SS**  trans-123.1114.7150.1-63.3-179.8000106.2C27C27-I29 PolarHBondContact O-N 2.97Å
30V27.9Very low28Very low118 Ų118136.2 Ų136.272%0.71576%0.764SS**  trans-56.4132.9178.1170.80000109.8P32V30-P32 WeakPolarHBondContact O-CD 3.47Å
31A23Very low28.1Very low81 Ų81139 Ų13967%0.66977%0.767SS**  trans-72.1124.1166.200000109.9N33A31-N33 PolarHBondContact O-N 3.21Å
32P30Very low28.3Very low123 Ų123134.5 Ų134.580%0.79976%0.763SS**  trans-81.3111.515529.5-25.3000108.6V30V30-P32 WeakPolarHBondContact O-CD 3.47Å
33N25.7Very low28.3Very low144 Ų144135.3 Ų135.377%0.7777%0.769SS**  trans-61.9135.4151.5-79.9-47.6000108.3A31A31-N33 PolarHBondContact O-N 3.21Å
34Q26.5Very low28.4Very low174 Ų174135.6 Ų135.681%0.81377%0.769SS**  trans159.8148.2134.1-81-64.7-46.600109.7
35P29.9Very low28.6Very low110 Ų110138.1 Ų138.171%0.71477%0.773SS**  trans-88.1121.8-148.333.5-32.8000111.8T37P35-T37 PolarHBondContact O-N 3.11Å
36T31.1Very low28.7Very low122 Ų122144.3 Ų144.375%0.74878%0.782SS**  trans-85113.4162.549.20000108T38T36-T38 PolarHBondContact O-N 3.26Å; T36-T38 PolarHBondContact O-OG1 3.22Å
37T27.6Very low28.8Very low134 Ų134148.5 Ų148.582%0.82279%0.787SS**  trans-42.390.1161.135.70000109.5P35 T39P35-T37 PolarHBondContact O-N 3.11Å; T37-T39 PolarHBondContact O-N 3.36Å
38T28.6Very low29.2Very low120 Ų120147.5 Ų147.574%0.73678%0.779SS**  trans-72.792.6170.7-63.20000105.3T36 Q40T36-T38 PolarHBondContact O-N 3.26Å; T36-T38 PolarHBondContact O-OG1 3.22Å; T38-Q40 PolarHBondContact O-N 3.1Å
39T28.4Very low29.7Very low102 Ų102144.4 Ų144.463%0.62677%0.773SS**  trans-37.5114.3163.6-34.10000106.5T37 W41T37-T39 PolarHBondContact O-N 3.36Å; T39-W41 PolarHBondContact O-N 3.41Å
40Q23.7Very low30Very low169 Ų169140.2 Ų140.279%0.7975%0.752SS**  trans-56.6100.1168.5-76.5176.8-19.600105.6T38 T42T38-Q40 PolarHBondContact O-N 3.1Å; Q40-T42 PolarHBondContact O-N 3.26Å
41W26.9Very low30.3Very low228 Ų228143.5 Ų143.586%0.86476%0.76SS**  trans-64.785.8156.8-71.396.7000105T39 M43T39-W41 PolarHBondContact O-N 3.41Å; W41-M43 PolarHBondContact O-N 3.4Å
42T28.5Very low30.8Very low117 Ų117146.6 Ų146.672%0.71876%0.764SS**  trans-55.195.3154.832.40000105Q40 P44Q40-T42 PolarHBondContact O-N 3.26Å; T42-P44 WeakPolarHBondContact O-CD 3.43Å
43M28.8Very low30.9Very low172 Ų172148 Ų14885%0.84776%0.764SS**  trans-56.6116.3168.8-70.3-160.7-16900105.8W41 F45W41-M43 PolarHBondContact O-N 3.4Å; M43-F45 PolarHBondContact O-N 3.44Å
44P33Very low31.2Very low120 Ų120146.1 Ų146.178%0.77977%0.769SS**  trans-59.5135175.224.5-30.1000106.8T42 R46T42-P44 WeakPolarHBondContact O-CD 3.43Å; P44-R46 PolarHBondContact O-N 3.1Å; P44-R46 VanDerWaalsContact O-N 3.08Å
45F33.1Very low31.3Very low203 Ų203141.9 Ų141.989%0.8976%0.763SS**  trans-26.7115.1171.8-111.3-106.9000110.2M43 Q47M43-F45 PolarHBondContact O-N 3.44Å; F45-Q47 VanDerWaalsContact C-N 3.3Å; F45-Q47 PolarHBondContact O-N 3.42Å
46R40.5Very low31.5Very low240 Ų240143.7 Ų143.791%0.90677%0.766SS**  trans-53.698.8173.3-100.3-172.2171.1-149.7-1.8107.8P44P44-R46 PolarHBondContact O-N 3.1Å; P44-R46 VanDerWaalsContact O-N 3.08Å
47Q30Very low31.7Very low172 Ų172143.9 Ų143.980%0.80477%0.77SS**  trans-57.5135.1162.9-73.4178.8-69.300106.8F45 V49F45-Q47 VanDerWaalsContact C-N 3.3Å; F45-Q47 PolarHBondContact O-N 3.42Å; Q47-V49 PolarHBondContact O-N 3.39Å; Q47-V49 VanDerWaalsContact O-N 3.13Å
48P35.1Very low31.7Very low102 Ų102144.9 Ų144.966%0.66277%0.77SS**  trans-61.5121.2179.824.6-31.5000108.2N50P48-N50 PolarHBondContact O-N 3.27Å
49V35.7Very low31.8Very low123 Ų123149.1 Ų149.175%0.74577%0.772SS**SBendtrans-68.874.7176.9-170.20000108.5Q47Q47-V49 PolarHBondContact O-N 3.39Å; Q47-V49 VanDerWaalsContact O-N 3.13Å
50N35.1Very low31.9Very low70 Ų70150.3 Ų150.337%0.37478%0.78SS.*  trans-12810.6174.7-102.319.4000112.2P48 L134P48-N50 PolarHBondContact O-N 3.27Å; N50-L134 WeakPolarHBondContact ND2-CD2 3.27Å
51Q35.9Very low32.3Very low188 Ų188147.9 Ų147.988%0.87978%0.776SS**SBendtrans-115.215.6179.7-77.1-164.218.100116
52L33.5Very low32.4Very low146 Ų146148 Ų14876%0.76478%0.777SS**SBendtrans-116.811.8174.1-108123.9000115.5
53L31.2Very low32.6Very low151 Ų151148.2 Ų148.279%0.79178%0.78SS**SBendtrans-101.17.6-179.4-87.2148.2000114.8
54A31.4Very low32.4Very low106 Ų106149.5 Ų149.588%0.87678%0.784SS**SBendtrans-97.4-3.8175.900000114.2
55A29.8Very low32Very low84 Ų84147.5 Ų147.569%0.69479%0.786SS**SBendtrans-122.352-172.900000112.5
56L34.4Very low31.7Very low148 Ų148141.8 Ų141.878%0.77578%0.784SS**  trans-137.2116.1165.6-77.7165.1000109.2
57P34.3Very low31Very low127 Ų127134.4 Ų134.483%0.82578%0.782SS**  trans-68.5136.9178.826.6-30.8000110.8
58N28.4Very low31Very low155 Ų155130.5 Ų130.583%0.82978%0.78SS**  trans-55.6150.8178-167.13.2000112.2
59R30Very low30.8Very low208 Ų208132.7 Ų132.779%0.78579%0.791SS**  trans9382.5153.7-141.3176.6-155.3-110.14.4117.5
60T31.6Very low30.8Very low128 Ų128131.8 Ų131.879%0.78579%0.789SS**  trans-120.1119.1139.841.70000109.8
61V30.9Very low31Very low117 Ų117132.5 Ų132.571%0.70980%0.799SS**PPolyproline II helixtrans-66.6123.8178.4169.90000108.3
62W29.1Very low31.3Very low230 Ų230131.8 Ų131.887%0.87180%0.796SS**PPolyproline II helixtrans-82.2124.8171.5-69.674.6000108.7
63P31.9Very low31.7Very low122 Ų122131.4 Ų131.479%0.79279%0.79SS**PPolyproline II helixtrans-72.7139.9178.128.5-30.5000110.5
64Q24.7Very low32.3Very low199 Ų199126.3 Ų126.393%0.9377%0.77SS**PPolyproline II helixtrans-71.1139.9173.6-61.5-162.530.300110.7
65G25.6Very low33.3Very low79 Ų79127.1 Ų127.181%0.81476%0.759SS**  trans123.9131157.800000115
66G26.5Very low34.7Very low82 Ų82129.8 Ų129.885%0.84575%0.752SS**  trans98.1106.6157.700000115.5
67G26Very low35.3Very low85 Ų85126.2 Ų126.288%0.87674%0.739SS**  trans-72140.9170.200000112.6
68A30.3Very low36.3Very low91 Ų91125.2 Ų125.275%0.75273%0.727SS**  trans-160.3128.2150.900000108.6C70A68-C70 PolarHBondContact O-N 3.5Å
69V30.7Very low38.2Very low148 Ų148125.7 Ų125.790%0.89772%0.717SS**  trans-16.8110.1166-87.70000116.1S71V69-S71 PolarHBondContact O-N 3.3Å
70C35.5Very low39.6Very low104 Ų104121.3 Ų121.370%0.70371%0.707SS**  trans-85.589.3168.8-1710000109A68A68-C70 PolarHBondContact O-N 3.5Å
71S38.8Very low40.8Very low85 Ų85118.9 Ų118.959%0.59470%0.7SS**  trans-70.5149.7165.2-164.30000109.2V69 E73 A74V69-S71 PolarHBondContact O-N 3.3Å; S71-E73 PolarHBondContact O-N 2.87Å; S71-A74 PolarHBondContact O-N 3Å; S71-A74 VanDerWaalsContact O-N 3.13Å
72Q43.6Very low42.5Very low172 Ų172116.3 Ų116.380%0.80468%0.682SS**THydrogen-bonded Turntrans-55.3-12.4-170.3-159.1151.9-73.900115.1
73E40.3Very low43.7Very low139 Ų139107.1 Ų107.165%0.6566%0.658SS**Hα-helixtrans-59.2-38.9172.6-62.5-66.913700113.3S71 L75 Y76 S77S71-E73 PolarHBondContact O-N 2.87Å; E73-L75 VanDerWaalsContact C-N 3.31Å; E73-L75 PolarHBondContact O-N 3.15Å; E73-Y76 PolarHBondContact O-N 3Å; E73-Y76 VanDerWaalsContact O-N 3.1Å; E73-S77 PolarHBondContact O-N 2.86Å; E73-S77 PolarHBondContact O-OG 3.14Å
74A45.7Very low44.8Very low43 Ų43105 Ų10536%0.35565%0.651SS.*Hα-helixtrans-67-30.8-174.400000113.2S71 L78S71-A74 PolarHBondContact O-N 3Å; S71-A74 VanDerWaalsContact O-N 3.13Å; A74-L78 WeakPolarHBondContact O-CB 3.22Å; A74-L78 WeakPolarHBondContact O-CD1 3.08Å; A74-L78 PolarHBondContact O-N 2.8Å
75L52.3Low46.4Very low123 Ų123101 Ų10164%0.64464%0.635SS**Hα-helixtrans-74.8-32175.1-70.6174.3000112E73 W79E73-L75 VanDerWaalsContact C-N 3.31Å; E73-L75 PolarHBondContact O-N 3.15Å; L75-W79 WeakPolarHBondContact O-CB 3.17Å; L75-W79 PolarHBondContact O-N 3.33Å
76Y57.6Low47.6Very low140 Ų140104.3 Ų104.355%0.54963%0.627SS.*Hα-helixtrans-74.2-38.3177-151.7-100.6000111.2E73 W79 M80E73-Y76 PolarHBondContact O-N 3Å; E73-Y76 VanDerWaalsContact O-N 3.1Å; Y76-W79 HydrophobicContact CE2-CE3 4.49Å; Y76-W79 PolarHBondContact O-N 3.39Å; Y76-M80 HydrophobicContact CD1-CE 4.49Å; Y76-M80 HydrophobicContact CD1-CG 4.47Å; Y76-M80 HydrophobicContact CE1-CE 3.64Å; Y76-M80 HydrophobicContact CE1-CG 4.48Å; Y76-M80 PolarHBondContact O-N 3.47Å
77S46.7Very low48.8Very low74 Ų74103.4 Ų103.452%0.51761%0.612SS.*Hα-helixtrans-65.1-38.9171.6-54.30000112.3E73 W79 M80 A81E73-S77 PolarHBondContact O-N 2.86Å; E73-S77 PolarHBondContact O-OG 3.14Å; S77-W79 VanDerWaalsContact C-N 3.29Å; S77-W79 PolarHBondContact O-N 2.73Å; S77-M80 PolarHBondContact O-N 3.19Å; S77-A81 VanDerWaalsContact O-CB 3.25Å; S77-A81 WeakPolarHBondContact O-CB 3.47Å; S77-A81 PolarHBondContact O-N 3.49Å
78L57.3Low49.9Very low106 Ų106102.4 Ų102.456%0.55560%0.596SS**Hα-helixtrans-65.5-31.8172.8-106.985.7000112.8A74 N82A74-L78 WeakPolarHBondContact O-CB 3.22Å; A74-L78 WeakPolarHBondContact O-CD1 3.08Å; A74-L78 PolarHBondContact O-N 2.8Å; L78-N82 WeakPolarHBondContact O-CB 3.2Å; L78-N82 PolarHBondContact O-N 3.37Å; L78-N82 PolarHBondContact O-ND2 3.33Å
79W66.9Low51Low164 Ų164100.7 Ų100.762%0.62158%0.581SS**Hα-helixtrans-71.3-41.6176.4-17072.6000111.5L75 Y76 S77 G83L75-W79 WeakPolarHBondContact O-CB 3.17Å; L75-W79 PolarHBondContact O-N 3.33Å; Y76-W79 HydrophobicContact CE2-CE3 4.49Å; Y76-W79 PolarHBondContact O-N 3.39Å; S77-W79 VanDerWaalsContact C-N 3.29Å; S77-W79 PolarHBondContact O-N 2.73Å; W79-G83 PolarHBondContact O-N 2.82Å
80M59Low52Low117 Ų11796.7 Ų96.758%0.57656%0.563SS**Hα-helixtrans-69.1-38.9174.5-69.8-64-175.500112.5Y76 S77 N82 G83Y76-M80 HydrophobicContact CD1-CE 4.49Å; Y76-M80 HydrophobicContact CD1-CG 4.47Å; Y76-M80 HydrophobicContact CE1-CE 3.64Å; Y76-M80 HydrophobicContact CE1-CG 4.48Å; Y76-M80 PolarHBondContact O-N 3.47Å; S77-M80 PolarHBondContact O-N 3.19Å; M80-N82 VanDerWaalsContact C-N 3.34Å; M80-N82 PolarHBondContact O-N 3.42Å; M80-G83 PolarHBondContact O-N 3.22Å
81A57.4Low52.7Low77 Ų7794.9 Ų94.964%0.63656%0.556SS**Hα-helixtrans-68.8-29.3-179.400000113.4S77S77-A81 VanDerWaalsContact O-CB 3.25Å; S77-A81 WeakPolarHBondContact O-CB 3.47Å; S77-A81 PolarHBondContact O-N 3.49Å
82N67.2Low53.2Low63 Ų6394 Ų9434%0.33755%0.554SS.*THydrogen-bonded Turntrans-102.16.7-179.1-65.5-54.9000113.9L78 M80 A84 I85L78-N82 WeakPolarHBondContact O-CB 3.2Å; L78-N82 PolarHBondContact O-N 3.37Å; L78-N82 PolarHBondContact O-ND2 3.33Å; M80-N82 VanDerWaalsContact C-N 3.34Å; M80-N82 PolarHBondContact O-N 3.42Å; N82-A84 PolarHBondContact O-N 3.16Å; N82-I85 HydrophobicContact CB-CD1 4.46Å; N82-I85 PolarHBondContact O-N 3.16Å; N82-I85 VanDerWaalsContact O-N 3.07Å
83G53.8Low53.5Low36 Ų3688.7 Ų88.737%0.37154%0.539SS..Hα-helixtrans-58-33179.500000113.6W79 M80 I85 F86 A87W79-G83 PolarHBondContact O-N 2.82Å; M80-G83 PolarHBondContact O-N 3.22Å; G83-I85 VanDerWaalsContact C-N 3.33Å; G83-I85 PolarHBondContact O-N 3.38Å; G83-F86 PolarHBondContact O-N 3.06Å; G83-A87 PolarHBondContact O-N 3.19Å; G83-A87 VanDerWaalsContact O-N 3.12Å
84A54.7Low53.9Low79 Ų7985.1 Ų85.165%0.65353%0.534SS*.Hα-helixtrans-65.8-32.8176.700000113.2N82 F86 A87 A88N82-A84 PolarHBondContact O-N 3.16Å; A84-F86 VanDerWaalsContact C-N 3.34Å; A84-A87 PolarHBondContact O-N 2.9Å; A84-A88 PolarHBondContact O-N 2.85Å
85I59.1Low53.9Low114 Ų11486.6 Ų86.659%0.58555%0.546SS*.Hα-helixtrans-71.1-33.9179.9-55.2177.8000110.3N82 G83 A89N82-I85 HydrophobicContact CB-CD1 4.46Å; N82-I85 PolarHBondContact O-N 3.16Å; N82-I85 VanDerWaalsContact O-N 3.07Å; G83-I85 VanDerWaalsContact C-N 3.33Å; G83-I85 PolarHBondContact O-N 3.38Å; I85-A89 PolarHBondContact O-N 3.37Å
86F51.1Low53.6Low148 Ų14884.3 Ų84.365%0.64955%0.545SS*.Hα-helixtrans-77.1-33.2176.2-75.8-77.5000113.2G83 A84 A89 A90G83-F86 PolarHBondContact O-N 3.06Å; A84-F86 VanDerWaalsContact C-N 3.34Å; F86-A89 PolarHBondContact O-N 2.77Å; F86-A90 PolarHBondContact O-N 3.24Å; F86-A90 VanDerWaalsContact O-N 3.08Å
87A51Low53.1Low64 Ų6482.9 Ų82.953%0.52955%0.551SS.*Hα-helixtrans-64.5-40.7174.400000112G83 A84 A90 A91G83-A87 PolarHBondContact O-N 3.19Å; G83-A87 VanDerWaalsContact O-N 3.12Å; A84-A87 PolarHBondContact O-N 2.9Å; A87-A90 PolarHBondContact O-N 3.32Å; A87-A91 PolarHBondContact O-N 2.82Å; A87-A91 VanDerWaalsContact O-N 3.1Å
88A49.7Very low52.7Low64 Ų6483.9 Ų83.953%0.52956%0.564SS.*Hα-helixtrans-65.2-39.7176.100000112.5A84 A91 A92A84-A88 PolarHBondContact O-N 2.85Å; A88-A91 PolarHBondContact O-N 3.36Å; A88-A92 PolarHBondContact O-N 3.43Å; A88-A92 VanDerWaalsContact O-N 3.14Å
89A52.6Low51.7Low55 Ų5583.4 Ų83.446%0.45558%0.575SS.*Hα-helixtrans-67.1-35176.800000112.9I85 F86 A93I85-A89 PolarHBondContact O-N 3.37Å; F86-A89 PolarHBondContact O-N 2.77Å; A89-A93 PolarHBondContact O-N 3.2Å
90A51.2Low50.3Low63 Ų6379.2 Ų79.252%0.52158%0.576SS.*Hα-helixtrans-70.1-38175.700000112.5F86 A87 A93 A94F86-A90 PolarHBondContact O-N 3.24Å; F86-A90 VanDerWaalsContact O-N 3.08Å; A87-A90 PolarHBondContact O-N 3.32Å; A90-A93 PolarHBondContact O-N 2.78Å; A90-A94 PolarHBondContact O-N 3.12Å
91A49.9Very low49Very low66 Ų6681.7 Ų81.755%0.54559%0.591SS.*Hα-helixtrans-65.7-39176.100000112.3A87 A88 A93 A94 A95A87-A91 PolarHBondContact O-N 2.82Å; A87-A91 VanDerWaalsContact O-N 3.1Å; A88-A91 PolarHBondContact O-N 3.36Å; A91-A93 VanDerWaalsContact C-N 3.34Å; A91-A93 PolarHBondContact O-N 3.29Å; A91-A94 PolarHBondContact O-N 3.31Å; A91-A95 PolarHBondContact O-N 3.05Å
92A49.7Very low47.8Very low66 Ų6685.4 Ų85.455%0.54561%0.605SS.*Hα-helixtrans-66-35.2176.200000112.7A88 A96A88-A92 PolarHBondContact O-N 3.43Å; A88-A92 VanDerWaalsContact O-N 3.14Å; A92-A96 PolarHBondContact O-N 3.24Å
93A51Low46.1Very low61 Ų6186 Ų8650%0.50463%0.626SS.*Hα-helixtrans-71.1-34.2177.600000112.9A89 A90 A91 A96 T97A89-A93 PolarHBondContact O-N 3.2Å; A90-A93 PolarHBondContact O-N 2.78Å; A91-A93 VanDerWaalsContact C-N 3.34Å; A91-A93 PolarHBondContact O-N 3.29Å; A93-A96 PolarHBondContact O-N 3.09Å; A93-T97 PolarHBondContact O-OG1 3.25Å
94A48.4Very low44.8Very low64 Ų6493.9 Ų93.953%0.52965%0.65SS.*Hα-helixtrans-69.2-35178.100000112.7A90 A91 A96 T97A90-A94 PolarHBondContact O-N 3.12Å; A91-A94 PolarHBondContact O-N 3.31Å; A94-A96 VanDerWaalsContact C-N 3.33Å; A94-A96 PolarHBondContact O-N 3.47Å; A94-T97 PolarHBondContact O-N 3.1Å; A94-T97 PolarHBondContact O-OG1 3.03Å; A94-T97 VanDerWaalsContact O-OG1 3.05Å
95A46.6Very low43.7Very low74 Ų7495.9 Ų95.961%0.61266%0.657SS**Hα-helixtrans-67.8-32.517600000112.6A91 T97A91-A95 PolarHBondContact O-N 3.05Å; A95-T97 VanDerWaalsContact C-N 3.33Å; A95-T97 PolarHBondContact O-N 2.72Å
96A45.3Very low41.9Very low76 Ų76100.5 Ų100.563%0.62867%0.673SS**Hα-helixtrans-73.3-21.2-179.400000113.9A92 A93 A94A92-A96 PolarHBondContact O-N 3.24Å; A93-A96 PolarHBondContact O-N 3.09Å; A94-A96 VanDerWaalsContact C-N 3.33Å; A94-A96 PolarHBondContact O-N 3.47Å
97T46.5Very low40.9Very low110 Ų11097.9 Ų97.968%0.67568%0.679SS**G310 helixtrans-87-5.3179.738.60000115A93 A94 A95 A99A93-T97 PolarHBondContact O-OG1 3.25Å; A94-T97 PolarHBondContact O-N 3.1Å; A94-T97 PolarHBondContact O-OG1 3.03Å; A94-T97 VanDerWaalsContact O-OG1 3.05Å; A95-T97 VanDerWaalsContact C-N 3.33Å; A95-T97 PolarHBondContact O-N 2.72Å; T97-A99 VanDerWaalsContact C-N 3.32Å; T97-A99 PolarHBondContact O-N 3.1Å
98A37.6Very low40.3Very low95 Ų95100.1 Ų100.179%0.78569%0.688SS**G310 helixtrans-78.6-10.2179.300000114.3
99A37.3Very low39.1Very low96 Ų96107.5 Ų107.579%0.79371%0.708SS**G310 helixtrans-104.6-0.2-170.900000115.9T97T97-A99 VanDerWaalsContact C-N 3.32Å; T97-A99 PolarHBondContact O-N 3.1Å
100A36.6Very low37.8Very low76 Ų76108.4 Ų108.463%0.62872%0.723SS**  trans-140.675.3-174.900000112.3
101N32.1Very low37.1Very low169 Ų169111 Ų11190%0.90473%0.734SS**  trans-161.985.1154.2-91.6-33.5000109.8
102V33.6Very low35.8Very low154 Ų154113.7 Ų113.793%0.93374%0.744SS**  trans-114.8126.6161.7176.40000106.9
103G29.7Very low34.7Very low75 Ų75119.1 Ų119.177%0.77376%0.76SS**  trans109.391.3154.500000117.7
104K26.2Very low33.8Very low202 Ų202121.3 Ų121.388%0.87877%0.77SS**  trans-49.2179.3151.9-95.2161.2173.5175.90114.5
105P32.5Very low32.6Very low122 Ų122124.2 Ų124.279%0.79278%0.78SS**  cis-136161.39.120.55.4000118.3
106F20.7Very low31.6Very low210 Ų210130.8 Ų130.892%0.92179%0.79SS**  trans-73.6149.6159.4-97.3-110.1000113.2
107A29.8Very low30.6Very low93 Ų93134.5 Ų134.577%0.76980%0.798SS**  trans-172169.6138.800000111.1
108P39.2Very low29.6Very low112 Ų112137.3 Ų137.373%0.72780%0.801SS**  -129170.3-111.620.55.5000117.6
109F24.1Very low29Very low219 Ų219139.2 Ų139.296%0.96180%0.803SS**  trans25.7127.9146.3-68.4-82.2000122.8
110G25.7Very low28.5Very low73 Ų73139.2 Ų139.275%0.75380%0.797SS**  trans-177.1154.7158.200000112.6
111P35.5Very low28.1Very low118 Ų118140.7 Ų140.777%0.76680%0.803SS**  -115.7163.1-12541.2-34.4000117.7
112T24Very low28Very low123 Ų123137.7 Ų137.776%0.75580%0.795SS**  trans33.8125.8144.2570000121.9
113M25.8Very low27.9Very low179 Ų179138.5 Ų138.588%0.88279%0.793SS**  175.7165.6124.8-93-48.3-150.700111
114P32Very low27.8Very low108 Ų108140.9 Ų140.970%0.70180%0.798SS**  trans-108.9165.5-133.540.6-35.1000117.3
115V22.6Very low28.1Very low124 Ų124134.9 Ų134.975%0.75279%0.786SS**  trans-2.5120.7154.1-171.70000117.8L117V115-L117 HydrophobicContact CG1-CD1 3.8Å
116R26.8Very low27.8Very low213 Ų213136.8 Ų136.880%0.80479%0.789SS**  trans-140.9102.5144.1-165.9170.6-171.9171.33.5110.3K118R116-K118 PolarHBondContact O-N 2.96Å
117L23.1Very low28.4Very low153 Ų153134.4 Ų134.480%0.80179%0.785SS**  trans-71110.6167.8-75.8118.5000108.8V115V115-L117 HydrophobicContact CG1-CD1 3.8Å
118K26.7Very low28.3Very low169 Ų169134.9 Ų134.974%0.73578%0.78SS**  trans-113.5113.9155.3-91.3-176.5175.6-177.80108.3R116R116-K118 PolarHBondContact O-N 2.96Å
119T24.1Very low27.9Very low136 Ų136139.5 Ų139.583%0.83479%0.788SS**  trans-73.4114167.848.30000109
120S28.1Very low28.2Very low96 Ų96133.6 Ų133.667%0.67178%0.775SS**  trans-156.7112.4155.950.60000108.3
121S27Very low28.6Very low106 Ų106135.2 Ų135.274%0.74178%0.775SS**  trans23.4136133.644.10000119.2
122S30.7Very low28.6Very low106 Ų106135 Ų13574%0.74177%0.771SS**  trans70.487154.153.90000117.6
123L31.3Very low29Very low171 Ų171138.1 Ų138.190%0.89577%0.774SS**  trans-134.396.8134.7-93.9152000107.2A125L123-A125 PolarHBondContact O-N 3.4Å; L123-A125 VanDerWaalsContact O-N 3.13Å
124S27.5Very low29.3Very low125 Ų125134.6 Ų134.687%0.87476%0.758SS**  trans-61.4102.4158.8-58.60000106.7
125A32Very low29.3Very low76 Ų76136.6 Ų136.663%0.62876%0.762SS**  trans-127.1119.616900000107.1L123 I127L123-A125 PolarHBondContact O-N 3.4Å; L123-A125 VanDerWaalsContact O-N 3.13Å; A125-I127 PolarHBondContact O-N 2.82Å
126D28.1Very low30Very low162 Ų162138.2 Ų138.287%0.86677%0.766SS**  trans-48.2106.4-179.8-65.1-74.7000112P128D126-P128 WeakPolarHBondContact O-CD 3.32Å
127I31.4Very low30.5Very low160 Ų160132.9 Ų132.982%0.82176%0.762SS**  trans-91.4108.3157.2-62.1176000105.5A125 K129A125-I127 PolarHBondContact O-N 2.82Å; I127-K129 PolarHBondContact O-N 3.11Å
128P29.1Very low30.8Very low103 Ų103133.5 Ų133.567%0.66976%0.76SS**  trans-60.7137.5-178.723.3-31.2000109.1D126 S130D126-P128 WeakPolarHBondContact O-CD 3.32Å; P128-S130 PolarHBondContact O-N 2.92Å
129K31Very low31.1Very low209 Ų209131 Ų13191%0.90976%0.761SS**  trans-59.579.3165.1-72.2171.3-178.9166.90107.8I127 S131I127-K129 PolarHBondContact O-N 3.11Å; K129-S131 PolarHBondContact O-N 3.29Å
130S30.8Very low31.9Very low96 Ų96129.6 Ų129.667%0.67175%0.748SS**  trans-65.5107.2172.8-178.70000106.3P128 T132P128-S130 PolarHBondContact O-N 2.92Å; S130-T132 PolarHBondContact O-N 2.96Å; S130-T132 PolarHBondContact O-OG1 3.01Å
131S33.2Very low32.1Very low107 Ų107135.9 Ų135.975%0.74876%0.756SS**  trans-51.983.6169.9-68.50000109.4K129 K133K129-S131 PolarHBondContact O-N 3.29Å; S131-K133 PolarHBondContact O-N 3.35Å
132T35.9Very low32.6Very low114 Ų114136.3 Ų136.370%0.69976%0.758SS**  trans-74.678.8158.99.80000106.1S130 L134S130-T132 PolarHBondContact O-N 2.96Å; S130-T132 PolarHBondContact O-OG1 3.01Å; T132-L134 HydrophobicContact CG2-CD1 4.03Å; T132-L134 HydrophobicContact CG2-CG 4.49Å; T132-L134 PolarHBondContact O-N 3.21Å
133K32.3Very low32.7Very low188 Ų188133.7 Ų133.782%0.81775%0.748SS**  trans-58.871.5149.7-90.3-179173.5175.70107.1S131 L135S131-K133 PolarHBondContact O-N 3.35Å; K133-L135 PolarHBondContact O-N 2.9Å
134L32.7Very low32.8Very low104 Ų104130.8 Ų130.855%0.54575%0.749SS.*  trans-81.8108.9161.2-96.7153.6000105.3N50 T132 L136N50-L134 WeakPolarHBondContact ND2-CD2 3.27Å; T132-L134 HydrophobicContact CG2-CD1 4.03Å; T132-L134 HydrophobicContact CG2-CG 4.49Å; T132-L134 PolarHBondContact O-N 3.21Å; L134-L136 PolarHBondContact O-N 3.08Å
135L30.6Very low33.4Very low150 Ų150129 Ų12979%0.78574%0.741SS**  trans-58.668.6168.1-65.3167000109.8K133 S137K133-L135 PolarHBondContact O-N 2.9Å; L135-S137 VanDerWaalsContact C-N 3.29Å; L135-S137 PolarHBondContact O-N 3.26Å
136L38.2Very low33.8Very low158 Ų158135.8 Ų135.883%0.82775%0.751SS**  trans-79.696.9155.6-150.672.3000104.5L134L134-L136 PolarHBondContact O-N 3.08Å
137S36.2Very low34.8Very low102 Ų102131.3 Ų131.371%0.71373%0.727SS**  trans4.6119.2159.345.80000113.6L135L135-S137 VanDerWaalsContact C-N 3.29Å; L135-S137 PolarHBondContact O-N 3.26Å
138Q29.8Very low35.4Very low166 Ų166132.7 Ų132.778%0.77673%0.727SS**  trans-11.7128174.6-59-166.1-10.100113.1I140Q138-I140 PolarHBondContact O-N 3.44Å
139P33Very low36.4Very low116 Ų116131 Ų13175%0.75371%0.712SS**  trans-46.7118.1171.522.1-31.6000105.6R141P139-R141 VanDerWaalsContact C-N 3.29Å; P139-R141 PolarHBondContact O-N 3.47Å
140I41.2Very low37Very low107 Ų107126.3 Ų126.355%0.54970%0.697SS.*  trans-47.3112.6174-64.9175.7000102.4Q138 C142Q138-I140 PolarHBondContact O-N 3.44Å; I140-C142 PolarHBondContact O-N 3.14Å
141R32.5Very low37.8Very low227 Ų227130.9 Ų130.986%0.85771%0.705SS**  trans-60.290173.6-86.4179.3167.1-161.9-2102.7P139 G143P139-R141 VanDerWaalsContact C-N 3.29Å; P139-R141 PolarHBondContact O-N 3.47Å; R141-G143 PolarHBondContact O-N 3.49Å
142C36.7Very low38.5Very low115 Ų115128.9 Ų128.978%0.77769%0.69SS**  trans-53.8102.4150-48.40000100.4I140 A144I140-C142 PolarHBondContact O-N 3.14Å; C142-A144 PolarHBondContact O-N 2.77Å
143G33.6Very low38.8Very low52 Ų52127 Ų12754%0.53668%0.682SS.*  trans-45.4148.7-177.800000108.4R141 A145R141-G143 PolarHBondContact O-N 3.49Å; G143-A145 PolarHBondContact O-N 3.35Å
144A33.8Very low39.7Very low109 Ų109125 Ų12590%0.90168%0.68SS**SBendtrans-62.838.7176.700000113.2C142 R146C142-A144 PolarHBondContact O-N 2.77Å; A144-R146 PolarHBondContact O-N 3.3Å
145A40.2Very low40.2Very low87 Ų87128.4 Ų128.472%0.71969%0.693SS**  trans-59.992.6147.100000106.1G143 N147G143-A145 PolarHBondContact O-N 3.35Å; A145-N147 PolarHBondContact O-N 3.01Å
146R40Very low41.1Very low219 Ų219123.6 Ų123.683%0.82667%0.666SS**  trans-34.9112.9149.4-88.3179.7-177.7138.40.5105.8A144 K148A144-R146 PolarHBondContact O-N 3.3Å; R146-K148 PolarHBondContact O-N 3.38Å
147N47.9Very low41.5Very low69 Ų69118.7 Ų118.737%0.36965%0.648SS.*  trans-56.3121.9-176.9-169.5-21.4000105.7A145 L149 D150A145-N147 PolarHBondContact O-N 3.01Å; N147-L149 HydrophobicContact CB-CB 4.3Å; N147-L149 VanDerWaalsContact CG-CD1 3.49Å; N147-L149 PolarHBondContact O-N 3.28Å; N147-L149 WeakPolarHBondContact OD1-CD1 3.49Å; N147-L149 PolarHBondContact OD1-N 2.9Å; N147-D150 PolarHBondContact O-N 3.1Å
148K45.6Very low42.1Very low188 Ų188118.5 Ų118.582%0.81765%0.647SS**G310 helixtrans-58.81.8179.7-151.9172.7-177.4-1780112.8R146 D150R146-K148 PolarHBondContact O-N 3.38Å; K148-D150 PolarHBondContact O-N 3.36Å
149L49.5Very low42.8Very low67 Ų67118 Ų11835%0.35165%0.649SS.*G310 helixtrans-54-16.6162.8-10395.4000115.3N147 K151 C152 I236N147-L149 HydrophobicContact CB-CB 4.3Å; N147-L149 VanDerWaalsContact CG-CD1 3.49Å; N147-L149 PolarHBondContact O-N 3.28Å; N147-L149 WeakPolarHBondContact OD1-CD1 3.49Å; N147-L149 PolarHBondContact OD1-N 2.9Å; L149-K151 PolarHBondContact O-N 3.44Å; L149-K151 VanDerWaalsContact O-N 3.09Å; L149-C152 PolarHBondContact O-N 2.97Å; L149-I236 HydrophobicContact CD1-CD1 3.88Å
150D43.6Very low43.5Very low111 Ų111113.1 Ų113.159%0.59462%0.617SS**G310 helixtrans-66.3-8.2-179.7-68.9-33.1000114.5N147 K148 C152 S153N147-D150 PolarHBondContact O-N 3.1Å; K148-D150 PolarHBondContact O-N 3.36Å; D150-C152 PolarHBondContact O-N 3.35Å; D150-S153 PolarHBondContact O-OG 2.83Å
151K48.4Very low43.5Very low193 Ų193111.4 Ų111.484%0.83961%0.614SS**G310 helixtrans-88.39.2178.7-152.8159-174.9-179.90115.3L149 S153L149-K151 PolarHBondContact O-N 3.44Å; L149-K151 VanDerWaalsContact O-N 3.09Å; K151-S153 PolarHBondContact O-N 3.23Å
152C46.7Very low44.3Very low65 Ų65105.2 Ų105.244%0.43961%0.606SS.*  trans-8345.3164.7-68.90000111.7L149 D150 C232L149-C152 PolarHBondContact O-N 2.97Å; D150-C152 PolarHBondContact O-N 3.35Å; C152-C232 HydrophobicContact CB-CB 3.64Å; C152-C232 WeakPolarHBondContact CB-SG 3.02Å; C152-C232 WeakPolarHBondContact SG-CA 3.38Å; C152-C232 WeakPolarHBondContact SG-CB 3.43Å; C152-C232 CovalentContact SG-SG 2.03Å; C152-C232 PolarHBondContact SG-SG 3.29Å
153S43.2Very low44.8Very low75 Ų75105.6 Ų105.652%0.52460%0.598SS.*  trans-109.3111.9176-59.20000107.6D150 K151D150-S153 PolarHBondContact O-OG 2.83Å; K151-S153 PolarHBondContact O-N 3.23Å
154N49.6Very low45.6Very low145 Ų145108.8 Ų108.878%0.77561%0.607SS**SBendtrans99.8-10.8142.2-48.6-14.3000121.7
155E45.1Very low45.9Very low175 Ų175107.8 Ų107.882%0.81859%0.592SS**SBendtrans-95.9-4.5-179-70.6-175.1125.900116.2
156E48.6Very low45.8Very low50 Ų50109.8 Ų109.823%0.23459%0.59CS.*SBendtrans-1187-179.5-64.6-177.7138.800113.3S158 K219 L231 K235E156-S158 VanDerWaalsContact C-N 3.26Å; E156-S158 PolarHBondContact O-N 2.88Å; E156-K219 WeakPolarHBondContact OE1-CE 3.34Å; E156-L231 WeakPolarHBondContact OE2-CD2 3.35Å; E156-K235 IonicContact OE1-NZ 3.6Å; E156-K235 WeakPolarHBondContact OE2-CE 3.31Å; E156-K235 IonicContact OE2-NZ 3.33Å; E156-K235 PolarHBondContact OE2-NZ 2.92Å
157A45.5Very low45.8Very low54 Ų54104.8 Ų104.845%0.44658%0.58SS.*G310 helixtrans-73.2-1617600000113.2L159 T160 S161A157-L159 VanDerWaalsContact C-N 3.34Å; A157-L159 PolarHBondContact O-N 3.19Å; A157-T160 WeakPolarHBondContact CA-OG1 3.48Å; A157-T160 PolarHBondContact O-N 2.74Å; A157-T160 PolarHBondContact O-OG1 3.5Å; A157-S161 PolarHBondContact O-N 3.41Å
158S49Very low45.3Very low99 Ų99107.7 Ų107.769%0.69261%0.605SS**G310 helixtrans-63.4-32-172.356.30000114.3E156E156-S158 VanDerWaalsContact C-N 3.26Å; E156-S158 PolarHBondContact O-N 2.88Å
159L44.7Very low45Very low156 Ų156104.2 Ų104.282%0.81760%0.596SS**G310 helixtrans-93.8-3175.8-66.7173000113.7A157A157-L159 VanDerWaalsContact C-N 3.34Å; A157-L159 PolarHBondContact O-N 3.19Å
160T47.9Very low44.6Very low13 Ų13111.6 Ų111.68%0.0862%0.619CS.*THydrogen-bonded Turntrans-96.9-7.1177.264.60000113.6A157 S162 M163 V164 P215 F216A157-T160 WeakPolarHBondContact CA-OG1 3.48Å; A157-T160 PolarHBondContact O-N 2.74Å; A157-T160 PolarHBondContact O-OG1 3.5Å; T160-S162 PolarHBondContact O-N 3.42Å; T160-S162 VanDerWaalsContact O-N 3.14Å; T160-M163 PolarHBondContact O-N 3.35Å; T160-V164 WeakPolarHBondContact O-CG2 3.39Å; T160-V164 PolarHBondContact O-N 3.35Å; T160-P215 HydrophobicContact CG2-CB 4.16Å; T160-F216 HydrophobicContact CG2-CD1 4.07Å; T160-F216 HydrophobicContact CG2-CE1 3.63Å; T160-F216 HydrophobicContact CG2-CZ 4.08Å
161S42.5Very low44.4Very low70 Ų70110.7 Ų110.749%0.4963%0.627SS.*Hα-helixtrans-56.2-31.4177.9-156.80000112.1A157 M163 V164 C165A157-S161 PolarHBondContact O-N 3.41Å; S161-M163 VanDerWaalsContact C-N 3.3Å; S161-M163 PolarHBondContact O-N 3.32Å; S161-V164 PolarHBondContact O-N 2.84Å; S161-C165 VanDerWaalsContact O-CB 3.31Å; S161-C165 WeakPolarHBondContact O-CB 3.44Å; S161-C165 PolarHBondContact O-N 3.42Å; S161-C165 PolarHBondContact O-SG 2.95Å
162S48Very low43.8Very low98 Ų98109.7 Ų109.769%0.68563%0.625SS**Hα-helixtrans-68.5-20.6175.2-95.90000115.1T160T160-S162 PolarHBondContact O-N 3.42Å; T160-S162 VanDerWaalsContact O-N 3.14Å
163M48.5Very low43.4Very low123 Ų123109 Ų10961%0.60663%0.629SS**Hα-helixtrans-104.5-15.9175.2-70.1-150.6169.900113.5T160 S161 C165 A213T160-M163 PolarHBondContact O-N 3.35Å; S161-M163 VanDerWaalsContact C-N 3.3Å; S161-M163 PolarHBondContact O-N 3.32Å; M163-C165 VanDerWaalsContact C-N 3.35Å; M163-A213 HydrophobicContact CE-CB 4.32Å
164V50Low43Very low119 Ų119111.1 Ų111.172%0.72164%0.639SS**Hα-helixtrans-82.6-19.7169.9-174.20000110.9T160 S161T160-V164 WeakPolarHBondContact O-CG2 3.39Å; T160-V164 PolarHBondContact O-N 3.35Å; S161-V164 PolarHBondContact O-N 2.84Å
165C38.6Very low42.4Very low88 Ų88109.6 Ų109.660%0.59564%0.635SS**SBendtrans-111.867176.1-58.90000111.6S161 M163S161-C165 VanDerWaalsContact O-CB 3.31Å; S161-C165 WeakPolarHBondContact O-CB 3.44Å; S161-C165 PolarHBondContact O-N 3.42Å; S161-C165 PolarHBondContact O-SG 2.95Å; M163-C165 VanDerWaalsContact C-N 3.35Å
166L39.9Very low41.9Very low129 Ų129108 Ų10868%0.67563%0.632SS**SBendtrans-134.5109.6155.3-75174.7000109
167N39.9Very low41.2Very low114 Ų114112.5 Ų112.561%0.6166%0.657SS**  trans9181.2159.5-57.48.7000117D169N167-D169 HydrophobicContact CB-CB 4.11Å; N167-D169 PolarHBondContact ND2-OD2 2.81Å; N167-D169 PolarHBondContact O-N 2.78Å; N167-D169 PolarHBondContact OD1-OD2 3.4Å
168S37.1Very low41.1Very low129 Ų129115.1 Ų115.190%0.90267%0.672SS**  trans-65.520.5133.8-63.50000113.5R170S168-R170 VanDerWaalsContact C-N 3.3Å; S168-R170 PolarHBondContact O-N 3.44Å
169D38.1Very low40.6Very low116 Ų116115.4 Ų115.462%0.6268%0.675SS**  trans-72.999.1168.4-63-45.2000107.1N167 A171N167-D169 HydrophobicContact CB-CB 4.11Å; N167-D169 PolarHBondContact ND2-OD2 2.81Å; N167-D169 PolarHBondContact O-N 2.78Å; N167-D169 PolarHBondContact OD1-OD2 3.4Å; D169-A171 PolarHBondContact O-N 3.14Å
170R41.3Very low41Very low222 Ų222114.4 Ų114.484%0.83868%0.677SS**  trans-33.993.5160.1-176.2156.3-178.4129.3-4.6108.2S168 E172S168-R170 VanDerWaalsContact C-N 3.3Å; S168-R170 PolarHBondContact O-N 3.44Å; R170-E172 PolarHBondContact O-N 3.31Å
171A40.2Very low41Very low92 Ų92122.1 Ų122.176%0.7671%0.712SS**  trans-58.8103.5164.200000104.1D169 G173D169-A171 PolarHBondContact O-N 3.14Å; A171-G173 PolarHBondContact O-N 2.88Å
172E35.6Very low41.2Very low172 Ų172126 Ų12680%0.80472%0.723SS**  trans-43.995.4165.6-75.7-92.4118.900106.1R170 V174R170-E172 PolarHBondContact O-N 3.31Å; E172-V174 VanDerWaalsContact C-N 3.32Å; E172-V174 PolarHBondContact O-N 3.15Å
173G37.3Very low42Very low51 Ų51130.8 Ų130.853%0.52673%0.731SS.*  trans-66104.3171.600000104.2A171 T175A171-G173 PolarHBondContact O-N 2.88Å; G173-T175 WeakPolarHBondContact O-CG2 3.46Å; G173-T175 PolarHBondContact O-N 3.04Å
174V35.8Very low42.4Very low118 Ų118132.5 Ų132.572%0.71574%0.736SS**  trans-53.2100.6161.5174.30000105.8E172 N176E172-V174 VanDerWaalsContact C-N 3.32Å; E172-V174 PolarHBondContact O-N 3.15Å; V174-N176 VanDerWaalsContact C-N 3.25Å; V174-N176 WeakPolarHBondContact CG1-OD1 3.44Å; V174-N176 PolarHBondContact O-N 3.44Å
175T36.6Very low43.4Very low113 Ų113131.1 Ų131.169%0.69373%0.729SS**  trans-76.583178.151.70000106.9G173 N177G173-T175 WeakPolarHBondContact O-CG2 3.46Å; G173-T175 PolarHBondContact O-N 3.04Å; T175-N177 PolarHBondContact O-N 3.29Å
176N35.2Very low45.2Very low142 Ų142135.3 Ų135.376%0.75974%0.737SS**  trans-76.685163.8-71.8-12.7000107.6V174 S178V174-N176 VanDerWaalsContact C-N 3.25Å; V174-N176 WeakPolarHBondContact CG1-OD1 3.44Å; V174-N176 PolarHBondContact O-N 3.44Å; N176-S178 PolarHBondContact O-N 2.84Å; N176-S178 VanDerWaalsContact O-N 3.16Å
177N33.4Very low47.6Very low144 Ų144132.9 Ų132.977%0.7773%0.728SS**  trans-57.5104.9151.2-72-20.4000106.8T175T175-N177 PolarHBondContact O-N 3.29Å
178S42.7Very low50Low109 Ų109131 Ų13176%0.76271%0.714SS**  trans176.6121.3149.7-800000110.2N176N176-S178 PolarHBondContact O-N 2.84Å; N176-S178 VanDerWaalsContact O-N 3.16Å
179S39Very low52.6Low106 Ų106128 Ų12874%0.74169%0.693SS**  trans81111.8159.6-580000118.8H181S179-H181 VanDerWaalsContact C-N 3.28Å; S179-H181 PolarHBondContact O-N 3.2Å; S179-H181 VanDerWaalsContact O-N 3.16Å
180P52.4Low55.2Low134 Ų134122.4 Ų122.487%0.8766%0.663SS**SBendtrans-70.63.1179.6-1931.9000117.7
181H49.8Very low57.5Low176 Ų176116.8 Ų116.882%0.81566%0.655SS**SBendtrans-111.772.2-179.3-87.3-82.2000112.1S179S179-H181 VanDerWaalsContact C-N 3.28Å; S179-H181 PolarHBondContact O-N 3.2Å; S179-H181 VanDerWaalsContact O-N 3.16Å
182Q46.6Very low59.9Low151 Ų151117.1 Ų117.171%0.70664%0.644SS**  trans17492.5152-97.1162.181.200108.2K184Q182-K184 PolarHBondContact O-N 3.4Å
183F63.7Low62.7Low199 Ų199111.4 Ų111.487%0.87362%0.623SS**  trans-69.382.5166.9-166.6-93.5000108P185F183-P185 WeakPolarHBondContact O-CD 3.4Å
184K57.6Low65.3Low159 Ų159111.2 Ų111.269%0.69162%0.621SS**  trans-69.7110.1167.4-77179.7-178.2173.80106.2Q182 K186Q182-K184 PolarHBondContact O-N 3.4Å; K184-K186 PolarHBondContact O-N 3.14Å
185P70.5Confident67.9Low90 Ų90111 Ų11158%0.58461%0.61SS**  trans-59.4120.617524.7-31.4000107.3F183 T187F183-P185 WeakPolarHBondContact O-CD 3.4Å; P185-T187 PolarHBondContact O-N 3.38Å
186K77.4Confident70.6Confident176 Ų176111 Ų11177%0.76561%0.605SS**  trans-58.4114175.3-70.6-179.7-179.6-1790107.9K184K184-K186 PolarHBondContact O-N 3.14Å
187T89.3Confident73.3Confident78 Ų78106.1 Ų106.148%0.47958%0.577SS.*PPolyproline II helixtrans-100.8142.3176.452.10000109.4P185 F197P185-T187 PolarHBondContact O-N 3.38Å; T187-F197 CarbonylContact C-O 3.19Å; T187-F197 WeakPolarHBondContact CA-O 3.34Å
188F89.9Confident76.1Confident75 Ų75105.3 Ų105.333%0.32957%0.573SS.*EExtended strand (participates in β ladder)trans-103.7116.8175.8-62.4-90.1000107.8F197 H200 L203F188-F197 HydrophobicContact CB-CB 4.48Å; F188-F197 PolarHBondContact N-O 2.89Å; F188-F197 PolarHBondContact O-N 3.02Å; F188-H200 HydrophobicContact CD1-CB 4.02Å; F188-H200 AromaticContact CD1-CD2 3.83Å; F188-H200 HydrophobicContact CD2-CB 4.35Å; F188-H200 VanDerWaalsContact CD2-N 3.25Å; F188-H200 HydrophobicContact CE1-CB 3.76Å; F188-H200 AromaticContact CE1-CD2 3.96Å; F188-H200 HydrophobicContact CE2-CB 4.11Å; F188-H200 VanDerWaalsContact CE2-N 3.31Å; F188-H200 HydrophobicContact CG-CB 4.3Å; F188-H200 HydrophobicContact CZ-CB 3.8Å; F188-L203 HydrophobicContact CB-CB 4.19Å; F188-L203 HydrophobicContact CB-CD2 3.87Å
189S93.1Very high78.4Confident64 Ų64101 Ų10145%0.44854%0.544SS..EExtended strand (participates in β ladder)trans-91.4138-179.7-169.30000111.1
190C92.1Very high80.9Confident0 Ų0100.3 Ų100.30%053%0.529CS..PPolyproline II helixtrans-75.6124.9169.3-177.70000110.3D192 G194 K195 F197 L203 H206 H210C190-D192 VanDerWaalsContact C-N 3.31Å; C190-D192 PolarHBondContact O-N 2.72Å; C190-G194 VanDerWaalsContact O-CA 3.3Å; C190-G194 WeakPolarHBondContact O-CA 3.23Å; C190-G194 PolarHBondContact O-N 3.08Å; C190-K195 HydrophobicContact CB-CB 4.41Å; C190-K195 PolarHBondContact N-O 3.04Å; C190-F197 HydrophobicContact CB-CE2 4.15Å; C190-L203 HydrophobicContact CB-CD1 3.66Å; C190-H206 VanDerWaalsContact SG-CD2 3.56Å; C190-H206 PolarHBondContact SG-NE2 3.44Å; C190-H206 VanDerWaalsContact SG-NE2 3.38Å; C190-H210 VanDerWaalsContact SG-CD2 3.53Å; C190-H210 PolarHBondContact SG-NE2 2.87Å
191P90.5Very high82.7Confident103 Ų103101.1 Ų101.167%0.66952%0.516SS*.THydrogen-bonded Turntrans-62.3-37.6-179.424.5-33.1000112.4M207P191-M207 HydrophobicContact CG-CE 4.34Å
192D90.6Very high84.7Confident99 Ų9993.5 Ų93.553%0.52948%0.481SS..THydrogen-bonded Turntrans-80.1-21.3-173.5-54.3-39.4000115.1C190 H210C190-D192 VanDerWaalsContact C-N 3.31Å; C190-D192 PolarHBondContact O-N 2.72Å; D192-H210 HydrophobicContact CB-CB 4.23Å; D192-H210 VanDerWaalsContact OD2-CB 3.28Å; D192-H210 WeakPolarHBondContact OD2-CB 3.43Å; D192-H210 IonicContact OD2-CD2 3.28Å; D192-H210 PolarHBondContact OD2-CD2 2.9Å; D192-H210 IonicContact OD2-CG 3.74Å; D192-H210 VanDerWaalsContact OD2-CG 3.28Å
193C93.5Very high86.8Confident53 Ų5387 Ų8736%0.35845%0.451SS..THydrogen-bonded Turntrans-139.73-17765.20000115.9K195 H206 H210C193-K195 PolarHBondContact O-N 2.77Å; C193-K195 VanDerWaalsContact SG-CG 3.57Å; C193-H206 PolarHBondContact SG-NE2 3.38Å; C193-H206 VanDerWaalsContact SG-NE2 3.44Å; C193-H210 VanDerWaalsContact SG-CE1 3.56Å; C193-H210 PolarHBondContact SG-NE2 3.05Å
194G91.1Very high88.1Confident46 Ų4681.5 Ų81.547%0.47443%0.429SS..  trans65.27.8179.600000115.2C190 L196C190-G194 VanDerWaalsContact O-CA 3.3Å; C190-G194 WeakPolarHBondContact O-CA 3.23Å; C190-G194 PolarHBondContact O-N 3.08Å; G194-L196 PolarHBondContact O-N 3.48Å
195K92.1Very high89.6Confident114 Ų11479.8 Ų79.850%0.49642%0.418SS..  trans-65.3128.9177.4-75179.2-172.9172.10110.2C190 C193 F197C190-K195 HydrophobicContact CB-CB 4.41Å; C190-K195 PolarHBondContact N-O 3.04Å; C193-K195 PolarHBondContact O-N 2.77Å; C193-K195 VanDerWaalsContact SG-CG 3.57Å; K195-F197 HydrophobicContact CB-CE2 3.84Å; K195-F197 HydrophobicContact CB-CZ 4.05Å; K195-F197 WeakPolarHBondContact O-CD2 3.27Å; K195-F197 WeakPolarHBondContact O-CE2 3.48Å
196L93.2Very high90.6Very high114 Ų11476.4 Ų76.460%0.59740%0.395SS*.EExtended strand (participates in β ladder)trans-90.7133.4178.1-58.2178000111G194G194-L196 PolarHBondContact O-N 3.48Å
197F91.8Very high91.2Very high38 Ų3870.3 Ų70.317%0.16737%0.37CS..EExtended strand (participates in β ladder)trans-118.1142.4175.5-62-84.5000109.9T187 F188 C190 K195 A199 N202 L203 H206T187-F197 CarbonylContact C-O 3.19Å; T187-F197 WeakPolarHBondContact CA-O 3.34Å; F188-F197 HydrophobicContact CB-CB 4.48Å; F188-F197 PolarHBondContact N-O 2.89Å; F188-F197 PolarHBondContact O-N 3.02Å; C190-F197 HydrophobicContact CB-CE2 4.15Å; K195-F197 HydrophobicContact CB-CE2 3.84Å; K195-F197 HydrophobicContact CB-CZ 4.05Å; K195-F197 WeakPolarHBondContact O-CD2 3.27Å; K195-F197 WeakPolarHBondContact O-CE2 3.48Å; F197-A199 PolarHBondContact O-N 3.45Å; F197-N202 HydrophobicContact CB-CB 4.15Å; F197-N202 HydrophobicContact CD1-CB 3.85Å; F197-N202 HydrophobicContact CG-CB 4.31Å; F197-L203 HydrophobicContact CB-CB 4.23Å; F197-L203 HydrophobicContact CD2-CB 3.81Å; F197-L203 HydrophobicContact CD2-CD1 3.66Å; F197-L203 HydrophobicContact CD2-CG 4.33Å; F197-L203 HydrophobicContact CE2-CD1 3.75Å; F197-L203 HydrophobicContact CG-CB 4.12Å; F197-H206 HydrophobicContact CE1-CB 3.86Å; F197-H206 HydrophobicContact CE2-CB 3.97Å; F197-H206 AromaticContact CE2-CD2 3.74Å; F197-H206 AromaticContact CE2-CG 3.76Å; F197-H206 HydrophobicContact CZ-CB 3.38Å; F197-H206 AromaticContact CZ-CD2 3.69Å; F197-H206 AromaticContact CZ-CG 3.24Å; F197-H206 AromaticContact CZ-ND1 3.66Å
198N92.3Very high91.4Very high127 Ų12767.1 Ų67.168%0.67935%0.35SS*.SBendtrans-78.6-4.6176.761.1-22000113.7N202N198-N202 PolarHBondContact OD1-ND2 2.84Å; N198-N202 VanDerWaalsContact OD1-ND2 3.1Å
199A90.4Very high91.5Very high19 Ų1966.5 Ų66.516%0.15735%0.352CS..SBendtrans-152.9145179.300000111.5F197 Y201 N202 L203F197-A199 PolarHBondContact O-N 3.45Å; A199-Y201 VanDerWaalsContact C-N 3.34Å; A199-Y201 HydrophobicContact CB-CD1 3.5Å; A199-Y201 VanDerWaalsContact CB-CD1 3.5Å; A199-Y201 HydrophobicContact CB-CE1 3.24Å; A199-Y201 HydrophobicContact CB-CG 4.49Å; A199-Y201 PolarHBondContact O-N 3.3Å; A199-N202 WeakPolarHBondContact O-CB 3.42Å; A199-N202 PolarHBondContact O-N 3.05Å; A199-N202 VanDerWaalsContact O-N 3.09Å; A199-L203 PolarHBondContact O-N 3.33Å
200H90.2Very high91.4Very high91 Ų9166.8 Ų66.842%0.42135%0.346SS..Hα-helixtrans-57.9-44.2-179.6-174.7-107.9000112.5F188 N202 L203 M204F188-H200 HydrophobicContact CD1-CB 4.02Å; F188-H200 AromaticContact CD1-CD2 3.83Å; F188-H200 HydrophobicContact CD2-CB 4.35Å; F188-H200 VanDerWaalsContact CD2-N 3.25Å; F188-H200 HydrophobicContact CE1-CB 3.76Å; F188-H200 AromaticContact CE1-CD2 3.96Å; F188-H200 HydrophobicContact CE2-CB 4.11Å; F188-H200 VanDerWaalsContact CE2-N 3.31Å; F188-H200 HydrophobicContact CG-CB 4.3Å; F188-H200 HydrophobicContact CZ-CB 3.8Å; H200-N202 PolarHBondContact O-N 3.34Å; H200-L203 WeakPolarHBondContact O-CB 3.21Å; H200-L203 PolarHBondContact O-N 2.92Å; H200-M204 PolarHBondContact O-N 3.24Å
201Y90.3Very high91.3Very high151 Ų15171.4 Ų71.459%0.59238%0.375SS*.Hα-helixtrans-61.5-29.417977.8-93.1000113A199 R205A199-Y201 VanDerWaalsContact C-N 3.34Å; A199-Y201 HydrophobicContact CB-CD1 3.5Å; A199-Y201 VanDerWaalsContact CB-CD1 3.5Å; A199-Y201 HydrophobicContact CB-CE1 3.24Å; A199-Y201 HydrophobicContact CB-CG 4.49Å; A199-Y201 PolarHBondContact O-N 3.3Å; Y201-R205 WeakPolarHBondContact O-CB 3.42Å; Y201-R205 PolarHBondContact O-N 3.36Å
202N91.7Very high91.3Very high17 Ų1768.5 Ų68.59%0.09136%0.364CS..Hα-helixtrans-71.9-38.7175.8-77-39.2000111.2F197 N198 A199 H200 R205 H206F197-N202 HydrophobicContact CB-CB 4.15Å; F197-N202 HydrophobicContact CD1-CB 3.85Å; F197-N202 HydrophobicContact CG-CB 4.31Å; N198-N202 PolarHBondContact OD1-ND2 2.84Å; N198-N202 VanDerWaalsContact OD1-ND2 3.1Å; A199-N202 WeakPolarHBondContact O-CB 3.42Å; A199-N202 PolarHBondContact O-N 3.05Å; A199-N202 VanDerWaalsContact O-N 3.09Å; H200-N202 PolarHBondContact O-N 3.34Å; N202-R205 PolarHBondContact OD1-NH2 2.9Å; N202-H206 WeakPolarHBondContact O-CB 3.3Å; N202-H206 PolarHBondContact O-N 3.18Å; N202-H206 VanDerWaalsContact O-N 3.11Å
203L91Very high91.2Very high13 Ų1365 Ų657%0.06835%0.348CS..Hα-helixtrans-63-49.3172.3173.162.2000110.6F188 C190 F197 A199 H200 R205 H206 M207F188-L203 HydrophobicContact CB-CB 4.19Å; F188-L203 HydrophobicContact CB-CD2 3.87Å; C190-L203 HydrophobicContact CB-CD1 3.66Å; F197-L203 HydrophobicContact CB-CB 4.23Å; F197-L203 HydrophobicContact CD2-CB 3.81Å; F197-L203 HydrophobicContact CD2-CD1 3.66Å; F197-L203 HydrophobicContact CD2-CG 4.33Å; F197-L203 HydrophobicContact CE2-CD1 3.75Å; F197-L203 HydrophobicContact CG-CB 4.12Å; A199-L203 PolarHBondContact O-N 3.33Å; H200-L203 WeakPolarHBondContact O-CB 3.21Å; H200-L203 PolarHBondContact O-N 2.92Å; L203-R205 VanDerWaalsContact C-N 3.29Å; L203-R205 PolarHBondContact O-N 2.99Å; L203-H206 CarbonylContact O-C 3.54Å; L203-H206 WeakPolarHBondContact O-CA 3.09Å; L203-H206 VanDerWaalsContact O-CB 3.31Å; L203-H206 WeakPolarHBondContact O-CB 3.35Å; L203-H206 PolarHBondContact O-N 3.33Å; L203-M207 HydrophobicContact CD1-SD 3.96Å; L203-M207 HydrophobicContact CG-SD 4.41Å; L203-M207 WeakPolarHBondContact O-CG 3.46Å; L203-M207 PolarHBondContact O-N 3.42Å
204M90.7Very high91.1Very high84 Ų8469.7 Ų69.741%0.41436%0.358SS..Hα-helixtrans-57.2-41.9177.5-69.3-60.9103.400112.3H200 H206 M207 P208H200-M204 PolarHBondContact O-N 3.24Å; M204-H206 PolarHBondContact O-N 3.02Å; M204-M207 HydrophobicContact CE-CG 4.05Å; M204-M207 PolarHBondContact O-N 3.38Å; M204-P208 WeakPolarHBondContact O-CD 3.39Å
205R90Very high90.9Very high124 Ų12469.5 Ų69.547%0.46835%0.349SS..Hα-helixtrans-67.7-20.7174.6-168.6-179.465-161.7-8.3113.5Y201 N202 L203 Q227Y201-R205 WeakPolarHBondContact O-CB 3.42Å; Y201-R205 PolarHBondContact O-N 3.36Å; N202-R205 PolarHBondContact OD1-NH2 2.9Å; L203-R205 VanDerWaalsContact C-N 3.29Å; L203-R205 PolarHBondContact O-N 2.99Å; R205-Q227 HydrophobicContact CG-CG 3.83Å
206H91.3Very high90.8Very high19 Ų1966.2 Ų66.29%0.08833%0.334CS..Hα-helixtrans-85-32.4176.1166.781.3000112.5C190 C193 F197 N202 L203 M204 P208 V209 H210C190-H206 VanDerWaalsContact SG-CD2 3.56Å; C190-H206 PolarHBondContact SG-NE2 3.44Å; C190-H206 VanDerWaalsContact SG-NE2 3.38Å; C193-H206 PolarHBondContact SG-NE2 3.38Å; C193-H206 VanDerWaalsContact SG-NE2 3.44Å; F197-H206 HydrophobicContact CE1-CB 3.86Å; F197-H206 HydrophobicContact CE2-CB 3.97Å; F197-H206 AromaticContact CE2-CD2 3.74Å; F197-H206 AromaticContact CE2-CG 3.76Å; F197-H206 HydrophobicContact CZ-CB 3.38Å; F197-H206 AromaticContact CZ-CD2 3.69Å; F197-H206 AromaticContact CZ-CG 3.24Å; F197-H206 AromaticContact CZ-ND1 3.66Å; N202-H206 WeakPolarHBondContact O-CB 3.3Å; N202-H206 PolarHBondContact O-N 3.18Å; N202-H206 VanDerWaalsContact O-N 3.11Å; L203-H206 CarbonylContact O-C 3.54Å; L203-H206 WeakPolarHBondContact O-CA 3.09Å; L203-H206 VanDerWaalsContact O-CB 3.31Å; L203-H206 WeakPolarHBondContact O-CB 3.35Å; L203-H206 PolarHBondContact O-N 3.33Å; M204-H206 PolarHBondContact O-N 3.02Å; H206-P208 VanDerWaalsContact C-N 3.29Å; H206-P208 VanDerWaalsContact O-N 3.08Å; H206-V209 WeakPolarHBondContact O-CB 3.28Å; H206-V209 WeakPolarHBondContact O-CG2 3.45Å; H206-V209 PolarHBondContact O-N 2.73Å; H206-H210 AromaticContact CD2-NE2 3.95Å; H206-H210 AromaticContact CE1-NE2 3.58Å; H206-H210 AromaticContact NE2-CD2 3.47Å; H206-H210 PolarHBondContact NE2-CD2 2.84Å; H206-H210 AromaticContact NE2-NE2 2.9Å; H206-H210 PolarHBondContact NE2-NE2 3.04Å
207M90.9Very high90.8Very high48 Ų4865.3 Ų65.324%0.23633%0.329CS..G310 helixtrans-47.6-39.2-178.2-63.9-54.3-68.800115.2P191 L203 M204 V209 H210P191-M207 HydrophobicContact CG-CE 4.34Å; L203-M207 HydrophobicContact CD1-SD 3.96Å; L203-M207 HydrophobicContact CG-SD 4.41Å; L203-M207 WeakPolarHBondContact O-CG 3.46Å; L203-M207 PolarHBondContact O-N 3.42Å; M204-M207 HydrophobicContact CE-CG 4.05Å; M204-M207 PolarHBondContact O-N 3.38Å; M207-V209 PolarHBondContact O-N 3.34Å; M207-H210 PolarHBondContact O-N 2.91Å
208P92.4Very high90.8Very high10 Ų1063.6 Ų63.67%0.06532%0.322CS..G310 helixtrans-61.7-9.1175.8-24.335000115.4M204 H206 G212 A213 R226M204-P208 WeakPolarHBondContact O-CD 3.39Å; H206-P208 VanDerWaalsContact C-N 3.29Å; H206-P208 VanDerWaalsContact O-N 3.08Å; P208-G212 PolarHBondContact O-N 2.96Å; P208-A213 HydrophobicContact CB-CB 4.32Å; P208-A213 WeakPolarHBondContact CB-O 3.3Å; P208-R226 HydrophobicContact CB-CB 4.23Å; P208-R226 HydrophobicContact CB-CG 4.01Å; P208-R226 PolarHBondContact O-NE 2.82Å
209V92.1Very high90.8Very high63 Ų6365.4 Ų65.438%0.38232%0.324SS..G310 helixtrans-67.5-37.8171.5176.20000111H206 M207H206-V209 WeakPolarHBondContact O-CB 3.28Å; H206-V209 WeakPolarHBondContact O-CG2 3.45Å; H206-V209 PolarHBondContact O-N 2.73Å; M207-V209 PolarHBondContact O-N 3.34Å
210H91.8Very high90.7Very high70 Ų7070.6 Ų70.632%0.32435%0.348SS..THydrogen-bonded Turntrans-84.1-46.3-177.6-65.2-63.2000112.6C190 D192 C193 H206 M207 G212C190-H210 VanDerWaalsContact SG-CD2 3.53Å; C190-H210 PolarHBondContact SG-NE2 2.87Å; D192-H210 HydrophobicContact CB-CB 4.23Å; D192-H210 VanDerWaalsContact OD2-CB 3.28Å; D192-H210 WeakPolarHBondContact OD2-CB 3.43Å; D192-H210 IonicContact OD2-CD2 3.28Å; D192-H210 PolarHBondContact OD2-CD2 2.9Å; D192-H210 IonicContact OD2-CG 3.74Å; D192-H210 VanDerWaalsContact OD2-CG 3.28Å; C193-H210 VanDerWaalsContact SG-CE1 3.56Å; C193-H210 PolarHBondContact SG-NE2 3.05Å; H206-H210 AromaticContact CD2-NE2 3.95Å; H206-H210 AromaticContact CE1-NE2 3.58Å; H206-H210 AromaticContact NE2-CD2 3.47Å; H206-H210 PolarHBondContact NE2-CD2 2.84Å; H206-H210 AromaticContact NE2-NE2 2.9Å; H206-H210 PolarHBondContact NE2-NE2 3.04Å; M207-H210 PolarHBondContact O-N 2.91Å; H210-G212 PolarHBondContact O-N 3.2Å
211T90Very high90.8Very high97 Ų9768.8 Ų68.860%0.59535%0.345SS*.SBendtrans-72.3-11.4179.761.90000113.3A213T211-A213 PolarHBondContact O-N 2.93Å; T211-A213 VanDerWaalsContact O-N 3.1Å; T211-A213 WeakPolarHBondContact OG1-CB 3.39Å; T211-A213 PolarHBondContact OG1-N 3.48Å
212G89.4Confident90.9Very high42 Ų4264.2 Ų64.243%0.43334%0.344SS..  trans682-170.500000113.8P208 H210 R214P208-G212 PolarHBondContact O-N 2.96Å; H210-G212 PolarHBondContact O-N 3.2Å; G212-R214 PolarHBondContact O-N 3.47Å
213A90.1Very high90.8Very high25 Ų2569.5 Ų69.521%0.20737%0.366CS..  trans-59136.6-175.900000111.4M163 P208 T211 P215M163-A213 HydrophobicContact CE-CB 4.32Å; P208-A213 HydrophobicContact CB-CB 4.32Å; P208-A213 WeakPolarHBondContact CB-O 3.3Å; T211-A213 PolarHBondContact O-N 2.93Å; T211-A213 VanDerWaalsContact O-N 3.1Å; T211-A213 WeakPolarHBondContact OG1-CB 3.39Å; T211-A213 PolarHBondContact OG1-N 3.48Å; A213-P215 VanDerWaalsContact C-CD 3.48Å
214R90.3Very high90.9Very high152 Ų15269.5 Ų69.557%0.57437%0.369SS*.  trans-129.569.1179.9-76.4171.5135.5156.52.8109.4G212 F216 G224 F225G212-R214 PolarHBondContact O-N 3.47Å; R214-F216 PolarHBondContact O-N 3.39Å; R214-F216 VanDerWaalsContact O-N 3.1Å; R214-G224 WeakPolarHBondContact CD-O 3.08Å; R214-G224 PolarHBondContact NE-O 2.94Å; R214-F225 CarbonylContact C-O 3.56Å; R214-F225 VanDerWaalsContact C-O 3.25Å; R214-F225 WeakPolarHBondContact CA-O 3.46Å
215P87.2Confident90.9Very high41 Ų4167.4 Ų67.427%0.26636%0.358SS..  trans-62.6-21.1-170.822.2-32.3000113.9T160 A213T160-P215 HydrophobicContact CG2-CB 4.16Å; A213-P215 VanDerWaalsContact C-CD 3.48Å
216F90.6Very high90.9Very high45 Ų4566.3 Ų66.320%0.19735%0.354CS..EExtended strand (participates in β ladder)trans-101.9100.2-177.2-56.4-79.2000110.7T160 R214 G224 F225 R226 A228 L231T160-F216 HydrophobicContact CG2-CD1 4.07Å; T160-F216 HydrophobicContact CG2-CE1 3.63Å; T160-F216 HydrophobicContact CG2-CZ 4.08Å; R214-F216 PolarHBondContact O-N 3.39Å; R214-F216 VanDerWaalsContact O-N 3.1Å; F216-G224 CarbonylContact O-C 3.34Å; F216-G224 WeakPolarHBondContact O-CA 3.27Å; F216-F225 HydrophobicContact CB-CB 4.22Å; F216-F225 PolarHBondContact N-O 3.43Å; F216-F225 VanDerWaalsContact N-O 3.08Å; F216-F225 PolarHBondContact O-N 3.2Å; F216-R226 WeakPolarHBondContact CE2-O 3.49Å; F216-A228 HydrophobicContact CD1-CB 3.8Å; F216-A228 VanDerWaalsContact CD2-N 3.31Å; F216-A228 HydrophobicContact CE1-CB 3.54Å; F216-A228 HydrophobicContact CE2-CB 4.48Å; F216-A228 VanDerWaalsContact CE2-N 3.35Å; F216-A228 HydrophobicContact CG-CB 4.38Å; F216-A228 HydrophobicContact CZ-CB 3.91Å; F216-L231 HydrophobicContact CB-CB 4Å; F216-L231 HydrophobicContact CB-CD2 3.78Å
217I92.3Very high90.8Very high96 Ų9668.2 Ų68.249%0.49236%0.363SS..EExtended strand (participates in β ladder)trans-100.5132.9-175.9-56.9174.1000110.5K219I217-K219 PolarHBondContact O-N 3.49Å
218C91.7Very high90.8Very high1 Ų168.4 Ų68.41%0.00737%0.372CS..  trans-76.8114.6170.9-175.60000110.7L220 C221 G222 K223 F225 L231 H238C218-L220 PolarHBondContact O-N 3.4Å; C218-C221 PolarHBondContact O-N 2.7Å; C218-G222 VanDerWaalsContact O-CA 3.27Å; C218-G222 WeakPolarHBondContact O-CA 3.46Å; C218-G222 PolarHBondContact O-N 2.83Å; C218-K223 PolarHBondContact N-O 2.99Å; C218-F225 HydrophobicContact CB-CE2 4.29Å; C218-L231 HydrophobicContact CB-CD1 3.53Å; C218-H238 PolarHBondContact SG-NE2 2.96Å; C218-H238 VanDerWaalsContact SG-NE2 3.42Å
219K91.5Very high90.6Very high166 Ų16671.5 Ų71.572%0.72239%0.394SS*.THydrogen-bonded Turntrans-60.7-24.9178.2-62-177.5-176.2179.40114.3E156 I217E156-K219 WeakPolarHBondContact OE1-CE 3.34Å; I217-K219 PolarHBondContact O-N 3.49Å
220L90.2Very high90.6Very high127 Ų12769.9 Ų69.967%0.66538%0.384SS*.THydrogen-bonded Turntrans-81.3-26.9-177.7-64.9175.3000114.1C218 H238C218-L220 PolarHBondContact O-N 3.4Å; L220-H238 HydrophobicContact CD1-CB 3.53Å
221C92.5Very high90.6Very high53 Ų5366.8 Ų66.836%0.35837%0.37SS..THydrogen-bonded Turntrans-136.25-178.865.90000115.2C218 K223 H234 H238C218-C221 PolarHBondContact O-N 2.7Å; C221-K223 PolarHBondContact O-N 3.14Å; C221-K223 VanDerWaalsContact O-N 3.12Å; C221-K223 VanDerWaalsContact SG-CG 3.57Å; C221-H234 PolarHBondContact SG-NE2 3.09Å; C221-H238 PolarHBondContact SG-NE2 2.72Å; C221-H238 VanDerWaalsContact SG-NE2 3.35Å
222G91Very high90.6Very high56 Ų5662.8 Ų62.858%0.57735%0.346SS*.  trans683.7-177.900000114.9C218 G224C218-G222 VanDerWaalsContact O-CA 3.27Å; C218-G222 WeakPolarHBondContact O-CA 3.46Å; C218-G222 PolarHBondContact O-N 2.83Å; G222-G224 PolarHBondContact O-N 3.37Å
223K91.2Very high90.7Very high127 Ų12766 Ų6655%0.55235%0.345SS*.  trans-71.4122.1-178.4-72.6-176.2-178.5-173.80111.3C218 C221 F225C218-K223 PolarHBondContact N-O 2.99Å; C221-K223 PolarHBondContact O-N 3.14Å; C221-K223 VanDerWaalsContact O-N 3.12Å; C221-K223 VanDerWaalsContact SG-CG 3.57Å; K223-F225 HydrophobicContact CB-CE2 3.91Å; K223-F225 HydrophobicContact CB-CZ 4.13Å; K223-F225 WeakPolarHBondContact O-CD2 3.22Å; K223-F225 VanDerWaalsContact O-CE2 3.24Å; K223-F225 WeakPolarHBondContact O-CE2 3.34Å
224G91.2Very high90.7Very high13 Ų1365.8 Ų65.813%0.13434%0.34CS..EExtended strand (participates in β ladder)trans-85.4144.2173.900000114.2R214 F216 G222R214-G224 WeakPolarHBondContact CD-O 3.08Å; R214-G224 PolarHBondContact NE-O 2.94Å; F216-G224 CarbonylContact O-C 3.34Å; F216-G224 WeakPolarHBondContact O-CA 3.27Å; G222-G224 PolarHBondContact O-N 3.37Å
225F90.6Very high90.7Very high41 Ų4161.8 Ų61.818%0.1833%0.327CS..EExtended strand (participates in β ladder)trans-130.2151.3179.7-62.5-88.2000111.3R214 F216 C218 K223 T230 L231 H234R214-F225 CarbonylContact C-O 3.56Å; R214-F225 VanDerWaalsContact C-O 3.25Å; R214-F225 WeakPolarHBondContact CA-O 3.46Å; F216-F225 HydrophobicContact CB-CB 4.22Å; F216-F225 PolarHBondContact N-O 3.43Å; F216-F225 VanDerWaalsContact N-O 3.08Å; F216-F225 PolarHBondContact O-N 3.2Å; C218-F225 HydrophobicContact CB-CE2 4.29Å; K223-F225 HydrophobicContact CB-CE2 3.91Å; K223-F225 HydrophobicContact CB-CZ 4.13Å; K223-F225 WeakPolarHBondContact O-CD2 3.22Å; K223-F225 VanDerWaalsContact O-CE2 3.24Å; K223-F225 WeakPolarHBondContact O-CE2 3.34Å; F225-T230 WeakPolarHBondContact CB-OG1 3.27Å; F225-L231 HydrophobicContact CB-CB 4.21Å; F225-L231 HydrophobicContact CD2-CB 3.86Å; F225-L231 HydrophobicContact CD2-CD1 3.68Å; F225-L231 HydrophobicContact CD2-CG 4.35Å; F225-L231 HydrophobicContact CE2-CD1 3.84Å; F225-L231 HydrophobicContact CG-CB 4.16Å; F225-H234 HydrophobicContact CE1-CB 3.92Å; F225-H234 HydrophobicContact CE2-CB 3.91Å; F225-H234 AromaticContact CE2-CD2 3.36Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.36Å; F225-H234 AromaticContact CE2-CG 3.6Å; F225-H234 AromaticContact CE2-NE2 3.95Å; F225-H234 HydrophobicContact CZ-CB 3.44Å; F225-H234 VanDerWaalsContact CZ-CB 3.44Å; F225-H234 AromaticContact CZ-CD2 3.42Å; F225-H234 VanDerWaalsContact CZ-CD2 3.42Å; F225-H234 WeakPolarHBondContact CZ-CD2 3.47Å; F225-H234 AromaticContact CZ-CG 3.17Å; F225-H234 AromaticContact CZ-ND1 3.59Å; F225-H234 AromaticContact CZ-NE2 3.9Å
226R90.9Very high90.8Very high100 Ų10060.9 Ų60.938%0.37732%0.319SS..SBendtrans-79.5-18.5177.7-66.3-176177.1105.3-3.5113.5P208 F216P208-R226 HydrophobicContact CB-CB 4.23Å; P208-R226 HydrophobicContact CB-CG 4.01Å; P208-R226 PolarHBondContact O-NE 2.82Å; F216-R226 WeakPolarHBondContact CE2-O 3.49Å
227Q89.4Confident90.8Very high59 Ų5962.9 Ų62.928%0.27633%0.331SS..SBendtrans-138.6138.2-174.6-61.4177.52.400111.4R205 S229 T230 L231R205-Q227 HydrophobicContact CG-CG 3.83Å; Q227-S229 VanDerWaalsContact C-N 3.3Å; Q227-S229 PolarHBondContact O-N 2.97Å; Q227-T230 HydrophobicContact CB-CG2 4.08Å; Q227-T230 PolarHBondContact O-N 3.32Å; Q227-T230 PolarHBondContact O-OG1 3.16Å; Q227-L231 PolarHBondContact O-N 2.65Å; Q227-L231 VanDerWaalsContact O-N 3.16Å
228A90Very high90.6Very high52 Ų5261.1 Ų61.143%0.4332%0.321SS..Hα-helixtrans-54.9-43.917600000112.6F216 T230 L231 C232F216-A228 HydrophobicContact CD1-CB 3.8Å; F216-A228 VanDerWaalsContact CD2-N 3.31Å; F216-A228 HydrophobicContact CE1-CB 3.54Å; F216-A228 HydrophobicContact CE2-CB 4.48Å; F216-A228 VanDerWaalsContact CE2-N 3.35Å; F216-A228 HydrophobicContact CG-CB 4.38Å; F216-A228 HydrophobicContact CZ-CB 3.91Å; A228-T230 PolarHBondContact O-N 3.13Å; A228-L231 PolarHBondContact O-N 3.23Å; A228-L231 VanDerWaalsContact O-N 3.13Å; A228-C232 WeakPolarHBondContact O-CB 3.35Å; A228-C232 PolarHBondContact O-N 3.03Å
229S89.4Confident90.5Very high75 Ų7564.8 Ų64.852%0.52434%0.343SS..Hα-helixtrans-59.9-33.4178.862.60000112.8Q227 R233Q227-S229 VanDerWaalsContact C-N 3.3Å; Q227-S229 PolarHBondContact O-N 2.97Å; S229-R233 WeakPolarHBondContact O-CB 3.37Å; S229-R233 PolarHBondContact O-N 2.87Å; S229-R233 VanDerWaalsContact O-N 3.09Å
230T91.2Very high90.2Very high30 Ų3064.3 Ų64.318%0.18434%0.343CS..Hα-helixtrans-75.5-3717761.10000112.5F225 Q227 A228 H234F225-T230 WeakPolarHBondContact CB-OG1 3.27Å; Q227-T230 HydrophobicContact CB-CG2 4.08Å; Q227-T230 PolarHBondContact O-N 3.32Å; Q227-T230 PolarHBondContact O-OG1 3.16Å; A228-T230 PolarHBondContact O-N 3.13Å; T230-H234 WeakPolarHBondContact O-CB 3.24Å; T230-H234 PolarHBondContact O-N 3.11Å
231L92Very high90Very high4 Ų463.6 Ų63.62%0.02134%0.337CS..Hα-helixtrans-64.2-48.1171.3170.760.8000110.8E156 F216 C218 F225 Q227 A228 R233 H234 K235E156-L231 WeakPolarHBondContact OE2-CD2 3.35Å; F216-L231 HydrophobicContact CB-CB 4Å; F216-L231 HydrophobicContact CB-CD2 3.78Å; C218-L231 HydrophobicContact CB-CD1 3.53Å; F225-L231 HydrophobicContact CB-CB 4.21Å; F225-L231 HydrophobicContact CD2-CB 3.86Å; F225-L231 HydrophobicContact CD2-CD1 3.68Å; F225-L231 HydrophobicContact CD2-CG 4.35Å; F225-L231 HydrophobicContact CE2-CD1 3.84Å; F225-L231 HydrophobicContact CG-CB 4.16Å; Q227-L231 PolarHBondContact O-N 2.65Å; Q227-L231 VanDerWaalsContact O-N 3.16Å; A228-L231 PolarHBondContact O-N 3.23Å; A228-L231 VanDerWaalsContact O-N 3.13Å; L231-R233 VanDerWaalsContact C-N 3.32Å; L231-R233 PolarHBondContact O-N 3.06Å; L231-H234 WeakPolarHBondContact O-CA 3.42Å; L231-H234 VanDerWaalsContact O-CB 3.3Å; L231-H234 WeakPolarHBondContact O-CB 3.29Å; L231-H234 PolarHBondContact O-N 3.32Å; L231-K235 PolarHBondContact O-N 2.52Å
232C90.4Very high89.8Confident14 Ų1466.9 Ų66.910%0.09535%0.345CS..Hα-helixtrans-55.7-49.1178.7-174.50000111.4C152 A228 H234 K235C152-C232 HydrophobicContact CB-CB 3.64Å; C152-C232 WeakPolarHBondContact CB-SG 3.02Å; C152-C232 WeakPolarHBondContact SG-CA 3.38Å; C152-C232 WeakPolarHBondContact SG-CB 3.43Å; C152-C232 CovalentContact SG-SG 2.03Å; C152-C232 PolarHBondContact SG-SG 3.29Å; A228-C232 WeakPolarHBondContact O-CB 3.35Å; A228-C232 PolarHBondContact O-N 3.03Å; C232-H234 VanDerWaalsContact C-N 3.25Å; C232-H234 PolarHBondContact O-N 3.3Å; C232-K235 WeakPolarHBondContact O-CB 3.41Å; C232-K235 PolarHBondContact O-N 2.94Å
233R90.2Very high89.7Confident109 Ų10967.4 Ų67.441%0.41134%0.338SS..Hα-helixtrans-61.8-33.5174.4-178.417462.9-151.5-1.3112.7S229 L231 I236S229-R233 WeakPolarHBondContact O-CB 3.37Å; S229-R233 PolarHBondContact O-N 2.87Å; S229-R233 VanDerWaalsContact O-N 3.09Å; L231-R233 VanDerWaalsContact C-N 3.32Å; L231-R233 PolarHBondContact O-N 3.06Å; R233-I236 WeakPolarHBondContact O-CB 3.49Å
234H91.8Very high89.7Confident20 Ų2063.3 Ų63.39%0.09332%0.321CS..Hα-helixtrans-67.8-35.4177.4166.272.6000112.5C221 F225 T230 L231 C232 I236 I237 H238C221-H234 PolarHBondContact SG-NE2 3.09Å; F225-H234 HydrophobicContact CE1-CB 3.92Å; F225-H234 HydrophobicContact CE2-CB 3.91Å; F225-H234 AromaticContact CE2-CD2 3.36Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.36Å; F225-H234 AromaticContact CE2-CG 3.6Å; F225-H234 AromaticContact CE2-NE2 3.95Å; F225-H234 HydrophobicContact CZ-CB 3.44Å; F225-H234 VanDerWaalsContact CZ-CB 3.44Å; F225-H234 AromaticContact CZ-CD2 3.42Å; F225-H234 VanDerWaalsContact CZ-CD2 3.42Å; F225-H234 WeakPolarHBondContact CZ-CD2 3.47Å; F225-H234 AromaticContact CZ-CG 3.17Å; F225-H234 AromaticContact CZ-ND1 3.59Å; F225-H234 AromaticContact CZ-NE2 3.9Å; T230-H234 WeakPolarHBondContact O-CB 3.24Å; T230-H234 PolarHBondContact O-N 3.11Å; L231-H234 WeakPolarHBondContact O-CA 3.42Å; L231-H234 VanDerWaalsContact O-CB 3.3Å; L231-H234 WeakPolarHBondContact O-CB 3.29Å; L231-H234 PolarHBondContact O-N 3.32Å; C232-H234 VanDerWaalsContact C-N 3.25Å; C232-H234 PolarHBondContact O-N 3.3Å; H234-I236 PolarHBondContact O-N 3.19Å; H234-I236 VanDerWaalsContact O-N 3.1Å; H234-I237 VanDerWaalsContact O-CB 3.29Å; H234-I237 WeakPolarHBondContact O-CB 3.35Å; H234-I237 PolarHBondContact O-N 3.05Å; H234-H238 AromaticContact CE1-NE2 3.82Å; H234-H238 AromaticContact NE2-CD2 4Å; H234-H238 AromaticContact NE2-NE2 3.32Å; H234-H238 PolarHBondContact NE2-NE2 2.78Å
235K89.8Confident89.9Confident69 Ų6969.7 Ų69.730%0.335%0.345SS..Hα-helixtrans-55.5-29.9178.7-68.9-177.4-179.3-178.10113.2E156 L231 C232 I237 H238 T239E156-K235 IonicContact OE1-NZ 3.6Å; E156-K235 WeakPolarHBondContact OE2-CE 3.31Å; E156-K235 IonicContact OE2-NZ 3.33Å; E156-K235 PolarHBondContact OE2-NZ 2.92Å; L231-K235 PolarHBondContact O-N 2.52Å; C232-K235 WeakPolarHBondContact O-CB 3.41Å; C232-K235 PolarHBondContact O-N 2.94Å; K235-I237 PolarHBondContact O-N 3.05Å; K235-I237 VanDerWaalsContact O-N 3.14Å; K235-H238 WeakPolarHBondContact O-CB 3.33Å; K235-H238 PolarHBondContact O-N 3.31Å; K235-T239 PolarHBondContact O-N 2.89Å
236I89.5Confident90.1Very high21 Ų2167.9 Ų67.911%0.10834%0.337CS..Hα-helixtrans-58.3-26.8175.4-55.6170.2000112.3L149 R233 H234 H238 T239 H240 E241 N254L149-I236 HydrophobicContact CD1-CD1 3.88Å; R233-I236 WeakPolarHBondContact O-CB 3.49Å; H234-I236 PolarHBondContact O-N 3.19Å; H234-I236 VanDerWaalsContact O-N 3.1Å; I236-H238 VanDerWaalsContact C-N 3.29Å; I236-H238 PolarHBondContact O-N 3.47Å; I236-T239 PolarHBondContact O-OG1 3.36Å; I236-H240 PolarHBondContact O-N 3.19Å; I236-E241 HydrophobicContact CG2-CB 4.46Å; I236-E241 WeakPolarHBondContact CG2-O 3.5Å; I236-N254 HydrophobicContact CG2-CB 4Å
237I89.3Confident90.2Very high87 Ų8771.3 Ų71.345%0.44636%0.357SS..Hα-helixtrans-68.6-32.4177.1-61.2171.6000110.8H234 K235H234-I237 VanDerWaalsContact O-CB 3.29Å; H234-I237 WeakPolarHBondContact O-CB 3.35Å; H234-I237 PolarHBondContact O-N 3.05Å; K235-I237 PolarHBondContact O-N 3.05Å; K235-I237 VanDerWaalsContact O-N 3.14Å
238H89.8Confident90.3Very high60 Ų6073.4 Ų73.428%0.27838%0.375SS..Hα-helixtrans-76.8-35.5179-68.4-61.9000113C218 L220 C221 H234 K235 I236 H240C218-H238 PolarHBondContact SG-NE2 2.96Å; C218-H238 VanDerWaalsContact SG-NE2 3.42Å; L220-H238 HydrophobicContact CD1-CB 3.53Å; C221-H238 PolarHBondContact SG-NE2 2.72Å; C221-H238 VanDerWaalsContact SG-NE2 3.35Å; H234-H238 AromaticContact CE1-NE2 3.82Å; H234-H238 AromaticContact NE2-CD2 4Å; H234-H238 AromaticContact NE2-NE2 3.32Å; H234-H238 PolarHBondContact NE2-NE2 2.78Å; K235-H238 WeakPolarHBondContact O-CB 3.33Å; K235-H238 PolarHBondContact O-N 3.31Å; I236-H238 VanDerWaalsContact C-N 3.29Å; I236-H238 PolarHBondContact O-N 3.47Å; H238-H240 PolarHBondContact O-CD2 2.76Å; H238-H240 PolarHBondContact O-N 3.25Å
239T88.3Confident90.5Very high78 Ų7873.5 Ų73.548%0.47937%0.371SS..Hα-helixtrans-76.9-10.6176.262.70000112.3K235 I236 E241K235-T239 PolarHBondContact O-N 2.89Å; I236-T239 PolarHBondContact O-OG1 3.36Å; T239-E241 PolarHBondContact O-N 2.78Å; T239-E241 WeakPolarHBondContact OG1-CB 3.22Å; T239-E241 WeakPolarHBondContact OG1-CG 3.45Å; T239-E241 PolarHBondContact OG1-N 3.13Å
240H85.5Confident90.7Very high156 Ų15672.5 Ų72.572%0.72237%0.373SS*.THydrogen-bonded Turntrans53.315.4-170.5-64.3-81.7000114I236 H238I236-H240 PolarHBondContact O-N 3.19Å; H238-H240 PolarHBondContact O-CD2 2.76Å; H238-H240 PolarHBondContact O-N 3.25Å
241E86.3Confident90.8Very high112 Ų11277 Ų7752%0.52339%0.39SS..  trans-68.7137.2179.8-73.4-179.716600110.4I236 T239 P243I236-E241 HydrophobicContact CG2-CB 4.46Å; I236-E241 WeakPolarHBondContact CG2-O 3.5Å; T239-E241 PolarHBondContact O-N 2.78Å; T239-E241 WeakPolarHBondContact OG1-CB 3.22Å; T239-E241 WeakPolarHBondContact OG1-CG 3.45Å; T239-E241 PolarHBondContact OG1-N 3.13Å; E241-P243 WeakPolarHBondContact O-CD 3.44Å
242K89Confident90.8Very high121 Ų12178.1 Ų78.153%0.52640%0.4SS..  trans-126.476179.8-68.9170.6172-1640109H244 A252 F253K242-H244 PolarHBondContact O-N 3.16Å; K242-H244 VanDerWaalsContact O-N 3.16Å; K242-A252 HydrophobicContact CB-CB 3.38Å; K242-A252 HydrophobicContact CD-CB 3.98Å; K242-A252 WeakPolarHBondContact CD-O 3.38Å; K242-A252 HydrophobicContact CG-CB 4.3Å; K242-F253 CarbonylContact C-O 3.53Å; K242-F253 WeakPolarHBondContact CA-O 2.91Å
243P87.8Confident90.9Very high68 Ų6879.6 Ų79.644%0.44241%0.405SS..  trans-64.4-21.7-172.423.4-33.4000113.3E241E241-P243 WeakPolarHBondContact O-CD 3.44Å
244H92.3Very high90.9Very high40 Ų4077.4 Ų77.419%0.18540%0.401CS..EExtended strand (participates in β ladder)trans-100.293.7-175.2-56.2-69.5000111K242 A252 F253 S256 L259K242-H244 PolarHBondContact O-N 3.16Å; K242-H244 VanDerWaalsContact O-N 3.16Å; H244-A252 CarbonylContact O-C 3.53Å; H244-A252 WeakPolarHBondContact O-CA 3.49Å; H244-F253 HydrophobicContact CB-CB 4.37Å; H244-F253 WeakPolarHBondContact CB-O 3.36Å; H244-F253 PolarHBondContact N-O 2.03Å; H244-F253 PolarHBondContact O-N 3.1Å; H244-S256 PolarHBondContact CD2-N 2.94Å; H244-S256 PolarHBondContact NE2-N 3.14Å; H244-L259 HydrophobicContact CB-CB 4.02Å; H244-L259 HydrophobicContact CB-CD2 3.81Å
245K94.3Very high90.9Very high147 Ų14781.4 Ų81.464%0.63942%0.416SS*.EExtended strand (participates in β ladder)trans-91.7134.8179.1-60.8-174.5179.71790111.7A252K245-A252 HydrophobicContact CG-CB 3.79Å
246C94.1Very high91Very high3 Ų381.2 Ų81.22%0.0242%0.423CS..  trans-76.5122.8168-179.30000109.3T248 G250 K251 F253 L259 H262C246-T248 VanDerWaalsContact C-N 3.29Å; C246-T248 PolarHBondContact O-N 2.78Å; C246-T248 PolarHBondContact SG-N 3.24Å; C246-G250 WeakPolarHBondContact O-CA 3.35Å; C246-G250 PolarHBondContact O-N 3.06Å; C246-K251 WeakPolarHBondContact CB-O 3.19Å; C246-K251 PolarHBondContact N-O 3.23Å; C246-F253 HydrophobicContact CB-CE2 4.46Å; C246-L259 HydrophobicContact CB-CD1 3.67Å; C246-H262 PolarHBondContact SG-NE2 3.36Å
247Q93.8Very high91.1Very high172 Ų17282.6 Ų82.680%0.80443%0.434SS*.THydrogen-bonded Turntrans-70.8-26.2179.1-69.1176.5-20.400112.6
248T92Very high91.3Very high104 Ų10480.4 Ų80.464%0.63843%0.425SS*.THydrogen-bonded Turntrans-76.6-38.6-177.8-45.90000113.3C246 H266C246-T248 VanDerWaalsContact C-N 3.29Å; C246-T248 PolarHBondContact O-N 2.78Å; C246-T248 PolarHBondContact SG-N 3.24Å; T248-H266 HydrophobicContact CG2-CB 4.34Å
249C94.5Very high91.5Very high53 Ų5378.6 Ų78.636%0.35842%0.417SS..THydrogen-bonded Turntrans-126.55.8-176.470.20000114.9K251 H262 H266C249-K251 PolarHBondContact O-N 3.42Å; C249-K251 VanDerWaalsContact SG-CG 3.54Å; C249-H262 VanDerWaalsContact SG-CE1 3.6Å; C249-H262 PolarHBondContact SG-NE2 3.36Å; C249-H266 PolarHBondContact SG-NE2 2.97Å
250G92.5Very high91.8Very high55 Ų5579.4 Ų79.457%0.56742%0.419SS*.  trans69.9-6-178.400000115.4C246 A252C246-G250 WeakPolarHBondContact O-CA 3.35Å; C246-G250 PolarHBondContact O-N 3.06Å; G250-A252 PolarHBondContact O-N 2.9Å
251K93.6Very high92.2Very high124 Ų12473.2 Ų73.254%0.53939%0.392SS..  trans-63.3129.6-178.7-71.7-177.3-168.3-63.90111.1C246 C249 F253C246-K251 WeakPolarHBondContact CB-O 3.19Å; C246-K251 PolarHBondContact N-O 3.23Å; C249-K251 PolarHBondContact O-N 3.42Å; C249-K251 VanDerWaalsContact SG-CG 3.54Å; K251-F253 HydrophobicContact CB-CE2 3.99Å; K251-F253 HydrophobicContact CB-CZ 4.11Å; K251-F253 WeakPolarHBondContact O-CE2 3.42Å
252A93Very high92.5Very high27 Ų2768.9 Ų68.922%0.22337%0.372CS..EExtended strand (participates in β ladder)trans-104143.3-178.900000112.1K242 H244 K245 G250K242-A252 HydrophobicContact CB-CB 3.38Å; K242-A252 HydrophobicContact CD-CB 3.98Å; K242-A252 WeakPolarHBondContact CD-O 3.38Å; K242-A252 HydrophobicContact CG-CB 4.3Å; H244-A252 CarbonylContact O-C 3.53Å; H244-A252 WeakPolarHBondContact O-CA 3.49Å; K245-A252 HydrophobicContact CG-CB 3.79Å; G250-A252 PolarHBondContact O-N 2.9Å
253F91.6Very high92.8Very high46 Ų4664.9 Ų64.920%0.20236%0.356CS..EExtended strand (participates in β ladder)trans-129151.4-177.8-57.8-88.8000111.5K242 H244 C246 K251 R255 T258 L259 H262K242-F253 CarbonylContact C-O 3.53Å; K242-F253 WeakPolarHBondContact CA-O 2.91Å; H244-F253 HydrophobicContact CB-CB 4.37Å; H244-F253 WeakPolarHBondContact CB-O 3.36Å; H244-F253 PolarHBondContact N-O 2.03Å; H244-F253 PolarHBondContact O-N 3.1Å; C246-F253 HydrophobicContact CB-CE2 4.46Å; K251-F253 HydrophobicContact CB-CE2 3.99Å; K251-F253 HydrophobicContact CB-CZ 4.11Å; K251-F253 WeakPolarHBondContact O-CE2 3.42Å; F253-R255 VanDerWaalsContact C-N 3.32Å; F253-T258 WeakPolarHBondContact CB-OG1 3.3Å; F253-L259 HydrophobicContact CB-CB 4.45Å; F253-L259 HydrophobicContact CD2-CB 3.97Å; F253-L259 HydrophobicContact CD2-CD1 3.8Å; F253-L259 HydrophobicContact CD2-CG 4.49Å; F253-L259 HydrophobicContact CE2-CD1 3.96Å; F253-L259 HydrophobicContact CG-CB 4.42Å; F253-H262 HydrophobicContact CE1-CB 4.16Å; F253-H262 HydrophobicContact CE2-CB 3.89Å; F253-H262 AromaticContact CE2-CD2 3.35Å; F253-H262 WeakPolarHBondContact CE2-CD2 3.49Å; F253-H262 AromaticContact CE2-CG 3.58Å; F253-H262 AromaticContact CE2-NE2 3.93Å; F253-H262 HydrophobicContact CZ-CB 3.53Å; F253-H262 AromaticContact CZ-CD2 3.53Å; F253-H262 AromaticContact CZ-CG 3.27Å; F253-H262 AromaticContact CZ-ND1 3.67Å
254N91.3Very high93.2Very high62 Ų6264.4 Ų64.433%0.33235%0.345SS..SBendtrans-82.4-8.717662.97.5000113.5I236I236-N254 HydrophobicContact CG2-CB 4Å
255R91.1Very high93.3Very high105 Ų10567 Ų6740%0.39636%0.359SS..  trans-135.2138.2178.9-64.2171.763.7172.21.6111.6F253 S257 T258 L259F253-R255 VanDerWaalsContact C-N 3.32Å; R255-S257 VanDerWaalsContact C-N 3.28Å; R255-S257 PolarHBondContact NE-OG 3.4Å; R255-S257 PolarHBondContact NH2-OG 3.5Å; R255-S257 PolarHBondContact O-N 3.38Å; R255-T258 HydrophobicContact CB-CG2 4.21Å; R255-T258 WeakPolarHBondContact CB-OG1 3.43Å; R255-T258 PolarHBondContact O-N 3.48Å; R255-T258 PolarHBondContact O-OG1 3.45Å; R255-L259 PolarHBondContact O-N 3.09Å; R255-L259 VanDerWaalsContact O-N 3.11Å
256S92.2Very high93.2Very high64 Ų6463.7 Ų63.745%0.44835%0.346SS..Hα-helixtrans-60.1-40.1172.457.10000111.6H244 T258 L259 N260H244-S256 PolarHBondContact CD2-N 2.94Å; H244-S256 PolarHBondContact NE2-N 3.14Å; S256-T258 VanDerWaalsContact C-N 3.28Å; S256-T258 PolarHBondContact O-N 3.4Å; S256-L259 WeakPolarHBondContact O-CB 3.43Å; S256-L259 PolarHBondContact O-N 2.75Å; S256-L259 VanDerWaalsContact O-N 3.16Å; S256-N260 PolarHBondContact O-N 3.29Å
257S91.8Very high93.2Very high50 Ų5069.7 Ų69.735%0.3538%0.377SS..Hα-helixtrans-60.1-37.3177.463.70000112.7R255 T261R255-S257 VanDerWaalsContact C-N 3.28Å; R255-S257 PolarHBondContact NE-OG 3.4Å; R255-S257 PolarHBondContact NH2-OG 3.5Å; R255-S257 PolarHBondContact O-N 3.38Å; S257-T261 WeakPolarHBondContact O-CG2 3.29Å; S257-T261 PolarHBondContact O-N 2.98Å; S257-T261 PolarHBondContact O-OG1 3.24Å
258T93.6Very high93.1Very high42 Ų4263.6 Ų63.626%0.25836%0.361SS..Hα-helixtrans-73.5-36.9177.148.70000111.7F253 R255 S256 T261 H262F253-T258 WeakPolarHBondContact CB-OG1 3.3Å; R255-T258 HydrophobicContact CB-CG2 4.21Å; R255-T258 WeakPolarHBondContact CB-OG1 3.43Å; R255-T258 PolarHBondContact O-N 3.48Å; R255-T258 PolarHBondContact O-OG1 3.45Å; S256-T258 VanDerWaalsContact C-N 3.28Å; S256-T258 PolarHBondContact O-N 3.4Å; T258-T261 WeakPolarHBondContact CA-OG1 3.45Å; T258-T261 PolarHBondContact O-N 3.11Å; T258-T261 PolarHBondContact O-OG1 3.36Å; T258-H262 VanDerWaalsContact O-CB 3.32Å; T258-H262 WeakPolarHBondContact O-CB 3.3Å; T258-H262 PolarHBondContact O-N 2.94Å
259L93.5Very high93.2Very high21 Ų2165.1 Ų65.111%0.1136%0.355CS..Hα-helixtrans-60.7-46.8171173.962000110.7H244 C246 F253 R255 S256 T261 H262 I263H244-L259 HydrophobicContact CB-CB 4.02Å; H244-L259 HydrophobicContact CB-CD2 3.81Å; C246-L259 HydrophobicContact CB-CD1 3.67Å; F253-L259 HydrophobicContact CB-CB 4.45Å; F253-L259 HydrophobicContact CD2-CB 3.97Å; F253-L259 HydrophobicContact CD2-CD1 3.8Å; F253-L259 HydrophobicContact CD2-CG 4.49Å; F253-L259 HydrophobicContact CE2-CD1 3.96Å; F253-L259 HydrophobicContact CG-CB 4.42Å; R255-L259 PolarHBondContact O-N 3.09Å; R255-L259 VanDerWaalsContact O-N 3.11Å; S256-L259 WeakPolarHBondContact O-CB 3.43Å; S256-L259 PolarHBondContact O-N 2.75Å; S256-L259 VanDerWaalsContact O-N 3.16Å; L259-T261 VanDerWaalsContact C-N 3.33Å; L259-T261 PolarHBondContact O-N 3.38Å; L259-H262 CarbonylContact O-C 3.57Å; L259-H262 WeakPolarHBondContact O-CA 3.39Å; L259-H262 WeakPolarHBondContact O-CB 3.42Å; L259-H262 PolarHBondContact O-N 3.09Å; L259-I263 HydrophobicContact CD1-CD1 4.03Å; L259-I263 HydrophobicContact CD1-CG1 4Å; L259-I263 HydrophobicContact CD2-CD1 4.46Å; L259-I263 HydrophobicContact CG-CD1 3.85Å; L259-I263 HydrophobicContact CG-CG1 4.3Å; L259-I263 WeakPolarHBondContact O-CG1 3.36Å; L259-I263 PolarHBondContact O-N 3.1Å
260N93.6Very high93.2Very high95 Ų9567 Ų6751%0.50836%0.357SS..Hα-helixtrans-63-36.1178.2-73.2-8.7000113S256 H262 R264S256-N260 PolarHBondContact O-N 3.29Å; N260-H262 VanDerWaalsContact C-N 3.28Å; N260-R264 PolarHBondContact O-NE 2.85Å
261T93.5Very high93.2Very high27 Ų2766.5 Ų66.517%0.16635%0.345CS..Hα-helixtrans-67.8-30.9170.953.50000112.7S257 T258 L259 Q283S257-T261 WeakPolarHBondContact O-CG2 3.29Å; S257-T261 PolarHBondContact O-N 2.98Å; S257-T261 PolarHBondContact O-OG1 3.24Å; T258-T261 WeakPolarHBondContact CA-OG1 3.45Å; T258-T261 PolarHBondContact O-N 3.11Å; T258-T261 PolarHBondContact O-OG1 3.36Å; L259-T261 VanDerWaalsContact C-N 3.33Å; L259-T261 PolarHBondContact O-N 3.38Å; T261-Q283 HydrophobicContact CG2-CG 4.04Å
262H94.6Very high93.3Very high20 Ų2063.3 Ų63.39%0.09333%0.331CS..Hα-helixtrans-76.7-41.1179.7165.972.8000112.2C246 C249 F253 T258 L259 N260 R264 I265 H266C246-H262 PolarHBondContact SG-NE2 3.36Å; C249-H262 VanDerWaalsContact SG-CE1 3.6Å; C249-H262 PolarHBondContact SG-NE2 3.36Å; F253-H262 HydrophobicContact CE1-CB 4.16Å; F253-H262 HydrophobicContact CE2-CB 3.89Å; F253-H262 AromaticContact CE2-CD2 3.35Å; F253-H262 WeakPolarHBondContact CE2-CD2 3.49Å; F253-H262 AromaticContact CE2-CG 3.58Å; F253-H262 AromaticContact CE2-NE2 3.93Å; F253-H262 HydrophobicContact CZ-CB 3.53Å; F253-H262 AromaticContact CZ-CD2 3.53Å; F253-H262 AromaticContact CZ-CG 3.27Å; F253-H262 AromaticContact CZ-ND1 3.67Å; T258-H262 VanDerWaalsContact O-CB 3.32Å; T258-H262 WeakPolarHBondContact O-CB 3.3Å; T258-H262 PolarHBondContact O-N 2.94Å; L259-H262 CarbonylContact O-C 3.57Å; L259-H262 WeakPolarHBondContact O-CA 3.39Å; L259-H262 WeakPolarHBondContact O-CB 3.42Å; L259-H262 PolarHBondContact O-N 3.09Å; N260-H262 VanDerWaalsContact C-N 3.28Å; H262-R264 PolarHBondContact O-N 2.89Å; H262-R264 VanDerWaalsContact O-N 3.16Å; H262-I265 WeakPolarHBondContact O-CB 3.33Å; H262-I265 WeakPolarHBondContact O-CG1 3.34Å; H262-I265 PolarHBondContact O-N 3.48Å; H262-H266 AromaticContact CE1-NE2 3.49Å; H262-H266 PolarHBondContact CE1-NE2 3.12Å; H262-H266 AromaticContact NE2-CD2 3.81Å; H262-H266 AromaticContact NE2-NE2 3.22Å; H262-H266 PolarHBondContact NE2-NE2 3.19Å
263I94.8Very high93.5Very high37 Ų3765.6 Ų65.619%0.1934%0.342CS..Hα-helixtrans-55.9-34.1175.8-68.8166.2000111.1L259 I265 H266 L267L259-I263 HydrophobicContact CD1-CD1 4.03Å; L259-I263 HydrophobicContact CD1-CG1 4Å; L259-I263 HydrophobicContact CD2-CD1 4.46Å; L259-I263 HydrophobicContact CG-CD1 3.85Å; L259-I263 HydrophobicContact CG-CG1 4.3Å; L259-I263 WeakPolarHBondContact O-CG1 3.36Å; L259-I263 PolarHBondContact O-N 3.1Å; I263-I265 PolarHBondContact O-N 3.48Å; I263-I265 VanDerWaalsContact O-N 3.11Å; I263-H266 WeakPolarHBondContact O-CB 3.47Å; I263-H266 PolarHBondContact O-N 3.23Å; I263-L267 HydrophobicContact CG2-CD1 4.06Å; I263-L267 HydrophobicContact CG2-CG 4.31Å; I263-L267 PolarHBondContact O-N 3.41Å; I263-L267 VanDerWaalsContact O-N 3.13Å
264R95.1Very high93.6Very high59 Ų5963.4 Ų63.422%0.22333%0.332CS..Hα-helixtrans-58.9-21.9174.2-72.3-175.1-102.8171.9-6.6114.4N260 H262 G268 Y269 H282N260-R264 PolarHBondContact O-NE 2.85Å; H262-R264 PolarHBondContact O-N 2.89Å; H262-R264 VanDerWaalsContact O-N 3.16Å; R264-G268 CarbonylContact O-C 3.55Å; R264-G268 PolarHBondContact O-N 3.23Å; R264-Y269 HydrophobicContact CG-CD1 4.05Å; R264-Y269 PolarHBondContact O-N 3.47Å; R264-H282 HydrophobicContact CB-CB 4.45Å; R264-H282 PolarHBondContact NH1-O 2.69Å; R264-H282 PolarHBondContact O-CE1 2.72Å; R264-H282 PolarHBondContact O-ND1 3.2Å
265I93.9Very high93.7Very high95 Ų9568.4 Ų68.449%0.48735%0.354SS..Hα-helixtrans-71.5-45.5174.1-58171.9000109.6H262 I263 L267 G268H262-I265 WeakPolarHBondContact O-CB 3.33Å; H262-I265 WeakPolarHBondContact O-CG1 3.34Å; H262-I265 PolarHBondContact O-N 3.48Å; I263-I265 PolarHBondContact O-N 3.48Å; I263-I265 VanDerWaalsContact O-N 3.11Å; I265-L267 VanDerWaalsContact C-N 3.32Å; I265-L267 PolarHBondContact O-N 3.4Å; I265-G268 PolarHBondContact O-N 2.92Å; I265-G268 VanDerWaalsContact O-N 3.09Å
266H93.7Very high93.7Very high76 Ų7669.9 Ų69.935%0.35236%0.363SS..Hα-helixtrans-63.5-38.2177.8-67.1-58.6000112.5T248 C249 H262 I263 G268T248-H266 HydrophobicContact CG2-CB 4.34Å; C249-H266 PolarHBondContact SG-NE2 2.97Å; H262-H266 AromaticContact CE1-NE2 3.49Å; H262-H266 PolarHBondContact CE1-NE2 3.12Å; H262-H266 AromaticContact NE2-CD2 3.81Å; H262-H266 AromaticContact NE2-NE2 3.22Å; H262-H266 PolarHBondContact NE2-NE2 3.19Å; I263-H266 WeakPolarHBondContact O-CB 3.47Å; I263-H266 PolarHBondContact O-N 3.23Å; H266-G268 PolarHBondContact O-N 3.2Å
267L93Very high93.7Very high130 Ų13069.9 Ų69.968%0.68136%0.363SS*.THydrogen-bonded Turntrans-77.2-5.2176.8-60.1177000113.4I263 I265 Y269I263-L267 HydrophobicContact CG2-CD1 4.06Å; I263-L267 HydrophobicContact CG2-CG 4.31Å; I263-L267 PolarHBondContact O-N 3.41Å; I263-L267 VanDerWaalsContact O-N 3.13Å; I265-L267 VanDerWaalsContact C-N 3.32Å; I265-L267 PolarHBondContact O-N 3.4Å; L267-Y269 PolarHBondContact O-N 3.03Å
268G92.7Very high93.8Very high44 Ų4470.1 Ų70.145%0.45437%0.373SS..THydrogen-bonded Turntrans61.47-168.500000114.1R264 I265 H266 K270R264-G268 CarbonylContact O-C 3.55Å; R264-G268 PolarHBondContact O-N 3.23Å; I265-G268 PolarHBondContact O-N 2.92Å; I265-G268 VanDerWaalsContact O-N 3.09Å; H266-G268 PolarHBondContact O-N 3.2Å; G268-K270 PolarHBondContact O-N 2.98Å
269Y93Very high93.9Very high135 Ų13574 Ų7453%0.52939%0.386SS..  trans-76.4118.7-169.5-177.3-120000112.1R264 L267 P271 H282R264-Y269 HydrophobicContact CG-CD1 4.05Å; R264-Y269 PolarHBondContact O-N 3.47Å; L267-Y269 PolarHBondContact O-N 3.03Å; Y269-P271 HydrophobicContact CD1-CG 4.36Å; Y269-P271 HydrophobicContact CE1-CB 3.78Å; Y269-P271 HydrophobicContact CE1-CG 3.96Å; Y269-P271 WeakPolarHBondContact O-CD 3.4Å; Y269-H282 PolarHBondContact O-ND1 3.37Å
270K94.8Very high93.9Very high92 Ų9273.8 Ų73.840%0.439%0.389SS..  trans-121.284.3-176-69.6160.9-179.3-66.50109.5G268 F272 G280 F281 H282G268-K270 PolarHBondContact O-N 2.98Å; K270-F272 PolarHBondContact O-N 2.93Å; K270-F272 VanDerWaalsContact O-N 3.17Å; K270-G280 WeakPolarHBondContact CD-O 3.45Å; K270-G280 PolarHBondContact NZ-O 2.76Å; K270-F281 CarbonylContact C-O 3.5Å; K270-F281 WeakPolarHBondContact CA-O 3.42Å; K270-H282 VanDerWaalsContact CG-CE1 3.44Å; K270-H282 WeakPolarHBondContact CG-CE1 3.47Å; K270-H282 PolarHBondContact NZ-NE2 2.96Å; K270-H282 VanDerWaalsContact NZ-NE2 3.2Å
271P92.9Very high94Very high46 Ų4670.8 Ų70.830%0.29937%0.372SS..  trans-67.3-16.5-174.323.8-32.2000114Y269Y269-P271 HydrophobicContact CD1-CG 4.36Å; Y269-P271 HydrophobicContact CE1-CB 3.78Å; Y269-P271 HydrophobicContact CE1-CG 3.96Å; Y269-P271 WeakPolarHBondContact O-CD 3.4Å
272F96.4Very high94Very high56 Ų5671.4 Ų71.425%0.24637%0.372CS..EExtended strand (participates in β ladder)trans-111.8103.5-179-51.9-74.5000109.4K270 G280 F281 Q283 K284 Y287K270-F272 PolarHBondContact O-N 2.93Å; K270-F272 VanDerWaalsContact O-N 3.17Å; F272-G280 CarbonylContact O-C 3.55Å; F272-G280 WeakPolarHBondContact O-CA 3.31Å; F272-F281 HydrophobicContact CB-CB 4.37Å; F272-F281 PolarHBondContact N-O 3.11Å; F272-F281 PolarHBondContact O-N 3.4Å; F272-Q283 VanDerWaalsContact CD2-C 3.44Å; F272-K284 HydrophobicContact CD1-CB 4.36Å; F272-K284 HydrophobicContact CD1-CG 4.39Å; F272-K284 HydrophobicContact CD2-CB 4.39Å; F272-K284 HydrophobicContact CE1-CB 3.85Å; F272-K284 HydrophobicContact CE1-CD 4.3Å; F272-K284 HydrophobicContact CE1-CG 3.98Å; F272-K284 HydrophobicContact CE2-CB 3.89Å; F272-K284 HydrophobicContact CZ-CB 3.61Å; F272-K284 HydrophobicContact CZ-CG 4.24Å; F272-Y287 HydrophobicContact CB-CD1 3.91Å; F272-Y287 HydrophobicContact CB-CD2 4.28Å; F272-Y287 HydrophobicContact CB-CG 3.64Å; F272-Y287 HydrophobicContact CD1-CD1 4.35Å; F272-Y287 HydrophobicContact CG-CD1 4.42Å; F272-Y287 HydrophobicContact CG-CG 4.47Å
273V95.9Very high94.1Very high75 Ų7574.5 Ų74.546%0.45539%0.387SS..EExtended strand (participates in β ladder)trans-105.8135.5179.2-177.30000108.8G278V273-G278 WeakPolarHBondContact CG1-O 3.39Å
274C94.8Very high94Very high1 Ų179.9 Ų79.91%0.00741%0.409CS..  trans-77.4120.3171.8-1750000110.6F276 C277 G278 K279 Y287 H290 H294C274-F276 VanDerWaalsContact C-N 3.26Å; C274-F276 PolarHBondContact O-N 3.18Å; C274-C277 PolarHBondContact O-N 3.21Å; C274-G278 WeakPolarHBondContact O-CA 3.47Å; C274-G278 PolarHBondContact O-N 3.22Å; C274-K279 PolarHBondContact N-O 3.09Å; C274-Y287 HydrophobicContact CB-CE2 4.05Å; C274-H290 WeakPolarHBondContact CB-NE2 3.38Å; C274-H290 PolarHBondContact SG-NE2 3.16Å; C274-H294 PolarHBondContact SG-CD2 3.22Å; C274-H294 PolarHBondContact SG-NE2 3.45Å
275E93Very high93.8Very high167 Ų16779.4 Ų79.478%0.7842%0.422SS*.THydrogen-bonded Turntrans-64-30.9178.7-68163.1-169.600112.4
276F90.2Very high93.8Very high135 Ų13579.1 Ų79.159%0.59242%0.421SS*.THydrogen-bonded Turntrans-76.8-29.8-178.4-62.8-72.2000114.5C274 H294C274-F276 VanDerWaalsContact C-N 3.26Å; C274-F276 PolarHBondContact O-N 3.18Å; F276-H294 HydrophobicContact CD2-CB 4.43Å
277C94Very high93.8Very high65 Ų6577.5 Ų77.544%0.43941%0.412SS..THydrogen-bonded Turntrans-134.55.7-175.170.10000115C274 K279 H290 H294C274-C277 PolarHBondContact O-N 3.21Å; C277-K279 PolarHBondContact O-N 2.72Å; C277-K279 VanDerWaalsContact SG-CB 3.54Å; C277-H290 PolarHBondContact SG-NE2 3.33Å; C277-H294 PolarHBondContact SG-NE2 3.37Å
278G93.4Very high93.8Very high55 Ų5578.3 Ų78.357%0.56741%0.411SS*.  trans68.21-178.800000115.3V273 C274 G280V273-G278 WeakPolarHBondContact CG1-O 3.39Å; C274-G278 WeakPolarHBondContact O-CA 3.47Å; C274-G278 PolarHBondContact O-N 3.22Å; G278-G280 PolarHBondContact O-N 3.05Å
279K95Very high93.6Very high124 Ų12478.1 Ų78.154%0.53940%0.399SS..  trans-72.4123.1-174.2-164.4168.7-174.5172.60111.7C274 C277 F281C274-K279 PolarHBondContact N-O 3.09Å; C277-K279 PolarHBondContact O-N 2.72Å; C277-K279 VanDerWaalsContact SG-CB 3.54Å; K279-F281 HydrophobicContact CB-CE2 4.06Å; K279-F281 HydrophobicContact CB-CZ 4.32Å; K279-F281 HydrophobicContact CD-CE2 4.48Å; K279-F281 HydrophobicContact CD-CZ 3.92Å; K279-F281 HydrophobicContact CG-CE2 4Å; K279-F281 HydrophobicContact CG-CZ 3.89Å; K279-F281 WeakPolarHBondContact O-CD2 3.44Å; K279-F281 VanDerWaalsContact O-CE2 3.24Å; K279-F281 WeakPolarHBondContact O-CE2 3.5Å
280G94.6Very high93.5Very high16 Ų1672.9 Ų72.917%0.16538%0.38CS..EExtended strand (participates in β ladder)trans-95139.8179.700000115K270 F272 G278K270-G280 WeakPolarHBondContact CD-O 3.45Å; K270-G280 PolarHBondContact NZ-O 2.76Å; F272-G280 CarbonylContact O-C 3.55Å; F272-G280 WeakPolarHBondContact O-CA 3.31Å; G278-G280 PolarHBondContact O-N 3.05Å
281F95.2Very high93.3Very high32 Ų3272.3 Ų72.314%0.1438%0.377CS..EExtended strand (participates in β ladder)trans-125.3143.7-178.1-59.5-92.7000112.4K270 F272 K279 N286 Y287 H290K270-F281 CarbonylContact C-O 3.5Å; K270-F281 WeakPolarHBondContact CA-O 3.42Å; F272-F281 HydrophobicContact CB-CB 4.37Å; F272-F281 PolarHBondContact N-O 3.11Å; F272-F281 PolarHBondContact O-N 3.4Å; K279-F281 HydrophobicContact CB-CE2 4.06Å; K279-F281 HydrophobicContact CB-CZ 4.32Å; K279-F281 HydrophobicContact CD-CE2 4.48Å; K279-F281 HydrophobicContact CD-CZ 3.92Å; K279-F281 HydrophobicContact CG-CE2 4Å; K279-F281 HydrophobicContact CG-CZ 3.89Å; K279-F281 WeakPolarHBondContact O-CD2 3.44Å; K279-F281 VanDerWaalsContact O-CE2 3.24Å; K279-F281 WeakPolarHBondContact O-CE2 3.5Å; F281-N286 HydrophobicContact CD1-CB 3.98Å; F281-Y287 AromaticContact CD2-CD2 3.97Å; F281-Y287 HydrophobicContact CD2-CD2 3.97Å; F281-Y287 HydrophobicContact CE2-CD2 4.34Å; F281-H290 HydrophobicContact CE1-CB 3.89Å; F281-H290 HydrophobicContact CE2-CB 3.86Å; F281-H290 AromaticContact CE2-CD2 3.24Å; F281-H290 WeakPolarHBondContact CE2-CD2 3.48Å; F281-H290 AromaticContact CE2-CG 3.6Å; F281-H290 AromaticContact CE2-NE2 3.97Å; F281-H290 HydrophobicContact CZ-CB 3.36Å; F281-H290 AromaticContact CZ-CD2 3.36Å; F281-H290 WeakPolarHBondContact CZ-CD2 3.38Å; F281-H290 AromaticContact CZ-CG 3.21Å; F281-H290 AromaticContact CZ-ND1 3.88Å
282H94.2Very high93.1Very high40 Ų4072.3 Ų72.319%0.18537%0.374CS..SBendtrans-80.3-15.4176.7-54.5-74.2000113.3R264 Y269 K270R264-H282 HydrophobicContact CB-CB 4.45Å; R264-H282 PolarHBondContact NH1-O 2.69Å; R264-H282 PolarHBondContact O-CE1 2.72Å; R264-H282 PolarHBondContact O-ND1 3.2Å; Y269-H282 PolarHBondContact O-ND1 3.37Å; K270-H282 VanDerWaalsContact CG-CE1 3.44Å; K270-H282 WeakPolarHBondContact CG-CE1 3.47Å; K270-H282 PolarHBondContact NZ-NE2 2.96Å; K270-H282 VanDerWaalsContact NZ-NE2 3.2Å
283Q94.8Very high92.7Very high84 Ų8472.9 Ų72.939%0.39338%0.382SS..SBendtrans-134.5141.3-176.4-63.7-172.42400111.8T261 F272 G285 N286 Y287T261-Q283 HydrophobicContact CG2-CG 4.04Å; F272-Q283 VanDerWaalsContact CD2-C 3.44Å; Q283-G285 VanDerWaalsContact C-N 3.33Å; Q283-G285 PolarHBondContact O-N 3.3Å; Q283-N286 PolarHBondContact O-N 2.75Å; Q283-Y287 PolarHBondContact O-N 3.32Å; Q283-Y287 VanDerWaalsContact O-N 3.11Å
284K93.7Very high92.3Very high151 Ų15172.9 Ų72.966%0.65738%0.376SS*.Hα-helixtrans-61.8-38.7-179.1-169.7174.2-179.4175.10112.6F272 Y287 K288F272-K284 HydrophobicContact CD1-CB 4.36Å; F272-K284 HydrophobicContact CD1-CG 4.39Å; F272-K284 HydrophobicContact CD2-CB 4.39Å; F272-K284 HydrophobicContact CE1-CB 3.85Å; F272-K284 HydrophobicContact CE1-CD 4.3Å; F272-K284 HydrophobicContact CE1-CG 3.98Å; F272-K284 HydrophobicContact CE2-CB 3.89Å; F272-K284 HydrophobicContact CZ-CB 3.61Å; F272-K284 HydrophobicContact CZ-CG 4.24Å; K284-Y287 PolarHBondContact O-N 2.89Å; K284-K288 WeakPolarHBondContact O-CB 3.2Å; K284-K288 PolarHBondContact O-N 3.06Å
285G91.2Very high91.8Very high48 Ų4876.8 Ų76.850%0.49540%0.397SS..Hα-helixtrans-62.6-43.1178.400000112.5Q283 K288 N289Q283-G285 VanDerWaalsContact C-N 3.33Å; Q283-G285 PolarHBondContact O-N 3.3Å; G285-K288 PolarHBondContact O-N 3.37Å; G285-N289 WeakPolarHBondContact O-CB 3.49Å; G285-N289 PolarHBondContact O-N 3.06Å
286N93.3Very high91.1Very high89 Ų8971 Ų7148%0.47638%0.383SS..Hα-helixtrans-66.4-40.5177.4-65.12.4000111.3F281 Q283 H290F281-N286 HydrophobicContact CD1-CB 3.98Å; Q283-N286 PolarHBondContact O-N 2.75Å; N286-H290 WeakPolarHBondContact O-CB 3.43Å; N286-H290 PolarHBondContact O-N 3.24Å
287Y94Very high90.6Very high42 Ų4269.7 Ų69.717%0.16538%0.379CS..Hα-helixtrans-61.6-49.3173.2170.6-120.1000112.4F272 C274 F281 Q283 K284 N289 H290 K291F272-Y287 HydrophobicContact CB-CD1 3.91Å; F272-Y287 HydrophobicContact CB-CD2 4.28Å; F272-Y287 HydrophobicContact CB-CG 3.64Å; F272-Y287 HydrophobicContact CD1-CD1 4.35Å; F272-Y287 HydrophobicContact CG-CD1 4.42Å; F272-Y287 HydrophobicContact CG-CG 4.47Å; C274-Y287 HydrophobicContact CB-CE2 4.05Å; F281-Y287 AromaticContact CD2-CD2 3.97Å; F281-Y287 HydrophobicContact CD2-CD2 3.97Å; F281-Y287 HydrophobicContact CE2-CD2 4.34Å; Q283-Y287 PolarHBondContact O-N 3.32Å; Q283-Y287 VanDerWaalsContact O-N 3.11Å; K284-Y287 PolarHBondContact O-N 2.89Å; Y287-N289 VanDerWaalsContact C-N 3.3Å; Y287-N289 PolarHBondContact O-N 3.49Å; Y287-H290 WeakPolarHBondContact O-CB 3.47Å; Y287-H290 PolarHBondContact O-N 3.06Å; Y287-H290 VanDerWaalsContact O-N 3.12Å; Y287-K291 PolarHBondContact O-N 2.89Å
288K92Very high90.2Very high148 Ų14871.5 Ų71.564%0.64338%0.379SS*.Hα-helixtrans-56.4-47177.8-177.5179.9179-179.10110.8K284 G285 H290 K291 M292K284-K288 WeakPolarHBondContact O-CB 3.2Å; K284-K288 PolarHBondContact O-N 3.06Å; G285-K288 PolarHBondContact O-N 3.37Å; K288-H290 VanDerWaalsContact C-N 3.34Å; K288-H290 PolarHBondContact O-N 2.8Å; K288-K291 PolarHBondContact O-N 3.24Å; K288-M292 WeakPolarHBondContact O-CG 2.95Å; K288-M292 PolarHBondContact O-N 3.48Å
289N89.7Confident89.8Confident40 Ų4072.5 Ų72.521%0.21438%0.382CS..Hα-helixtrans-62.2-42177.4178.755000112.6G285 Y287 K291 M292 Q311G285-N289 WeakPolarHBondContact O-CB 3.49Å; G285-N289 PolarHBondContact O-N 3.06Å; Y287-N289 VanDerWaalsContact C-N 3.3Å; Y287-N289 PolarHBondContact O-N 3.49Å; N289-K291 VanDerWaalsContact C-N 3.32Å; N289-K291 PolarHBondContact O-N 3.38Å; N289-M292 WeakPolarHBondContact O-CB 2.95Å; N289-M292 PolarHBondContact O-N 2.79Å; N289-Q311 PolarHBondContact ND2-NE2 2.89Å; N289-Q311 PolarHBondContact ND2-OE1 3.47Å; N289-Q311 VanDerWaalsContact ND2-OE1 3.09Å; N289-Q311 WeakPolarHBondContact OD1-CG 3Å; N289-Q311 PolarHBondContact OD1-NE2 2.89Å
290H91.4Very high89.6Confident25 Ų2570.1 Ų70.112%0.11637%0.372CS..Hα-helixtrans-62.4-39.7175.6169.560.7000112.1C274 C277 F281 N286 Y287 K288 M292 T293 H294C274-H290 WeakPolarHBondContact CB-NE2 3.38Å; C274-H290 PolarHBondContact SG-NE2 3.16Å; C277-H290 PolarHBondContact SG-NE2 3.33Å; F281-H290 HydrophobicContact CE1-CB 3.89Å; F281-H290 HydrophobicContact CE2-CB 3.86Å; F281-H290 AromaticContact CE2-CD2 3.24Å; F281-H290 WeakPolarHBondContact CE2-CD2 3.48Å; F281-H290 AromaticContact CE2-CG 3.6Å; F281-H290 AromaticContact CE2-NE2 3.97Å; F281-H290 HydrophobicContact CZ-CB 3.36Å; F281-H290 AromaticContact CZ-CD2 3.36Å; F281-H290 WeakPolarHBondContact CZ-CD2 3.38Å; F281-H290 AromaticContact CZ-CG 3.21Å; F281-H290 AromaticContact CZ-ND1 3.88Å; N286-H290 WeakPolarHBondContact O-CB 3.43Å; N286-H290 PolarHBondContact O-N 3.24Å; Y287-H290 WeakPolarHBondContact O-CB 3.47Å; Y287-H290 PolarHBondContact O-N 3.06Å; Y287-H290 VanDerWaalsContact O-N 3.12Å; K288-H290 VanDerWaalsContact C-N 3.34Å; K288-H290 PolarHBondContact O-N 2.8Å; H290-M292 PolarHBondContact O-N 3.16Å; H290-T293 WeakPolarHBondContact O-CB 3.42Å; H290-T293 PolarHBondContact O-N 3.3Å; H290-T293 PolarHBondContact O-OG1 3.18Å; H290-H294 AromaticContact CE1-NE2 3.41Å; H290-H294 PolarHBondContact CE1-NE2 3.04Å; H290-H294 AromaticContact NE2-CD2 3.91Å; H290-H294 AromaticContact NE2-NE2 3.23Å; H290-H294 PolarHBondContact NE2-NE2 3.01Å
291K90.6Very high89.5Confident79 Ų7976.4 Ų76.434%0.34340%0.395SS..Hα-helixtrans-58.5-33.7177.4-169.2172176.5170.30112.2Y287 K288 N289 T293 H294Y287-K291 PolarHBondContact O-N 2.89Å; K288-K291 PolarHBondContact O-N 3.24Å; N289-K291 VanDerWaalsContact C-N 3.32Å; N289-K291 PolarHBondContact O-N 3.38Å; K291-T293 PolarHBondContact O-N 3.12Å; K291-H294 PolarHBondContact O-N 2.77Å; K291-H294 VanDerWaalsContact O-N 3.13Å
292M88.7Confident89.4Confident47 Ų4774.9 Ų74.923%0.23239%0.388CS..Hα-helixtrans-62.7-21.4175.1-55.5-56-6400113.5K288 N289 H290 H294 E297 H310K288-M292 WeakPolarHBondContact O-CG 2.95Å; K288-M292 PolarHBondContact O-N 3.48Å; N289-M292 WeakPolarHBondContact O-CB 2.95Å; N289-M292 PolarHBondContact O-N 2.79Å; H290-M292 PolarHBondContact O-N 3.16Å; M292-H294 VanDerWaalsContact C-N 3.32Å; M292-E297 HydrophobicContact CE-CB 3.74Å; M292-E297 WeakPolarHBondContact CE-OE2 3.38Å; M292-H310 PolarHBondContact O-CE1 2.64Å; M292-H310 PolarHBondContact O-ND1 3.49Å
293T86.7Confident89.4Confident67 Ų6780 Ų8041%0.41141%0.412SS..Hα-helixtrans-75.5-23.2177.570.40000112.5H290 K291H290-T293 WeakPolarHBondContact O-CB 3.42Å; H290-T293 PolarHBondContact O-N 3.3Å; H290-T293 PolarHBondContact O-OG1 3.18Å; K291-T293 PolarHBondContact O-N 3.12Å
294H87.5Confident89.2Confident75 Ų7580.3 Ų80.335%0.34742%0.415SS..Hα-helixtrans-80.6-42.5176.8-68.4-58.6000112C274 F276 C277 H290 K291 M292 G296C274-H294 PolarHBondContact SG-CD2 3.22Å; C274-H294 PolarHBondContact SG-NE2 3.45Å; F276-H294 HydrophobicContact CD2-CB 4.43Å; C277-H294 PolarHBondContact SG-NE2 3.37Å; H290-H294 AromaticContact CE1-NE2 3.41Å; H290-H294 PolarHBondContact CE1-NE2 3.04Å; H290-H294 AromaticContact NE2-CD2 3.91Å; H290-H294 AromaticContact NE2-NE2 3.23Å; H290-H294 PolarHBondContact NE2-NE2 3.01Å; K291-H294 PolarHBondContact O-N 2.77Å; K291-H294 VanDerWaalsContact O-N 3.13Å; M292-H294 VanDerWaalsContact C-N 3.32Å; H294-G296 PolarHBondContact O-N 3.49Å; H294-G296 VanDerWaalsContact O-N 3.16Å
295N84Confident89.2Confident83 Ų8375.3 Ų75.344%0.44440%0.399SS..SBendtrans-69.5-10.6179.1-69.824000113.3E297N295-E297 HydrophobicContact CB-CB 4.3Å; N295-E297 HydrophobicContact CB-CG 4.02Å; N295-E297 PolarHBondContact ND2-OE1 2.86Å; N295-E297 VanDerWaalsContact ND2-OE1 3.14Å; N295-E297 PolarHBondContact O-N 3.32Å
296G78.7Confident89.1Confident47 Ų4779.8 Ų79.849%0.48541%0.407SS..  trans66.9-4.3-172.900000114.6H294 K298H294-G296 PolarHBondContact O-N 3.49Å; H294-G296 VanDerWaalsContact O-N 3.16Å; G296-K298 PolarHBondContact O-N 3.16Å
297E79.5Confident89.1Confident106 Ų10681.6 Ų81.650%0.49541%0.41SS..  trans-63.1107.1-179-74.5173.2-13800111.3M292 N295 H310M292-E297 HydrophobicContact CE-CB 3.74Å; M292-E297 WeakPolarHBondContact CE-OE2 3.38Å; N295-E297 HydrophobicContact CB-CB 4.3Å; N295-E297 HydrophobicContact CB-CG 4.02Å; N295-E297 PolarHBondContact ND2-OE1 2.86Å; N295-E297 VanDerWaalsContact ND2-OE1 3.14Å; N295-E297 PolarHBondContact O-N 3.32Å; E297-H310 PolarHBondContact O-ND1 3.16Å
298K85.9Confident88.9Confident103 Ų10380.9 Ų80.945%0.44841%0.413SS..  trans-107.384.1175.3-71.2165.9167.3-175.20109.2G296 F300 A308 F309 H310G296-K298 PolarHBondContact O-N 3.16Å; K298-F300 PolarHBondContact O-N 3.36Å; K298-A308 HydrophobicContact CB-CB 3.39Å; K298-A308 HydrophobicContact CD-CB 3.94Å; K298-A308 VanDerWaalsContact CD-O 3.3Å; K298-A308 WeakPolarHBondContact CD-O 3.43Å; K298-A308 HydrophobicContact CG-CB 4.25Å; K298-F309 CarbonylContact C-O 3.57Å; K298-F309 WeakPolarHBondContact CA-O 3.46Å; K298-H310 WeakPolarHBondContact CG-CE1 3.42Å
299A86Confident88.8Confident77 Ų7776 Ų7664%0.63639%0.392SS*.  trans-65.3-24.8-175.100000113.9F309A299-F309 PolarHBondContact N-O 3.17Å
300F90.5Very high88.8Confident73 Ų7376.4 Ų76.432%0.3239%0.392SS..EExtended strand (participates in β ladder)trans-103.7103.6-173-56.5-77000110.5K298 A308 F309 H310 Q311 I312 L315K298-F300 PolarHBondContact O-N 3.36Å; F300-A308 CarbonylContact O-C 3.46Å; F300-A308 WeakPolarHBondContact O-CA 3.47Å; F300-F309 PolarHBondContact N-O 3.34Å; F300-F309 VanDerWaalsContact N-O 3.14Å; F300-F309 PolarHBondContact O-N 2.82Å; F300-H310 WeakPolarHBondContact CE2-O 3.46Å; F300-Q311 VanDerWaalsContact CD2-C 3.48Å; F300-I312 HydrophobicContact CD1-CB 3.89Å; F300-I312 HydrophobicContact CD1-CD1 4.49Å; F300-I312 HydrophobicContact CD1-CG1 4.17Å; F300-I312 HydrophobicContact CE1-CB 3.74Å; F300-I312 HydrophobicContact CE1-CD1 4.22Å; F300-I312 HydrophobicContact CE1-CG1 4.22Å; F300-I312 HydrophobicContact CE2-CB 4.4Å; F300-I312 HydrophobicContact CG-CB 4.29Å; F300-I312 HydrophobicContact CZ-CB 4.01Å; F300-L315 HydrophobicContact CB-CB 4.13Å; F300-L315 HydrophobicContact CB-CD2 3.85Å
301K91.9Very high88.6Confident148 Ų14877.2 Ų77.264%0.64340%0.396SS*.EExtended strand (participates in β ladder)trans-99.2138.7-179.8-61.7-177.2-178.9178.40111.2A308K301-A308 HydrophobicContact CG-CB 3.9Å
302C93.5Very high88.6Confident1 Ų178.4 Ų78.41%0.00741%0.405CS..  trans-67.4128.8166.5177.70000109.7I304 C305 H306 K307 L315 H318 M319 H322C302-I304 VanDerWaalsContact C-N 3.28Å; C302-I304 PolarHBondContact O-N 3.42Å; C302-I304 PolarHBondContact SG-N 2.86Å; C302-C305 PolarHBondContact SG-N 3.33Å; C302-H306 WeakPolarHBondContact O-CA 3.48Å; C302-H306 PolarHBondContact O-N 3.16Å; C302-K307 WeakPolarHBondContact CB-O 3.49Å; C302-K307 PolarHBondContact N-O 2.94Å; C302-L315 HydrophobicContact CB-CD1 3.94Å; C302-H318 WeakPolarHBondContact CB-NE2 3.39Å; C302-H318 PolarHBondContact SG-NE2 3.2Å; C302-H318 VanDerWaalsContact SG-NE2 3.39Å; C302-M319 HydrophobicContact CB-CE 3.7Å; C302-M319 WeakPolarHBondContact SG-CE 3.24Å; C302-H322 PolarHBondContact SG-NE2 2.79Å
303H93.3Very high88.6Confident147 Ų14781.6 Ų81.668%0.68142%0.415SS*.THydrogen-bonded Turntrans-76.7-16.8176.869.183.3000112.9
304I91.1Very high88.8Confident90 Ų9081.2 Ų81.246%0.46241%0.411SS..THydrogen-bonded Turntrans-91-50.5-177.5-54.2176.5000111.8C302 H322C302-I304 VanDerWaalsContact C-N 3.28Å; C302-I304 PolarHBondContact O-N 3.42Å; C302-I304 PolarHBondContact SG-N 2.86Å; I304-H322 HydrophobicContact CD1-CB 3.55Å; I304-H322 WeakPolarHBondContact CG2-ND1 3.35Å
305C93.5Very high89Confident47 Ų4778.9 Ų78.932%0.31840%0.401SS..THydrogen-bonded Turntrans-116.27.7-17970.60000114.6C302 K307 H318 H322C302-C305 PolarHBondContact SG-N 3.33Å; C305-K307 PolarHBondContact O-N 3.29Å; C305-H318 PolarHBondContact SG-CE1 2.78Å; C305-H318 PolarHBondContact SG-NE2 2.7Å; C305-H322 PolarHBondContact SG-NE2 2.78Å; C305-H322 VanDerWaalsContact SG-NE2 3.41Å
306H90.2Very high89.3Confident142 Ų14278.5 Ų78.566%0.65740%0.402SS*.  trans59.57.4176-52.6-56.7000116.4C302 A308C302-H306 WeakPolarHBondContact O-CA 3.48Å; C302-H306 PolarHBondContact O-N 3.16Å; H306-A308 PolarHBondContact O-N 3.34Å
307K91.7Very high89.7Confident126 Ų12680.3 Ų80.355%0.54840%0.397SS..  trans-60.1131.1170.2-71.5-177.5-169.1-670110.1C302 C305 F309C302-K307 WeakPolarHBondContact CB-O 3.49Å; C302-K307 PolarHBondContact N-O 2.94Å; C305-K307 PolarHBondContact O-N 3.29Å; K307-F309 HydrophobicContact CB-CE2 3.89Å; K307-F309 HydrophobicContact CB-CZ 4.06Å; K307-F309 WeakPolarHBondContact O-CE2 3.41Å
308A90.8Very high90.2Very high27 Ų2776.4 Ų76.422%0.22338%0.378CS..EExtended strand (participates in β ladder)trans-105.5142.3-177.500000111.4K298 F300 K301 H306K298-A308 HydrophobicContact CB-CB 3.39Å; K298-A308 HydrophobicContact CD-CB 3.94Å; K298-A308 VanDerWaalsContact CD-O 3.3Å; K298-A308 WeakPolarHBondContact CD-O 3.43Å; K298-A308 HydrophobicContact CG-CB 4.25Å; F300-A308 CarbonylContact O-C 3.46Å; F300-A308 WeakPolarHBondContact O-CA 3.47Å; K301-A308 HydrophobicContact CG-CB 3.9Å; H306-A308 PolarHBondContact O-N 3.34Å
309F90.5Very high90.4Very high46 Ų4673 Ų7320%0.20236%0.364CS..EExtended strand (participates in β ladder)trans-129.3151.7-176.8-57.8-90.7000111K298 A299 F300 K307 Q311 N314 L315 H318K298-F309 CarbonylContact C-O 3.57Å; K298-F309 WeakPolarHBondContact CA-O 3.46Å; A299-F309 PolarHBondContact N-O 3.17Å; F300-F309 PolarHBondContact N-O 3.34Å; F300-F309 VanDerWaalsContact N-O 3.14Å; F300-F309 PolarHBondContact O-N 2.82Å; K307-F309 HydrophobicContact CB-CE2 3.89Å; K307-F309 HydrophobicContact CB-CZ 4.06Å; K307-F309 WeakPolarHBondContact O-CE2 3.41Å; F309-Q311 VanDerWaalsContact C-N 3.35Å; F309-N314 HydrophobicContact CB-CB 4.17Å; F309-N314 HydrophobicContact CD1-CB 3.89Å; F309-N314 HydrophobicContact CG-CB 4.25Å; F309-L315 HydrophobicContact CD2-CB 4.03Å; F309-L315 HydrophobicContact CD2-CD1 3.91Å; F309-L315 HydrophobicContact CE2-CD1 4.06Å; F309-L315 HydrophobicContact CG-CB 4.45Å; F309-H318 HydrophobicContact CE1-CB 4.14Å; F309-H318 HydrophobicContact CE2-CB 3.9Å; F309-H318 AromaticContact CE2-CD2 3.23Å; F309-H318 WeakPolarHBondContact CE2-CD2 3.45Å; F309-H318 AromaticContact CE2-CG 3.66Å; F309-H318 AromaticContact CE2-NE2 4Å; F309-H318 HydrophobicContact CZ-CB 3.5Å; F309-H318 AromaticContact CZ-CD2 3.4Å; F309-H318 WeakPolarHBondContact CZ-CD2 3.24Å; F309-H318 AromaticContact CZ-CG 3.34Å
310H88.2Confident90.5Very high48 Ų4871.3 Ų71.322%0.22234%0.343CS..SBendtrans-77.9-19.3176.1-58.2-69.6000113.3M292 E297 K298 F300M292-H310 PolarHBondContact O-CE1 2.64Å; M292-H310 PolarHBondContact O-ND1 3.49Å; E297-H310 PolarHBondContact O-ND1 3.16Å; K298-H310 WeakPolarHBondContact CG-CE1 3.42Å; F300-H310 WeakPolarHBondContact CE2-O 3.46Å
311Q88.6Confident90.3Very high42 Ų4271.9 Ų71.920%0.19635%0.353CS..SBendtrans-134.2139.6-175.8-61.9-176.9-72.700111.7N289 F300 F309 Y313 N314 L315N289-Q311 PolarHBondContact ND2-NE2 2.89Å; N289-Q311 PolarHBondContact ND2-OE1 3.47Å; N289-Q311 VanDerWaalsContact ND2-OE1 3.09Å; N289-Q311 WeakPolarHBondContact OD1-CG 3Å; N289-Q311 PolarHBondContact OD1-NE2 2.89Å; F300-Q311 VanDerWaalsContact CD2-C 3.48Å; F309-Q311 VanDerWaalsContact C-N 3.35Å; Q311-Y313 VanDerWaalsContact C-N 3.3Å; Q311-Y313 HydrophobicContact CB-CD1 3.71Å; Q311-Y313 HydrophobicContact CB-CE1 3.55Å; Q311-Y313 HydrophobicContact CB-CG 4.48Å; Q311-Y313 HydrophobicContact CG-CD1 4.47Å; Q311-Y313 HydrophobicContact CG-CE1 3.9Å; Q311-Y313 VanDerWaalsContact NE2-CE1 3.29Å; Q311-Y313 PolarHBondContact O-N 3.11Å; Q311-Y313 PolarHBondContact OE1-OH 3.13Å; Q311-N314 WeakPolarHBondContact O-CB 3.43Å; Q311-N314 PolarHBondContact O-N 3.01Å; Q311-N314 VanDerWaalsContact O-N 3.11Å; Q311-L315 PolarHBondContact O-N 3.09Å
312I90.2Very high90.1Very high104 Ų10468 Ų6853%0.53334%0.336SS..Hα-helixtrans-58.5-39.8179.3-167.6164.8000112.5F300 N314 L315 T316F300-I312 HydrophobicContact CD1-CB 3.89Å; F300-I312 HydrophobicContact CD1-CD1 4.49Å; F300-I312 HydrophobicContact CD1-CG1 4.17Å; F300-I312 HydrophobicContact CE1-CB 3.74Å; F300-I312 HydrophobicContact CE1-CD1 4.22Å; F300-I312 HydrophobicContact CE1-CG1 4.22Å; F300-I312 HydrophobicContact CE2-CB 4.4Å; F300-I312 HydrophobicContact CG-CB 4.29Å; F300-I312 HydrophobicContact CZ-CB 4.01Å; I312-N314 VanDerWaalsContact C-N 3.27Å; I312-N314 PolarHBondContact O-N 3.45Å; I312-L315 CarbonylContact O-C 3.25Å; I312-L315 WeakPolarHBondContact O-CA 3.43Å; I312-L315 WeakPolarHBondContact O-CB 3.49Å; I312-L315 PolarHBondContact O-N 3.5Å; I312-L315 VanDerWaalsContact O-N 3.08Å; I312-T316 PolarHBondContact O-N 3.3Å; I312-T316 PolarHBondContact O-OG1 3.49Å
313Y88.5Confident89.7Confident114 Ų11472.9 Ų72.945%0.44736%0.359SS..Hα-helixtrans-65.7-31.2-179.974-100.2000112.5Q311 L315 T316 F317Q311-Y313 VanDerWaalsContact C-N 3.3Å; Q311-Y313 HydrophobicContact CB-CD1 3.71Å; Q311-Y313 HydrophobicContact CB-CE1 3.55Å; Q311-Y313 HydrophobicContact CB-CG 4.48Å; Q311-Y313 HydrophobicContact CG-CD1 4.47Å; Q311-Y313 HydrophobicContact CG-CE1 3.9Å; Q311-Y313 VanDerWaalsContact NE2-CE1 3.29Å; Q311-Y313 PolarHBondContact O-N 3.11Å; Q311-Y313 PolarHBondContact OE1-OH 3.13Å; Y313-L315 VanDerWaalsContact C-N 3.35Å; Y313-T316 PolarHBondContact O-N 3.37Å; Y313-F317 HydrophobicContact CD2-CD2 4.16Å; Y313-F317 HydrophobicContact CD2-CE2 4.2Å; Y313-F317 WeakPolarHBondContact O-CD2 3.36Å; Y313-F317 PolarHBondContact O-N 2.74Å
314N90.6Very high88.8Confident59 Ų5975 Ų7532%0.31637%0.37SS..Hα-helixtrans-67.8-39.7174.4-73.9-35.6000110.6F309 Q311 I312 H318F309-N314 HydrophobicContact CB-CB 4.17Å; F309-N314 HydrophobicContact CD1-CB 3.89Å; F309-N314 HydrophobicContact CG-CB 4.25Å; Q311-N314 WeakPolarHBondContact O-CB 3.43Å; Q311-N314 PolarHBondContact O-N 3.01Å; Q311-N314 VanDerWaalsContact O-N 3.11Å; I312-N314 VanDerWaalsContact C-N 3.27Å; I312-N314 PolarHBondContact O-N 3.45Å; N314-H318 VanDerWaalsContact O-CB 3.3Å; N314-H318 WeakPolarHBondContact O-CB 3.32Å; N314-H318 PolarHBondContact O-N 3.35Å
315L91.4Very high88.2Confident27 Ų2779.2 Ų79.214%0.14138%0.384CS..Hα-helixtrans-62.2-47.8171.5174.764.5000111F300 C302 F309 Q311 I312 Y313 F317 H318 M319F300-L315 HydrophobicContact CB-CB 4.13Å; F300-L315 HydrophobicContact CB-CD2 3.85Å; C302-L315 HydrophobicContact CB-CD1 3.94Å; F309-L315 HydrophobicContact CD2-CB 4.03Å; F309-L315 HydrophobicContact CD2-CD1 3.91Å; F309-L315 HydrophobicContact CE2-CD1 4.06Å; F309-L315 HydrophobicContact CG-CB 4.45Å; Q311-L315 PolarHBondContact O-N 3.09Å; I312-L315 CarbonylContact O-C 3.25Å; I312-L315 WeakPolarHBondContact O-CA 3.43Å; I312-L315 WeakPolarHBondContact O-CB 3.49Å; I312-L315 PolarHBondContact O-N 3.5Å; I312-L315 VanDerWaalsContact O-N 3.08Å; Y313-L315 VanDerWaalsContact C-N 3.35Å; L315-F317 VanDerWaalsContact C-N 3.34Å; L315-F317 PolarHBondContact O-N 2.98Å; L315-H318 CarbonylContact O-C 3.5Å; L315-H318 WeakPolarHBondContact O-CA 3.34Å; L315-H318 WeakPolarHBondContact O-CB 3.44Å; L315-H318 PolarHBondContact O-N 2.93Å; L315-M319 HydrophobicContact CD1-CE 3.42Å; L315-M319 VanDerWaalsContact CD1-CE 3.42Å; L315-M319 HydrophobicContact CD1-SD 4.29Å; L315-M319 HydrophobicContact CG-CE 4.35Å; L315-M319 WeakPolarHBondContact O-CG 3.14Å; L315-M319 PolarHBondContact O-N 3.46Å
316T90.7Very high87.8Confident74 Ų7482 Ų8245%0.45439%0.391SS..Hα-helixtrans-56.7-45.4177.7-52.50000111.6I312 Y313 H318 M319 H320I312-T316 PolarHBondContact O-N 3.3Å; I312-T316 PolarHBondContact O-OG1 3.49Å; Y313-T316 PolarHBondContact O-N 3.37Å; T316-H318 VanDerWaalsContact C-N 3.35Å; T316-M319 WeakPolarHBondContact O-CB 3.22Å; T316-M319 PolarHBondContact O-N 3.13Å; T316-H320 PolarHBondContact O-CE1 2.82Å; T316-H320 PolarHBondContact O-ND1 2.63Å
317F86.8Confident87.6Confident86 Ų8678.5 Ų78.538%0.37738%0.381SS..Hα-helixtrans-65.3-39.2174.6-76.9-58.8000112.6Y313 L315 M319 H320 R339Y313-F317 HydrophobicContact CD2-CD2 4.16Å; Y313-F317 HydrophobicContact CD2-CE2 4.2Å; Y313-F317 WeakPolarHBondContact O-CD2 3.36Å; Y313-F317 PolarHBondContact O-N 2.74Å; L315-F317 VanDerWaalsContact C-N 3.34Å; L315-F317 PolarHBondContact O-N 2.98Å; F317-M319 VanDerWaalsContact C-N 3.26Å; F317-M319 PolarHBondContact O-N 3.32Å; F317-H320 WeakPolarHBondContact O-CB 3.46Å; F317-H320 PolarHBondContact O-N 3.46Å; F317-H320 VanDerWaalsContact O-N 3.16Å; F317-H320 PolarHBondContact O-ND1 2.73Å; F317-R339 HydrophobicContact CD1-CG 4.14Å; F317-R339 HydrophobicContact CG-CG 4.43Å
318H89.9Confident87.5Confident23 Ų2375.5 Ų75.511%0.10637%0.368CS..Hα-helixtrans-62.6-31.9174.2169.753.8000112.4C302 C305 F309 N314 L315 T316 H320 T321 H322C302-H318 WeakPolarHBondContact CB-NE2 3.39Å; C302-H318 PolarHBondContact SG-NE2 3.2Å; C302-H318 VanDerWaalsContact SG-NE2 3.39Å; C305-H318 PolarHBondContact SG-CE1 2.78Å; C305-H318 PolarHBondContact SG-NE2 2.7Å; F309-H318 HydrophobicContact CE1-CB 4.14Å; F309-H318 HydrophobicContact CE2-CB 3.9Å; F309-H318 AromaticContact CE2-CD2 3.23Å; F309-H318 WeakPolarHBondContact CE2-CD2 3.45Å; F309-H318 AromaticContact CE2-CG 3.66Å; F309-H318 AromaticContact CE2-NE2 4Å; F309-H318 HydrophobicContact CZ-CB 3.5Å; F309-H318 AromaticContact CZ-CD2 3.4Å; F309-H318 WeakPolarHBondContact CZ-CD2 3.24Å; F309-H318 AromaticContact CZ-CG 3.34Å; N314-H318 VanDerWaalsContact O-CB 3.3Å; N314-H318 WeakPolarHBondContact O-CB 3.32Å; N314-H318 PolarHBondContact O-N 3.35Å; L315-H318 CarbonylContact O-C 3.5Å; L315-H318 WeakPolarHBondContact O-CA 3.34Å; L315-H318 WeakPolarHBondContact O-CB 3.44Å; L315-H318 PolarHBondContact O-N 2.93Å; T316-H318 VanDerWaalsContact C-N 3.35Å; H318-H320 PolarHBondContact O-N 2.85Å; H318-H320 VanDerWaalsContact O-N 3.16Å; H318-T321 PolarHBondContact ND1-OG1 2.85Å; H318-T321 WeakPolarHBondContact O-CB 3.18Å; H318-T321 PolarHBondContact O-N 3.39Å; H318-T321 PolarHBondContact O-OG1 2.68Å; H318-H322 AromaticContact CE1-NE2 3.44Å; H318-H322 PolarHBondContact CE1-NE2 3.01Å; H318-H322 AromaticContact NE2-NE2 3.4Å; H318-H322 PolarHBondContact NE2-NE2 2.84Å
319M89.9Confident87.5Confident33 Ų3378.5 Ų78.516%0.16338%0.384CS..Hα-helixtrans-60.5-28.5175.6-66.1-53.385.900112.6C302 L315 T316 F317 T321 H322 Q323C302-M319 HydrophobicContact CB-CE 3.7Å; C302-M319 WeakPolarHBondContact SG-CE 3.24Å; L315-M319 HydrophobicContact CD1-CE 3.42Å; L315-M319 VanDerWaalsContact CD1-CE 3.42Å; L315-M319 HydrophobicContact CD1-SD 4.29Å; L315-M319 HydrophobicContact CG-CE 4.35Å; L315-M319 WeakPolarHBondContact O-CG 3.14Å; L315-M319 PolarHBondContact O-N 3.46Å; T316-M319 WeakPolarHBondContact O-CB 3.22Å; T316-M319 PolarHBondContact O-N 3.13Å; F317-M319 VanDerWaalsContact C-N 3.26Å; F317-M319 PolarHBondContact O-N 3.32Å; M319-T321 PolarHBondContact O-N 3.24Å; M319-H322 PolarHBondContact O-N 2.82Å; M319-H322 VanDerWaalsContact O-N 3.1Å; M319-Q323 PolarHBondContact O-N 3.13Å
320H89Confident87.6Confident40 Ų4076.3 Ų76.319%0.18537%0.374CS..THydrogen-bonded Turntrans-70.6-8.8174.8-5986.2000113.5T316 F317 H318 P327 C338T316-H320 PolarHBondContact O-CE1 2.82Å; T316-H320 PolarHBondContact O-ND1 2.63Å; F317-H320 WeakPolarHBondContact O-CB 3.46Å; F317-H320 PolarHBondContact O-N 3.46Å; F317-H320 VanDerWaalsContact O-N 3.16Å; F317-H320 PolarHBondContact O-ND1 2.73Å; H318-H320 PolarHBondContact O-N 2.85Å; H318-H320 VanDerWaalsContact O-N 3.16Å; H320-P327 WeakPolarHBondContact CD2-CG 3.35Å; H320-C338 HydrophobicContact CB-CB 4.03Å; H320-C338 PolarHBondContact O-SG 3.38Å
321T86.1Confident87.8Confident85 Ų8580.5 Ų80.552%0.52139%0.394SS..THydrogen-bonded Turntrans-84-18.6171.169.20000112.2H318 M319H318-T321 PolarHBondContact ND1-OG1 2.85Å; H318-T321 WeakPolarHBondContact O-CB 3.18Å; H318-T321 PolarHBondContact O-N 3.39Å; H318-T321 PolarHBondContact O-OG1 2.68Å; M319-T321 PolarHBondContact O-N 3.24Å
322H88.3Confident87.9Confident66 Ų6681.9 Ų81.931%0.30640%0.402SS..THydrogen-bonded Turntrans-87.1-22.7172-66.6-64000112.3C302 I304 C305 H318 M319C302-H322 PolarHBondContact SG-NE2 2.79Å; I304-H322 HydrophobicContact CD1-CB 3.55Å; I304-H322 WeakPolarHBondContact CG2-ND1 3.35Å; C305-H322 PolarHBondContact SG-NE2 2.78Å; C305-H322 VanDerWaalsContact SG-NE2 3.41Å; H318-H322 AromaticContact CE1-NE2 3.44Å; H318-H322 PolarHBondContact CE1-NE2 3.01Å; H318-H322 AromaticContact NE2-NE2 3.4Å; H318-H322 PolarHBondContact NE2-NE2 2.84Å; M319-H322 PolarHBondContact O-N 2.82Å; M319-H322 VanDerWaalsContact O-N 3.1Å
323Q84.5Confident88Confident104 Ų10479.5 Ų79.549%0.48639%0.394SS..SBendtrans-89.7128.6175.2-61.7175.90.900109M319 K325M319-Q323 PolarHBondContact O-N 3.13Å; Q323-K325 PolarHBondContact O-N 3.05Å
324E74.6Confident88Confident192 Ų19276.8 Ų76.890%0.89740%0.401SS*.SBendtrans-64.5-24.4174.9-61.8-177.2171.800112.1K326E324-K326 PolarHBondContact O-N 3.17Å; E324-K326 VanDerWaalsContact O-N 3.11Å
325K78.7Confident88Confident178 Ų17879.6 Ų79.677%0.77441%0.41SS*.  trans-75.599.4177.8-64.1-174.7-178.4-179.20110.2Q323 P327Q323-K325 PolarHBondContact O-N 3.05Å; K325-P327 WeakPolarHBondContact O-CD 3.45Å
326K85.4Confident87.9Confident106 Ų10679.1 Ų79.146%0.46141%0.412SS..  trans-82.6116.8173.1-65-176.4-175.9172.90109.7E324 F328 G336E324-K326 PolarHBondContact O-N 3.17Å; E324-K326 VanDerWaalsContact O-N 3.11Å; K326-F328 PolarHBondContact O-N 2.94Å; K326-F328 VanDerWaalsContact O-N 3.14Å; K326-G336 WeakPolarHBondContact CD-O 3.4Å; K326-G336 PolarHBondContact NZ-O 3.13Å
327P85Confident87.8Confident68 Ų6877.7 Ų77.744%0.44240%0.399SS..SBendtrans-64.2-22.6-171.6-2332.3000115.2H320 K325H320-P327 WeakPolarHBondContact CD2-CG 3.35Å; K325-P327 WeakPolarHBondContact O-CD 3.45Å
328F89.6Confident87.9Confident64 Ų6474.7 Ų74.728%0.28139%0.389SS..EExtended strand (participates in β ladder)trans-113.9103.7-175.4-57.9-75.7000110K326 G336 F337 R339 N340 L343K326-F328 PolarHBondContact O-N 2.94Å; K326-F328 VanDerWaalsContact O-N 3.14Å; F328-G336 CarbonylContact O-C 3.51Å; F328-G336 WeakPolarHBondContact O-CA 3.38Å; F328-F337 HydrophobicContact CB-CB 4.44Å; F328-F337 WeakPolarHBondContact CB-O 3.42Å; F328-F337 PolarHBondContact N-O 2.97Å; F328-F337 PolarHBondContact O-N 3.22Å; F328-R339 VanDerWaalsContact CD2-C 3.46Å; F328-N340 HydrophobicContact CD1-CB 3.92Å; F328-N340 HydrophobicContact CD2-CB 4.4Å; F328-N340 VanDerWaalsContact CD2-N 3.29Å; F328-N340 HydrophobicContact CE1-CB 3.72Å; F328-N340 HydrophobicContact CE2-CB 4.21Å; F328-N340 HydrophobicContact CG-CB 4.26Å; F328-N340 HydrophobicContact CZ-CB 3.86Å; F328-L343 HydrophobicContact CB-CB 4.2Å; F328-L343 HydrophobicContact CB-CD2 3.9Å
329T91.2Very high87.8Confident89 Ų8979 Ų7955%0.54640%0.404SS..EExtended strand (participates in β ladder)trans-98.3141.717649.90000110.7
330C93.3Very high87.9Confident1 Ų180.6 Ų80.61%0.00741%0.413CS..  trans-76.2121.8168.2-177.10000108.9L332 C333 G334 K335 F337 L343 H346C330-L332 PolarHBondContact O-N 3.28Å; C330-L332 PolarHBondContact SG-N 3.05Å; C330-C333 VanDerWaalsContact SG-SG 3.61Å; C330-G334 WeakPolarHBondContact O-CA 3.47Å; C330-G334 PolarHBondContact O-N 2.78Å; C330-K335 PolarHBondContact N-O 3.1Å; C330-F337 HydrophobicContact CB-CE2 4.35Å; C330-L343 HydrophobicContact CB-CD1 3.65Å; C330-H346 PolarHBondContact SG-NE2 3.05Å
331H92.3Very high88Confident135 Ų13584.5 Ų84.563%0.62543%0.43SS*.THydrogen-bonded Turntrans-69.4-22.8177.360.5-82.2000112.7
332L89.8Confident88.3Confident71 Ų7182.4 Ų82.437%0.37242%0.415SS..THydrogen-bonded Turntrans-86.8-25-177.8-60172.4000114C330 L347 H351C330-L332 PolarHBondContact O-N 3.28Å; C330-L332 PolarHBondContact SG-N 3.05Å; L332-L347 HydrophobicContact CD1-CD2 4.3Å; L332-H351 HydrophobicContact CD1-CB 3.42Å; L332-H351 VanDerWaalsContact CD1-CB 3.42Å; L332-H351 VanDerWaalsContact CD1-CG 3.44Å
333C91.7Very high88.5Confident54 Ų5480.2 Ų80.237%0.36541%0.406SS..THydrogen-bonded Turntrans-137.65.4-17971.40000115C330 K335 H346C330-C333 VanDerWaalsContact SG-SG 3.61Å; C333-K335 PolarHBondContact O-N 3.19Å; C333-H346 PolarHBondContact SG-CE1 2.71Å; C333-H346 PolarHBondContact SG-NE2 3.43Å
334G89.4Confident89Confident57 Ų5781 Ų8159%0.58841%0.408SS*.  trans70.6-8.2179.400000115.8C330 G336C330-G334 WeakPolarHBondContact O-CA 3.47Å; C330-G334 PolarHBondContact O-N 2.78Å; G334-G336 PolarHBondContact O-N 2.88Å
335K89.7Confident89.9Confident119 Ų11976.4 Ų76.452%0.51739%0.385SS..  trans-61.9123.2-177.3-69.4-178.1-176.1-178.80111.3C330 C333 F337C330-K335 PolarHBondContact N-O 3.1Å; C333-K335 PolarHBondContact O-N 3.19Å; K335-F337 HydrophobicContact CB-CE2 3.84Å; K335-F337 HydrophobicContact CB-CZ 3.95Å; K335-F337 VanDerWaalsContact O-CD2 3.32Å; K335-F337 WeakPolarHBondContact O-CD2 3.39Å; K335-F337 WeakPolarHBondContact O-CE2 3.34Å
336G89.6Confident90.6Very high17 Ų1768.8 Ų68.818%0.17535%0.352CS..EExtended strand (participates in β ladder)trans-83.5145.5173.800000113.2K326 F328 G334K326-G336 WeakPolarHBondContact CD-O 3.4Å; K326-G336 PolarHBondContact NZ-O 3.13Å; F328-G336 CarbonylContact O-C 3.51Å; F328-G336 WeakPolarHBondContact O-CA 3.38Å; G334-G336 PolarHBondContact O-N 2.88Å
337F89.9Confident91Very high43 Ų4365.1 Ų65.119%0.18934%0.337CS..EExtended strand (participates in β ladder)trans-135145177.5-58.9-85.6000111.6F328 C330 K335 R339 D342 L343 H346F328-F337 HydrophobicContact CB-CB 4.44Å; F328-F337 WeakPolarHBondContact CB-O 3.42Å; F328-F337 PolarHBondContact N-O 2.97Å; F328-F337 PolarHBondContact O-N 3.22Å; C330-F337 HydrophobicContact CB-CE2 4.35Å; K335-F337 HydrophobicContact CB-CE2 3.84Å; K335-F337 HydrophobicContact CB-CZ 3.95Å; K335-F337 VanDerWaalsContact O-CD2 3.32Å; K335-F337 WeakPolarHBondContact O-CD2 3.39Å; K335-F337 WeakPolarHBondContact O-CE2 3.34Å; F337-R339 VanDerWaalsContact C-N 3.34Å; F337-D342 HydrophobicContact CB-CB 4.2Å; F337-D342 HydrophobicContact CD1-CB 3.86Å; F337-D342 HydrophobicContact CG-CB 4.3Å; F337-L343 HydrophobicContact CB-CB 4.3Å; F337-L343 HydrophobicContact CD2-CB 3.88Å; F337-L343 HydrophobicContact CD2-CD1 3.79Å; F337-L343 HydrophobicContact CD2-CG 4.43Å; F337-L343 HydrophobicContact CE2-CD1 3.92Å; F337-L343 HydrophobicContact CG-CB 4.25Å; F337-H346 HydrophobicContact CE1-CB 4.01Å; F337-H346 HydrophobicContact CE2-CB 3.94Å; F337-H346 AromaticContact CE2-CD2 3.71Å; F337-H346 AromaticContact CE2-CG 3.66Å; F337-H346 HydrophobicContact CZ-CB 3.48Å; F337-H346 VanDerWaalsContact CZ-CB 3.48Å; F337-H346 AromaticContact CZ-CD2 3.85Å; F337-H346 AromaticContact CZ-CG 3.32Å; F337-H346 AromaticContact CZ-ND1 3.56Å
338C87.4Confident91.3Very high23 Ų2369.1 Ų69.116%0.15534%0.343CS..SBendtrans-78.1-18.8178-55.80000112.9H320H320-C338 HydrophobicContact CB-CB 4.03Å; H320-C338 PolarHBondContact O-SG 3.38Å
339R88.3Confident91.4Very high115 Ų11573.4 Ų73.443%0.43436%0.362SS..SBendtrans-129.6139.4179.4-54.4-178.6-64.4-176.70.2111F317 F328 F337 F341 D342 L343F317-R339 HydrophobicContact CD1-CG 4.14Å; F317-R339 HydrophobicContact CG-CG 4.43Å; F328-R339 VanDerWaalsContact CD2-C 3.46Å; F337-R339 VanDerWaalsContact C-N 3.34Å; R339-F341 PolarHBondContact O-N 2.73Å; R339-D342 WeakPolarHBondContact CB-OD2 3.2Å; R339-D342 IonicContact CZ-OD1 2.77Å; R339-D342 IonicContact CZ-OD2 3.09Å; R339-D342 IonicContact NE-OD1 3.67Å; R339-D342 IonicContact NE-OD2 2.72Å; R339-D342 PolarHBondContact NE-OD2 3.08Å; R339-D342 VanDerWaalsContact NH2-CG 3.33Å; R339-D342 IonicContact NH2-OD1 2.7Å; R339-D342 PolarHBondContact NH2-OD1 2.87Å; R339-D342 IonicContact NH2-OD2 3.44Å; R339-D342 PolarHBondContact NH2-OD2 3.4Å; R339-D342 VanDerWaalsContact NH2-OD2 3.09Å; R339-D342 PolarHBondContact O-N 2.97Å; R339-L343 PolarHBondContact O-N 2.73Å
340N91.4Very high91.3Very high65 Ų6574.5 Ų74.535%0.34836%0.364SS..Hα-helixtrans-57.7-34.8172.3-172-62.9000112F328 D342 L343 K344F328-N340 HydrophobicContact CD1-CB 3.92Å; F328-N340 HydrophobicContact CD2-CB 4.4Å; F328-N340 VanDerWaalsContact CD2-N 3.29Å; F328-N340 HydrophobicContact CE1-CB 3.72Å; F328-N340 HydrophobicContact CE2-CB 4.21Å; F328-N340 HydrophobicContact CG-CB 4.26Å; F328-N340 HydrophobicContact CZ-CB 3.86Å; N340-D342 VanDerWaalsContact C-N 3.32Å; N340-D342 PolarHBondContact O-N 3.27Å; N340-L343 PolarHBondContact O-N 3.44Å; N340-K344 PolarHBondContact O-N 3.28Å; N340-K344 VanDerWaalsContact OD1-CD 3.27Å; N340-K344 WeakPolarHBondContact OD1-CD 3.45Å; N340-K344 WeakPolarHBondContact OD1-CE 3.5Å; N340-K344 WeakPolarHBondContact OD1-CG 3.47Å
341F91.7Very high91Very high123 Ų12375.5 Ų75.554%0.53937%0.368SS..Hα-helixtrans-59-41.6175.2177.5-94.4000112.7R339 K344 K345R339-F341 PolarHBondContact O-N 2.73Å; F341-K344 PolarHBondContact O-N 3.24Å; F341-K345 HydrophobicContact CE1-CD 4.44Å; F341-K345 WeakPolarHBondContact O-CB 3.35Å; F341-K345 PolarHBondContact O-N 2.96Å
342D92Very high90.5Very high41 Ų4172.3 Ų72.322%0.21936%0.356CS..Hα-helixtrans-69.8-40.3179-62.2-41.7000110.8F337 R339 N340 K345 H346F337-D342 HydrophobicContact CB-CB 4.2Å; F337-D342 HydrophobicContact CD1-CB 3.86Å; F337-D342 HydrophobicContact CG-CB 4.3Å; R339-D342 WeakPolarHBondContact CB-OD2 3.2Å; R339-D342 IonicContact CZ-OD1 2.77Å; R339-D342 IonicContact CZ-OD2 3.09Å; R339-D342 IonicContact NE-OD1 3.67Å; R339-D342 IonicContact NE-OD2 2.72Å; R339-D342 PolarHBondContact NE-OD2 3.08Å; R339-D342 VanDerWaalsContact NH2-CG 3.33Å; R339-D342 IonicContact NH2-OD1 2.7Å; R339-D342 PolarHBondContact NH2-OD1 2.87Å; R339-D342 IonicContact NH2-OD2 3.44Å; R339-D342 PolarHBondContact NH2-OD2 3.4Å; R339-D342 VanDerWaalsContact NH2-OD2 3.09Å; R339-D342 PolarHBondContact O-N 2.97Å; N340-D342 VanDerWaalsContact C-N 3.32Å; N340-D342 PolarHBondContact O-N 3.27Å; D342-K345 PolarHBondContact O-N 2.72Å; D342-H346 VanDerWaalsContact O-CB 3.27Å; D342-H346 WeakPolarHBondContact O-CB 3.39Å; D342-H346 PolarHBondContact O-N 3.07Å
343L93.3Very high89.6Confident20 Ų2080.5 Ų80.511%0.10538%0.382CS..Hα-helixtrans-59.1-48.9171.617461.4000111.3F328 C330 F337 R339 N340 K345 H346 L347F328-L343 HydrophobicContact CB-CB 4.2Å; F328-L343 HydrophobicContact CB-CD2 3.9Å; C330-L343 HydrophobicContact CB-CD1 3.65Å; F337-L343 HydrophobicContact CB-CB 4.3Å; F337-L343 HydrophobicContact CD2-CB 3.88Å; F337-L343 HydrophobicContact CD2-CD1 3.79Å; F337-L343 HydrophobicContact CD2-CG 4.43Å; F337-L343 HydrophobicContact CE2-CD1 3.92Å; F337-L343 HydrophobicContact CG-CB 4.25Å; R339-L343 PolarHBondContact O-N 2.73Å; N340-L343 PolarHBondContact O-N 3.44Å; L343-K345 VanDerWaalsContact C-N 3.33Å; L343-K345 PolarHBondContact O-N 3.48Å; L343-H346 CarbonylContact O-C 3.54Å; L343-H346 WeakPolarHBondContact O-CA 3.48Å; L343-H346 WeakPolarHBondContact O-CB 3.46Å; L343-H346 PolarHBondContact O-N 3.24Å; L343-H346 VanDerWaalsContact O-N 3.14Å; L343-L347 HydrophobicContact CD1-CD1 4.23Å; L343-L347 HydrophobicContact CD1-CG 4.07Å; L343-L347 HydrophobicContact CG-CD1 4.1Å; L343-L347 HydrophobicContact CG-CG 4.39Å; L343-L347 WeakPolarHBondContact O-CG 3.49Å; L343-L347 PolarHBondContact O-N 3.42Å
344K94.2Very high88.3Confident121 Ų12182.3 Ų82.353%0.52639%0.387SS..Hα-helixtrans-62.6-37.6177-77-179.3174.9175.10112.8N340 F341 H346 R348N340-K344 PolarHBondContact O-N 3.28Å; N340-K344 VanDerWaalsContact OD1-CD 3.27Å; N340-K344 WeakPolarHBondContact OD1-CD 3.45Å; N340-K344 WeakPolarHBondContact OD1-CE 3.5Å; N340-K344 WeakPolarHBondContact OD1-CG 3.47Å; F341-K344 PolarHBondContact O-N 3.24Å; K344-H346 VanDerWaalsContact C-N 3.35Å; K344-R348 WeakPolarHBondContact O-CB 3.44Å; K344-R348 WeakPolarHBondContact O-CG 3.42Å; K344-R348 PolarHBondContact O-N 3.43Å
345K93.7Very high86.8Confident94 Ų9481.2 Ų81.241%0.40937%0.367SS..Hα-helixtrans-65.3-41.4173.7-176.5-178.8178-176.30110.7F341 D342 L343 K349F341-K345 HydrophobicContact CE1-CD 4.44Å; F341-K345 WeakPolarHBondContact O-CB 3.35Å; F341-K345 PolarHBondContact O-N 2.96Å; D342-K345 PolarHBondContact O-N 2.72Å; L343-K345 VanDerWaalsContact C-N 3.33Å; L343-K345 PolarHBondContact O-N 3.48Å; K345-K349 HydrophobicContact CG-CD 4.28Å; K345-K349 WeakPolarHBondContact O-CB 3.36Å; K345-K349 VanDerWaalsContact O-CG 3.29Å; K345-K349 WeakPolarHBondContact O-CG 3.2Å; K345-K349 PolarHBondContact O-N 3.38Å
346H93.5Very high85.2Confident18 Ų1883.5 Ų83.58%0.08338%0.377CS..Hα-helixtrans-62.2-50174.6161.983.2000111.5C330 C333 F337 D342 L343 K344 R348 K349 L350 H351C330-H346 PolarHBondContact SG-NE2 3.05Å; C333-H346 PolarHBondContact SG-CE1 2.71Å; C333-H346 PolarHBondContact SG-NE2 3.43Å; F337-H346 HydrophobicContact CE1-CB 4.01Å; F337-H346 HydrophobicContact CE2-CB 3.94Å; F337-H346 AromaticContact CE2-CD2 3.71Å; F337-H346 AromaticContact CE2-CG 3.66Å; F337-H346 HydrophobicContact CZ-CB 3.48Å; F337-H346 VanDerWaalsContact CZ-CB 3.48Å; F337-H346 AromaticContact CZ-CD2 3.85Å; F337-H346 AromaticContact CZ-CG 3.32Å; F337-H346 AromaticContact CZ-ND1 3.56Å; D342-H346 VanDerWaalsContact O-CB 3.27Å; D342-H346 WeakPolarHBondContact O-CB 3.39Å; D342-H346 PolarHBondContact O-N 3.07Å; L343-H346 CarbonylContact O-C 3.54Å; L343-H346 WeakPolarHBondContact O-CA 3.48Å; L343-H346 WeakPolarHBondContact O-CB 3.46Å; L343-H346 PolarHBondContact O-N 3.24Å; L343-H346 VanDerWaalsContact O-N 3.14Å; K344-H346 VanDerWaalsContact C-N 3.35Å; H346-R348 PolarHBondContact O-N 3.08Å; H346-K349 PolarHBondContact O-N 3.41Å; H346-K349 VanDerWaalsContact O-N 3.15Å; H346-L350 PolarHBondContact O-N 3.37Å; H346-H351 AromaticContact CE1-NE2 3.76Å; H346-H351 AromaticContact NE2-CD2 3.43Å; H346-H351 PolarHBondContact NE2-CD2 3.14Å; H346-H351 AromaticContact NE2-NE2 3.32Å; H346-H351 PolarHBondContact NE2-NE2 3.41Å
347L93.2Very high83.5Confident30 Ų3086 Ų8616%0.15740%0.397CS..Hα-helixtrans-57.4-48.3176-69.2172.1000111L332 L343 K349 L350 H351 D352L332-L347 HydrophobicContact CD1-CD2 4.3Å; L343-L347 HydrophobicContact CD1-CD1 4.23Å; L343-L347 HydrophobicContact CD1-CG 4.07Å; L343-L347 HydrophobicContact CG-CD1 4.1Å; L343-L347 HydrophobicContact CG-CG 4.39Å; L343-L347 WeakPolarHBondContact O-CG 3.49Å; L343-L347 PolarHBondContact O-N 3.42Å; L347-K349 VanDerWaalsContact C-N 3.28Å; L347-K349 PolarHBondContact O-N 3.12Å; L347-L350 PolarHBondContact O-N 3.46Å; L347-H351 HydrophobicContact CD2-CB 4.22Å; L347-H351 CarbonylContact O-C 3.53Å; L347-H351 WeakPolarHBondContact O-CA 3.34Å; L347-H351 WeakPolarHBondContact O-CB 3.25Å; L347-H351 PolarHBondContact O-N 3.34Å; L347-D352 PolarHBondContact O-N 3.32Å
348R91.7Very high81.7Confident152 Ų15288.7 Ų88.757%0.57441%0.413SS*.Hα-helixtrans-65.6-27.6178.6-73.6-172.8-62.61783114.4K344 H346 D352K344-R348 WeakPolarHBondContact O-CB 3.44Å; K344-R348 WeakPolarHBondContact O-CG 3.42Å; K344-R348 PolarHBondContact O-N 3.43Å; H346-R348 PolarHBondContact O-N 3.08Å; R348-D352 WeakPolarHBondContact O-CB 3.47Å
349K91.1Very high80Confident154 Ų15494.6 Ų94.667%0.6744%0.44SS*.Hα-helixtrans-87-33.8-179.4-76.6-172.7171.9-151.80113.3K345 H346 L347K345-K349 HydrophobicContact CG-CD 4.28Å; K345-K349 WeakPolarHBondContact O-CB 3.36Å; K345-K349 VanDerWaalsContact O-CG 3.29Å; K345-K349 WeakPolarHBondContact O-CG 3.2Å; K345-K349 PolarHBondContact O-N 3.38Å; H346-K349 PolarHBondContact O-N 3.41Å; H346-K349 VanDerWaalsContact O-N 3.15Å; L347-K349 VanDerWaalsContact C-N 3.28Å; L347-K349 PolarHBondContact O-N 3.12Å
350L90.2Very high78.3Confident111 Ų11193.5 Ų93.558%0.58146%0.456SS*.Hα-helixtrans-115.4-20.5-171.7-64.6-179.3000113.9H346 L347H346-L350 PolarHBondContact O-N 3.37Å; L347-L350 PolarHBondContact O-N 3.46Å
351H87.7Confident76Confident23 Ų2397 Ų9711%0.10648%0.475CS..THydrogen-bonded Turntrans-134.63-170.6-58.2-66.3000115L332 H346 L347 R353 I354 N355L332-H351 HydrophobicContact CD1-CB 3.42Å; L332-H351 VanDerWaalsContact CD1-CB 3.42Å; L332-H351 VanDerWaalsContact CD1-CG 3.44Å; H346-H351 AromaticContact CE1-NE2 3.76Å; H346-H351 AromaticContact NE2-CD2 3.43Å; H346-H351 PolarHBondContact NE2-CD2 3.14Å; H346-H351 AromaticContact NE2-NE2 3.32Å; H346-H351 PolarHBondContact NE2-NE2 3.41Å; L347-H351 HydrophobicContact CD2-CB 4.22Å; L347-H351 CarbonylContact O-C 3.53Å; L347-H351 WeakPolarHBondContact O-CA 3.34Å; L347-H351 WeakPolarHBondContact O-CB 3.25Å; L347-H351 PolarHBondContact O-N 3.34Å; H351-R353 PolarHBondContact O-N 3.2Å; H351-I354 PolarHBondContact O-N 3.2Å; H351-N355 PolarHBondContact O-N 3.48Å; H351-N355 VanDerWaalsContact O-N 3.1Å; H351-N355 PolarHBondContact O-ND2 3.4Å
352D81.1Confident73.8Confident67 Ų6795.8 Ų95.836%0.35848%0.481SS..Hα-helixtrans-61.2-32.8-175.9-152.552.6000112.5L347 R348 I354 N355 K356L347-D352 PolarHBondContact O-N 3.32Å; R348-D352 WeakPolarHBondContact O-CB 3.47Å; D352-I354 PolarHBondContact O-N 3.1Å; D352-N355 PolarHBondContact O-N 3.35Å; D352-K356 PolarHBondContact O-N 3.05Å
353R71.7Confident71.3Confident244 Ų24498.4 Ų98.492%0.92150%0.503SS*.Hα-helixtrans-65.1-27176.3-63.9-170.7-175-174.81.7112.4H351H351-R353 PolarHBondContact O-N 3.2Å
354I64.5Low68.7Low92 Ų92102.8 Ų102.847%0.47253%0.532SS..Hα-helixtrans-85.5-42.2178.6-56.7172.5000109.8H351 D352 K356 A357H351-I354 PolarHBondContact O-N 3.2Å; D352-I354 PolarHBondContact O-N 3.1Å; I354-K356 PolarHBondContact O-N 3.48Å; I354-A357 PolarHBondContact O-N 3.26Å
355N57.4Low66.1Low33 Ų33102.7 Ų102.718%0.17654%0.544CS..Hα-helixtrans-73.7-14.3-171.9-74.3-78.2000116H351 D352 A357H351-N355 PolarHBondContact O-N 3.48Å; H351-N355 VanDerWaalsContact O-N 3.1Å; H351-N355 PolarHBondContact O-ND2 3.4Å; D352-N355 PolarHBondContact O-N 3.35Å; N355-A357 VanDerWaalsContact C-N 3.29Å
356K55.8Low63.5Low167 Ų167104.2 Ų104.273%0.72656%0.561SS**THydrogen-bonded Turntrans-73.1-22.1175.5-90-176.6-178.9176.70113D352 I354D352-K356 PolarHBondContact O-N 3.05Å; I354-K356 PolarHBondContact O-N 3.48Å
357A53.8Low60.5Low71 Ų71111.1 Ų111.159%0.58760%0.599SS**THydrogen-bonded Turntrans-72.8-38.2179.800000112.1I354 N355 M359I354-A357 PolarHBondContact O-N 3.26Å; N355-A357 VanDerWaalsContact C-N 3.29Å; A357-M359 PolarHBondContact O-N 3.43Å
358D51.6Low57.7Low99 Ų99115.8 Ų115.853%0.52963%0.629SS.*THydrogen-bonded Turntrans-86.3-10.4-167.6-54.8-41000115
359M53.2Low54.8Low146 Ų146113.4 Ų113.472%0.71964%0.642SS**THydrogen-bonded Turntrans-87.3-8.8178.9-63.9-71142.200113.1A357A357-M359 PolarHBondContact O-N 3.43Å
360A51.4Low52Low93 Ų93112.8 Ų112.877%0.76965%0.651SS**SBendtrans-81.4-14.6179.600000113.7
361D43.2Very low49Very low138 Ų138111.5 Ų111.574%0.73866%0.657SS**SBendtrans-118.711.1-174.2-160.421.2000114.8S363D361-S363 PolarHBondContact O-N 3.5Å
362S45.4Very low46.2Very low97 Ų97118.4 Ų118.468%0.67870%0.695SS**  trans-82.266.1172.3-59.10000111.1
363S40.7Very low43.6Very low97 Ų97118.3 Ų118.368%0.67871%0.709SS**PPolyproline II helixtrans-63141.1157.8-68.70000109D361D361-S363 PolarHBondContact O-N 3.5Å
364P38.1Very low41.5Very low111 Ų111112.5 Ų112.572%0.72171%0.706SS**PPolyproline II helixtrans-65.1143.9-17427.2-32.6000110.6T366P364-T366 PolarHBondContact O-N 3.41Å
365P39.3Very low39.8Very low120 Ų120114.4 Ų114.478%0.77973%0.727SS**PPolyproline II helixtrans-63.3122-171.424.5-32.5000110.8N367P365-N367 PolarHBondContact O-N 3.48Å
366T38.6Very low38.5Very low125 Ų125116.5 Ų116.577%0.76776%0.757SS**  trans-74.8112167.642.60000108.3P364 T368P364-T366 PolarHBondContact O-N 3.41Å; T366-T368 PolarHBondContact O-N 3.45Å
367N31.4Very low37.1Very low164 Ų164116.5 Ų116.588%0.87777%0.765SS**  trans-60.8105.6173.5-76.8-39.7000109.4P365P365-N367 PolarHBondContact O-N 3.48Å
368T33.7Very low36.4Very low127 Ų127117.8 Ų117.878%0.77977%0.77SS**  trans-121.7119.9157.642.60000108T366T366-T368 PolarHBondContact O-N 3.45Å
369A30.3Very low35.5Very low103 Ų103119 Ų11985%0.85179%0.786SS**  trans-76.6125.5-179.700000109.2
370T33Very low34.7Very low140 Ų140118.7 Ų118.786%0.85979%0.787SS**  trans-143126.6151.916.50000108.8
371A27.3Very low33.9Very low85 Ų85124.3 Ų124.370%0.70279%0.794SS**  trans-73.5171.8178.300000111.9
372N29.3Very low33.4Very low168 Ų168129.1 Ų129.190%0.89880%0.802SS**  trans88.6121.8-178.1-49.8-21.2000111.8
373G25.4Very low32.8Very low64 Ų64129.4 Ų129.466%0.6680%0.804SS**  cis156.8137.39.600000106.5
374S27.4Very low32.8Very low123 Ų123131.3 Ų131.386%0.8681%0.811SS**  trans80.2119.7154.5-49.70000120.6
375S29.8Very low32.9Very low131 Ų131130.3 Ų130.392%0.91681%0.812SS**  trans73.2118.9146.6-73.80000120.4
376G29.5Very low32.4Very low78 Ų78131.9 Ų131.980%0.80481%0.814SS**  trans148.878152.200000116
377N27.6Very low32.3Very low166 Ų166134 Ų13489%0.88882%0.817SS**  trans-5.3122.7156.7-68.8-22.8000118.2
378S37.9Very low32.9Very low99 Ų99137.9 Ų137.969%0.69284%0.836SS**  -168.6100.2124.742.30000110.9L380S378-L380 PolarHBondContact O-N 3.44Å
379S33.6Very low32.8Very low124 Ų124138.5 Ų138.587%0.86784%0.838SS**  trans-55.993.4162.352.10000111.1
380L36.5Very low32.9Very low140 Ų140140.3 Ų140.373%0.73384%0.838SS**  trans-118.612.3174.1-86.9177.8000115.6S378S378-L380 PolarHBondContact O-N 3.44Å
381F34.1Very low32.9Very low211 Ų211140.3 Ų140.393%0.92584%0.836SS**  trans-133.967.5171-78.1-81.4000112.6
382R33.1Very low33.3Very low238 Ų238143.6 Ų143.690%0.89884%0.844SS**SBendtrans-138.3122.5154-118.9171.2-177.6169.9-0.1110.9
383S32.3Very low33.5Very low103 Ų103142.1 Ų142.172%0.7284%0.841SS**  trans74.588.1153.4-57.80000118.5
384V41.1Very low34.1Very low137 Ų137147.3 Ų147.383%0.8385%0.853SS**  trans-123.467.8130.7-168.30000107.9
385A40Very low34.5Very low90 Ų90149 Ų14974%0.74485%0.853SS**  trans-1078.7162.900000111.8
386N29.1Very low34.9Very low153 Ų153150.4 Ų150.482%0.81885%0.848SS**  trans-116.983.9173.6-82.2-3.5000109.9
387M36.4Very low35.4Very low170 Ų170156.4 Ų156.484%0.83785%0.851SS**  trans-135.1101.2143.3-78.7-155170.900105.9
388I42.6Very low36.1Very low246 Ų246155.5 Ų155.5100%1.26285%0.848SS**  trans-7.90172.2-59.8165.9000115.3

Retrieved 388 of 388 residues in 136.4 ms (Link to these results)