A0A061IPZ7_CRIGR Loading...

Amphiregulin

AlphaFold DB , UniProt , Accession A0A061IPZ7, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Areg, Length 247 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.7Very low50.8Low248 Ų248146.1 Ų146.1100%1.22275%0.746SS**  0105.40-65.3175.5-17700107.5
2R41.3Very low52Low251 Ų251140.8 Ų140.895%0.94773%0.725SS**  trans-107.4115.6175.4-76.3-179.7177.4168.8-0.9106.6
3T43Very low52.7Low134 Ų134138.9 Ų138.982%0.82271%0.711SS**  trans-62.3133.8170.433.40000108.8L5T3-L5 PolarHBondContact O-N 3.1Å
4P51.1Low53.7Low123 Ų123133.4 Ų133.480%0.79969%0.692SS**  trans-72.2120.5174.429.2-29000107.6L6P4-L6 VanDerWaalsContact C-N 3.33Å; P4-L6 PolarHBondContact O-N 2.93Å
5L51.7Low54.4Low168 Ų168130.5 Ų130.588%0.8868%0.677SS**  trans-63.298168.7-117.3139.9000107T3 P7T3-L5 PolarHBondContact O-N 3.1Å; L5-P7 WeakPolarHBondContact O-CD 3.23Å
6L52.3Low55.2Low119 Ų119129.4 Ų129.462%0.62367%0.672SS**  trans-57.1119.1174.6-146.8144.6000106.8P4 R8 L10P4-L6 VanDerWaalsContact C-N 3.33Å; P4-L6 PolarHBondContact O-N 2.93Å; L6-R8 PolarHBondContact O-N 3.21Å; L6-R8 VanDerWaalsContact O-N 3.1Å; L6-L10 HydrophobicContact CD2-CB 4.48Å; L6-L10 HydrophobicContact CD2-CD1 4.09Å
7P55.6Low55.8Low72 Ų72129.2 Ų129.247%0.46867%0.671SS.*  trans-65.3121.1-168.720.8-28.7000108.6L5 A9 L10L5-P7 WeakPolarHBondContact O-CD 3.23Å; P7-A9 HydrophobicContact CB-CB 4.36Å; P7-A9 PolarHBondContact O-N 3.22Å; P7-L10 HydrophobicContact CG-CD1 3.81Å; P7-L10 HydrophobicContact CG-CG 4.04Å; P7-L10 PolarHBondContact O-N 3.42Å
8R57.3Low56.2Low214 Ų214127.3 Ų127.381%0.80866%0.661SS**Hα-helixtrans-45.5-24172.5-88.4176.7164.8160.6-5.5113L6 L10 L11 V12L6-R8 PolarHBondContact O-N 3.21Å; L6-R8 VanDerWaalsContact O-N 3.1Å; R8-L10 VanDerWaalsContact C-N 3.31Å; R8-L10 PolarHBondContact O-N 2.64Å; R8-L11 PolarHBondContact O-N 2.94Å; R8-V12 WeakPolarHBondContact O-CG2 3.28Å; R8-V12 PolarHBondContact O-N 3.26Å
9A52.6Low56.6Low60 Ų60127.2 Ų127.250%0.49666%0.661SS.*Hα-helixtrans-54.2-39.417100000113.6P7 V12 Q13P7-A9 HydrophobicContact CB-CB 4.36Å; P7-A9 PolarHBondContact O-N 3.22Å; A9-V12 PolarHBondContact O-N 3.47Å; A9-Q13 WeakPolarHBondContact O-CB 3.41Å; A9-Q13 PolarHBondContact O-N 3.15Å
10L56.7Low56.6Low94 Ų94122.6 Ų122.649%0.49265%0.646SS.*Hα-helixtrans-70.5-34.9-178.5-69.3171.9000112.8L6 P7 R8 S14L6-L10 HydrophobicContact CD2-CB 4.48Å; L6-L10 HydrophobicContact CD2-CD1 4.09Å; P7-L10 HydrophobicContact CG-CD1 3.81Å; P7-L10 HydrophobicContact CG-CG 4.04Å; P7-L10 PolarHBondContact O-N 3.42Å; R8-L10 VanDerWaalsContact C-N 3.31Å; R8-L10 PolarHBondContact O-N 2.64Å; L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.24Å; L10-S14 PolarHBondContact O-N 3.39Å
11L59.6Low56.5Low124 Ų124120.9 Ų120.965%0.64964%0.644SS**Hα-helixtrans-70.3-42.9175.9-68.7175.1000111.1R8 S14 L15R8-L11 PolarHBondContact O-N 2.94Å; L11-S14 PolarHBondContact O-N 3.06Å; L11-L15 WeakPolarHBondContact O-CB 3.4Å; L11-L15 PolarHBondContact O-N 2.95Å
12V65.7Low57Low82 Ų82112 Ų11250%0.49762%0.617SS.*Hα-helixtrans-65.5-42.1175.91750000110.5R8 A9 L15 L16R8-V12 WeakPolarHBondContact O-CG2 3.28Å; R8-V12 PolarHBondContact O-N 3.26Å; A9-V12 PolarHBondContact O-N 3.47Å; V12-L15 PolarHBondContact O-N 2.98Å; V12-L16 HydrophobicContact CG1-CD1 3.55Å; V12-L16 WeakPolarHBondContact O-CB 3.49Å; V12-L16 WeakPolarHBondContact O-CD1 3.32Å; V12-L16 PolarHBondContact O-N 3.37Å
13Q60.6Low57.2Low117 Ų117108 Ų10855%0.54761%0.608SS.*Hα-helixtrans-69.2-36.7179.5-163.8163.29.600112.1A9 L17A9-Q13 WeakPolarHBondContact O-CB 3.41Å; A9-Q13 PolarHBondContact O-N 3.15Å; Q13-L17 WeakPolarHBondContact O-CB 3.37Å; Q13-L17 WeakPolarHBondContact O-CD1 3.45Å; Q13-L17 WeakPolarHBondContact O-CG 3.38Å; Q13-L17 PolarHBondContact O-N 3.06Å
14S66.2Low57.2Low62 Ų62111.8 Ų111.843%0.43461%0.609SS.*Hα-helixtrans-63.6-43.6170.6-174.50000111.7L10 L11 L17 L18L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.24Å; L10-S14 PolarHBondContact O-N 3.39Å; L11-S14 PolarHBondContact O-N 3.06Å; S14-L17 PolarHBondContact O-N 3.33Å; S14-L18 WeakPolarHBondContact O-CD1 3.3Å; S14-L18 WeakPolarHBondContact O-CG 3.2Å; S14-L18 PolarHBondContact O-N 2.82Å
15L65.4Low56.9Low89 Ų89110.6 Ų110.647%0.46661%0.609SS.*Hα-helixtrans-64.3-41.9177.4-168.468.6000112.1L11 V12 L18 L19L11-L15 WeakPolarHBondContact O-CB 3.4Å; L11-L15 PolarHBondContact O-N 2.95Å; V12-L15 PolarHBondContact O-N 2.98Å; L15-L18 PolarHBondContact O-N 3.43Å; L15-L19 HydrophobicContact CD1-CD1 4.5Å; L15-L19 HydrophobicContact CG-CD1 4Å; L15-L19 WeakPolarHBondContact O-CD1 3.36Å; L15-L19 PolarHBondContact O-N 2.97Å
16L67.3Low56.3Low114 Ų114107.7 Ų107.760%0.59761%0.61SS**Hα-helixtrans-65.8-35.8174.5-95.7127.5000112.8V12 G20V12-L16 HydrophobicContact CG1-CD1 3.55Å; V12-L16 WeakPolarHBondContact O-CB 3.49Å; V12-L16 WeakPolarHBondContact O-CD1 3.32Å; V12-L16 PolarHBondContact O-N 3.37Å; L16-G20 WeakPolarHBondContact O-CA 3.44Å; L16-G20 PolarHBondContact O-N 3.28Å
17L65.6Low56Low126 Ų126105.5 Ų105.566%0.6662%0.616SS**Hα-helixtrans-68.3-38.1175-74.6166.3000111.8Q13 S14 S21Q13-L17 WeakPolarHBondContact O-CB 3.37Å; Q13-L17 WeakPolarHBondContact O-CD1 3.45Å; Q13-L17 WeakPolarHBondContact O-CG 3.38Å; Q13-L17 PolarHBondContact O-N 3.06Å; S14-L17 PolarHBondContact O-N 3.33Å; L17-S21 PolarHBondContact O-N 3.13Å
18L62Low55.1Low95 Ų95110 Ų11050%0.49764%0.635SS.*Hα-helixtrans-65.2-42.6174.8-77.1154.7000111.9S14 L15 S21S14-L18 WeakPolarHBondContact O-CD1 3.3Å; S14-L18 WeakPolarHBondContact O-CG 3.2Å; S14-L18 PolarHBondContact O-N 2.82Å; L15-L18 PolarHBondContact O-N 3.43Å; L18-S21 PolarHBondContact O-OG 3.33Å
19L63.8Low54.5Low124 Ų124107 Ų10765%0.64964%0.635SS**Hα-helixtrans-75.3-34177.5-74.5153000113L15L15-L19 HydrophobicContact CD1-CD1 4.5Å; L15-L19 HydrophobicContact CG-CD1 4Å; L15-L19 WeakPolarHBondContact O-CD1 3.36Å; L15-L19 PolarHBondContact O-N 2.97Å
20G56Low53.9Low36 Ų36112.1 Ų112.137%0.37165%0.654SS.*Hα-helixtrans-77-20.3-175.800000115.3L16 G22L16-G20 WeakPolarHBondContact O-CA 3.44Å; L16-G20 PolarHBondContact O-N 3.28Å; G20-G22 PolarHBondContact O-N 3.2Å
21S55.2Low53.2Low86 Ų86113.8 Ų113.860%0.60166%0.663SS**G310 helixtrans-73.2-7.8178.164.60000114.8L17 L18L17-S21 PolarHBondContact O-N 3.13Å; L18-S21 PolarHBondContact O-OG 3.33Å
22G48.9Very low52Low63 Ų63115.1 Ų115.165%0.64967%0.671SS**G310 helixtrans-81.6-8.8-179.400000116.2G20G20-G22 PolarHBondContact O-N 3.2Å
23H44.3Very low50.8Low167 Ų167116.8 Ų116.877%0.77368%0.681SS**G310 helixtrans-1004.2-172.2-74.9-70.4000115.8
24Y44.5Very low49.6Very low212 Ų212118 Ų11883%0.83170%0.696SS**SBendtrans-102.115.4-176-65.5-80.9000115.2
25A44.1Very low48.4Very low98 Ų98120.3 Ų120.381%0.8171%0.713SS**  trans-143.165178.300000112
26A39.4Very low46.8Very low108 Ų108119.5 Ų119.589%0.89373%0.726SS**  trans-137.680.1162.100000108.3
27G46Very low45.1Very low73 Ų73123.6 Ų123.675%0.75374%0.739SS**  trans-149.685.7171.400000107.6
28L35.9Very low43.7Very low166 Ų166125.1 Ų125.187%0.86975%0.746SS**  trans-150.798163.6-125.8160.3000107.8
29D45.8Very low42.5Very low151 Ų151125.8 Ų125.881%0.80776%0.756SS**  trans-46.7134163.7-83.7-74.9000110.9
30L39.5Very low41.3Very low168 Ų168124.5 Ų124.588%0.8876%0.763SS**  trans-135.186.3158.5-15778.2000108.4
31N42.2Very low40Very low129 Ų129132.7 Ų132.769%0.6979%0.789SS**  trans-86118.2152.7-175.922.3000106.2
32D32.8Very low39Very low152 Ų152133.7 Ų133.781%0.81380%0.796SS**  trans-159.1125.9139-97.8-34000111.2
33T41.4Very low38.1Very low116 Ų116133.6 Ų133.671%0.71280%0.796SS**  trans-69.4127172.1-66.20000109
34T35.8Very low37.5Very low142 Ų142133.8 Ų133.887%0.87180%0.796SS**  trans-149.4115.8147.2-74.70000111.1
35S39.7Very low37.2Very low112 Ų112129.9 Ų129.978%0.78379%0.786SS**  trans-51.3130.8171.6153.80000113.7
36G32.2Very low36.7Very low72 Ų72132.8 Ų132.874%0.74279%0.787SS**  trans-143.869.4173.900000113
37K31.2Very low36.6Very low199 Ų199132.2 Ų132.287%0.86578%0.782SS**  trans13.1105.1149.2-160171.2-173.6-179.70118.1
38I36.2Very low36.1Very low159 Ų159135.6 Ų135.682%0.81579%0.789SS**PPolyproline II helixtrans-96.1129.9159.6-58.4172.8000108.3
39P38.5Very low35.9Very low108 Ų108131 Ų13170%0.70178%0.782SS**PPolyproline II helixtrans-89.8120.4162.130.5-23.2000110.3
40A36.8Very low35.2Very low97 Ų97131.9 Ų131.980%0.80279%0.785SS**PPolyproline II helixtrans-70.8136.4162.500000109.5
41F30.5Very low34.8Very low209 Ų209129.5 Ų129.592%0.91778%0.778SS**  trans-125.4138.2164.4-118-87.2000110.2
42S33Very low34.2Very low106 Ų106129.5 Ų129.574%0.74178%0.782SS**  trans-95.3146.4-160.759.20000114.8
43G31.5Very low34.1Very low62 Ų62127.8 Ų127.864%0.63978%0.782SS**  trans28.8135144.900000122.8
44H31.5Very low33.8Very low170 Ų170126.9 Ų126.979%0.78779%0.787SS**  -170.7148101.2-102.765.9000112.1
45H36.7Very low33.6Very low131 Ų131123.6 Ų123.661%0.60678%0.78SS**  trans-75.8152.7175.512.9-82.2000110.6
46N33.9Very low33.4Very low158 Ų158123 Ų12385%0.84578%0.777SS**  trans-177.7134131.5-84.8-18.7000111.9
47A37.2Very low33.6Very low96 Ų96127.3 Ų127.379%0.79378%0.777SS**  trans-103134.4170.500000109.2
48T35.9Very low33.8Very low145 Ų145124 Ų12489%0.8977%0.773SS**  trans-164.1127.11585.60000109.1
49G32.8Very low33.6Very low70 Ų70121.4 Ų121.472%0.72277%0.77SS**  trans-93.9161.2170.400000112.3
50L29.4Very low33.1Very low168 Ų168121.5 Ų121.588%0.8877%0.768SS**  trans-177.3118141.9-137.378.6000111.7
51V32.8Very low32.9Very low118 Ų118124.4 Ų124.472%0.71577%0.769SS**  60.4113.8124.51750000122.8
52V28.8Very low33Very low130 Ų130118.6 Ų118.679%0.78875%0.754SS**  62.9125.2124.8-1760000121.9
53S30.5Very low32.9Very low115 Ų115122.2 Ų122.280%0.80476%0.759SS**  -174108.2122.9-156.80000108.3
54A34.3Very low33.2Very low98 Ų98127.2 Ų127.281%0.8177%0.768SS**  95.9131.46900000113.6
55G32Very low34Very low72 Ų72124.8 Ų124.874%0.74277%0.767SS**  trans135.771.6173.700000112.9
56S36.8Very low34.2Very low101 Ų101124.6 Ų124.671%0.70678%0.781SS**  62129.688-122.20000113.1
57E35.7Very low34.2Very low162 Ų162120.7 Ų120.776%0.75778%0.777SS**  cis-176.1144.43.848-153.7103.700111.6
58V35.7Very low34.6Very low129 Ų129121.4 Ų121.478%0.78278%0.777SS**  trans60.7117135.5157.60000121.1
59S31.3Very low34.6Very low105 Ų105123.9 Ų123.973%0.73478%0.778SS**  79.1140.776.6-1060000112.7
60T28.7Very low34.9Very low110 Ų110128.7 Ų128.768%0.67579%0.787SS**  cis178.7136.429.6-88.40000109.5
61I32.5Very low35.5Very low157 Ų157125.5 Ų125.581%0.80578%0.778SS**  trans52.5140.2138.2-80.8164.1000125.1
62S31.4Very low35.8Very low88 Ų88126.2 Ų126.262%0.61578%0.783SS**  trans104.8127.4138.4-125.60000122.7
63E32.6Very low36.4Very low182 Ų182123.3 Ų123.385%0.8578%0.78SS**  trans95.5131.7131.8-99.3160.9121.600122.4
64M37Very low36.8Very low167 Ų167125.2 Ų125.282%0.82378%0.78SS**  trans-87.9161.1174.6-122.4-71.1163.400110.5
65P48.5Very low37.2Very low118 Ų118130.9 Ų130.977%0.76678%0.782SS**  trans-139.3155.3133.433.9-17.8000115.7
66S41.2Very low38Very low128 Ų128134.5 Ų134.590%0.89579%0.785SS**  trans-72.8154.9179.9-179.30000114.7
67G33.5Very low38.2Very low75 Ų75140.8 Ų140.877%0.77380%0.795SS**  trans170.9120.5163.700000114.6
68S45.3Very low39.1Very low111 Ų111137.8 Ų137.878%0.77679%0.792SS**  trans-69.7156.1-17649.80000116.2
69E35.1Very low39.6Very low197 Ų197139.9 Ų139.992%0.92179%0.793SS**  -178.7156.8116.5-91.5-165.913900113.1
70L40.8Very low40.2Very low172 Ų172143.7 Ų143.790%0.90180%0.799SS**  trans-80.8150.3-166.7-130.596.2000113.8
71S41.6Very low41Very low101 Ų101148.1 Ų148.171%0.70681%0.805SS**  155.9142.5120.8-168.50000115.4
72T39.6Very low41.8Very low133 Ų133148 Ų14882%0.81681%0.806SS**  trans80.1117.7152.5-62.40000118.3
73G40.2Very low42.8Very low69 Ų69150.8 Ų150.871%0.71181%0.814SS**  trans-93.1-178.9-167.300000116
74D38.4Very low43.7Very low154 Ų154150.2 Ų150.282%0.82481%0.812SS**  trans-159.9150.7140.6-134-14000108.9
75Y42.4Very low44.4Very low217 Ų217147.5 Ų147.585%0.85181%0.806SS**  trans-92.9138.7-162.9-47.2-96000111.7
76D48.9Very low44.2Very low149 Ų149151.2 Ų151.280%0.79781%0.813SS**  trans-172.1107.7135.3-156.70.7000108.6
77Y42.6Very low44.3Very low232 Ų232153 Ų15391%0.9181%0.811SS**  trans-132.9113.4169.3-129.1-92.4000108.8
78S53.1Low44.9Very low100 Ų100155 Ų15570%0.69981%0.813SS**  trans-56.9132.7-179.8-49.50000111.2E80S78-E80 PolarHBondContact O-N 2.96Å; S78-E80 VanDerWaalsContact O-N 3.09Å
79E46.4Very low44.8Very low172 Ų172152.4 Ų152.480%0.80480%0.804SS**  trans-71.190.1174.855.8-145.1156.200111.5Y81E79-Y81 PolarHBondContact O-N 3.49Å
80E45.3Very low45.1Very low186 Ų186153.1 Ų153.187%0.86980%0.8SS**  trans-77.4112.7160.2-81.6-167.3162.600109.2S78 D82S78-E80 PolarHBondContact O-N 2.96Å; S78-E80 VanDerWaalsContact O-N 3.09Å; E80-D82 PolarHBondContact O-N 3Å
81Y44.3Very low45.7Very low202 Ų202151.1 Ų151.179%0.79280%0.795SS**  trans-6790.6173.1-100.8-102.2000110.6E79 N83E79-Y81 PolarHBondContact O-N 3.49Å; Y81-N83 PolarHBondContact O-N 3.09Å
82D49.5Very low46.1Very low156 Ų156151.5 Ų151.583%0.83479%0.788SS**  trans-70.3105158.7-95.1-33000109.2E80 E84E80-D82 PolarHBondContact O-N 3Å; D82-E84 VanDerWaalsContact C-N 3.29Å; D82-E84 PolarHBondContact O-N 3.34Å; D82-E84 VanDerWaalsContact O-N 3.1Å
83N52.4Low46.3Very low145 Ų145150.3 Ų150.378%0.77578%0.776SS**  trans-78.581.2166.2-81.1-96.2000108.8Y81Y81-N83 PolarHBondContact O-N 3.09Å
84E51Low46.9Very low171 Ų171154.2 Ų154.280%0.79978%0.781SS**  trans-87.1123.4165.7-167.7146.3115.200109.7D82 Q86D82-E84 VanDerWaalsContact C-N 3.29Å; D82-E84 PolarHBondContact O-N 3.34Å; D82-E84 VanDerWaalsContact O-N 3.1Å; E84-Q86 PolarHBondContact O-N 3.23Å
85P52.5Low47.6Very low110 Ų110150.8 Ų150.871%0.71477%0.769SS**  trans-69.2116.5173.6-11.325.8000109.3I87P85-I87 PolarHBondContact O-N 3.2Å
86Q43.5Very low48Very low195 Ų195146 Ų14691%0.91176%0.762SS**  trans-58.7107.7168.8-71.3-163.4-10.600109.9E84 S88E84-Q86 PolarHBondContact O-N 3.23Å; Q86-S88 PolarHBondContact O-N 2.98Å
87I43.9Very low48.4Very low167 Ų167150.4 Ų150.486%0.85677%0.767SS**  trans-67103.9167-66.5169.6000106.9P85 G89P85-I87 PolarHBondContact O-N 3.2Å; I87-G89 PolarHBondContact O-N 2.67Å
88S46Very low48.8Very low115 Ų115145.1 Ų145.180%0.80476%0.759SS**  trans-63.8116175.9-173.40000110.6Q86Q86-S88 PolarHBondContact O-N 2.98Å
89G42.9Very low48.8Very low58 Ų58148.8 Ų148.860%0.59877%0.765SS**  trans58.290.1141.300000117.4I87 V91I87-G89 PolarHBondContact O-N 2.67Å; G89-V91 PolarHBondContact O-N 3.04Å; G89-V91 VanDerWaalsContact O-N 3.14Å
90Y42.2Very low48.8Very low212 Ų212148.7 Ų148.783%0.83177%0.765SS**  trans-66.6103.6157.9-141.8-90.1000108.3I92Y90-I92 HydrophobicContact CD1-CD1 3.67Å; Y90-I92 HydrophobicContact CD1-CG1 3.64Å; Y90-I92 HydrophobicContact CE1-CD1 4.07Å; Y90-I92 HydrophobicContact CE1-CG1 3.86Å; Y90-I92 PolarHBondContact O-N 3.47Å
91V53.5Low48.8Very low130 Ų130146.2 Ų146.279%0.78876%0.762SS**  trans-85.995168.5-1780000107.5G89 D93G89-V91 PolarHBondContact O-N 3.04Å; G89-V91 VanDerWaalsContact O-N 3.14Å; V91-D93 PolarHBondContact O-N 2.92Å
92I49.8Very low49.4Very low109 Ų109143.9 Ų143.956%0.55976%0.762SS**  trans-7599.7158.9-71.6137000106.2Y90 D94Y90-I92 HydrophobicContact CD1-CD1 3.67Å; Y90-I92 HydrophobicContact CD1-CG1 3.64Å; Y90-I92 HydrophobicContact CE1-CD1 4.07Å; Y90-I92 HydrophobicContact CE1-CG1 3.86Å; Y90-I92 PolarHBondContact O-N 3.47Å; I92-D94 HydrophobicContact CG2-CB 4.34Å; I92-D94 WeakPolarHBondContact CG2-OD1 3.24Å; I92-D94 PolarHBondContact O-N 3.25Å
93D44.4Very low49.3Very low107 Ų107145.1 Ų145.157%0.57276%0.76SS**  trans-80.494.6162.8-177.851.2000107.8V91 S95V91-D93 PolarHBondContact O-N 2.92Å; D93-S95 PolarHBondContact O-N 3.44Å; D93-S95 WeakPolarHBondContact OD1-CB 3.24Å; D93-S95 PolarHBondContact OD1-OG 3.3Å; D93-S95 WeakPolarHBondContact OD2-CB 3.41Å
94D53Low48.8Very low152 Ų152144.1 Ų144.181%0.81376%0.761SS**THydrogen-bonded Turntrans-71.924.4176.7-93.6-28.6000113.3I92I92-D94 HydrophobicContact CG2-CB 4.34Å; I92-D94 WeakPolarHBondContact CG2-OD1 3.24Å; I92-D94 PolarHBondContact O-N 3.25Å
95S53Low48.7Very low81 Ų81144.8 Ų144.857%0.56676%0.762SS**THydrogen-bonded Turntrans-96.56-172.7-520000114.5D93 R97D93-S95 PolarHBondContact O-N 3.44Å; D93-S95 WeakPolarHBondContact OD1-CB 3.24Å; D93-S95 PolarHBondContact OD1-OG 3.3Å; D93-S95 WeakPolarHBondContact OD2-CB 3.41Å; S95-R97 VanDerWaalsContact C-N 3.27Å; S95-R97 PolarHBondContact O-N 2.89Å
96V50.5Low48.5Very low118 Ų118149.6 Ų149.672%0.71577%0.771SS**  trans-73.681.7176.2-173.80000110.4V98V96-V98 HydrophobicContact CG1-CG2 4Å; V96-V98 PolarHBondContact O-N 3.28Å
97R57.4Low48.2Very low240 Ų240147 Ų14791%0.90676%0.764SS**  trans-72.1103.2160.5-69-176.6-176.3-141.1-0.2108S95 E99S95-R97 VanDerWaalsContact C-N 3.27Å; S95-R97 PolarHBondContact O-N 2.89Å; R97-E99 PolarHBondContact O-N 2.98Å; R97-E99 VanDerWaalsContact O-N 3.12Å
98V49.4Very low48.4Very low122 Ų122148.4 Ų148.474%0.73976%0.764SS**  trans-7399.3167.6-1710000107.6V96 Q100V96-V98 HydrophobicContact CG1-CG2 4Å; V96-V98 PolarHBondContact O-N 3.28Å; V98-Q100 PolarHBondContact O-N 2.89Å
99E53Low48.1Very low177 Ų177148.6 Ų148.683%0.82776%0.76SS**  trans-69.3117.2164.7-167166.7165.900107.7R97 V101R97-E99 PolarHBondContact O-N 2.98Å; R97-E99 VanDerWaalsContact O-N 3.12Å; E99-V101 PolarHBondContact O-N 3.33Å; E99-V101 VanDerWaalsContact O-N 3.16Å
100Q48.1Very low47.8Very low169 Ų169154.9 Ų154.979%0.7977%0.774SS**  trans-61.7120.4-178.7-59.5-17910.800108.8V98 I102V98-Q100 PolarHBondContact O-N 2.89Å; Q100-I102 PolarHBondContact O-N 3.38Å
101V44.8Very low47.6Very low135 Ų135148.1 Ų148.182%0.81877%0.769SS**  trans-61.7100.2173.7172.10000108.7E99 K103E99-V101 PolarHBondContact O-N 3.33Å; E99-V101 VanDerWaalsContact O-N 3.16Å; V101-K103 PolarHBondContact O-N 2.96Å; V101-K103 VanDerWaalsContact O-N 3.14Å
102I57.2Low46.7Very low153 Ų153149.6 Ų149.679%0.78577%0.772SS**  trans-66.8110165.5-60170.8000106.2Q100 P104Q100-I102 PolarHBondContact O-N 3.38Å; I102-P104 WeakPolarHBondContact O-CD 3.27Å
103K47.8Very low46.4Very low181 Ų181155 Ų15579%0.78779%0.786SS**PPolyproline II helixtrans-53124.1170.8-72.1175.4179.6175.40108.7V101 K105V101-K103 PolarHBondContact O-N 2.96Å; V101-K103 VanDerWaalsContact O-N 3.14Å; K103-K105 PolarHBondContact O-N 3.43Å; K103-K105 VanDerWaalsContact O-N 3.15Å
104P41.8Very low46Very low124 Ų124156.9 Ų156.981%0.80580%0.801SS**PPolyproline II helixtrans-62.5121.3174.8-17.829.3000109.4I102I102-P104 WeakPolarHBondContact O-CD 3.27Å
105K48.1Very low45.4Very low186 Ų186154.4 Ų154.481%0.80980%0.796SS**PPolyproline II helixtrans-63.5135.9168.9-77.6-178.1176.8177.50109K103 N107K103-K105 PolarHBondContact O-N 3.43Å; K103-K105 VanDerWaalsContact O-N 3.15Å; K105-N107 WeakPolarHBondContact CB-OD1 3.25Å; K105-N107 PolarHBondContact O-N 2.87Å; K105-N107 PolarHBondContact O-OD1 3.5Å
106K48.5Very low44.7Very low211 Ų211158.3 Ų158.392%0.91781%0.81SS**  trans-68.4110.9171.5-67.1-180179.4177.60108.5
107N37.7Very low44.4Very low140 Ų140161.5 Ų161.575%0.74982%0.815SS**  trans-118117.9174.2-575.4000108.7K105K105-N107 WeakPolarHBondContact CB-OD1 3.25Å; K105-N107 PolarHBondContact O-N 2.87Å; K105-N107 PolarHBondContact O-OD1 3.5Å
108K46.2Very low43.8Very low197 Ų197156.4 Ų156.486%0.85781%0.812SS**  trans-86.4142.4166.8-69-178.7176179.70108.8
109T40.5Very low43.4Very low119 Ų119160 Ų16073%0.7382%0.818SS**  trans79.8133.5148.2-50.20000119.6
110E37.8Very low42.9Very low189 Ų189163.5 Ų163.588%0.88382%0.824SS**  trans62.3135.1162.3-81172.5158.600117.7
111G37.3Very low42.5Very low71 Ų71165 Ų16573%0.73283%0.828SS**  cis178.2-167.14.600000109.3
112D33.7Very low42.3Very low161 Ų161167.7 Ų167.786%0.86183%0.828SS**  trans96.2135.8161.9-143.915.2000119.6
113R43.1Very low41.3Very low223 Ų223169.5 Ų169.584%0.84283%0.83SS**  trans-79.8149.9-167.9-60.5165.5170.2161.1-1.6108.8
114T37.5Very low40.7Very low145 Ų145164.8 Ų164.889%0.8983%0.833SS**  trans-159.6128.2132.818.60000109.4
115S39.8Very low40.7Very low101 Ų101164.2 Ų164.271%0.70683%0.832SS**  trans-57.6135.5172.642.70000112
116D37.8Very low40.4Very low163 Ų163165.2 Ų165.287%0.87284%0.837SS**  -158.1124.9123-96.9-38.3000112.1
117K44.7Very low40.2Very low185 Ų185161 Ų16180%0.80483%0.834SS**  trans-98.4154.2165.8-102176-179.41660106.6
118P45Very low40.3Very low132 Ų132157.9 Ų157.986%0.85784%0.835SS**  -130.4159106.116.72.3000115.3
119K40.1Very low40.3Very low197 Ų197159 Ų15986%0.85784%0.84SS**  trans-63.3142-174.7-61.4156.9176.1172.30113.3
120R42.6Very low40.5Very low251 Ų251156.6 Ų156.695%0.94784%0.838SS**  -160.9123.9126.4-127.6170.8163.5142.1-4.5111.5
121K41.1Very low40.9Very low202 Ų202158.7 Ų158.788%0.87884%0.838SS**  trans-119.1156.4170.3-93.7-157.2177.6-173.90109.9
122K40.8Very low41.3Very low190 Ų190167.3 Ų167.383%0.82685%0.849SS**  trans81.1138.9165.1-88.9-179.6176.6175.50115.6
123K35.7Very low42Very low191 Ų191166.9 Ų166.983%0.8385%0.846SS**  cis-166130.9-0.2-158.4179.4-177.9-169.90105.2
124G34.3Very low42.3Very low82 Ų82165.6 Ų165.685%0.84585%0.847SS**  trans-149.589.5175.900000110
125S42.1Very low43.1Very low113 Ų113168.5 Ų168.579%0.7985%0.847SS**  trans-73.5126.1170.551.30000110
126K43.1Very low43.8Very low206 Ų206172.5 Ų172.590%0.89685%0.852SS**  trans-163.1124.6137-111.1166.2-175.7175.20110.7G128K126-G128 PolarHBondContact O-N 2.94Å
127S44.3Very low44.9Very low123 Ų123173.1 Ų173.186%0.8685%0.847SS**  trans-57119.4176.6500000112.1
128G38.1Very low45.8Very low74 Ų74172.2 Ų172.276%0.76384%0.843SS**  trans-117.696.2163.200000109.6K126 G130K126-G128 PolarHBondContact O-N 2.94Å; G128-G130 PolarHBondContact O-N 3.47Å
129K47.7Very low46.9Very low221 Ų221170.7 Ų170.796%0.96183%0.827SS**  trans-57122.7160.2-103.3176.4174175.10107.2
130G44.3Very low48.7Very low68 Ų68162.5 Ų162.570%0.70179%0.794SS**  trans177.387.6174.300000115.3G128G128-G130 PolarHBondContact O-N 3.47Å
131R46.3Very low50.4Low233 Ų233151.2 Ų151.288%0.87975%0.753SS**  trans68.8104.5154.9-61.1177.4173165.8-2.1115.3N133R131-N133 VanDerWaalsContact C-N 3.34Å; R131-N133 PolarHBondContact O-N 3.21Å
132R46.2Very low51.9Low253 Ų253146.6 Ų146.696%0.95574%0.739SS**  trans-48.3101.6158.2-71.5175.5176.2162.2-2.2107.7K134R132-K134 PolarHBondContact O-N 2.85Å
133N46.9Very low53.5Low151 Ų151140.6 Ų140.681%0.80772%0.718SS**  trans-56.2107.5168.3-76.8-31.2000106.4R131 K135R131-N133 VanDerWaalsContact C-N 3.34Å; R131-N133 PolarHBondContact O-N 3.21Å; N133-K135 PolarHBondContact O-N 2.91Å
134K49.7Very low55.3Low197 Ų197137.7 Ų137.786%0.85771%0.711SS**  trans-43.8112.5152.8-101.7177.5173.2176.80103.9R132 K136R132-K134 PolarHBondContact O-N 2.85Å; K134-K136 PolarHBondContact O-N 3.11Å
135K53.7Low57.1Low206 Ų206137.5 Ų137.590%0.89669%0.687SS**  trans-56.787.3162.2-86179.7174.3178.70104.7N133 K137N133-K135 PolarHBondContact O-N 2.91Å; K135-K137 PolarHBondContact O-N 3.36Å
136K55.9Low58.5Low185 Ų185138.6 Ų138.680%0.80468%0.68SS**  trans-52.1114.8158.2-85.2-173173.4-172.30102.3K134 K138K134-K136 PolarHBondContact O-N 3.11Å; K136-K138 PolarHBondContact O-N 3.3Å
137K59.5Low60.2Low176 Ų176135.4 Ų135.477%0.76567%0.673SS**  trans-45.4111.6168.8-70.3179177-179.20104.2K135 N139K135-K137 PolarHBondContact O-N 3.36Å; K137-N139 PolarHBondContact O-N 3.21Å
138K64.7Low62.1Low166 Ų166131.2 Ų131.272%0.72264%0.639SS**  trans-60.1126.1178.7-70.7-175.1176.5-171.90104.7K136 T143K136-K138 PolarHBondContact O-N 3.3Å; K138-T143 HydrophobicContact CB-CG2 3.73Å; K138-T143 HydrophobicContact CD-CG2 3.98Å
139N68.8Low64.5Low99 Ų99128.5 Ų128.553%0.52961%0.608SS.*  trans-57.7135178.8-69.7-20.3000106.9K137 C141 D142K137-N139 PolarHBondContact O-N 3.21Å; N139-C141 PolarHBondContact O-N 3.41Å; N139-C141 VanDerWaalsContact O-N 3.11Å; N139-D142 PolarHBondContact O-N 3.47Å
140P76.3Confident66.5Low26 Ų26123.1 Ų123.117%0.16959%0.589CS.*G310 helixtrans-63.1-20-177.724.6-33.1000112.5D142 T143 N144 F145 Y156P140-D142 VanDerWaalsContact C-N 3.28Å; P140-D142 PolarHBondContact O-N 2.82Å; P140-T143 PolarHBondContact O-N 3.34Å; P140-N144 PolarHBondContact O-N 2.96Å; P140-F145 HydrophobicContact CB-CD2 4.4Å; P140-F145 PolarHBondContact O-N 2.89Å; P140-Y156 HydrophobicContact CB-CD2 4.46Å; P140-Y156 HydrophobicContact CG-CD1 3.39Å; P140-Y156 HydrophobicContact CG-CD2 3.33Å; P140-Y156 HydrophobicContact CG-CE1 3.69Å; P140-Y156 HydrophobicContact CG-CE2 3.64Å; P140-Y156 HydrophobicContact CG-CG 3.18Å
141C78.3Confident68.5Low13 Ų13123.3 Ų123.39%0.08857%0.571CS.*G310 helixtrans-55.3-38166-76.30000113.4N139 F145 Q146 C154N139-C141 PolarHBondContact O-N 3.41Å; N139-C141 VanDerWaalsContact O-N 3.11Å; C141-F145 CarbonylContact O-C 3.54Å; C141-Q146 PolarHBondContact O-N 3.44Å; C141-C154 VanDerWaalsContact CA-SG 3.56Å; C141-C154 HydrophobicContact CB-CB 3.71Å; C141-C154 WeakPolarHBondContact CB-SG 3.47Å; C141-C154 WeakPolarHBondContact SG-CB 3.45Å; C141-C154 PolarHBondContact SG-O 2.88Å; C141-C154 VanDerWaalsContact SG-O 3.34Å; C141-C154 CovalentContact SG-SG 2.05Å; C141-C154 PolarHBondContact SG-SG 2.8Å
142D73.5Confident70.5Confident106 Ų106113.4 Ų113.457%0.56754%0.542SS*.G310 helixtrans-85.9-8.9-177.4-57.6-35.7000113.1N139 P140N139-D142 PolarHBondContact O-N 3.47Å; P140-D142 VanDerWaalsContact C-N 3.28Å; P140-D142 PolarHBondContact O-N 2.82Å
143T74.1Confident72.5Confident63 Ų63107.9 Ų107.939%0.38753%0.527SS..THydrogen-bonded Turntrans-116.9-58.1-174.463.90000113.4K138 P140K138-T143 HydrophobicContact CB-CG2 3.73Å; K138-T143 HydrophobicContact CD-CG2 3.98Å; P140-T143 PolarHBondContact O-N 3.34Å
144N72.8Confident74.4Confident130 Ų130102.7 Ų102.770%0.69550%0.502SS*.THydrogen-bonded Turntrans-105.3-22.8-170.5-63.9-40.5000112.7P140P140-N144 PolarHBondContact O-N 2.96Å
145F73.7Confident76.1Confident79 Ų7995.4 Ų95.435%0.34647%0.474SS..SBendtrans-115.625.5-176.4-61-87.3000112P140 C141 N147 F148 V162P140-F145 HydrophobicContact CB-CD2 4.4Å; P140-F145 PolarHBondContact O-N 2.89Å; C141-F145 CarbonylContact O-C 3.54Å; F145-N147 PolarHBondContact O-N 3.49Å; F145-F148 HydrophobicContact CB-CB 3.95Å; F145-F148 HydrophobicContact CD1-CB 4.4Å; F145-F148 HydrophobicContact CD1-CD2 4.23Å; F145-F148 HydrophobicContact CD1-CG 4.32Å; F145-F148 VanDerWaalsContact O-CB 3.28Å; F145-F148 WeakPolarHBondContact O-CB 3.41Å; F145-F148 PolarHBondContact O-N 3.29Å; F145-V162 HydrophobicContact CB-CG1 4.16Å; F145-V162 HydrophobicContact CB-CG2 4.42Å; F145-V162 HydrophobicContact CD1-CB 4.23Å; F145-V162 HydrophobicContact CD1-CG1 4.35Å; F145-V162 HydrophobicContact CD1-CG2 4.18Å; F145-V162 HydrophobicContact CD2-CB 4.44Å; F145-V162 HydrophobicContact CD2-CG2 3.55Å; F145-V162 HydrophobicContact CE1-CB 4.43Å; F145-V162 HydrophobicContact CE1-CG2 4.31Å; F145-V162 HydrophobicContact CE2-CG2 3.69Å; F145-V162 HydrophobicContact CG-CB 4.22Å; F145-V162 HydrophobicContact CG-CG1 4.17Å; F145-V162 HydrophobicContact CG-CG2 3.79Å; F145-V162 HydrophobicContact CZ-CG2 4.07Å
146Q71Confident77.5Confident136 Ų13690.5 Ų90.564%0.63645%0.45SS*.THydrogen-bonded Turntrans-60.8124.8173.1-166167.146.600108.1C141 F148C141-Q146 PolarHBondContact O-N 3.44Å; Q146-F148 VanDerWaalsContact C-N 3.32Å; Q146-F148 PolarHBondContact O-N 2.86Å
147N77.9Confident78.6Confident138 Ų13885.1 Ų85.174%0.73843%0.43SS*.THydrogen-bonded Turntrans68.419.6-174.4-39.5-47.6000115.3F145F145-N147 PolarHBondContact O-N 3.49Å
148F84.4Confident78.9Confident36 Ų3683 Ų8316%0.15842%0.422CS..SBendtrans-66.1-42.7170.5178.5-98000111.3F145 Q146 V162 C164 R174F145-F148 HydrophobicContact CB-CB 3.95Å; F145-F148 HydrophobicContact CD1-CB 4.4Å; F145-F148 HydrophobicContact CD1-CD2 4.23Å; F145-F148 HydrophobicContact CD1-CG 4.32Å; F145-F148 VanDerWaalsContact O-CB 3.28Å; F145-F148 WeakPolarHBondContact O-CB 3.41Å; F145-F148 PolarHBondContact O-N 3.29Å; Q146-F148 VanDerWaalsContact C-N 3.32Å; Q146-F148 PolarHBondContact O-N 2.86Å; F148-V162 HydrophobicContact CD1-CG1 4.07Å; F148-V162 HydrophobicContact CE1-CG1 4.47Å; F148-C164 WeakPolarHBondContact CD1-SG 3.24Å; F148-C164 VanDerWaalsContact CE1-SG 3.53Å; F148-R174 HydrophobicContact CD1-CG 4.5Å; F148-R174 HydrophobicContact CD2-CG 4.39Å; F148-R174 VanDerWaalsContact CD2-NH1 3.3Å; F148-R174 HydrophobicContact CE1-CG 4.08Å; F148-R174 HydrophobicContact CE2-CG 4Å; F148-R174 VanDerWaalsContact CE2-NE 3.33Å; F148-R174 VanDerWaalsContact CE2-NH2 3.29Å; F148-R174 HydrophobicContact CZ-CG 3.8Å; F148-R174 WeakPolarHBondContact O-CB 3.09Å; F148-R174 WeakPolarHBondContact O-CG 3.41Å
149C88.8Confident78.6Confident16 Ų1682.5 Ų82.511%0.10843%0.428CS..  trans-90.5126.6171.8-46.80000109.5C164C149-C164 WeakPolarHBondContact CA-SG 3.31Å; C149-C164 HydrophobicContact CB-CB 3.76Å; C149-C164 WeakPolarHBondContact CB-SG 3.44Å; C149-C164 WeakPolarHBondContact SG-CA 3.4Å; C149-C164 WeakPolarHBondContact SG-CB 3.33Å; C149-C164 CovalentContact SG-SG 2.02Å; C149-C164 PolarHBondContact SG-SG 3.18Å
150I89Confident78.3Confident109 Ų10984.1 Ų84.156%0.55944%0.436SS*.SBendtrans-85.5-55.2-178.8-54.6171.7000109.8R174I150-R174 PolarHBondContact N-O 3Å
151H87.8Confident78.1Confident71 Ų7186.1 Ų86.133%0.32945%0.454SS..SBendtrans-120.675.5179.8-64.7-69.1000111.1C166 D167 Y170 C175H151-C166 WeakPolarHBondContact O-CA 3.45Å; H151-D167 PolarHBondContact O-N 3.36Å; H151-Y170 HydrophobicContact CB-CD1 3.65Å; H151-Y170 HydrophobicContact CB-CD2 3.71Å; H151-Y170 HydrophobicContact CB-CE1 3.98Å; H151-Y170 HydrophobicContact CB-CE2 4.04Å; H151-Y170 HydrophobicContact CB-CG 3.49Å; H151-Y170 VanDerWaalsContact CB-CG 3.49Å; H151-Y170 AromaticContact CD2-CD1 3.41Å; H151-Y170 VanDerWaalsContact CD2-CD1 3.41Å; H151-Y170 WeakPolarHBondContact CD2-CD1 3.35Å; H151-Y170 AromaticContact CD2-CE1 3.08Å; H151-Y170 WeakPolarHBondContact CD2-CE1 3.4Å; H151-Y170 AromaticContact CD2-CZ 3.64Å; H151-Y170 AromaticContact CE1-CZ 3.98Å; H151-Y170 AromaticContact CG-CD1 3.66Å; H151-Y170 AromaticContact CG-CE1 3.47Å; H151-Y170 VanDerWaalsContact CG-CE1 3.47Å; H151-Y170 AromaticContact CG-CE2 3.97Å; H151-Y170 AromaticContact CG-CG 3.96Å; H151-Y170 AromaticContact CG-CZ 3.62Å; H151-Y170 AromaticContact ND1-CZ 3.85Å; H151-Y170 AromaticContact NE2-CE1 3.56Å; H151-Y170 AromaticContact NE2-CZ 3.86Å; H151-C175 HydrophobicContact CB-CB 4.3Å; H151-C175 WeakPolarHBondContact O-CB 3.32Å
152G87Confident78.3Confident25 Ų2586.3 Ų86.326%0.25846%0.455SS..EExtended strand (participates in β ladder)trans161.3-173177.700000114.2K165G152-K165 CarbonylContact C-O 3.44Å; G152-K165 WeakPolarHBondContact CA-O 3.29Å
153E88.5Confident78.8Confident137 Ų13784.2 Ų84.264%0.6445%0.446SS*.EExtended strand (participates in β ladder)trans-97.4133.6-176.8-64-174.416700112.1K165E153-K165 HydrophobicContact CB-CB 4.48Å; E153-K165 PolarHBondContact N-O 3.32Å; E153-K165 PolarHBondContact O-N 2.86Å
154C87.4Confident79.5Confident43 Ų4382.3 Ų82.329%0.29144%0.435SS..EExtended strand (participates in β ladder)trans-79.4122.8173.1-178.70000110.7C141 V162C141-C154 VanDerWaalsContact CA-SG 3.56Å; C141-C154 HydrophobicContact CB-CB 3.71Å; C141-C154 WeakPolarHBondContact CB-SG 3.47Å; C141-C154 WeakPolarHBondContact SG-CB 3.45Å; C141-C154 PolarHBondContact SG-O 2.88Å; C141-C154 VanDerWaalsContact SG-O 3.34Å; C141-C154 CovalentContact SG-SG 2.05Å; C141-C154 PolarHBondContact SG-SG 2.8Å; C154-V162 WeakPolarHBondContact SG-CG1 3.41Å
155V85.6Confident80.3Confident44 Ų4482.6 Ų82.627%0.26743%0.43SS..EExtended strand (participates in β ladder)trans-115.8123.3176-176.50000109.1I157 T163 K165V155-I157 HydrophobicContact CG1-CG1 4.35Å; V155-T163 PolarHBondContact N-O 3.02Å; V155-T163 PolarHBondContact O-N 2.86Å; V155-K165 HydrophobicContact CG2-CD 3.92Å; V155-K165 HydrophobicContact CG2-CG 3.94Å
156Y81.9Confident81.1Confident102 Ų10281 Ų8140%0.443%0.428SS..EExtended strand (participates in β ladder)trans-96.3119.9170.9178.1-115.7000110.1P140 E158 V162P140-Y156 HydrophobicContact CB-CD2 4.46Å; P140-Y156 HydrophobicContact CG-CD1 3.39Å; P140-Y156 HydrophobicContact CG-CD2 3.33Å; P140-Y156 HydrophobicContact CG-CE1 3.69Å; P140-Y156 HydrophobicContact CG-CE2 3.64Å; P140-Y156 HydrophobicContact CG-CG 3.18Å; Y156-E158 HydrophobicContact CD1-CG 4.32Å; Y156-E158 HydrophobicContact CE1-CG 3.87Å; Y156-V162 HydrophobicContact CD2-CG2 3.74Å; Y156-V162 HydrophobicContact CE2-CG2 4.49Å
157I79.4Confident81.8Confident72 Ų7278.5 Ų78.537%0.36942%0.42SS..EExtended strand (participates in β ladder)trans-98.8116.1173.1-54.2173.6000107V155 N159 L160 A161 T163V155-I157 HydrophobicContact CG1-CG1 4.35Å; I157-N159 PolarHBondContact O-N 3.35Å; I157-L160 HydrophobicContact CB-CB 4.31Å; I157-L160 HydrophobicContact CG2-CB 3.99Å; I157-L160 HydrophobicContact CG2-CD1 4.12Å; I157-L160 PolarHBondContact O-N 3.39Å; I157-L160 VanDerWaalsContact O-N 3.14Å; I157-A161 PolarHBondContact N-O 2.83Å; I157-T163 HydrophobicContact CD1-CG2 4.47Å
158E65.8Low81.7Confident132 Ų13276.5 Ų76.562%0.61742%0.416SS*.THydrogen-bonded Turntrans-54.8119177.9-71.3-171.1160.300109Y156Y156-E158 HydrophobicContact CD1-CG 4.32Å; Y156-E158 HydrophobicContact CE1-CG 3.87Å
159N59.7Low81.1Confident155 Ų15578.1 Ų78.183%0.82942%0.424SS*.THydrogen-bonded Turntrans81.13.6178.9-44.6-40.1000118.4I157I157-N159 PolarHBondContact O-N 3.35Å
160L62.3Low80.8Confident134 Ų13479.9 Ų79.970%0.70243%0.429SS*.THydrogen-bonded Turntrans-132.510.4-173.5-74161.7000116.2I157I157-L160 HydrophobicContact CB-CB 4.31Å; I157-L160 HydrophobicContact CG2-CB 3.99Å; I157-L160 HydrophobicContact CG2-CD1 4.12Å; I157-L160 PolarHBondContact O-N 3.39Å; I157-L160 VanDerWaalsContact O-N 3.14Å
161A71.6Confident80.4Confident67 Ų6780.2 Ų80.255%0.55443%0.427SS*.EExtended strand (participates in β ladder)trans86.8171.3-178.400000115.4I157I157-A161 PolarHBondContact N-O 2.83Å
162V82Confident80.2Confident17 Ų1778.5 Ų78.510%0.10343%0.429CS..EExtended strand (participates in β ladder)trans-88.1128.5-179.3171.70000108.9F145 F148 C154 Y156F145-V162 HydrophobicContact CB-CG1 4.16Å; F145-V162 HydrophobicContact CB-CG2 4.42Å; F145-V162 HydrophobicContact CD1-CB 4.23Å; F145-V162 HydrophobicContact CD1-CG1 4.35Å; F145-V162 HydrophobicContact CD1-CG2 4.18Å; F145-V162 HydrophobicContact CD2-CB 4.44Å; F145-V162 HydrophobicContact CD2-CG2 3.55Å; F145-V162 HydrophobicContact CE1-CB 4.43Å; F145-V162 HydrophobicContact CE1-CG2 4.31Å; F145-V162 HydrophobicContact CE2-CG2 3.69Å; F145-V162 HydrophobicContact CG-CB 4.22Å; F145-V162 HydrophobicContact CG-CG1 4.17Å; F145-V162 HydrophobicContact CG-CG2 3.79Å; F145-V162 HydrophobicContact CZ-CG2 4.07Å; F148-V162 HydrophobicContact CD1-CG1 4.07Å; F148-V162 HydrophobicContact CE1-CG1 4.47Å; C154-V162 WeakPolarHBondContact SG-CG1 3.41Å; Y156-V162 HydrophobicContact CD2-CG2 3.74Å; Y156-V162 HydrophobicContact CE2-CG2 4.49Å
163T84.8Confident80Confident62 Ų6285.8 Ų85.838%0.3846%0.456SS..EExtended strand (participates in β ladder)trans-120.7153.3177.456.30000110.8V155 I157V155-T163 PolarHBondContact N-O 3.02Å; V155-T163 PolarHBondContact O-N 2.86Å; I157-T163 HydrophobicContact CD1-CG2 4.47Å
164C88.8Confident80Confident24 Ų2485.3 Ų85.316%0.16245%0.448CS..EExtended strand (participates in β ladder)trans-104.1131.7175.1-63.70000110.5F148 C149 E173 C175F148-C164 WeakPolarHBondContact CD1-SG 3.24Å; F148-C164 VanDerWaalsContact CE1-SG 3.53Å; C149-C164 WeakPolarHBondContact CA-SG 3.31Å; C149-C164 HydrophobicContact CB-CB 3.76Å; C149-C164 WeakPolarHBondContact CB-SG 3.44Å; C149-C164 WeakPolarHBondContact SG-CA 3.4Å; C149-C164 WeakPolarHBondContact SG-CB 3.33Å; C149-C164 CovalentContact SG-SG 2.02Å; C149-C164 PolarHBondContact SG-SG 3.18Å; C164-E173 PolarHBondContact SG-O 2.9Å; C164-C175 WeakPolarHBondContact CB-SG 3.41Å
165K89.3Confident80Confident135 Ų13583.3 Ų83.359%0.58743%0.434SS*.EExtended strand (participates in β ladder)trans-93108163.6-75.8-172.8174.9-176.50108.3G152 E153 V155G152-K165 CarbonylContact C-O 3.44Å; G152-K165 WeakPolarHBondContact CA-O 3.29Å; E153-K165 HydrophobicContact CB-CB 4.48Å; E153-K165 PolarHBondContact N-O 3.32Å; E153-K165 PolarHBondContact O-N 2.86Å; V155-K165 HydrophobicContact CG2-CD 3.92Å; V155-K165 HydrophobicContact CG2-CG 3.94Å
166C90.3Very high79.9Confident46 Ų4683.5 Ų83.531%0.31145%0.445SS..EExtended strand (participates in β ladder)trans-76.4148.3-176.5-53.20000112.8H151 Y170 G172 C175H151-C166 WeakPolarHBondContact O-CA 3.45Å; C166-Y170 WeakPolarHBondContact CB-O 3.44Å; C166-G172 PolarHBondContact SG-O 2.85Å; C166-C175 WeakPolarHBondContact CA-SG 3.28Å; C166-C175 HydrophobicContact CB-CB 3.62Å; C166-C175 WeakPolarHBondContact CB-SG 3.38Å; C166-C175 PolarHBondContact N-SG 3.24Å; C166-C175 WeakPolarHBondContact SG-CA 3.38Å; C166-C175 WeakPolarHBondContact SG-CB 3.37Å; C166-C175 CovalentContact SG-SG 2.03Å; C166-C175 PolarHBondContact SG-SG 2.82Å
167D86.4Confident79.9Confident84 Ų8485.1 Ų85.145%0.44946%0.456SS..PPolyproline II helixtrans-68.2158.2172.1-66.8-30.4000111H151 E169 Y170H151-D167 PolarHBondContact O-N 3.36Å; D167-E169 PolarHBondContact O-N 2.88Å; D167-E169 VanDerWaalsContact O-N 3.13Å; D167-Y170 HydrophobicContact CB-CD2 4.21Å; D167-Y170 PolarHBondContact O-N 3.37Å
168S75Confident79.9Confident96 Ų9688.3 Ų88.367%0.67147%0.468SS*.THydrogen-bonded Turntrans-55.7123.417756.80000109.6
169E71.9Confident80.1Confident70 Ų7084.5 Ų84.533%0.32746%0.456SS..THydrogen-bonded Turntrans92.7-1.8-176.6-55.5159.4-154.300115.7D167 K178 S179 K181D167-E169 PolarHBondContact O-N 2.88Å; D167-E169 VanDerWaalsContact O-N 3.13Å; E169-K178 CarbonylContact O-C 3.52Å; E169-K178 WeakPolarHBondContact O-CA 3.36Å; E169-S179 PolarHBondContact O-N 3.44Å; E169-K181 HydrophobicContact CG-CB 4.25Å; E169-K181 HydrophobicContact CG-CD 3.83Å; E169-K181 WeakPolarHBondContact OE1-CD 3.21Å; E169-K181 IonicContact OE1-NZ 2.67Å; E169-K181 PolarHBondContact OE1-NZ 3Å
170Y83.3Confident80.2Confident52 Ų5285.4 Ų85.420%0.20446%0.457CS..EExtended strand (participates in β ladder)trans-113.9141.8174-67.3-87.9000111.9H151 C166 D167 E177 K178H151-Y170 HydrophobicContact CB-CD1 3.65Å; H151-Y170 HydrophobicContact CB-CD2 3.71Å; H151-Y170 HydrophobicContact CB-CE1 3.98Å; H151-Y170 HydrophobicContact CB-CE2 4.04Å; H151-Y170 HydrophobicContact CB-CG 3.49Å; H151-Y170 VanDerWaalsContact CB-CG 3.49Å; H151-Y170 AromaticContact CD2-CD1 3.41Å; H151-Y170 VanDerWaalsContact CD2-CD1 3.41Å; H151-Y170 WeakPolarHBondContact CD2-CD1 3.35Å; H151-Y170 AromaticContact CD2-CE1 3.08Å; H151-Y170 WeakPolarHBondContact CD2-CE1 3.4Å; H151-Y170 AromaticContact CD2-CZ 3.64Å; H151-Y170 AromaticContact CE1-CZ 3.98Å; H151-Y170 AromaticContact CG-CD1 3.66Å; H151-Y170 AromaticContact CG-CE1 3.47Å; H151-Y170 VanDerWaalsContact CG-CE1 3.47Å; H151-Y170 AromaticContact CG-CE2 3.97Å; H151-Y170 AromaticContact CG-CG 3.96Å; H151-Y170 AromaticContact CG-CZ 3.62Å; H151-Y170 AromaticContact ND1-CZ 3.85Å; H151-Y170 AromaticContact NE2-CE1 3.56Å; H151-Y170 AromaticContact NE2-CZ 3.86Å; C166-Y170 WeakPolarHBondContact CB-O 3.44Å; D167-Y170 HydrophobicContact CB-CD2 4.21Å; D167-Y170 PolarHBondContact O-N 3.37Å; Y170-E177 CarbonylContact C-O 3.38Å; Y170-E177 WeakPolarHBondContact CA-O 3.36Å; Y170-K178 HydrophobicContact CD1-CB 4.29Å; Y170-K178 HydrophobicContact CE1-CB 4.07Å; Y170-K178 HydrophobicContact CE1-CD 4.46Å; Y170-K178 HydrophobicContact CE1-CG 4.27Å
171F80.1Confident80Confident116 Ų11685 Ų8551%0.50945%0.449SS..EExtended strand (participates in β ladder)trans-141.3170.8-175-64.5-96.2000110.9C175 E177F171-C175 WeakPolarHBondContact O-CA 3.38Å; F171-E177 PolarHBondContact N-O 3.23Å; F171-E177 WeakPolarHBondContact O-CB 3.23Å; F171-E177 PolarHBondContact O-N 3.45Å
172G82.3Confident79.3Confident36 Ų3687.7 Ų87.737%0.37146%0.459SS..SBendtrans94.8168.2-178.300000113.6C166 R174 C175C166-G172 PolarHBondContact SG-O 2.85Å; G172-R174 PolarHBondContact O-N 3.49Å; G172-R174 VanDerWaalsContact O-N 3.07Å; G172-C175 PolarHBondContact O-N 3.44Å; G172-C175 VanDerWaalsContact O-N 3.14Å
173E84.1Confident77.9Confident177 Ų17794.9 Ų94.983%0.82749%0.492SS*.THydrogen-bonded Turntrans-60.8-24-172.6-61.2-176.1166.200113.9C164C164-E173 PolarHBondContact SG-O 2.9Å
174R87.2Confident76.6Confident128 Ų12895.9 Ų95.948%0.48350%0.501SS..THydrogen-bonded Turntrans-119.45.9179.3-67.7179.7172-113.48.6114F148 I150 G172 G176F148-R174 HydrophobicContact CD1-CG 4.5Å; F148-R174 HydrophobicContact CD2-CG 4.39Å; F148-R174 VanDerWaalsContact CD2-NH1 3.3Å; F148-R174 HydrophobicContact CE1-CG 4.08Å; F148-R174 HydrophobicContact CE2-CG 4Å; F148-R174 VanDerWaalsContact CE2-NE 3.33Å; F148-R174 VanDerWaalsContact CE2-NH2 3.29Å; F148-R174 HydrophobicContact CZ-CG 3.8Å; F148-R174 WeakPolarHBondContact O-CB 3.09Å; F148-R174 WeakPolarHBondContact O-CG 3.41Å; I150-R174 PolarHBondContact N-O 3Å; G172-R174 PolarHBondContact O-N 3.49Å; G172-R174 VanDerWaalsContact O-N 3.07Å; R174-G176 VanDerWaalsContact C-N 3.28Å; R174-G176 PolarHBondContact O-N 3.42Å
175C88.4Confident75Confident0 Ų0102.7 Ų102.70%053%0.528CS..SBendtrans57.837.2-176.6-43.50000113.6H151 C164 C166 F171 G172H151-C175 HydrophobicContact CB-CB 4.3Å; H151-C175 WeakPolarHBondContact O-CB 3.32Å; C164-C175 WeakPolarHBondContact CB-SG 3.41Å; C166-C175 WeakPolarHBondContact CA-SG 3.28Å; C166-C175 HydrophobicContact CB-CB 3.62Å; C166-C175 WeakPolarHBondContact CB-SG 3.38Å; C166-C175 PolarHBondContact N-SG 3.24Å; C166-C175 WeakPolarHBondContact SG-CA 3.38Å; C166-C175 WeakPolarHBondContact SG-CB 3.37Å; C166-C175 CovalentContact SG-SG 2.03Å; C166-C175 PolarHBondContact SG-SG 2.82Å; F171-C175 WeakPolarHBondContact O-CA 3.38Å; G172-C175 PolarHBondContact O-N 3.44Å; G172-C175 VanDerWaalsContact O-N 3.14Å
176G83.8Confident73.6Confident48 Ų48101.5 Ų101.550%0.49553%0.528SS..  trans-93-17.3178.200000113.6R174R174-G176 VanDerWaalsContact C-N 3.28Å; R174-G176 PolarHBondContact O-N 3.42Å
177E81.9Confident72.2Confident136 Ų136104.8 Ų104.864%0.63654%0.543SS*.EExtended strand (participates in β ladder)trans-92.2120.9-178.9-64.6169.6-149.100108.9Y170 F171Y170-E177 CarbonylContact C-O 3.38Å; Y170-E177 WeakPolarHBondContact CA-O 3.36Å; F171-E177 PolarHBondContact N-O 3.23Å; F171-E177 WeakPolarHBondContact O-CB 3.23Å; F171-E177 PolarHBondContact O-N 3.45Å
178K78.8Confident71.5Confident139 Ų139105.5 Ų105.560%0.60455%0.547SS*.EExtended strand (participates in β ladder)trans-86114172.3-171.7171.5-177.4169.90108.2E169 Y170 M180E169-K178 CarbonylContact O-C 3.52Å; E169-K178 WeakPolarHBondContact O-CA 3.36Å; Y170-K178 HydrophobicContact CD1-CB 4.29Å; Y170-K178 HydrophobicContact CE1-CB 4.07Å; Y170-K178 HydrophobicContact CE1-CD 4.46Å; Y170-K178 HydrophobicContact CE1-CG 4.27Å; K178-M180 PolarHBondContact O-N 3.28Å
179S69.9Low71.7Confident52 Ų52104.8 Ų104.836%0.36454%0.535SS..  trans-70.6124.9170.4176.60000108.3E169 K181E169-S179 PolarHBondContact O-N 3.44Å; S179-K181 VanDerWaalsContact C-N 3.29Å; S179-K181 PolarHBondContact O-N 3.43Å
180M62.2Low72.1Confident174 Ų174106.8 Ų106.886%0.85755%0.547SS*.  trans-63.597.6164.5-107.9177.768.800107.5K178 T182K178-M180 PolarHBondContact O-N 3.28Å; M180-T182 PolarHBondContact O-N 2.98Å
181K57.8Low72.2Confident125 Ų125107.1 Ų107.154%0.54356%0.557SS.*  trans-64.899.9168-157-175-1541670106.4E169 S179 Q183E169-K181 HydrophobicContact CG-CB 4.25Å; E169-K181 HydrophobicContact CG-CD 3.83Å; E169-K181 WeakPolarHBondContact OE1-CD 3.21Å; E169-K181 IonicContact OE1-NZ 2.67Å; E169-K181 PolarHBondContact OE1-NZ 3Å; S179-K181 VanDerWaalsContact C-N 3.29Å; S179-K181 PolarHBondContact O-N 3.43Å; K181-Q183 PolarHBondContact O-N 2.89Å
182T58.3Low72.6Confident124 Ų124106.7 Ų106.776%0.76156%0.555SS**  trans-53.7113.3157.824.70000105.2M180 S184M180-T182 PolarHBondContact O-N 2.98Å; T182-S184 PolarHBondContact O-N 2.92Å
183Q52.1Low73Confident169 Ų169110.6 Ų110.679%0.7957%0.566SS**  trans-53.1107.2176.4-79.8-177.2-3.600107.3K181 K185K181-Q183 PolarHBondContact O-N 2.89Å; Q183-K185 PolarHBondContact O-N 3.27Å
184S57.4Low73.3Confident82 Ų82104.5 Ų104.557%0.57355%0.546SS*.  trans-64.888.9159.255.30000105T182 D186T182-S184 PolarHBondContact O-N 2.92Å; S184-D186 PolarHBondContact O-N 2.92Å
185K54Low73.6Confident167 Ų167103.2 Ų103.273%0.72655%0.549SS*.  trans-48118.4167.5-96.8174.2169.8161.40106.1Q183 D187Q183-K185 PolarHBondContact O-N 3.27Å; K185-D187 PolarHBondContact O-N 3.1Å
186D59.7Low73.9Confident110 Ų110105.9 Ų105.959%0.58857%0.57SS**  trans-30.7104.9-164.9-61.4-75.7000113.2S184 N188 D189 L190S184-D186 PolarHBondContact O-N 2.92Å; D186-N188 PolarHBondContact O-N 3.11Å; D186-D189 HydrophobicContact CB-CB 4.49Å; D186-D189 PolarHBondContact O-N 2.63Å; D186-L190 PolarHBondContact O-N 2.92Å
187D62.2Low74.4Confident115 Ų115106.4 Ų106.462%0.61557%0.57SS**Hα-helixtrans-52-24.2174.3-67-44.9000111.4K185 S191K185-D187 PolarHBondContact O-N 3.1Å; D187-S191 WeakPolarHBondContact O-CB 3.28Å; D187-S191 PolarHBondContact O-N 2.81Å
188N71.4Confident75.1Confident100 Ų100104.8 Ų104.854%0.53557%0.565SS.*Hα-helixtrans-63.8-42.1174.2-169.118.7000113.1D186 K192D186-N188 PolarHBondContact O-N 3.11Å; N188-K192 VanDerWaalsContact O-CG 3.25Å; N188-K192 WeakPolarHBondContact O-CG 3.46Å; N188-K192 PolarHBondContact O-N 3.45Å; N188-K192 WeakPolarHBondContact OD1-CE 3.3Å
189D79.8Confident75.8Confident80 Ų80102.7 Ų102.743%0.42856%0.564SS.*Hα-helixtrans-78-36.9-179.3-74.2-14.3000111.4D186 S191 K192 I193D186-D189 HydrophobicContact CB-CB 4.49Å; D186-D189 PolarHBondContact O-N 2.63Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.86Å; D189-K192 PolarHBondContact O-N 3.3Å; D189-K192 IonicContact OD1-NZ 2.98Å; D189-K192 PolarHBondContact OD1-NZ 3Å; D189-I193 WeakPolarHBondContact O-CD1 3.33Å; D189-I193 VanDerWaalsContact O-CG1 3.26Å; D189-I193 WeakPolarHBondContact O-CG1 3.48Å; D189-I193 PolarHBondContact O-N 3.24Å
190L79.6Confident77.1Confident112 Ų112104.6 Ų104.659%0.58657%0.573SS**Hα-helixtrans-60.6-43168.8-108.9154.8000111.7D186 I193 A194D186-L190 PolarHBondContact O-N 2.92Å; L190-I193 PolarHBondContact O-N 3.46Å; L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 2.66Å
191S85.6Confident78.8Confident59 Ų59103.2 Ų103.241%0.41356%0.563SS.*Hα-helixtrans-63.1-42.2175.8-176.40000112.1D187 D189 I193 A194 L195D187-S191 WeakPolarHBondContact O-CB 3.28Å; D187-S191 PolarHBondContact O-N 2.81Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.86Å; S191-I193 PolarHBondContact O-N 2.9Å; S191-A194 PolarHBondContact O-N 3.21Å; S191-L195 WeakPolarHBondContact O-CB 3.49Å; S191-L195 VanDerWaalsContact O-CG 3.26Å; S191-L195 WeakPolarHBondContact O-CG 3.42Å; S191-L195 PolarHBondContact O-N 2.92Å
192K88.8Confident80.7Confident107 Ų107101.1 Ų101.147%0.46556%0.56SS.*Hα-helixtrans-62.1-43.2174.9-73.5170.2-158.6155.50112.3N188 D189 L195 A196N188-K192 VanDerWaalsContact O-CG 3.25Å; N188-K192 WeakPolarHBondContact O-CG 3.46Å; N188-K192 PolarHBondContact O-N 3.45Å; N188-K192 WeakPolarHBondContact OD1-CE 3.3Å; D189-K192 PolarHBondContact O-N 3.3Å; D189-K192 IonicContact OD1-NZ 2.98Å; D189-K192 PolarHBondContact OD1-NZ 3Å; K192-L195 PolarHBondContact O-N 3.31Å; K192-A196 WeakPolarHBondContact O-CB 3.48Å; K192-A196 PolarHBondContact O-N 3.35Å
193I90Very high82.5Confident118 Ų11897.8 Ų97.861%0.60554%0.541SS*.Hα-helixtrans-64.2-43.9177.4-66.6164.1000110D189 L190 S191 L195 A196 A197D189-I193 WeakPolarHBondContact O-CD1 3.33Å; D189-I193 VanDerWaalsContact O-CG1 3.26Å; D189-I193 WeakPolarHBondContact O-CG1 3.48Å; D189-I193 PolarHBondContact O-N 3.24Å; L190-I193 PolarHBondContact O-N 3.46Å; S191-I193 PolarHBondContact O-N 2.9Å; I193-L195 PolarHBondContact O-N 3.04Å; I193-A196 PolarHBondContact O-N 3.08Å; I193-A197 WeakPolarHBondContact O-CB 3.34Å; I193-A197 PolarHBondContact O-N 3.25Å
194A91Very high84.6Confident49 Ų4993.1 Ų93.141%0.40552%0.524SS..Hα-helixtrans-60.5-44.5176.100000111.8L190 S191 A196 A197 I198L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 2.66Å; S191-A194 PolarHBondContact O-N 3.21Å; A194-A196 PolarHBondContact O-N 2.94Å; A194-A197 PolarHBondContact O-N 3.03Å; A194-I198 VanDerWaalsContact O-CG1 3.28Å; A194-I198 WeakPolarHBondContact O-CG1 3.43Å; A194-I198 PolarHBondContact O-N 3.37Å
195L92.1Very high86.5Confident102 Ų10292.7 Ų92.753%0.53452%0.518SS..Hα-helixtrans-64.3-38.9176.2-72172.3000112.5S191 K192 I193 T199S191-L195 WeakPolarHBondContact O-CB 3.49Å; S191-L195 VanDerWaalsContact O-CG 3.26Å; S191-L195 WeakPolarHBondContact O-CG 3.42Å; S191-L195 PolarHBondContact O-N 2.92Å; K192-L195 PolarHBondContact O-N 3.31Å; I193-L195 PolarHBondContact O-N 3.04Å; L195-T199 WeakPolarHBondContact O-CB 3.47Å; L195-T199 PolarHBondContact O-N 3.17Å; L195-T199 PolarHBondContact O-OG1 3.06Å
196A94.8Very high88.5Confident55 Ų5587.5 Ų87.546%0.45550%0.501SS..Hα-helixtrans-63.1-46174.900000111K192 I193 A194 I198 T199 V200K192-A196 WeakPolarHBondContact O-CB 3.48Å; K192-A196 PolarHBondContact O-N 3.35Å; I193-A196 PolarHBondContact O-N 3.08Å; A194-A196 PolarHBondContact O-N 2.94Å; A196-I198 PolarHBondContact O-N 3.39Å; A196-T199 WeakPolarHBondContact O-CB 3.28Å; A196-T199 PolarHBondContact O-N 3.44Å; A196-V200 WeakPolarHBondContact O-CG2 3.25Å; A196-V200 PolarHBondContact O-N 3.02Å
197A95.6Very high90.3Very high59 Ų5988.3 Ų88.349%0.48850%0.504SS..Hα-helixtrans-60.5-45.4178.200000112.3I193 A194 T199 V200 F201I193-A197 WeakPolarHBondContact O-CB 3.34Å; I193-A197 PolarHBondContact O-N 3.25Å; A194-A197 PolarHBondContact O-N 3.03Å; A197-T199 VanDerWaalsContact C-N 3.3Å; A197-T199 PolarHBondContact O-N 2.75Å; A197-V200 PolarHBondContact O-N 3.32Å; A197-F201 PolarHBondContact O-N 3.4Å
198I95.6Very high91.9Very high102 Ų10287.7 Ų87.752%0.52350%0.5SS..Hα-helixtrans-60.5-42.4176.5-66.9164000110.6A194 A196 V200 F201 V202A194-I198 VanDerWaalsContact O-CG1 3.28Å; A194-I198 WeakPolarHBondContact O-CG1 3.43Å; A194-I198 PolarHBondContact O-N 3.37Å; A196-I198 PolarHBondContact O-N 3.39Å; I198-V200 PolarHBondContact O-N 3.48Å; I198-F201 PolarHBondContact O-N 3.44Å; I198-V202 HydrophobicContact CG2-CG2 4.28Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.41Å; I198-V202 PolarHBondContact O-N 2.95Å
199T95Very high93Very high96 Ų9685.3 Ų85.359%0.58949%0.494SS*.Hα-helixtrans-62.8-44.1-179.9-56.40000111.5L195 A196 A197 S203L195-T199 WeakPolarHBondContact O-CB 3.47Å; L195-T199 PolarHBondContact O-N 3.17Å; L195-T199 PolarHBondContact O-OG1 3.06Å; A196-T199 WeakPolarHBondContact O-CB 3.28Å; A196-T199 PolarHBondContact O-N 3.44Å; A197-T199 VanDerWaalsContact C-N 3.3Å; A197-T199 PolarHBondContact O-N 2.75Å; T199-S203 WeakPolarHBondContact O-CB 3.49Å; T199-S203 PolarHBondContact O-N 2.95Å; T199-S203 VanDerWaalsContact O-N 3.08Å
200V97.2Very high93.7Very high91 Ų9185.2 Ų85.255%0.55250%0.496SS*.Hα-helixtrans-62.4-47.8176.1174.70000110.4A196 A197 I198 V202 S203 V204A196-V200 WeakPolarHBondContact O-CG2 3.25Å; A196-V200 PolarHBondContact O-N 3.02Å; A197-V200 PolarHBondContact O-N 3.32Å; I198-V200 PolarHBondContact O-N 3.48Å; V200-V202 PolarHBondContact O-N 3.43Å; V200-S203 PolarHBondContact O-N 3.32Å; V200-S203 PolarHBondContact O-OG 2.97Å; V200-V204 HydrophobicContact CG1-CG2 4.5Å; V200-V204 WeakPolarHBondContact O-CG2 3.36Å; V200-V204 PolarHBondContact O-N 3.25Å
201F97.2Very high94.5Very high146 Ų14681.4 Ų81.464%0.6448%0.484SS*.Hα-helixtrans-60.1-47.5-178.9-170.2-99.5000112.4A197 I198 S203 V204 V205A197-F201 PolarHBondContact O-N 3.4Å; I198-F201 PolarHBondContact O-N 3.44Å; F201-S203 VanDerWaalsContact C-N 3.28Å; F201-S203 PolarHBondContact O-N 2.97Å; F201-V204 PolarHBondContact O-N 2.89Å; F201-V205 HydrophobicContact CD1-CG2 4.11Å; F201-V205 HydrophobicContact CE1-CG2 3.79Å; F201-V205 HydrophobicContact CZ-CG2 4.08Å; F201-V205 WeakPolarHBondContact O-CG2 3.05Å; F201-V205 PolarHBondContact O-N 3.49Å
202V96.6Very high94.9Very high81 Ų8183.2 Ų83.249%0.49149%0.488SS..Hα-helixtrans-60.5-40.3177.7172.80000111I198 V200 V205 T206I198-V202 HydrophobicContact CG2-CG2 4.28Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.41Å; I198-V202 PolarHBondContact O-N 2.95Å; V200-V202 PolarHBondContact O-N 3.43Å; V202-V205 PolarHBondContact O-N 3.46Å; V202-T206 PolarHBondContact O-N 2.91Å; V202-T206 PolarHBondContact O-OG1 3.47Å
203S96.9Very high95.2Very high53 Ų5381.2 Ų81.237%0.37149%0.485SS..Hα-helixtrans-63.1-43178.376.40000112.5T199 V200 F201 T206 L207T199-S203 WeakPolarHBondContact O-CB 3.49Å; T199-S203 PolarHBondContact O-N 2.95Å; T199-S203 VanDerWaalsContact O-N 3.08Å; V200-S203 PolarHBondContact O-N 3.32Å; V200-S203 PolarHBondContact O-OG 2.97Å; F201-S203 VanDerWaalsContact C-N 3.28Å; F201-S203 PolarHBondContact O-N 2.97Å; S203-T206 WeakPolarHBondContact CA-OG1 3.39Å; S203-T206 PolarHBondContact O-N 3.33Å; S203-T206 PolarHBondContact O-OG1 3.2Å; S203-T206 VanDerWaalsContact O-OG1 3.11Å; S203-L207 WeakPolarHBondContact O-CB 3.26Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.43Å; S203-L207 PolarHBondContact O-N 2.88Å
204V97Very high95.4Very high71 Ų7178.9 Ų78.943%0.4348%0.476SS..Hα-helixtrans-65.3-46178.4174.40000110.4V200 F201 T206 L207 I208V200-V204 HydrophobicContact CG1-CG2 4.5Å; V200-V204 WeakPolarHBondContact O-CG2 3.36Å; V200-V204 PolarHBondContact O-N 3.25Å; F201-V204 PolarHBondContact O-N 2.89Å; V204-T206 VanDerWaalsContact C-N 3.31Å; V204-T206 PolarHBondContact O-N 3.37Å; V204-L207 PolarHBondContact O-N 3.34Å; V204-I208 HydrophobicContact CG1-CD1 3.83Å; V204-I208 HydrophobicContact CG1-CG1 4.48Å; V204-I208 VanDerWaalsContact O-CG1 3.29Å; V204-I208 WeakPolarHBondContact O-CG1 3.49Å; V204-I208 PolarHBondContact O-N 2.89Å
205V96.6Very high95.4Very high73 Ų7380 Ų8044%0.44248%0.477SS..Hα-helixtrans-61-41.2178.1174.50000111.2F201 V202 I208 A209F201-V205 HydrophobicContact CD1-CG2 4.11Å; F201-V205 HydrophobicContact CE1-CG2 3.79Å; F201-V205 HydrophobicContact CZ-CG2 4.08Å; F201-V205 WeakPolarHBondContact O-CG2 3.05Å; F201-V205 PolarHBondContact O-N 3.49Å; V202-V205 PolarHBondContact O-N 3.46Å; V205-I208 PolarHBondContact O-N 2.79Å; V205-A209 WeakPolarHBondContact O-CB 3.26Å; V205-A209 PolarHBondContact O-N 3.5Å
206T96.3Very high95.5Very high59 Ų5979 Ų7936%0.36248%0.476SS..Hα-helixtrans-67.6-40.8176.424.80000112.5V202 S203 V204 I208 A209 V210V202-T206 PolarHBondContact O-N 2.91Å; V202-T206 PolarHBondContact O-OG1 3.47Å; S203-T206 WeakPolarHBondContact CA-OG1 3.39Å; S203-T206 PolarHBondContact O-N 3.33Å; S203-T206 PolarHBondContact O-OG1 3.2Å; S203-T206 VanDerWaalsContact O-OG1 3.11Å; V204-T206 VanDerWaalsContact C-N 3.31Å; V204-T206 PolarHBondContact O-N 3.37Å; T206-I208 VanDerWaalsContact C-N 3.33Å; T206-I208 PolarHBondContact O-N 3.33Å; T206-A209 PolarHBondContact O-N 3Å; T206-V210 VanDerWaalsContact O-CG2 3.31Å; T206-V210 WeakPolarHBondContact O-CG2 3.5Å; T206-V210 PolarHBondContact O-N 3.34Å
207L96.3Very high95.3Very high127 Ų12781.5 Ų81.567%0.66548%0.478SS*.Hα-helixtrans-61.9-40.6175.5-72.6174.3000112S203 V204 G211S203-L207 WeakPolarHBondContact O-CB 3.26Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.43Å; S203-L207 PolarHBondContact O-N 2.88Å; V204-L207 PolarHBondContact O-N 3.34Å; L207-G211 PolarHBondContact O-N 3.01Å
208I96.4Very high95.1Very high101 Ų10184 Ų8452%0.51848%0.482SS..Hα-helixtrans-63.1-47.9175.5-67165.9000110.3V204 V205 T206 V210 G211 I212V204-I208 HydrophobicContact CG1-CD1 3.83Å; V204-I208 HydrophobicContact CG1-CG1 4.48Å; V204-I208 VanDerWaalsContact O-CG1 3.29Å; V204-I208 WeakPolarHBondContact O-CG1 3.49Å; V204-I208 PolarHBondContact O-N 2.89Å; V205-I208 PolarHBondContact O-N 2.79Å; T206-I208 VanDerWaalsContact C-N 3.33Å; T206-I208 PolarHBondContact O-N 3.33Å; I208-V210 PolarHBondContact O-N 3.5Å; I208-G211 PolarHBondContact O-N 3.32Å; I208-I212 HydrophobicContact CG2-CD1 3.91Å; I208-I212 WeakPolarHBondContact O-CG1 3.15Å; I208-I212 PolarHBondContact O-N 3.04Å
209A94.8Very high94.8Very high50 Ų5088.4 Ų88.441%0.41349%0.493SS..Hα-helixtrans-60.1-45.917900000112.1V205 T206 I212 V213V205-A209 WeakPolarHBondContact O-CB 3.26Å; V205-A209 PolarHBondContact O-N 3.5Å; T206-A209 PolarHBondContact O-N 3Å; A209-I212 PolarHBondContact O-N 2.85Å; A209-V213 WeakPolarHBondContact O-CG2 3.06Å; A209-V213 PolarHBondContact O-N 2.83Å
210V95.1Very high94.5Very high79 Ų7991.6 Ų91.648%0.47950%0.498SS..Hα-helixtrans-63.2-42.3175.8173.50000110.8T206 I208 I212 V213 V214T206-V210 VanDerWaalsContact O-CG2 3.31Å; T206-V210 WeakPolarHBondContact O-CG2 3.5Å; T206-V210 PolarHBondContact O-N 3.34Å; I208-V210 PolarHBondContact O-N 3.5Å; V210-I212 VanDerWaalsContact C-N 3.33Å; V210-I212 PolarHBondContact O-N 2.92Å; V210-V213 PolarHBondContact O-N 2.81Å; V210-V214 HydrophobicContact CG1-CG2 4.15Å; V210-V214 WeakPolarHBondContact O-CB 3.33Å; V210-V214 VanDerWaalsContact O-CG2 3.29Å; V210-V214 WeakPolarHBondContact O-CG2 3.42Å; V210-V214 PolarHBondContact O-N 2.84Å
211G95.3Very high94.1Very high32 Ų3295.2 Ų95.233%0.3350%0.502SS..Hα-helixtrans-58.2-43.1175.200000112.6L207 I208 V214 T215L207-G211 PolarHBondContact O-N 3.01Å; I208-G211 PolarHBondContact O-N 3.32Å; G211-V214 PolarHBondContact O-N 2.82Å; G211-T215 WeakPolarHBondContact O-CB 3Å; G211-T215 WeakPolarHBondContact O-CG2 3.44Å; G211-T215 PolarHBondContact O-N 3.01Å; G211-T215 PolarHBondContact O-OG1 2.93Å
212I95.1Very high93.5Very high97 Ų9796.2 Ų96.250%0.49750%0.503SS..Hα-helixtrans-63.6-47.3175.5-66.3165.7000110.5I208 A209 V210 V214 T215 V216I208-I212 HydrophobicContact CG2-CD1 3.91Å; I208-I212 WeakPolarHBondContact O-CG1 3.15Å; I208-I212 PolarHBondContact O-N 3.04Å; A209-I212 PolarHBondContact O-N 2.85Å; V210-I212 VanDerWaalsContact C-N 3.33Å; V210-I212 PolarHBondContact O-N 2.92Å; I212-V214 PolarHBondContact O-N 2.92Å; I212-T215 WeakPolarHBondContact CA-OG1 3.35Å; I212-T215 PolarHBondContact O-N 3.17Å; I212-T215 PolarHBondContact O-OG1 3.03Å; I212-V216 HydrophobicContact CG2-CG2 4.29Å; I212-V216 WeakPolarHBondContact O-CB 3.19Å; I212-V216 VanDerWaalsContact O-CG2 3.23Å; I212-V216 WeakPolarHBondContact O-CG2 3.12Å; I212-V216 PolarHBondContact O-N 3.34Å
213V93.5Very high92.9Very high65 Ų6598.2 Ų98.239%0.39451%0.505SS..Hα-helixtrans-61.1-46.2179.1172.40000111.1A209 V210 V216 Q217A209-V213 WeakPolarHBondContact O-CG2 3.06Å; A209-V213 PolarHBondContact O-N 2.83Å; V210-V213 PolarHBondContact O-N 2.81Å; V213-V216 PolarHBondContact O-N 2.9Å; V213-Q217 HydrophobicContact CG1-CG 4.46Å; V213-Q217 WeakPolarHBondContact O-CB 3.33Å; V213-Q217 WeakPolarHBondContact O-CG 2.98Å; V213-Q217 PolarHBondContact O-N 2.92Å
214V94.5Very high92.3Very high69 Ų69103.6 Ų103.642%0.41852%0.522SS..Hα-helixtrans-63.4-46.7178.9171.60000110.7V210 G211 I212 V216 Q217 L218V210-V214 HydrophobicContact CG1-CG2 4.15Å; V210-V214 WeakPolarHBondContact O-CB 3.33Å; V210-V214 VanDerWaalsContact O-CG2 3.29Å; V210-V214 WeakPolarHBondContact O-CG2 3.42Å; V210-V214 PolarHBondContact O-N 2.84Å; G211-V214 PolarHBondContact O-N 2.82Å; I212-V214 PolarHBondContact O-N 2.92Å; V214-V216 PolarHBondContact O-N 2.86Å; V214-Q217 PolarHBondContact O-N 2.66Å; V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.2Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 VanDerWaalsContact O-CG 3.27Å; V214-L218 WeakPolarHBondContact O-CG 2.98Å; V214-L218 PolarHBondContact O-N 2.84Å
215T92.6Very high91.6Very high71 Ų71106.7 Ų106.744%0.43653%0.531SS..Hα-helixtrans-63.7-39.7179.151.80000112.2G211 I212 L218 R219G211-T215 WeakPolarHBondContact O-CB 3Å; G211-T215 WeakPolarHBondContact O-CG2 3.44Å; G211-T215 PolarHBondContact O-N 3.01Å; G211-T215 PolarHBondContact O-OG1 2.93Å; I212-T215 WeakPolarHBondContact CA-OG1 3.35Å; I212-T215 PolarHBondContact O-N 3.17Å; I212-T215 PolarHBondContact O-OG1 3.03Å; T215-L218 PolarHBondContact O-N 3.45Å; T215-R219 WeakPolarHBondContact O-CB 3.38Å; T215-R219 VanDerWaalsContact O-CG 3.28Å; T215-R219 WeakPolarHBondContact O-CG 3.12Å; T215-R219 PolarHBondContact O-N 3.07Å
216V92.4Very high90.8Very high83 Ų83110 Ų11050%0.50354%0.537SS..Hα-helixtrans-65-43.2174171.20000111.1I212 V213 V214 R219 K220I212-V216 HydrophobicContact CG2-CG2 4.29Å; I212-V216 WeakPolarHBondContact O-CB 3.19Å; I212-V216 VanDerWaalsContact O-CG2 3.23Å; I212-V216 WeakPolarHBondContact O-CG2 3.12Å; I212-V216 PolarHBondContact O-N 3.34Å; V213-V216 PolarHBondContact O-N 2.9Å; V214-V216 PolarHBondContact O-N 2.86Å; V216-R219 PolarHBondContact O-N 3.45Å; V216-K220 WeakPolarHBondContact O-CB 3.46Å; V216-K220 PolarHBondContact O-N 3Å
217Q90.9Very high90Very high107 Ų107112.5 Ų112.550%0.555%0.545SS..Hα-helixtrans-65.3-40.9177-75.2-151.568.900112.5V213 V214 K220 R221V213-Q217 HydrophobicContact CG1-CG 4.46Å; V213-Q217 WeakPolarHBondContact O-CB 3.33Å; V213-Q217 WeakPolarHBondContact O-CG 2.98Å; V213-Q217 PolarHBondContact O-N 2.92Å; V214-Q217 PolarHBondContact O-N 2.66Å; Q217-K220 PolarHBondContact O-N 3.34Å; Q217-R221 WeakPolarHBondContact O-CG 3.01Å; Q217-R221 PolarHBondContact O-N 3.44Å
218L91.6Very high89.4Confident110 Ų110108 Ų10858%0.57653%0.528SS*.Hα-helixtrans-64.3-45.1175.4-71.9175.2000111.1V214 T215 K220 R221 Y222V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.2Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 VanDerWaalsContact O-CG 3.27Å; V214-L218 WeakPolarHBondContact O-CG 2.98Å; V214-L218 PolarHBondContact O-N 2.84Å; T215-L218 PolarHBondContact O-N 3.45Å; L218-K220 VanDerWaalsContact C-N 3.33Å; L218-K220 PolarHBondContact O-N 3.14Å; L218-R221 PolarHBondContact O-N 2.86Å; L218-Y222 VanDerWaalsContact O-CB 3.25Å; L218-Y222 WeakPolarHBondContact O-CB 3.48Å; L218-Y222 PolarHBondContact O-N 2.85Å
219R90.2Very high88.6Confident196 Ų196107.9 Ų107.974%0.7453%0.526SS*.Hα-helixtrans-59.8-43.3174.1-75.6179.8-178.5-166.31.9111.6T215 V216 Y222 F223T215-R219 WeakPolarHBondContact O-CB 3.38Å; T215-R219 VanDerWaalsContact O-CG 3.28Å; T215-R219 WeakPolarHBondContact O-CG 3.12Å; T215-R219 PolarHBondContact O-N 3.07Å; V216-R219 PolarHBondContact O-N 3.45Å; R219-Y222 PolarHBondContact O-N 3.01Å; R219-F223 VanDerWaalsContact O-CB 3.24Å; R219-F223 WeakPolarHBondContact O-CB 3.08Å; R219-F223 PolarHBondContact O-N 2.82Å
220K88.4Confident87.9Confident163 Ų163107.2 Ų107.271%0.70952%0.52SS*.Hα-helixtrans-65.2-40.9178.6-170175.8-178.5177.30112.2V216 Q217 L218 K224V216-K220 WeakPolarHBondContact O-CB 3.46Å; V216-K220 PolarHBondContact O-N 3Å; Q217-K220 PolarHBondContact O-N 3.34Å; L218-K220 VanDerWaalsContact C-N 3.33Å; L218-K220 PolarHBondContact O-N 3.14Å; K220-K224 WeakPolarHBondContact O-CB 3.28Å; K220-K224 PolarHBondContact O-N 2.95Å; K220-K224 VanDerWaalsContact O-N 3.11Å
221R88.1Confident87.3Confident167 Ų167108.4 Ų108.463%0.6352%0.52SS*.Hα-helixtrans-66.4-47.9175-75.3-168.7-175.4-162.32.5111.6Q217 L218 F223 K224 E225Q217-R221 WeakPolarHBondContact O-CG 3.01Å; Q217-R221 PolarHBondContact O-N 3.44Å; L218-R221 PolarHBondContact O-N 2.86Å; R221-F223 VanDerWaalsContact C-N 3.34Å; R221-F223 PolarHBondContact O-N 2.89Å; R221-K224 PolarHBondContact O-N 2.86Å; R221-E225 PolarHBondContact O-N 2.05Å
222Y85.6Confident86.7Confident167 Ų167112 Ų11266%0.65553%0.529SS*.Hα-helixtrans-60.9-43.2179.3-171.7-94.9000111.9L218 R219 K224 E225 Y226L218-Y222 VanDerWaalsContact O-CB 3.25Å; L218-Y222 WeakPolarHBondContact O-CB 3.48Å; L218-Y222 PolarHBondContact O-N 2.85Å; R219-Y222 PolarHBondContact O-N 3.01Å; Y222-K224 PolarHBondContact O-N 2.95Å; Y222-E225 PolarHBondContact O-N 2.02Å; Y222-Y226 WeakPolarHBondContact O-CB 3.01Å; Y222-Y226 PolarHBondContact O-N 3.13Å
223F83.6Confident86.1Confident123 Ų123114.8 Ų114.854%0.53953%0.533SS..Hα-helixtrans-65.5-39.3177.4-164-96.2000112.1R219 R221 Y226 E227R219-F223 VanDerWaalsContact O-CB 3.24Å; R219-F223 WeakPolarHBondContact O-CB 3.08Å; R219-F223 PolarHBondContact O-N 2.82Å; R221-F223 VanDerWaalsContact C-N 3.34Å; R221-F223 PolarHBondContact O-N 2.89Å; F223-Y226 PolarHBondContact O-N 3.47Å; F223-E227 HydrophobicContact CD1-CG 4.17Å; F223-E227 VanDerWaalsContact CE1-CD 3.41Å; F223-E227 HydrophobicContact CE1-CG 3.83Å; F223-E227 VanDerWaalsContact CE1-OE1 3.24Å; F223-E227 WeakPolarHBondContact CE1-OE1 3.41Å; F223-E227 HydrophobicContact CZ-CG 4.35Å; F223-E227 PolarHBondContact O-N 3.5Å
224K84.3Confident85.5Confident165 Ų165119 Ų11972%0.71755%0.546SS*.Hα-helixtrans-64.1-41.8175.7-175.7-177.9174.2-179.80112.3K220 R221 Y222 G228K220-K224 WeakPolarHBondContact O-CB 3.28Å; K220-K224 PolarHBondContact O-N 2.95Å; K220-K224 VanDerWaalsContact O-N 3.11Å; R221-K224 PolarHBondContact O-N 2.86Å; Y222-K224 PolarHBondContact O-N 2.95Å; K224-G228 PolarHBondContact O-N 3.11Å
225E82.1Confident85Confident136 Ų136120.3 Ų120.364%0.63655%0.546SS*.Hα-helixtrans-65.1-42.8175.3-77.4169.2-168.700111.3R221 Y222 G228 E229R221-E225 PolarHBondContact O-N 2.05Å; Y222-E225 PolarHBondContact O-N 2.02Å; E225-G228 PolarHBondContact O-N 2.03Å; E225-E229 PolarHBondContact O-N 3.07Å
226Y78.9Confident84.4Confident142 Ų142122 Ų12256%0.55755%0.552SS**Hα-helixtrans-63.1-43.3177.1-177-98.8000113Y222 F223 E229 A230Y222-Y226 WeakPolarHBondContact O-CB 3.01Å; Y222-Y226 PolarHBondContact O-N 3.13Å; F223-Y226 PolarHBondContact O-N 3.47Å; Y226-E229 PolarHBondContact O-N 2.79Å; Y226-A230 WeakPolarHBondContact O-CB 3.35Å; Y226-A230 PolarHBondContact O-N 3.24Å
227E80.9Confident83.6Confident113 Ų113127.9 Ų127.953%0.52857%0.565SS.*Hα-helixtrans-65.3-40.1174.4-79.5-168.7151.600112.4F223 A230 E231F223-E227 HydrophobicContact CD1-CG 4.17Å; F223-E227 VanDerWaalsContact CE1-CD 3.41Å; F223-E227 HydrophobicContact CE1-CG 3.83Å; F223-E227 VanDerWaalsContact CE1-OE1 3.24Å; F223-E227 WeakPolarHBondContact CE1-OE1 3.41Å; F223-E227 HydrophobicContact CZ-CG 4.35Å; F223-E227 PolarHBondContact O-N 3.5Å; E227-A230 PolarHBondContact O-N 3.24Å; E227-E231 PolarHBondContact O-N 2.96Å
228G82.2Confident83Confident31 Ų31129 Ų12932%0.3257%0.571SS.*Hα-helixtrans-60.6-46.2175.100000112K224 E225 A230 E231 E232K224-G228 PolarHBondContact O-N 3.11Å; E225-G228 PolarHBondContact O-N 2.03Å; G228-A230 VanDerWaalsContact C-N 3.32Å; G228-A230 PolarHBondContact O-N 3.48Å; G228-E231 PolarHBondContact O-N 3.14Å; G228-E232 WeakPolarHBondContact O-CG 3.48Å; G228-E232 PolarHBondContact O-N 3.31Å
229E81.4Confident82.2Confident99 Ų99130.6 Ų130.646%0.46358%0.575SS.*Hα-helixtrans-64.2-38.4176.6-162.6-169.8153.600111.9E225 Y226 E232 R233E225-E229 PolarHBondContact O-N 3.07Å; Y226-E229 PolarHBondContact O-N 2.79Å; E229-E232 PolarHBondContact O-N 3.2Å; E229-R233 WeakPolarHBondContact O-CB 3.4Å; E229-R233 VanDerWaalsContact O-CG 3.24Å; E229-R233 WeakPolarHBondContact O-CG 3.47Å; E229-R233 PolarHBondContact O-N 3.21Å; E229-R233 IonicContact OE1-CZ 2.9Å; E229-R233 IonicContact OE1-NE 3.99Å; E229-R233 PolarHBondContact OE1-NE 3.04Å; E229-R233 IonicContact OE1-NH2 2.79Å; E229-R233 PolarHBondContact OE1-NH2 3.19Å
230A78.4Confident81.4Confident36 Ų36126.2 Ų126.230%0.29857%0.57SS.*Hα-helixtrans-66.4-35.717600000112.5Y226 E227 G228 K234Y226-A230 WeakPolarHBondContact O-CB 3.35Å; Y226-A230 PolarHBondContact O-N 3.24Å; E227-A230 PolarHBondContact O-N 3.24Å; G228-A230 VanDerWaalsContact C-N 3.32Å; G228-A230 PolarHBondContact O-N 3.48Å; A230-K234 VanDerWaalsContact O-CG 3.3Å; A230-K234 WeakPolarHBondContact O-CG 3.34Å; A230-K234 PolarHBondContact O-N 2.97Å
231E83.4Confident80.3Confident104 Ų104121.5 Ų121.549%0.48657%0.567SS.*Hα-helixtrans-69.5-45.1175-164.6-170.314400111.6E227 G228 R233 K234 K235E227-E231 PolarHBondContact O-N 2.96Å; G228-E231 PolarHBondContact O-N 3.14Å; E231-R233 VanDerWaalsContact C-N 3.34Å; E231-R233 PolarHBondContact O-N 3.44Å; E231-K234 WeakPolarHBondContact O-CB 3.48Å; E231-K234 PolarHBondContact O-N 3.36Å; E231-K234 VanDerWaalsContact O-N 3.09Å; E231-K235 PolarHBondContact O-N 2.97Å; E231-K235 VanDerWaalsContact OE1-CE 3.28Å; E231-K235 WeakPolarHBondContact OE1-CE 3.39Å; E231-K235 IonicContact OE1-NZ 2.82Å; E231-K235 PolarHBondContact OE1-NZ 3.1Å
232E83.1Confident79.1Confident108 Ų108119 Ų11951%0.50557%0.567SS.*Hα-helixtrans-59.5-43.9176-71.4-67.2122.800111.3G228 E229 K234 K235 L236G228-E232 WeakPolarHBondContact O-CG 3.48Å; G228-E232 PolarHBondContact O-N 3.31Å; E229-E232 PolarHBondContact O-N 3.2Å; E232-K234 VanDerWaalsContact C-N 3.28Å; E232-K234 PolarHBondContact O-N 2.99Å; E232-K235 PolarHBondContact O-N 3.37Å; E232-K235 IonicContact OE1-NZ 3.21Å; E232-L236 WeakPolarHBondContact O-CG 3.44Å; E232-L236 PolarHBondContact O-N 3Å
233R81.1Confident78.1Confident155 Ų155115.8 Ų115.859%0.58556%0.564SS**Hα-helixtrans-62.4-32.7175.2-73.9175.3179.5-1324.8112.9E229 E231 R237E229-R233 WeakPolarHBondContact O-CB 3.4Å; E229-R233 VanDerWaalsContact O-CG 3.24Å; E229-R233 WeakPolarHBondContact O-CG 3.47Å; E229-R233 PolarHBondContact O-N 3.21Å; E229-R233 IonicContact OE1-CZ 2.9Å; E229-R233 IonicContact OE1-NE 3.99Å; E229-R233 PolarHBondContact OE1-NE 3.04Å; E229-R233 IonicContact OE1-NH2 2.79Å; E229-R233 PolarHBondContact OE1-NH2 3.19Å; E231-R233 VanDerWaalsContact C-N 3.34Å; E231-R233 PolarHBondContact O-N 3.44Å; R233-R237 PolarHBondContact O-N 3.47Å
234K82.6Confident77Confident153 Ų153114.7 Ų114.767%0.66557%0.569SS**Hα-helixtrans-69.9-42.9174.3-74.2171-176.41780111.3A230 E231 E232 R237 Q238A230-K234 VanDerWaalsContact O-CG 3.3Å; A230-K234 WeakPolarHBondContact O-CG 3.34Å; A230-K234 PolarHBondContact O-N 2.97Å; E231-K234 WeakPolarHBondContact O-CB 3.48Å; E231-K234 PolarHBondContact O-N 3.36Å; E231-K234 VanDerWaalsContact O-N 3.09Å; E232-K234 VanDerWaalsContact C-N 3.28Å; E232-K234 PolarHBondContact O-N 2.99Å; K234-R237 PolarHBondContact O-N 3.26Å; K234-Q238 PolarHBondContact O-N 3.26Å
235K82.4Confident75.8Confident97 Ų97113.3 Ų113.342%0.42258%0.575SS.*Hα-helixtrans-60.7-47.3176.1-73.1177.4-174.5156.20111.7E231 E232 R237 Q238 E239E231-K235 PolarHBondContact O-N 2.97Å; E231-K235 VanDerWaalsContact OE1-CE 3.28Å; E231-K235 WeakPolarHBondContact OE1-CE 3.39Å; E231-K235 IonicContact OE1-NZ 2.82Å; E231-K235 PolarHBondContact OE1-NZ 3.1Å; E232-K235 PolarHBondContact O-N 3.37Å; E232-K235 IonicContact OE1-NZ 3.21Å; K235-R237 VanDerWaalsContact C-N 3.34Å; K235-R237 PolarHBondContact O-N 3.19Å; K235-Q238 PolarHBondContact O-N 3.14Å; K235-Q238 VanDerWaalsContact O-N 3.15Å; K235-E239 PolarHBondContact O-N 2.96Å
236L79.9Confident74.7Confident107 Ų107114.8 Ų114.856%0.5659%0.585SS**Hα-helixtrans-58.5-43.3176.6-71.3172.1000112.4E232 Q238 E239 T240E232-L236 WeakPolarHBondContact O-CG 3.44Å; E232-L236 PolarHBondContact O-N 3Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 2.85Å; L236-E239 PolarHBondContact O-N 3.16Å; L236-T240 PolarHBondContact O-N 3.09Å; L236-T240 PolarHBondContact O-OG1 3.26Å
237R76.7Confident73.4Confident206 Ų206115.4 Ų115.478%0.77762%0.62SS**Hα-helixtrans-63.3-39.4176.5-83.3-176.3175.5-117.90.3112.9R233 K234 K235 G241R233-R237 PolarHBondContact O-N 3.47Å; K234-R237 PolarHBondContact O-N 3.26Å; K235-R237 VanDerWaalsContact C-N 3.34Å; K235-R237 PolarHBondContact O-N 3.19Å; R237-G241 PolarHBondContact O-N 3.26Å
238Q78.9Confident73Confident132 Ų132115.6 Ų115.662%0.61762%0.624SS**Hα-helixtrans-67.6-42.1178.1-166.3175.38.900111.2K234 K235 L236 G241 N242K234-Q238 PolarHBondContact O-N 3.26Å; K235-Q238 PolarHBondContact O-N 3.14Å; K235-Q238 VanDerWaalsContact O-N 3.15Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 2.85Å; Q238-G241 PolarHBondContact O-N 3.15Å; Q238-N242 PolarHBondContact O-N 3.14Å; Q238-N242 PolarHBondContact O-ND2 3.31Å; Q238-N242 VanDerWaalsContact O-ND2 3.13Å; Q238-N242 PolarHBondContact O-OD1 3.34Å
239E74.5Confident72.5Confident142 Ų142120 Ų12066%0.66464%0.64SS**Hα-helixtrans-65.5-39.8177-168.1158-178.100112.1K235 L236 G241 N242K235-E239 PolarHBondContact O-N 2.96Å; L236-E239 PolarHBondContact O-N 3.16Å; E239-G241 VanDerWaalsContact C-N 3.32Å; E239-G241 PolarHBondContact O-N 3.18Å; E239-N242 PolarHBondContact O-N 2.86Å
240T72.4Confident72.1Confident105 Ų105121.2 Ų121.264%0.64465%0.65SS**Hα-helixtrans-67-31.8175.8-37.80000112.4L236 N242L236-T240 PolarHBondContact O-N 3.09Å; L236-T240 PolarHBondContact O-OG1 3.26Å; T240-N242 VanDerWaalsContact C-N 3.32Å
241G66.1Low71.7Confident63 Ų63126.2 Ų126.265%0.64967%0.671SS**Hα-helixtrans-76-17.4176.900000114.4R237 Q238 E239R237-G241 PolarHBondContact O-N 3.26Å; Q238-G241 PolarHBondContact O-N 3.15Å; E239-G241 VanDerWaalsContact C-N 3.32Å; E239-G241 PolarHBondContact O-N 3.18Å
242N62.7Low71Confident116 Ų116127.6 Ų127.662%0.6268%0.683SS**THydrogen-bonded Turntrans-96.2-1.1-177.7-63.2-17.9000113.4Q238 E239 T240 P244Q238-N242 PolarHBondContact O-N 3.14Å; Q238-N242 PolarHBondContact O-ND2 3.31Å; Q238-N242 VanDerWaalsContact O-ND2 3.13Å; Q238-N242 PolarHBondContact O-OD1 3.34Å; E239-N242 PolarHBondContact O-N 2.86Å; T240-N242 VanDerWaalsContact C-N 3.32Å; N242-P244 VanDerWaalsContact O-CD 3.23Å; N242-P244 WeakPolarHBondContact O-CD 3.49Å
243V64.6Low70.1Confident99 Ų99128.9 Ų128.960%0.669%0.694SS**SBendtrans-74.7113.3174.7-177.60000108.2V245V243-V245 PolarHBondContact O-N 2.81Å
244P60.6Low69.4Low99 Ų99127 Ų12764%0.64370%0.702SS**  trans-65.1123.7175.826.5-30.5000108.4N242 I246N242-P244 VanDerWaalsContact O-CD 3.23Å; N242-P244 WeakPolarHBondContact O-CD 3.49Å; P244-I246 VanDerWaalsContact C-N 3.34Å; P244-I246 PolarHBondContact O-N 3.12Å
245V59.3Low68.3Low137 Ų137125 Ų12583%0.8371%0.705SS**  trans-64.599.6167.8177.40000106.3V243 A247V243-V245 PolarHBondContact O-N 2.81Å; V245-A247 PolarHBondContact O-N 3.29Å; V245-A247 VanDerWaalsContact O-N 3.1Å
246I57.8Low67.2Low166 Ų166127.3 Ų127.385%0.85173%0.729SS**  trans-73.499.7169.1-57172.8000105.3P244P244-I246 VanDerWaalsContact C-N 3.34Å; P244-I246 PolarHBondContact O-N 3.12Å
247A52.6Low66Low156 Ų156129.2 Ų129.2100%1.28974%0.744SS**  trans-100.1016900000109.6V245V245-A247 PolarHBondContact O-N 3.29Å; V245-A247 VanDerWaalsContact O-N 3.1Å

Retrieved 247 of 247 residues in 35.1 ms (Link to these results)