A0A077Z7R4_TRITR Loading...

60S ribosomal protein L7:L12

AlphaFold DB , UniProt , Accession A0A077Z7R4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 220 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M47.9Very low60Low236 Ų236135.8 Ų135.8100%1.16371%0.705SS**  015.10-99.7179.5173.100114.7
2I53.3Low60.4Low160 Ų160132.4 Ų132.482%0.82169%0.688SS**  trans-95.4-14.2-170-68.8164.5000114.2
3S58.7Low60.9Low105 Ų105137.2 Ų137.273%0.73469%0.692SS**THydrogen-bonded Turntrans-83.7-20.9-170.1-143.20000116.4K5S3-K5 PolarHBondContact O-N 3.21Å
4R58.8Low61.5Low232 Ų232135.8 Ų135.888%0.87569%0.687SS**THydrogen-bonded Turntrans-79.9-9.9-177.1-74.5-163.5-161.4-177.86.2115.2
5K57.4Low62Low171 Ų171135.7 Ų135.774%0.74368%0.683SS**Hα-helixtrans-83.6-21.3-175.1-75.8-175.7176.7179.70114.1S3S3-K5 PolarHBondContact O-N 3.21Å
6N61.6Low62.1Low125 Ų125132.5 Ų132.567%0.66868%0.677SS**Hα-helixtrans-82.9-26.4-177.1-87.37.8000114.4T9N6-T9 PolarHBondContact O-OG1 2.75Å
7D62.8Low62.1Low123 Ų123132 Ų13266%0.65868%0.676SS**Hα-helixtrans-76.2-31.3-178.8-62.7-38.6000112.5T9 A10 A11D7-T9 PolarHBondContact O-N 3.03Å; D7-A10 PolarHBondContact O-N 2.72Å; D7-A11 PolarHBondContact O-N 2.96Å
8F66Low62Low147 Ų147127.6 Ų127.665%0.64566%0.662SS**Hα-helixtrans-69.4-34.1-179.7-162.4-101.4000112.5A11 L12F8-A11 PolarHBondContact O-N 2.6Å; F8-L12 HydrophobicContact CD1-CD1 3.74Å; F8-L12 HydrophobicContact CE1-CD1 3.53Å; F8-L12 HydrophobicContact CE1-CG 4.28Å; F8-L12 HydrophobicContact CZ-CD1 4.46Å; F8-L12 PolarHBondContact O-N 2.82Å
9T65.9Low62Low75 Ų75127.4 Ų127.446%0.4666%0.661SS.*Hα-helixtrans-72-28.4176.3420000112.6N6 D7 R13N6-T9 PolarHBondContact O-OG1 2.75Å; D7-T9 PolarHBondContact O-N 3.03Å; T9-R13 PolarHBondContact O-N 3.15Å
10A64.9Low61.8Low60 Ų60123.1 Ų123.150%0.49665%0.649SS.*Hα-helixtrans-69.7-41.6172.600000112.1D7 L12 R13 N14D7-A10 PolarHBondContact O-N 2.72Å; A10-L12 PolarHBondContact O-N 2.97Å; A10-R13 PolarHBondContact O-N 2.84Å; A10-N14 PolarHBondContact O-N 3.39Å
11A63.2Low61.7Low60 Ų60125 Ų12550%0.49665%0.653SS.*Hα-helixtrans-63.3-40.3177.900000112.7D7 F8 N14 Q15D7-A11 PolarHBondContact O-N 2.96Å; F8-A11 PolarHBondContact O-N 2.6Å; A11-N14 PolarHBondContact O-N 3.04Å; A11-Q15 PolarHBondContact O-N 2.69Å
12L64.3Low62.2Low95 Ų95118.9 Ų118.950%0.49762%0.623SS.*Hα-helixtrans-67.3-35.9177.8-83.8165000113.3F8 A10 S16F8-L12 HydrophobicContact CD1-CD1 3.74Å; F8-L12 HydrophobicContact CE1-CD1 3.53Å; F8-L12 HydrophobicContact CE1-CG 4.28Å; F8-L12 HydrophobicContact CZ-CD1 4.46Å; F8-L12 PolarHBondContact O-N 2.82Å; A10-L12 PolarHBondContact O-N 2.97Å; L12-S16 PolarHBondContact O-N 3.35Å
13R66.6Low62.2Low195 Ų195118.7 Ų118.774%0.73662%0.619SS**Hα-helixtrans-67.5-39.7176-75.7-170.9-159.4179.16.5112.4T9 A10 S16 L17T9-R13 PolarHBondContact O-N 3.15Å; A10-R13 PolarHBondContact O-N 2.84Å; R13-S16 PolarHBondContact O-N 3.03Å; R13-L17 PolarHBondContact O-N 3.07Å
14N69.8Low62.1Low117 Ų117121.2 Ų121.263%0.62662%0.619SS**Hα-helixtrans-72-33.5-176.6-143.6-4.7000112.1A10 A11 L17 A18A10-N14 PolarHBondContact O-N 3.39Å; A11-N14 PolarHBondContact O-N 3.04Å; N14-L17 PolarHBondContact O-N 2.91Å; N14-A18 PolarHBondContact O-N 2.99Å
15Q68.6Low61.8Low135 Ų135115.4 Ų115.463%0.63160%0.602SS**Hα-helixtrans-64.3-39.2170.9-98.8-171-8.400112.9A11 L17 A18 L19A11-Q15 PolarHBondContact O-N 2.69Å; Q15-L17 VanDerWaalsContact C-N 3.32Å; Q15-L17 PolarHBondContact O-N 3.28Å; Q15-A18 PolarHBondContact O-N 2.72Å; Q15-L19 PolarHBondContact O-N 2.95Å
16S64Low61.9Low84 Ų84112 Ų11259%0.58759%0.592SS**Hα-helixtrans-67.7-32.2180-158.30000112.6L12 R13 G20L12-S16 PolarHBondContact O-N 3.35Å; R13-S16 PolarHBondContact O-N 3.03Å; S16-G20 PolarHBondContact O-N 2.7Å
17L61.2Low62.1Low124 Ų124109.3 Ų109.365%0.64958%0.583SS**Hα-helixtrans-70.7-36.3174.4-69.4173.5000112.3R13 N14 Q15 G20 F21R13-L17 PolarHBondContact O-N 3.07Å; N14-L17 PolarHBondContact O-N 2.91Å; Q15-L17 VanDerWaalsContact C-N 3.32Å; Q15-L17 PolarHBondContact O-N 3.28Å; L17-G20 PolarHBondContact O-N 3.11Å; L17-F21 PolarHBondContact O-N 3.39Å
18A60.8Low62Low52 Ų52110.2 Ų110.243%0.4359%0.585SS.*Hα-helixtrans-65.4-37.9177.100000112.5N14 Q15 F21 I22N14-A18 PolarHBondContact O-N 2.99Å; Q15-A18 PolarHBondContact O-N 2.72Å; A18-F21 PolarHBondContact O-N 3.1Å; A18-I22 WeakPolarHBondContact O-CD1 3.37Å; A18-I22 WeakPolarHBondContact O-CG1 3.19Å; A18-I22 PolarHBondContact O-N 2.98Å
19L61.7Low61.8Low124 Ų124110.5 Ų110.565%0.64958%0.583SS**Hα-helixtrans-67.6-35.7176.7-71.1170.4000112.4Q15 Q23Q15-L19 PolarHBondContact O-N 2.95Å; L19-Q23 PolarHBondContact O-N 3.39Å
20G58.3Low61.6Low41 Ų41111 Ų11142%0.42359%0.588SS.*Hα-helixtrans-65.7-38.3175.800000113.6S16 L17 Q23 Q24S16-G20 PolarHBondContact O-N 2.7Å; L17-G20 PolarHBondContact O-N 3.11Å; G20-Q23 PolarHBondContact O-N 3.25Å; G20-Q24 PolarHBondContact O-N 2.88Å
21F60.3Low61.4Low164 Ų164117.3 Ų117.372%0.71960%0.599SS**Hα-helixtrans-70.4-32179.8-115.5-92.6000113.3L17 A18L17-F21 PolarHBondContact O-N 3.39Å; A18-F21 PolarHBondContact O-N 3.1Å
22I58.6Low61.6Low107 Ų107121.9 Ų121.955%0.54961%0.608SS.*Hα-helixtrans-71.7-39.1178.4-66.6165.8000110.4A18 Q24 Q25A18-I22 WeakPolarHBondContact O-CD1 3.37Å; A18-I22 WeakPolarHBondContact O-CG1 3.19Å; A18-I22 PolarHBondContact O-N 2.98Å; I22-Q24 VanDerWaalsContact C-N 3.29Å; I22-Q24 PolarHBondContact O-N 3.11Å; I22-Q25 PolarHBondContact O-N 3.34Å
23Q53.5Low61.4Low157 Ų157122.9 Ų122.973%0.73461%0.614SS**Hα-helixtrans-68.6-26.4-179.1-153.7-176.99.200113.3L19 G20L19-Q23 PolarHBondContact O-N 3.39Å; G20-Q23 PolarHBondContact O-N 3.25Å
24Q56.3Low61Low157 Ų157124 Ų12473%0.73462%0.618SS**Hα-helixtrans-79.7-23.8179.4-163.2152.7-13.400113.4G20 I22G20-Q24 PolarHBondContact O-N 2.88Å; I22-Q24 VanDerWaalsContact C-N 3.29Å; I22-Q24 PolarHBondContact O-N 3.11Å
25Q51.6Low60.3Low111 Ų111123 Ų12352%0.51962%0.619SS.*Hα-helixtrans-74.7-35.8176.4-74.4-74.90.600112.5I22 S27 M28 Y29I22-Q25 PolarHBondContact O-N 3.34Å; Q25-S27 VanDerWaalsContact C-N 3.34Å; Q25-S27 PolarHBondContact O-N 2.92Å; Q25-M28 PolarHBondContact O-N 3.49Å; Q25-Y29 PolarHBondContact O-N 3.39Å
26D60.1Low60.2Low99 Ų99124.5 Ų124.553%0.52962%0.624SS.*Hα-helixtrans-67.2-31.9-177.3-76.4-31.9000113.4M28 C30D26-M28 PolarHBondContact O-N 3.04Å; D26-C30 WeakPolarHBondContact O-CB 3.31Å; D26-C30 PolarHBondContact O-N 3.01Å; D26-C30 VanDerWaalsContact O-N 3.1Å; D26-C30 PolarHBondContact O-SG 3.33Å
27S66.1Low59.9Low68 Ų68126.5 Ų126.548%0.47663%0.633SS.*Hα-helixtrans-67.3-34.3179.3-170.40000112.8Q25 R31Q25-S27 VanDerWaalsContact C-N 3.34Å; Q25-S27 PolarHBondContact O-N 2.92Å; S27-R31 PolarHBondContact O-N 3.37Å
28M59.5Low59.4Low142 Ų142124.9 Ų124.970%0.764%0.637SS**Hα-helixtrans-71.6-45.2177.1-97.4-89.9-92.300112Q25 D26 C30 R31 F32Q25-M28 PolarHBondContact O-N 3.49Å; D26-M28 PolarHBondContact O-N 3.04Å; M28-C30 PolarHBondContact O-N 3.41Å; M28-R31 PolarHBondContact O-N 3.18Å; M28-F32 PolarHBondContact O-N 2.92Å
29Y62.2Low59Low154 Ų154127.6 Ų127.660%0.60465%0.653SS**Hα-helixtrans-66.3-36.6179.5-88.7-84.9000112.7Q25 R31 F32 L33Q25-Y29 PolarHBondContact O-N 3.39Å; Y29-R31 VanDerWaalsContact C-N 3.32Å; Y29-R31 PolarHBondContact O-N 3.07Å; Y29-F32 PolarHBondContact O-N 3.48Å; Y29-L33 PolarHBondContact O-N 3.34Å
30C61.7Low58.4Low84 Ų84133.4 Ų133.457%0.56867%0.666SS**Hα-helixtrans-66.3-33177.8-71.70000112.9D26 M28D26-C30 WeakPolarHBondContact O-CB 3.31Å; D26-C30 PolarHBondContact O-N 3.01Å; D26-C30 VanDerWaalsContact O-N 3.1Å; D26-C30 PolarHBondContact O-SG 3.33Å; M28-C30 PolarHBondContact O-N 3.41Å
31R60.5Low57.5Low193 Ų193136 Ų13673%0.72868%0.678SS**Hα-helixtrans-72.2-38.8175-73.2-175.7-178.4-175.50.9112.1S27 M28 Y29 R34S27-R31 PolarHBondContact O-N 3.37Å; M28-R31 PolarHBondContact O-N 3.18Å; Y29-R31 VanDerWaalsContact C-N 3.32Å; Y29-R31 PolarHBondContact O-N 3.07Å; R31-R34 PolarHBondContact O-N 2.97Å
32F67.5Low56.8Low157 Ų157137 Ų13769%0.68969%0.685SS**Hα-helixtrans-65.8-40.8-179.3-167.3-102.4000112.8M28 Y29 R34 S35M28-F32 PolarHBondContact O-N 2.92Å; Y29-F32 PolarHBondContact O-N 3.48Å; F32-R34 VanDerWaalsContact C-N 3.34Å; F32-R34 PolarHBondContact O-N 3.07Å; F32-S35 PolarHBondContact O-N 3.49Å
33L60.8Low55.9Low116 Ų116136.8 Ų136.861%0.60769%0.692SS**Hα-helixtrans-70-28.3-178.6-75.8163.1000113.6Y29 F36Y29-L33 PolarHBondContact O-N 3.34Å; L33-F36 PolarHBondContact O-N 2.91Å
34R58.8Low55.4Low219 Ų219137.1 Ų137.183%0.82670%0.699SS**Hα-helixtrans-70-30.4178.6-113.3179.3174.3172.4-1.5113.2R31 F32R31-R34 PolarHBondContact O-N 2.97Å; F32-R34 VanDerWaalsContact C-N 3.34Å; F32-R34 PolarHBondContact O-N 3.07Å
35S55.1Low54.6Low94 Ų94136 Ų13666%0.65770%0.703SS**Hα-helixtrans-76.2-27178.3-660000113.3F32F32-S35 PolarHBondContact O-N 3.49Å
36F64.7Low54.5Low168 Ų168142 Ų14274%0.73772%0.721SS**Hα-helixtrans-75.8-29.6-176.3-168-104.3000113.5L33 A38L33-F36 PolarHBondContact O-N 2.91Å; F36-A38 VanDerWaalsContact C-N 3.34Å; F36-A38 PolarHBondContact O-N 3.3Å
37V59.3Low53.6Low126 Ų126143.4 Ų143.476%0.76473%0.733SS**G310 helixtrans-77.6-17.3-176172.90000113.2S39V37-S39 PolarHBondContact O-N 3.26Å
38A50.3Low52.7Low90 Ų90145.3 Ų145.374%0.74474%0.744SS**G310 helixtrans-85.1-3.2-174.900000115.5F36F36-A38 VanDerWaalsContact C-N 3.34Å; F36-A38 PolarHBondContact O-N 3.3Å
39S53Low51.5Low109 Ų109148.2 Ų148.276%0.76275%0.753SS**G310 helixtrans-110.59.8-168.2-157.90000116V37V37-S39 PolarHBondContact O-N 3.26Å
40R49.4Very low50.5Low245 Ų245151.6 Ų151.693%0.92576%0.764SS**  trans-123.362.9-177.5-138.7168.5-170.5-173.81.2113.2
41S37.9Very low49.4Very low95 Ų95153.7 Ų153.766%0.66477%0.77SS**  trans-133.9104165.7176.30000108.7
42H45.4Very low48.4Very low186 Ų186151.1 Ų151.186%0.86177%0.769SS**  trans-170.2114.7130.1-98.7-65.5000110
43S41.4Very low46.8Very low102 Ų102148.9 Ų148.971%0.71377%0.772SS**  trans-76.2144.2167.742.80000110.9
44N41.2Very low46.1Very low165 Ų165148.6 Ų148.688%0.88279%0.786SS**  trans-163.6104.5143.2-115.2-23.4000110.8
45V41.4Very low45.4Very low133 Ų133145.4 Ų145.481%0.80679%0.785SS**  trans-93.5121.5169.3167.60000106.8
46R49.3Very low45.1Very low238 Ų238149.3 Ų149.390%0.89879%0.793SS**  trans-147.188.5168.9-153.6174.5-180-178.8-0.8110.4
47T39.3Very low44Very low127 Ų127147.8 Ų147.878%0.77979%0.792SS**  trans-104.2130.6164.530.90000109.3
48P48.3Very low43Very low109 Ų109146.4 Ų146.471%0.70879%0.794SS**  trans-121.1123.414631.6-18.4000108.4
49F33.7Very low43Very low203 Ų203151.3 Ų151.389%0.8980%0.799SS**  47.9127.788-105.7-85.9000114.6
50R41.7Very low42.1Very low224 Ų224151 Ų15185%0.84580%0.797SS**  trans97.9132.5175.3-70.9-157.9176.8-177.11.6113.7
51L39.5Very low41.8Very low129 Ų129148.2 Ų148.268%0.67579%0.794SS**  cis176153.89177.493.1000105.5
52L39.4Very low41.7Very low138 Ų138152.8 Ų152.872%0.72381%0.805SS**  trans86.2102.1148.1-124.878.1000119.3
53C33.1Very low41.3Very low111 Ų111152.3 Ų152.375%0.7580%0.803SS**  45107123.9-54.70000119.7
54A45.7Very low41.2Very low109 Ų109153.5 Ų153.590%0.90181%0.808SS**  trans-130.194.6135.700000108.2
55L44.5Very low41.4Very low153 Ų153150.4 Ų150.480%0.80180%0.796SS**  trans-80.4137.8158.8-115.5166.3000107.1
56Q49Very low41.1Very low175 Ų175152.6 Ų152.682%0.81879%0.794SS**  trans136126.1165.5-83.2161.3-38.900108.6
57D42.3Very low40.9Very low136 Ų136147.6 Ų147.673%0.72778%0.781SS**  cis-151.2136.914.4-79-59.3000106.4
58A36.7Very low41.1Very low98 Ų98148.4 Ų148.481%0.8178%0.776SS**  45.190.786.100000115.3
59K50Low41Very low193 Ų193148.9 Ų148.984%0.83977%0.773SS**  trans-156.5116131.7-164.1142.2-177.7167.30111.8
60S35.9Very low41.4Very low103 Ų103145 Ų14572%0.7277%0.766SS**  trans-53.4133.6160.748.60000113
61E41.6Very low41.6Very low186 Ų186138 Ų13887%0.86976%0.756SS**  trans-152.1102.5140.6-111.9169.5157.800108.7
62Q35.7Very low41.9Very low190 Ų190137.5 Ų137.589%0.88876%0.76SS**  trans-75128.3158.2-74.9170.3-51.400107.5
63Q36.9Very low42.2Very low176 Ų176140.8 Ų140.882%0.82277%0.769SS**  trans-139.7129.7140.8-80.6-165-2600110.1
64P39.9Very low43.1Very low127 Ų127144.6 Ų144.683%0.82577%0.773SS**  trans-79.7126.6173.732.7-29.4000108.5
65V45.1Very low43.9Very low101 Ų101145.4 Ų145.461%0.61277%0.766SS**  trans-119.566.5173.2-160.60000108.1Q67V65-Q67 HydrophobicContact CG1-CB 4.03Å; V65-Q67 HydrophobicContact CG1-CG 3.6Å; V65-Q67 PolarHBondContact O-N 3.47Å
66F35.4Very low44.8Very low178 Ų178142.7 Ų142.778%0.78176%0.758SS**  trans-73.583.2150.8-169.2-98.9000106.1E68F66-E68 HydrophobicContact CD1-CB 4.18Å; F66-E68 HydrophobicContact CE1-CB 3.76Å; F66-E68 HydrophobicContact CE1-CG 4.42Å; F66-E68 PolarHBondContact O-N 3.19Å
67Q46.2Very low45.2Very low133 Ų133139.7 Ų139.762%0.62175%0.754SS**  trans-88.192.2164.1-89178.130.300107.4V65 N69V65-Q67 HydrophobicContact CG1-CB 4.03Å; V65-Q67 HydrophobicContact CG1-CG 3.6Å; V65-Q67 PolarHBondContact O-N 3.47Å; Q67-N69 PolarHBondContact O-N 3.44Å; Q67-N69 PolarHBondContact OE1-ND2 3.45Å
68E41.7Very low46Very low144 Ų144137.3 Ų137.367%0.67375%0.753SS**  trans-62.574.5153.4-169.1177.3156.700108.3F66 T70F66-E68 HydrophobicContact CD1-CB 4.18Å; F66-E68 HydrophobicContact CE1-CB 3.76Å; F66-E68 HydrophobicContact CE1-CG 4.42Å; F66-E68 PolarHBondContact O-N 3.19Å; E68-T70 PolarHBondContact O-N 2.98Å
69N47.3Very low46.5Very low120 Ų120140.1 Ų140.164%0.64275%0.754SS**  trans-7782.8165.3-76.5-40.1000107.3Q67 A71Q67-N69 PolarHBondContact O-N 3.44Å; Q67-N69 PolarHBondContact OE1-ND2 3.45Å; N69-A71 PolarHBondContact O-N 3.1Å
70T41.1Very low47Very low121 Ų121134.8 Ų134.874%0.74275%0.754SS**  trans-6494151.2-65.60000106.5E68E68-T70 PolarHBondContact O-N 2.98Å
71A47.3Very low47.7Very low78 Ų78137.9 Ų137.965%0.64576%0.757SS**  trans-110.8131.116200000107.9N69N69-A71 PolarHBondContact O-N 3.1Å
72P46Very low48.6Very low117 Ų117134.7 Ų134.776%0.7675%0.753SS**  trans-68142.6-163.9-1227.4000110.6K74P72-K74 VanDerWaalsContact C-N 3.28Å; P72-K74 PolarHBondContact O-N 2.96Å
73F44.5Very low49.9Very low208 Ų208133 Ų13391%0.91275%0.749SS**  trans-52.489.5170.8-70.4-82.6000110.9V75F73-V75 PolarHBondContact O-N 2.91Å
74K52.9Low51.1Low191 Ų191133.9 Ų133.983%0.8375%0.753SS**  trans-79.799.3164.9-169.3167.5-176.8-173.40105.7P72 P76P72-K74 VanDerWaalsContact C-N 3.28Å; P72-K74 PolarHBondContact O-N 2.96Å; K74-P76 WeakPolarHBondContact O-CD 3.04Å; K74-P76 VanDerWaalsContact O-N 3.12Å
75V61.2Low52.7Low125 Ų125129.4 Ų129.476%0.75873%0.727SS**  trans-58114171-173.40000106.6F73F73-V75 PolarHBondContact O-N 2.91Å
76P63.5Low54.5Low97 Ų97127.8 Ų127.863%0.6372%0.72SS**PPolyproline II helixtrans-66.3138.8176.626.4-31000108.9K74K74-P76 WeakPolarHBondContact O-CD 3.04Å; K74-P76 VanDerWaalsContact O-N 3.12Å
77P57.9Low57Low111 Ų111126.8 Ų126.872%0.72172%0.717SS**PPolyproline II helixtrans-60.6145.817824.4-31.9000111.2
78A59.1Low59.1Low86 Ų86127.6 Ų127.671%0.71172%0.721SS**SBendtrans-56.1143.617300000110.2
79D47.5Very low61.5Low157 Ų157123.9 Ų123.984%0.8471%0.708SS**SBendtrans88.782.8173.6-45.5-44.3000116.2
80G59.5Low63.6Low81 Ų81123.8 Ų123.884%0.83570%0.702SS**  trans94.622132.100000119.7
81E52.4Low66.1Low169 Ų169122.7 Ų122.779%0.7969%0.692SS**  trans-89.8124.8171.1-63.7-162.7149.900111.7L83E81-L83 PolarHBondContact O-N 3.27Å
82P59.6Low68.4Low118 Ų118123.4 Ų123.477%0.76668%0.684SS**  trans-58108.4176.3-20.531.3000109.2E84P82-E84 PolarHBondContact O-N 3.17Å
83L62.1Low70.6Confident154 Ų154121.4 Ų121.481%0.80667%0.67SS**  trans-53.2111.7167.2-63.7172.9000106.5E81 A85E81-L83 PolarHBondContact O-N 3.27Å; L83-A85 PolarHBondContact O-N 3.18Å
84E63.4Low73Confident196 Ų196115.7 Ų115.792%0.91665%0.649SS**  trans-65.884.4178.1-66.7-161.4159.400108.7P82P82-E84 PolarHBondContact O-N 3.17Å
85A72.2Confident75Confident33 Ų33114.9 Ų114.927%0.27364%0.64SS.*  trans-91.1152.7174.800000109.9L83 V89 K90L83-A85 PolarHBondContact O-N 3.18Å; A85-V89 HydrophobicContact CB-CB 3.74Å; A85-V89 HydrophobicContact CB-CG1 3.7Å; A85-V89 HydrophobicContact CB-CG2 4.36Å; A85-K90 VanDerWaalsContact O-CE 3.27Å; A85-K90 WeakPolarHBondContact O-CE 3.01Å
86S82.9Confident76.6Confident66 Ų66112.3 Ų112.346%0.46262%0.622SS.*  trans-56.5154.5173.561.60000111.5E88 V89 K90S86-E88 PolarHBondContact O-N 3.5Å; S86-E88 VanDerWaalsContact O-N 3.11Å; S86-V89 PolarHBondContact O-N 2.84Å; S86-V89 WeakPolarHBondContact OG-CG2 3.33Å; S86-K90 PolarHBondContact O-N 2.98Å
87E88.8Confident78Confident157 Ų157113.1 Ų113.173%0.73462%0.624SS**Hα-helixtrans-54.3-32.6179.6-62.9-176.5170.500112.5K90 N91E87-K90 PolarHBondContact O-N 3.46Å; E87-N91 PolarHBondContact O-N 3.28Å; E87-N91 PolarHBondContact O-ND2 3.33Å; E87-N91 VanDerWaalsContact O-ND2 3.07Å
88E89.7Confident79.7Confident151 Ų151115.9 Ų115.971%0.70663%0.625SS**Hα-helixtrans-61.8-43.2175.9-60.3-175.9161.400112.5S86 N91 L92S86-E88 PolarHBondContact O-N 3.5Å; S86-E88 VanDerWaalsContact O-N 3.11Å; E88-N91 PolarHBondContact O-N 3.25Å; E88-L92 WeakPolarHBondContact O-CG 3.13Å; E88-L92 PolarHBondContact O-N 3.44Å
89V92.2Very high81.4Confident66 Ų66115.2 Ų115.240%0.461%0.609SS.*Hα-helixtrans-67.3-40.8178.8176.30000110.3A85 S86 N91 L92 V93A85-V89 HydrophobicContact CB-CB 3.74Å; A85-V89 HydrophobicContact CB-CG1 3.7Å; A85-V89 HydrophobicContact CB-CG2 4.36Å; S86-V89 PolarHBondContact O-N 2.84Å; S86-V89 WeakPolarHBondContact OG-CG2 3.33Å; V89-N91 PolarHBondContact O-N 2.99Å; V89-L92 WeakPolarHBondContact O-CB 3.38Å; V89-L92 PolarHBondContact O-N 3.27Å; V89-V93 HydrophobicContact CG1-CG2 4.47Å; V89-V93 WeakPolarHBondContact O-CG2 3.27Å; V89-V93 PolarHBondContact O-N 3.25Å
90K92.3Very high83.6Confident117 Ų117111.4 Ų111.451%0.50959%0.592SS.*Hα-helixtrans-59.9-47.1176.1-64.1177.7-178.8172.20111.2A85 S86 E87 L92 V93 D94A85-K90 VanDerWaalsContact O-CE 3.27Å; A85-K90 WeakPolarHBondContact O-CE 3.01Å; S86-K90 PolarHBondContact O-N 2.98Å; E87-K90 PolarHBondContact O-N 3.46Å; K90-L92 VanDerWaalsContact C-N 3.3Å; K90-L92 PolarHBondContact O-N 3.32Å; K90-V93 PolarHBondContact O-N 3.14Å; K90-V93 VanDerWaalsContact O-N 3.17Å; K90-D94 PolarHBondContact O-N 3.17Å
91N93.6Very high85.2Confident98 Ų98114.6 Ų114.652%0.52459%0.589SS.*Hα-helixtrans-61.3-36.1175.8-73-39.6000112.8E87 E88 V89 R95E87-N91 PolarHBondContact O-N 3.28Å; E87-N91 PolarHBondContact O-ND2 3.33Å; E87-N91 VanDerWaalsContact O-ND2 3.07Å; E88-N91 PolarHBondContact O-N 3.25Å; V89-N91 PolarHBondContact O-N 2.99Å; N91-R95 VanDerWaalsContact O-CG 3.24Å; N91-R95 WeakPolarHBondContact O-CG 3.28Å; N91-R95 PolarHBondContact O-N 3.08Å; N91-R95 VanDerWaalsContact O-N 3.13Å
92L95.1Very high87.1Confident94 Ų94111.7 Ų111.749%0.49258%0.583SS.*Hα-helixtrans-67.7-42.9174.6-72.6171.5000111.7E88 V89 K90 D94 R95 I96E88-L92 WeakPolarHBondContact O-CG 3.13Å; E88-L92 PolarHBondContact O-N 3.44Å; V89-L92 WeakPolarHBondContact O-CB 3.38Å; V89-L92 PolarHBondContact O-N 3.27Å; K90-L92 VanDerWaalsContact C-N 3.3Å; K90-L92 PolarHBondContact O-N 3.32Å; L92-D94 PolarHBondContact O-N 3.43Å; L92-R95 PolarHBondContact O-N 3.38Å; L92-I96 VanDerWaalsContact O-CG1 3.26Å; L92-I96 WeakPolarHBondContact O-CG1 3.32Å; L92-I96 PolarHBondContact O-N 3.13Å
93V92.8Very high88.8Confident75 Ų75109.7 Ų109.746%0.45557%0.566SS.*Hα-helixtrans-59.5-47.4176172.70000110.5V89 K90 R95 I96 V97V89-V93 HydrophobicContact CG1-CG2 4.47Å; V89-V93 WeakPolarHBondContact O-CG2 3.27Å; V89-V93 PolarHBondContact O-N 3.25Å; K90-V93 PolarHBondContact O-N 3.14Å; K90-V93 VanDerWaalsContact O-N 3.17Å; V93-R95 PolarHBondContact O-N 2.58Å; V93-I96 PolarHBondContact O-N 3.34Å; V93-I96 VanDerWaalsContact O-N 3.1Å; V93-V97 HydrophobicContact CG1-CG2 4.41Å; V93-V97 WeakPolarHBondContact O-CG2 3.42Å; V93-V97 PolarHBondContact O-N 2.73Å
94D94.1Very high90.4Very high87 Ų87105.1 Ų105.147%0.46554%0.541SS..Hα-helixtrans-60.5-34.8177.1-72.6-30000112.8K90 L92 K98K90-D94 PolarHBondContact O-N 3.17Å; L92-D94 PolarHBondContact O-N 3.43Å; D94-K98 WeakPolarHBondContact O-CD 3.49Å; D94-K98 VanDerWaalsContact O-CG 3.24Å; D94-K98 WeakPolarHBondContact O-CG 3.48Å; D94-K98 PolarHBondContact O-N 3.13Å
95R95Very high91.8Very high174 Ų17498.8 Ų98.866%0.65752%0.518SS*.Hα-helixtrans-71.5-38.4175.1-73.1175.267.7-174.91112.2N91 L92 V93 K98 L99N91-R95 VanDerWaalsContact O-CG 3.24Å; N91-R95 WeakPolarHBondContact O-CG 3.28Å; N91-R95 PolarHBondContact O-N 3.08Å; N91-R95 VanDerWaalsContact O-N 3.13Å; L92-R95 PolarHBondContact O-N 3.38Å; V93-R95 PolarHBondContact O-N 2.58Å; R95-K98 PolarHBondContact O-N 3.49Å; R95-L99 WeakPolarHBondContact O-CG 3.35Å
96I94.1Very high92.9Very high72 Ų7299.3 Ų99.337%0.36952%0.523SS..Hα-helixtrans-66-43.5177.8-68162.4000110.5L92 V93 K98 L99L92-I96 VanDerWaalsContact O-CG1 3.26Å; L92-I96 WeakPolarHBondContact O-CG1 3.32Å; L92-I96 PolarHBondContact O-N 3.13Å; V93-I96 PolarHBondContact O-N 3.34Å; V93-I96 VanDerWaalsContact O-N 3.1Å; I96-K98 PolarHBondContact O-N 2.71Å; I96-L99 PolarHBondContact O-N 3Å; I96-L99 VanDerWaalsContact O-N 3.14Å
97V92.8Very high93.5Very high113 Ų11399 Ų9969%0.68552%0.515SS*.Hα-helixtrans-64.4-29.2179.41740000112.3V93 L99V93-V97 HydrophobicContact CG1-CG2 4.41Å; V93-V97 WeakPolarHBondContact O-CG2 3.42Å; V93-V97 PolarHBondContact O-N 2.73Å; V97-L99 VanDerWaalsContact C-N 3.34Å
98K95.2Very high93.7Very high169 Ų16995.2 Ų95.274%0.73550%0.501SS*.THydrogen-bonded Turntrans-76.2-16176.6-72.4168.6-171.9169.70114.1D94 R95 I96D94-K98 WeakPolarHBondContact O-CD 3.49Å; D94-K98 VanDerWaalsContact O-CG 3.24Å; D94-K98 WeakPolarHBondContact O-CG 3.48Å; D94-K98 PolarHBondContact O-N 3.13Å; R95-K98 PolarHBondContact O-N 3.49Å; I96-K98 PolarHBondContact O-N 2.71Å
99L93Very high93.9Very high72 Ų7294.1 Ų94.138%0.37749%0.494SS..SBendtrans-79.4155.3179.7-69.9173.6000111.6R95 I96 V97 D103 I104 L107R95-L99 WeakPolarHBondContact O-CG 3.35Å; I96-L99 PolarHBondContact O-N 3Å; I96-L99 VanDerWaalsContact O-N 3.14Å; V97-L99 VanDerWaalsContact C-N 3.34Å; L99-D103 HydrophobicContact CB-CB 4.23Å; L99-D103 HydrophobicContact CD2-CB 4.34Å; L99-I104 HydrophobicContact CB-CG1 4.1Å; L99-L107 HydrophobicContact CD1-CD1 3.99Å
100T94Very high93.9Very high78 Ų7895.9 Ų95.948%0.47950%0.5SS..  trans-77.4159.6175.374.20000111.5V102 D103 I104T100-V102 PolarHBondContact O-N 3.01Å; T100-V102 VanDerWaalsContact O-N 3.17Å; T100-D103 PolarHBondContact O-N 2.82Å; T100-D103 VanDerWaalsContact O-N 3.08Å; T100-D103 PolarHBondContact OG1-N 2.87Å; T100-D103 PolarHBondContact OG1-OD2 3.06Å; T100-I104 WeakPolarHBondContact O-CG1 3.4Å; T100-I104 PolarHBondContact O-N 3.46Å
101L93.1Very high94Very high148 Ų14894.7 Ų94.778%0.77550%0.499SS*.Hα-helixtrans-57.2-32.6179.1-64.8178.8000113.3I104 S105L101-I104 HydrophobicContact CD2-CD1 4.36Å; L101-S105 PolarHBondContact O-N 3.44Å
102V93.4Very high93.8Very high108 Ų10893.5 Ų93.566%0.65549%0.489SS*.Hα-helixtrans-67-47177.4-179.50000110.1T100 I104 S105 A106T100-V102 PolarHBondContact O-N 3.01Å; T100-V102 VanDerWaalsContact O-N 3.17Å; V102-I104 VanDerWaalsContact C-N 3.33Å; V102-I104 PolarHBondContact O-N 2.95Å; V102-S105 PolarHBondContact O-N 2.99Å; V102-S105 PolarHBondContact O-OG 3.41Å; V102-A106 PolarHBondContact O-N 2.65Å
103D94.5Very high93.5Very high76 Ų7695.4 Ų95.441%0.40650%0.495SS..Hα-helixtrans-65.7-35.5178.6-59.4-45.6000112.3L99 T100 S105 A106 L107L99-D103 HydrophobicContact CB-CB 4.23Å; L99-D103 HydrophobicContact CD2-CB 4.34Å; T100-D103 PolarHBondContact O-N 2.82Å; T100-D103 VanDerWaalsContact O-N 3.08Å; T100-D103 PolarHBondContact OG1-N 2.87Å; T100-D103 PolarHBondContact OG1-OD2 3.06Å; D103-S105 VanDerWaalsContact C-N 3.33Å; D103-S105 PolarHBondContact O-N 3.45Å; D103-A106 PolarHBondContact O-N 2.93Å; D103-L107 WeakPolarHBondContact O-CB 3.37Å; D103-L107 PolarHBondContact O-N 2.91Å
104I96.1Very high93.3Very high58 Ų58102 Ų10230%0.29751%0.512SS..Hα-helixtrans-62.5-41.2176.8-67165.2000110.9L99 T100 L101 V102 L107 N108L99-I104 HydrophobicContact CB-CG1 4.1Å; T100-I104 WeakPolarHBondContact O-CG1 3.4Å; T100-I104 PolarHBondContact O-N 3.46Å; L101-I104 HydrophobicContact CD2-CD1 4.36Å; V102-I104 VanDerWaalsContact C-N 3.33Å; V102-I104 PolarHBondContact O-N 2.95Å; I104-L107 PolarHBondContact O-N 2.92Å; I104-N108 PolarHBondContact O-N 2.96Å
105S92.5Very high93.1Very high62 Ų62103.3 Ų103.343%0.43452%0.518SS..Hα-helixtrans-65.3-38.8176.978.20000112.3L101 V102 D103 N108 K109L101-S105 PolarHBondContact O-N 3.44Å; V102-S105 PolarHBondContact O-N 2.99Å; V102-S105 PolarHBondContact O-OG 3.41Å; D103-S105 VanDerWaalsContact C-N 3.33Å; D103-S105 PolarHBondContact O-N 3.45Å; S105-N108 PolarHBondContact O-N 3.22Å; S105-K109 WeakPolarHBondContact O-CG 3.26Å; S105-K109 PolarHBondContact O-N 3.4Å
106A95Very high92.7Very high44 Ų44101.6 Ų101.636%0.36452%0.522SS..Hα-helixtrans-66.8-41.7174.700000111.4V102 D103 N108 K109 L110V102-A106 PolarHBondContact O-N 2.65Å; D103-A106 PolarHBondContact O-N 2.93Å; A106-N108 VanDerWaalsContact C-N 3.35Å; A106-N108 PolarHBondContact O-N 2.98Å; A106-K109 PolarHBondContact O-N 3.15Å; A106-L110 WeakPolarHBondContact O-CG 3.39Å; A106-L110 PolarHBondContact O-N 2.94Å
107L96.2Very high92.2Very high59 Ų59103 Ų10331%0.30953%0.53SS..Hα-helixtrans-58.9-44.3174.8-178.7151.1000111.3L99 D103 I104 K109 L110 L111L99-L107 HydrophobicContact CD1-CD1 3.99Å; D103-L107 WeakPolarHBondContact O-CB 3.37Å; D103-L107 PolarHBondContact O-N 2.91Å; I104-L107 PolarHBondContact O-N 2.92Å; L107-K109 PolarHBondContact O-N 3.5Å; L107-L110 PolarHBondContact O-N 3.25Å; L107-L111 HydrophobicContact CD2-CD1 3.55Å; L107-L111 HydrophobicContact CD2-CG 4.11Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 2.97Å
108N93.5Very high91.4Very high79 Ų79102.3 Ų102.342%0.42253%0.528SS..Hα-helixtrans-61.8-43177.3-170.7-88.6000112.2I104 S105 A106 L111 K112I104-N108 PolarHBondContact O-N 2.96Å; S105-N108 PolarHBondContact O-N 3.22Å; A106-N108 VanDerWaalsContact C-N 3.35Å; A106-N108 PolarHBondContact O-N 2.98Å; N108-L111 PolarHBondContact O-N 3.42Å; N108-K112 WeakPolarHBondContact O-CG 3.37Å; N108-K112 PolarHBondContact O-N 3.25Å; N108-K112 VanDerWaalsContact O-N 3.07Å; N108-K112 WeakPolarHBondContact OD1-CE 3.32Å
109K93.1Very high90.3Very high128 Ų12899.7 Ų99.756%0.55752%0.522SS*.Hα-helixtrans-60.5-45.7175.1-70175.8-179.5-179.30111.6S105 A106 L107 L111 K112 Q113S105-K109 WeakPolarHBondContact O-CG 3.26Å; S105-K109 PolarHBondContact O-N 3.4Å; A106-K109 PolarHBondContact O-N 3.15Å; L107-K109 PolarHBondContact O-N 3.5Å; K109-L111 PolarHBondContact O-N 2.91Å; K109-K112 PolarHBondContact O-N 2.87Å; K109-Q113 WeakPolarHBondContact O-CG 3.16Å; K109-Q113 PolarHBondContact O-N 2.77Å
110L92.9Very high89.4Confident103 Ų103101.9 Ų101.954%0.53954%0.538SS..Hα-helixtrans-63.5-40.6177.6-71.2176.3000112.1A106 L107 Q113 R114A106-L110 WeakPolarHBondContact O-CG 3.39Å; A106-L110 PolarHBondContact O-N 2.94Å; L107-L110 PolarHBondContact O-N 3.25Å; L110-Q113 PolarHBondContact O-N 3.43Å; L110-R114 WeakPolarHBondContact O-CB 3.19Å; L110-R114 WeakPolarHBondContact O-CG 3.41Å; L110-R114 PolarHBondContact O-N 2.74Å
111L93.7Very high88.3Confident91 Ų91102.8 Ų102.848%0.47655%0.545SS..Hα-helixtrans-60.9-45.2175.7-73.8178.7000111.6L107 N108 K109 Q113 R114 L115L107-L111 HydrophobicContact CD2-CD1 3.55Å; L107-L111 HydrophobicContact CD2-CG 4.11Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 2.97Å; N108-L111 PolarHBondContact O-N 3.42Å; K109-L111 PolarHBondContact O-N 2.91Å; L111-Q113 PolarHBondContact O-N 2.88Å; L111-R114 PolarHBondContact O-N 2.88Å; L111-L115 VanDerWaalsContact O-CB 3.28Å; L111-L115 WeakPolarHBondContact O-CB 3.33Å; L111-L115 WeakPolarHBondContact O-CG 3.42Å; L111-L115 PolarHBondContact O-N 2.59Å
112K90Very high86.8Confident74 Ų74103.6 Ų103.632%0.32255%0.549SS..Hα-helixtrans-60.7-45177-71.3173.7172.2-175.80112.3N108 K109 N116 L117 D119N108-K112 WeakPolarHBondContact O-CG 3.37Å; N108-K112 PolarHBondContact O-N 3.25Å; N108-K112 VanDerWaalsContact O-N 3.07Å; N108-K112 WeakPolarHBondContact OD1-CE 3.32Å; K109-K112 PolarHBondContact O-N 2.87Å; K112-N116 PolarHBondContact O-N 2.86Å; K112-N116 VanDerWaalsContact O-N 3.11Å; K112-L117 PolarHBondContact O-N 2.97Å; K112-D119 WeakPolarHBondContact CD-OD1 3.49Å; K112-D119 WeakPolarHBondContact CE-OD1 3.36Å; K112-D119 IonicContact NZ-OD1 2.77Å; K112-D119 PolarHBondContact NZ-OD1 3.37Å
113Q89.1Confident85.5Confident134 Ų134105.5 Ų105.563%0.62655%0.552SS**Hα-helixtrans-62.8-43.4176.9-73.2179-32.500112.5K109 L110 L111 N116K109-Q113 WeakPolarHBondContact O-CG 3.16Å; K109-Q113 PolarHBondContact O-N 2.77Å; L110-Q113 PolarHBondContact O-N 3.43Å; L111-Q113 PolarHBondContact O-N 2.88Å; Q113-N116 PolarHBondContact O-N 3.37Å
114R89Confident84Confident212 Ų212107.4 Ų107.480%0.857%0.569SS**Hα-helixtrans-74.4-37.5-177.3-66-69.7-99-175.6-5.4112.6L110 L111 N116L110-R114 WeakPolarHBondContact O-CB 3.19Å; L110-R114 WeakPolarHBondContact O-CG 3.41Å; L110-R114 PolarHBondContact O-N 2.74Å; L111-R114 PolarHBondContact O-N 2.88Å; R114-N116 PolarHBondContact O-N 3.49Å
115L90Very high82Confident115 Ų115113.4 Ų113.460%0.60260%0.599SS**THydrogen-bonded Turntrans-79.90.4176-63.9175.5000112.7L111 L117L111-L115 VanDerWaalsContact O-CB 3.28Å; L111-L115 WeakPolarHBondContact O-CB 3.33Å; L111-L115 WeakPolarHBondContact O-CG 3.42Å; L111-L115 PolarHBondContact O-N 2.59Å; L115-L117 HydrophobicContact CB-CD1 3.89Å; L115-L117 HydrophobicContact CB-CG 3.83Å; L115-L117 HydrophobicContact CD1-CD1 3.97Å; L115-L117 PolarHBondContact O-N 2.89Å; L115-L117 VanDerWaalsContact O-N 3.1Å
116N85.2Confident80.5Confident138 Ų138113 Ų11374%0.73861%0.606SS**THydrogen-bonded Turntrans46.936.7-173.3-66.3-75.5000112.1K112 Q113 R114 P118K112-N116 PolarHBondContact O-N 2.86Å; K112-N116 VanDerWaalsContact O-N 3.11Å; Q113-N116 PolarHBondContact O-N 3.37Å; R114-N116 PolarHBondContact O-N 3.49Å; N116-P118 WeakPolarHBondContact O-CD 3.24Å
117L84.8Confident78.3Confident101 Ų101117.1 Ų117.153%0.52963%0.628SS.*  trans-79.6104.9173.2-68.2168.1000106K112 L115 D119K112-L117 PolarHBondContact O-N 2.97Å; L115-L117 HydrophobicContact CB-CD1 3.89Å; L115-L117 HydrophobicContact CB-CG 3.83Å; L115-L117 HydrophobicContact CD1-CD1 3.97Å; L115-L117 PolarHBondContact O-N 2.89Å; L115-L117 VanDerWaalsContact O-N 3.1Å; L117-D119 PolarHBondContact O-N 2.93Å
118P74.3Confident75.6Confident99 Ų99122.5 Ų122.564%0.64365%0.654SS**  trans-57.3136.916827.2-33.4000106.7N116 V120N116-P118 WeakPolarHBondContact O-CD 3.24Å; P118-V120 VanDerWaalsContact O-CG2 3.31Å; P118-V120 WeakPolarHBondContact O-CG2 3.24Å; P118-V120 PolarHBondContact O-N 3.36Å
119D73.8Confident73.4Confident115 Ų115125.1 Ų125.162%0.61567%0.673SS**  trans-57.395.1168.5-82.1-53.7000106.4K112 L117 P121K112-D119 WeakPolarHBondContact CD-OD1 3.49Å; K112-D119 WeakPolarHBondContact CE-OD1 3.36Å; K112-D119 IonicContact NZ-OD1 2.77Å; K112-D119 PolarHBondContact NZ-OD1 3.37Å; L117-D119 PolarHBondContact O-N 2.93Å; D119-P121 WeakPolarHBondContact O-CD 3.32Å
120V74.4Confident71Confident117 Ų117122.5 Ų122.571%0.70968%0.682SS**  trans-67.8109.3179.5-151.50000103.4P118 I122P118-V120 VanDerWaalsContact O-CG2 3.31Å; P118-V120 WeakPolarHBondContact O-CG2 3.24Å; P118-V120 PolarHBondContact O-N 3.36Å; V120-I122 PolarHBondContact O-N 3.26Å; V120-I122 VanDerWaalsContact O-N 3.15Å
121P69Low68.6Low97 Ų97121.8 Ų121.863%0.6369%0.691SS**  trans-56131.4169.226.5-31.5000104.2D119 M123D119-P121 WeakPolarHBondContact O-CD 3.32Å; P121-M123 HydrophobicContact CG-CG 4.5Å; P121-M123 PolarHBondContact O-N 3.14Å
122I63.3Low66.2Low166 Ų166129.1 Ų129.185%0.85171%0.714SS**  trans-58.388.1173.1-60.6178.5000105.2V120 P124V120-I122 PolarHBondContact O-N 3.26Å; V120-I122 VanDerWaalsContact O-N 3.15Å; I122-P124 WeakPolarHBondContact O-CD 3.22Å
123M64.3Low63.8Low147 Ų147129.5 Ų129.572%0.72474%0.739SS**  trans-66.8120.4173.5-80.1-146.9-76.200103.4P121 I125P121-M123 HydrophobicContact CG-CG 4.5Å; P121-M123 PolarHBondContact O-N 3.14Å; M123-I125 PolarHBondContact O-N 2.73Å
124P63.4Low62.4Low116 Ų116127.9 Ų127.975%0.75375%0.749SS**  trans-59.2108.7176.922.9-29.4000106I122 G126I122-P124 WeakPolarHBondContact O-CD 3.22Å; P124-G126 PolarHBondContact O-N 2.78Å
125I54.9Low60.9Low184 Ų184123.3 Ų123.394%0.94475%0.747SS**  trans-67.479.8162.8-62.1174.3000104M123M123-I125 PolarHBondContact O-N 2.73Å
126G59.8Low59.4Low55 Ų55123.3 Ų123.357%0.56775%0.754SS**  trans-121142.5-179.700000108.8P124P124-G126 PolarHBondContact O-N 2.78Å
127P48.6Very low57.4Low129 Ų129122.1 Ų122.184%0.83876%0.756SS**  trans-83.9144.5-135.331-34.4000113.6
128M41.4Very low55.2Low172 Ų172122.4 Ų122.485%0.84777%0.766SS**  trans-15.8141.1146.2-163.48216600114.1
129T46.3Very low53.4Low134 Ų134122.2 Ų122.282%0.82277%0.773SS**  trans105.896.6163.873.30000117.4
130G42Very low51.7Low73 Ų73125.8 Ų125.875%0.75379%0.786SS**  84.7120.3113.200000119.1
131A44.1Very low50Low88 Ų88129.5 Ų129.573%0.72779%0.793SS**  85.1103.9126.300000119.9
132Y42.4Very low48.5Very low246 Ų246133.3 Ų133.397%0.96580%0.802SS**  trans79.7110.8139-76.4-98.2000120.6
133G40.6Very low47.1Very low81 Ų81133.9 Ų133.984%0.83580%0.801SS**  trans164.586.7158.100000112.8
134A57.8Low46Very low101 Ų101131 Ų13184%0.83580%0.801SS**  trans-77.6167.8-176.600000114.3
135P57.5Low44.9Very low116 Ų116129.8 Ų129.875%0.75380%0.801SS**  trans-110.1-151.5-16644.4-32.1000111.4
136P59.2Low44.1Very low115 Ų115127.2 Ų127.275%0.74779%0.794SS**  cis-129.9165.2-35.726.1-5.5000113.2
137S42.4Very low43.5Very low113 Ų113129.1 Ų129.179%0.7980%0.804SS**  trans-163.893.2148.8-173.80000108
138S38.6Very low43.5Very low106 Ų106132.1 Ų132.174%0.74180%0.804SS**  80118.385.9-64.50000113.7
139A37.2Very low43.8Very low96 Ų96131 Ų13179%0.79380%0.795SS**  trans83.380.9156.600000118.8
140Q38.2Very low44.5Very low189 Ų189130.4 Ų130.488%0.88379%0.791SS**SBend-150.4113.9127.3-160.9117.9-36.300110.3
141K39.4Very low45.6Very low195 Ų195128.8 Ų128.885%0.84877%0.768SS**  trans79.372.6161.9-110.8165.6-178.5175.90118.8
142E37.6Very low47.2Very low177 Ų177126.9 Ų126.983%0.82774%0.743SS**  13.3107.7115.5-146.3152.712000117.2
143Q34.1Very low48.9Very low178 Ų178116.1 Ų116.183%0.83271%0.705SS**  67.7135128.6-127.790.9-1800122
144A41Very low51Low88 Ų88112.3 Ų112.373%0.72767%0.666SS**  trans81.587.216200000115.5
145A40.2Very low52.3Low90 Ų90110.1 Ų110.174%0.74464%0.637SS**  43.6119.267.500000110.4
146T38.9Very low53.4Low130 Ų130104.9 Ų104.980%0.79860%0.603SS**  cis-167.8151.826.5-32.10000106.4K148T146-K148 PolarHBondContact O-N 3.32Å
147A45.4Very low54.5Low95 Ų95102.5 Ų102.579%0.78558%0.584SS**  trans-19.9116.8167.600000114.6K149A147-K149 PolarHBondContact O-N 3.43Å
148K49.1Very low56.5Low191 Ų191103.2 Ų103.283%0.8357%0.572SS**  trans-47.5110.4174.9-64.4178.3176.3-175.40109.3T146 T150T146-K148 PolarHBondContact O-N 3.32Å; K148-T150 PolarHBondContact O-N 3.34Å
149K48.9Very low58.7Low150 Ų150100.5 Ų100.565%0.65255%0.547SS*.  trans-55105.9160.7-104.9176.2170.1-1780106.2A147 S151A147-K149 PolarHBondContact O-N 3.43Å; K149-S151 PolarHBondContact O-N 3.39Å; K149-S151 VanDerWaalsContact O-N 3.13Å
150T60.3Low61Low121 Ų12199.8 Ų99.874%0.74253%0.53SS*.SBendtrans-7819.2174.2500000112.1K148K148-T150 PolarHBondContact O-N 3.34Å
151S64.3Low63.2Low38 Ų3898.7 Ų98.727%0.26653%0.525SS..  trans-140105.9-170.7146.80000106.2K149 D197K149-S151 PolarHBondContact O-N 3.39Å; K149-S151 VanDerWaalsContact O-N 3.13Å; S151-D197 WeakPolarHBondContact CB-OD1 3.39Å; S151-D197 PolarHBondContact OG-OD1 2.82Å
152F77.8Confident65.5Low48 Ų4895.7 Ų95.721%0.21152%0.523CS..EExtended strand (participates in β ladder)trans-105137.5175.3-66.6-82.3000109.6D197 I198 E200 A203 I219 E220F152-D197 PolarHBondContact O-N 3.29Å; F152-I198 WeakPolarHBondContact CB-O 3.34Å; F152-I198 PolarHBondContact N-O 3.49Å; F152-I198 PolarHBondContact O-N 3.43Å; F152-E200 HydrophobicContact CD2-CB 4.18Å; F152-E200 HydrophobicContact CE2-CB 3.59Å; F152-E200 HydrophobicContact CE2-CG 3.87Å; F152-E200 HydrophobicContact CZ-CB 4.34Å; F152-E200 HydrophobicContact CZ-CG 4.14Å; F152-A203 HydrophobicContact CB-CB 3.97Å; F152-I219 HydrophobicContact CB-CG2 3.68Å; F152-I219 HydrophobicContact CD1-CG2 3.52Å; F152-I219 HydrophobicContact CE1-CG2 4.41Å; F152-I219 HydrophobicContact CG-CG2 3.84Å; F152-E220 CarbonylContact C-O 3.5Å; F152-E220 VanDerWaalsContact CA-O 3.22Å; F152-E220 WeakPolarHBondContact CA-O 3.5Å
153A79.6Confident67.9Low20 Ų2091.2 Ų91.217%0.16550%0.501CS..EExtended strand (participates in β ladder)trans-102.9121.9174.500000109.6T193 R195 E196 E220A153-T193 HydrophobicContact CB-CG2 4Å; A153-R195 WeakPolarHBondContact CA-O 3.47Å; A153-E196 HydrophobicContact CB-CG 4.32Å; A153-E220 PolarHBondContact N-O 3.47Å; A153-E220 PolarHBondContact O-N 3.22Å
154V84.1Confident70.4Confident1 Ų185.3 Ų85.31%0.00647%0.473CS..EExtended strand (participates in β ladder)trans-91.4108.6177.6-176.40000108.7V194 R195 A203 L210 C217V154-V194 PolarHBondContact O-N 3.48Å; V154-R195 PolarHBondContact N-O 3Å; V154-A203 HydrophobicContact CG2-CB 4.2Å; V154-L210 HydrophobicContact CG1-CD1 4.09Å; V154-C217 HydrophobicContact CG1-CB 4.05Å
155K83.8Confident72.8Confident56 Ų5687 Ų8724%0.24347%0.468CS..EExtended strand (participates in β ladder)trans-100.6130.9176.1-69.4-178.8-178.6170.70111T193 C217 T218 E220K155-T193 HydrophobicContact CG-CG2 4.12Å; K155-C217 CarbonylContact O-C 3.57Å; K155-C217 VanDerWaalsContact O-CA 3.25Å; K155-C217 WeakPolarHBondContact O-CA 3.46Å; K155-T218 PolarHBondContact N-O 3.32Å; K155-T218 PolarHBondContact O-N 3.44Å; K155-E220 WeakPolarHBondContact CD-OE1 3.39Å; K155-E220 VanDerWaalsContact CE-OE2 3.32Å; K155-E220 WeakPolarHBondContact CE-OE2 3.44Å; K155-E220 IonicContact NZ-OE1 2.65Å; K155-E220 PolarHBondContact NZ-OE1 3.21Å; K155-E220 IonicContact NZ-OE2 2.7Å; K155-E220 PolarHBondContact NZ-OE2 3.44Å
156L81Confident75.3Confident6 Ų684.4 Ų84.43%0.03145%0.447CS..EExtended strand (participates in β ladder)trans-83.8118.7167.8-76.9169.3000109I171 F186 L190 P191 Q192 V194 L210 C217L156-I171 HydrophobicContact CD1-CD1 4Å; L156-I171 HydrophobicContact CD1-CG1 4.41Å; L156-F186 HydrophobicContact CD1-CE1 4.4Å; L156-L190 HydrophobicContact CB-CD2 4.06Å; L156-P191 WeakPolarHBondContact O-CA 3.4Å; L156-Q192 PolarHBondContact N-O 3.38Å; L156-Q192 PolarHBondContact O-N 3.46Å; L156-V194 HydrophobicContact CB-CG2 4.26Å; L156-V194 HydrophobicContact CD1-CG2 3.25Å; L156-V194 HydrophobicContact CG-CG2 3.46Å; L156-V194 VanDerWaalsContact CG-CG2 3.46Å; L156-L210 HydrophobicContact CD2-CB 4.4Å; L156-L210 HydrophobicContact CD2-CD1 4.16Å; L156-L210 HydrophobicContact CD2-CD2 4.44Å; L156-L210 HydrophobicContact CG-CD1 4.49Å; L156-C217 WeakPolarHBondContact CD2-SG 3.49Å
157L83.2Confident77.7Confident65 Ų6578.3 Ų78.334%0.3441%0.409SS..EExtended strand (participates in β ladder)trans-98.6-42.6-179.5-66.7-172000112.8L190 P191 E216 T218L157-L190 WeakPolarHBondContact O-CD1 3.33Å; L157-P191 HydrophobicContact CD2-CB 3.94Å; L157-P191 HydrophobicContact CD2-CG 4.5Å; L157-E216 PolarHBondContact N-O 3.36Å; L157-T218 WeakPolarHBondContact CD1-OG1 3.39Å
158K83.3Confident79.9Confident127 Ų12774.9 Ų74.955%0.55238%0.378SS*.EExtended strand (participates in β ladder)trans-138149.8179.1-56.7-163.8-162.3104.40110.4G215 E216K158-G215 CarbonylContact O-C 3.57Å; K158-G215 WeakPolarHBondContact O-CA 3.31Å; K158-E216 HydrophobicContact CB-CB 3.98Å; K158-E216 WeakPolarHBondContact CD-OE2 3.46Å; K158-E216 IonicContact NZ-OE2 2.67Å; K158-E216 PolarHBondContact NZ-OE2 3.49Å; K158-E216 PolarHBondContact O-N 3.22Å
159F85.2Confident81.9Confident50 Ų5072.9 Ų72.922%0.21937%0.369CS..EExtended strand (participates in β ladder)trans-129.6148.4171.469.9-99.3000110.4E161 K164 L167 V187 L190 G214F159-E161 HydrophobicContact CE2-CG 3.94Å; F159-K164 HydrophobicContact CE2-CD 4.39Å; F159-L167 HydrophobicContact CB-CD1 3.54Å; F159-V187 HydrophobicContact CB-CG1 4.41Å; F159-V187 HydrophobicContact CD1-CG1 3.76Å; F159-V187 WeakPolarHBondContact CD1-O 3.3Å; F159-V187 HydrophobicContact CD2-CG1 4.17Å; F159-V187 HydrophobicContact CE1-CG1 4.16Å; F159-V187 WeakPolarHBondContact CE1-O 3.23Å; F159-V187 HydrophobicContact CE2-CG1 4.46Å; F159-V187 HydrophobicContact CG-CG1 3.86Å; F159-V187 HydrophobicContact CZ-CG1 4.49Å; F159-L190 HydrophobicContact CD1-CD1 3.16Å; F159-L190 HydrophobicContact CD1-CD2 4.11Å; F159-L190 HydrophobicContact CD1-CG 3.67Å; F159-L190 HydrophobicContact CE1-CD1 3.56Å; F159-L190 HydrophobicContact CE1-CG 3.94Å; F159-L190 HydrophobicContact CG-CD1 4.18Å; F159-G214 CarbonylContact C-O 3.6Å
160D86.3Confident83.8Confident81 Ų8168 Ų6843%0.43335%0.348SS..  trans-82.9124.3167.9-67.3-37.6000110.5T162 K163 K164 G214D160-T162 PolarHBondContact O-N 2.84Å; D160-K163 PolarHBondContact O-N 3.23Å; D160-K164 PolarHBondContact O-N 3.37Å; D160-G214 PolarHBondContact N-O 2.9Å; D160-G214 WeakPolarHBondContact OD2-CA 3.33Å
161E84.6Confident85.2Confident165 Ų16562.2 Ų62.277%0.77131%0.313SS*.G310 helixtrans-57.9-34179.8-67.1-177.6175.700112.9F159 K163 K164F159-E161 HydrophobicContact CE2-CG 3.94Å; E161-K163 PolarHBondContact O-N 3Å; E161-K164 VanDerWaalsContact O-CB 3.31Å; E161-K164 WeakPolarHBondContact O-CB 3.36Å; E161-K164 PolarHBondContact O-N 3.42Å
162T87.2Confident86.4Confident132 Ų13264.6 Ų64.681%0.8132%0.318SS*.G310 helixtrans-62.6-30.1178.454.40000112.9D160D160-T162 PolarHBondContact O-N 2.84Å
163K87.6Confident86.8Confident83 Ų8365.9 Ų65.936%0.36134%0.338SS..G310 helixtrans-108.610.8-177.3-58.8-178.8-172.7170.60113.3D160 E161 I165 A166 L167 A212 L213D160-K163 PolarHBondContact O-N 3.23Å; E161-K163 PolarHBondContact O-N 3Å; K163-I165 VanDerWaalsContact C-N 3.25Å; K163-I165 PolarHBondContact O-N 3.25Å; K163-I165 VanDerWaalsContact O-N 3.15Å; K163-A166 WeakPolarHBondContact O-CB 3.43Å; K163-A166 PolarHBondContact O-N 2.79Å; K163-L167 PolarHBondContact O-N 2.93Å; K163-L167 VanDerWaalsContact O-N 3.08Å; K163-A212 PolarHBondContact NZ-O 3.32Å; K163-L213 WeakPolarHBondContact CB-O 3.44Å; K163-L213 WeakPolarHBondContact CD-O 3.34Å
164K87.9Confident87.1Confident54 Ų5466 Ų6624%0.23534%0.335CS..Hα-helixtrans-50.7-40.7178.2-175.6171.9-179.3176.70113.4F159 D160 E161 A166 L167 I168 V187 E188F159-K164 HydrophobicContact CE2-CD 4.39Å; D160-K164 PolarHBondContact O-N 3.37Å; E161-K164 VanDerWaalsContact O-CB 3.31Å; E161-K164 WeakPolarHBondContact O-CB 3.36Å; E161-K164 PolarHBondContact O-N 3.42Å; K164-A166 VanDerWaalsContact C-N 3.32Å; K164-A166 PolarHBondContact O-N 3.25Å; K164-L167 PolarHBondContact O-N 3.31Å; K164-I168 HydrophobicContact CG-CD1 3.98Å; K164-I168 WeakPolarHBondContact O-CD1 3.44Å; K164-I168 WeakPolarHBondContact O-CG1 3.44Å; K164-I168 PolarHBondContact O-N 3.35Å; K164-V187 HydrophobicContact CG-CG1 4.07Å; K164-E188 VanDerWaalsContact NZ-CG 3.35Å; K164-E188 IonicContact NZ-OE1 2.93Å; K164-E188 PolarHBondContact NZ-OE1 3.24Å
165I91.3Very high87.1Confident124 Ų12467.6 Ų67.664%0.63635%0.345SS*.Hα-helixtrans-64.1-38.3178.5-61.4173.3000111.5K163 K169K163-I165 VanDerWaalsContact C-N 3.25Å; K163-I165 PolarHBondContact O-N 3.25Å; K163-I165 VanDerWaalsContact O-N 3.15Å; I165-K169 WeakPolarHBondContact O-CG 3.01Å; I165-K169 PolarHBondContact O-N 2.89Å
166A91.3Very high87Confident36 Ų3669.7 Ų69.730%0.29837%0.365SS..Hα-helixtrans-72.9-40.3-17900000111K163 K164 I168 K169 E170 L213K163-A166 WeakPolarHBondContact O-CB 3.43Å; K163-A166 PolarHBondContact O-N 2.79Å; K164-A166 VanDerWaalsContact C-N 3.32Å; K164-A166 PolarHBondContact O-N 3.25Å; A166-I168 PolarHBondContact O-N 3.01Å; A166-K169 WeakPolarHBondContact O-CB 3.39Å; A166-K169 PolarHBondContact O-N 3.19Å; A166-E170 PolarHBondContact O-N 3.44Å; A166-E170 VanDerWaalsContact O-N 3.09Å; A166-L213 HydrophobicContact CB-CD2 3.84Å
167L89.8Confident87.2Confident2 Ų272.9 Ų72.91%0.0140%0.399CS..Hα-helixtrans-61.6-41.4172.4-69171.1000112.7F159 K163 K164 K169 E170 I171 L210 L213F159-L167 HydrophobicContact CB-CD1 3.54Å; K163-L167 PolarHBondContact O-N 2.93Å; K163-L167 VanDerWaalsContact O-N 3.08Å; K164-L167 PolarHBondContact O-N 3.31Å; L167-K169 VanDerWaalsContact C-N 3.26Å; L167-K169 PolarHBondContact O-N 3.46Å; L167-E170 PolarHBondContact O-N 2.86Å; L167-I171 WeakPolarHBondContact O-CD1 3.25Å; L167-I171 WeakPolarHBondContact O-CG1 3.41Å; L167-I171 PolarHBondContact O-N 3.22Å; L167-L210 HydrophobicContact CD2-CD2 4.2Å; L167-L213 HydrophobicContact CD2-CB 3.66Å; L167-L213 HydrophobicContact CG-CB 4.24Å
168I91.3Very high87.3Confident23 Ų2372 Ų7212%0.11839%0.394CS..Hα-helixtrans-61-36.4175.8-69.2163.6000111.3K164 A166 K172 A183 K184 V187K164-I168 HydrophobicContact CG-CD1 3.98Å; K164-I168 WeakPolarHBondContact O-CD1 3.44Å; K164-I168 WeakPolarHBondContact O-CG1 3.44Å; K164-I168 PolarHBondContact O-N 3.35Å; A166-I168 PolarHBondContact O-N 3.01Å; I168-K172 WeakPolarHBondContact O-CG 3.18Å; I168-K172 PolarHBondContact O-N 3.22Å; I168-A183 HydrophobicContact CG2-CB 4.05Å; I168-K184 HydrophobicContact CD1-CG 4.02Å; I168-V187 HydrophobicContact CG1-CG2 3.88Å
169K90.6Very high87.6Confident148 Ų14871.4 Ų71.464%0.64340%0.397SS*.Hα-helixtrans-67.8-43.4176.6-71.6175.5-179.21800111.3I165 A166 L167 K172 A173I165-K169 WeakPolarHBondContact O-CG 3.01Å; I165-K169 PolarHBondContact O-N 2.89Å; A166-K169 WeakPolarHBondContact O-CB 3.39Å; A166-K169 PolarHBondContact O-N 3.19Å; L167-K169 VanDerWaalsContact C-N 3.26Å; L167-K169 PolarHBondContact O-N 3.46Å; K169-K172 PolarHBondContact O-N 3.49Å; K169-A173 PolarHBondContact O-N 3.22Å
170E88.8Confident87.8Confident47 Ų4774.1 Ų74.122%0.2241%0.414CS..Hα-helixtrans-65.8-47.2179.1-160.862.4-15700111.7A166 L167 K172 A173 L174 L210 L213A166-E170 PolarHBondContact O-N 3.44Å; A166-E170 VanDerWaalsContact O-N 3.09Å; L167-E170 PolarHBondContact O-N 2.86Å; E170-K172 PolarHBondContact O-N 2.82Å; E170-A173 CarbonylContact O-C 3.48Å; E170-A173 WeakPolarHBondContact O-CA 3.42Å; E170-A173 WeakPolarHBondContact O-CB 3.34Å; E170-A173 PolarHBondContact O-N 3.27Å; E170-L174 HydrophobicContact CG-CD1 4.11Å; E170-L174 HydrophobicContact CG-CG 4.26Å; E170-L174 WeakPolarHBondContact O-CG 3.38Å; E170-L174 PolarHBondContact O-N 3.38Å; E170-L210 HydrophobicContact CB-CD2 4.49Å; E170-L210 HydrophobicContact CG-CD2 4.06Å; E170-L213 HydrophobicContact CB-CD1 3.56Å; E170-L213 HydrophobicContact CG-CD1 3.73Å
171I89.7Confident88Confident0 Ų074.6 Ų74.60%042%0.42CS..Hα-helixtrans-59.3-35.5178.9-71.7159.6000111.9L156 L167 A173 L174 V175 L178 F186 V187L156-I171 HydrophobicContact CD1-CD1 4Å; L156-I171 HydrophobicContact CD1-CG1 4.41Å; L167-I171 WeakPolarHBondContact O-CD1 3.25Å; L167-I171 WeakPolarHBondContact O-CG1 3.41Å; L167-I171 PolarHBondContact O-N 3.22Å; I171-A173 VanDerWaalsContact C-N 3.35Å; I171-L174 PolarHBondContact O-N 3.5Å; I171-V175 PolarHBondContact O-N 3.4Å; I171-L178 HydrophobicContact CG2-CD1 3.72Å; I171-F186 HydrophobicContact CD1-CD1 3.9Å; I171-F186 HydrophobicContact CD1-CE1 4.34Å; I171-F186 HydrophobicContact CG1-CD1 4.49Å; I171-F186 HydrophobicContact CG2-CD1 4.09Å; I171-F186 HydrophobicContact CG2-CG 4.41Å; I171-V187 HydrophobicContact CD1-CG2 3.25Å
172K89.6Confident88.3Confident88 Ų8871.2 Ų71.238%0.38340%0.404SS..Hα-helixtrans-68-32.2174.1-76.7-174.766.61750113.6I168 K169 E170 L180 A183I168-K172 WeakPolarHBondContact O-CG 3.18Å; I168-K172 PolarHBondContact O-N 3.22Å; K169-K172 PolarHBondContact O-N 3.49Å; E170-K172 PolarHBondContact O-N 2.82Å; K172-L180 HydrophobicContact CD-CD2 3.97Å; K172-A183 HydrophobicContact CD-CB 4.42Å; K172-A183 HydrophobicContact CG-CB 3.88Å
173A87.6Confident88.4Confident75 Ų7565 Ų6562%0.6237%0.365SS*.Hα-helixtrans-75.7-40.2174.100000110.8K169 E170 I171K169-A173 PolarHBondContact O-N 3.22Å; E170-A173 CarbonylContact O-C 3.48Å; E170-A173 WeakPolarHBondContact O-CA 3.42Å; E170-A173 WeakPolarHBondContact O-CB 3.34Å; E170-A173 PolarHBondContact O-N 3.27Å; I171-A173 VanDerWaalsContact C-N 3.35Å
174L84.9Confident88.6Confident22 Ų2266.5 Ų66.512%0.11537%0.372CS..Hα-helixtrans-68.9-47-179.6-67-178.6000111.8E170 I171 P176 V194 R195 L206 L210E170-L174 HydrophobicContact CG-CD1 4.11Å; E170-L174 HydrophobicContact CG-CG 4.26Å; E170-L174 WeakPolarHBondContact O-CG 3.38Å; E170-L174 PolarHBondContact O-N 3.38Å; I171-L174 PolarHBondContact O-N 3.5Å; L174-P176 WeakPolarHBondContact O-CD 3.24Å; L174-V194 HydrophobicContact CB-CG1 4.2Å; L174-V194 HydrophobicContact CD1-CG1 3.7Å; L174-R195 PolarHBondContact O-NE 3.46Å; L174-R195 PolarHBondContact O-NH2 3.45Å; L174-L206 HydrophobicContact CD1-CD2 4.38Å; L174-L206 HydrophobicContact CD2-CD1 4.38Å; L174-L206 HydrophobicContact CD2-CD2 3.45Å; L174-L206 VanDerWaalsContact CD2-CD2 3.45Å; L174-L210 HydrophobicContact CD1-CD1 4.42Å; L174-L210 HydrophobicContact CD1-CD2 4.26Å
175V83.5Confident88.7Confident35 Ų3569.7 Ų69.721%0.21239%0.386CS..SBendtrans-11393.8-179.7-173.30000110.1I171 G177 L178 V194I171-V175 PolarHBondContact O-N 3.4Å; V175-G177 PolarHBondContact O-N 2.93Å; V175-L178 HydrophobicContact CB-CD1 3.78Å; V175-L178 HydrophobicContact CB-CG 4.02Å; V175-L178 HydrophobicContact CG1-CD1 4.06Å; V175-L178 HydrophobicContact CG1-CG 3.88Å; V175-L178 HydrophobicContact CG2-CD1 4.42Å; V175-L178 PolarHBondContact O-N 2.89Å; V175-V194 WeakPolarHBondContact CG2-O 3.5Å
176P81.7Confident88.6Confident100 Ų10065.3 Ų65.365%0.64936%0.362SS*.THydrogen-bonded Turntrans-65.4131178.327.4-32.8000110L174 R195L174-P176 WeakPolarHBondContact O-CD 3.24Å; P176-R195 VanDerWaalsContact CD-NH2 3.3Å
177G85.6Confident88.4Confident74 Ų7463.7 Ų63.776%0.76335%0.349SS*.THydrogen-bonded Turntrans109.5-9.8-17700000114.7V175 N179V175-G177 PolarHBondContact O-N 2.93Å; G177-N179 PolarHBondContact O-N 3.1Å
178L85.8Confident88.4Confident45 Ų4569.3 Ų69.324%0.23638%0.375CS..  trans-73.7118.3170.3-66.4-176.4000111.2I171 V175 Q182I171-L178 HydrophobicContact CG2-CD1 3.72Å; V175-L178 HydrophobicContact CB-CD1 3.78Å; V175-L178 HydrophobicContact CB-CG 4.02Å; V175-L178 HydrophobicContact CG1-CD1 4.06Å; V175-L178 HydrophobicContact CG1-CG 3.88Å; V175-L178 HydrophobicContact CG2-CD1 4.42Å; V175-L178 PolarHBondContact O-N 2.89Å; L178-Q182 HydrophobicContact CD2-CB 4.19Å
179N89.4Confident88.1Confident115 Ų11570.4 Ų70.462%0.61539%0.385SS*.  trans-67158.3171.3-74.5-33.7000111.3G177 V181 Q182 A183G177-N179 PolarHBondContact O-N 3.1Å; N179-V181 PolarHBondContact O-N 3.25Å; N179-V181 VanDerWaalsContact O-N 3.1Å; N179-Q182 HydrophobicContact CB-CG 4.23Å; N179-Q182 WeakPolarHBondContact O-CA 3.45Å; N179-Q182 PolarHBondContact O-N 3.2Å; N179-A183 PolarHBondContact O-N 3Å
180L90.1Very high87.6Confident107 Ų10766 Ų6656%0.5637%0.368SS*.Hα-helixtrans-52.5-35.5176.6-74.3169.8000113.1K172 K184K172-L180 HydrophobicContact CD-CD2 3.97Å; L180-K184 WeakPolarHBondContact O-CG 3.14Å; L180-K184 PolarHBondContact O-N 3.48Å
181V90.8Very high87.4Confident92 Ų9268.2 Ų68.256%0.55839%0.387SS*.Hα-helixtrans-70.4-38.5177-178.70000111.3N179 K185N179-V181 PolarHBondContact O-N 3.25Å; N179-V181 VanDerWaalsContact O-N 3.1Å; V181-K185 WeakPolarHBondContact O-CG 3.39Å; V181-K185 PolarHBondContact O-N 3.06Å
182Q90.6Very high87.1Confident94 Ų9471.2 Ų71.244%0.43940%0.4SS..Hα-helixtrans-74.3-39.7-179.1-58.5-59.2-8.700111.7L178 N179 K184 K185 F186L178-Q182 HydrophobicContact CD2-CB 4.19Å; N179-Q182 HydrophobicContact CB-CG 4.23Å; N179-Q182 WeakPolarHBondContact O-CA 3.45Å; N179-Q182 PolarHBondContact O-N 3.2Å; Q182-K184 VanDerWaalsContact C-N 3.31Å; Q182-K184 PolarHBondContact O-N 3.22Å; Q182-K185 PolarHBondContact O-N 3.35Å; Q182-F186 WeakPolarHBondContact O-CB 3.41Å; Q182-F186 PolarHBondContact O-N 2.92Å
183A89.3Confident86.9Confident0 Ų069 Ų690%039%0.394CS..Hα-helixtrans-63-36.1177.100000112.7I168 K172 N179 F186 V187I168-A183 HydrophobicContact CG2-CB 4.05Å; K172-A183 HydrophobicContact CD-CB 4.42Å; K172-A183 HydrophobicContact CG-CB 3.88Å; N179-A183 PolarHBondContact O-N 3Å; A183-F186 PolarHBondContact O-N 3.15Å; A183-V187 PolarHBondContact O-N 3.08Å
184K90.7Very high86.6Confident116 Ų11665.8 Ų65.850%0.50437%0.367SS..Hα-helixtrans-65-46173.8-73.5177.5179.9-172.90111.9I168 L180 Q182 F186 V187 E188I168-K184 HydrophobicContact CD1-CG 4.02Å; L180-K184 WeakPolarHBondContact O-CG 3.14Å; L180-K184 PolarHBondContact O-N 3.48Å; Q182-K184 VanDerWaalsContact C-N 3.31Å; Q182-K184 PolarHBondContact O-N 3.22Å; K184-F186 VanDerWaalsContact C-N 3.34Å; K184-V187 PolarHBondContact O-N 3.09Å; K184-E188 WeakPolarHBondContact O-CG 3.37Å; K184-E188 PolarHBondContact O-N 3.19Å
185K91.1Very high86.2Confident120 Ų12069.4 Ų69.452%0.52238%0.379SS..Hα-helixtrans-60.3-45.6175.3-71.6-178.8177.3-171.30111.1V181 Q182 V187 E188 S189V181-K185 WeakPolarHBondContact O-CG 3.39Å; V181-K185 PolarHBondContact O-N 3.06Å; Q182-K185 PolarHBondContact O-N 3.35Å; K185-V187 VanDerWaalsContact C-N 3.35Å; K185-V187 PolarHBondContact O-N 3.44Å; K185-E188 CarbonylContact O-C 3.54Å; K185-E188 WeakPolarHBondContact O-CA 3.27Å; K185-E188 PolarHBondContact O-N 3.45Å; K185-S189 WeakPolarHBondContact O-CB 3.36Å; K185-S189 PolarHBondContact O-N 3.26Å; K185-S189 PolarHBondContact O-OG 3.3Å
186F87.7Confident86Confident32 Ų3273.8 Ų73.814%0.1440%0.397CS..Hα-helixtrans-55.8-45.6-178.9-167.2-80.9000112.6L156 I171 Q182 A183 K184 E188 S189 Q192 T193 V194L156-F186 HydrophobicContact CD1-CE1 4.4Å; I171-F186 HydrophobicContact CD1-CD1 3.9Å; I171-F186 HydrophobicContact CD1-CE1 4.34Å; I171-F186 HydrophobicContact CG1-CD1 4.49Å; I171-F186 HydrophobicContact CG2-CD1 4.09Å; I171-F186 HydrophobicContact CG2-CG 4.41Å; Q182-F186 WeakPolarHBondContact O-CB 3.41Å; Q182-F186 PolarHBondContact O-N 2.92Å; A183-F186 PolarHBondContact O-N 3.15Å; K184-F186 VanDerWaalsContact C-N 3.34Å; F186-E188 VanDerWaalsContact C-N 3.35Å; F186-S189 WeakPolarHBondContact CA-OG 3.41Å; F186-S189 PolarHBondContact O-N 2.67Å; F186-S189 PolarHBondContact O-OG 3.47Å; F186-Q192 HydrophobicContact CE1-CB 4.07Å; F186-Q192 HydrophobicContact CE2-CB 4.1Å; F186-Q192 VanDerWaalsContact CE2-OE1 3.26Å; F186-Q192 VanDerWaalsContact CG-OE1 3.32Å; F186-Q192 HydrophobicContact CZ-CB 3.76Å; F186-T193 WeakPolarHBondContact CZ-O 3.28Å; F186-V194 HydrophobicContact CE1-CG2 3.97Å; F186-V194 HydrophobicContact CZ-CG2 4.27Å
187V88.6Confident85.6Confident3 Ų374.1 Ų74.12%0.01839%0.394CS..Hα-helixtrans-68.8-33.5176.7179.30000111.8F159 K164 I168 I171 A183 K184 K185F159-V187 HydrophobicContact CB-CG1 4.41Å; F159-V187 HydrophobicContact CD1-CG1 3.76Å; F159-V187 WeakPolarHBondContact CD1-O 3.3Å; F159-V187 HydrophobicContact CD2-CG1 4.17Å; F159-V187 HydrophobicContact CE1-CG1 4.16Å; F159-V187 WeakPolarHBondContact CE1-O 3.23Å; F159-V187 HydrophobicContact CE2-CG1 4.46Å; F159-V187 HydrophobicContact CG-CG1 3.86Å; F159-V187 HydrophobicContact CZ-CG1 4.49Å; K164-V187 HydrophobicContact CG-CG1 4.07Å; I168-V187 HydrophobicContact CG1-CG2 3.88Å; I171-V187 HydrophobicContact CD1-CG2 3.25Å; A183-V187 PolarHBondContact O-N 3.08Å; K184-V187 PolarHBondContact O-N 3.09Å; K185-V187 VanDerWaalsContact C-N 3.35Å; K185-V187 PolarHBondContact O-N 3.44Å
188E89.3Confident85.1Confident119 Ų11971.4 Ų71.456%0.55636%0.361SS*.Hα-helixtrans-77.7-23.8178.5-69.9170.5-178.900113.4K164 K184 K185 F186 L190K164-E188 VanDerWaalsContact NZ-CG 3.35Å; K164-E188 IonicContact NZ-OE1 2.93Å; K164-E188 PolarHBondContact NZ-OE1 3.24Å; K184-E188 WeakPolarHBondContact O-CG 3.37Å; K184-E188 PolarHBondContact O-N 3.19Å; K185-E188 CarbonylContact O-C 3.54Å; K185-E188 WeakPolarHBondContact O-CA 3.27Å; K185-E188 PolarHBondContact O-N 3.45Å; F186-E188 VanDerWaalsContact C-N 3.35Å; E188-L190 PolarHBondContact O-N 3.23Å
189S83.8Confident84.9Confident47 Ų4770.6 Ų70.633%0.32936%0.364SS..SBendtrans-96.847.5-174.854.80000113.6K185 F186 Q192K185-S189 WeakPolarHBondContact O-CB 3.36Å; K185-S189 PolarHBondContact O-N 3.26Å; K185-S189 PolarHBondContact O-OG 3.3Å; F186-S189 WeakPolarHBondContact CA-OG 3.41Å; F186-S189 PolarHBondContact O-N 2.67Å; F186-S189 PolarHBondContact O-OG 3.47Å; S189-Q192 VanDerWaalsContact CB-NE2 3.33Å; S189-Q192 VanDerWaalsContact O-CD 3.3Å; S189-Q192 VanDerWaalsContact O-CG 3.23Å; S189-Q192 WeakPolarHBondContact O-CG 3.46Å; S189-Q192 PolarHBondContact O-NE2 3.32Å; S189-Q192 PolarHBondContact OG-NE2 3.48Å; S189-Q192 PolarHBondContact OG-OE1 3.33Å
190L80.3Confident84.5Confident54 Ų5470.4 Ų70.428%0.28336%0.36SS..  trans-66.2149175.8-61.5178.8000112L156 L157 F159 E188L156-L190 HydrophobicContact CB-CD2 4.06Å; L157-L190 WeakPolarHBondContact O-CD1 3.33Å; F159-L190 HydrophobicContact CD1-CD1 3.16Å; F159-L190 HydrophobicContact CD1-CD2 4.11Å; F159-L190 HydrophobicContact CD1-CG 3.67Å; F159-L190 HydrophobicContact CE1-CD1 3.56Å; F159-L190 HydrophobicContact CE1-CG 3.94Å; F159-L190 HydrophobicContact CG-CD1 4.18Å; E188-L190 PolarHBondContact O-N 3.23Å
191P85Confident84.2Confident95 Ų9569.2 Ų69.262%0.61736%0.359SS*.SBendcis-83.1135.5-4.8-12.330.2000113L156 L157L156-P191 WeakPolarHBondContact O-CA 3.4Å; L157-P191 HydrophobicContact CD2-CB 3.94Å; L157-P191 HydrophobicContact CD2-CG 4.5Å
192Q84.3Confident83.8Confident62 Ų6270.7 Ų70.729%0.2936%0.359SS..EExtended strand (participates in β ladder)trans-136.5146.1179-87.5-178.19.500113.9L156 F186 S189L156-Q192 PolarHBondContact N-O 3.38Å; L156-Q192 PolarHBondContact O-N 3.46Å; F186-Q192 HydrophobicContact CE1-CB 4.07Å; F186-Q192 HydrophobicContact CE2-CB 4.1Å; F186-Q192 VanDerWaalsContact CE2-OE1 3.26Å; F186-Q192 VanDerWaalsContact CG-OE1 3.32Å; F186-Q192 HydrophobicContact CZ-CB 3.76Å; S189-Q192 VanDerWaalsContact CB-NE2 3.33Å; S189-Q192 VanDerWaalsContact O-CD 3.3Å; S189-Q192 VanDerWaalsContact O-CG 3.23Å; S189-Q192 WeakPolarHBondContact O-CG 3.46Å; S189-Q192 PolarHBondContact O-NE2 3.32Å; S189-Q192 PolarHBondContact OG-NE2 3.48Å; S189-Q192 PolarHBondContact OG-OE1 3.33Å
193T84.4Confident83.4Confident42 Ų4266.2 Ų66.226%0.25834%0.339SS..EExtended strand (participates in β ladder)trans-82.1119.7177.6-41.30000110.7A153 K155 F186 E196A153-T193 HydrophobicContact CB-CG2 4Å; K155-T193 HydrophobicContact CG-CG2 4.12Å; F186-T193 WeakPolarHBondContact CZ-O 3.28Å; T193-E196 HydrophobicContact CG2-CG 3.45Å; T193-E196 VanDerWaalsContact CG2-CG 3.45Å
194V82.2Confident83.3Confident8 Ų870.7 Ų70.75%0.04836%0.36CS..EExtended strand (participates in β ladder)trans-80.9-46.4-177.6-178.60000111.3V154 L156 L174 V175 F186V154-V194 PolarHBondContact O-N 3.48Å; L156-V194 HydrophobicContact CB-CG2 4.26Å; L156-V194 HydrophobicContact CD1-CG2 3.25Å; L156-V194 HydrophobicContact CG-CG2 3.46Å; L156-V194 VanDerWaalsContact CG-CG2 3.46Å; L174-V194 HydrophobicContact CB-CG1 4.2Å; L174-V194 HydrophobicContact CD1-CG1 3.7Å; V175-V194 WeakPolarHBondContact CG2-O 3.5Å; F186-V194 HydrophobicContact CE1-CG2 3.97Å; F186-V194 HydrophobicContact CZ-CG2 4.27Å
195R75.8Confident83.2Confident98 Ų9871.4 Ų71.437%0.3736%0.363SS..EExtended strand (participates in β ladder)trans-147.4137.6178.1-76.4-62.4-162.9153.83109.7A153 V154 L174 P176 I198A153-R195 WeakPolarHBondContact CA-O 3.47Å; V154-R195 PolarHBondContact N-O 3Å; L174-R195 PolarHBondContact O-NE 3.46Å; L174-R195 PolarHBondContact O-NH2 3.45Å; P176-R195 VanDerWaalsContact CD-NH2 3.3Å; R195-I198 HydrophobicContact CB-CD1 3.27Å; R195-I198 HydrophobicContact CB-CG1 3.99Å; R195-I198 HydrophobicContact CG-CD1 3.89Å
196E78.8Confident83Confident126 Ų12666.7 Ų66.759%0.58934%0.343SS*.EExtended strand (participates in β ladder)trans-110.1155.7177.4-65.5176178.700108.7A153 T193A153-E196 HydrophobicContact CB-CG 4.32Å; T193-E196 HydrophobicContact CG2-CG 3.45Å; T193-E196 VanDerWaalsContact CG2-CG 3.45Å
197D73.8Confident83Confident107 Ų10769.6 Ų69.657%0.57236%0.355SS*.EExtended strand (participates in β ladder)trans62.538.6177.4-63-65.1000115.7S151 F152S151-D197 WeakPolarHBondContact CB-OD1 3.39Å; S151-D197 PolarHBondContact OG-OD1 2.82Å; F152-D197 PolarHBondContact O-N 3.29Å
198I75.3Confident83Confident17 Ų1775.9 Ų75.99%0.08739%0.385CS..EExtended strand (participates in β ladder)trans-92.7140.9175.9-63.2-170.1000110.9F152 R195 E202 A203 L206F152-I198 WeakPolarHBondContact CB-O 3.34Å; F152-I198 PolarHBondContact N-O 3.49Å; F152-I198 PolarHBondContact O-N 3.43Å; R195-I198 HydrophobicContact CB-CD1 3.27Å; R195-I198 HydrophobicContact CB-CG1 3.99Å; R195-I198 HydrophobicContact CG-CD1 3.89Å; I198-E202 HydrophobicContact CG2-CB 3.21Å; I198-E202 HydrophobicContact CG2-CG 4.46Å; I198-A203 HydrophobicContact CB-CB 4.49Å; I198-A203 HydrophobicContact CG2-CB 4.03Å; I198-A203 VanDerWaalsContact CG2-N 3.28Å; I198-L206 HydrophobicContact CD1-CD1 3.25Å; I198-L206 HydrophobicContact CD1-CG 4.46Å
199G82.7Confident82.9Confident29 Ų2974.6 Ų74.630%0.29938%0.379SS..  trans-68.6151.3172.700000112.5P201 E202 A203G199-P201 VanDerWaalsContact O-N 3.12Å; G199-E202 PolarHBondContact O-N 3.19Å; G199-A203 PolarHBondContact O-N 3.43Å
200E79.8Confident83.1Confident110 Ų11072.3 Ų72.351%0.51436%0.363SS..Hα-helixtrans-43.4-47.1-179.2-158.3178.3161.900115.5F152 E202 A203 Q204F152-E200 HydrophobicContact CD2-CB 4.18Å; F152-E200 HydrophobicContact CE2-CB 3.59Å; F152-E200 HydrophobicContact CE2-CG 3.87Å; F152-E200 HydrophobicContact CZ-CB 4.34Å; F152-E200 HydrophobicContact CZ-CG 4.14Å; E200-E202 PolarHBondContact O-N 3.42Å; E200-A203 PolarHBondContact O-N 3.32Å; E200-Q204 WeakPolarHBondContact O-CG 3.42Å; E200-Q204 PolarHBondContact O-N 3.46Å; E200-Q204 VanDerWaalsContact O-N 3.15Å
201P83.8Confident83.4Confident83 Ų8372.3 Ų72.354%0.53937%0.371SS..Hα-helixtrans-71.7-28.5-17829-36.5000113.5G199 K205G199-P201 VanDerWaalsContact O-N 3.12Å; P201-K205 VanDerWaalsContact O-CG 3.31Å; P201-K205 WeakPolarHBondContact O-CG 3.48Å; P201-K205 PolarHBondContact O-N 3.44Å
202E82.5Confident83.5Confident122 Ų12271.3 Ų71.357%0.5737%0.371SS*.Hα-helixtrans-78.9-38.8176.5-73.3179.8-17600110.5I198 G199 E200 Q204 K205 L206I198-E202 HydrophobicContact CG2-CB 3.21Å; I198-E202 HydrophobicContact CG2-CG 4.46Å; G199-E202 PolarHBondContact O-N 3.19Å; E200-E202 PolarHBondContact O-N 3.42Å; E202-Q204 VanDerWaalsContact C-N 3.32Å; E202-Q204 PolarHBondContact O-N 3.37Å; E202-K205 PolarHBondContact O-N 3.1Å; E202-L206 WeakPolarHBondContact O-CG 3.45Å; E202-L206 PolarHBondContact O-N 3.46Å
203A83Confident83.6Confident1 Ų170.4 Ų70.41%0.00837%0.367CS..Hα-helixtrans-62.1-39.7177.700000111.8F152 V154 I198 G199 E200 L206 K207 I219F152-A203 HydrophobicContact CB-CB 3.97Å; V154-A203 HydrophobicContact CG2-CB 4.2Å; I198-A203 HydrophobicContact CB-CB 4.49Å; I198-A203 HydrophobicContact CG2-CB 4.03Å; I198-A203 VanDerWaalsContact CG2-N 3.28Å; G199-A203 PolarHBondContact O-N 3.43Å; E200-A203 PolarHBondContact O-N 3.32Å; A203-L206 PolarHBondContact O-N 3.22Å; A203-K207 WeakPolarHBondContact O-CB 3.24Å; A203-K207 PolarHBondContact O-N 3.34Å; A203-I219 HydrophobicContact CB-CD1 4.3Å; A203-I219 HydrophobicContact CB-CG2 4.28Å
204Q87.4Confident83.5Confident94 Ų9468.8 Ų68.844%0.43936%0.359SS..Hα-helixtrans-65.3-45.5174.8-71175.710.800112.1E200 E202 L206 K207 E208E200-Q204 WeakPolarHBondContact O-CG 3.42Å; E200-Q204 PolarHBondContact O-N 3.46Å; E200-Q204 VanDerWaalsContact O-N 3.15Å; E202-Q204 VanDerWaalsContact C-N 3.32Å; E202-Q204 PolarHBondContact O-N 3.37Å; Q204-L206 VanDerWaalsContact C-N 3.34Å; Q204-L206 PolarHBondContact O-N 3.36Å; Q204-K207 PolarHBondContact O-N 3.49Å; Q204-E208 WeakPolarHBondContact O-CG 3.49Å; Q204-E208 PolarHBondContact O-N 3.41Å
205K88.7Confident83.7Confident131 Ų13168.6 Ų68.657%0.5736%0.358SS*.Hα-helixtrans-59.4-43.3175.6-73.1173.7-176.7178.90112.2P201 E202 E208 Q209P201-K205 VanDerWaalsContact O-CG 3.31Å; P201-K205 WeakPolarHBondContact O-CG 3.48Å; P201-K205 PolarHBondContact O-N 3.44Å; E202-K205 PolarHBondContact O-N 3.1Å; K205-E208 PolarHBondContact O-N 3.46Å; K205-Q209 VanDerWaalsContact O-CG 3.3Å; K205-Q209 WeakPolarHBondContact O-CG 3.07Å; K205-Q209 PolarHBondContact O-N 3.22Å
206L86.9Confident84.1Confident20 Ų2068.6 Ų68.611%0.10536%0.363CS..Hα-helixtrans-65.6-40.5176.9-68.9-167.1000112.2L174 I198 E202 A203 Q204 E208 Q209 L210L174-L206 HydrophobicContact CD1-CD2 4.38Å; L174-L206 HydrophobicContact CD2-CD1 4.38Å; L174-L206 HydrophobicContact CD2-CD2 3.45Å; L174-L206 VanDerWaalsContact CD2-CD2 3.45Å; I198-L206 HydrophobicContact CD1-CD1 3.25Å; I198-L206 HydrophobicContact CD1-CG 4.46Å; E202-L206 WeakPolarHBondContact O-CG 3.45Å; E202-L206 PolarHBondContact O-N 3.46Å; A203-L206 PolarHBondContact O-N 3.22Å; Q204-L206 VanDerWaalsContact C-N 3.34Å; Q204-L206 PolarHBondContact O-N 3.36Å; L206-E208 VanDerWaalsContact C-N 3.33Å; L206-E208 PolarHBondContact O-N 3.33Å; L206-Q209 PolarHBondContact O-N 3.32Å; L206-L210 WeakPolarHBondContact O-CB 3.37Å; L206-L210 VanDerWaalsContact O-CG 3.27Å; L206-L210 WeakPolarHBondContact O-CG 3.21Å; L206-L210 PolarHBondContact O-N 3.4Å
207K86.1Confident84.4Confident93 Ų9363 Ų6340%0.40434%0.338SS..Hα-helixtrans-61.3-42.5175.4177.1173.5-178178.20111.5A203 Q204 A211 C217 I219A203-K207 WeakPolarHBondContact O-CB 3.24Å; A203-K207 PolarHBondContact O-N 3.34Å; Q204-K207 PolarHBondContact O-N 3.49Å; K207-A211 WeakPolarHBondContact O-CB 3.42Å; K207-A211 PolarHBondContact O-N 3.36Å; K207-C217 WeakPolarHBondContact CE-O 3.45Å; K207-C217 HydrophobicContact CG-CB 4.21Å; K207-I219 HydrophobicContact CB-CD1 4.02Å; K207-I219 HydrophobicContact CB-CG1 4.4Å; K207-I219 HydrophobicContact CD-CD1 3.65Å; K207-I219 HydrophobicContact CD-CG1 3.98Å; K207-I219 HydrophobicContact CG-CD1 4.47Å
208E89.4Confident84.9Confident136 Ų13660.4 Ų60.464%0.63633%0.326SS*.Hα-helixtrans-64.6-44.5176.3-72.2175.7-177.200112.1Q204 K205 L206 A211 A212Q204-E208 WeakPolarHBondContact O-CG 3.49Å; Q204-E208 PolarHBondContact O-N 3.41Å; K205-E208 PolarHBondContact O-N 3.46Å; L206-E208 VanDerWaalsContact C-N 3.33Å; L206-E208 PolarHBondContact O-N 3.33Å; E208-A211 PolarHBondContact O-N 3.29Å; E208-A212 WeakPolarHBondContact O-CB 3.5Å; E208-A212 PolarHBondContact O-N 3.26Å
209Q87.9Confident85.2Confident91 Ų9162 Ų6243%0.42533%0.334SS..Hα-helixtrans-60.3-48.5176.1-74.2173.9-31.600111.5K205 L206 A212 L213K205-Q209 VanDerWaalsContact O-CG 3.3Å; K205-Q209 WeakPolarHBondContact O-CG 3.07Å; K205-Q209 PolarHBondContact O-N 3.22Å; L206-Q209 PolarHBondContact O-N 3.32Å; Q209-A212 PolarHBondContact O-N 3.25Å; Q209-L213 VanDerWaalsContact O-CG 3.24Å; Q209-L213 WeakPolarHBondContact O-CG 2.9Å; Q209-L213 PolarHBondContact O-N 3.31Å
210L87.7Confident85.1Confident0 Ų066.2 Ų66.20%035%0.346CS..Hα-helixtrans-68.8-36.7179.8-67.5169.2000112.1V154 L156 L167 E170 L174 L206 L213 G214 G215 C217V154-L210 HydrophobicContact CG1-CD1 4.09Å; L156-L210 HydrophobicContact CD2-CB 4.4Å; L156-L210 HydrophobicContact CD2-CD1 4.16Å; L156-L210 HydrophobicContact CD2-CD2 4.44Å; L156-L210 HydrophobicContact CG-CD1 4.49Å; L167-L210 HydrophobicContact CD2-CD2 4.2Å; E170-L210 HydrophobicContact CB-CD2 4.49Å; E170-L210 HydrophobicContact CG-CD2 4.06Å; L174-L210 HydrophobicContact CD1-CD1 4.42Å; L174-L210 HydrophobicContact CD1-CD2 4.26Å; L206-L210 WeakPolarHBondContact O-CB 3.37Å; L206-L210 VanDerWaalsContact O-CG 3.27Å; L206-L210 WeakPolarHBondContact O-CG 3.21Å; L206-L210 PolarHBondContact O-N 3.4Å; L210-L213 CarbonylContact O-C 3.56Å; L210-L213 PolarHBondContact O-N 3.44Å; L210-G214 PolarHBondContact O-N 3.24Å; L210-G215 WeakPolarHBondContact O-CA 2.98Å; L210-G215 PolarHBondContact O-N 3.27Å; L210-C217 WeakPolarHBondContact CB-SG 3.38Å; L210-C217 WeakPolarHBondContact CD1-SG 3.31Å
211A86.6Confident85.4Confident54 Ų5464 Ų6445%0.44634%0.337SS..Hα-helixtrans-65.9-40.517500000112.6K207 E208 L213 G214 G215K207-A211 WeakPolarHBondContact O-CB 3.42Å; K207-A211 PolarHBondContact O-N 3.36Å; E208-A211 PolarHBondContact O-N 3.29Å; A211-L213 PolarHBondContact O-N 3.35Å; A211-G214 PolarHBondContact O-N 3.45Å; A211-G215 WeakPolarHBondContact CA-O 3.12Å
212A87.6Confident85.5Confident74 Ų7463 Ų6361%0.61233%0.327SS*.Hα-helixtrans-58.8-37.8173.800000111.5K163 E208 Q209 G214K163-A212 PolarHBondContact NZ-O 3.32Å; E208-A212 WeakPolarHBondContact O-CB 3.5Å; E208-A212 PolarHBondContact O-N 3.26Å; Q209-A212 PolarHBondContact O-N 3.25Å; A212-G214 VanDerWaalsContact C-N 3.26Å; A212-G214 PolarHBondContact O-N 3.28Å
213L86.2Confident85.6Confident42 Ų4259.7 Ų59.722%0.2231%0.313CS..THydrogen-bonded Turntrans-80.14.2176.7-59.2175.6000114K163 A166 L167 E170 Q209 L210 A211K163-L213 WeakPolarHBondContact CB-O 3.44Å; K163-L213 WeakPolarHBondContact CD-O 3.34Å; A166-L213 HydrophobicContact CB-CD2 3.84Å; L167-L213 HydrophobicContact CD2-CB 3.66Å; L167-L213 HydrophobicContact CG-CB 4.24Å; E170-L213 HydrophobicContact CB-CD1 3.56Å; E170-L213 HydrophobicContact CG-CD1 3.73Å; Q209-L213 VanDerWaalsContact O-CG 3.24Å; Q209-L213 WeakPolarHBondContact O-CG 2.9Å; Q209-L213 PolarHBondContact O-N 3.31Å; L210-L213 CarbonylContact O-C 3.56Å; L210-L213 PolarHBondContact O-N 3.44Å; A211-L213 PolarHBondContact O-N 3.35Å
214G82.4Confident85.8Confident9 Ų963.2 Ų63.29%0.09333%0.331CS..THydrogen-bonded Turntrans81.624.8177.600000115.2F159 D160 L210 A211 A212F159-G214 CarbonylContact C-O 3.6Å; D160-G214 PolarHBondContact N-O 2.9Å; D160-G214 WeakPolarHBondContact OD2-CA 3.33Å; L210-G214 PolarHBondContact O-N 3.24Å; A211-G214 PolarHBondContact O-N 3.45Å; A212-G214 VanDerWaalsContact C-N 3.26Å; A212-G214 PolarHBondContact O-N 3.28Å
215G85.5Confident85.7Confident3 Ų361.3 Ų61.33%0.03132%0.324CS..EExtended strand (participates in β ladder)trans-100.3127.3169.500000111.4K158 L210 A211 C217K158-G215 CarbonylContact O-C 3.57Å; K158-G215 WeakPolarHBondContact O-CA 3.31Å; L210-G215 WeakPolarHBondContact O-CA 2.98Å; L210-G215 PolarHBondContact O-N 3.27Å; A211-G215 WeakPolarHBondContact CA-O 3.12Å; G215-C217 PolarHBondContact O-N 3.48Å
216E84.1Confident85.5Confident99 Ų9956.6 Ų56.646%0.46331%0.308SS..EExtended strand (participates in β ladder)trans-82.5109.9169.3-166.6176-166.200108.7L157 K158L157-E216 PolarHBondContact N-O 3.36Å; K158-E216 HydrophobicContact CB-CB 3.98Å; K158-E216 WeakPolarHBondContact CD-OE2 3.46Å; K158-E216 IonicContact NZ-OE2 2.67Å; K158-E216 PolarHBondContact NZ-OE2 3.49Å; K158-E216 PolarHBondContact O-N 3.22Å
217C84.4Confident85.4Confident9 Ų959.2 Ų59.26%0.06132%0.322CS..EExtended strand (participates in β ladder)trans-108.2134.4-179.6-52.90000112V154 K155 L156 K207 L210 G215V154-C217 HydrophobicContact CG1-CB 4.05Å; K155-C217 CarbonylContact O-C 3.57Å; K155-C217 VanDerWaalsContact O-CA 3.25Å; K155-C217 WeakPolarHBondContact O-CA 3.46Å; L156-C217 WeakPolarHBondContact CD2-SG 3.49Å; K207-C217 WeakPolarHBondContact CE-O 3.45Å; K207-C217 HydrophobicContact CG-CB 4.21Å; L210-C217 WeakPolarHBondContact CB-SG 3.38Å; L210-C217 WeakPolarHBondContact CD1-SG 3.31Å; G215-C217 PolarHBondContact O-N 3.48Å
218T84.9Confident85.3Confident52 Ų5256.6 Ų56.632%0.31932%0.316SS..EExtended strand (participates in β ladder)trans-106.5130.7168.9-620000109K155 L157 E220K155-T218 PolarHBondContact N-O 3.32Å; K155-T218 PolarHBondContact O-N 3.44Å; L157-T218 WeakPolarHBondContact CD1-OG1 3.39Å; T218-E220 HydrophobicContact CG2-CG 4.32Å
219I81.5Confident85Confident49 Ų4950 Ų5025%0.25129%0.289SS..EExtended strand (participates in β ladder)trans-93.7120.5173.3-59.1172.2000105.6F152 A203 K207F152-I219 HydrophobicContact CB-CG2 3.68Å; F152-I219 HydrophobicContact CD1-CG2 3.52Å; F152-I219 HydrophobicContact CE1-CG2 4.41Å; F152-I219 HydrophobicContact CG-CG2 3.84Å; A203-I219 HydrophobicContact CB-CD1 4.3Å; A203-I219 HydrophobicContact CB-CG2 4.28Å; K207-I219 HydrophobicContact CB-CD1 4.02Å; K207-I219 HydrophobicContact CB-CG1 4.4Å; K207-I219 HydrophobicContact CD-CD1 3.65Å; K207-I219 HydrophobicContact CD-CG1 3.98Å; K207-I219 HydrophobicContact CG-CD1 4.47Å
220E80.9Confident84.7Confident118 Ų11846.3 Ų46.355%0.55128%0.277SS*.  trans-110.70172.8-70.9-177.3-163.700112.1F152 A153 K155 T218F152-E220 CarbonylContact C-O 3.5Å; F152-E220 VanDerWaalsContact CA-O 3.22Å; F152-E220 WeakPolarHBondContact CA-O 3.5Å; A153-E220 PolarHBondContact N-O 3.47Å; A153-E220 PolarHBondContact O-N 3.22Å; K155-E220 WeakPolarHBondContact CD-OE1 3.39Å; K155-E220 VanDerWaalsContact CE-OE2 3.32Å; K155-E220 WeakPolarHBondContact CE-OE2 3.44Å; K155-E220 IonicContact NZ-OE1 2.65Å; K155-E220 PolarHBondContact NZ-OE1 3.21Å; K155-E220 IonicContact NZ-OE2 2.7Å; K155-E220 PolarHBondContact NZ-OE2 3.44Å; T218-E220 HydrophobicContact CG2-CG 4.32Å

Retrieved 220 of 220 residues in 102.8 ms (Link to these results)