G4VKR3_SCHMA Loading...

FLZ-type domain-containing protein

AlphaFold DB (A0A5K4EWW4), UniProt , Accession G4VKR3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 203 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M43.5Very low52.2Low242 Ų242167.5 Ų167.5100%1.19288%0.879SS**  0114.60-77.4175158.200105.9
2A43.3Very low53.1Low113 Ų113169.6 Ų169.693%0.93488%0.876SS**  trans-75.1132-154.900000113.5
3S50.6Low53.2Low95 Ų95166.2 Ų166.266%0.66487%0.871SS**  trans-83145.4-174.7-48.20000112.9
4E52Low53.5Low184 Ų184160.7 Ų160.786%0.8685%0.853SS**  trans35.593.5132.8-57.4174.6134.200118.1
5E54.2Low53.6Low185 Ų185156.7 Ų156.786%0.86485%0.852SS**  trans-170104.2156.9-113.6178.8171.900109.9
6L53Low53.9Low171 Ų171160.8 Ų160.890%0.89585%0.851SS**  trans178.317.8152.8-102.4148.5000116.8
7N54.5Low54.4Low165 Ų165165.4 Ų165.488%0.88285%0.854SS**  trans-102.126.9-179.5-83.4-21.7000115.8
8N56Low55.3Low155 Ų155162.3 Ų162.383%0.82985%0.849SS**  trans-113.250.8175.1-76.5-21.8000112.6V10N8-V10 PolarHBondContact O-N 3.43Å
9L51.9Low56.4Low170 Ų170163.9 Ų163.989%0.8985%0.849SS**  trans-74.583.9169.8-158.871.5000109.5R11L9-R11 PolarHBondContact O-N 3.25Å
10V56.5Low57.3Low127 Ų127159.6 Ų159.677%0.7783%0.831SS**  trans-53.2103.7170.5177.30000108.4N8 K12N8-V10 PolarHBondContact O-N 3.43Å; V10-K12 PolarHBondContact O-N 2.95Å; V10-K12 VanDerWaalsContact O-N 3.1Å
11R58.1Low58.3Low235 Ų235157.4 Ų157.489%0.88782%0.821SS**  trans-60.2114.1172.5-89.8-177.1-176.7149.81.8108.4L9L9-R11 PolarHBondContact O-N 3.25Å
12K63.3Low60Low193 Ų193152.2 Ų152.284%0.83980%0.795SS**PPolyproline II helixtrans-58.1126.6167.3-72.7176.5177.2175.40108.7V10 S14V10-K12 PolarHBondContact O-N 2.95Å; V10-K12 VanDerWaalsContact O-N 3.1Å; K12-S14 PolarHBondContact O-N 2.93Å
13P54Low61.7Low125 Ų125149.5 Ų149.581%0.81277%0.773SS**PPolyproline II helixtrans-62.4125.8173.423.4-29.4000108.7A15P13-A15 PolarHBondContact O-N 3.27Å
14S57.4Low62.8Low90 Ų90146.9 Ų146.963%0.62976%0.757SS**PPolyproline II helixtrans-58.9124.5176.4-173.40000109.1K12 R16K12-S14 PolarHBondContact O-N 2.93Å; S14-R16 PolarHBondContact O-N 2.93Å; S14-R16 WeakPolarHBondContact OG-CG 3.27Å
15A56.1Low63.9Low101 Ų101141.5 Ų141.584%0.83573%0.734SS**  trans-70.728.3176.300000113.3P13 R17P13-A15 PolarHBondContact O-N 3.27Å; A15-R17 VanDerWaalsContact C-N 3.34Å; A15-R17 PolarHBondContact O-N 2.89Å
16R58.6Low64.9Low222 Ų222136.1 Ų136.184%0.83871%0.713SS**  trans-7197.1172.1-77.8-179.9172.6-153.4-2.4107S14 S18S14-R16 PolarHBondContact O-N 2.93Å; S14-R16 WeakPolarHBondContact OG-CG 3.27Å; R16-S18 PolarHBondContact O-N 3.25Å; R16-S18 VanDerWaalsContact O-N 3.12Å
17R62.5Low65.8Low238 Ų238132.5 Ų132.590%0.89870%0.695SS**  trans-34.7120.3164.7-72.8178.8160.1-135.4-3.4108A15 K19A15-R17 VanDerWaalsContact C-N 3.34Å; A15-R17 PolarHBondContact O-N 2.89Å; R17-K19 PolarHBondContact O-N 2.93Å
18S69.9Low66.4Low110 Ų110130.1 Ų130.177%0.76968%0.678SS**PPolyproline II helixtrans-48.4140.7173.946.30000108.8R16R16-S18 PolarHBondContact O-N 3.25Å; R16-S18 VanDerWaalsContact O-N 3.12Å
19K75.3Confident66.7Low194 Ų194129 Ų12984%0.84367%0.668SS**PPolyproline II helixtrans-49.4136.5173-73.4177.8176.91770108.3R17 D21R17-K19 PolarHBondContact O-N 2.93Å; K19-D21 PolarHBondContact O-N 3.47Å
20P75.8Confident67Low76 Ų76129.4 Ų129.449%0.49466%0.658SS.*PPolyproline II helixtrans-56.2135.1174.824.2-32.2000108.8A24 L25P20-A24 HydrophobicContact CB-CB 4.21Å; P20-L25 HydrophobicContact CB-CD2 4.19Å; P20-L25 HydrophobicContact CB-CG 4.29Å; P20-L25 HydrophobicContact CG-CD2 3.83Å; P20-L25 HydrophobicContact CG-CG 4.22Å
21D78.3Confident67Low115 Ų115129.6 Ų129.662%0.61565%0.654SS**PPolyproline II helixtrans-65.1155.7173.4-173.419000110K19 A23 A24 L25K19-D21 PolarHBondContact O-N 3.47Å; D21-A23 PolarHBondContact O-N 3.43Å; D21-A24 WeakPolarHBondContact O-CA 3.49Å; D21-A24 WeakPolarHBondContact O-CB 3.45Å; D21-A24 PolarHBondContact O-N 3.06Å; D21-L25 PolarHBondContact O-N 2.87Å; D21-L25 VanDerWaalsContact O-N 3.12Å
22M78.8Confident66.8Low132 Ų132126.1 Ų126.165%0.6565%0.645SS**Hα-helixtrans-55.5-35.8178.8-80.8-62.6-59.600111.7A24 L25 V26M22-A24 PolarHBondContact O-N 3.1Å; M22-L25 PolarHBondContact O-N 3.25Å; M22-L25 HydrophobicContact SD-CD1 4.23Å; M22-V26 WeakPolarHBondContact O-CG2 3.39Å; M22-V26 PolarHBondContact O-N 3.12Å; M22-V26 VanDerWaalsContact O-N 3.07Å
23A78.7Confident66.1Low56 Ų56124.3 Ų124.346%0.46364%0.64SS.*Hα-helixtrans-60.6-42.9173.300000112.4D21 L25 V26 D27D21-A23 PolarHBondContact O-N 3.43Å; A23-L25 VanDerWaalsContact C-N 3.33Å; A23-L25 PolarHBondContact O-N 3.1Å; A23-V26 PolarHBondContact O-N 2.84Å; A23-D27 PolarHBondContact O-N 3.45Å
24A73.9Confident65.8Low41 Ų41121.4 Ų121.434%0.33962%0.623SS.*Hα-helixtrans-67.8-32.217900000112.6P20 D21 M22 Q28P20-A24 HydrophobicContact CB-CB 4.21Å; D21-A24 WeakPolarHBondContact O-CA 3.49Å; D21-A24 WeakPolarHBondContact O-CB 3.45Å; D21-A24 PolarHBondContact O-N 3.06Å; M22-A24 PolarHBondContact O-N 3.1Å; A24-Q28 WeakPolarHBondContact O-CG 3.47Å; A24-Q28 PolarHBondContact O-N 3.33Å
25L74.5Confident65.3Low71 Ų71122.7 Ų122.737%0.37263%0.629SS.*Hα-helixtrans-69.8-42.1174.2-68.2174.9000112P20 D21 M22 A23 D27 Q28 Q29P20-L25 HydrophobicContact CB-CD2 4.19Å; P20-L25 HydrophobicContact CB-CG 4.29Å; P20-L25 HydrophobicContact CG-CD2 3.83Å; P20-L25 HydrophobicContact CG-CG 4.22Å; D21-L25 PolarHBondContact O-N 2.87Å; D21-L25 VanDerWaalsContact O-N 3.12Å; M22-L25 PolarHBondContact O-N 3.25Å; M22-L25 HydrophobicContact SD-CD1 4.23Å; A23-L25 VanDerWaalsContact C-N 3.33Å; A23-L25 PolarHBondContact O-N 3.1Å; L25-D27 VanDerWaalsContact C-N 3.35Å; L25-Q28 PolarHBondContact O-N 2.89Å; L25-Q29 PolarHBondContact O-N 3.46Å; L25-Q29 VanDerWaalsContact O-N 3.16Å
26V76.1Confident64.7Low71 Ų71127.6 Ų127.643%0.4363%0.626SS.*Hα-helixtrans-64.6-40.3176173.20000111M22 A23 Q29 R30M22-V26 WeakPolarHBondContact O-CG2 3.39Å; M22-V26 PolarHBondContact O-N 3.12Å; M22-V26 VanDerWaalsContact O-N 3.07Å; A23-V26 PolarHBondContact O-N 2.84Å; V26-Q29 PolarHBondContact O-N 3.12Å; V26-R30 PolarHBondContact O-N 3.19Å
27D70.5Confident63.9Low96 Ų96122 Ų12251%0.51362%0.621SS.*Hα-helixtrans-67.1-36.1176.8-80.4-12.3000112.6A23 L25 Q29 R30 L31A23-D27 PolarHBondContact O-N 3.45Å; L25-D27 VanDerWaalsContact C-N 3.35Å; D27-Q29 VanDerWaalsContact C-N 3.31Å; D27-Q29 PolarHBondContact O-N 2.9Å; D27-R30 PolarHBondContact O-N 3.34Å; D27-L31 PolarHBondContact O-N 3.43Å
28Q67.5Low63Low114 Ų114122.1 Ų122.153%0.53362%0.622SS.*Hα-helixtrans-61.8-39.1171.8-79.8-175.9-10.200111.8A24 L25 L31 F32A24-Q28 WeakPolarHBondContact O-CG 3.47Å; A24-Q28 PolarHBondContact O-N 3.33Å; L25-Q28 PolarHBondContact O-N 2.89Å; Q28-L31 PolarHBondContact O-N 3.32Å; Q28-F32 WeakPolarHBondContact O-CD2 3.36Å
29Q62.1Low62.1Low132 Ų132125.1 Ų125.162%0.61762%0.621SS**Hα-helixtrans-68.9-34.9174.1-80.4179.7-26.800112.8L25 V26 D27 L31 F32 Q33L25-Q29 PolarHBondContact O-N 3.46Å; L25-Q29 VanDerWaalsContact O-N 3.16Å; V26-Q29 PolarHBondContact O-N 3.12Å; D27-Q29 VanDerWaalsContact C-N 3.31Å; D27-Q29 PolarHBondContact O-N 2.9Å; Q29-L31 VanDerWaalsContact C-N 3.32Å; Q29-L31 PolarHBondContact O-N 3.07Å; Q29-F32 PolarHBondContact O-N 2.96Å; Q29-Q33 PolarHBondContact O-N 2.97Å
30R59.4Low60.5Low179 Ų179120.9 Ų120.968%0.67561%0.613SS**Hα-helixtrans-63.1-36.1173.3-89.4-173.4-174.4-142.20.2112.9V26 D27 F32 Q33 S34V26-R30 PolarHBondContact O-N 3.19Å; D27-R30 PolarHBondContact O-N 3.34Å; R30-F32 PolarHBondContact O-N 3.5Å; R30-Q33 CarbonylContact O-C 3.58Å; R30-Q33 PolarHBondContact O-N 3.26Å; R30-S34 PolarHBondContact O-N 3.16Å
31L55.4Low59.1Low130 Ų130123.9 Ų123.968%0.68162%0.624SS**Hα-helixtrans-64.8-28.3176.7-78.3161000112.7D27 Q28 Q29 S34D27-L31 PolarHBondContact O-N 3.43Å; Q28-L31 PolarHBondContact O-N 3.32Å; Q29-L31 VanDerWaalsContact C-N 3.32Å; Q29-L31 PolarHBondContact O-N 3.07Å; L31-S34 WeakPolarHBondContact O-CB 3.36Å
32F54.2Low57.4Low162 Ų162126.2 Ų126.271%0.71163%0.629SS**Hα-helixtrans-82-16.6171.3-70.6-73.3000113.9Q28 Q29 R30 S34Q28-F32 WeakPolarHBondContact O-CD2 3.36Å; Q29-F32 PolarHBondContact O-N 2.96Å; R30-F32 PolarHBondContact O-N 3.5Å; F32-S34 VanDerWaalsContact C-N 3.3Å
33Q49.7Very low55.7Low155 Ų155128 Ų12872%0.72464%0.636SS**THydrogen-bonded Turntrans-86.6-0.2171.1-68.6-177.49.700113.3Q29 R30Q29-Q33 PolarHBondContact O-N 2.97Å; R30-Q33 CarbonylContact O-C 3.58Å; R30-Q33 PolarHBondContact O-N 3.26Å
34S46.6Very low54.2Low65 Ų65130.3 Ų130.346%0.45564%0.64SS.*SBendtrans-52.5125.5159.51700000107.7R30 L31 F32 W36R30-S34 PolarHBondContact O-N 3.16Å; L31-S34 WeakPolarHBondContact O-CB 3.36Å; F32-S34 VanDerWaalsContact C-N 3.3Å; S34-W36 PolarHBondContact O-N 3.15Å
35P47.4Very low52.8Low117 Ų117136.4 Ų136.476%0.7666%0.661SS**  trans-63.497.6172.327.2-29.3000105.2S37P35-S37 PolarHBondContact O-N 3.13Å
36W44.5Very low51.6Low204 Ų204137.9 Ų137.977%0.77368%0.678SS**  trans-49.7107.1155.7-79.244.8000103.1S34 R38S34-W36 PolarHBondContact O-N 3.15Å; W36-R38 VanDerWaalsContact C-N 3.28Å; W36-R38 PolarHBondContact O-N 3.29Å
37S40.6Very low50.5Low105 Ų105140.9 Ų140.973%0.73469%0.691SS**  trans-36.5100-179169.90000106.9P35 K39P35-S37 PolarHBondContact O-N 3.13Å; S37-K39 PolarHBondContact O-N 2.94Å
38R43Very low49.7Very low239 Ų239141 Ų14190%0.90270%0.695SS**  trans-6688.9170.1-82.7-171-164.4170.84.6102W36 P40W36-R38 VanDerWaalsContact C-N 3.28Å; W36-R38 PolarHBondContact O-N 3.29Å; R38-P40 VanDerWaalsContact O-N 3.12Å
39K52Low49.1Very low174 Ų174140.9 Ų140.976%0.75770%0.704SS**  trans-44.7124.1155.2-70180178.2178.50104.1S37 L41S37-K39 PolarHBondContact O-N 2.94Å; K39-L41 PolarHBondContact O-N 3.36Å
40P41.8Very low48.9Very low105 Ų105140.6 Ų140.668%0.68271%0.711SS**  trans-56.1112.6-174.121-30.2000107.2R38 F42R38-P40 VanDerWaalsContact O-N 3.12Å; P40-F42 HydrophobicContact CB-CB 4.42Å; P40-F42 HydrophobicContact CB-CD2 4.4Å; P40-F42 PolarHBondContact O-N 3.16Å
41L46Very low48.7Very low138 Ų138137.8 Ų137.872%0.72371%0.713SS**SBendtrans-71.529.7166.2-96.2165.6000110.3K39 L44K39-L41 PolarHBondContact O-N 3.36Å; L41-L44 HydrophobicContact CD2-CD1 4.03Å
42F43.6Very low48.8Very low164 Ų164134.5 Ų134.572%0.71970%0.701SS**  trans-122.763.4-177.9-60-72.4000108.1P40P40-F42 HydrophobicContact CB-CB 4.42Å; P40-F42 HydrophobicContact CB-CD2 4.4Å; P40-F42 PolarHBondContact O-N 3.16Å
43Q41.8Very low48.9Very low171 Ų171134 Ų13480%0.79971%0.705SS**  trans-14221.5151.5-1141782.600110.6E45Q43-E45 VanDerWaalsContact C-N 3.35Å
44L46.7Very low49.1Very low103 Ų103134 Ų13454%0.53971%0.705SS.*G310 helixtrans-85-8.2173.2-80.1160.4000112.8L41 S46 L47L41-L44 HydrophobicContact CD2-CD1 4.03Å; L44-S46 PolarHBondContact O-N 2.98Å; L44-S46 VanDerWaalsContact O-N 3.12Å; L44-L47 HydrophobicContact CD2-CD1 4.4Å; L44-L47 PolarHBondContact O-N 3.22Å
45E45.1Very low49.6Very low169 Ų169138.6 Ų138.679%0.7972%0.724SS**G310 helixtrans-64.8-10.4169.7-70.4168.7129.800112.6Q43Q43-E45 VanDerWaalsContact C-N 3.35Å
46S50.5Low49.7Very low102 Ų102139 Ų13971%0.71372%0.724SS**G310 helixtrans-86-8177.1176.60000114.3L44L44-S46 PolarHBondContact O-N 2.98Å; L44-S46 VanDerWaalsContact O-N 3.12Å
47L52.6Low49.5Very low135 Ų135132.6 Ų132.671%0.70772%0.721SS**SBendtrans-1236.2-171.9-71.5170.6000114L44 P49L44-L47 HydrophobicContact CD2-CD1 4.4Å; L44-L47 PolarHBondContact O-N 3.22Å; L47-P49 WeakPolarHBondContact O-CD 3.39Å
48V52.2Low49.7Very low99 Ų99133.1 Ų133.160%0.673%0.725SS**SBendtrans-89.7114.2169.5-1760000107.8V50V48-V50 PolarHBondContact O-N 3.45Å
49P56.4Low49.7Very low111 Ų111131.1 Ų131.172%0.72173%0.725SS**  trans-63.5103168.724.7-29.9000108.3L47 V51L47-P49 WeakPolarHBondContact O-CD 3.39Å; P49-V51 PolarHBondContact O-N 3.21Å; P49-V51 VanDerWaalsContact O-N 3.09Å
50V57.1Low49.6Very low125 Ų125128.3 Ų128.376%0.75873%0.725SS**  trans-71.6100.4168.31790000106.6V48 S52V48-V50 PolarHBondContact O-N 3.45Å; V50-S52 PolarHBondContact O-N 3.07Å
51V55.2Low49.7Very low120 Ų120128.2 Ų128.273%0.72773%0.727SS**  trans-84.1107.2172-167.40000107.6P49 L53P49-V51 PolarHBondContact O-N 3.21Å; P49-V51 VanDerWaalsContact O-N 3.09Å; V51-L53 PolarHBondContact O-N 3.07Å
52S57.2Low49.6Very low61 Ų61126.1 Ų126.143%0.42772%0.724SS.*  trans-69.3113.5172-85.50000111V50 H54V50-S52 PolarHBondContact O-N 3.07Å; S52-H54 WeakPolarHBondContact CB-CE1 3.13Å; S52-H54 WeakPolarHBondContact CB-NE2 3.32Å; S52-H54 PolarHBondContact O-N 3.2Å; S52-H54 VanDerWaalsContact O-N 3.16Å; S52-H54 PolarHBondContact OG-CE1 3.04Å; S52-H54 PolarHBondContact OG-NE2 3.22Å
53L57.4Low50Low151 Ų151125.8 Ų125.879%0.79173%0.728SS**G310 helixtrans-735.7178.2-80.9164.7000114.7V51V51-L53 PolarHBondContact O-N 3.07Å
54H53.3Low50.3Low157 Ų157125.3 Ų125.373%0.72773%0.725SS**G310 helixtrans-86.80.3-173.323.1-81.9000115.5S52S52-H54 WeakPolarHBondContact CB-CE1 3.13Å; S52-H54 WeakPolarHBondContact CB-NE2 3.32Å; S52-H54 PolarHBondContact O-N 3.2Å; S52-H54 VanDerWaalsContact O-N 3.16Å; S52-H54 PolarHBondContact OG-CE1 3.04Å; S52-H54 PolarHBondContact OG-NE2 3.22Å
55D56.3Low50.3Low160 Ų160131.4 Ų131.486%0.85674%0.741SS**G310 helixtrans-110.212.1179.8-105.5-19000114.1
56V51.3Low50.3Low127 Ų127131.1 Ų131.177%0.7774%0.744SS**SBendtrans-117.897.3179.6-167.60000109.5
57G38.6Very low50.1Low68 Ų68134 Ų13470%0.70175%0.751SS**  trans96.678.7161.200000115.3
58S46.2Very low49.6Very low116 Ų116135.6 Ų135.681%0.81176%0.757SS**  trans-14792.8143.7-83.60000107P60S58-P60 WeakPolarHBondContact O-CD 3.4Å
59H41.6Very low49.5Very low197 Ų197137.5 Ų137.591%0.91277%0.77SS**  trans-59.6115.6161.5-89.2-87.4000108.1
60P50.3Low48.8Very low115 Ų115138 Ų13875%0.74778%0.776SS**  trans-90.1116.5157.19.712.8000106.3S58 S62S58-P60 WeakPolarHBondContact O-CD 3.4Å; P60-S62 PolarHBondContact O-N 3.36Å
61S43.5Very low48.3Very low104 Ų104138 Ų13873%0.72778%0.781SS**  trans-40.7126.9158.749.10000110.8
62S45.6Very low47.8Very low94 Ų94138.3 Ų138.366%0.65778%0.783SS**  trans56.7113.5141.662.10000118.1P60P60-S62 PolarHBondContact O-N 3.36Å
63I51.9Low46.9Very low156 Ų156139.5 Ų139.580%0.880%0.797SS**  161.8135.2111.3-73.4147.6000108.8
64E47.9Very low46.4Very low161 Ų161140.9 Ų140.975%0.75280%0.799SS**  trans-30.9137.5173.7-56173.6134.700116.4
65R45.4Very low46.1Very low231 Ų231142.8 Ų142.887%0.87281%0.805SS**  175.9125.1107.6-93.2171.9131.486.74.3110.8
66L45.5Very low45.6Very low163 Ų163145.4 Ų145.485%0.85380%0.803SS**  trans-66.1132.2168.5-65159.6000109
67D46.3Very low45.1Very low162 Ų162149.1 Ų149.187%0.86681%0.81SS**  -158133.8128.7-116-29.9000112.5
68M43.3Very low45.7Very low169 Ų169153.2 Ų153.283%0.83381%0.814SS**  trans-80.4119.5-177.2-73.9-85.8174.700110
69T49.4Very low45.7Very low139 Ų139156.5 Ų156.585%0.85381%0.814SS**  trans-143.6117.115452.60000110.6
70S41.2Very low45.9Very low123 Ų123155.5 Ų155.586%0.8681%0.809SS**  trans-71.3139.8167.766.50000109.8
71S47.3Very low46.1Very low123 Ų123155.9 Ų155.986%0.8681%0.812SS**  trans-140.8141.5155.4-168.70000112
72V44.6Very low46.1Very low128 Ų128156.5 Ų156.578%0.77682%0.816SS**  trans-75.1151.2-169.1165.50000110.8
73A38.4Very low46.2Very low86 Ų86155.8 Ų155.871%0.71182%0.816SS**  trans-40.4138.817200000114.4
74E47Very low46.1Very low180 Ų180153.9 Ų153.984%0.84182%0.817SS**  trans-160127.7137.8-115.4176.7159.100112.4R76E74-R76 PolarHBondContact O-N 3.45Å
75K46.5Very low46.2Very low197 Ų197155.5 Ų155.586%0.85782%0.822SS**  trans-60.3122.5177.2-66.9167174.71750110.5
76R45.4Very low46.2Very low214 Ų214150 Ų15081%0.80882%0.818SS**  trans-139.8119.8153.6-69.8-167.1-179.4169.53.3111.3E74 L78E74-R76 PolarHBondContact O-N 3.45Å; R76-L78 HydrophobicContact CB-CD1 4.39Å; R76-L78 PolarHBondContact O-N 3.41Å
77F42Very low46.3Very low206 Ų206147.9 Ų147.990%0.90482%0.817SS**  trans-54.8116.3168.9-74.5-101.7000110.9
78L49.8Very low46.6Very low153 Ų153145.5 Ų145.580%0.80181%0.813SS**  trans-139.4107162.5-91.698.3000111.3R76R76-L78 HydrophobicContact CB-CD1 4.39Å; R76-L78 PolarHBondContact O-N 3.41Å
79K46.2Very low47Very low186 Ų186144.6 Ų144.681%0.80981%0.812SS**  50.9105.2124-147.998.7166.7-168.10116.7
80H46.5Very low47.3Very low175 Ų175146 Ų14681%0.8181%0.814SS**  trans-53.4128.8166.8-21.4-83.1000111.2
81P54.5Low48.2Very low123 Ų123144.2 Ų144.280%0.79980%0.801SS**  trans-87.8117.2161.330.9-25000109.2A83P81-A83 PolarHBondContact O-N 3.26Å; P81-A83 VanDerWaalsContact O-N 3.16Å
82S44.5Very low48.4Very low117 Ų117145 Ų14582%0.81880%0.796SS**  trans-64108168.3-47.30000108.9S84S82-S84 PolarHBondContact O-N 3.42Å
83A46.7Very low49.2Very low79 Ų79146.9 Ų146.965%0.65380%0.8SS**  trans-81.2107.1170.600000108.8P81 F85P81-A83 PolarHBondContact O-N 3.26Å; P81-A83 VanDerWaalsContact O-N 3.16Å; A83-F85 WeakPolarHBondContact O-CD1 3.25Å; A83-F85 WeakPolarHBondContact O-CE1 2.9Å; A83-F85 PolarHBondContact O-N 3.04Å
84S49.2Very low50.1Low117 Ų117150.2 Ų150.282%0.81880%0.804SS**  trans-71.1117.9164.6-52.70000108.6S82S82-S84 PolarHBondContact O-N 3.42Å
85F49.8Very low50.6Low195 Ų195150.1 Ų150.186%0.85580%0.804SS**  trans-86.8108.8168.912.2-85.1000107.8A83 S87A83-F85 WeakPolarHBondContact O-CD1 3.25Å; A83-F85 WeakPolarHBondContact O-CE1 2.9Å; A83-F85 PolarHBondContact O-N 3.04Å; F85-S87 PolarHBondContact O-N 3.06Å
86S47Very low50.9Low115 Ų115147.3 Ų147.380%0.80480%0.798SS**  trans-68116.9162-76.40000108.2
87S47.2Very low51.4Low118 Ų118143.8 Ų143.883%0.82580%0.796SS**  trans-75.9123.5162.862.80000108.5F85F85-S87 PolarHBondContact O-N 3.06Å
88S52.9Low51.9Low112 Ų112140.2 Ų140.278%0.78379%0.786SS**  trans-119.9119.4163.140.70000107.5
89D51.6Low52.4Low151 Ų151139.2 Ų139.281%0.80778%0.78SS**  trans-48.2128.2174.4-67.1-66.8000111.7
90D55.7Low52.9Low169 Ų169137.5 Ų137.590%0.90478%0.78SS**  trans-120.2113.2157.4-123.5-26.7000106.8
91S58.6Low53.5Low84 Ų84133.7 Ų133.759%0.58777%0.772SS**  trans-86.3152.2-173.7-560000110.7
92D52.7Low53.8Low141 Ų141134.6 Ų134.675%0.75477%0.769SS**  trans7587.7150.1-49.5-30.6000118.9
93I60.5Low54.7Low167 Ų167134.2 Ų134.286%0.85676%0.758SS**  trans-123.599.2140.3-64.3179.7000108
94I57Low55.6Low156 Ų156138 Ų13880%0.876%0.762SS**  trans-79.8113.1162.4-62.6166.6000106
95E58.6Low56.4Low177 Ų177139.2 Ų139.283%0.82776%0.76SS**  trans-141.8131.1152-135.9173.9-166.500111.3
96N52.9Low57.3Low138 Ų138136.5 Ų136.574%0.73875%0.754SS**  trans-94.9101.1-158.8-179.832.1000108.3
97N56.6Low58.5Low141 Ų141138.4 Ų138.475%0.75476%0.755SS**  trans-11888.1168.7-80.4-24.5000109.7I99N97-I99 HydrophobicContact CB-CG1 4.27Å; N97-I99 PolarHBondContact O-N 3.43Å
98N50.9Low59.8Low131 Ų131137.6 Ų137.670%0.70174%0.741SS**  trans-59.296.4157.5175.918000109N100N98-N100 PolarHBondContact OD1-OD1 2.9Å
99I60.1Low61.1Low132 Ų132135.8 Ų135.868%0.67773%0.726SS**  trans-113.589.5166-37.6172.8000106.3N97 S101N97-I99 HydrophobicContact CB-CG1 4.27Å; N97-I99 PolarHBondContact O-N 3.43Å; I99-S101 PolarHBondContact O-N 3.01Å
100N58.2Low61.7Low150 Ų150135.5 Ų135.580%0.80272%0.724SS**  trans-67.782.7160.5-88.930.5000108.1N98N98-N100 PolarHBondContact OD1-OD1 2.9Å
101S58.4Low62.2Low94 Ų94131.3 Ų131.366%0.65771%0.708SS**  trans-93102.615752.10000106.8I99 D103I99-S101 PolarHBondContact O-N 3.01Å; S101-D103 PolarHBondContact O-N 3.49Å; S101-D103 VanDerWaalsContact O-N 3.1Å
102I61.8Low62.5Low142 Ų142131.3 Ų131.373%0.72871%0.705SS**  trans-73.1100.1170.4-146.9146.3000105.4E104I102-E104 HydrophobicContact CG1-CG 4.4Å; I102-E104 HydrophobicContact CG2-CG 3.91Å; I102-E104 PolarHBondContact O-N 3.17Å
103D62.9Low63.2Low110 Ų110131.7 Ų131.759%0.58870%0.7SS**  trans-81.593.7177.8-164.2-2.3000106.9S101 D105S101-D103 PolarHBondContact O-N 3.49Å; S101-D103 VanDerWaalsContact O-N 3.1Å; D103-D105 VanDerWaalsContact C-N 3.3Å
104E65Low63.6Low157 Ų157129.6 Ų129.673%0.73469%0.69SS**  trans-90.210.3-176.8-63.7-114.1129.300112.3I102I102-E104 HydrophobicContact CG1-CG 4.4Å; I102-E104 HydrophobicContact CG2-CG 3.91Å; I102-E104 PolarHBondContact O-N 3.17Å
105D65.8Low63.8Low144 Ų144127.2 Ų127.277%0.7769%0.685SS**  trans-97-2.9-177.7-85.1-36.7000114.3D103 D107D103-D105 VanDerWaalsContact C-N 3.3Å; D105-D107 PolarHBondContact O-N 3.39Å
106D69.4Low63.9Low137 Ų137126.5 Ų126.573%0.73369%0.686SS**THydrogen-bonded Turntrans-78.9-10.5-176.8-85.6-31.5000115.1
107D72.6Confident63.9Low156 Ų156129.1 Ų129.183%0.83469%0.69SS**THydrogen-bonded Turntrans-98.814.1-173.4-81.2-35.9000114.9D105 P109D105-D107 PolarHBondContact O-N 3.39Å; D107-P109 VanDerWaalsContact O-CD 3.27Å; D107-P109 WeakPolarHBondContact O-CD 3.36Å
108L73.1Confident63.7Low100 Ų100128 Ų12852%0.52469%0.694SS.*  trans-70.9116.3-179.3-162.470.9000111.2L110 T112 F113L108-L110 PolarHBondContact O-N 2.74Å; L108-T112 HydrophobicContact CD1-CG2 4.41Å; L108-T112 HydrophobicContact CD2-CG2 4.11Å; L108-T112 HydrophobicContact CG-CG2 4.4Å; L108-F113 HydrophobicContact CD2-CE2 3.84Å; L108-F113 HydrophobicContact CD2-CZ 3.97Å
109P79.9Confident63.6Low74 Ų74128.5 Ų128.548%0.48170%0.697SS.*  trans-65.8139.9-177.727.1-34.1000110.5D107 S111 T112D107-P109 VanDerWaalsContact O-CD 3.27Å; D107-P109 WeakPolarHBondContact O-CD 3.36Å; P109-S111 PolarHBondContact O-N 2.72Å; P109-T112 WeakPolarHBondContact O-CB 3.18Å; P109-T112 PolarHBondContact O-N 3.08Å; P109-T112 PolarHBondContact O-OG1 3.15Å
110L66Low62.7Low146 Ų146128.5 Ų128.576%0.76470%0.703SS**G310 helixtrans-53.3-18.2178.6-71170.3000113.8L108 T112 F113L108-L110 PolarHBondContact O-N 2.74Å; L110-T112 PolarHBondContact O-N 3.03Å; L110-F113 PolarHBondContact O-N 3.24Å; L110-F113 VanDerWaalsContact O-N 3.16Å
111S65.9Low61.9Low81 Ų81129.2 Ų129.257%0.56671%0.705SS**G310 helixtrans-60.1-23.717351.50000113.9P109 F113 L114P109-S111 PolarHBondContact O-N 2.72Å; S111-F113 PolarHBondContact O-N 2.77Å; S111-L114 PolarHBondContact O-N 3.4Å
112T64.5Low61.2Low84 Ų84129.4 Ų129.452%0.51570%0.703SS.*G310 helixtrans-71.8-21.5178.4-38.60000112.1L108 P109 L110L108-T112 HydrophobicContact CD1-CG2 4.41Å; L108-T112 HydrophobicContact CD2-CG2 4.11Å; L108-T112 HydrophobicContact CG-CG2 4.4Å; P109-T112 WeakPolarHBondContact O-CB 3.18Å; P109-T112 PolarHBondContact O-N 3.08Å; P109-T112 PolarHBondContact O-OG1 3.15Å; L110-T112 PolarHBondContact O-N 3.03Å
113F66.6Low60.4Low149 Ų149128.3 Ų128.365%0.65470%0.699SS**G310 helixtrans-97.34.7-179.2-64.2-80.8000113.6L108 L110 S111L108-F113 HydrophobicContact CD2-CE2 3.84Å; L108-F113 HydrophobicContact CD2-CZ 3.97Å; L110-F113 PolarHBondContact O-N 3.24Å; L110-F113 VanDerWaalsContact O-N 3.16Å; S111-F113 PolarHBondContact O-N 2.77Å
114L68.8Low59.4Low123 Ų123130.3 Ų130.364%0.64471%0.709SS**SBendtrans-84.1126.8176.6-65179.7000109.9S111 L116S111-L114 PolarHBondContact O-N 3.4Å; L114-L116 PolarHBondContact O-N 2.93Å; L114-L116 VanDerWaalsContact O-N 3.13Å
115P62.2Low58.3Low106 Ų106128.2 Ų128.269%0.68871%0.708SS**PPolyproline II helixtrans-54.1122.4173.6-23.331.9000110.1K117P115-K117 PolarHBondContact O-N 2.82Å; P115-K117 VanDerWaalsContact O-N 3.15Å
116L61.2Low57.3Low162 Ų162127.5 Ų127.585%0.84871%0.708SS**PPolyproline II helixtrans-57120.5172.1-71.7165000107.7L114 S118L114-L116 PolarHBondContact O-N 2.93Å; L114-L116 VanDerWaalsContact O-N 3.13Å; L116-S118 PolarHBondContact O-N 3.5Å
117K52.2Low56.2Low192 Ų192126.9 Ų126.984%0.83570%0.704SS**  trans-64.4104.3174.2-68174.8178.7173.40107.7P115 D119P115-K117 PolarHBondContact O-N 2.82Å; P115-K117 VanDerWaalsContact O-N 3.15Å; K117-D119 VanDerWaalsContact C-N 3.33Å; K117-D119 PolarHBondContact O-N 2.99Å
118S51.5Low55Low118 Ų118125.6 Ų125.683%0.82570%0.695SS**  trans-67.492.1171-47.30000109L116 T120L116-S118 PolarHBondContact O-N 3.5Å; S118-T120 PolarHBondContact O-N 2.69Å
119D48.6Very low53.8Low142 Ų142125 Ų12576%0.75970%0.696SS**  trans-62.9118.1167.4-80.1-36.8000109.2K117K117-D119 VanDerWaalsContact C-N 3.33Å; K117-D119 PolarHBondContact O-N 2.99Å
120T41.3Very low52.1Low131 Ų131127.2 Ų127.280%0.80470%0.704SS**  trans56.885.115746.70000117.7S118S118-T120 PolarHBondContact O-N 2.69Å
121L43.2Very low51.1Low165 Ų165127.1 Ų127.186%0.86470%0.699SS**  trans-137.690.5141.8-15271.6000111.1
122T42.6Very low50Low99 Ų99131.1 Ų131.161%0.60771%0.709SS**  trans10.2121.6141.744.30000118.7
123N45.1Very low48.9Very low119 Ų119136.7 Ų136.764%0.63672%0.722SS**SBend79.894.9129.6-54.7-9.6000117.4T125N123-T125 PolarHBondContact O-N 2.72Å
124N41.6Very low47.7Very low152 Ų152135.2 Ų135.281%0.81373%0.727SS**  trans44.173.314147.2-83.7000116.4
125T43Very low46.3Very low113 Ų113136.4 Ų136.469%0.69373%0.734SS**  trans-115.6102.7159.6-53.50000109.1N123 I127N123-T125 PolarHBondContact O-N 2.72Å; T125-I127 VanDerWaalsContact C-N 3.29Å; T125-I127 HydrophobicContact CG2-CD1 4.23Å; T125-I127 HydrophobicContact CG2-CG1 3.46Å; T125-I127 VanDerWaalsContact CG2-CG1 3.46Å; T125-I127 PolarHBondContact O-N 3.38Å
126T44.5Very low45.2Very low128 Ų128137.7 Ų137.779%0.78574%0.735SS**  trans-67.391.4159.9-52.90000106.9I128T126-I128 HydrophobicContact CG2-CG1 3.94Å; T126-I128 PolarHBondContact O-N 3.5Å; T126-I128 VanDerWaalsContact O-N 3.15Å
127I46.1Very low44.2Very low125 Ų125136.5 Ų136.564%0.64173%0.73SS**  trans-79.297169.6-58.2-174.4000106.6T125 T129T125-I127 VanDerWaalsContact C-N 3.29Å; T125-I127 HydrophobicContact CG2-CD1 4.23Å; T125-I127 HydrophobicContact CG2-CG1 3.46Å; T125-I127 VanDerWaalsContact CG2-CG1 3.46Å; T125-I127 PolarHBondContact O-N 3.38Å; I127-T129 VanDerWaalsContact C-N 3.29Å; I127-T129 HydrophobicContact CG2-CG2 4.03Å; I127-T129 PolarHBondContact O-N 3.04Å; I127-T129 VanDerWaalsContact O-N 3.08Å
128I48.1Very low43.8Very low128 Ų128133.8 Ų133.866%0.65673%0.725SS**  trans-72.589164.8-55.5174.8000106.1T126 N130T126-I128 HydrophobicContact CG2-CG1 3.94Å; T126-I128 PolarHBondContact O-N 3.5Å; T126-I128 VanDerWaalsContact O-N 3.15Å; I128-N130 PolarHBondContact O-N 2.82Å
129T47.5Very low43.4Very low88 Ų88134.9 Ų134.954%0.5472%0.721SS.*  trans-78.778.4166.8180000108.9I127 H131I127-T129 VanDerWaalsContact C-N 3.29Å; I127-T129 HydrophobicContact CG2-CG2 4.03Å; I127-T129 PolarHBondContact O-N 3.04Å; I127-T129 VanDerWaalsContact O-N 3.08Å; T129-H131 VanDerWaalsContact C-N 3.26Å; T129-H131 PolarHBondContact O-N 3.11Å
130N43Very low43.2Very low120 Ų120133.3 Ų133.364%0.64272%0.721SS**  trans-68.192.6154.9-80.7-17.1000106.9I128 H132I128-N130 PolarHBondContact O-N 2.82Å; N130-H132 PolarHBondContact O-N 3.02Å
131H45.9Very low42.9Very low144 Ų144133.6 Ų133.667%0.66772%0.718SS**  trans-71.773.1161.4-67.7-71.5000108.4T129 Y133T129-H131 VanDerWaalsContact C-N 3.26Å; T129-H131 PolarHBondContact O-N 3.11Å; H131-Y133 VanDerWaalsContact C-N 3.32Å; H131-Y133 HydrophobicContact CB-CE2 4.45Å; H131-Y133 PolarHBondContact O-N 2.06Å
132H42Very low42.8Very low165 Ų165131.3 Ų131.376%0.76472%0.716SS**  trans-66.393.9161.7-100.766.8000107.2N130N130-H132 PolarHBondContact O-N 3.02Å
133Y42.4Very low42.5Very low201 Ų201133.4 Ų133.479%0.78872%0.723SS**  trans-71131.7158.2-81.2-83.6000108.1H131 N135H131-Y133 VanDerWaalsContact C-N 3.32Å; H131-Y133 HydrophobicContact CB-CE2 4.45Å; H131-Y133 PolarHBondContact O-N 2.06Å; Y133-N135 PolarHBondContact O-N 3.48Å; Y133-N135 VanDerWaalsContact O-N 3.11Å
134P41.2Very low42.5Very low119 Ų119135.1 Ų135.177%0.77373%0.732SS**  trans-65.3115.4-175.824.2-31.1000110.3N136P134-N136 VanDerWaalsContact C-N 3.34Å; P134-N136 PolarHBondContact O-N 3.39Å
135N38.8Very low42.4Very low147 Ų147133.8 Ų133.879%0.78674%0.735SS**  trans-6394.4162.4179.911000108Y133 N137Y133-N135 PolarHBondContact O-N 3.48Å; Y133-N135 VanDerWaalsContact O-N 3.11Å; N135-N137 VanDerWaalsContact C-N 3.31Å; N135-N137 PolarHBondContact O-N 3.35Å
136N39.7Very low42.4Very low134 Ų134135.4 Ų135.472%0.71774%0.739SS**  trans-78.887.1177.6-163.47.7000109.1P134 N138P134-N136 VanDerWaalsContact C-N 3.34Å; P134-N136 PolarHBondContact O-N 3.39Å; N136-N138 PolarHBondContact O-N 2.89Å; N136-N138 PolarHBondContact OD1-ND2 3.09Å
137N39.5Very low42.4Very low136 Ų136137.7 Ų137.773%0.72774%0.74SS**  trans-78.498.2170.9-158.39.6000108N135N135-N137 VanDerWaalsContact C-N 3.31Å; N135-N137 PolarHBondContact O-N 3.35Å
138N44.8Very low42.5Very low136 Ų136138.9 Ų138.973%0.72775%0.748SS**  trans-137.597.2167.1-89.8-34.6000110.9N136 S140N136-N138 PolarHBondContact O-N 2.89Å; N136-N138 PolarHBondContact OD1-ND2 3.09Å; N138-S140 PolarHBondContact O-N 2.93Å
139N42.1Very low42.6Very low141 Ų141140.9 Ų140.975%0.75476%0.755SS**  trans-21.9117.8151.5179.214.8000114.4
140S44.4Very low42.8Very low109 Ų109142.7 Ų142.776%0.76276%0.761SS**  trans-170.996.5138-81.90000111.1N138 S142N138-S140 PolarHBondContact O-N 2.93Å; S140-S142 PolarHBondContact O-N 3.34Å
141N35.7Very low43.3Very low137 Ų137144.2 Ų144.273%0.73377%0.769SS**  trans21.897.2138.9-155.620.6000117.3
142S41.7Very low43.9Very low117 Ų117141.3 Ų141.382%0.81876%0.755SS**  trans-158.3114.2148.7-83.50000110S140 N144S140-S142 PolarHBondContact O-N 3.34Å; S142-N144 PolarHBondContact O-N 3.17Å
143N36.3Very low44.7Very low143 Ų143139.6 Ų139.677%0.76575%0.75SS**  trans-56.8115.1176-54.4-44000109.8
144N43.7Very low45.5Very low155 Ų155132.5 Ų132.583%0.82973%0.728SS**  trans-172.790.8154.7-84.1-25.3000107.7S142 N146S142-N144 PolarHBondContact O-N 3.17Å; N144-N146 VanDerWaalsContact C-N 3.35Å; N144-N146 PolarHBondContact O-N 3.23Å
145S39.5Very low46.6Very low123 Ų123130.9 Ų130.986%0.8672%0.72SS**  trans-7383.4178.857.20000110.9
146N43.5Very low48Very low147 Ų147125.1 Ų125.179%0.78669%0.691SS**  trans-111.487.8166.8-81.2-19.2000108.8N144 D148N144-N146 VanDerWaalsContact C-N 3.35Å; N144-N146 PolarHBondContact O-N 3.23Å; N146-D148 PolarHBondContact O-N 3.07Å
147H45Very low49.3Very low176 Ų176121.2 Ų121.282%0.81567%0.673SS**  trans3386.1151.6-136.6-15.9000115.5Q149H147-Q149 VanDerWaalsContact C-N 3.33Å; H147-Q149 PolarHBondContact O-N 3.28Å
148D47.2Very low50.6Low150 Ų150116.4 Ų116.480%0.80265%0.649SS**  trans-56.1100.4165.5-76.2-44.5000108.6N146 N150N146-D148 PolarHBondContact O-N 3.07Å; D148-N150 VanDerWaalsContact C-N 3.25Å; D148-N150 PolarHBondContact O-N 3.42Å
149Q49.9Very low51.8Low171 Ų171117.2 Ų117.280%0.79966%0.66SS**  trans-62.497.5164.1-66.6-176.110.600105.2H147 N151H147-Q149 VanDerWaalsContact C-N 3.33Å; H147-Q149 PolarHBondContact O-N 3.28Å; Q149-N151 PolarHBondContact O-N 3.16Å
150N52Low52.9Low125 Ų125117.5 Ų117.567%0.66865%0.654SS**  trans-43.2105.9169.5-83.8-34.3000108.2D148 F152D148-N150 VanDerWaalsContact C-N 3.25Å; D148-N150 PolarHBondContact O-N 3.42Å; N150-F152 PolarHBondContact O-N 3.12Å
151N54.4Low54.1Low153 Ų153117.6 Ų117.682%0.81865%0.652SS**  trans-56.690.5173.6-116.79.8000107Q149 I153Q149-N151 PolarHBondContact O-N 3.16Å; N151-I153 PolarHBondContact O-N 3.37Å
152F57.6Low55.6Low82 Ų82112.5 Ų112.536%0.3663%0.629SS.*  trans-73.698.6176.7-176.1-97.2000105.4N150 P154 T182 A186N150-F152 PolarHBondContact O-N 3.12Å; F152-P154 HydrophobicContact CD1-CB 4.48Å; F152-P154 HydrophobicContact CE1-CB 4.26Å; F152-P154 WeakPolarHBondContact O-CD 3.35Å; F152-T182 HydrophobicContact CE1-CG2 4.17Å; F152-A186 HydrophobicContact CD1-CB 4.28Å; F152-A186 HydrophobicContact CE1-CB 4.24Å
153I59.2Low56.8Low130 Ų130109.4 Ų109.467%0.66761%0.605SS**  trans-79.2110.6171-59.1176.5000105.8N151 S155N151-I153 PolarHBondContact O-N 3.37Å; I153-S155 PolarHBondContact O-N 2.11Å
154P60.6Low58.2Low51 Ų51109.7 Ų109.733%0.33161%0.606SS.*  trans-66.199.2179.926.6-33.1000109.5F152 F173 T182F152-P154 HydrophobicContact CD1-CB 4.48Å; F152-P154 HydrophobicContact CE1-CB 4.26Å; F152-P154 WeakPolarHBondContact O-CD 3.35Å; P154-F173 HydrophobicContact CB-CZ 4.15Å; P154-F173 HydrophobicContact CG-CZ 4.4Å; P154-T182 HydrophobicContact CB-CG2 3.13Å
155S64Low59.5Low86 Ų86109.1 Ų109.160%0.60160%0.603SS**  trans-92.1143.8173.859.20000110.7I153 P157I153-S155 PolarHBondContact O-N 2.11Å; S155-P157 WeakPolarHBondContact O-CD 3.42Å
156C66.9Low61Low25 Ų25104.6 Ų104.617%0.16957%0.569CS.*  trans-53.3122.6174.1-164.30000110.8C158 F173 C178C156-C158 HydrophobicContact CB-CB 4.48Å; C156-C158 WeakPolarHBondContact CB-SG 3.22Å; C156-C158 PolarHBondContact O-N 3.46Å; C156-C158 WeakPolarHBondContact SG-CB 3.4Å; C156-C158 CovalentContact SG-SG 2.06Å; C156-C158 PolarHBondContact SG-SG 3.42Å; C156-F173 HydrophobicContact CB-CD1 4.43Å; C156-C178 WeakPolarHBondContact SG-CB 3.47Å; C156-C178 PolarHBondContact SG-SG 3.05Å
157P67.1Low62.6Low53 Ų53102.7 Ų102.734%0.34457%0.565SS.*SBendtrans-81.831.9-179.95.710.3000111.1S155 R181 T182S155-P157 WeakPolarHBondContact O-CD 3.42Å; P157-R181 PolarHBondContact O-NH2 3.32Å; P157-T182 WeakPolarHBondContact CD-OG1 3.4Å
158C67.2Low64.2Low34 Ų34103.1 Ų103.123%0.2356%0.559CS.*SBendtrans-129.1146.1-168.572.40000108.5C156 K160 C174 C178C156-C158 HydrophobicContact CB-CB 4.48Å; C156-C158 WeakPolarHBondContact CB-SG 3.22Å; C156-C158 PolarHBondContact O-N 3.46Å; C156-C158 WeakPolarHBondContact SG-CB 3.4Å; C156-C158 CovalentContact SG-SG 2.06Å; C156-C158 PolarHBondContact SG-SG 3.42Å; C158-K160 PolarHBondContact O-N 2.92Å; C158-K160 PolarHBondContact SG-O 2.85Å; C158-C174 HydrophobicContact CB-CB 4.49Å; C158-C174 WeakPolarHBondContact SG-CB 3.44Å; C158-C178 VanDerWaalsContact CB-SG 3.51Å; C158-C178 PolarHBondContact SG-SG 2.99Å
159T69.7Low65.5Low154 Ų15496.3 Ų96.395%0.94552%0.522SS*.SBendtrans-813.1173.647.90000113
160K65.9Low66.6Low147 Ų14794.4 Ų94.464%0.63952%0.518SS*.SBendtrans-84139.7-178.2-69.8-177.5-178.31780109.7C158 C174C158-K160 PolarHBondContact O-N 2.92Å; C158-K160 PolarHBondContact SG-O 2.85Å; K160-C174 HydrophobicContact CB-CB 3.73Å
161P68.2Low67.6Low111 Ų11189.8 Ų89.872%0.72150%0.5SS*.PPolyproline II helixtrans-59.1145.7173.827.6-33.9000109.3
162A68.1Low68.6Low29 Ų2987.1 Ų87.124%0.2449%0.485CS..PPolyproline II helixtrans-63.1147.4173.400000110.6L164 G171 F173A162-L164 PolarHBondContact O-N 3.16Å; A162-L164 VanDerWaalsContact O-N 3.17Å; A162-G171 WeakPolarHBondContact CB-O 3.29Å; A162-F173 WeakPolarHBondContact CA-O 3.3Å
163V66.4Low69.7Low52 Ų5283.8 Ų83.832%0.31547%0.471SS..  trans-77.9105.1177.6-179.10000107.3D165 D166 L169 F173 C174V163-D165 HydrophobicContact CG1-CB 4.35Å; V163-D165 PolarHBondContact O-N 3.05Å; V163-D166 HydrophobicContact CB-CB 4.42Å; V163-D166 HydrophobicContact CG1-CB 3.86Å; V163-L169 HydrophobicContact CB-CD1 4.26Å; V163-F173 PolarHBondContact N-O 3.02Å; V163-C174 WeakPolarHBondContact CG2-O 3.13Å
164L66.2Low70.9Confident149 Ų14978.5 Ų78.578%0.7845%0.445SS*.THydrogen-bonded Turntrans-70.1-23.6176.8-78.8148.7000112.4A162A162-L164 PolarHBondContact O-N 3.16Å; A162-L164 VanDerWaalsContact O-N 3.17Å
165D71.1Confident71.9Confident144 Ų14478 Ų7877%0.7744%0.442SS*.THydrogen-bonded Turntrans-85.1-7.9-175.1-56.2-39.8000113.3V163 P167V163-D165 HydrophobicContact CG1-CB 4.35Å; V163-D165 PolarHBondContact O-N 3.05Å; D165-P167 WeakPolarHBondContact O-CD 3.3Å
166D71.6Confident72.8Confident27 Ų2777.1 Ų77.114%0.14443%0.434CS..  trans-106.7100.7178-165.4-21.9000109.8V163 R168 L169V163-D166 HydrophobicContact CB-CB 4.42Å; V163-D166 HydrophobicContact CG1-CB 3.86Å; D166-R168 PolarHBondContact O-N 3.4Å; D166-R168 VanDerWaalsContact OD1-CB 3.25Å; D166-R168 WeakPolarHBondContact OD1-CB 3.3Å; D166-R168 WeakPolarHBondContact OD1-CG 3.46Å; D166-R168 IonicContact OD1-CZ 3.39Å; D166-R168 PolarHBondContact OD1-N 3.3Å; D166-R168 IonicContact OD1-NE 2.74Å; D166-R168 PolarHBondContact OD1-NE 2.88Å; D166-R168 IonicContact OD1-NH2 3.49Å; D166-R168 IonicContact OD2-CZ 3.68Å; D166-R168 IonicContact OD2-NE 3.73Å; D166-R168 PolarHBondContact OD2-NE 2.95Å; D166-R168 IonicContact OD2-NH2 2.9Å; D166-R168 PolarHBondContact OD2-NH2 3.15Å; D166-L169 HydrophobicContact CB-CB 4.46Å; D166-L169 HydrophobicContact CB-CD1 4.13Å; D166-L169 HydrophobicContact CB-CG 4.15Å; D166-L169 PolarHBondContact O-N 2.91Å
167P75.8Confident73.7Confident108 Ų10882.7 Ų82.770%0.70146%0.457SS*.G310 helixtrans-61.9-17.9-179.224.1-32.6000112.7D165 L169D165-P167 WeakPolarHBondContact O-CD 3.3Å; P167-L169 VanDerWaalsContact C-N 3.25Å; P167-L169 PolarHBondContact O-N 2.91Å
168R78.1Confident74.5Confident185 Ų18580.6 Ų80.670%0.69844%0.444SS*.G310 helixtrans-74.2-18.4177-55.4172.5-64.21773.4113D166D166-R168 PolarHBondContact O-N 3.4Å; D166-R168 VanDerWaalsContact OD1-CB 3.25Å; D166-R168 WeakPolarHBondContact OD1-CB 3.3Å; D166-R168 WeakPolarHBondContact OD1-CG 3.46Å; D166-R168 IonicContact OD1-CZ 3.39Å; D166-R168 PolarHBondContact OD1-N 3.3Å; D166-R168 IonicContact OD1-NE 2.74Å; D166-R168 PolarHBondContact OD1-NE 2.88Å; D166-R168 IonicContact OD1-NH2 3.49Å; D166-R168 IonicContact OD2-CZ 3.68Å; D166-R168 IonicContact OD2-NE 3.73Å; D166-R168 PolarHBondContact OD2-NE 2.95Å; D166-R168 IonicContact OD2-NH2 2.9Å; D166-R168 PolarHBondContact OD2-NH2 3.15Å
169L76.2Confident75.4Confident6 Ų681.3 Ų81.33%0.03145%0.445CS..G310 helixtrans-99.9-0.2-178.6-59.8-177.6000112.2V163 D166 P167 G171 L172 F173 L179V163-L169 HydrophobicContact CB-CD1 4.26Å; D166-L169 HydrophobicContact CB-CB 4.46Å; D166-L169 HydrophobicContact CB-CD1 4.13Å; D166-L169 HydrophobicContact CB-CG 4.15Å; D166-L169 PolarHBondContact O-N 2.91Å; P167-L169 VanDerWaalsContact C-N 3.25Å; P167-L169 PolarHBondContact O-N 2.91Å; L169-G171 PolarHBondContact O-N 2.93Å; L169-L172 PolarHBondContact O-N 3.36Å; L169-F173 HydrophobicContact CB-CB 4.34Å; L169-F173 HydrophobicContact CD2-CB 4.27Å; L169-L179 HydrophobicContact CD2-CB 4.17Å; L169-L179 HydrophobicContact CD2-CD2 3.89Å
170D72.7Confident76.2Confident131 Ų13177.5 Ų77.570%0.70142%0.418SS*.THydrogen-bonded Turntrans49.819.5-178.6-72.9-32.3000114.8L172D170-L172 HydrophobicContact CB-CD1 4.15Å; D170-L172 HydrophobicContact CB-CG 4.26Å; D170-L172 PolarHBondContact O-N 3.35Å
171G73.5Confident77.2Confident29 Ų2975.7 Ų75.730%0.29941%0.407SS..THydrogen-bonded Turntrans62.420.4-169.900000113.9A162 L169A162-G171 WeakPolarHBondContact CB-O 3.29Å; L169-G171 PolarHBondContact O-N 2.93Å
172L74.8Confident78Confident96 Ų9670.5 Ų70.550%0.50337%0.373SS..THydrogen-bonded Turntrans-99.1-24.6177.4-67.9173.8000112.9L169 D170L169-L172 PolarHBondContact O-N 3.36Å; D170-L172 HydrophobicContact CB-CD1 4.15Å; D170-L172 HydrophobicContact CB-CG 4.26Å; D170-L172 PolarHBondContact O-N 3.35Å
173F81.3Confident78.9Confident13 Ų1372.6 Ų72.66%0.05739%0.386CS..  trans-123.5146.1-174-56.7-82.5000112.9P154 C156 A162 V163 L169 S175 C178 L179 T182P154-F173 HydrophobicContact CB-CZ 4.15Å; P154-F173 HydrophobicContact CG-CZ 4.4Å; C156-F173 HydrophobicContact CB-CD1 4.43Å; A162-F173 WeakPolarHBondContact CA-O 3.3Å; V163-F173 PolarHBondContact N-O 3.02Å; L169-F173 HydrophobicContact CB-CB 4.34Å; L169-F173 HydrophobicContact CD2-CB 4.27Å; F173-S175 VanDerWaalsContact C-N 3.31Å; F173-S175 PolarHBondContact O-N 2.9Å; F173-C178 HydrophobicContact CB-CB 4.27Å; F173-L179 HydrophobicContact CB-CB 4.23Å; F173-L179 HydrophobicContact CD1-CB 4.16Å; F173-L179 HydrophobicContact CD1-CD1 4.5Å; F173-L179 HydrophobicContact CD2-CB 4.14Å; F173-L179 HydrophobicContact CD2-CD1 3.77Å; F173-L179 HydrophobicContact CD2-CG 4.48Å; F173-L179 HydrophobicContact CE1-CD1 4.25Å; F173-L179 HydrophobicContact CE2-CD1 3.48Å; F173-L179 VanDerWaalsContact CE2-CD1 3.48Å; F173-L179 HydrophobicContact CG-CB 3.9Å; F173-L179 HydrophobicContact CG-CD1 4.27Å; F173-L179 HydrophobicContact CZ-CD1 3.75Å; F173-T182 HydrophobicContact CE1-CG2 4.26Å
174C82.7Confident80Confident18 Ų1875.7 Ų75.712%0.12240%0.396CS..SBendtrans-76.3-17.8-179.587.40000114.9C158 K160 V163 C178C158-C174 HydrophobicContact CB-CB 4.49Å; C158-C174 WeakPolarHBondContact SG-CB 3.44Å; K160-C174 HydrophobicContact CB-CB 3.73Å; V163-C174 WeakPolarHBondContact CG2-O 3.13Å; C174-C178 HydrophobicContact CB-CB 4.23Å; C174-C178 WeakPolarHBondContact CB-SG 3.35Å; C174-C178 WeakPolarHBondContact SG-CB 3.24Å; C174-C178 CovalentContact SG-SG 2.11Å; C174-C178 PolarHBondContact SG-SG 3.1Å
175S81.9Confident80.9Confident40 Ų4072.3 Ų72.328%0.2838%0.377SS..SBendtrans-174.9165.3-17366.10000109F173 E177 C178 L179F173-S175 VanDerWaalsContact C-N 3.31Å; F173-S175 PolarHBondContact O-N 2.9Å; S175-E177 VanDerWaalsContact C-N 3.25Å; S175-E177 PolarHBondContact O-N 3.19Å; S175-E177 PolarHBondContact OG-N 3.22Å; S175-C178 VanDerWaalsContact O-CB 3.3Å; S175-C178 WeakPolarHBondContact O-CB 3.37Å; S175-C178 PolarHBondContact O-N 3.39Å; S175-C178 VanDerWaalsContact O-N 3.16Å; S175-C178 PolarHBondContact OG-N 2.98Å; S175-C178 VanDerWaalsContact OG-N 3.12Å; S175-L179 PolarHBondContact O-N 3.16Å; S175-L179 VanDerWaalsContact O-N 3.17Å
176T83.9Confident81.5Confident69 Ų6967.2 Ų67.242%0.42336%0.355SS..Hα-helixtrans-59.2-36.3170.7-44.10000112.1C178 L179 I180T176-C178 VanDerWaalsContact C-N 3.32Å; T176-C178 PolarHBondContact O-N 3.01Å; T176-L179 WeakPolarHBondContact O-CB 3.42Å; T176-L179 PolarHBondContact O-N 3.19Å; T176-I180 HydrophobicContact CG2-CD1 3.96Å; T176-I180 HydrophobicContact CG2-CG1 4.41Å; T176-I180 VanDerWaalsContact O-CG1 3.3Å; T176-I180 WeakPolarHBondContact O-CG1 3.46Å; T176-I180 PolarHBondContact O-N 2.82Å
177E85.3Confident82.3Confident142 Ų14271.2 Ų71.266%0.66437%0.371SS*.Hα-helixtrans-61.3-40.4175.1-62-60.6139.300112.3S175 R181S175-E177 VanDerWaalsContact C-N 3.25Å; S175-E177 PolarHBondContact O-N 3.19Å; S175-E177 PolarHBondContact OG-N 3.22Å; E177-R181 WeakPolarHBondContact O-CB 3.38Å; E177-R181 PolarHBondContact O-N 3.12Å
178C84.1Confident82.6Confident9 Ų969.6 Ų69.66%0.06136%0.357CS..Hα-helixtrans-61.4-45.6176-84.20000110.6C156 C158 F173 C174 S175 T176 T182C156-C178 WeakPolarHBondContact SG-CB 3.47Å; C156-C178 PolarHBondContact SG-SG 3.05Å; C158-C178 VanDerWaalsContact CB-SG 3.51Å; C158-C178 PolarHBondContact SG-SG 2.99Å; F173-C178 HydrophobicContact CB-CB 4.27Å; C174-C178 HydrophobicContact CB-CB 4.23Å; C174-C178 WeakPolarHBondContact CB-SG 3.35Å; C174-C178 WeakPolarHBondContact SG-CB 3.24Å; C174-C178 CovalentContact SG-SG 2.11Å; C174-C178 PolarHBondContact SG-SG 3.1Å; S175-C178 VanDerWaalsContact O-CB 3.3Å; S175-C178 WeakPolarHBondContact O-CB 3.37Å; S175-C178 PolarHBondContact O-N 3.39Å; S175-C178 VanDerWaalsContact O-N 3.16Å; S175-C178 PolarHBondContact OG-N 2.98Å; S175-C178 VanDerWaalsContact OG-N 3.12Å; T176-C178 VanDerWaalsContact C-N 3.32Å; T176-C178 PolarHBondContact O-N 3.01Å; C178-T182 PolarHBondContact O-N 3.11Å; C178-T182 PolarHBondContact O-OG1 2.73Å; C178-T182 VanDerWaalsContact O-OG1 3.07Å
179L85.7Confident82.7Confident49 Ų4965.1 Ų65.126%0.25734%0.34SS..Hα-helixtrans-62.1-51.8175.5171.964.4000112.1L169 F173 S175 T176 R181 T182 C183L169-L179 HydrophobicContact CD2-CB 4.17Å; L169-L179 HydrophobicContact CD2-CD2 3.89Å; F173-L179 HydrophobicContact CB-CB 4.23Å; F173-L179 HydrophobicContact CD1-CB 4.16Å; F173-L179 HydrophobicContact CD1-CD1 4.5Å; F173-L179 HydrophobicContact CD2-CB 4.14Å; F173-L179 HydrophobicContact CD2-CD1 3.77Å; F173-L179 HydrophobicContact CD2-CG 4.48Å; F173-L179 HydrophobicContact CE1-CD1 4.25Å; F173-L179 HydrophobicContact CE2-CD1 3.48Å; F173-L179 VanDerWaalsContact CE2-CD1 3.48Å; F173-L179 HydrophobicContact CG-CB 3.9Å; F173-L179 HydrophobicContact CG-CD1 4.27Å; F173-L179 HydrophobicContact CZ-CD1 3.75Å; S175-L179 PolarHBondContact O-N 3.16Å; S175-L179 VanDerWaalsContact O-N 3.17Å; T176-L179 WeakPolarHBondContact O-CB 3.42Å; T176-L179 PolarHBondContact O-N 3.19Å; L179-R181 VanDerWaalsContact C-N 3.32Å; L179-R181 PolarHBondContact O-N 2.89Å; L179-T182 PolarHBondContact O-N 2.86Å; L179-T182 VanDerWaalsContact O-N 3.09Å; L179-C183 PolarHBondContact O-N 3.34Å; L179-C183 PolarHBondContact O-SG 2.91Å; L179-C183 VanDerWaalsContact O-SG 3.39Å
180I87.7Confident83.1Confident73 Ų7371.2 Ų71.237%0.37436%0.362SS..Hα-helixtrans-55.7-47.9-178.7-70.9165.8000110.5T176 T182 C183 H184T176-I180 HydrophobicContact CG2-CD1 3.96Å; T176-I180 HydrophobicContact CG2-CG1 4.41Å; T176-I180 VanDerWaalsContact O-CG1 3.3Å; T176-I180 WeakPolarHBondContact O-CG1 3.46Å; T176-I180 PolarHBondContact O-N 2.82Å; I180-T182 VanDerWaalsContact C-N 3.31Å; I180-T182 PolarHBondContact O-N 3.43Å; I180-C183 WeakPolarHBondContact O-CB 3.42Å; I180-C183 PolarHBondContact O-N 3.16Å; I180-C183 VanDerWaalsContact O-N 3.15Å; I180-H184 PolarHBondContact O-CD2 3.36Å; I180-H184 PolarHBondContact O-N 2.87Å
181R85.6Confident83.5Confident109 Ų10967.1 Ų67.141%0.41134%0.34SS..Hα-helixtrans-58.1-43.1178.4-178.4169.658.21534.5112.1P157 E177 L179 H184 E185P157-R181 PolarHBondContact O-NH2 3.32Å; E177-R181 WeakPolarHBondContact O-CB 3.38Å; E177-R181 PolarHBondContact O-N 3.12Å; L179-R181 VanDerWaalsContact C-N 3.32Å; L179-R181 PolarHBondContact O-N 2.89Å; R181-H184 WeakPolarHBondContact O-CB 3.48Å; R181-H184 PolarHBondContact O-N 2.9Å; R181-E185 WeakPolarHBondContact O-CG 3.47Å; R181-E185 PolarHBondContact O-N 3.25Å
182T84.7Confident83.8Confident2 Ų272.7 Ų72.71%0.01235%0.352CS..Hα-helixtrans-69.5-34.4178.7-500000112.4F152 P154 P157 F173 C178 L179 I180 E185 A186F152-T182 HydrophobicContact CE1-CG2 4.17Å; P154-T182 HydrophobicContact CB-CG2 3.13Å; P157-T182 WeakPolarHBondContact CD-OG1 3.4Å; F173-T182 HydrophobicContact CE1-CG2 4.26Å; C178-T182 PolarHBondContact O-N 3.11Å; C178-T182 PolarHBondContact O-OG1 2.73Å; C178-T182 VanDerWaalsContact O-OG1 3.07Å; L179-T182 PolarHBondContact O-N 2.86Å; L179-T182 VanDerWaalsContact O-N 3.09Å; I180-T182 VanDerWaalsContact C-N 3.31Å; I180-T182 PolarHBondContact O-N 3.43Å; T182-E185 PolarHBondContact O-N 3Å; T182-A186 WeakPolarHBondContact O-CB 3.36Å; T182-A186 PolarHBondContact O-N 3.09Å
183C88.5Confident83.9Confident73 Ų7373.1 Ų73.149%0.49336%0.355SS..Hα-helixtrans-61.5-43.1170.9-67.10000111.9L179 I180 A186 F187L179-C183 PolarHBondContact O-N 3.34Å; L179-C183 PolarHBondContact O-SG 2.91Å; L179-C183 VanDerWaalsContact O-SG 3.39Å; I180-C183 WeakPolarHBondContact O-CB 3.42Å; I180-C183 PolarHBondContact O-N 3.16Å; I180-C183 VanDerWaalsContact O-N 3.15Å; C183-A186 PolarHBondContact O-N 3.32Å; C183-F187 WeakPolarHBondContact O-CB 3.44Å; C183-F187 PolarHBondContact O-N 3.41Å
184H88.4Confident83.5Confident117 Ų11776.9 Ų76.954%0.54237%0.372SS..Hα-helixtrans-59.6-47.5174-81.8-79.9000111.8I180 R181 A186 F187 D188I180-H184 PolarHBondContact O-CD2 3.36Å; I180-H184 PolarHBondContact O-N 2.87Å; R181-H184 WeakPolarHBondContact O-CB 3.48Å; R181-H184 PolarHBondContact O-N 2.9Å; H184-A186 VanDerWaalsContact C-N 3.35Å; H184-A186 PolarHBondContact O-N 3.29Å; H184-F187 PolarHBondContact O-N 2.81Å; H184-D188 PolarHBondContact O-N 3.41Å
185E85.1Confident82.5Confident78 Ų7882.7 Ų82.736%0.36440%0.397SS..Hα-helixtrans-62.7-40.1178.9-72.1174.2-167.300112.7R181 T182 R189R181-E185 WeakPolarHBondContact O-CG 3.47Å; R181-E185 PolarHBondContact O-N 3.25Å; T182-E185 PolarHBondContact O-N 3Å; E185-R189 WeakPolarHBondContact O-CB 3.34Å; E185-R189 PolarHBondContact O-N 3.44Å
186A84.7Confident81.1Confident38 Ų3886 Ų8631%0.31442%0.42SS..Hα-helixtrans-64.7-43.5175.700000111.3F152 T182 C183 H184 R189 W190F152-A186 HydrophobicContact CD1-CB 4.28Å; F152-A186 HydrophobicContact CE1-CB 4.24Å; T182-A186 WeakPolarHBondContact O-CB 3.36Å; T182-A186 PolarHBondContact O-N 3.09Å; C183-A186 PolarHBondContact O-N 3.32Å; H184-A186 VanDerWaalsContact C-N 3.35Å; H184-A186 PolarHBondContact O-N 3.29Å; A186-R189 PolarHBondContact O-N 2.81Å; A186-W190 WeakPolarHBondContact O-CB 3.17Å; A186-W190 PolarHBondContact O-N 2.77Å
187F87.1Confident79.7Confident111 Ų11188.7 Ų88.749%0.48743%0.43SS..Hα-helixtrans-64-45176.3-175.4-105000111.9C183 H184 R189 W190 L191C183-F187 WeakPolarHBondContact O-CB 3.44Å; C183-F187 PolarHBondContact O-N 3.41Å; H184-F187 PolarHBondContact O-N 2.81Å; F187-R189 VanDerWaalsContact C-N 3.27Å; F187-R189 PolarHBondContact O-N 2.88Å; F187-W190 HydrophobicContact CD2-CE3 4.19Å; F187-W190 AromaticContact CE2-CE3 3.95Å; F187-W190 HydrophobicContact CE2-CE3 3.95Å; F187-W190 HydrophobicContact CE2-CZ3 4.01Å; F187-W190 WeakPolarHBondContact O-CB 3.49Å; F187-W190 PolarHBondContact O-N 3.38Å; F187-L191 HydrophobicContact CD1-CD1 3.8Å; F187-L191 HydrophobicContact CD1-CG 4.19Å; F187-L191 HydrophobicContact CE1-CD1 3.39Å; F187-L191 HydrophobicContact CE1-CD2 4.33Å; F187-L191 HydrophobicContact CE1-CG 3.88Å; F187-L191 HydrophobicContact CZ-CD1 4.02Å; F187-L191 HydrophobicContact CZ-CD2 4.11Å; F187-L191 HydrophobicContact CZ-CG 4.08Å; F187-L191 WeakPolarHBondContact O-CG 3.12Å; F187-L191 PolarHBondContact O-N 3.2Å
188D82.9Confident77.9Confident74 Ų7490.7 Ų90.740%0.39644%0.436SS..Hα-helixtrans-62.5-36.1176.4-73.2-20000112H184 R192H184-D188 PolarHBondContact O-N 3.41Å; D188-R192 WeakPolarHBondContact O-CG 3.36Å; D188-R192 PolarHBondContact O-N 3.32Å; D188-R192 PolarHBondContact O-NH1 3.41Å
189R79.9Confident76.4Confident90 Ų9097.6 Ų97.634%0.3447%0.473SS..Hα-helixtrans-69.4-41.1175.7-168.5176.6-121-116.61111.3E185 A186 F187 R192 N193E185-R189 WeakPolarHBondContact O-CB 3.34Å; E185-R189 PolarHBondContact O-N 3.44Å; A186-R189 PolarHBondContact O-N 2.81Å; F187-R189 VanDerWaalsContact C-N 3.27Å; F187-R189 PolarHBondContact O-N 2.88Å; R189-R192 PolarHBondContact O-N 3.16Å; R189-N193 WeakPolarHBondContact O-CB 3.1Å; R189-N193 PolarHBondContact O-N 3.38Å; R189-N193 PolarHBondContact O-OD1 3.41Å
190W84.8Confident74.5Confident134 Ų134103.4 Ų103.451%0.50850%0.504SS..Hα-helixtrans-59.6-49.3172.7178.782000110.9A186 F187 R192 N193 H194A186-W190 WeakPolarHBondContact O-CB 3.17Å; A186-W190 PolarHBondContact O-N 2.77Å; F187-W190 HydrophobicContact CD2-CE3 4.19Å; F187-W190 AromaticContact CE2-CE3 3.95Å; F187-W190 HydrophobicContact CE2-CE3 3.95Å; F187-W190 HydrophobicContact CE2-CZ3 4.01Å; F187-W190 WeakPolarHBondContact O-CB 3.49Å; F187-W190 PolarHBondContact O-N 3.38Å; W190-R192 PolarHBondContact O-N 3Å; W190-N193 PolarHBondContact O-N 2.96Å; W190-N193 VanDerWaalsContact O-N 3.16Å; W190-H194 AromaticContact CD1-CD2 3.29Å; W190-H194 AromaticContact CD1-NE2 3.44Å; W190-H194 AromaticContact CD2-CD2 3.91Å; W190-H194 AromaticContact CE2-CD2 3.51Å; W190-H194 AromaticContact CE2-NE2 3.99Å; W190-H194 AromaticContact CG-CD2 3.78Å; W190-H194 AromaticContact NE1-CD2 3.1Å; W190-H194 PolarHBondContact NE1-CD2 3.41Å; W190-H194 AromaticContact NE1-NE2 3.16Å; W190-H194 PolarHBondContact NE1-NE2 3.21Å; W190-H194 VanDerWaalsContact NE1-NE2 3.16Å; W190-H194 PolarHBondContact O-CD2 3.37Å; W190-H194 PolarHBondContact O-N 3.47Å
191L81.4Confident72.5Confident45 Ų45105.1 Ų105.124%0.23652%0.523CS..Hα-helixtrans-55.1-50.8174.5-75.5-179.1000111.3F187 N193 H194 H195F187-L191 HydrophobicContact CD1-CD1 3.8Å; F187-L191 HydrophobicContact CD1-CG 4.19Å; F187-L191 HydrophobicContact CE1-CD1 3.39Å; F187-L191 HydrophobicContact CE1-CD2 4.33Å; F187-L191 HydrophobicContact CE1-CG 3.88Å; F187-L191 HydrophobicContact CZ-CD1 4.02Å; F187-L191 HydrophobicContact CZ-CD2 4.11Å; F187-L191 HydrophobicContact CZ-CG 4.08Å; F187-L191 WeakPolarHBondContact O-CG 3.12Å; F187-L191 PolarHBondContact O-N 3.2Å; L191-N193 VanDerWaalsContact C-N 3.3Å; L191-N193 PolarHBondContact O-N 3.11Å; L191-H194 PolarHBondContact O-N 3.24Å; L191-H195 WeakPolarHBondContact O-CB 3.22Å; L191-H195 PolarHBondContact O-CD2 2.97Å; L191-H195 PolarHBondContact O-N 3.31Å
192R78.8Confident70.6Confident146 Ų146107.7 Ų107.755%0.55154%0.543SS*.Hα-helixtrans-59-39.5178.5-74.7-172.9-60.3-87.9-1113D188 R189 W190 C196D188-R192 WeakPolarHBondContact O-CG 3.36Å; D188-R192 PolarHBondContact O-N 3.32Å; D188-R192 PolarHBondContact O-NH1 3.41Å; R189-R192 PolarHBondContact O-N 3.16Å; W190-R192 PolarHBondContact O-N 3Å; R192-C196 PolarHBondContact O-SG 3.27Å
193N78.1Confident68.4Low105 Ų105118.9 Ų118.956%0.56160%0.6SS**Hα-helixtrans-70.3-33.8179.7-69.1-7.6000112.5R189 W190 L191R189-N193 WeakPolarHBondContact O-CB 3.1Å; R189-N193 PolarHBondContact O-N 3.38Å; R189-N193 PolarHBondContact O-OD1 3.41Å; W190-N193 PolarHBondContact O-N 2.96Å; W190-N193 VanDerWaalsContact O-N 3.16Å; L191-N193 VanDerWaalsContact C-N 3.3Å; L191-N193 PolarHBondContact O-N 3.11Å
194H72.1Confident67.4Low92 Ų92121.2 Ų121.243%0.42661%0.606SS.*Hα-helixtrans-94.8-18.6-177.8-70.7-74.4000114.1W190 L191 C196 I197W190-H194 AromaticContact CD1-CD2 3.29Å; W190-H194 AromaticContact CD1-NE2 3.44Å; W190-H194 AromaticContact CD2-CD2 3.91Å; W190-H194 AromaticContact CE2-CD2 3.51Å; W190-H194 AromaticContact CE2-NE2 3.99Å; W190-H194 AromaticContact CG-CD2 3.78Å; W190-H194 AromaticContact NE1-CD2 3.1Å; W190-H194 PolarHBondContact NE1-CD2 3.41Å; W190-H194 AromaticContact NE1-NE2 3.16Å; W190-H194 PolarHBondContact NE1-NE2 3.21Å; W190-H194 VanDerWaalsContact NE1-NE2 3.16Å; W190-H194 PolarHBondContact O-CD2 3.37Å; W190-H194 PolarHBondContact O-N 3.47Å; L191-H194 PolarHBondContact O-N 3.24Å; H194-C196 PolarHBondContact O-N 2.95Å; H194-I197 PolarHBondContact O-N 3.45Å
195H61.3Low66.3Low140 Ų140121.4 Ų121.465%0.64861%0.609SS**THydrogen-bonded Turntrans-79.4-1.1173.4-81.7-70.7000114L191 I197L191-H195 WeakPolarHBondContact O-CB 3.22Å; L191-H195 PolarHBondContact O-CD2 2.97Å; L191-H195 PolarHBondContact O-N 3.31Å; H195-I197 PolarHBondContact O-N 3.44Å
196C53.3Low65.2Low110 Ų110123.8 Ų123.874%0.74362%0.623SS**THydrogen-bonded Turntrans-75.1-0.7165.6-60.40000113.2R192 H194R192-C196 PolarHBondContact O-SG 3.27Å; H194-C196 PolarHBondContact O-N 2.95Å
197I53.5Low64.1Low126 Ų126128.9 Ų128.965%0.64664%0.641SS**SBendtrans-106.973.3179.7-47.1173.1000109.4H194 H195H194-I197 PolarHBondContact O-N 3.45Å; H195-I197 PolarHBondContact O-N 3.44Å
198K48.6Very low62.6Low183 Ų183130 Ų13080%0.79665%0.65SS**SBendtrans165.690.9158.3-95.4159-176.7-176.80107.6
199N51.8Low61.3Low154 Ų154133.7 Ų133.782%0.82467%0.667SS**SBendtrans-173-7.3152.7-86.4-19.3000113.3
200D46.4Very low59.9Low172 Ų172136.9 Ų136.992%0.9269%0.691SS**SBendtrans-105.530.3-178.9-73.6-23.5000115.4
201S45.2Very low58Low108 Ų108137.1 Ų137.176%0.75571%0.705SS**  trans-14564.4173.663.10000111.8
202I45.9Very low56.1Low164 Ų164144.8 Ų144.884%0.84174%0.744SS**  trans-115.6106.3156-61.5175.4000105.3
203I38Very low54Low237 Ų237144.6 Ų144.6100%1.21576%0.761SS**  trans-78.60160.2-63.7172.9000107.2

Retrieved 203 of 203 residues in 30.8 ms (Link to these results)