A0A077ZCS6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZCS6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 250 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
1M33.8Very low36.1Very low247 Ų247169.7 Ų169.7100%1.21786%0.863SS**  0118.90-69.6-166.9175.900107.5
2L40.7Very low36Very low190 Ų190161.5 Ų161.5100%0.99585%0.852SS**  trans-87.7136-163.2-76160.3000112.7
3G35.1Very low35.7Very low72 Ų72161.8 Ų161.874%0.74285%0.854SS**  trans115.8102.5140.900000117.3
4P35.7Very low35.3Very low114 Ų114156.4 Ų156.474%0.7484%0.837SS**  trans-133.1157.413336.4-24.4000112.3
5K43.4Very low34.8Very low201 Ų201161.5 Ų161.587%0.87484%0.839SS**  trans136.1126.4139.7-73175.9-179.5-177.60115.4
6D35.2Very low34.5Very low157 Ų157161.9 Ų161.984%0.8484%0.842SS**  trans-50.5148163.8-62.8-78.5000114.7
7Y35.3Very low34Very low212 Ų212166.2 Ų166.283%0.83185%0.845SS**  trans-151.3127.2144.1-146.8-99.2000112.6
8K33.7Very low33.8Very low174 Ų174164.3 Ų164.376%0.75785%0.845SS**  trans-78.7167.7173.4-75.1-175.4171.9-179.50112.3
9R36.8Very low33.5Very low227 Ų227162.7 Ų162.786%0.85784%0.844SS**  trans85.1138.1161.8-65.9179-105.4-138.6-3.6114.9
10G34.2Very low33.1Very low66 Ų66160.6 Ų160.668%0.6883%0.834SS**  cis176.31724.800000110.4
11H33.8Very low33Very low207 Ų207159.2 Ų159.296%0.95883%0.832SS**  trans48.4115.5160.3-80.1-83.8000120.4
12G34.5Very low32.6Very low71 Ų71157.2 Ų157.273%0.73281%0.811SS**  trans-178.487.4164.900000112.3
13D32Very low32Very low165 Ų165154.9 Ų154.988%0.88280%0.804SS**  trans42101.4150-59.3-23.9000121.4
14S29.9Very low31.6Very low87 Ų87158.5 Ų158.561%0.60881%0.806SS**  trans-2.2141.5131.8-169.70000119.6
15W28.4Very low31.1Very low232 Ų232163.7 Ų163.788%0.87981%0.811SS**  trans100.652.4158.6-51.6111.6000119.7
16L29Very low30.5Very low169 Ų169164.1 Ų164.189%0.88581%0.807SS**  trans-147.696.4147.5-79.4178.7000110.1
17R27.1Very low30Very low235 Ų235161 Ų16189%0.88780%0.797SS**PPolyproline II helixtrans-72.3137.1168.7-69.1-167.5-174.2-148.93.2109.5V19R17-V19 PolarHBondContact O-N 3.27Å
18P29.9Very low29.7Very low131 Ų131159.9 Ų159.985%0.85180%0.797SS**PPolyproline II helixtrans-74123.7172.728.8-29.5000109.9
19V28.6Very low29.4Very low134 Ų134159.7 Ų159.781%0.81280%0.801SS**PPolyproline II helixtrans-89.8124173.1-178.90000109.6R17 V21R17-V19 PolarHBondContact O-N 3.27Å; V19-V21 PolarHBondContact O-N 3.3Å
20D25.5Very low29Very low121 Ų121155 Ų15565%0.64779%0.792SS**PPolyproline II helixtrans-54.9116.2178.3-172.810.8000113R22D20-R22 PolarHBondContact O-N 3.49Å
21V29.7Very low28.7Very low131 Ų131163 Ų16379%0.79480%0.803SS**  trans-88.890.1175.7-1770000108.6V19 V23V19-V21 PolarHBondContact O-N 3.3Å; V21-V23 PolarHBondContact O-N 3.47Å
22R26.1Very low28.5Very low205 Ų205159.1 Ų159.177%0.77479%0.794SS**  trans-63.6122.7169.9-68.9-174.7-167.2-178.15.7110.2D20 L24D20-R22 PolarHBondContact O-N 3.49Å; R22-L24 PolarHBondContact O-N 3.4Å
23V27.7Very low28.5Very low141 Ų141161 Ų16186%0.85578%0.784SS**  trans-61.895173.9178.40000109.4V21 R25V21-V23 PolarHBondContact O-N 3.47Å; V23-R25 PolarHBondContact O-N 2.95Å
24L27Very low28.6Very low148 Ų148157.9 Ų157.978%0.77576%0.763SS**  trans-77.9116.8168.8-78.9167.6000109.6R22 W26R22-L24 PolarHBondContact O-N 3.4Å; L24-W26 PolarHBondContact O-N 3.25Å
25R26.1Very low28.6Very low224 Ų224158 Ų15885%0.84576%0.762SS**  trans-52.7109.1178.3-163-179.8-162.8-177.24.5111.2V23 S27V23-R25 PolarHBondContact O-N 2.95Å; R25-S27 PolarHBondContact O-N 3.18Å
26W30.2Very low29Very low209 Ų209150 Ų15079%0.79273%0.732SS**  trans-76101.2171-70.565.4000108.8L24L24-W26 PolarHBondContact O-N 3.25Å
27S25.4Very low29.2Very low92 Ų92146.5 Ų146.564%0.64371%0.713SS**  trans-121.6130.3171.4-67.90000109.3R25R25-S27 PolarHBondContact O-N 3.18Å
28K27.9Very low29.4Very low189 Ų189139.9 Ų139.982%0.82270%0.695SS**  trans64.872.7-178.3-77.2177.7173.8176.10115.9L30K28-L30 VanDerWaalsContact C-N 3.28Å; K28-L30 HydrophobicContact CD-CD1 4.47Å; K28-L30 HydrophobicContact CG-CD1 4.3Å; K28-L30 PolarHBondContact O-N 3.24Å; K28-L30 VanDerWaalsContact O-N 3.13Å
29M26.6Very low29.5Very low170 Ų170138.3 Ų138.384%0.83768%0.683SS**  trans-74.686.5150.5-158.8175.4-177.800107.5
30L28.3Very low29.6Very low128 Ų128134.7 Ų134.767%0.6767%0.668SS**  trans-119.2136.2168.1-79167.4000107.4K28 T32K28-L30 VanDerWaalsContact C-N 3.28Å; K28-L30 HydrophobicContact CD-CD1 4.47Å; K28-L30 HydrophobicContact CG-CD1 4.3Å; K28-L30 PolarHBondContact O-N 3.24Å; K28-L30 VanDerWaalsContact O-N 3.13Å; L30-T32 PolarHBondContact O-N 3.35Å
31Y28Very low30Very low233 Ų233138.6 Ų138.691%0.91468%0.682SS**  trans-44.6104.8178-88.8-110.6000112.2
32T31.5Very low30.3Very low126 Ų126143.6 Ų143.677%0.77369%0.686SS**  trans-137.7136.9157510000108.7L30L30-T32 PolarHBondContact O-N 3.35Å
33E34.1Very low30.7Very low112 Ų112137.9 Ų137.952%0.52368%0.678SS.*SBendtrans-56.8144.1-170.7-56.5179.814000111.2R187E33-R187 IonicContact OE1-CZ 2.72Å; E33-R187 IonicContact OE1-NH1 3.41Å; E33-R187 PolarHBondContact OE1-NH1 3.01Å; E33-R187 IonicContact OE2-CZ 2.8Å; E33-R187 IonicContact OE2-NH1 3.89Å; E33-R187 PolarHBondContact OE2-NH1 3.33Å
34K34.3Very low30.9Very low99 Ų99134.4 Ų134.443%0.4366%0.657SS.*  trans90.153.8169-45.9-178.9-172.9-176.30120.2F49 D50K34-F49 HydrophobicContact CB-CB 4.47Å; K34-D50 VanDerWaalsContact CD-OD2 3.24Å; K34-D50 WeakPolarHBondContact CD-OD2 3.47Å; K34-D50 IonicContact NZ-OD1 2.69Å; K34-D50 PolarHBondContact NZ-OD1 3.3Å; K34-D50 IonicContact NZ-OD2 3.66Å; K34-D50 PolarHBondContact NZ-OD2 3.48Å
35C29.5Very low31.1Very low89 Ų89129.8 Ų129.860%0.60164%0.64SS**EExtended strand (participates in β ladder)trans-125.5126163.8-69.10000112.6V46C35-V46 HydrophobicContact CB-CG1 3.87Å
36Y37.4Very low31.4Very low64 Ų64123 Ų12325%0.25162%0.623SS.*EExtended strand (participates in β ladder)trans-112.2152.1166.6-68.7-105.2000110.7F49 L194Y36-F49 AromaticContact CD2-CD2 3.9Å; Y36-F49 HydrophobicContact CD2-CD2 3.9Å; Y36-F49 HydrophobicContact CE2-CB 4.34Å; Y36-F49 AromaticContact CE2-CD2 3.38Å; Y36-F49 HydrophobicContact CE2-CD2 3.38Å; Y36-F49 AromaticContact CE2-CE2 3.91Å; Y36-F49 HydrophobicContact CE2-CE2 3.91Å; Y36-F49 HydrophobicContact CE2-CG 4.11Å; Y36-L194 HydrophobicContact CD1-CD2 3.23Å; Y36-L194 HydrophobicContact CD1-CG 4.08Å; Y36-L194 HydrophobicContact CD2-CD2 4.42Å; Y36-L194 HydrophobicContact CE1-CB 4.45Å; Y36-L194 HydrophobicContact CE1-CD1 4.13Å; Y36-L194 HydrophobicContact CE1-CD2 2.95Å; Y36-L194 HydrophobicContact CE1-CG 3.26Å; Y36-L194 HydrophobicContact CE2-CD1 4.29Å; Y36-L194 HydrophobicContact CE2-CD2 4.19Å; Y36-L194 HydrophobicContact CE2-CG 4.29Å; Y36-L194 HydrophobicContact CG-CD2 3.99Å; Y36-L194 VanDerWaalsContact CZ-CD2 3.48Å; Y36-L194 WeakPolarHBondContact OH-CG 3.29Å
37I33.3Very low31.6Very low95 Ų95116.3 Ų116.349%0.48761%0.605SS.*EExtended strand (participates in β ladder)trans-89.8109.8175.1-60.6177.2000107.6V39 V44 F212I37-V39 HydrophobicContact CG2-CG2 4.09Å; I37-V44 HydrophobicContact CG2-CG1 3.44Å; I37-V44 VanDerWaalsContact CG2-CG1 3.44Å; I37-F212 HydrophobicContact CD1-CE2 4.37Å
38L30.9Very low31.9Very low96 Ų96114.5 Ų114.550%0.50359%0.593SS.*EExtended strand (participates in β ladder)trans-81121.4164-74.6170.3000108.3V44 A45 V47L38-V44 WeakPolarHBondContact O-CA 3.38Å; L38-A45 WeakPolarHBondContact CB-O 3.26Å; L38-A45 PolarHBondContact N-O 2.92Å; L38-A45 PolarHBondContact O-N 3.08Å; L38-A45 VanDerWaalsContact O-N 3.12Å; L38-V47 HydrophobicContact CD1-CB 4.16Å; L38-V47 HydrophobicContact CD1-CG2 3.43Å; L38-V47 VanDerWaalsContact CD1-CG2 3.43Å; L38-V47 HydrophobicContact CG-CG2 4.42Å
39V31.7Very low32.3Very low98 Ų98108.9 Ų108.959%0.59457%0.568SS**EExtended strand (participates in β ladder)trans-97.799.6166.5-175.90000106.8I37 V44I37-V39 HydrophobicContact CG2-CG2 4.09Å; V39-V44 HydrophobicContact CG2-CG2 4.28Å
40A30.1Very low32.6Very low59 Ų59105.3 Ų105.349%0.48855%0.553SS.*EExtended strand (participates in β ladder)trans-86.8151.5161.600000108.1R42 S43A40-R42 PolarHBondContact O-N 2.91Å; A40-S43 WeakPolarHBondContact CB-O 3.43Å; A40-S43 PolarHBondContact N-O 2.71Å; A40-S43 PolarHBondContact O-N 2.89Å
41E35.1Very low33.1Very low202 Ų202103.3 Ų103.394%0.94455%0.549SS*.THydrogen-bonded Turntrans-51.4-12.7-166.4-71.8-179.7143.600116.4
42R35.6Very low33.5Very low237 Ų23798.2 Ų98.289%0.89453%0.532SS*.THydrogen-bonded Turntrans-143.916.4168.6-66.2-172.2168.7168.8-4.3114.9A40A40-R42 PolarHBondContact O-N 2.91Å
43S33.9Very low33.6Very low85 Ų85100.4 Ų100.459%0.59453%0.531SS*.EExtended strand (participates in β ladder)trans-157.2132.5-175.1-58.20000112.4A40A40-S43 WeakPolarHBondContact CB-O 3.43Å; A40-S43 PolarHBondContact N-O 2.71Å; A40-S43 PolarHBondContact O-N 2.89Å
44V32.6Very low33.4Very low67 Ų6798.3 Ų98.341%0.40654%0.54SS..EExtended strand (participates in β ladder)trans-101.5116.4173.3174.40000109.6I37 L38 V39I37-V44 HydrophobicContact CG2-CG1 3.44Å; I37-V44 VanDerWaalsContact CG2-CG1 3.44Å; L38-V44 WeakPolarHBondContact O-CA 3.38Å; V39-V44 HydrophobicContact CG2-CG2 4.28Å
45A30.3Very low33.1Very low52 Ų52102.4 Ų102.443%0.4356%0.562SS.*EExtended strand (participates in β ladder)trans-115.4142.1174.200000110.3L38L38-A45 WeakPolarHBondContact CB-O 3.26Å; L38-A45 PolarHBondContact N-O 2.92Å; L38-A45 PolarHBondContact O-N 3.08Å; L38-A45 VanDerWaalsContact O-N 3.12Å
46V33.2Very low33.3Very low80 Ų80103 Ų10349%0.48557%0.568SS.*EExtended strand (participates in β ladder)trans-97.6122.2175-179.30000107.4C35C35-V46 HydrophobicContact CB-CG1 3.87Å
47V34.5Very low33Very low69 Ų69104.5 Ų104.542%0.41859%0.593SS.*EExtended strand (participates in β ladder)trans-130.5138.5-179.3-162.60000109.6L38L38-V47 HydrophobicContact CD1-CB 4.16Å; L38-V47 HydrophobicContact CD1-CG2 3.43Å; L38-V47 VanDerWaalsContact CD1-CG2 3.43Å; L38-V47 HydrophobicContact CG-CG2 4.42Å
48S31.4Very low33.1Very low54 Ų54106.3 Ų106.338%0.37860%0.604SS.*EExtended strand (participates in β ladder)trans-70.4140.7-179.5-174.90000111.6D50 S51S48-D50 VanDerWaalsContact C-N 3.27Å; S48-D50 PolarHBondContact O-N 3.39Å; S48-S51 PolarHBondContact O-N 3.03Å; S48-S51 PolarHBondContact O-OG 3.13Å
49F35Very low33.5Very low72 Ų72110.5 Ų110.532%0.31662%0.621SS.*G310 helixtrans-66.6-27.3-178.7-161.2-101.9000112.9K34 Y36 S51 F52K34-F49 HydrophobicContact CB-CB 4.47Å; Y36-F49 AromaticContact CD2-CD2 3.9Å; Y36-F49 HydrophobicContact CD2-CD2 3.9Å; Y36-F49 HydrophobicContact CE2-CB 4.34Å; Y36-F49 AromaticContact CE2-CD2 3.38Å; Y36-F49 HydrophobicContact CE2-CD2 3.38Å; Y36-F49 AromaticContact CE2-CE2 3.91Å; Y36-F49 HydrophobicContact CE2-CE2 3.91Å; Y36-F49 HydrophobicContact CE2-CG 4.11Å; F49-S51 PolarHBondContact O-N 2.74Å; F49-F52 PolarHBondContact O-N 2.89Å
50D34.3Very low34Very low95 Ų95111.5 Ų111.551%0.50863%0.627SS.*G310 helixtrans-66.2-20.7-178.5-66.5-29.3000113K34 S48 F52K34-D50 VanDerWaalsContact CD-OD2 3.24Å; K34-D50 WeakPolarHBondContact CD-OD2 3.47Å; K34-D50 IonicContact NZ-OD1 2.69Å; K34-D50 PolarHBondContact NZ-OD1 3.3Å; K34-D50 IonicContact NZ-OD2 3.66Å; K34-D50 PolarHBondContact NZ-OD2 3.48Å; S48-D50 VanDerWaalsContact C-N 3.27Å; S48-D50 PolarHBondContact O-N 3.39Å; D50-F52 VanDerWaalsContact C-N 3.32Å; D50-F52 PolarHBondContact O-N 2.75Å
51S39.1Very low34.3Very low85 Ų85115.3 Ų115.359%0.59464%0.644SS**G310 helixtrans-79.7-7.8178.50.50000114.2S48 F49S48-S51 PolarHBondContact O-N 3.03Å; S48-S51 PolarHBondContact O-OG 3.13Å; F49-S51 PolarHBondContact O-N 2.74Å
52F34.7Very low34.4Very low127 Ų127109.4 Ų109.456%0.55764%0.638SS**SBendtrans-101.5-13.6-172.1-148.3-95.7000114.4F49 D50F49-F52 PolarHBondContact O-N 2.89Å; D50-F52 VanDerWaalsContact C-N 3.32Å; D50-F52 PolarHBondContact O-N 2.75Å
53F35.2Very low34.4Very low171 Ų171105.5 Ų105.575%0.7564%0.635SS**SBendtrans-125.724.4177.8-89.4-77.8000113.2M55F53-M55 VanDerWaalsContact C-N 3.3Å; F53-M55 PolarHBondContact O-N 3.37Å
54G28.2Very low34.7Very low68 Ų68109 Ų10970%0.70165%0.646SS**  trans-67.681.1175.900000112.7
55M29.9Very low35Very low185 Ų185110.7 Ų110.791%0.91166%0.661SS**  trans-100.1101.1143.2-73.3-173.684.300106.1F53 A57F53-M55 VanDerWaalsContact C-N 3.3Å; F53-M55 PolarHBondContact O-N 3.37Å; M55-A57 PolarHBondContact O-N 3.1Å
56S33.2Very low35.5Very low102 Ų102113 Ų11371%0.71367%0.674SS**  trans-59.5124.1169.5-143.50000107.7D58S56-D58 PolarHBondContact O-N 3.13Å
57A30Very low35.6Very low95 Ų95113.3 Ų113.379%0.78569%0.694SS**  trans-8684.9166.200000106.9M55M55-A57 PolarHBondContact O-N 3.1Å
58D36.1Very low35.9Very low134 Ų134116.6 Ų116.672%0.71771%0.708SS**  trans-154.5143.9169.7-78.4-48.4000110.2S56S56-D58 PolarHBondContact O-N 3.13Å
59E39.2Very low36.2Very low183 Ų183121.6 Ų121.686%0.85573%0.727SS**  trans75.7140.4166.8-72.3-173.2134.100119.5
60V41.8Very low36.8Very low119 Ų119126 Ų12672%0.72175%0.754SS**  cis-173.9149-25.3127.60000103.1
61T36.4Very low37.3Very low139 Ų139126.5 Ų126.585%0.85376%0.764SS**  trans-34.8127.7176.247.80000115.8
62G38.1Very low38.2Very low78 Ų78125.9 Ų125.980%0.80476%0.756SS**  trans-153.299.1169.300000110.6
63N34.6Very low39.9Very low156 Ų156123.1 Ų123.183%0.83475%0.753SS**  trans-75.6115.9171.5-173.831.7000108.1
64D40.1Very low41.8Very low157 Ų157119.5 Ų119.584%0.8474%0.741SS**  trans-146.3125.6155.6-144.7-3.8000111.3S66D64-S66 PolarHBondContact O-N 2.72Å
65S39.4Very low44.2Very low103 Ų103116.9 Ų116.972%0.7271%0.711SS**  trans-90.2103.2-173.2-58.90000108.2
66S41.5Very low46.7Very low100 Ų100118.3 Ų118.370%0.69971%0.707SS**  trans-154.1112.8167.1-139.60000110.5D64 I68D64-S66 PolarHBondContact O-N 2.72Å; S66-I68 PolarHBondContact O-N 3.28Å
67G34.8Very low49.3Very low87 Ų87116.4 Ų116.490%0.89769%0.692SS**  trans-61.9102.1-179.400000111.3
68I41.4Very low52Low138 Ų138112.4 Ų112.471%0.70866%0.656SS**  trans-140106.6173.9-58.4-172.9000108.9S66S66-I68 PolarHBondContact O-N 3.28Å
69M37.4Very low54.2Low159 Ų159110.7 Ų110.778%0.78365%0.647SS**  trans54.692.6156.2-60.4-161.8179.500119.1C71M69-C71 PolarHBondContact O-N 2.98Å
70N47.4Very low56Low165 Ų165109.9 Ų109.988%0.88264%0.643SS**  trans-69.374.2157.9-82.8-7.2000110.7V72N70-V72 VanDerWaalsContact C-N 3.32Å; N70-V72 PolarHBondContact O-N 3.18Å
71C43.9Very low57.5Low105 Ų105106.9 Ų106.971%0.70964%0.637SS**  trans-75.788.7165.5-68.60000108.7M69 S73M69-C71 PolarHBondContact O-N 2.98Å; C71-S73 PolarHBondContact O-N 2.57Å
72V59.1Low59.5Low73 Ų73101.5 Ų101.544%0.44260%0.603SS.*  trans-64.791.5178.71750000109.1N70 L74 N97 W99N70-V72 VanDerWaalsContact C-N 3.32Å; N70-V72 PolarHBondContact O-N 3.18Å; V72-L74 HydrophobicContact CG1-CD2 4.04Å; V72-L74 HydrophobicContact CG1-CG 4.32Å; V72-L74 PolarHBondContact O-N 2.92Å; V72-L74 VanDerWaalsContact O-N 3.15Å; V72-N97 WeakPolarHBondContact CA-OD1 3.29Å; V72-N97 WeakPolarHBondContact CB-OD1 3.43Å; V72-N97 HydrophobicContact CG1-CB 4.41Å; V72-N97 VanDerWaalsContact CG1-CG 3.43Å; V72-N97 WeakPolarHBondContact CG1-ND2 3.48Å; V72-N97 WeakPolarHBondContact CG1-OD1 3.41Å; V72-N97 WeakPolarHBondContact CG2-OD1 3.24Å; V72-W99 HydrophobicContact CG1-CZ2 4.31Å
73S69.7Low61.7Low69 Ų6997.9 Ų97.948%0.48357%0.565SS.*  trans-67.4113.8170.258.40000108.4C71 N97C71-S73 PolarHBondContact O-N 2.57Å; S73-N97 PolarHBondContact O-ND2 2.86Å
74L75.5Confident64Low95 Ų9591.4 Ų91.450%0.49754%0.536SS..PPolyproline II helixtrans-86.1142.5171-67.2173.9000109.4V72 W99V72-L74 HydrophobicContact CG1-CD2 4.04Å; V72-L74 HydrophobicContact CG1-CG 4.32Å; V72-L74 PolarHBondContact O-N 2.92Å; V72-L74 VanDerWaalsContact O-N 3.15Å; L74-W99 HydrophobicContact CD2-CH2 3.45Å; L74-W99 VanDerWaalsContact CD2-CH2 3.45Å; L74-W99 HydrophobicContact CD2-CZ2 3.69Å
75P78.4Confident66Low12 Ų1286.1 Ų86.18%0.07851%0.506CS..PPolyproline II helixtrans-63.3154.6168.731.8-34.7000108.9W86 F90 C93 L111P75-W86 HydrophobicContact CG-CZ2 4.5Å; P75-F90 HydrophobicContact CG-CB 4.31Å; P75-F90 HydrophobicContact CG-CD2 3.91Å; P75-C93 HydrophobicContact CG-CB 4.49Å; P75-L111 HydrophobicContact CG-CD1 3.83Å
76R83.8Confident68.2Low216 Ų21682.3 Ų82.382%0.81548%0.476SS*.PPolyproline II helixtrans-59.4146.9173.2-67.2-173.4-179.4-142.8-1.5109.8W86R76-W86 PolarHBondContact O-NE1 3.09Å
77P87.1Confident70.5Confident62 Ų6278 Ų7840%0.40345%0.445SS..PPolyproline II helixtrans-53.5145.9169.6-23.533.6000111.4L111 E113P77-L111 CarbonylContact C-O 3.52Å; P77-L111 VanDerWaalsContact CA-O 3.31Å; P77-L111 WeakPolarHBondContact CA-O 3.4Å; P77-E113 HydrophobicContact CB-CG 3.86Å; P77-E113 WeakPolarHBondContact CB-OE1 3.33Å; P77-E113 WeakPolarHBondContact CG-OE1 3.21Å
78F86.9Confident73Confident10 Ų1079.4 Ų79.44%0.04443%0.431CS..BIsolated β-bridgetrans-95.7114.2177.2-176.8-101.8000110.1F83 W86 L111 L112 E113 T116 L142F78-F83 AromaticContact CD1-CD2 3.96Å; F78-F83 HydrophobicContact CD1-CD2 3.96Å; F78-F83 HydrophobicContact CE1-CB 4.26Å; F78-F83 AromaticContact CE1-CD2 3.84Å; F78-F83 HydrophobicContact CE1-CD2 3.84Å; F78-F83 HydrophobicContact CE2-CB 4.37Å; F78-F83 HydrophobicContact CE2-CD2 4.48Å; F78-F83 HydrophobicContact CG-CD2 4.32Å; F78-F83 HydrophobicContact CZ-CB 3.86Å; F78-F83 HydrophobicContact CZ-CD2 4.12Å; F78-W86 HydrophobicContact CB-CD2 3.76Å; F78-W86 HydrophobicContact CB-CE3 4.34Å; F78-W86 HydrophobicContact CB-CG 3.98Å; F78-W86 HydrophobicContact CB-CZ2 4.04Å; F78-W86 HydrophobicContact CD2-CB 3.63Å; F78-W86 AromaticContact CD2-CD1 3.81Å; F78-W86 HydrophobicContact CD2-CD2 4.09Å; F78-W86 AromaticContact CD2-CG 3.55Å; F78-W86 HydrophobicContact CD2-CG 3.55Å; F78-W86 HydrophobicContact CE2-CB 4.05Å; F78-W86 HydrophobicContact CE2-CG 4.44Å; F78-W86 HydrophobicContact CG-CD2 4.14Å; F78-W86 HydrophobicContact CG-CG 4.08Å; F78-L111 PolarHBondContact N-O 3.12Å; F78-L112 HydrophobicContact CB-CD2 4.36Å; F78-E113 PolarHBondContact O-N 3.47Å; F78-T116 HydrophobicContact CD1-CG2 3.77Å; F78-T116 WeakPolarHBondContact CD1-OG1 3.26Å; F78-T116 HydrophobicContact CE1-CG2 4.04Å; F78-T116 VanDerWaalsContact CE1-OG1 3.22Å; F78-T116 WeakPolarHBondContact CE1-OG1 3.2Å; F78-L142 HydrophobicContact CE1-CD1 4.2Å
79D81.1Confident75Confident99 Ų9979.1 Ų79.153%0.52942%0.421SS..  trans-98.6-61.7172.256.8-10.6000110.8
80E77Confident77.5Confident165 Ų16571.6 Ų71.677%0.77138%0.384SS*.SBendtrans-142.5157.3-172.1-64-175-178.600111.9
81G74.7Confident79.4Confident57 Ų5766.9 Ų66.959%0.58836%0.356SS*.SBendtrans112.2-148.3169.600000114.5F83G81-F83 PolarHBondContact O-N 2.86Å; G81-F83 VanDerWaalsContact O-N 3.16Å
82N77.7Confident81.5Confident26 Ų2667.9 Ų67.914%0.13935%0.353CS..  trans-83.396.4-175.3-169.5-21.2000110.9G84 E85 W86 Q143 L179N82-G84 PolarHBondContact O-N 2.85Å; N82-G84 VanDerWaalsContact O-N 3.17Å; N82-G84 WeakPolarHBondContact OD1-CA 3.13Å; N82-G84 PolarHBondContact OD1-N 2.92Å; N82-E85 HydrophobicContact CB-CB 4.13Å; N82-E85 PolarHBondContact O-N 3.36Å; N82-E85 PolarHBondContact OD1-N 2.91Å; N82-W86 PolarHBondContact O-N 2.73Å; N82-W86 VanDerWaalsContact O-N 3.08Å; N82-Q143 PolarHBondContact OD1-NE2 3.4Å; N82-L179 HydrophobicContact CB-CD2 4.07Å; N82-L179 HydrophobicContact CB-CG 4.44Å
83F84.3Confident82.8Confident1 Ų165.3 Ų65.30%0.00434%0.339CS..Hα-helixtrans-54.8-32.2176-174.5-110000113.2F78 G81 W86 L87 L112 L138 K139 L142F78-F83 AromaticContact CD1-CD2 3.96Å; F78-F83 HydrophobicContact CD1-CD2 3.96Å; F78-F83 HydrophobicContact CE1-CB 4.26Å; F78-F83 AromaticContact CE1-CD2 3.84Å; F78-F83 HydrophobicContact CE1-CD2 3.84Å; F78-F83 HydrophobicContact CE2-CB 4.37Å; F78-F83 HydrophobicContact CE2-CD2 4.48Å; F78-F83 HydrophobicContact CG-CD2 4.32Å; F78-F83 HydrophobicContact CZ-CB 3.86Å; F78-F83 HydrophobicContact CZ-CD2 4.12Å; G81-F83 PolarHBondContact O-N 2.86Å; G81-F83 VanDerWaalsContact O-N 3.16Å; F83-W86 AromaticContact CD2-CE3 3.97Å; F83-W86 HydrophobicContact CD2-CE3 3.97Å; F83-W86 HydrophobicContact CD2-CZ3 4.46Å; F83-W86 AromaticContact CE2-CE3 3.65Å; F83-W86 HydrophobicContact CE2-CE3 3.65Å; F83-W86 AromaticContact CE2-CZ3 3.7Å; F83-W86 HydrophobicContact CE2-CZ3 3.7Å; F83-W86 HydrophobicContact CZ-CE3 4.44Å; F83-W86 HydrophobicContact CZ-CZ3 4.31Å; F83-W86 PolarHBondContact O-N 3.27Å; F83-L87 VanDerWaalsContact O-CB 3.22Å; F83-L87 WeakPolarHBondContact O-CB 3.46Å; F83-L87 PolarHBondContact O-N 3.01Å; F83-L112 HydrophobicContact CE2-CD2 4.11Å; F83-L138 HydrophobicContact CE1-CB 3.82Å; F83-L138 HydrophobicContact CZ-CB 3.9Å; F83-L138 HydrophobicContact CZ-CD1 4.06Å; F83-K139 HydrophobicContact CD1-CG 3.7Å; F83-K139 HydrophobicContact CE1-CG 3.96Å; F83-L142 HydrophobicContact CB-CD1 3.83Å; F83-L142 HydrophobicContact CD1-CD1 3.93Å; F83-L142 HydrophobicContact CD2-CD1 3.55Å; F83-L142 HydrophobicContact CE1-CD1 4.39Å; F83-L142 HydrophobicContact CE2-CD1 4.05Å; F83-L142 HydrophobicContact CG-CD1 3.48Å; F83-L142 VanDerWaalsContact CG-CD1 3.48Å; F83-L142 HydrophobicContact CZ-CD1 4.44Å
84G83.5Confident83.6Confident21 Ų2162 Ų6222%0.21632%0.316CS..Hα-helixtrans-66.3-39.9176.400000113.5N82 L88N82-G84 PolarHBondContact O-N 2.85Å; N82-G84 VanDerWaalsContact O-N 3.17Å; N82-G84 WeakPolarHBondContact OD1-CA 3.13Å; N82-G84 PolarHBondContact OD1-N 2.92Å; G84-L88 WeakPolarHBondContact O-CG 2.86Å; G84-L88 PolarHBondContact O-N 3.39Å
85E81Confident84.1Confident46 Ų4659.7 Ų59.722%0.21531%0.314CS..Hα-helixtrans-69-42174.9-169-169151.500111.1N82 L87 L88 R89 Q175N82-E85 HydrophobicContact CB-CB 4.13Å; N82-E85 PolarHBondContact O-N 3.36Å; N82-E85 PolarHBondContact OD1-N 2.91Å; E85-L87 VanDerWaalsContact C-N 3.34Å; E85-L87 PolarHBondContact O-N 3.19Å; E85-L88 WeakPolarHBondContact O-CB 3.45Å; E85-L88 PolarHBondContact O-N 3.08Å; E85-R89 PolarHBondContact O-N 3.19Å; E85-R89 IonicContact OE1-CZ 3.71Å; E85-R89 IonicContact OE1-NE 2.66Å; E85-R89 IonicContact OE1-NH2 2.81Å; E85-R89 PolarHBondContact OE1-NH2 3.47Å; E85-Q175 PolarHBondContact OE2-NE2 3.06Å
86W87.3Confident84.5Confident23 Ų2362.5 Ų62.59%0.08734%0.339CS..Hα-helixtrans-62-43175.8-179.988.2000111.8P75 R76 F78 N82 F83 L88 R89 F90 L108 L111 L112P75-W86 HydrophobicContact CG-CZ2 4.5Å; R76-W86 PolarHBondContact O-NE1 3.09Å; F78-W86 HydrophobicContact CB-CD2 3.76Å; F78-W86 HydrophobicContact CB-CE3 4.34Å; F78-W86 HydrophobicContact CB-CG 3.98Å; F78-W86 HydrophobicContact CB-CZ2 4.04Å; F78-W86 HydrophobicContact CD2-CB 3.63Å; F78-W86 AromaticContact CD2-CD1 3.81Å; F78-W86 HydrophobicContact CD2-CD2 4.09Å; F78-W86 AromaticContact CD2-CG 3.55Å; F78-W86 HydrophobicContact CD2-CG 3.55Å; F78-W86 HydrophobicContact CE2-CB 4.05Å; F78-W86 HydrophobicContact CE2-CG 4.44Å; F78-W86 HydrophobicContact CG-CD2 4.14Å; F78-W86 HydrophobicContact CG-CG 4.08Å; N82-W86 PolarHBondContact O-N 2.73Å; N82-W86 VanDerWaalsContact O-N 3.08Å; F83-W86 AromaticContact CD2-CE3 3.97Å; F83-W86 HydrophobicContact CD2-CE3 3.97Å; F83-W86 HydrophobicContact CD2-CZ3 4.46Å; F83-W86 AromaticContact CE2-CE3 3.65Å; F83-W86 HydrophobicContact CE2-CE3 3.65Å; F83-W86 AromaticContact CE2-CZ3 3.7Å; F83-W86 HydrophobicContact CE2-CZ3 3.7Å; F83-W86 HydrophobicContact CZ-CE3 4.44Å; F83-W86 HydrophobicContact CZ-CZ3 4.31Å; F83-W86 PolarHBondContact O-N 3.27Å; W86-L88 VanDerWaalsContact C-N 3.31Å; W86-L88 PolarHBondContact O-N 3.39Å; W86-R89 WeakPolarHBondContact O-CB 3.32Å; W86-R89 PolarHBondContact O-N 3.32Å; W86-F90 HydrophobicContact CE3-CB 4.47Å; W86-F90 HydrophobicContact CH2-CB 4.32Å; W86-F90 AromaticContact CH2-CD2 3.91Å; W86-F90 HydrophobicContact CH2-CD2 3.91Å; W86-F90 HydrophobicContact CH2-CG 4.31Å; W86-F90 HydrophobicContact CZ2-CD2 4.34Å; W86-F90 HydrophobicContact CZ3-CB 4.25Å; W86-F90 HydrophobicContact CZ3-CD2 4.47Å; W86-F90 HydrophobicContact CZ3-CG 4.45Å; W86-F90 PolarHBondContact O-N 3.12Å; W86-L108 HydrophobicContact CH2-CD1 4.38Å; W86-L108 HydrophobicContact CZ3-CD1 4.09Å; W86-L111 HydrophobicContact CH2-CB 4.13Å; W86-L111 HydrophobicContact CZ2-CB 3.8Å; W86-L112 HydrophobicContact CH2-CD2 3.99Å; W86-L112 HydrophobicContact CZ3-CD2 4.13Å
87L88.3Confident84.5Confident10 Ų1053.6 Ų53.65%0.05231%0.307CS..Hα-helixtrans-62.2-38.1178.5-171.267.3000111.7F83 E85 R89 F90 E91 L108 Y131 T135F83-L87 VanDerWaalsContact O-CB 3.22Å; F83-L87 WeakPolarHBondContact O-CB 3.46Å; F83-L87 PolarHBondContact O-N 3.01Å; E85-L87 VanDerWaalsContact C-N 3.34Å; E85-L87 PolarHBondContact O-N 3.19Å; L87-R89 VanDerWaalsContact C-N 3.31Å; L87-R89 PolarHBondContact O-N 2.69Å; L87-F90 HydrophobicContact CD1-CD1 4.27Å; L87-F90 WeakPolarHBondContact O-CB 3.25Å; L87-F90 PolarHBondContact O-N 3.45Å; L87-E91 VanDerWaalsContact O-CG 3.32Å; L87-E91 WeakPolarHBondContact O-CG 3.2Å; L87-E91 PolarHBondContact O-N 3.18Å; L87-L108 HydrophobicContact CD1-CD1 4.12Å; L87-Y131 WeakPolarHBondContact CD1-OH 3.42Å; L87-T135 HydrophobicContact CD1-CG2 3.85Å; L87-T135 HydrophobicContact CD2-CG2 4.11Å
88L86.8Confident84.4Confident115 Ų11557.8 Ų57.860%0.60233%0.326SS*.Hα-helixtrans-58.9-42.2172.9-77.7163000111.8G84 E85 W86 E91 I92G84-L88 WeakPolarHBondContact O-CG 2.86Å; G84-L88 PolarHBondContact O-N 3.39Å; E85-L88 WeakPolarHBondContact O-CB 3.45Å; E85-L88 PolarHBondContact O-N 3.08Å; W86-L88 VanDerWaalsContact C-N 3.31Å; W86-L88 PolarHBondContact O-N 3.39Å; L88-E91 PolarHBondContact O-N 3.39Å; L88-I92 WeakPolarHBondContact O-CG1 3.45Å; L88-I92 PolarHBondContact O-N 3Å; L88-I92 VanDerWaalsContact O-N 3.09Å
89R85.2Confident84.4Confident133 Ų13359 Ų5950%0.50233%0.331SS..Hα-helixtrans-66.8-41175.4-62.9-177.1-171.5179.85.1111.7E85 W86 L87 E91 I92 C93E85-R89 PolarHBondContact O-N 3.19Å; E85-R89 IonicContact OE1-CZ 3.71Å; E85-R89 IonicContact OE1-NE 2.66Å; E85-R89 IonicContact OE1-NH2 2.81Å; E85-R89 PolarHBondContact OE1-NH2 3.47Å; W86-R89 WeakPolarHBondContact O-CB 3.32Å; W86-R89 PolarHBondContact O-N 3.32Å; L87-R89 VanDerWaalsContact C-N 3.31Å; L87-R89 PolarHBondContact O-N 2.69Å; R89-E91 VanDerWaalsContact C-N 3.3Å; R89-E91 PolarHBondContact O-N 2.75Å; R89-I92 PolarHBondContact O-N 3.47Å; R89-C93 PolarHBondContact O-N 3.24Å; R89-C93 PolarHBondContact O-SG 3.35Å; R89-C93 VanDerWaalsContact O-SG 3.38Å
90F88.1Confident84.7Confident0 Ų058.4 Ų58.40%033%0.327CS..Hα-helixtrans-58.5-43.1174.2176.2-86.6000111.3P75 W86 L87 C93 S94 W99 K104 L108 L111 Y131P75-F90 HydrophobicContact CG-CB 4.31Å; P75-F90 HydrophobicContact CG-CD2 3.91Å; W86-F90 HydrophobicContact CE3-CB 4.47Å; W86-F90 HydrophobicContact CH2-CB 4.32Å; W86-F90 AromaticContact CH2-CD2 3.91Å; W86-F90 HydrophobicContact CH2-CD2 3.91Å; W86-F90 HydrophobicContact CH2-CG 4.31Å; W86-F90 HydrophobicContact CZ2-CD2 4.34Å; W86-F90 HydrophobicContact CZ3-CB 4.25Å; W86-F90 HydrophobicContact CZ3-CD2 4.47Å; W86-F90 HydrophobicContact CZ3-CG 4.45Å; W86-F90 PolarHBondContact O-N 3.12Å; L87-F90 HydrophobicContact CD1-CD1 4.27Å; L87-F90 WeakPolarHBondContact O-CB 3.25Å; L87-F90 PolarHBondContact O-N 3.45Å; F90-C93 PolarHBondContact O-N 2.93Å; F90-S94 VanDerWaalsContact O-CB 3.26Å; F90-S94 WeakPolarHBondContact O-CB 3.07Å; F90-S94 PolarHBondContact O-N 2.86Å; F90-S94 PolarHBondContact O-OG 3.42Å; F90-W99 HydrophobicContact CE2-CE3 4.45Å; F90-W99 AromaticContact CE2-CZ3 3.73Å; F90-W99 HydrophobicContact CE2-CZ3 3.73Å; F90-W99 HydrophobicContact CZ-CE3 4.11Å; F90-W99 AromaticContact CZ-CZ3 3.84Å; F90-W99 HydrophobicContact CZ-CZ3 3.84Å; F90-K104 HydrophobicContact CE1-CB 4.08Å; F90-K104 HydrophobicContact CE1-CD 4.37Å; F90-K104 HydrophobicContact CE1-CG 4.13Å; F90-K104 HydrophobicContact CZ-CB 4.18Å; F90-K104 HydrophobicContact CZ-CG 4.42Å; F90-L108 HydrophobicContact CD1-CD1 4.38Å; F90-L108 HydrophobicContact CE1-CD1 4.15Å; F90-L108 HydrophobicContact CE2-CB 4.39Å; F90-L108 HydrophobicContact CE2-CD1 4.41Å; F90-L108 HydrophobicContact CZ-CB 4.17Å; F90-L108 HydrophobicContact CZ-CD1 4.16Å; F90-L111 HydrophobicContact CD2-CD1 3.84Å; F90-L111 HydrophobicContact CE2-CD1 3.71Å; F90-Y131 WeakPolarHBondContact CD1-OH 3.27Å; F90-Y131 AromaticContact CE1-CE2 3.78Å; F90-Y131 HydrophobicContact CE1-CE2 3.78Å; F90-Y131 AromaticContact CE1-CZ 3.88Å; F90-Y131 VanDerWaalsContact CE1-OH 3.31Å; F90-Y131 WeakPolarHBondContact CE1-OH 3.42Å; F90-Y131 HydrophobicContact CZ-CE2 4.45Å
91E88.4Confident85.3Confident66 Ų6655.1 Ų55.131%0.30832%0.315SS..Hα-helixtrans-63-44.4177.4-71.3-72.1-17100112L87 L88 R89 C93 S94 G95 K104 Y131L87-E91 VanDerWaalsContact O-CG 3.32Å; L87-E91 WeakPolarHBondContact O-CG 3.2Å; L87-E91 PolarHBondContact O-N 3.18Å; L88-E91 PolarHBondContact O-N 3.39Å; R89-E91 VanDerWaalsContact C-N 3.3Å; R89-E91 PolarHBondContact O-N 2.75Å; E91-C93 PolarHBondContact O-N 3.34Å; E91-S94 WeakPolarHBondContact CA-OG 3.37Å; E91-S94 PolarHBondContact O-N 3.23Å; E91-S94 PolarHBondContact O-OG 3.18Å; E91-S94 PolarHBondContact OE2-OG 3.44Å; E91-G95 PolarHBondContact O-N 3.22Å; E91-K104 IonicContact OE2-NZ 2.64Å; E91-K104 PolarHBondContact OE2-NZ 3.1Å; E91-Y131 WeakPolarHBondContact OE1-CE1 3.35Å; E91-Y131 PolarHBondContact OE1-OH 3.07Å
92I86.8Confident86Confident126 Ų12658.7 Ų58.765%0.64632%0.316SS*.Hα-helixtrans-58.7-48.7175-66.4163.9000110.7L88 R89 S94 G95 A96L88-I92 WeakPolarHBondContact O-CG1 3.45Å; L88-I92 PolarHBondContact O-N 3Å; L88-I92 VanDerWaalsContact O-N 3.09Å; R89-I92 PolarHBondContact O-N 3.47Å; I92-S94 VanDerWaalsContact C-N 3.32Å; I92-S94 PolarHBondContact O-N 3.32Å; I92-G95 PolarHBondContact O-N 2.8Å; I92-A96 PolarHBondContact O-N 2.78Å
93C86.5Confident86.4Confident19 Ų1959.1 Ų59.113%0.12832%0.32CS..Hα-helixtrans-63.5-39.4176.8-66.70000111.7P75 R89 F90 E91 G95 A96 N97P75-C93 HydrophobicContact CG-CB 4.49Å; R89-C93 PolarHBondContact O-N 3.24Å; R89-C93 PolarHBondContact O-SG 3.35Å; R89-C93 VanDerWaalsContact O-SG 3.38Å; F90-C93 PolarHBondContact O-N 2.93Å; E91-C93 PolarHBondContact O-N 3.34Å; C93-G95 VanDerWaalsContact C-N 3.31Å; C93-G95 PolarHBondContact O-N 3.06Å; C93-A96 PolarHBondContact O-N 3.25Å; C93-N97 WeakPolarHBondContact O-CB 3.33Å; C93-N97 VanDerWaalsContact O-CG 3.23Å; C93-N97 PolarHBondContact O-N 3.39Å; C93-N97 PolarHBondContact O-ND2 2.81Å
94S87.7Confident86.7Confident1 Ų160.2 Ų60.21%0.00733%0.325CS..Hα-helixtrans-65.9-36.617980.70000111.8F90 E91 I92 N97 N98 W99 K104F90-S94 VanDerWaalsContact O-CB 3.26Å; F90-S94 WeakPolarHBondContact O-CB 3.07Å; F90-S94 PolarHBondContact O-N 2.86Å; F90-S94 PolarHBondContact O-OG 3.42Å; E91-S94 WeakPolarHBondContact CA-OG 3.37Å; E91-S94 PolarHBondContact O-N 3.23Å; E91-S94 PolarHBondContact O-OG 3.18Å; E91-S94 PolarHBondContact OE2-OG 3.44Å; I92-S94 VanDerWaalsContact C-N 3.32Å; I92-S94 PolarHBondContact O-N 3.32Å; S94-N97 CarbonylContact O-C 3.44Å; S94-N97 PolarHBondContact O-N 3.32Å; S94-N98 PolarHBondContact O-N 3.3Å; S94-W99 PolarHBondContact O-N 3.06Å; S94-K104 WeakPolarHBondContact OG-CE 3.37Å; S94-K104 PolarHBondContact OG-NZ 3.49Å
95G85.8Confident86.9Confident45 Ų4559.5 Ų59.546%0.46432%0.317SS..Hα-helixtrans-66.6-45.2173.600000111.7E91 I92 C93 N97 N98E91-G95 PolarHBondContact O-N 3.22Å; I92-G95 PolarHBondContact O-N 2.8Å; C93-G95 VanDerWaalsContact C-N 3.31Å; C93-G95 PolarHBondContact O-N 3.06Å; G95-N97 PolarHBondContact O-N 3.04Å; G95-N98 PolarHBondContact O-N 3.15Å; G95-N98 VanDerWaalsContact O-N 3.14Å; G95-N98 PolarHBondContact O-OD1 2.66Å
96A85.6Confident87.2Confident72 Ų7265.1 Ų65.160%0.59534%0.336SS*.Hα-helixtrans-60.8-30.9174.600000112.8I92 C93I92-A96 PolarHBondContact O-N 2.78Å; C93-A96 PolarHBondContact O-N 3.25Å
97N84.8Confident87.2Confident29 Ų2970.1 Ų70.116%0.15536%0.355CS..THydrogen-bonded Turntrans-95.24.3179.4-64.3-50.4000114.2V72 S73 C93 S94 G95 W99V72-N97 WeakPolarHBondContact CA-OD1 3.29Å; V72-N97 WeakPolarHBondContact CB-OD1 3.43Å; V72-N97 HydrophobicContact CG1-CB 4.41Å; V72-N97 VanDerWaalsContact CG1-CG 3.43Å; V72-N97 WeakPolarHBondContact CG1-ND2 3.48Å; V72-N97 WeakPolarHBondContact CG1-OD1 3.41Å; V72-N97 WeakPolarHBondContact CG2-OD1 3.24Å; S73-N97 PolarHBondContact O-ND2 2.86Å; C93-N97 WeakPolarHBondContact O-CB 3.33Å; C93-N97 VanDerWaalsContact O-CG 3.23Å; C93-N97 PolarHBondContact O-N 3.39Å; C93-N97 PolarHBondContact O-ND2 2.81Å; S94-N97 CarbonylContact O-C 3.44Å; S94-N97 PolarHBondContact O-N 3.32Å; G95-N97 PolarHBondContact O-N 3.04Å; N97-W99 VanDerWaalsContact C-N 3.28Å; N97-W99 HydrophobicContact CB-CD2 4.24Å; N97-W99 HydrophobicContact CB-CG 4.16Å; N97-W99 HydrophobicContact CB-CZ2 4.3Å; N97-W99 VanDerWaalsContact CB-NE1 3.25Å; N97-W99 VanDerWaalsContact O-CD1 3.26Å; N97-W99 PolarHBondContact O-N 3.25Å
98N84.6Confident87.2Confident149 Ų14969.7 Ų69.780%0.79735%0.353SS*.THydrogen-bonded Turntrans50.942.2-176.7-66.1-39.1000114S94 G95S94-N98 PolarHBondContact O-N 3.3Å; G95-N98 PolarHBondContact O-N 3.15Å; G95-N98 VanDerWaalsContact O-N 3.14Å; G95-N98 PolarHBondContact O-OD1 2.66Å
99W87.5Confident87.2Confident37 Ų3764.9 Ų64.914%0.1433%0.329CS..  trans-77.7128.4177.6-66-5.7000111.5V72 L74 F90 S94 N97 V103 K104 R107V72-W99 HydrophobicContact CG1-CZ2 4.31Å; L74-W99 HydrophobicContact CD2-CH2 3.45Å; L74-W99 VanDerWaalsContact CD2-CH2 3.45Å; L74-W99 HydrophobicContact CD2-CZ2 3.69Å; F90-W99 HydrophobicContact CE2-CE3 4.45Å; F90-W99 AromaticContact CE2-CZ3 3.73Å; F90-W99 HydrophobicContact CE2-CZ3 3.73Å; F90-W99 HydrophobicContact CZ-CE3 4.11Å; F90-W99 AromaticContact CZ-CZ3 3.84Å; F90-W99 HydrophobicContact CZ-CZ3 3.84Å; S94-W99 PolarHBondContact O-N 3.06Å; N97-W99 VanDerWaalsContact C-N 3.28Å; N97-W99 HydrophobicContact CB-CD2 4.24Å; N97-W99 HydrophobicContact CB-CG 4.16Å; N97-W99 HydrophobicContact CB-CZ2 4.3Å; N97-W99 VanDerWaalsContact CB-NE1 3.25Å; N97-W99 VanDerWaalsContact O-CD1 3.26Å; N97-W99 PolarHBondContact O-N 3.25Å; W99-V103 HydrophobicContact CB-CB 4.22Å; W99-V103 HydrophobicContact CB-CG1 3.96Å; W99-V103 HydrophobicContact CD2-CG1 4.01Å; W99-V103 HydrophobicContact CG-CB 4.43Å; W99-V103 HydrophobicContact CG-CG1 3.64Å; W99-K104 HydrophobicContact CB-CG 3.88Å; W99-K104 HydrophobicContact CE3-CG 4.37Å; W99-K104 VanDerWaalsContact O-CE 3.24Å; W99-K104 WeakPolarHBondContact O-CE 3.12Å; W99-R107 HydrophobicContact CE3-CB 4.25Å; W99-R107 HydrophobicContact CE3-CG 4.36Å; W99-R107 HydrophobicContact CH2-CB 4.03Å; W99-R107 HydrophobicContact CH2-CG 4.03Å; W99-R107 HydrophobicContact CZ2-CG 4.23Å; W99-R107 HydrophobicContact CZ3-CB 3.78Å; W99-R107 HydrophobicContact CZ3-CG 4.1Å
100N88.1Confident87.3Confident85 Ų8563.1 Ų63.146%0.45533%0.332SS..  trans-77.2167.1166.271.88.4000111E102 V103 K104N100-E102 PolarHBondContact O-N 2.86Å; N100-E102 PolarHBondContact OD1-N 3.36Å; N100-V103 PolarHBondContact O-N 3.4Å; N100-V103 WeakPolarHBondContact OD1-CB 3.33Å; N100-V103 WeakPolarHBondContact OD1-CG2 3.34Å; N100-V103 PolarHBondContact OD1-N 3.44Å; N100-K104 WeakPolarHBondContact O-CG 3.49Å; N100-K104 PolarHBondContact O-N 3.48Å
101D89.5Confident87.3Confident97 Ų9763.7 Ų63.752%0.51934%0.335SS..Hα-helixtrans-59.2-32.3-176.2-73.4-3.8000113.3K104 A105D101-K104 PolarHBondContact O-N 2.84Å; D101-A105 VanDerWaalsContact O-CB 3.3Å; D101-A105 WeakPolarHBondContact O-CB 3.26Å; D101-A105 PolarHBondContact O-N 3.5Å
102E87.7Confident87.4Confident131 Ų13161 Ų6161%0.61232%0.323SS*.Hα-helixtrans-68.2-40175.6-61.3-178.917300112.6N100 R106N100-E102 PolarHBondContact O-N 2.86Å; N100-E102 PolarHBondContact OD1-N 3.36Å; E102-R106 WeakPolarHBondContact O-CG 3.14Å; E102-R106 PolarHBondContact O-N 3.32Å; E102-R106 VanDerWaalsContact O-N 3.16Å; E102-R106 PolarHBondContact O-NE 3.02Å
103V87.6Confident87.4Confident36 Ų3659.8 Ų59.822%0.21832%0.315CS..Hα-helixtrans-69.2-42.2174.6173.20000109.5W99 N100 A105 R106 R107W99-V103 HydrophobicContact CB-CB 4.22Å; W99-V103 HydrophobicContact CB-CG1 3.96Å; W99-V103 HydrophobicContact CD2-CG1 4.01Å; W99-V103 HydrophobicContact CG-CB 4.43Å; W99-V103 HydrophobicContact CG-CG1 3.64Å; N100-V103 PolarHBondContact O-N 3.4Å; N100-V103 WeakPolarHBondContact OD1-CB 3.33Å; N100-V103 WeakPolarHBondContact OD1-CG2 3.34Å; N100-V103 PolarHBondContact OD1-N 3.44Å; V103-A105 PolarHBondContact O-N 3.05Å; V103-R106 PolarHBondContact O-N 3.38Å; V103-R107 HydrophobicContact CG1-CG 3.97Å; V103-R107 WeakPolarHBondContact O-CB 3.37Å; V103-R107 VanDerWaalsContact O-CG 3.24Å; V103-R107 WeakPolarHBondContact O-CG 3.42Å; V103-R107 PolarHBondContact O-N 3.44Å
104K89.4Confident87.4Confident24 Ų2461.5 Ų61.510%0.10434%0.336CS..Hα-helixtrans-58.6-47.3174.9-67.1-178.5-168.6-170.60111.5F90 E91 S94 W99 N100 D101 R106 R107 L108 Y131F90-K104 HydrophobicContact CE1-CB 4.08Å; F90-K104 HydrophobicContact CE1-CD 4.37Å; F90-K104 HydrophobicContact CE1-CG 4.13Å; F90-K104 HydrophobicContact CZ-CB 4.18Å; F90-K104 HydrophobicContact CZ-CG 4.42Å; E91-K104 IonicContact OE2-NZ 2.64Å; E91-K104 PolarHBondContact OE2-NZ 3.1Å; S94-K104 WeakPolarHBondContact OG-CE 3.37Å; S94-K104 PolarHBondContact OG-NZ 3.49Å; W99-K104 HydrophobicContact CB-CG 3.88Å; W99-K104 HydrophobicContact CE3-CG 4.37Å; W99-K104 VanDerWaalsContact O-CE 3.24Å; W99-K104 WeakPolarHBondContact O-CE 3.12Å; N100-K104 WeakPolarHBondContact O-CG 3.49Å; N100-K104 PolarHBondContact O-N 3.48Å; D101-K104 PolarHBondContact O-N 2.84Å; K104-R106 VanDerWaalsContact C-N 3.29Å; K104-R106 PolarHBondContact O-N 2.82Å; K104-R107 PolarHBondContact O-N 2.91Å; K104-L108 VanDerWaalsContact O-CB 3.26Å; K104-L108 WeakPolarHBondContact O-CB 3.24Å; K104-L108 PolarHBondContact O-N 2.78Å; K104-Y131 HydrophobicContact CB-CD2 3.53Å; K104-Y131 HydrophobicContact CB-CE2 3.61Å; K104-Y131 HydrophobicContact CB-CG 4.04Å; K104-Y131 HydrophobicContact CD-CD1 4.2Å; K104-Y131 HydrophobicContact CD-CE1 3.93Å; K104-Y131 HydrophobicContact CD-CE2 4.24Å; K104-Y131 HydrophobicContact CD-CG 4.48Å; K104-Y131 HydrophobicContact CG-CE2 4.49Å
105A88.5Confident87.2Confident6 Ų669.4 Ų69.45%0.0537%0.373CS..Hα-helixtrans-60.8-36178.100000112.8D101 V103 P109D101-A105 VanDerWaalsContact O-CB 3.3Å; D101-A105 WeakPolarHBondContact O-CB 3.26Å; D101-A105 PolarHBondContact O-N 3.5Å; V103-A105 PolarHBondContact O-N 3.05Å; A105-P109 WeakPolarHBondContact O-CD 3.34Å
106R87.1Confident87.2Confident164 Ų16467.4 Ų67.462%0.61935%0.352SS*.Hα-helixtrans-75.9-35175.2-73.2-176.2-71177.1-3.9113.6E102 V103 K104 P109E102-R106 WeakPolarHBondContact O-CG 3.14Å; E102-R106 PolarHBondContact O-N 3.32Å; E102-R106 VanDerWaalsContact O-N 3.16Å; E102-R106 PolarHBondContact O-NE 3.02Å; V103-R106 PolarHBondContact O-N 3.38Å; K104-R106 VanDerWaalsContact C-N 3.29Å; K104-R106 PolarHBondContact O-N 2.82Å; R106-P109 WeakPolarHBondContact O-CG 3.5Å
107R87.2Confident87.3Confident128 Ų12867.6 Ų67.648%0.48334%0.339SS..Hα-helixtrans-82.1-36.4-177.3-70.7-67-176.4-176.30.1112.8W99 V103 K104 T110W99-R107 HydrophobicContact CE3-CB 4.25Å; W99-R107 HydrophobicContact CE3-CG 4.36Å; W99-R107 HydrophobicContact CH2-CB 4.03Å; W99-R107 HydrophobicContact CH2-CG 4.03Å; W99-R107 HydrophobicContact CZ2-CG 4.23Å; W99-R107 HydrophobicContact CZ3-CB 3.78Å; W99-R107 HydrophobicContact CZ3-CG 4.1Å; V103-R107 HydrophobicContact CG1-CG 3.97Å; V103-R107 WeakPolarHBondContact O-CB 3.37Å; V103-R107 VanDerWaalsContact O-CG 3.24Å; V103-R107 WeakPolarHBondContact O-CG 3.42Å; V103-R107 PolarHBondContact O-N 3.44Å; K104-R107 PolarHBondContact O-N 2.91Å; R107-T110 WeakPolarHBondContact O-CB 3.26Å; R107-T110 PolarHBondContact O-N 3.36Å; R107-T110 PolarHBondContact O-OG1 3.33Å
108L87.9Confident87.4Confident0 Ų070.2 Ų70.20%035%0.353CS..G310 helixtrans-49.3-52.5-178.9-171119000113.2W86 L87 F90 K104 T110 L111 L112 Y131 L134 T135 L138W86-L108 HydrophobicContact CH2-CD1 4.38Å; W86-L108 HydrophobicContact CZ3-CD1 4.09Å; L87-L108 HydrophobicContact CD1-CD1 4.12Å; F90-L108 HydrophobicContact CD1-CD1 4.38Å; F90-L108 HydrophobicContact CE1-CD1 4.15Å; F90-L108 HydrophobicContact CE2-CB 4.39Å; F90-L108 HydrophobicContact CE2-CD1 4.41Å; F90-L108 HydrophobicContact CZ-CB 4.17Å; F90-L108 HydrophobicContact CZ-CD1 4.16Å; K104-L108 VanDerWaalsContact O-CB 3.26Å; K104-L108 WeakPolarHBondContact O-CB 3.24Å; K104-L108 PolarHBondContact O-N 2.78Å; L108-T110 PolarHBondContact O-N 2.95Å; L108-T110 VanDerWaalsContact O-N 3.17Å; L108-L111 PolarHBondContact O-N 2.79Å; L108-L112 HydrophobicContact CD2-CD1 3.98Å; L108-L112 WeakPolarHBondContact O-CG 3.4Å; L108-Y131 HydrophobicContact CD1-CE2 3.92Å; L108-L134 HydrophobicContact CD2-CD1 4.47Å; L108-L134 HydrophobicContact CD2-CD2 3.74Å; L108-L134 HydrophobicContact CD2-CG 4.01Å; L108-T135 HydrophobicContact CD1-CG2 4.39Å; L108-L138 HydrophobicContact CD2-CD1 3.43Å; L108-L138 VanDerWaalsContact CD2-CD1 3.43Å
109P86.6Confident87.5Confident15 Ų1563.8 Ų63.810%0.09732%0.32CS..G310 helixtrans-63.7-23.2-179.126.1-36.5000114.2A105 R106 L111 L112 Y120A105-P109 WeakPolarHBondContact O-CD 3.34Å; R106-P109 WeakPolarHBondContact O-CG 3.5Å; P109-L111 PolarHBondContact O-N 2.89Å; P109-L112 PolarHBondContact O-N 3.13Å; P109-Y120 HydrophobicContact CB-CD1 3.84Å; P109-Y120 HydrophobicContact CB-CD2 4.26Å; P109-Y120 HydrophobicContact CB-CE1 3.51Å; P109-Y120 HydrophobicContact CB-CE2 3.95Å; P109-Y120 HydrophobicContact CB-CG 4.2Å; P109-Y120 HydrophobicContact CG-CE1 4.17Å; P109-Y120 HydrophobicContact CG-CE2 4.23Å
110T87.4Confident87.6Confident95 Ų9563.7 Ų63.758%0.58332%0.32SS*.G310 helixtrans-73.5-11.7176.469.30000113.3R107 L108R107-T110 WeakPolarHBondContact O-CB 3.26Å; R107-T110 PolarHBondContact O-N 3.36Å; R107-T110 PolarHBondContact O-OG1 3.33Å; L108-T110 PolarHBondContact O-N 2.95Å; L108-T110 VanDerWaalsContact O-N 3.17Å
111L89.1Confident87.6Confident12 Ų1264.7 Ų64.76%0.06332%0.322CS..G310 helixtrans-112.27179.7-61.2162.5000111.9P75 P77 F78 W86 F90 L108 P109P75-L111 HydrophobicContact CG-CD1 3.83Å; P77-L111 CarbonylContact C-O 3.52Å; P77-L111 VanDerWaalsContact CA-O 3.31Å; P77-L111 WeakPolarHBondContact CA-O 3.4Å; F78-L111 PolarHBondContact N-O 3.12Å; W86-L111 HydrophobicContact CH2-CB 4.13Å; W86-L111 HydrophobicContact CZ2-CB 3.8Å; F90-L111 HydrophobicContact CD2-CD1 3.84Å; F90-L111 HydrophobicContact CE2-CD1 3.71Å; L108-L111 PolarHBondContact O-N 2.79Å; P109-L111 PolarHBondContact O-N 2.89Å
112L89.1Confident87.6Confident9 Ų970.1 Ų70.15%0.04734%0.335CS..BIsolated β-bridgetrans-98.5133.4174.8-56179.5000109F78 F83 W86 L108 P109 T116 F117 Y120 L138F78-L112 HydrophobicContact CB-CD2 4.36Å; F83-L112 HydrophobicContact CE2-CD2 4.11Å; W86-L112 HydrophobicContact CH2-CD2 3.99Å; W86-L112 HydrophobicContact CZ3-CD2 4.13Å; L108-L112 HydrophobicContact CD2-CD1 3.98Å; L108-L112 WeakPolarHBondContact O-CG 3.4Å; P109-L112 PolarHBondContact O-N 3.13Å; L112-T116 HydrophobicContact CB-CG2 4.18Å; L112-T116 HydrophobicContact CD1-CG2 4.07Å; L112-T116 HydrophobicContact CD2-CG2 3.77Å; L112-T116 HydrophobicContact CG-CG2 4.18Å; L112-F117 HydrophobicContact CB-CB 4.21Å; L112-F117 HydrophobicContact CB-CD2 4.45Å; L112-Y120 HydrophobicContact CD1-CG 4.47Å; L112-L138 HydrophobicContact CD1-CD1 3.96Å
113E88.7Confident87.7Confident101 Ų10164.7 Ų64.747%0.47231%0.31SS..  trans-120.6164.8176.3-65.8-173.1-178.800111P77 F78 E115 T116 F117P77-E113 HydrophobicContact CB-CG 3.86Å; P77-E113 WeakPolarHBondContact CB-OE1 3.33Å; P77-E113 WeakPolarHBondContact CG-OE1 3.21Å; F78-E113 PolarHBondContact O-N 3.47Å; E113-E115 PolarHBondContact O-N 3.15Å; E113-T116 WeakPolarHBondContact O-CB 3.12Å; E113-T116 PolarHBondContact O-N 2.82Å; E113-F117 PolarHBondContact O-N 3.25Å
114G85.7Confident87.8Confident56 Ų5666.2 Ų66.258%0.57732%0.322SS*.Hα-helixtrans56.3-134.5172.500000114.9T116 F117 L118G114-T116 PolarHBondContact O-N 3.34Å; G114-F117 PolarHBondContact O-N 3.41Å; G114-L118 PolarHBondContact O-N 2.91Å
115E83.4Confident87.7Confident166 Ų16669.7 Ų69.778%0.77634%0.342SS*.Hα-helixtrans-61.5-28.9-178.4-63.9-167158.400112.8E113 L118 A119E113-E115 PolarHBondContact O-N 3.15Å; E115-L118 WeakPolarHBondContact O-CB 3.4Å; E115-L118 PolarHBondContact O-N 3.3Å; E115-A119 PolarHBondContact O-N 3.15Å
116T85.2Confident87.7Confident4 Ų474.1 Ų74.13%0.02537%0.365CS..Hα-helixtrans-68.9-38.9-179.3-53.30000111.9F78 L112 E113 G114 L118 A119 Y120 L142F78-T116 HydrophobicContact CD1-CG2 3.77Å; F78-T116 WeakPolarHBondContact CD1-OG1 3.26Å; F78-T116 HydrophobicContact CE1-CG2 4.04Å; F78-T116 VanDerWaalsContact CE1-OG1 3.22Å; F78-T116 WeakPolarHBondContact CE1-OG1 3.2Å; L112-T116 HydrophobicContact CB-CG2 4.18Å; L112-T116 HydrophobicContact CD1-CG2 4.07Å; L112-T116 HydrophobicContact CD2-CG2 3.77Å; L112-T116 HydrophobicContact CG-CG2 4.18Å; E113-T116 WeakPolarHBondContact O-CB 3.12Å; E113-T116 PolarHBondContact O-N 2.82Å; G114-T116 PolarHBondContact O-N 3.34Å; T116-L118 VanDerWaalsContact C-N 3.35Å; T116-A119 WeakPolarHBondContact O-CB 3.4Å; T116-A119 PolarHBondContact O-N 3.47Å; T116-Y120 PolarHBondContact O-N 2.9Å; T116-Y120 VanDerWaalsContact O-N 3.09Å; T116-L142 HydrophobicContact CG2-CD1 3.57Å; T116-L142 HydrophobicContact CG2-CD2 3.89Å; T116-L142 HydrophobicContact CG2-CG 4.29Å
117F88Confident87.7Confident75 Ų7566.8 Ų66.833%0.32934%0.338SS..Hα-helixtrans-66.8-37.8173-175.8-108.1000111.9L112 E113 G114 A119 Y120 Q121L112-F117 HydrophobicContact CB-CB 4.21Å; L112-F117 HydrophobicContact CB-CD2 4.45Å; E113-F117 PolarHBondContact O-N 3.25Å; G114-F117 PolarHBondContact O-N 3.41Å; F117-A119 VanDerWaalsContact C-N 3.32Å; F117-A119 PolarHBondContact O-N 3.16Å; F117-Y120 HydrophobicContact CE2-CD1 4.33Å; F117-Y120 WeakPolarHBondContact O-CB 3.34Å; F117-Y120 PolarHBondContact O-N 2.64Å; F117-Q121 HydrophobicContact CD1-CG 4.39Å; F117-Q121 HydrophobicContact CE1-CG 4.06Å; F117-Q121 HydrophobicContact CZ-CG 4.29Å; F117-Q121 WeakPolarHBondContact O-CG 3.13Å; F117-Q121 PolarHBondContact O-N 3.4Å
118L87.4Confident87.7Confident85 Ų8563.1 Ų63.145%0.44533%0.325SS..Hα-helixtrans-63.7-37.9173.9-64.3177.2000112G114 E115 T116 Q121 R122G114-L118 PolarHBondContact O-N 2.91Å; E115-L118 WeakPolarHBondContact O-CB 3.4Å; E115-L118 PolarHBondContact O-N 3.3Å; T116-L118 VanDerWaalsContact C-N 3.35Å; L118-Q121 PolarHBondContact O-N 2.77Å; L118-R122 WeakPolarHBondContact O-CG 3.23Å; L118-R122 PolarHBondContact O-N 3.32Å
119A87.4Confident87.4Confident13 Ų1372.9 Ų72.911%0.10736%0.361CS..Hα-helixtrans-62-43.9173.800000111.3E115 T116 F117 Q121 R122 L138 N141E115-A119 PolarHBondContact O-N 3.15Å; T116-A119 WeakPolarHBondContact O-CB 3.4Å; T116-A119 PolarHBondContact O-N 3.47Å; F117-A119 VanDerWaalsContact C-N 3.32Å; F117-A119 PolarHBondContact O-N 3.16Å; A119-Q121 VanDerWaalsContact C-N 3.31Å; A119-Q121 PolarHBondContact O-N 2.95Å; A119-R122 PolarHBondContact O-N 3.48Å; A119-R122 VanDerWaalsContact O-N 3.14Å; A119-L138 HydrophobicContact CB-CD2 4.33Å; A119-N141 HydrophobicContact CB-CB 4.36Å
120Y88.3Confident87.5Confident36 Ų3675.9 Ų75.914%0.14138%0.376CS..Hα-helixtrans-58.1-41.6173172.8-98.8000112.7P109 L112 T116 F117 R122 L123 R128 L134P109-Y120 HydrophobicContact CB-CD1 3.84Å; P109-Y120 HydrophobicContact CB-CD2 4.26Å; P109-Y120 HydrophobicContact CB-CE1 3.51Å; P109-Y120 HydrophobicContact CB-CE2 3.95Å; P109-Y120 HydrophobicContact CB-CG 4.2Å; P109-Y120 HydrophobicContact CG-CE1 4.17Å; P109-Y120 HydrophobicContact CG-CE2 4.23Å; L112-Y120 HydrophobicContact CD1-CG 4.47Å; T116-Y120 PolarHBondContact O-N 2.9Å; T116-Y120 VanDerWaalsContact O-N 3.09Å; F117-Y120 HydrophobicContact CE2-CD1 4.33Å; F117-Y120 WeakPolarHBondContact O-CB 3.34Å; F117-Y120 PolarHBondContact O-N 2.64Å; Y120-R122 PolarHBondContact O-N 3.2Å; Y120-L123 PolarHBondContact O-N 3.4Å; Y120-L123 VanDerWaalsContact O-N 3.16Å; Y120-R128 HydrophobicContact CD2-CG 4.43Å; Y120-R128 HydrophobicContact CE2-CB 4.24Å; Y120-R128 HydrophobicContact CE2-CG 3.66Å; Y120-R128 PolarHBondContact O-NE 3.38Å; Y120-R128 PolarHBondContact O-NH2 2.67Å; Y120-L134 HydrophobicContact CD2-CD1 3.6Å; Y120-L134 HydrophobicContact CE2-CD1 3.69Å; Y120-L134 HydrophobicContact CE2-CD2 4.26Å
121Q89.5Confident87.6Confident105 Ų10572 Ų7249%0.49135%0.351SS..Hα-helixtrans-63.9-20178.2-76.8-169.4-21.400114F117 L118 A119 R128F117-Q121 HydrophobicContact CD1-CG 4.39Å; F117-Q121 HydrophobicContact CE1-CG 4.06Å; F117-Q121 HydrophobicContact CZ-CG 4.29Å; F117-Q121 WeakPolarHBondContact O-CG 3.13Å; F117-Q121 PolarHBondContact O-N 3.4Å; L118-Q121 PolarHBondContact O-N 2.77Å; A119-Q121 VanDerWaalsContact C-N 3.31Å; A119-Q121 PolarHBondContact O-N 2.95Å; Q121-R128 PolarHBondContact O-NH2 3.41Å
122R89Confident87.6Confident211 Ų21173 Ų7380%0.79637%0.365SS*.Hα-helixtrans-86.9-15.3176.8-66.7171.8-176.8171.82.4113.8L118 A119 Y120L118-R122 WeakPolarHBondContact O-CG 3.23Å; L118-R122 PolarHBondContact O-N 3.32Å; A119-R122 PolarHBondContact O-N 3.48Å; A119-R122 VanDerWaalsContact O-N 3.14Å; Y120-R122 PolarHBondContact O-N 3.2Å
123L90Very high87.6Confident18 Ų1878.1 Ų78.19%0.09438%0.384CS..SBendtrans-73.8147.9179.3-58.7177.9000111.5Y120 V127 R128 L134 E137 L138Y120-L123 PolarHBondContact O-N 3.4Å; Y120-L123 VanDerWaalsContact O-N 3.16Å; L123-V127 HydrophobicContact CB-CG1 4.34Å; L123-V127 HydrophobicContact CD1-CG1 4.15Å; L123-R128 HydrophobicContact CB-CG 4.38Å; L123-R128 PolarHBondContact O-NE 3.41Å; L123-R128 PolarHBondContact O-NH2 3.19Å; L123-L134 HydrophobicContact CD1-CD1 3.72Å; L123-E137 HydrophobicContact CD1-CB 4.11Å; L123-E137 HydrophobicContact CD2-CB 3.78Å; L123-E137 HydrophobicContact CD2-CG 4.38Å; L123-L138 HydrophobicContact CD1-CD2 4.2Å; L123-L138 HydrophobicContact CD1-CG 4.16Å
124S89.5Confident87.6Confident67 Ų6773.3 Ų73.347%0.46936%0.361SS..  trans-69.7153.7174.8640000111.8D126 V127 R128S124-D126 PolarHBondContact O-N 3.2Å; S124-V127 WeakPolarHBondContact O-CB 3.45Å; S124-V127 PolarHBondContact O-N 2.8Å; S124-V127 WeakPolarHBondContact OG-CG2 3.47Å; S124-R128 WeakPolarHBondContact O-CG 3.46Å; S124-R128 PolarHBondContact O-N 3.05Å; S124-R128 VanDerWaalsContact O-N 3.08Å
125D87.4Confident87.8Confident97 Ų9771.3 Ų71.352%0.51934%0.338SS..Hα-helixtrans-62.3-29.5-178.7-68.3-29.1000113.2V127 R128 R129D125-V127 VanDerWaalsContact C-N 3.35Å; D125-R128 PolarHBondContact O-N 2.97Å; D125-R128 IonicContact OD1-CZ 3.33Å; D125-R128 IonicContact OD1-NH1 2.67Å; D125-R128 PolarHBondContact OD1-NH1 3.37Å; D125-R129 WeakPolarHBondContact O-CG 3.32Å; D125-R129 PolarHBondContact O-N 2.87Å; D125-R129 VanDerWaalsContact O-N 3.13Å
126D87Confident88Confident99 Ų9966.8 Ų66.853%0.52932%0.322SS..Hα-helixtrans-62.6-40.7174.1-176.561.6000111.9S124 R133S124-D126 PolarHBondContact O-N 3.2Å; D126-R133 IonicContact OD2-CZ 3.2Å; D126-R133 IonicContact OD2-NH1 3.51Å; D126-R133 PolarHBondContact OD2-NH1 3.49Å; D126-R133 IonicContact OD2-NH2 3.62Å; D126-R133 PolarHBondContact OD2-NH2 3.37Å
127V87.7Confident88.2Confident10 Ų1070.1 Ų70.16%0.06134%0.337CS..Hα-helixtrans-69.4-40.5174.5172.50000110.8L123 S124 D125 R129 N130 R133 E137L123-V127 HydrophobicContact CB-CG1 4.34Å; L123-V127 HydrophobicContact CD1-CG1 4.15Å; S124-V127 WeakPolarHBondContact O-CB 3.45Å; S124-V127 PolarHBondContact O-N 2.8Å; S124-V127 WeakPolarHBondContact OG-CG2 3.47Å; D125-V127 VanDerWaalsContact C-N 3.35Å; V127-R129 VanDerWaalsContact C-N 3.29Å; V127-R129 PolarHBondContact O-N 3.23Å; V127-N130 PolarHBondContact O-N 3.17Å; V127-R133 HydrophobicContact CG1-CB 4.26Å; V127-E137 HydrophobicContact CG1-CB 4.12Å; V127-E137 HydrophobicContact CG1-CG 3.81Å
128R86.9Confident88.2Confident52 Ų5266.6 Ų66.620%0.19632%0.322CS..Hα-helixtrans-64.2-31.5-178.2-67.5176.6177.3152.63.4113.7Y120 Q121 L123 S124 D125 N130Y120-R128 HydrophobicContact CD2-CG 4.43Å; Y120-R128 HydrophobicContact CE2-CB 4.24Å; Y120-R128 HydrophobicContact CE2-CG 3.66Å; Y120-R128 PolarHBondContact O-NE 3.38Å; Y120-R128 PolarHBondContact O-NH2 2.67Å; Q121-R128 PolarHBondContact O-NH2 3.41Å; L123-R128 HydrophobicContact CB-CG 4.38Å; L123-R128 PolarHBondContact O-NE 3.41Å; L123-R128 PolarHBondContact O-NH2 3.19Å; S124-R128 WeakPolarHBondContact O-CG 3.46Å; S124-R128 PolarHBondContact O-N 3.05Å; S124-R128 VanDerWaalsContact O-N 3.08Å; D125-R128 PolarHBondContact O-N 2.97Å; D125-R128 IonicContact OD1-CZ 3.33Å; D125-R128 IonicContact OD1-NH1 2.67Å; D125-R128 PolarHBondContact OD1-NH1 3.37Å; R128-N130 VanDerWaalsContact C-N 3.33Å
129R82.8Confident88.1Confident204 Ų20466.5 Ų66.577%0.7732%0.318SS*.Hα-helixtrans-74.1-24.7179.1-72175-174.6-170.12.6113D125 V127D125-R129 WeakPolarHBondContact O-CG 3.32Å; D125-R129 PolarHBondContact O-N 2.87Å; D125-R129 VanDerWaalsContact O-N 3.13Å; V127-R129 VanDerWaalsContact C-N 3.29Å; V127-R129 PolarHBondContact O-N 3.23Å
130N88.4Confident87.9Confident78 Ų7870.2 Ų70.242%0.41734%0.336SS..  trans-104.3110-178.3-174.7-61.7000110.6V127 R128 G132 R133 L134V127-N130 PolarHBondContact O-N 3.17Å; R128-N130 VanDerWaalsContact C-N 3.33Å; N130-G132 VanDerWaalsContact C-N 3.32Å; N130-G132 PolarHBondContact O-N 3.23Å; N130-G132 PolarHBondContact OD1-N 3.28Å; N130-G132 VanDerWaalsContact OD1-N 3.12Å; N130-R133 HydrophobicContact CB-CB 4.15Å; N130-R133 HydrophobicContact CB-CG 4.27Å; N130-R133 PolarHBondContact O-N 3.45Å; N130-R133 PolarHBondContact OD1-N 3.14Å; N130-L134 VanDerWaalsContact O-CB 3.26Å; N130-L134 WeakPolarHBondContact O-CB 3.36Å; N130-L134 PolarHBondContact O-N 2.91Å
131Y88.7Confident87.6Confident13 Ų1372.8 Ų72.85%0.05135%0.352CS..Hα-helixtrans-56.3-41.7-177.1-178.9-106.4000113.8L87 F90 E91 K104 L108 L134 T135L87-Y131 WeakPolarHBondContact CD1-OH 3.42Å; F90-Y131 WeakPolarHBondContact CD1-OH 3.27Å; F90-Y131 AromaticContact CE1-CE2 3.78Å; F90-Y131 HydrophobicContact CE1-CE2 3.78Å; F90-Y131 AromaticContact CE1-CZ 3.88Å; F90-Y131 VanDerWaalsContact CE1-OH 3.31Å; F90-Y131 WeakPolarHBondContact CE1-OH 3.42Å; F90-Y131 HydrophobicContact CZ-CE2 4.45Å; E91-Y131 WeakPolarHBondContact OE1-CE1 3.35Å; E91-Y131 PolarHBondContact OE1-OH 3.07Å; K104-Y131 HydrophobicContact CB-CD2 3.53Å; K104-Y131 HydrophobicContact CB-CE2 3.61Å; K104-Y131 HydrophobicContact CB-CG 4.04Å; K104-Y131 HydrophobicContact CD-CD1 4.2Å; K104-Y131 HydrophobicContact CD-CE1 3.93Å; K104-Y131 HydrophobicContact CD-CE2 4.24Å; K104-Y131 HydrophobicContact CD-CG 4.48Å; K104-Y131 HydrophobicContact CG-CE2 4.49Å; L108-Y131 HydrophobicContact CD1-CE2 3.92Å; Y131-L134 PolarHBondContact O-N 2.95Å; Y131-T135 HydrophobicContact CD1-CG2 4.44Å; Y131-T135 HydrophobicContact CD2-CG2 4.12Å; Y131-T135 HydrophobicContact CE1-CG2 3.97Å; Y131-T135 HydrophobicContact CE2-CG2 3.62Å; Y131-T135 HydrophobicContact CG-CG2 4.5Å; Y131-T135 WeakPolarHBondContact O-CG2 3.37Å; Y131-T135 PolarHBondContact O-N 2.87Å; Y131-T135 PolarHBondContact O-OG1 3.31Å
132G88.5Confident87.1Confident35 Ų3570.1 Ų70.136%0.36134%0.341SS..Hα-helixtrans-64.9-42.6179.500000112.7N130 T135 T136N130-G132 VanDerWaalsContact C-N 3.32Å; N130-G132 PolarHBondContact O-N 3.23Å; N130-G132 PolarHBondContact OD1-N 3.28Å; N130-G132 VanDerWaalsContact OD1-N 3.12Å; G132-T135 PolarHBondContact O-OG1 2.9Å; G132-T135 VanDerWaalsContact O-OG1 3.1Å; G132-T136 WeakPolarHBondContact O-CB 3.48Å; G132-T136 PolarHBondContact O-N 3.48Å; G132-T136 PolarHBondContact O-OG1 2.72Å
133R89.1Confident86.3Confident116 Ų11662.9 Ų62.944%0.43832%0.316SS..Hα-helixtrans-69.5-43.3175.8-66.8179.866.9-166.7-3.8111.4D126 V127 N130 T135 T136 E137D126-R133 IonicContact OD2-CZ 3.2Å; D126-R133 IonicContact OD2-NH1 3.51Å; D126-R133 PolarHBondContact OD2-NH1 3.49Å; D126-R133 IonicContact OD2-NH2 3.62Å; D126-R133 PolarHBondContact OD2-NH2 3.37Å; V127-R133 HydrophobicContact CG1-CB 4.26Å; N130-R133 HydrophobicContact CB-CB 4.15Å; N130-R133 HydrophobicContact CB-CG 4.27Å; N130-R133 PolarHBondContact O-N 3.45Å; N130-R133 PolarHBondContact OD1-N 3.14Å; R133-T135 PolarHBondContact O-N 2.85Å; R133-T136 PolarHBondContact O-N 3.29Å; R133-E137 WeakPolarHBondContact O-CB 3.33Å; R133-E137 WeakPolarHBondContact O-CG 3.38Å; R133-E137 PolarHBondContact O-N 3.24Å
134L90.1Very high85.3Confident0 Ų064.7 Ų64.70%033%0.329CS..Hα-helixtrans-55.3-51176.9173.759.5000112.2L108 Y120 L123 N130 Y131 T136 E137 L138L108-L134 HydrophobicContact CD2-CD1 4.47Å; L108-L134 HydrophobicContact CD2-CD2 3.74Å; L108-L134 HydrophobicContact CD2-CG 4.01Å; Y120-L134 HydrophobicContact CD2-CD1 3.6Å; Y120-L134 HydrophobicContact CE2-CD1 3.69Å; Y120-L134 HydrophobicContact CE2-CD2 4.26Å; L123-L134 HydrophobicContact CD1-CD1 3.72Å; N130-L134 VanDerWaalsContact O-CB 3.26Å; N130-L134 WeakPolarHBondContact O-CB 3.36Å; N130-L134 PolarHBondContact O-N 2.91Å; Y131-L134 PolarHBondContact O-N 2.95Å; L134-T136 VanDerWaalsContact C-N 3.34Å; L134-T136 PolarHBondContact O-N 3.38Å; L134-E137 PolarHBondContact O-N 3.39Å; L134-L138 HydrophobicContact CD1-CD1 3.76Å; L134-L138 HydrophobicContact CD1-CG 4.14Å; L134-L138 HydrophobicContact CG-CD1 4.11Å; L134-L138 WeakPolarHBondContact O-CB 3.15Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.34Å
135T89.7Confident83.8Confident13 Ų1367.1 Ų67.18%0.0834%0.343CS..Hα-helixtrans-67.3-34.8-179.352.90000112.6L87 L108 Y131 G132 R133 K139L87-T135 HydrophobicContact CD1-CG2 3.85Å; L87-T135 HydrophobicContact CD2-CG2 4.11Å; L108-T135 HydrophobicContact CD1-CG2 4.39Å; Y131-T135 HydrophobicContact CD1-CG2 4.44Å; Y131-T135 HydrophobicContact CD2-CG2 4.12Å; Y131-T135 HydrophobicContact CE1-CG2 3.97Å; Y131-T135 HydrophobicContact CE2-CG2 3.62Å; Y131-T135 HydrophobicContact CG-CG2 4.5Å; Y131-T135 WeakPolarHBondContact O-CG2 3.37Å; Y131-T135 PolarHBondContact O-N 2.87Å; Y131-T135 PolarHBondContact O-OG1 3.31Å; G132-T135 PolarHBondContact O-OG1 2.9Å; G132-T135 VanDerWaalsContact O-OG1 3.1Å; R133-T135 PolarHBondContact O-N 2.85Å; T135-K139 WeakPolarHBondContact O-CB 3.4Å; T135-K139 VanDerWaalsContact O-CG 3.26Å; T135-K139 WeakPolarHBondContact O-CG 3.37Å; T135-K139 PolarHBondContact O-N 2.91Å
136T87.6Confident82.4Confident72 Ų7267.6 Ų67.644%0.44235%0.352SS..Hα-helixtrans-67.1-48.1176.2-58.10000111.2G132 R133 L134 L138 K139 N140G132-T136 WeakPolarHBondContact O-CB 3.48Å; G132-T136 PolarHBondContact O-N 3.48Å; G132-T136 PolarHBondContact O-OG1 2.72Å; R133-T136 PolarHBondContact O-N 3.29Å; L134-T136 VanDerWaalsContact C-N 3.34Å; L134-T136 PolarHBondContact O-N 3.38Å; T136-L138 PolarHBondContact O-N 2.84Å; T136-K139 WeakPolarHBondContact O-CB 3.44Å; T136-K139 PolarHBondContact O-N 3.45Å; T136-N140 VanDerWaalsContact O-CG 3.26Å; T136-N140 PolarHBondContact O-N 3.4Å; T136-N140 PolarHBondContact O-ND2 3.5Å
137E88.7Confident81.8Confident74 Ų7464.7 Ų64.735%0.34634%0.34SS..Hα-helixtrans-65.2-39.7178-73.2-57.7139.700112.2L123 V127 R133 L134 N140 N141L123-E137 HydrophobicContact CD1-CB 4.11Å; L123-E137 HydrophobicContact CD2-CB 3.78Å; L123-E137 HydrophobicContact CD2-CG 4.38Å; V127-E137 HydrophobicContact CG1-CB 4.12Å; V127-E137 HydrophobicContact CG1-CG 3.81Å; R133-E137 WeakPolarHBondContact O-CB 3.33Å; R133-E137 WeakPolarHBondContact O-CG 3.38Å; R133-E137 PolarHBondContact O-N 3.24Å; L134-E137 PolarHBondContact O-N 3.39Å; E137-N140 PolarHBondContact O-N 2.6Å; E137-N141 WeakPolarHBondContact O-CB 3.47Å; E137-N141 PolarHBondContact O-N 3.43Å; E137-N141 PolarHBondContact O-ND2 3.32Å
138L88.3Confident81Confident0 Ų065.7 Ų65.70%035%0.349CS..Hα-helixtrans-64.3-43173.9-75.3172.9000111.8F83 L108 L112 A119 L123 L134 T136 N140 N141 L142F83-L138 HydrophobicContact CE1-CB 3.82Å; F83-L138 HydrophobicContact CZ-CB 3.9Å; F83-L138 HydrophobicContact CZ-CD1 4.06Å; L108-L138 HydrophobicContact CD2-CD1 3.43Å; L108-L138 VanDerWaalsContact CD2-CD1 3.43Å; L112-L138 HydrophobicContact CD1-CD1 3.96Å; A119-L138 HydrophobicContact CB-CD2 4.33Å; L123-L138 HydrophobicContact CD1-CD2 4.2Å; L123-L138 HydrophobicContact CD1-CG 4.16Å; L134-L138 HydrophobicContact CD1-CD1 3.76Å; L134-L138 HydrophobicContact CD1-CG 4.14Å; L134-L138 HydrophobicContact CG-CD1 4.11Å; L134-L138 WeakPolarHBondContact O-CB 3.15Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.34Å; T136-L138 PolarHBondContact O-N 2.84Å; L138-N140 VanDerWaalsContact C-N 3.31Å; L138-N140 PolarHBondContact O-N 2.81Å; L138-N141 PolarHBondContact O-N 3.21Å; L138-L142 HydrophobicContact CB-CD1 4.41Å; L138-L142 VanDerWaalsContact O-CB 3.29Å; L138-L142 WeakPolarHBondContact O-CB 3.04Å; L138-L142 WeakPolarHBondContact O-CD1 3.45Å; L138-L142 WeakPolarHBondContact O-CG 3.5Å; L138-L142 PolarHBondContact O-N 2.99Å
139K85.3Confident80.6Confident83 Ų8373 Ų7336%0.36138%0.377SS..Hα-helixtrans-57.1-45.1173.3-80.6172.8178.3172.20111.6F83 T135 T136 Q143F83-K139 HydrophobicContact CD1-CG 3.7Å; F83-K139 HydrophobicContact CE1-CG 3.96Å; T135-K139 WeakPolarHBondContact O-CB 3.4Å; T135-K139 VanDerWaalsContact O-CG 3.26Å; T135-K139 WeakPolarHBondContact O-CG 3.37Å; T135-K139 PolarHBondContact O-N 2.91Å; T136-K139 WeakPolarHBondContact O-CB 3.44Å; T136-K139 PolarHBondContact O-N 3.45Å; K139-Q143 WeakPolarHBondContact O-CA 3.32Å; K139-Q143 WeakPolarHBondContact O-CB 3.42Å; K139-Q143 PolarHBondContact O-N 3.16Å
140N82.9Confident80.4Confident92 Ų9265.6 Ų65.649%0.49236%0.36SS..Hα-helixtrans-66.2-39.3-179.7-69.3-19.7000112.7T136 E137 L138T136-N140 VanDerWaalsContact O-CG 3.26Å; T136-N140 PolarHBondContact O-N 3.4Å; T136-N140 PolarHBondContact O-ND2 3.5Å; E137-N140 PolarHBondContact O-N 2.6Å; L138-N140 VanDerWaalsContact C-N 3.31Å; L138-N140 PolarHBondContact O-N 2.81Å
141N82.6Confident79.8Confident89 Ų8962.3 Ų62.348%0.47634%0.343SS..Hα-helixtrans-73.1-38178.7-78-61.6000112.9A119 E137 L138A119-N141 HydrophobicContact CB-CB 4.36Å; E137-N141 WeakPolarHBondContact O-CB 3.47Å; E137-N141 PolarHBondContact O-N 3.43Å; E137-N141 PolarHBondContact O-ND2 3.32Å; L138-N141 PolarHBondContact O-N 3.21Å
142L79.2Confident79.5Confident49 Ų4965.2 Ų65.226%0.25736%0.356SS..Hα-helixtrans-83.9-26.9-178.2-62.6169.4000112.9F78 F83 T116 L138 P144F78-L142 HydrophobicContact CE1-CD1 4.2Å; F83-L142 HydrophobicContact CB-CD1 3.83Å; F83-L142 HydrophobicContact CD1-CD1 3.93Å; F83-L142 HydrophobicContact CD2-CD1 3.55Å; F83-L142 HydrophobicContact CE1-CD1 4.39Å; F83-L142 HydrophobicContact CE2-CD1 4.05Å; F83-L142 HydrophobicContact CG-CD1 3.48Å; F83-L142 VanDerWaalsContact CG-CD1 3.48Å; F83-L142 HydrophobicContact CZ-CD1 4.44Å; T116-L142 HydrophobicContact CG2-CD1 3.57Å; T116-L142 HydrophobicContact CG2-CD2 3.89Å; T116-L142 HydrophobicContact CG2-CG 4.29Å; L138-L142 HydrophobicContact CB-CD1 4.41Å; L138-L142 VanDerWaalsContact O-CB 3.29Å; L138-L142 WeakPolarHBondContact O-CB 3.04Å; L138-L142 WeakPolarHBondContact O-CD1 3.45Å; L138-L142 WeakPolarHBondContact O-CG 3.5Å; L138-L142 PolarHBondContact O-N 2.99Å; L142-P144 VanDerWaalsContact C-CD 3.42Å
143Q72.8Confident79.2Confident60 Ų6067.1 Ų67.128%0.2836%0.361SS..SBendtrans-127.365.3179-61.8-178.8-4.800110.2N82 K139N82-Q143 PolarHBondContact OD1-NE2 3.4Å; K139-Q143 WeakPolarHBondContact O-CA 3.32Å; K139-Q143 WeakPolarHBondContact O-CB 3.42Å; K139-Q143 PolarHBondContact O-N 3.16Å
144P67.7Low78.8Confident56 Ų5667.3 Ų67.336%0.36437%0.367SS..  trans-58.7150175.324.1-32.5000109.5L142 C146 S147L142-P144 VanDerWaalsContact C-CD 3.42Å; P144-C146 PolarHBondContact O-N 3.17Å; P144-S147 WeakPolarHBondContact O-CA 3.35Å; P144-S147 WeakPolarHBondContact O-CB 3.47Å; P144-S147 PolarHBondContact O-N 3.37Å; P144-S147 PolarHBondContact O-OG 3.24Å
145P58.5Low78.5Confident118 Ų11867.8 Ų67.877%0.76637%0.369SS*.THydrogen-bonded Turntrans-57.3-26.7-175.219.8-32.1000113.9S147 A148P145-S147 PolarHBondContact O-N 2.92Å; P145-A148 PolarHBondContact O-N 2.97Å
146C58.6Low78.1Confident106 Ų10673.2 Ų73.272%0.71639%0.391SS*.Hα-helixtrans-62.3-22.6171.8-65.90000113.6P144 A148 A150P144-C146 PolarHBondContact O-N 3.17Å; C146-A148 VanDerWaalsContact C-N 3.32Å; C146-A148 PolarHBondContact O-N 2.98Å; C146-A150 PolarHBondContact O-N 3.39Å
147S73Confident77.8Confident39 Ų3975.3 Ų75.327%0.27340%0.4SS..Hα-helixtrans-65.6-31.1176.271.90000112.5P144 P145 R149 A150 A151P144-S147 WeakPolarHBondContact O-CA 3.35Å; P144-S147 WeakPolarHBondContact O-CB 3.47Å; P144-S147 PolarHBondContact O-N 3.37Å; P144-S147 PolarHBondContact O-OG 3.24Å; P145-S147 PolarHBondContact O-N 2.92Å; S147-R149 PolarHBondContact O-N 3.44Å; S147-A150 PolarHBondContact O-N 3.43Å; S147-A151 WeakPolarHBondContact O-CB 3.39Å; S147-A151 PolarHBondContact O-N 3.45Å
148A72.5Confident77.4Confident30 Ų3073.6 Ų73.625%0.24839%0.392CS..Hα-helixtrans-63.4-43.3-179.600000111.7P145 C146 A151 F152P145-A148 PolarHBondContact O-N 2.97Å; C146-A148 VanDerWaalsContact C-N 3.32Å; C146-A148 PolarHBondContact O-N 2.98Å; A148-A151 PolarHBondContact O-N 3.02Å; A148-F152 WeakPolarHBondContact O-CB 3.33Å; A148-F152 PolarHBondContact O-N 3.48Å
149R76.7Confident76.9Confident205 Ų20579.9 Ų79.977%0.77442%0.416SS*.Hα-helixtrans-65.3-43.1176.5-168.2176.574.6153.21.4111.3S147 F152 V153S147-R149 PolarHBondContact O-N 3.44Å; R149-F152 PolarHBondContact O-N 3.11Å; R149-V153 WeakPolarHBondContact O-CG2 3.44Å; R149-V153 PolarHBondContact O-N 3Å; R149-V153 VanDerWaalsContact O-N 3.07Å
150A78.6Confident76.6Confident50 Ų5078.7 Ų78.741%0.41341%0.409SS..Hα-helixtrans-63.9-44.8176.800000111.6C146 S147 F152 V153 Q154C146-A150 PolarHBondContact O-N 3.39Å; S147-A150 PolarHBondContact O-N 3.43Å; A150-F152 VanDerWaalsContact C-N 3.31Å; A150-F152 PolarHBondContact O-N 3.43Å; A150-V153 PolarHBondContact O-N 2.78Å; A150-Q154 WeakPolarHBondContact O-CG 3.27Å; A150-Q154 PolarHBondContact O-N 3.29Å
151A77.7Confident76.5Confident9 Ų982.2 Ų82.27%0.07442%0.415CS..Hα-helixtrans-61.8-37.9175.600000111.6S147 A148 Q154 F155 L179 A180S147-A151 WeakPolarHBondContact O-CB 3.39Å; S147-A151 PolarHBondContact O-N 3.45Å; A148-A151 PolarHBondContact O-N 3.02Å; A151-Q154 PolarHBondContact O-N 3.33Å; A151-F155 WeakPolarHBondContact O-CB 3.49Å; A151-F155 PolarHBondContact O-N 2.8Å; A151-L179 HydrophobicContact CB-CB 3.82Å; A151-A180 HydrophobicContact CB-CB 4.07Å
152F81.5Confident76Confident73 Ų7385.1 Ų85.132%0.3244%0.437SS..Hα-helixtrans-66.3-39.2175-171-109.6000112.7A148 R149 A150 F155 K156 A180 V181A148-F152 WeakPolarHBondContact O-CB 3.33Å; A148-F152 PolarHBondContact O-N 3.48Å; R149-F152 PolarHBondContact O-N 3.11Å; A150-F152 VanDerWaalsContact C-N 3.31Å; A150-F152 PolarHBondContact O-N 3.43Å; F152-F155 PolarHBondContact O-N 3.2Å; F152-K156 HydrophobicContact CD1-CD 4.29Å; F152-K156 HydrophobicContact CE1-CD 3.86Å; F152-K156 HydrophobicContact CE1-CG 4.45Å; F152-K156 HydrophobicContact CZ-CD 4.28Å; F152-K156 VanDerWaalsContact CZ-CE 3.42Å; F152-K156 PolarHBondContact O-N 3.39Å; F152-A180 HydrophobicContact CB-CB 3.86Å; F152-A180 HydrophobicContact CD2-CB 4.09Å; F152-V181 HydrophobicContact CD2-CG2 4.4Å
153V82Confident75.9Confident76 Ų7687 Ų8746%0.46147%0.469SS..Hα-helixtrans-64.1-43.7172.71730000110.4R149 A150 K156 N157R149-V153 WeakPolarHBondContact O-CG2 3.44Å; R149-V153 PolarHBondContact O-N 3Å; R149-V153 VanDerWaalsContact O-N 3.07Å; A150-V153 PolarHBondContact O-N 2.78Å; V153-K156 PolarHBondContact O-N 2.85Å; V153-N157 WeakPolarHBondContact CG1-ND2 3.44Å; V153-N157 WeakPolarHBondContact O-CB 3.4Å; V153-N157 VanDerWaalsContact O-CG 3.32Å; V153-N157 PolarHBondContact O-N 2.88Å; V153-N157 PolarHBondContact O-ND2 2.88Å
154Q81.1Confident76.2Confident119 Ų11985.5 Ų85.556%0.55646%0.461SS*.Hα-helixtrans-61.2-45.4174.9-71.7-175.711.700111.8A150 A151 K156 N157 M158A150-Q154 WeakPolarHBondContact O-CG 3.27Å; A150-Q154 PolarHBondContact O-N 3.29Å; A151-Q154 PolarHBondContact O-N 3.33Å; Q154-K156 PolarHBondContact O-N 3.05Å; Q154-N157 CarbonylContact O-C 3.5Å; Q154-N157 PolarHBondContact O-N 3.15Å; Q154-M158 WeakPolarHBondContact O-CB 3.18Å; Q154-M158 PolarHBondContact O-N 3.39Å
155F83.7Confident76.6Confident10 Ų1085.7 Ų85.74%0.04446%0.464CS..Hα-helixtrans-56.3-47.8176.4169.8-99.2000111.7A151 F152 N157 M158 L173 A176 L177 L192 L193 Q200A151-F155 WeakPolarHBondContact O-CB 3.49Å; A151-F155 PolarHBondContact O-N 2.8Å; F152-F155 PolarHBondContact O-N 3.2Å; F155-N157 VanDerWaalsContact C-N 3.34Å; F155-N157 PolarHBondContact O-N 2.81Å; F155-M158 PolarHBondContact O-N 3.39Å; F155-L173 HydrophobicContact CD2-CD1 3.55Å; F155-L173 HydrophobicContact CD2-CG 4.17Å; F155-L173 HydrophobicContact CE2-CD1 3.44Å; F155-L173 VanDerWaalsContact CE2-CD1 3.44Å; F155-L173 HydrophobicContact CE2-CG 3.72Å; F155-L173 HydrophobicContact CG-CD1 4.5Å; F155-L173 HydrophobicContact CZ-CD1 4.32Å; F155-A176 HydrophobicContact CB-CB 4.13Å; F155-A176 HydrophobicContact CD2-CB 4.31Å; F155-L177 HydrophobicContact CD1-CD1 4.37Å; F155-L177 HydrophobicContact CD2-CB 3.77Å; F155-L177 HydrophobicContact CD2-CD1 4.23Å; F155-L177 HydrophobicContact CE1-CD1 4.05Å; F155-L177 HydrophobicContact CE2-CB 3.64Å; F155-L177 HydrophobicContact CE2-CD1 3.89Å; F155-L177 HydrophobicContact CE2-CD2 4.3Å; F155-L177 HydrophobicContact CE2-CG 4.14Å; F155-L177 HydrophobicContact CG-CD1 4.46Å; F155-L177 HydrophobicContact CZ-CB 4.41Å; F155-L177 HydrophobicContact CZ-CD1 3.8Å; F155-L177 HydrophobicContact CZ-CD2 4.43Å; F155-L177 HydrophobicContact CZ-CG 4.43Å; F155-L192 HydrophobicContact CZ-CB 4.48Å; F155-L193 HydrophobicContact CE2-CD2 4.15Å; F155-Q200 PolarHBondContact O-NE2 3.05Å
156K81.3Confident77.3Confident128 Ų12883.1 Ų83.156%0.55745%0.446SS*.Hα-helixtrans-63.2-39.6177.3-80.1-173.1166.7178.90112.9F152 V153 Q154 M158 Q200F152-K156 HydrophobicContact CD1-CD 4.29Å; F152-K156 HydrophobicContact CE1-CD 3.86Å; F152-K156 HydrophobicContact CE1-CG 4.45Å; F152-K156 HydrophobicContact CZ-CD 4.28Å; F152-K156 VanDerWaalsContact CZ-CE 3.42Å; F152-K156 PolarHBondContact O-N 3.39Å; V153-K156 PolarHBondContact O-N 2.85Å; Q154-K156 PolarHBondContact O-N 3.05Å; K156-M158 VanDerWaalsContact C-N 3.34Å; K156-Q200 PolarHBondContact O-NE2 2.87Å
157N80.8Confident78Confident115 Ų11586.3 Ų86.362%0.61544%0.443SS*.Hα-helixtrans-87.6-2.6-176.8-67.6-22.6000113.4V153 Q154 F155 R159V153-N157 WeakPolarHBondContact CG1-ND2 3.44Å; V153-N157 WeakPolarHBondContact O-CB 3.4Å; V153-N157 VanDerWaalsContact O-CG 3.32Å; V153-N157 PolarHBondContact O-N 2.88Å; V153-N157 PolarHBondContact O-ND2 2.88Å; Q154-N157 CarbonylContact O-C 3.5Å; Q154-N157 PolarHBondContact O-N 3.15Å; F155-N157 VanDerWaalsContact C-N 3.34Å; F155-N157 PolarHBondContact O-N 2.81Å; N157-R159 WeakPolarHBondContact O-CG 3.49Å; N157-R159 PolarHBondContact O-N 2.95Å
158M80.6Confident78.2Confident38 Ų3887.7 Ų87.719%0.18745%0.45CS..  trans-67.7123.9-176.7-166.8138.9-79.100110Q154 F155 K156 F169 R172 L173 A176 Q200Q154-M158 WeakPolarHBondContact O-CB 3.18Å; Q154-M158 PolarHBondContact O-N 3.39Å; F155-M158 PolarHBondContact O-N 3.39Å; K156-M158 VanDerWaalsContact C-N 3.34Å; M158-F169 HydrophobicContact CG-CE2 4.29Å; M158-R172 HydrophobicContact SD-CB 4.16Å; M158-R172 PolarHBondContact SD-NH1 2.97Å; M158-L173 HydrophobicContact CB-CD1 4.25Å; M158-A176 HydrophobicContact SD-CB 4.32Å; M158-Q200 VanDerWaalsContact O-CG 3.23Å; M158-Q200 WeakPolarHBondContact O-CG 3.39Å; M158-Q200 PolarHBondContact O-NE2 2.86Å
159R78.9Confident78.5Confident132 Ų13286.3 Ų86.350%0.49844%0.438SS..  trans-112.6152.9178.1-56.8-17481.3173.4-0.8109.9N157 R161 R172 N204N157-R159 WeakPolarHBondContact O-CG 3.49Å; N157-R159 PolarHBondContact O-N 2.95Å; R159-R161 PolarHBondContact O-N 2.86Å; R159-R172 PolarHBondContact O-NH2 3.32Å; R159-N204 PolarHBondContact NH2-OD1 2.86Å; R159-N204 VanDerWaalsContact NH2-OD1 3.15Å
160W77.9Confident78.7Confident58 Ų5879 Ų7922%0.2242%0.416CS..PPolyproline II helixtrans-70.6127171.2-176.726.1000109.5E164 V166 F169 L201 N204 C205W160-E164 WeakPolarHBondContact CZ2-O 3.4Å; W160-E164 PolarHBondContact NE1-O 3.43Å; W160-V166 HydrophobicContact CH2-CG2 4.07Å; W160-V166 HydrophobicContact CZ2-CG2 3.89Å; W160-F169 HydrophobicContact CB-CD1 4.34Å; W160-F169 HydrophobicContact CB-CD2 3.96Å; W160-F169 HydrophobicContact CB-CE1 4.5Å; W160-F169 HydrophobicContact CB-CE2 4.15Å; W160-F169 HydrophobicContact CB-CG 4.07Å; W160-F169 HydrophobicContact CB-CZ 4.42Å; W160-F169 AromaticContact CD1-CG 3.92Å; W160-F169 HydrophobicContact CG-CB 4.31Å; W160-F169 HydrophobicContact CG-CD1 4.47Å; W160-F169 HydrophobicContact CG-CD2 4.42Å; W160-F169 HydrophobicContact CG-CG 4.14Å; W160-L201 HydrophobicContact CB-CD2 4.27Å; W160-L201 HydrophobicContact CD2-CD2 3.63Å; W160-L201 HydrophobicContact CE3-CD2 3.28Å; W160-L201 HydrophobicContact CG-CD2 4.07Å; W160-L201 HydrophobicContact CZ3-CD2 3.78Å; W160-N204 PolarHBondContact N-ND2 3.36Å; W160-N204 PolarHBondContact O-ND2 3.47Å; W160-C205 VanDerWaalsContact CZ3-SG 3.55Å
161R80.4Confident78.7Confident166 Ų16681 Ų8163%0.62642%0.417SS*.PPolyproline II helixtrans-83.1144.3-179.5-62.6178.3178.6179.8-0.5109.9R159 G163 E164R159-R161 PolarHBondContact O-N 2.86Å; R161-G163 PolarHBondContact O-N 3.42Å; R161-E164 HydrophobicContact CB-CB 4.17Å; R161-E164 PolarHBondContact N-OE2 3.19Å; R161-E164 WeakPolarHBondContact O-CB 3.43Å; R161-E164 PolarHBondContact O-N 3.36Å
162T73.7Confident78.9Confident150 Ų15082.4 Ų82.492%0.9242%0.42SS*.THydrogen-bonded Turntrans-62129173.545.70000110
163G76.7Confident79Confident90 Ų9078.9 Ų78.993%0.92841%0.405SS*.THydrogen-bonded Turntrans87.9-5.5-178.500000115.2R161R161-G163 PolarHBondContact O-N 3.42Å
164E79.1Confident79.1Confident28 Ų2877 Ų7713%0.13139%0.394CS..  trans-85.4142.2176.8-173.9-173.9-16900111.3W160 R161 T168 F169 R172W160-E164 WeakPolarHBondContact CZ2-O 3.4Å; W160-E164 PolarHBondContact NE1-O 3.43Å; R161-E164 HydrophobicContact CB-CB 4.17Å; R161-E164 PolarHBondContact N-OE2 3.19Å; R161-E164 WeakPolarHBondContact O-CB 3.43Å; R161-E164 PolarHBondContact O-N 3.36Å; E164-T168 HydrophobicContact CG-CG2 3.95Å; E164-T168 VanDerWaalsContact OE1-C 3.23Å; E164-T168 WeakPolarHBondContact OE1-CB 3.4Å; E164-T168 VanDerWaalsContact OE1-CG2 3.27Å; E164-T168 WeakPolarHBondContact OE1-CG2 3.26Å; E164-F169 WeakPolarHBondContact OE1-CA 3.22Å; E164-F169 PolarHBondContact OE1-N 3.14Å; E164-F169 VanDerWaalsContact OE1-N 3.16Å; E164-R172 VanDerWaalsContact CD-NH2 3.31Å; E164-R172 IonicContact OE1-CZ 3.79Å; E164-R172 IonicContact OE1-NE 2.84Å; E164-R172 PolarHBondContact OE1-NE 3.07Å; E164-R172 IonicContact OE1-NH2 3.25Å; E164-R172 PolarHBondContact OE1-NH2 3.09Å; E164-R172 IonicContact OE2-CZ 2.64Å; E164-R172 IonicContact OE2-NE 3.39Å; E164-R172 IonicContact OE2-NH2 3.62Å; E164-R172 PolarHBondContact OE2-NH2 2.75Å
165S75.6Confident79.1Confident59 Ų5974 Ų7441%0.41338%0.38SS..  trans-68.1149.6172.686.60000111.7R167 T168 F169S165-R167 PolarHBondContact O-N 3.37Å; S165-R167 PolarHBondContact OG-N 3.36Å; S165-T168 PolarHBondContact O-N 3.06Å; S165-T168 VanDerWaalsContact O-N 3.15Å; S165-T168 PolarHBondContact OG-N 3.17Å; S165-T168 PolarHBondContact OG-OG1 3.19Å; S165-F169 PolarHBondContact O-N 3.36Å
166V73.7Confident79.1Confident65 Ų6574 Ų7439%0.39438%0.381SS..Hα-helixtrans-57.1-35.4174.31790000111.1W160 F169 V170 L201W160-V166 HydrophobicContact CH2-CG2 4.07Å; W160-V166 HydrophobicContact CZ2-CG2 3.89Å; V166-F169 PolarHBondContact O-N 2.94Å; V166-V170 HydrophobicContact CG1-CG2 4.27Å; V166-V170 WeakPolarHBondContact O-CG2 3.44Å; V166-V170 PolarHBondContact O-N 2.75Å; V166-L201 HydrophobicContact CG1-CD1 4.4Å
167R73.5Confident79.3Confident173 Ų17367.9 Ų67.965%0.65336%0.355SS*.Hα-helixtrans-62.6-46.8177.6-68.2-177176.7-175.8-0.7111.7S165 F169 V170 H171S165-R167 PolarHBondContact O-N 3.37Å; S165-R167 PolarHBondContact OG-N 3.36Å; R167-F169 VanDerWaalsContact C-N 3.32Å; R167-F169 PolarHBondContact O-N 3.26Å; R167-V170 PolarHBondContact O-N 3.35Å; R167-H171 WeakPolarHBondContact O-CB 3.22Å; R167-H171 PolarHBondContact O-N 3.32Å
168T77.2Confident79.3Confident68 Ų6865.2 Ų65.242%0.41734%0.34SS..Hα-helixtrans-63.4-40.4177.5-46.10000110.9E164 S165 H171 R172E164-T168 HydrophobicContact CG-CG2 3.95Å; E164-T168 VanDerWaalsContact OE1-C 3.23Å; E164-T168 WeakPolarHBondContact OE1-CB 3.4Å; E164-T168 VanDerWaalsContact OE1-CG2 3.27Å; E164-T168 WeakPolarHBondContact OE1-CG2 3.26Å; S165-T168 PolarHBondContact O-N 3.06Å; S165-T168 VanDerWaalsContact O-N 3.15Å; S165-T168 PolarHBondContact OG-N 3.17Å; S165-T168 PolarHBondContact OG-OG1 3.19Å; T168-H171 WeakPolarHBondContact O-CB 3.17Å; T168-H171 PolarHBondContact O-N 2.85Å; T168-R172 WeakPolarHBondContact O-CG 3.36Å; T168-R172 PolarHBondContact O-N 2.97Å
169F78.1Confident79.2Confident0 Ų065.6 Ų65.60%034%0.343CS..Hα-helixtrans-62.5-49.6176.3170.2-113.7000112.2M158 W160 E164 S165 V166 R167 H171 R172 L173 A197 Q200 L201M158-F169 HydrophobicContact CG-CE2 4.29Å; W160-F169 HydrophobicContact CB-CD1 4.34Å; W160-F169 HydrophobicContact CB-CD2 3.96Å; W160-F169 HydrophobicContact CB-CE1 4.5Å; W160-F169 HydrophobicContact CB-CE2 4.15Å; W160-F169 HydrophobicContact CB-CG 4.07Å; W160-F169 HydrophobicContact CB-CZ 4.42Å; W160-F169 AromaticContact CD1-CG 3.92Å; W160-F169 HydrophobicContact CG-CB 4.31Å; W160-F169 HydrophobicContact CG-CD1 4.47Å; W160-F169 HydrophobicContact CG-CD2 4.42Å; W160-F169 HydrophobicContact CG-CG 4.14Å; E164-F169 WeakPolarHBondContact OE1-CA 3.22Å; E164-F169 PolarHBondContact OE1-N 3.14Å; E164-F169 VanDerWaalsContact OE1-N 3.16Å; S165-F169 PolarHBondContact O-N 3.36Å; V166-F169 PolarHBondContact O-N 2.94Å; R167-F169 VanDerWaalsContact C-N 3.32Å; R167-F169 PolarHBondContact O-N 3.26Å; F169-H171 VanDerWaalsContact C-N 3.28Å; F169-H171 PolarHBondContact O-N 3.48Å; F169-R172 PolarHBondContact O-N 2.92Å; F169-L173 HydrophobicContact CE1-CD2 4.42Å; F169-L173 HydrophobicContact CZ-CD2 4.28Å; F169-L173 WeakPolarHBondContact O-CB 3.38Å; F169-L173 PolarHBondContact O-N 3.03Å; F169-A197 HydrophobicContact CE1-CB 4.16Å; F169-Q200 HydrophobicContact CE1-CB 4.46Å; F169-Q200 HydrophobicContact CZ-CB 3.78Å; F169-L201 HydrophobicContact CD1-CD2 3.98Å; F169-L201 HydrophobicContact CD1-CG 4.33Å; F169-L201 HydrophobicContact CE1-CD2 4.12Å; F169-L201 HydrophobicContact CE1-CG 4.05Å
170V80.3Confident79.3Confident52 Ų5259.7 Ų59.732%0.31532%0.323SS..Hα-helixtrans-61.9-39177.7172.20000110.9V166 R167 L173 T174V166-V170 HydrophobicContact CG1-CG2 4.27Å; V166-V170 WeakPolarHBondContact O-CG2 3.44Å; V166-V170 PolarHBondContact O-N 2.75Å; R167-V170 PolarHBondContact O-N 3.35Å; V170-L173 PolarHBondContact O-N 3.49Å; V170-T174 WeakPolarHBondContact O-CB 3.16Å; V170-T174 PolarHBondContact O-N 2.85Å; V170-T174 PolarHBondContact O-OG1 3.38Å
171H79.8Confident79.5Confident91 Ų9159.4 Ų59.442%0.42133%0.327SS..Hα-helixtrans-60-51.2175.3-177.5-92000111.6R167 T168 F169 L173 T174 Q175R167-H171 WeakPolarHBondContact O-CB 3.22Å; R167-H171 PolarHBondContact O-N 3.32Å; T168-H171 WeakPolarHBondContact O-CB 3.17Å; T168-H171 PolarHBondContact O-N 2.85Å; F169-H171 VanDerWaalsContact C-N 3.28Å; F169-H171 PolarHBondContact O-N 3.48Å; H171-L173 VanDerWaalsContact C-N 3.3Å; H171-L173 PolarHBondContact O-N 3.45Å; H171-T174 WeakPolarHBondContact O-CB 3.31Å; H171-T174 PolarHBondContact O-N 3.2Å; H171-T174 VanDerWaalsContact O-N 3.14Å; H171-Q175 PolarHBondContact CE1-NE2 2.78Å; H171-Q175 PolarHBondContact ND1-OE1 3.19Å; H171-Q175 WeakPolarHBondContact O-CG 3.42Å; H171-Q175 PolarHBondContact O-N 3.46Å
172R81.9Confident79.1Confident39 Ų3956.4 Ų56.415%0.14733%0.329CS..Hα-helixtrans-60.1-41.2176.1-70.2-170.1-57.2102.6-2.9112.3M158 R159 E164 T168 F169 T174 Q175 A176M158-R172 HydrophobicContact SD-CB 4.16Å; M158-R172 PolarHBondContact SD-NH1 2.97Å; R159-R172 PolarHBondContact O-NH2 3.32Å; E164-R172 VanDerWaalsContact CD-NH2 3.31Å; E164-R172 IonicContact OE1-CZ 3.79Å; E164-R172 IonicContact OE1-NE 2.84Å; E164-R172 PolarHBondContact OE1-NE 3.07Å; E164-R172 IonicContact OE1-NH2 3.25Å; E164-R172 PolarHBondContact OE1-NH2 3.09Å; E164-R172 IonicContact OE2-CZ 2.64Å; E164-R172 IonicContact OE2-NE 3.39Å; E164-R172 IonicContact OE2-NH2 3.62Å; E164-R172 PolarHBondContact OE2-NH2 2.75Å; T168-R172 WeakPolarHBondContact O-CG 3.36Å; T168-R172 PolarHBondContact O-N 2.97Å; F169-R172 PolarHBondContact O-N 2.92Å; R172-T174 VanDerWaalsContact C-N 3.29Å; R172-T174 PolarHBondContact O-N 2.89Å; R172-Q175 PolarHBondContact O-N 3.48Å; R172-A176 WeakPolarHBondContact O-CB 3.49Å; R172-A176 PolarHBondContact O-N 3.35Å
173L83.4Confident79.3Confident0 Ų053.2 Ų53.20%033%0.326CS..Hα-helixtrans-63.1-38.7177.8-172.567.4000111.5F155 M158 F169 V170 H171 A176 L177 L193 A197F155-L173 HydrophobicContact CD2-CD1 3.55Å; F155-L173 HydrophobicContact CD2-CG 4.17Å; F155-L173 HydrophobicContact CE2-CD1 3.44Å; F155-L173 VanDerWaalsContact CE2-CD1 3.44Å; F155-L173 HydrophobicContact CE2-CG 3.72Å; F155-L173 HydrophobicContact CG-CD1 4.5Å; F155-L173 HydrophobicContact CZ-CD1 4.32Å; M158-L173 HydrophobicContact CB-CD1 4.25Å; F169-L173 HydrophobicContact CE1-CD2 4.42Å; F169-L173 HydrophobicContact CZ-CD2 4.28Å; F169-L173 WeakPolarHBondContact O-CB 3.38Å; F169-L173 PolarHBondContact O-N 3.03Å; V170-L173 PolarHBondContact O-N 3.49Å; H171-L173 VanDerWaalsContact C-N 3.3Å; H171-L173 PolarHBondContact O-N 3.45Å; L173-A176 PolarHBondContact O-N 3.37Å; L173-L177 WeakPolarHBondContact O-CB 3.32Å; L173-L177 PolarHBondContact O-N 3.34Å; L173-L193 HydrophobicContact CB-CD2 4.41Å; L173-L193 HydrophobicContact CD2-CD2 4.17Å; L173-L193 HydrophobicContact CG-CD2 3.88Å; L173-A197 HydrophobicContact CD2-CB 3.8Å
174T83.4Confident79.5Confident37 Ų3750.4 Ų50.423%0.22729%0.29CS..Hα-helixtrans-65.4-45.5174.7-55.50000111.3V170 H171 R172 A176 L177 N178 L193V170-T174 WeakPolarHBondContact O-CB 3.16Å; V170-T174 PolarHBondContact O-N 2.85Å; V170-T174 PolarHBondContact O-OG1 3.38Å; H171-T174 WeakPolarHBondContact O-CB 3.31Å; H171-T174 PolarHBondContact O-N 3.2Å; H171-T174 VanDerWaalsContact O-N 3.14Å; R172-T174 VanDerWaalsContact C-N 3.29Å; R172-T174 PolarHBondContact O-N 2.89Å; T174-A176 PolarHBondContact O-N 3.29Å; T174-L177 PolarHBondContact O-N 3.5Å; T174-N178 WeakPolarHBondContact O-CB 3.26Å; T174-N178 VanDerWaalsContact O-CG 3.25Å; T174-N178 PolarHBondContact O-N 3.16Å; T174-N178 PolarHBondContact O-ND2 2.98Å; T174-L193 HydrophobicContact CG2-CD1 4.14Å
175Q81.8Confident79.6Confident55 Ų5553 Ų5326%0.25730%0.304SS..Hα-helixtrans-60.3-45.4175.7-70.9-178.5-48.700111.7E85 H171 R172 L177 N178 L179E85-Q175 PolarHBondContact OE2-NE2 3.06Å; H171-Q175 PolarHBondContact CE1-NE2 2.78Å; H171-Q175 PolarHBondContact ND1-OE1 3.19Å; H171-Q175 WeakPolarHBondContact O-CG 3.42Å; H171-Q175 PolarHBondContact O-N 3.46Å; R172-Q175 PolarHBondContact O-N 3.48Å; Q175-L177 VanDerWaalsContact C-N 3.33Å; Q175-L177 PolarHBondContact O-N 2.82Å; Q175-N178 PolarHBondContact O-N 3.29Å; Q175-L179 WeakPolarHBondContact O-CG 3.21Å; Q175-L179 PolarHBondContact O-N 3.41Å; Q175-L179 VanDerWaalsContact O-N 3.11Å
176A82.8Confident79.6Confident9 Ų953 Ų537%0.07431%0.308CS..Hα-helixtrans-62.5-38.7176.700000112.2F155 M158 R172 L173 T174 L179 A180F155-A176 HydrophobicContact CB-CB 4.13Å; F155-A176 HydrophobicContact CD2-CB 4.31Å; M158-A176 HydrophobicContact SD-CB 4.32Å; R172-A176 WeakPolarHBondContact O-CB 3.49Å; R172-A176 PolarHBondContact O-N 3.35Å; L173-A176 PolarHBondContact O-N 3.37Å; T174-A176 PolarHBondContact O-N 3.29Å; A176-L179 PolarHBondContact O-N 3.38Å; A176-A180 VanDerWaalsContact O-CB 3.27Å; A176-A180 WeakPolarHBondContact O-CB 3.39Å; A176-A180 PolarHBondContact O-N 2.78Å
177L84.8Confident79.5Confident1 Ų157.3 Ų57.31%0.00532%0.317CS..Hα-helixtrans-67.5-41.8176.8-174.463.7000112.2F155 L173 T174 Q175 L179 A180 V181 L184 R189 L192 L193F155-L177 HydrophobicContact CD1-CD1 4.37Å; F155-L177 HydrophobicContact CD2-CB 3.77Å; F155-L177 HydrophobicContact CD2-CD1 4.23Å; F155-L177 HydrophobicContact CE1-CD1 4.05Å; F155-L177 HydrophobicContact CE2-CB 3.64Å; F155-L177 HydrophobicContact CE2-CD1 3.89Å; F155-L177 HydrophobicContact CE2-CD2 4.3Å; F155-L177 HydrophobicContact CE2-CG 4.14Å; F155-L177 HydrophobicContact CG-CD1 4.46Å; F155-L177 HydrophobicContact CZ-CB 4.41Å; F155-L177 HydrophobicContact CZ-CD1 3.8Å; F155-L177 HydrophobicContact CZ-CD2 4.43Å; F155-L177 HydrophobicContact CZ-CG 4.43Å; L173-L177 WeakPolarHBondContact O-CB 3.32Å; L173-L177 PolarHBondContact O-N 3.34Å; T174-L177 PolarHBondContact O-N 3.5Å; Q175-L177 VanDerWaalsContact C-N 3.33Å; Q175-L177 PolarHBondContact O-N 2.82Å; L177-L179 PolarHBondContact O-N 3.44Å; L177-A180 PolarHBondContact O-N 3.08Å; L177-V181 PolarHBondContact O-N 3.17Å; L177-L184 HydrophobicContact CD1-CD2 4.38Å; L177-L184 HydrophobicContact CD2-CD2 4.31Å; L177-L184 HydrophobicContact CG-CD2 4.48Å; L177-R189 HydrophobicContact CD2-CB 4.37Å; L177-R189 HydrophobicContact CD2-CG 3.49Å; L177-R189 VanDerWaalsContact CD2-CG 3.49Å; L177-R189 HydrophobicContact CG-CG 4.4Å; L177-L192 HydrophobicContact CD1-CB 4.45Å; L177-L192 HydrophobicContact CD1-CD1 4.02Å; L177-L192 HydrophobicContact CD2-CB 4.16Å; L177-L193 HydrophobicContact CB-CD2 4.15Å; L177-L193 HydrophobicContact CD2-CD1 4.28Å; L177-L193 HydrophobicContact CD2-CD2 3.68Å; L177-L193 HydrophobicContact CD2-CG 3.6Å
178N80.7Confident79.6Confident58 Ų5851.1 Ų51.131%0.3130%0.3SS..Hα-helixtrans-62.3-33.9177.5-71.5-18.6000112T174 Q175T174-N178 WeakPolarHBondContact O-CB 3.26Å; T174-N178 VanDerWaalsContact O-CG 3.25Å; T174-N178 PolarHBondContact O-N 3.16Å; T174-N178 PolarHBondContact O-ND2 2.98Å; Q175-N178 PolarHBondContact O-N 3.29Å
179L79Confident79.6Confident46 Ų4651.7 Ų51.724%0.24130%0.295CS..Hα-helixtrans-75.3-37.1173.4-68.9173.1000112.6N82 A151 Q175 A176 L177N82-L179 HydrophobicContact CB-CD2 4.07Å; N82-L179 HydrophobicContact CB-CG 4.44Å; A151-L179 HydrophobicContact CB-CB 3.82Å; Q175-L179 WeakPolarHBondContact O-CG 3.21Å; Q175-L179 PolarHBondContact O-N 3.41Å; Q175-L179 VanDerWaalsContact O-N 3.11Å; A176-L179 PolarHBondContact O-N 3.38Å; L177-L179 PolarHBondContact O-N 3.44Å
180A81.7Confident79.4Confident9 Ų953.8 Ų53.87%0.07431%0.306CS..Hα-helixtrans-71.2-38.5-177.100000113.3A151 F152 A176 L177A151-A180 HydrophobicContact CB-CB 4.07Å; F152-A180 HydrophobicContact CB-CB 3.86Å; F152-A180 HydrophobicContact CD2-CB 4.09Å; A176-A180 VanDerWaalsContact O-CB 3.27Å; A176-A180 WeakPolarHBondContact O-CB 3.39Å; A176-A180 PolarHBondContact O-N 2.78Å; L177-A180 PolarHBondContact O-N 3.08Å
181V81.1Confident79Confident52 Ų5259.5 Ų59.532%0.31532%0.322SS..SBendtrans-139.377.1-176.3-1680000109.2F152 L177 G183 L184F152-V181 HydrophobicContact CD2-CG2 4.4Å; L177-V181 PolarHBondContact O-N 3.17Å; V181-G183 PolarHBondContact O-N 2.77Å; V181-L184 HydrophobicContact CB-CB 4.38Å; V181-L184 HydrophobicContact CG1-CB 4.03Å; V181-L184 HydrophobicContact CG1-CD1 4.29Å; V181-L184 PolarHBondContact O-N 2.8Å
182P73.3Confident78.8Confident102 Ų10258.3 Ų58.366%0.66232%0.318SS*.THydrogen-bonded Turntrans-62.7131.6174.526.7-33.2000109.4
183G77.5Confident78.8Confident83 Ų8357 Ų5786%0.85631%0.314SS*.THydrogen-bonded Turntrans91.35.918000000115.9V181 D185V181-G183 PolarHBondContact O-N 2.77Å; G183-D185 PolarHBondContact O-N 3.43Å
184L80.1Confident78.2Confident32 Ų3260.2 Ų60.217%0.16833%0.331CS..  trans-60.9131.5173.1-170.165.7000111L177 V181 R189 L192L177-L184 HydrophobicContact CD1-CD2 4.38Å; L177-L184 HydrophobicContact CD2-CD2 4.31Å; L177-L184 HydrophobicContact CG-CD2 4.48Å; V181-L184 HydrophobicContact CB-CB 4.38Å; V181-L184 HydrophobicContact CG1-CB 4.03Å; V181-L184 HydrophobicContact CG1-CD1 4.29Å; V181-L184 PolarHBondContact O-N 2.8Å; L184-R189 HydrophobicContact CD2-CB 3.92Å; L184-R189 HydrophobicContact CD2-CG 4.37Å; L184-R189 HydrophobicContact CG-CB 4.28Å; L184-R189 PolarHBondContact O-NH2 3.42Å; L184-L192 HydrophobicContact CD2-CD1 3.72Å
185D81Confident77.8Confident82 Ų8266.7 Ų66.744%0.43935%0.351SS..  trans-60.5149.4177.271.2-84.5000111.3G183 R187 S188 R189G183-D185 PolarHBondContact O-N 3.43Å; D185-R187 PolarHBondContact O-N 3.26Å; D185-R187 WeakPolarHBondContact OD2-CB 3.45Å; D185-R187 PolarHBondContact OD2-N 2.75Å; D185-S188 VanDerWaalsContact CG-OG 3.24Å; D185-S188 PolarHBondContact O-N 3.36Å; D185-S188 WeakPolarHBondContact OD1-CB 3.07Å; D185-S188 PolarHBondContact OD1-OG 2.62Å; D185-S188 PolarHBondContact OD2-N 2.72Å; D185-S188 PolarHBondContact OD2-OG 2.93Å; D185-R189 WeakPolarHBondContact O-CB 3.24Å; D185-R189 PolarHBondContact O-N 3.17Å
186A75.8Confident77.4Confident59 Ų5964.7 Ų64.749%0.48834%0.343SS..Hα-helixtrans-56.2-38.6-174.600000112.4R189 D190A186-R189 PolarHBondContact O-N 3.48Å; A186-D190 WeakPolarHBondContact O-CB 3.38Å; A186-D190 PolarHBondContact O-N 2.59Å
187R72Confident77Confident156 Ų15664.8 Ų64.859%0.58934%0.344SS*.Hα-helixtrans-68.2-45.3-179-63.9-170.5-175.3-156.69.9111.9E33 D185 R189 R191E33-R187 IonicContact OE1-CZ 2.72Å; E33-R187 IonicContact OE1-NH1 3.41Å; E33-R187 PolarHBondContact OE1-NH1 3.01Å; E33-R187 IonicContact OE2-CZ 2.8Å; E33-R187 IonicContact OE2-NH1 3.89Å; E33-R187 PolarHBondContact OE2-NH1 3.33Å; D185-R187 PolarHBondContact O-N 3.26Å; D185-R187 WeakPolarHBondContact OD2-CB 3.45Å; D185-R187 PolarHBondContact OD2-N 2.75Å; R187-R189 VanDerWaalsContact C-N 3.32Å; R187-R191 WeakPolarHBondContact O-CB 3.35Å; R187-R191 WeakPolarHBondContact O-CG 3.43Å; R187-R191 PolarHBondContact O-N 3.46Å
188S75.8Confident76.2Confident42 Ų4268.6 Ų68.629%0.29436%0.361SS..Hα-helixtrans-66.9-36.9177.3-62.80000111.4D185 R191 L192D185-S188 VanDerWaalsContact CG-OG 3.24Å; D185-S188 PolarHBondContact O-N 3.36Å; D185-S188 WeakPolarHBondContact OD1-CB 3.07Å; D185-S188 PolarHBondContact OD1-OG 2.62Å; D185-S188 PolarHBondContact OD2-N 2.72Å; D185-S188 PolarHBondContact OD2-OG 2.93Å; S188-R191 PolarHBondContact O-N 3.5Å; S188-L192 WeakPolarHBondContact O-CG 3.42Å; S188-L192 PolarHBondContact O-N 3.34Å
189R77.3Confident75.8Confident81 Ų8167.3 Ų67.331%0.30636%0.355SS..Hα-helixtrans-59.6-52.4174.8-165.6-171.5-50.9148.36.6111.2L177 L184 D185 A186 R187 R191 L192 L193L177-R189 HydrophobicContact CD2-CB 4.37Å; L177-R189 HydrophobicContact CD2-CG 3.49Å; L177-R189 VanDerWaalsContact CD2-CG 3.49Å; L177-R189 HydrophobicContact CG-CG 4.4Å; L184-R189 HydrophobicContact CD2-CB 3.92Å; L184-R189 HydrophobicContact CD2-CG 4.37Å; L184-R189 HydrophobicContact CG-CB 4.28Å; L184-R189 PolarHBondContact O-NH2 3.42Å; D185-R189 WeakPolarHBondContact O-CB 3.24Å; D185-R189 PolarHBondContact O-N 3.17Å; A186-R189 PolarHBondContact O-N 3.48Å; R187-R189 VanDerWaalsContact C-N 3.32Å; R189-R191 VanDerWaalsContact C-N 3.31Å; R189-R191 PolarHBondContact O-N 2.84Å; R189-L192 PolarHBondContact O-N 3.01Å; R189-L192 VanDerWaalsContact O-N 3.17Å; R189-L193 HydrophobicContact CG-CD1 4.09Å; R189-L193 WeakPolarHBondContact O-CG 3.15Å; R189-L193 PolarHBondContact O-N 3.02Å
190D73.1Confident75.4Confident43 Ų4365.7 Ų65.723%0.2335%0.347CS..Hα-helixtrans-60.5-42.3179.5-69.6-12.3000111.5A186 L192 L193 L194A186-D190 WeakPolarHBondContact O-CB 3.38Å; A186-D190 PolarHBondContact O-N 2.59Å; D190-L192 PolarHBondContact O-N 3.34Å; D190-L193 PolarHBondContact O-N 3.44Å; D190-L194 VanDerWaalsContact O-CB 3.24Å; D190-L194 WeakPolarHBondContact O-CB 3.31Å; D190-L194 WeakPolarHBondContact O-CD1 3.22Å; D190-L194 WeakPolarHBondContact O-CG 3.44Å; D190-L194 PolarHBondContact O-N 3.24Å
191R72.4Confident74.7Confident173 Ų17366.9 Ų66.965%0.65335%0.352SS*.Hα-helixtrans-61.6-42.9176-77.1177.5177.2-176.32.3112.6R187 S188 R189 R195R187-R191 WeakPolarHBondContact O-CB 3.35Å; R187-R191 WeakPolarHBondContact O-CG 3.43Å; R187-R191 PolarHBondContact O-N 3.46Å; S188-R191 PolarHBondContact O-N 3.5Å; R189-R191 VanDerWaalsContact C-N 3.31Å; R189-R191 PolarHBondContact O-N 2.84Å; R191-R195 VanDerWaalsContact O-CB 3.26Å; R191-R195 WeakPolarHBondContact O-CB 3.37Å; R191-R195 PolarHBondContact O-N 3.24Å
192L77Confident73.9Confident65 Ų6565.5 Ų65.534%0.3434%0.344SS..Hα-helixtrans-68.6-42.1177.9-72.4-177.1000111.7F155 L177 L184 S188 R189 D190 R195 S196F155-L192 HydrophobicContact CZ-CB 4.48Å; L177-L192 HydrophobicContact CD1-CB 4.45Å; L177-L192 HydrophobicContact CD1-CD1 4.02Å; L177-L192 HydrophobicContact CD2-CB 4.16Å; L184-L192 HydrophobicContact CD2-CD1 3.72Å; S188-L192 WeakPolarHBondContact O-CG 3.42Å; S188-L192 PolarHBondContact O-N 3.34Å; R189-L192 PolarHBondContact O-N 3.01Å; R189-L192 VanDerWaalsContact O-N 3.17Å; D190-L192 PolarHBondContact O-N 3.34Å; L192-R195 PolarHBondContact O-N 3.1Å; L192-S196 WeakPolarHBondContact O-CB 3.46Å; L192-S196 PolarHBondContact O-N 3.21Å
193L80.1Confident73.3Confident12 Ų1265.6 Ų65.66%0.06334%0.336CS..Hα-helixtrans-62.5-48.6176.1-69.7173.1000111.4F155 L173 T174 L177 R189 D190 R195 S196 A197F155-L193 HydrophobicContact CE2-CD2 4.15Å; L173-L193 HydrophobicContact CB-CD2 4.41Å; L173-L193 HydrophobicContact CD2-CD2 4.17Å; L173-L193 HydrophobicContact CG-CD2 3.88Å; T174-L193 HydrophobicContact CG2-CD1 4.14Å; L177-L193 HydrophobicContact CB-CD2 4.15Å; L177-L193 HydrophobicContact CD2-CD1 4.28Å; L177-L193 HydrophobicContact CD2-CD2 3.68Å; L177-L193 HydrophobicContact CD2-CG 3.6Å; R189-L193 HydrophobicContact CG-CD1 4.09Å; R189-L193 WeakPolarHBondContact O-CG 3.15Å; R189-L193 PolarHBondContact O-N 3.02Å; D190-L193 PolarHBondContact O-N 3.44Å; L193-R195 PolarHBondContact O-N 2.99Å; L193-S196 PolarHBondContact O-N 3.28Å; L193-A197 WeakPolarHBondContact O-CB 3.39Å; L193-A197 PolarHBondContact O-N 2.97Å
194L72.5Confident72.2Confident68 Ų6864.4 Ų64.436%0.35631%0.31SS..Hα-helixtrans-53.2-53.3174.4-88.8161.7000111.7Y36 D190 S196 F198Y36-L194 HydrophobicContact CD1-CD2 3.23Å; Y36-L194 HydrophobicContact CD1-CG 4.08Å; Y36-L194 HydrophobicContact CD2-CD2 4.42Å; Y36-L194 HydrophobicContact CE1-CB 4.45Å; Y36-L194 HydrophobicContact CE1-CD1 4.13Å; Y36-L194 HydrophobicContact CE1-CD2 2.95Å; Y36-L194 HydrophobicContact CE1-CG 3.26Å; Y36-L194 HydrophobicContact CE2-CD1 4.29Å; Y36-L194 HydrophobicContact CE2-CD2 4.19Å; Y36-L194 HydrophobicContact CE2-CG 4.29Å; Y36-L194 HydrophobicContact CG-CD2 3.99Å; Y36-L194 VanDerWaalsContact CZ-CD2 3.48Å; Y36-L194 WeakPolarHBondContact OH-CG 3.29Å; D190-L194 VanDerWaalsContact O-CB 3.24Å; D190-L194 WeakPolarHBondContact O-CB 3.31Å; D190-L194 WeakPolarHBondContact O-CD1 3.22Å; D190-L194 WeakPolarHBondContact O-CG 3.44Å; D190-L194 PolarHBondContact O-N 3.24Å; L194-S196 PolarHBondContact O-N 3.47Å; L194-F198 WeakPolarHBondContact O-CB 3.37Å; L194-F198 PolarHBondContact O-N 3.24Å
195R74Confident70.8Confident172 Ų17264.4 Ų64.465%0.64931%0.312SS*.Hα-helixtrans-62.5-46.6-177.3-178.6174.5179.3171.30.1111.1R191 L192 L193 C199R191-R195 VanDerWaalsContact O-CB 3.26Å; R191-R195 WeakPolarHBondContact O-CB 3.37Å; R191-R195 PolarHBondContact O-N 3.24Å; L192-R195 PolarHBondContact O-N 3.1Å; L193-R195 PolarHBondContact O-N 2.99Å; R195-C199 WeakPolarHBondContact O-CB 3.48Å; R195-C199 PolarHBondContact O-N 2.78Å; R195-C199 PolarHBondContact O-SG 3.5Å
196S74.4Confident69.3Low13 Ų1366.9 Ų66.99%0.09132%0.324CS..Hα-helixtrans-67.6-52.3-178-168.80000111L192 L193 L194 F198 C199 Q200L192-S196 WeakPolarHBondContact O-CB 3.46Å; L192-S196 PolarHBondContact O-N 3.21Å; L193-S196 PolarHBondContact O-N 3.28Å; L194-S196 PolarHBondContact O-N 3.47Å; S196-F198 VanDerWaalsContact C-N 3.33Å; S196-F198 PolarHBondContact O-N 3.32Å; S196-C199 PolarHBondContact O-N 2.86Å; S196-C199 VanDerWaalsContact O-N 3.15Å; S196-Q200 WeakPolarHBondContact O-CB 3.47Å; S196-Q200 WeakPolarHBondContact O-CG 3.43Å; S196-Q200 PolarHBondContact O-N 3.19Å; S196-Q200 PolarHBondContact O-OE1 3.43Å; S196-Q200 PolarHBondContact OG-NE2 3.44Å; S196-Q200 PolarHBondContact OG-OE1 2.96Å
197A73.1Confident67.7Low11 Ų1167.3 Ų67.39%0.09133%0.328CS..Hα-helixtrans-58-45.2178.200000111.3F169 L173 L193 C199 Q200 L201F169-A197 HydrophobicContact CE1-CB 4.16Å; L173-A197 HydrophobicContact CD2-CB 3.8Å; L193-A197 WeakPolarHBondContact O-CB 3.39Å; L193-A197 PolarHBondContact O-N 2.97Å; A197-C199 PolarHBondContact O-N 3.4Å; A197-Q200 PolarHBondContact O-N 3.38Å; A197-L201 WeakPolarHBondContact O-CB 3.49Å; A197-L201 WeakPolarHBondContact O-CG 3.3Å; A197-L201 PolarHBondContact O-N 2.96Å
198F69.2Low66.4Low82 Ų8261.3 Ų61.336%0.3631%0.308SS..Hα-helixtrans-60.6-46.5176.9-174.2-94.1000111.8L194 S196 Q200 C202 F212L194-F198 WeakPolarHBondContact O-CB 3.37Å; L194-F198 PolarHBondContact O-N 3.24Å; S196-F198 VanDerWaalsContact C-N 3.33Å; S196-F198 PolarHBondContact O-N 3.32Å; F198-Q200 PolarHBondContact O-N 3.4Å; F198-C202 VanDerWaalsContact O-CB 3.26Å; F198-C202 WeakPolarHBondContact O-CB 3.16Å; F198-C202 PolarHBondContact O-N 2.94Å; F198-C202 PolarHBondContact O-SG 2.82Å; F198-F212 HydrophobicContact CE2-CD2 4.3Å; F198-F212 HydrophobicContact CE2-CE1 4.35Å; F198-F212 AromaticContact CE2-CE2 3.6Å; F198-F212 HydrophobicContact CE2-CE2 3.6Å; F198-F212 AromaticContact CE2-CZ 3.63Å; F198-F212 HydrophobicContact CE2-CZ 3.63Å; F198-F212 HydrophobicContact CZ-CD1 4.23Å; F198-F212 HydrophobicContact CZ-CD2 4.17Å; F198-F212 AromaticContact CZ-CE1 3.81Å; F198-F212 HydrophobicContact CZ-CE1 3.81Å; F198-F212 AromaticContact CZ-CE2 3.75Å; F198-F212 HydrophobicContact CZ-CE2 3.75Å; F198-F212 HydrophobicContact CZ-CG 4.39Å; F198-F212 AromaticContact CZ-CZ 3.55Å; F198-F212 HydrophobicContact CZ-CZ 3.55Å
199C71Confident64.8Low30 Ų3064.5 Ų64.520%0.20332%0.317CS..Hα-helixtrans-62.1-43178.1-70.60000112.1R195 S196 A197 Q203 C232R195-C199 WeakPolarHBondContact O-CB 3.48Å; R195-C199 PolarHBondContact O-N 2.78Å; R195-C199 PolarHBondContact O-SG 3.5Å; S196-C199 PolarHBondContact O-N 2.86Å; S196-C199 VanDerWaalsContact O-N 3.15Å; A197-C199 PolarHBondContact O-N 3.4Å; C199-Q203 VanDerWaalsContact O-CG 3.26Å; C199-Q203 WeakPolarHBondContact O-CG 3.33Å; C199-Q203 PolarHBondContact O-N 3.28Å; C199-Q203 VanDerWaalsContact O-N 3.13Å; C199-C232 PolarHBondContact SG-SG 3Å
200Q70.8Confident63Low12 Ų1264 Ų646%0.05633%0.325CS..Hα-helixtrans-77.8-37.5-174.5-72.5146-7.100112.4F155 K156 M158 F169 S196 A197 F198 Q203 N204F155-Q200 PolarHBondContact O-NE2 3.05Å; K156-Q200 PolarHBondContact O-NE2 2.87Å; M158-Q200 VanDerWaalsContact O-CG 3.23Å; M158-Q200 WeakPolarHBondContact O-CG 3.39Å; M158-Q200 PolarHBondContact O-NE2 2.86Å; F169-Q200 HydrophobicContact CE1-CB 4.46Å; F169-Q200 HydrophobicContact CZ-CB 3.78Å; S196-Q200 WeakPolarHBondContact O-CB 3.47Å; S196-Q200 WeakPolarHBondContact O-CG 3.43Å; S196-Q200 PolarHBondContact O-N 3.19Å; S196-Q200 PolarHBondContact O-OE1 3.43Å; S196-Q200 PolarHBondContact OG-NE2 3.44Å; S196-Q200 PolarHBondContact OG-OE1 2.96Å; A197-Q200 PolarHBondContact O-N 3.38Å; F198-Q200 PolarHBondContact O-N 3.4Å; Q200-Q203 PolarHBondContact O-N 3.24Å; Q200-N204 PolarHBondContact O-N 3.16Å
201L68.1Low61.7Low35 Ų3567.1 Ų67.118%0.18333%0.334CS..Hα-helixtrans-64.8-43.3171.3-68.8171.8000110.8W160 V166 F169 A197 Q203 N204 C205W160-L201 HydrophobicContact CB-CD2 4.27Å; W160-L201 HydrophobicContact CD2-CD2 3.63Å; W160-L201 HydrophobicContact CE3-CD2 3.28Å; W160-L201 HydrophobicContact CG-CD2 4.07Å; W160-L201 HydrophobicContact CZ3-CD2 3.78Å; V166-L201 HydrophobicContact CG1-CD1 4.4Å; F169-L201 HydrophobicContact CD1-CD2 3.98Å; F169-L201 HydrophobicContact CD1-CG 4.33Å; F169-L201 HydrophobicContact CE1-CD2 4.12Å; F169-L201 HydrophobicContact CE1-CG 4.05Å; A197-L201 WeakPolarHBondContact O-CB 3.49Å; A197-L201 WeakPolarHBondContact O-CG 3.3Å; A197-L201 PolarHBondContact O-N 2.96Å; L201-Q203 PolarHBondContact O-N 2.94Å; L201-N204 PolarHBondContact O-N 2.9Å; L201-C205 WeakPolarHBondContact O-CB 3.44Å; L201-C205 PolarHBondContact O-N 3.32Å
202C62.7Low60.4Low22 Ų2262 Ų6215%0.14932%0.317CS..Hα-helixtrans-62.8-31.3175.6-71.50000112.5F198 V208 K209F198-C202 VanDerWaalsContact O-CB 3.26Å; F198-C202 WeakPolarHBondContact O-CB 3.16Å; F198-C202 PolarHBondContact O-N 2.94Å; F198-C202 PolarHBondContact O-SG 2.82Å; C202-V208 HydrophobicContact CB-CG1 4.48Å; C202-V208 WeakPolarHBondContact SG-CG1 3.16Å; C202-K209 WeakPolarHBondContact O-CE 3.34Å; C202-K209 VanDerWaalsContact O-CG 3.29Å; C202-K209 WeakPolarHBondContact O-CG 3.24Å
203Q61.4Low59.1Low104 Ų10466.4 Ų66.449%0.48633%0.333SS..Hα-helixtrans-71.2-31.4178.3-76.9171.814.800112.9C199 Q200 L201C199-Q203 VanDerWaalsContact O-CG 3.26Å; C199-Q203 WeakPolarHBondContact O-CG 3.33Å; C199-Q203 PolarHBondContact O-N 3.28Å; C199-Q203 VanDerWaalsContact O-N 3.13Å; Q200-Q203 PolarHBondContact O-N 3.24Å; L201-Q203 PolarHBondContact O-N 2.94Å
204N54.6Low57.4Low58 Ų5872.8 Ų72.831%0.3136%0.363SS..Hα-helixtrans-102-24.2-174.7-67.9-4.9000113.8R159 W160 Q200 L201R159-N204 PolarHBondContact NH2-OD1 2.86Å; R159-N204 VanDerWaalsContact NH2-OD1 3.15Å; W160-N204 PolarHBondContact N-ND2 3.36Å; W160-N204 PolarHBondContact O-ND2 3.47Å; Q200-N204 PolarHBondContact O-N 3.16Å; L201-N204 PolarHBondContact O-N 2.9Å
205C51.2Low56.5Low33 Ų3374.2 Ų74.222%0.22337%0.366CS..  trans-95.2106.3174.4-103.90000111.7W160 L201 A207 V208 K209W160-C205 VanDerWaalsContact CZ3-SG 3.55Å; L201-C205 WeakPolarHBondContact O-CB 3.44Å; L201-C205 PolarHBondContact O-N 3.32Å; C205-A207 PolarHBondContact O-N 3.32Å; C205-V208 HydrophobicContact CB-CB 3.75Å; C205-V208 HydrophobicContact CB-CG2 3.5Å; C205-V208 VanDerWaalsContact CB-CG2 3.5Å; C205-V208 PolarHBondContact O-N 2.83Å; C205-K209 PolarHBondContact O-N 3.33Å; C205-K209 VanDerWaalsContact O-N 3.08Å
206I48.5Very low55.2Low133 Ų13369.1 Ų69.168%0.68235%0.351SS*.Hα-helixtrans-54.5-39.6164.3-62.4170.2000109.8V208 K209 C210I206-V208 PolarHBondContact O-N 3.23Å; I206-K209 CarbonylContact O-C 3.48Å; I206-K209 WeakPolarHBondContact O-CB 3.34Å; I206-K209 PolarHBondContact O-N 3.46Å; I206-C210 PolarHBondContact O-N 2.91Å; I206-C210 PolarHBondContact O-SG 3.32Å
207A41.9Very low54.1Low69 Ų6971.6 Ų71.657%0.5737%0.366SS*.Hα-helixtrans-61.4-38.5178.300000113.6C205 C210 Y211C205-A207 PolarHBondContact O-N 3.32Å; A207-C210 PolarHBondContact O-N 3.09Å; A207-Y211 WeakPolarHBondContact O-CB 3.39Å; A207-Y211 PolarHBondContact O-N 2.97Å
208V46Very low53Low30 Ų3076.8 Ų76.818%0.18239%0.392CS..Hα-helixtrans-71.9-40.4176.1178.80000109.8C202 C205 I206 C210 F212C202-V208 HydrophobicContact CB-CG1 4.48Å; C202-V208 WeakPolarHBondContact SG-CG1 3.16Å; C205-V208 HydrophobicContact CB-CB 3.75Å; C205-V208 HydrophobicContact CB-CG2 3.5Å; C205-V208 VanDerWaalsContact CB-CG2 3.5Å; C205-V208 PolarHBondContact O-N 2.83Å; I206-V208 PolarHBondContact O-N 3.23Å; V208-C210 VanDerWaalsContact C-N 3.3Å; V208-C210 PolarHBondContact O-N 3.25Å; V208-F212 HydrophobicContact CG1-CD2 4.3Å; V208-F212 WeakPolarHBondContact O-CB 3.26Å; V208-F212 PolarHBondContact O-N 3.26Å
209K41.4Very low51.8Low109 Ų10976.4 Ų76.447%0.47439%0.393SS..Hα-helixtrans-57.1-42.4170.8-76.1-179.6176.6170.80111.7C202 C205 I206 K213C202-K209 WeakPolarHBondContact O-CE 3.34Å; C202-K209 VanDerWaalsContact O-CG 3.29Å; C202-K209 WeakPolarHBondContact O-CG 3.24Å; C205-K209 PolarHBondContact O-N 3.33Å; C205-K209 VanDerWaalsContact O-N 3.08Å; I206-K209 CarbonylContact O-C 3.48Å; I206-K209 WeakPolarHBondContact O-CB 3.34Å; I206-K209 PolarHBondContact O-N 3.46Å; K209-K213 WeakPolarHBondContact O-CB 3.1Å; K209-K213 PolarHBondContact O-N 3.22Å
210C38.5Very low50.6Low71 Ų7179.3 Ų79.348%0.4841%0.406SS..Hα-helixtrans-70.6-49.5179.7-66.80000112.3I206 A207 V208 F212 K213 E214I206-C210 PolarHBondContact O-N 2.91Å; I206-C210 PolarHBondContact O-SG 3.32Å; A207-C210 PolarHBondContact O-N 3.09Å; V208-C210 VanDerWaalsContact C-N 3.3Å; V208-C210 PolarHBondContact O-N 3.25Å; C210-F212 VanDerWaalsContact C-N 3.34Å; C210-F212 PolarHBondContact O-N 3.02Å; C210-K213 PolarHBondContact O-N 3.12Å; C210-E214 PolarHBondContact O-N 2.89Å
211Y45.9Very low49.6Very low107 Ų10786.3 Ų86.342%0.4244%0.436SS..Hα-helixtrans-61.4-42.1179.7-170.5-93.6000111.9A207 K215A207-Y211 WeakPolarHBondContact O-CB 3.39Å; A207-Y211 PolarHBondContact O-N 2.97Å; Y211-K215 HydrophobicContact CE1-CD 3.89Å; Y211-K215 PolarHBondContact O-N 3.27Å; Y211-K215 VanDerWaalsContact O-N 3.13Å; Y211-K215 WeakPolarHBondContact OH-CE 3.37Å; Y211-K215 PolarHBondContact OH-NZ 2.86Å
212F47.1Very low48.6Very low67 Ų6795.1 Ų95.129%0.29447%0.467SS..Hα-helixtrans-71.1-41.2173.9-105.9-94.4000111.9I37 F198 V208 C210 E214 L216I37-F212 HydrophobicContact CD1-CE2 4.37Å; F198-F212 HydrophobicContact CE2-CD2 4.3Å; F198-F212 HydrophobicContact CE2-CE1 4.35Å; F198-F212 AromaticContact CE2-CE2 3.6Å; F198-F212 HydrophobicContact CE2-CE2 3.6Å; F198-F212 AromaticContact CE2-CZ 3.63Å; F198-F212 HydrophobicContact CE2-CZ 3.63Å; F198-F212 HydrophobicContact CZ-CD1 4.23Å; F198-F212 HydrophobicContact CZ-CD2 4.17Å; F198-F212 AromaticContact CZ-CE1 3.81Å; F198-F212 HydrophobicContact CZ-CE1 3.81Å; F198-F212 AromaticContact CZ-CE2 3.75Å; F198-F212 HydrophobicContact CZ-CE2 3.75Å; F198-F212 HydrophobicContact CZ-CG 4.39Å; F198-F212 AromaticContact CZ-CZ 3.55Å; F198-F212 HydrophobicContact CZ-CZ 3.55Å; V208-F212 HydrophobicContact CG1-CD2 4.3Å; V208-F212 WeakPolarHBondContact O-CB 3.26Å; V208-F212 PolarHBondContact O-N 3.26Å; C210-F212 VanDerWaalsContact C-N 3.34Å; C210-F212 PolarHBondContact O-N 3.02Å; F212-E214 PolarHBondContact O-N 3.47Å; F212-L216 HydrophobicContact CD1-CB 4.43Å; F212-L216 HydrophobicContact CD1-CD1 4.11Å; F212-L216 HydrophobicContact CE1-CD1 4.31Å; F212-L216 WeakPolarHBondContact O-CA 3.5Å; F212-L216 WeakPolarHBondContact O-CB 3.47Å; F212-L216 PolarHBondContact O-N 3.24Å
213K47.9Very low47.4Very low157 Ų15799.9 Ų99.968%0.68349%0.485SS*.Hα-helixtrans-59.7-38.5178.6-169.6175.2-177.6-175.80111.3K209 C210 T217K209-K213 WeakPolarHBondContact O-CB 3.1Å; K209-K213 PolarHBondContact O-N 3.22Å; C210-K213 PolarHBondContact O-N 3.12Å; K213-T217 VanDerWaalsContact O-CB 3.25Å; K213-T217 WeakPolarHBondContact O-CB 3.49Å; K213-T217 PolarHBondContact O-N 3.35Å; K213-T217 VanDerWaalsContact O-N 3.1Å; K213-T217 PolarHBondContact O-OG1 3.28Å
214E45.4Very low46.4Very low146 Ų146105.5 Ų105.568%0.68250%0.502SS*.Hα-helixtrans-74.1-48.5-179.7-157.7167.5-16500112.8C210 F212 L218C210-E214 PolarHBondContact O-N 2.89Å; F212-E214 PolarHBondContact O-N 3.47Å; E214-L218 PolarHBondContact O-N 2.84Å
215K53.5Low45.6Very low98 Ų98114.7 Ų114.743%0.42653%0.532SS..Hα-helixtrans-72.7-35.6176.5-93.3-168.5174.1177.80114.2Y211 T217 L218 L219Y211-K215 HydrophobicContact CE1-CD 3.89Å; Y211-K215 PolarHBondContact O-N 3.27Å; Y211-K215 VanDerWaalsContact O-N 3.13Å; Y211-K215 WeakPolarHBondContact OH-CE 3.37Å; Y211-K215 PolarHBondContact OH-NZ 2.86Å; K215-T217 VanDerWaalsContact C-N 3.33Å; K215-L218 PolarHBondContact O-N 3.23Å; K215-L219 WeakPolarHBondContact O-CB 3.42Å; K215-L219 PolarHBondContact O-N 3.46Å
216L45.8Very low44.8Very low64 Ų64121.9 Ų121.934%0.33556%0.555SS.*Hα-helixtrans-70.1-31.9176.7-159.486000110.4F212 L218 L219 I220F212-L216 HydrophobicContact CD1-CB 4.43Å; F212-L216 HydrophobicContact CD1-CD1 4.11Å; F212-L216 HydrophobicContact CE1-CD1 4.31Å; F212-L216 WeakPolarHBondContact O-CA 3.5Å; F212-L216 WeakPolarHBondContact O-CB 3.47Å; F212-L216 PolarHBondContact O-N 3.24Å; L216-L218 VanDerWaalsContact C-N 3.35Å; L216-L219 PolarHBondContact O-N 2.97Å; L216-I220 HydrophobicContact CD2-CD1 3.69Å; L216-I220 HydrophobicContact CG-CD1 3.68Å; L216-I220 HydrophobicContact CG-CG1 4.14Å; L216-I220 WeakPolarHBondContact O-CB 3.46Å; L216-I220 WeakPolarHBondContact O-CD1 3.5Å; L216-I220 WeakPolarHBondContact O-CG1 3.26Å; L216-I220 PolarHBondContact O-N 3.16Å
217T51.5Low43.8Very low66 Ų66126 Ų12641%0.40556%0.562SS.*Hα-helixtrans-65.8-38.5171.9-58.20000111.5K213 K215 K221K213-T217 VanDerWaalsContact O-CB 3.25Å; K213-T217 WeakPolarHBondContact O-CB 3.49Å; K213-T217 PolarHBondContact O-N 3.35Å; K213-T217 VanDerWaalsContact O-N 3.1Å; K213-T217 PolarHBondContact O-OG1 3.28Å; K215-T217 VanDerWaalsContact C-N 3.33Å; T217-K221 WeakPolarHBondContact O-CB 3.45Å; T217-K221 VanDerWaalsContact O-CG 3.26Å; T217-K221 WeakPolarHBondContact O-CG 3.45Å; T217-K221 PolarHBondContact O-N 3.21Å
218L50.7Low43.1Very low119 Ų119131.6 Ų131.662%0.62357%0.569SS**Hα-helixtrans-68.1-39.5173.5-75.9161.8000112.5E214 K215 L216 R222E214-L218 PolarHBondContact O-N 2.84Å; K215-L218 PolarHBondContact O-N 3.23Å; L216-L218 VanDerWaalsContact C-N 3.35Å; L218-R222 PolarHBondContact O-N 3.3Å
219L44.9Very low42.2Very low75 Ų75139.3 Ų139.339%0.39360%0.597SS.*Hα-helixtrans-70.3-42.2175.7-89.5151.6000112.4K215 L216 K221 R222 F223K215-L219 WeakPolarHBondContact O-CB 3.42Å; K215-L219 PolarHBondContact O-N 3.46Å; L216-L219 PolarHBondContact O-N 2.97Å; L219-K221 VanDerWaalsContact C-N 3.34Å; L219-K221 PolarHBondContact O-N 3.14Å; L219-R222 CarbonylContact O-C 3.6Å; L219-R222 WeakPolarHBondContact O-CA 3.44Å; L219-R222 PolarHBondContact O-N 3.24Å; L219-F223 HydrophobicContact CD2-CD2 3.73Å; L219-F223 HydrophobicContact CD2-CE2 3.56Å; L219-F223 WeakPolarHBondContact O-CB 3.5Å; L219-F223 WeakPolarHBondContact O-CD2 3.35Å; L219-F223 PolarHBondContact O-N 3.26Å
220I45.5Very low41.7Very low91 Ų91137.8 Ų137.847%0.46760%0.598SS.*Hα-helixtrans-66.1-36.6177-70.6166000110.8L216 R222 F223 R224L216-I220 HydrophobicContact CD2-CD1 3.69Å; L216-I220 HydrophobicContact CG-CD1 3.68Å; L216-I220 HydrophobicContact CG-CG1 4.14Å; L216-I220 WeakPolarHBondContact O-CB 3.46Å; L216-I220 WeakPolarHBondContact O-CD1 3.5Å; L216-I220 WeakPolarHBondContact O-CG1 3.26Å; L216-I220 PolarHBondContact O-N 3.16Å; I220-R222 PolarHBondContact O-N 3.4Å; I220-F223 PolarHBondContact O-N 2.64Å; I220-R224 PolarHBondContact O-N 3.05Å; I220-R224 VanDerWaalsContact O-N 3.08Å
221K49.1Very low41.4Very low158 Ų158141.2 Ų141.269%0.68761%0.611SS**Hα-helixtrans-61.9-30.3170.4-77.6178.6179.2-176.40112.2T217 L219T217-K221 WeakPolarHBondContact O-CB 3.45Å; T217-K221 VanDerWaalsContact O-CG 3.26Å; T217-K221 WeakPolarHBondContact O-CG 3.45Å; T217-K221 PolarHBondContact O-N 3.21Å; L219-K221 VanDerWaalsContact C-N 3.34Å; L219-K221 PolarHBondContact O-N 3.14Å
222R47.5Very low41Very low221 Ų221139.9 Ų139.983%0.83462%0.617SS**Hα-helixtrans-89.7-23.7178.6-153.3170.2-174163.11.5114.1L218 L219 I220L218-R222 PolarHBondContact O-N 3.3Å; L219-R222 CarbonylContact O-C 3.6Å; L219-R222 WeakPolarHBondContact O-CA 3.44Å; L219-R222 PolarHBondContact O-N 3.24Å; I220-R222 PolarHBondContact O-N 3.4Å
223F37.7Very low40.4Very low121 Ų121140.8 Ų140.853%0.53164%0.637SS.*Hα-helixtrans-108.411.4-176.3-84.6-83.7000114.5L219 I220 R225 R226L219-F223 HydrophobicContact CD2-CD2 3.73Å; L219-F223 HydrophobicContact CD2-CE2 3.56Å; L219-F223 WeakPolarHBondContact O-CB 3.5Å; L219-F223 WeakPolarHBondContact O-CD2 3.35Å; L219-F223 PolarHBondContact O-N 3.26Å; I220-F223 PolarHBondContact O-N 2.64Å; F223-R225 PolarHBondContact O-N 3.13Å; F223-R226 PolarHBondContact O-N 3.39Å
224R40.6Very low39.7Very low223 Ų223137.9 Ų137.984%0.84264%0.636SS**THydrogen-bonded Turntrans-56.14.7176.9-125.9179.8177172.7-1.7115.9I220I220-R224 PolarHBondContact O-N 3.05Å; I220-R224 VanDerWaalsContact O-N 3.08Å
225R37.9Very low39.1Very low251 Ų251141.9 Ų141.995%0.94765%0.645SS**THydrogen-bonded Turntrans-98.6-6.3169-83.9-173.7175.5178-0.9115.6F223F223-R225 PolarHBondContact O-N 3.13Å
226R32.6Very low38.1Very low183 Ų183143.3 Ų143.369%0.69166%0.664SS**SBendtrans-135.7118.2175.2-69.6-172.3-178.2-171.30.6111.2F223 Y228F223-R226 PolarHBondContact O-N 3.39Å; R226-Y228 HydrophobicContact CB-CD2 4.16Å; R226-Y228 HydrophobicContact CB-CE2 3.86Å; R226-Y228 PolarHBondContact O-N 3.3Å; R226-Y228 VanDerWaalsContact O-N 3.09Å
227R27.6Very low37.5Very low221 Ų221148 Ų14883%0.83469%0.688SS**  trans-62.2102.8178.2-73.2178.7-177.9165.9-0.2110.6Y229R227-Y229 HydrophobicContact CB-CE2 4.3Å
228Y28.5Very low36.7Very low185 Ų185147.6 Ų147.673%0.72570%0.697SS**  trans-128.8113.7161.6-67-79.2000108.3R226R226-Y228 HydrophobicContact CB-CD2 4.16Å; R226-Y228 HydrophobicContact CB-CE2 3.86Å; R226-Y228 PolarHBondContact O-N 3.3Å; R226-Y228 VanDerWaalsContact O-N 3.09Å
229Y27.1Very low35.7Very low193 Ų193146.4 Ų146.476%0.75771%0.714SS**  trans-91132.1177.6-66.3-88.1000109.8R227 L231R227-Y229 HydrophobicContact CB-CE2 4.3Å; Y229-L231 PolarHBondContact O-N 3.08Å
230C31Very low35.4Very low76 Ų76147.1 Ų147.151%0.51473%0.73SS.*  trans-80.2105.5169.1-169.70000109C232 A233C230-C232 PolarHBondContact O-N 3.23Å; C230-C232 VanDerWaalsContact O-N 3.12Å; C230-A233 PolarHBondContact O-N 3.27Å
231L32Very low34.9Very low143 Ų143154.1 Ų154.175%0.74975%0.751SS**G310 helixtrans-67.2-5.1-178.6-84.2151.6000114.5Y229 A233Y229-L231 PolarHBondContact O-N 3.08Å; L231-A233 VanDerWaalsContact C-N 3.31Å
232C36.7Very low34.4Very low80 Ų80155.8 Ų155.854%0.54176%0.761SS.*G310 helixtrans-83.4-4.2179.2-58.80000113.9C199 C230C199-C232 PolarHBondContact SG-SG 3Å; C230-C232 PolarHBondContact O-N 3.23Å; C230-C232 VanDerWaalsContact O-N 3.12Å
233A34.8Very low33.8Very low86 Ų86148.6 Ų148.671%0.71176%0.756SS**G310 helixtrans-92.23.8-173.800000115.1C230 L231C230-A233 PolarHBondContact O-N 3.27Å; L231-A233 VanDerWaalsContact C-N 3.31Å
234S33.8Very low33.8Very low96 Ų96148.9 Ų148.967%0.67177%0.77SS**  trans-98.920.4-166.3-53.70000116.4
235R33Very low33.8Very low230 Ų230143.9 Ų143.987%0.86877%0.766SS**  trans-131.4108.6169.4-73.3-167.8178.9-152-0.7111.4I237R235-I237 PolarHBondContact O-N 2.72Å
236P31.7Very low33.9Very low127 Ų127135.7 Ų135.783%0.82575%0.752SS**  trans-66.4116.6165.4-1.216.5000107.6G238P236-G238 VanDerWaalsContact C-N 3.31Å; P236-G238 PolarHBondContact O-N 3.03Å
237I34Very low34.1Very low162 Ų162136.1 Ų136.183%0.83176%0.759SS**  trans-81.591.8160.1-58.9173.4000104.2R235R235-I237 PolarHBondContact O-N 2.72Å
238G34Very low34.3Very low58 Ų58134.1 Ų134.160%0.59876%0.759SS**  trans-165.674.6-174.200000110.1P236 A240P236-G238 VanDerWaalsContact C-N 3.31Å; P236-G238 PolarHBondContact O-N 3.03Å; G238-A240 PolarHBondContact O-N 2.84Å
239G29.9Very low34.4Very low95 Ų95130.3 Ų130.398%0.97976%0.758SS**  trans-69.388.4155.100000107.6
240A38.3Very low34.8Very low89 Ų89133 Ų13374%0.73678%0.784SS**  trans-149.8120.4165.400000107.2G238G238-A240 PolarHBondContact O-N 2.84Å
241R35.2Very low34.9Very low238 Ų238135.9 Ų135.990%0.89880%0.798SS**  trans-48.2138.1175.3-65.3167.7170.5179-4.7110.3
242E38.6Very low35.1Very low194 Ų194135.5 Ų135.591%0.90780%0.8SS**  trans178.1114.4133.5-98.6165.5-160.100110.9
243G36Very low35Very low70 Ų70138.6 Ų138.672%0.72282%0.815SS**  trans52.8125.7143.900000121.8
244P37.4Very low35Very low126 Ų126141.6 Ų141.682%0.81882%0.821SS**  trans-79.9148156.236-28.8000109
245P39.9Very low35.1Very low119 Ų119144.5 Ų144.577%0.77383%0.83SS**  -146.8134.3104.632.2-13000111.8
246A39.3Very low35.2Very low79 Ų79138.8 Ų138.865%0.65383%0.828SS**  94.4122.291.300000114
247K37.6Very low35.5Very low191 Ų191139.6 Ų139.683%0.8383%0.828SS**  trans67.8107132.7-62.1178.7-176.2-174.20119.8
248H32Very low35.6Very low179 Ų179137.9 Ų137.983%0.82983%0.828SS**  63.3131.9121.4-94.6-79.2000122.8
249C31.2Very low35.7Very low105 Ų105144.6 Ų144.671%0.70985%0.847SS**  trans73105.2141.5-69.40000120
250L33.6Very low36.3Very low250 Ų250149.1 Ų149.1100%1.30984%0.835SS**  -149.1089.3-97.4160.6000109.3

Retrieved 250 of 250 residues in 44.7 ms (Link to these results)