A0A5K4F5V2_SCHMA Loading...

Glycine-rich cell wall structural protein 2-like

AlphaFold DB (A0A5K4F6C8), UniProt , Accession A0A5K4F5V2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 177 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
1M55.6Low65.6Low228 Ų228133.1 Ų133.1100%1.12369%0.691SS**  032.10-55.3-171.8-74.500113.4
2K59Low65.2Low196 Ų196127 Ų12785%0.85267%0.674SS**  trans-91.9-13-176.2-70.2-177.3178.4-178.20114.8
3Q57.6Low64.9Low181 Ų181125.3 Ų125.385%0.84666%0.664SS**SBendtrans-79.8-16.4-175.5-69.6-170.2-14.800114.3
4S66.8Low64.3Low83 Ų83119.1 Ų119.158%0.5864%0.644SS**Hα-helixtrans-75.7-26-177.967.40000113.4V8S4-V8 WeakPolarHBondContact O-CG2 3.47Å
5L66.7Low63.6Low114 Ų114121.1 Ų121.160%0.59764%0.64SS**Hα-helixtrans-73.2-36.3-172.8-131153.5000111.9V8 F9L5-V8 PolarHBondContact O-N 3.11Å; L5-F9 HydrophobicContact CD2-CD2 3.87Å; L5-F9 HydrophobicContact CD2-CE2 3.6Å; L5-F9 WeakPolarHBondContact O-CD2 3.36Å; L5-F9 PolarHBondContact O-N 2.87Å
6T68.6Low62.8Low92 Ų92117.3 Ų117.356%0.56463%0.632SS**Hα-helixtrans-66.5-38.2178.7-41.70000112.3V8 F9 L10T6-V8 VanDerWaalsContact C-N 3.32Å; T6-V8 PolarHBondContact O-N 3.22Å; T6-F9 PolarHBondContact O-N 2.89Å; T6-L10 PolarHBondContact O-N 3.03Å
7L69.7Low62Low122 Ų122115.1 Ų115.164%0.63962%0.624SS**Hα-helixtrans-63.2-40.2178.9-164.986.2000111.4F9 L10 V11L7-F9 PolarHBondContact O-N 3.11Å; L7-L10 PolarHBondContact O-N 2.85Å; L7-V11 WeakPolarHBondContact O-CG2 3.48Å; L7-V11 PolarHBondContact O-N 2.85Å
8V72.6Confident61.3Low99 Ų99111.4 Ų111.460%0.661%0.611SS**Hα-helixtrans-64.2-40.8178.5177.80000111.3S4 L5 T6 A12S4-V8 WeakPolarHBondContact O-CG2 3.47Å; L5-V8 PolarHBondContact O-N 3.11Å; T6-V8 VanDerWaalsContact C-N 3.32Å; T6-V8 PolarHBondContact O-N 3.22Å; V8-A12 PolarHBondContact O-N 2.92Å; V8-A12 VanDerWaalsContact O-N 3.14Å
9F68.1Low60.4Low134 Ų134113.3 Ų113.359%0.58861%0.609SS**Hα-helixtrans-64.3-40.9178-94.1-83.7000112.9L5 T6 L7 A12 I13L5-F9 HydrophobicContact CD2-CD2 3.87Å; L5-F9 HydrophobicContact CD2-CE2 3.6Å; L5-F9 WeakPolarHBondContact O-CD2 3.36Å; L5-F9 PolarHBondContact O-N 2.87Å; T6-F9 PolarHBondContact O-N 2.89Å; L7-F9 PolarHBondContact O-N 3.11Å; F9-A12 PolarHBondContact O-N 3.04Å; F9-I13 WeakPolarHBondContact O-CG1 3.47Å; F9-I13 PolarHBondContact O-N 3.32Å; F9-I13 VanDerWaalsContact O-N 3.1Å
10L67.7Low59.5Low117 Ų117113.2 Ų113.261%0.61361%0.613SS**Hα-helixtrans-67.7-39.7180-71170.6000112.5T6 L7 A12 I13 G14T6-L10 PolarHBondContact O-N 3.03Å; L7-L10 PolarHBondContact O-N 2.85Å; L10-A12 VanDerWaalsContact C-N 3.35Å; L10-I13 PolarHBondContact O-N 3.09Å; L10-G14 PolarHBondContact O-N 3.14Å
11V69.2Low58.6Low98 Ų98113 Ų11359%0.59462%0.616SS**Hα-helixtrans-64.9-40.2176.3175.30000110.9L7 G14 Y15L7-V11 WeakPolarHBondContact O-CG2 3.48Å; L7-V11 PolarHBondContact O-N 2.85Å; V11-G14 PolarHBondContact O-N 3.31Å; V11-Y15 WeakPolarHBondContact O-CB 3.36Å; V11-Y15 PolarHBondContact O-N 2.87Å
12A60.7Low57.7Low60 Ų60106.1 Ų106.150%0.49659%0.59SS.*Hα-helixtrans-65.4-42.9178.700000112.8V8 F9 L10 A16V8-A12 PolarHBondContact O-N 2.92Å; V8-A12 VanDerWaalsContact O-N 3.14Å; F9-A12 PolarHBondContact O-N 3.04Å; L10-A12 VanDerWaalsContact C-N 3.35Å; A12-A16 PolarHBondContact O-N 3.09Å; A12-A16 VanDerWaalsContact O-N 3.12Å
13I61.9Low56.7Low105 Ų105104.8 Ų104.854%0.53859%0.587SS.*Hα-helixtrans-67.1-44.2177.9-63.4166.4000110.3F9 L10 Y15 A16 T17F9-I13 WeakPolarHBondContact O-CG1 3.47Å; F9-I13 PolarHBondContact O-N 3.32Å; F9-I13 VanDerWaalsContact O-N 3.1Å; L10-I13 PolarHBondContact O-N 3.09Å; I13-Y15 VanDerWaalsContact C-N 3.33Å; I13-Y15 PolarHBondContact O-N 3.08Å; I13-A16 PolarHBondContact O-N 3.16Å; I13-T17 PolarHBondContact O-N 3.4Å; I13-T17 VanDerWaalsContact O-N 3.09Å; I13-T17 PolarHBondContact O-OG1 3.1Å
14G55.4Low55.7Low38 Ų38103.9 Ų103.939%0.39259%0.588SS.*Hα-helixtrans-61.5-39178.200000113.2L10 V11 T17 A18L10-G14 PolarHBondContact O-N 3.14Å; V11-G14 PolarHBondContact O-N 3.31Å; G14-T17 WeakPolarHBondContact CA-OG1 3.48Å; G14-T17 PolarHBondContact O-OG1 3.31Å; G14-A18 PolarHBondContact O-N 3.19Å
15Y54.2Low54.1Low149 Ų149109.4 Ų109.458%0.58460%0.597SS**Hα-helixtrans-67.1-46.4176.6-154.6-104.4000110.9V11 I13 T17 A18 Y19V11-Y15 WeakPolarHBondContact O-CB 3.36Å; V11-Y15 PolarHBondContact O-N 2.87Å; I13-Y15 VanDerWaalsContact C-N 3.33Å; I13-Y15 PolarHBondContact O-N 3.08Å; Y15-T17 VanDerWaalsContact C-N 3.28Å; Y15-T17 PolarHBondContact O-N 3.17Å; Y15-A18 PolarHBondContact O-N 3.32Å; Y15-A18 VanDerWaalsContact O-N 3.11Å; Y15-Y19 AromaticContact CD1-CD2 3.74Å; Y15-Y19 HydrophobicContact CD1-CD2 3.74Å; Y15-Y19 AromaticContact CD1-CE2 3.43Å; Y15-Y19 HydrophobicContact CD1-CE2 3.43Å; Y15-Y19 VanDerWaalsContact CD1-CE2 3.43Å; Y15-Y19 AromaticContact CD2-CE2 3.97Å; Y15-Y19 HydrophobicContact CD2-CE2 3.97Å; Y15-Y19 AromaticContact CE1-CD2 3.76Å; Y15-Y19 HydrophobicContact CE1-CD2 3.76Å; Y15-Y19 AromaticContact CE1-CE2 3.06Å; Y15-Y19 HydrophobicContact CE1-CE2 3.06Å; Y15-Y19 AromaticContact CE1-CZ 3.71Å; Y15-Y19 AromaticContact CE2-CE2 3.65Å; Y15-Y19 HydrophobicContact CE2-CE2 3.65Å; Y15-Y19 HydrophobicContact CG-CD2 4.26Å; Y15-Y19 AromaticContact CG-CE2 3.89Å; Y15-Y19 HydrophobicContact CG-CE2 3.89Å; Y15-Y19 AromaticContact CZ-CE2 3.2Å; Y15-Y19 AromaticContact CZ-CZ 3.59Å; Y15-Y19 VanDerWaalsContact CZ-OH 3.25Å; Y15-Y19 VanDerWaalsContact O-CD2 3.26Å; Y15-Y19 WeakPolarHBondContact O-CD2 3.42Å; Y15-Y19 PolarHBondContact O-N 3.15Å; Y15-Y19 PolarHBondContact OH-OH 2.76Å
16A51.8Low52.8Low61 Ų61109.2 Ų109.250%0.50461%0.606SS.*Hα-helixtrans-61.4-34.7178.800000113.4A12 I13 T20A12-A16 PolarHBondContact O-N 3.09Å; A12-A16 VanDerWaalsContact O-N 3.12Å; I13-A16 PolarHBondContact O-N 3.16Å; A16-T20 PolarHBondContact O-OG1 2.92Å
17T48.9Very low51.1Low80 Ų80107.4 Ų107.449%0.49161%0.605SS.*Hα-helixtrans-73-28176.251.10000113.3I13 G14 Y15 T20 T21I13-T17 PolarHBondContact O-N 3.4Å; I13-T17 VanDerWaalsContact O-N 3.09Å; I13-T17 PolarHBondContact O-OG1 3.1Å; G14-T17 WeakPolarHBondContact CA-OG1 3.48Å; G14-T17 PolarHBondContact O-OG1 3.31Å; Y15-T17 VanDerWaalsContact C-N 3.28Å; Y15-T17 PolarHBondContact O-N 3.17Å; T17-T20 PolarHBondContact O-OG1 3.42Å; T17-T21 PolarHBondContact O-OG1 3.22Å
18A48.7Very low49.4Very low49 Ų49105.5 Ų105.541%0.40561%0.614SS.*Hα-helixtrans-74.9-32178.500000113.4G14 Y15 S22G14-A18 PolarHBondContact O-N 3.19Å; Y15-A18 PolarHBondContact O-N 3.32Å; Y15-A18 VanDerWaalsContact O-N 3.11Å; A18-S22 PolarHBondContact O-OG 3.45Å
19Y44.3Very low47.7Very low146 Ų146111 Ų11157%0.57363%0.626SS**Hα-helixtrans-79.1-18.7178.5-77.4-85.4000114Y15Y15-Y19 AromaticContact CD1-CD2 3.74Å; Y15-Y19 HydrophobicContact CD1-CD2 3.74Å; Y15-Y19 AromaticContact CD1-CE2 3.43Å; Y15-Y19 HydrophobicContact CD1-CE2 3.43Å; Y15-Y19 VanDerWaalsContact CD1-CE2 3.43Å; Y15-Y19 AromaticContact CD2-CE2 3.97Å; Y15-Y19 HydrophobicContact CD2-CE2 3.97Å; Y15-Y19 AromaticContact CE1-CD2 3.76Å; Y15-Y19 HydrophobicContact CE1-CD2 3.76Å; Y15-Y19 AromaticContact CE1-CE2 3.06Å; Y15-Y19 HydrophobicContact CE1-CE2 3.06Å; Y15-Y19 AromaticContact CE1-CZ 3.71Å; Y15-Y19 AromaticContact CE2-CE2 3.65Å; Y15-Y19 HydrophobicContact CE2-CE2 3.65Å; Y15-Y19 HydrophobicContact CG-CD2 4.26Å; Y15-Y19 AromaticContact CG-CE2 3.89Å; Y15-Y19 HydrophobicContact CG-CE2 3.89Å; Y15-Y19 AromaticContact CZ-CE2 3.2Å; Y15-Y19 AromaticContact CZ-CZ 3.59Å; Y15-Y19 VanDerWaalsContact CZ-OH 3.25Å; Y15-Y19 VanDerWaalsContact O-CD2 3.26Å; Y15-Y19 WeakPolarHBondContact O-CD2 3.42Å; Y15-Y19 PolarHBondContact O-N 3.15Å; Y15-Y19 PolarHBondContact OH-OH 2.76Å
20T42.3Very low46.3Very low112 Ų112108.4 Ų108.469%0.68764%0.637SS**Hα-helixtrans-88.9-12.7178.346.40000113.5A16 T17A16-T20 PolarHBondContact O-OG1 2.92Å; T17-T20 PolarHBondContact O-OG1 3.42Å
21T41.2Very low44.9Very low110 Ų110105.9 Ų105.968%0.67564%0.639SS**SBendtrans-115.523.6-178.157.70000114.7T17T17-T21 PolarHBondContact O-OG1 3.22Å
22S37.1Very low43.6Very low83 Ų83103.7 Ų103.758%0.5864%0.637SS**  trans-121.351.5175.1-51.60000111.6A18A18-S22 PolarHBondContact O-OG 3.45Å
23H37.8Very low42.5Very low167 Ų167105.7 Ų105.777%0.77365%0.646SS**  trans-114.629162.7-89.2-78.6000111.9Y25H23-Y25 PolarHBondContact O-N 3.5Å; H23-Y25 VanDerWaalsContact O-N 3.17Å
24D36Very low41.7Very low162 Ų162110.2 Ų110.287%0.86666%0.657SS**  trans-8158.9143.9-78-49.8000108.2S26D24-S26 PolarHBondContact O-N 3.22Å
25Y33.1Very low41Very low200 Ų200110.7 Ų110.778%0.78466%0.663SS**  trans-64.497.4156.1-125.9-90000104.5H23 G27H23-Y25 PolarHBondContact O-N 3.5Å; H23-Y25 VanDerWaalsContact O-N 3.17Å; Y25-G27 PolarHBondContact O-N 3Å
26S38.6Very low40.3Very low110 Ų110109.2 Ų109.277%0.76967%0.674SS**  trans-7.1100.9166.3170.40000111D24 G28D24-S26 PolarHBondContact O-N 3.22Å; S26-G28 PolarHBondContact O-N 3.49Å
27G34.7Very low39.6Very low53 Ų53113.6 Ų113.655%0.54669%0.689SS.*  trans-45.7107.5-178.800000111.5Y25 Y29Y25-G27 PolarHBondContact O-N 3Å; G27-Y29 PolarHBondContact O-N 3.4Å
28G32.9Very low39.5Very low82 Ų82113.5 Ų113.585%0.84569%0.691SS**  trans-72.525.2143.800000111.5S26 G30S26-G28 PolarHBondContact O-N 3.49Å; G28-G30 VanDerWaalsContact C-N 3.34Å; G28-G30 PolarHBondContact O-N 2.88Å
29Y38.1Very low39.2Very low216 Ų216118 Ų11885%0.84771%0.708SS**  trans-76.193.5172.1-72.2-75.8000107.4G27 G31G27-Y29 PolarHBondContact O-N 3.4Å; Y29-G31 VanDerWaalsContact C-N 3.33Å; Y29-G31 PolarHBondContact O-N 2.92Å
30G37.5Very low38.6Very low78 Ų78116.7 Ų116.780%0.80472%0.72SS**  trans-44.298171.200000110.2G28 G32G28-G30 VanDerWaalsContact C-N 3.34Å; G28-G30 PolarHBondContact O-N 2.88Å; G30-G32 VanDerWaalsContact C-N 3.28Å; G30-G32 PolarHBondContact O-N 2.82Å
31G38Very low38.1Very low65 Ų65114.3 Ų114.367%0.6772%0.718SS**  trans-66.396.5165.400000106.2Y29 C33Y29-G31 VanDerWaalsContact C-N 3.33Å; Y29-G31 PolarHBondContact O-N 2.92Å; G31-C33 PolarHBondContact O-N 2.94Å; G31-C33 VanDerWaalsContact O-N 3.11Å
32G43Very low37.9Very low52 Ų52120.7 Ų120.754%0.53673%0.731SS.*  trans-50.3120.4163.500000107.5G30 Y34G30-G32 VanDerWaalsContact C-N 3.28Å; G30-G32 PolarHBondContact O-N 2.82Å; G32-Y34 WeakPolarHBondContact O-CD2 3.33Å; G32-Y34 PolarHBondContact O-N 3.16Å
33C36.8Very low37.8Very low102 Ų102120.6 Ų120.669%0.68974%0.744SS**  trans-65.1105.4-177.9-54.20000108.3G31 G35 C38G31-C33 PolarHBondContact O-N 2.94Å; G31-C33 VanDerWaalsContact O-N 3.11Å; C33-G35 PolarHBondContact O-N 3.35Å; C33-C38 HydrophobicContact CB-CB 4.47Å; C33-C38 WeakPolarHBondContact CB-SG 3.49Å; C33-C38 PolarHBondContact O-SG 3.1Å
34Y45.8Very low37.7Very low199 Ų199120 Ų12078%0.7875%0.746SS**  trans-90.198.5173.9-76.2-85.2000109.1G32G32-Y34 WeakPolarHBondContact O-CD2 3.33Å; G32-Y34 PolarHBondContact O-N 3.16Å
35G40.2Very low37.7Very low49 Ų49117.8 Ų117.851%0.50574%0.744SS.*SBendtrans163.6156.9176.100000111.4C33 D37 C38C33-G35 PolarHBondContact O-N 3.35Å; G35-D37 PolarHBondContact O-N 3.41Å; G35-D37 VanDerWaalsContact O-N 3.15Å; G35-C38 PolarHBondContact O-SG 3.2Å; G35-C38 VanDerWaalsContact O-SG 3.33Å
36S39.4Very low37.8Very low118 Ų118111.3 Ų111.383%0.82574%0.738SS**THydrogen-bonded Turntrans-69.4-3.2177.3-45.40000113.6
37D36.7Very low37.8Very low152 Ų152118.2 Ų118.281%0.81375%0.749SS**THydrogen-bonded Turntrans-101.628.6-173.9-54.9-44.4000112.5G35 D39G35-D37 PolarHBondContact O-N 3.41Å; G35-D37 VanDerWaalsContact O-N 3.15Å; D37-D39 PolarHBondContact O-N 3.4Å
38C47.4Very low37.8Very low79 Ų79119 Ų11953%0.53476%0.757SS.*  trans-80.544.9170.4-57.20000111.2C33 G35C33-C38 HydrophobicContact CB-CB 4.47Å; C33-C38 WeakPolarHBondContact CB-SG 3.49Å; C33-C38 PolarHBondContact O-SG 3.1Å; G35-C38 PolarHBondContact O-SG 3.2Å; G35-C38 VanDerWaalsContact O-SG 3.33Å
39D41.3Very low38Very low144 Ų144119 Ų11977%0.7776%0.757SS**  trans-85.7112.7170.5-105.6-75.2000107.5D37D37-D39 PolarHBondContact O-N 3.4Å
40S32.9Very low38Very low118 Ų118112 Ų11283%0.82575%0.75SS**SBendtrans103.8102.4173.3-53.90000116.3
41G31.9Very low38Very low62 Ų62111.7 Ų111.764%0.63974%0.735SS**  106.2108.4113.400000115.4
42Y36.5Very low38.3Very low243 Ų243113.9 Ų113.995%0.95374%0.736SS**  trans57.469.2154.3-60-80.6000116
43G34.6Very low38.2Very low82 Ų82113.8 Ų113.885%0.84573%0.734SS**  trans-13046.6163.100000110.5
44D36.2Very low38.5Very low153 Ų153115 Ų11582%0.81874%0.744SS**  trans-64148164.6-141-63.1000108.5
45S35.8Very low38.2Very low117 Ų117113 Ų11382%0.81875%0.747SS**  trans76.385174.4-53.30000117.7
46G35Very low38.3Very low64 Ų64114.7 Ų114.766%0.6675%0.75SS**  trans-16196.6158.900000110.5G48G46-G48 PolarHBondContact O-N 3.14Å; G46-G48 VanDerWaalsContact O-N 3.12Å
47Y38.7Very low38Very low254 Ų254112.5 Ų112.5100%0.99675%0.746SS**SBendtrans-45.4116.9173-98.2-103.8000110.6
48G35.2Very low37.8Very low71 Ų71108.2 Ų108.273%0.73274%0.738SS**  trans114.655.7177.100000113.6G46 G50G46-G48 PolarHBondContact O-N 3.14Å; G46-G48 VanDerWaalsContact O-N 3.12Å; G48-G50 PolarHBondContact O-N 2.88Å
49G37.4Very low37Very low82 Ų82108.2 Ų108.285%0.84575%0.751SS**  trans-63.188.3161.300000109.5C51G49-C51 PolarHBondContact O-N 2.93Å
50G38.1Very low36.8Very low67 Ų67112.7 Ų112.769%0.69176%0.759SS**  trans-66.599.3173.600000109.1G48 T52G48-G50 PolarHBondContact O-N 2.88Å; G50-T52 PolarHBondContact O-N 3.15Å
51C38.2Very low36.7Very low72 Ų72110.4 Ų110.449%0.48675%0.754SS.*  trans-66.1122.8166167.50000109.6G49 C56G49-C51 PolarHBondContact O-N 2.93Å; C51-C56 HydrophobicContact CB-CB 3.81Å; C51-C56 WeakPolarHBondContact CB-SG 3.26Å; C51-C56 WeakPolarHBondContact SG-CB 3.43Å; C51-C56 CovalentContact SG-SG 1.97Å; C51-C56 PolarHBondContact SG-SG 3.2Å
52T44.2Very low36.5Very low112 Ų112111.7 Ų111.769%0.68777%0.767SS**  trans-107103.8169.741.60000108.8G50G50-T52 PolarHBondContact O-N 3.15Å
53G39.8Very low36.3Very low49 Ų49103.1 Ų103.151%0.50575%0.752SS.*SBendtrans170.1144.7178.900000110.9D55 C56G53-D55 PolarHBondContact O-N 3.28Å; G53-D55 VanDerWaalsContact O-N 3.16Å; G53-C56 PolarHBondContact O-N 3.09Å
54S44.3Very low36.4Very low128 Ų128111.2 Ų111.290%0.89576%0.759SS**THydrogen-bonded Turntrans-64.4-14.7177.4-57.50000113.2
55D38.2Very low36.1Very low156 Ų156107.2 Ų107.283%0.83475%0.754SS**THydrogen-bonded Turntrans-94.310.1-177.9-57-54.9000113.9G53 G57G53-D55 PolarHBondContact O-N 3.28Å; G53-D55 VanDerWaalsContact O-N 3.16Å; D55-G57 PolarHBondContact O-N 3.31Å
56C42.2Very low36Very low86 Ų86105.6 Ų105.658%0.58176%0.755SS**  trans-79.458.5166.9-88.50000112.5C51 G53C51-C56 HydrophobicContact CB-CB 3.81Å; C51-C56 WeakPolarHBondContact CB-SG 3.26Å; C51-C56 WeakPolarHBondContact SG-CB 3.43Å; C51-C56 CovalentContact SG-SG 1.97Å; C51-C56 PolarHBondContact SG-SG 3.2Å; G53-C56 PolarHBondContact O-N 3.09Å
57G33.1Very low35.7Very low72 Ų72105.9 Ų105.974%0.74276%0.759SS**  trans-82.1130.4154.100000109.1D55D55-G57 PolarHBondContact O-N 3.31Å
58G32.3Very low35.2Very low62 Ų6297.8 Ų97.864%0.63974%0.738SS**  trans110.743.6162.900000116.4Y60G58-Y60 PolarHBondContact O-N 3.4Å
59G30.9Very low35.5Very low78 Ų78100.7 Ų100.780%0.80475%0.747SS**  trans-8784.8155.500000110.2G61G59-G61 VanDerWaalsContact C-N 3.28Å; G59-G61 PolarHBondContact O-N 3Å
60Y37.2Very low35.3Very low239 Ų23999.9 Ų99.994%0.93774%0.739SS**  trans-65.990.3163.6-68.8-93.1000107.9G58G58-Y60 PolarHBondContact O-N 3.4Å
61G30.6Very low35.2Very low70 Ų7099.5 Ų99.572%0.72274%0.735SS**  trans178.696.3-17700000115G59G59-G61 VanDerWaalsContact C-N 3.28Å; G59-G61 PolarHBondContact O-N 3Å
62G28.3Very low35.3Very low89 Ų89104.1 Ų104.192%0.91876%0.755SS**  trans74.487.1138.800000116.8
63G31.4Very low34.9Very low62 Ų62102.7 Ų102.764%0.63975%0.749SS**  trans176.8100.3160.600000109.1G65G63-G65 PolarHBondContact O-N 3.49Å
64Y38.6Very low34.4Very low253 Ų253103.3 Ų103.399%0.99276%0.756SS**SBendtrans-60.188.9166.2-63.1-94.3000107.5
65G29.8Very low34.3Very low68 Ų68104.4 Ų104.470%0.70175%0.751SS**  trans176.232.3-168.500000111.5G63G63-G65 PolarHBondContact O-N 3.49Å
66G31.6Very low34.3Very low83 Ų83108.3 Ų108.386%0.85676%0.756SS**  trans-60.7132.4154.400000106.6
67G28.9Very low33.8Very low71 Ų71107.7 Ų107.773%0.73277%0.765SS**  cis135.3108.539.800000104
68C28.4Very low33.7Very low84 Ų84108.3 Ų108.357%0.56877%0.77SS**  trans-134.480.2162.6-810000107.8C73C68-C73 HydrophobicContact CB-CB 3.38Å; C68-C73 WeakPolarHBondContact CB-SG 3.1Å; C68-C73 WeakPolarHBondContact SG-CB 3.14Å; C68-C73 CovalentContact SG-SG 2Å; C68-C73 PolarHBondContact SG-SG 3.12Å
69S41.2Very low33.6Very low131 Ų131108.4 Ų108.492%0.91677%0.772SS**  trans-82.5106.2159.2-178.80000106.3
70G34.7Very low34Very low65 Ų65116.9 Ų116.967%0.6778%0.781SS**SBendtrans103.5108173.800000113.6
71G34.4Very low33.8Very low60 Ų60108.8 Ų108.862%0.61977%0.77SS**SBendtrans67.9106.3157.900000115.4
72D40.8Very low33.9Very low168 Ų168108.6 Ų108.690%0.89877%0.768SS**  trans64.962.3152.5-48.3-40.1000116.8
73C36.8Very low34.3Very low82 Ų82112.4 Ų112.455%0.55477%0.768SS**  trans-101.777.5163.4-65.30000111.7C68C68-C73 HydrophobicContact CB-CB 3.38Å; C68-C73 WeakPolarHBondContact CB-SG 3.1Å; C68-C73 WeakPolarHBondContact SG-CB 3.14Å; C68-C73 CovalentContact SG-SG 2Å; C68-C73 PolarHBondContact SG-SG 3.12Å
74G29.4Very low34.3Very low63 Ų63113.9 Ų113.965%0.64977%0.767SS**  71.472.3120.900000117.5Y76G74-Y76 PolarHBondContact O-N 3.14Å; G74-Y76 VanDerWaalsContact O-N 3.11Å
75N42.3Very low34.3Very low151 Ų151110.2 Ų110.281%0.80777%0.765SS**  15.283.2119.3-165.520.1000116.8
76Y38Very low34.3Very low237 Ų237109.6 Ų109.693%0.92976%0.759SS**  trans-160.176147.2-80.1-68.7000108.8G74G74-Y76 PolarHBondContact O-N 3.14Å; G74-Y76 VanDerWaalsContact O-N 3.11Å
77G31.1Very low34.6Very low74 Ų74109.5 Ų109.576%0.76376%0.757SS**SBendtrans-178.248.7-177.400000115.7
78G30.9Very low35Very low84 Ų84113.5 Ų113.587%0.86676%0.762SS**  trans34.591.9152.700000118.8
79G31.2Very low35.4Very low65 Ų65114 Ų11467%0.6777%0.765SS**  trans-165.996.6160.500000108.8G81G79-G81 VanDerWaalsContact C-N 3.3Å; G79-G81 PolarHBondContact O-N 3.12Å
80Y38Very low34.9Very low256 Ų256110.3 Ų110.3100%1.00475%0.748SS**  trans-59.895.9171.9-65.1-92.8000108.6
81G34.3Very low35.2Very low68 Ų68114.7 Ų114.770%0.70176%0.756SS**  trans178.159.1-175.900000107.4G79G79-G81 VanDerWaalsContact C-N 3.3Å; G79-G81 PolarHBondContact O-N 3.12Å
82G31.8Very low35.1Very low66 Ų66122.9 Ų122.968%0.6877%0.77SS**  trans-50.7142.8-176.400000111.7C84G82-C84 PolarHBondContact O-N 2.97Å
83D35.8Very low34.6Very low170 Ų170118.9 Ų118.991%0.90977%0.768SS**  trans-46.7104.9170.7-54.6-78.5000110
84C32.8Very low34.1Very low93 Ų93118.2 Ų118.263%0.62878%0.775SS**  trans-116.589.8166-129.80000108.3G82 G86 C89G82-C84 PolarHBondContact O-N 2.97Å; C84-G86 PolarHBondContact O-N 3.2Å; C84-C89 WeakPolarHBondContact CB-SG 3.34Å; C84-C89 PolarHBondContact SG-SG 3.19Å
85N37.4Very low33.9Very low175 Ų175118.6 Ų118.694%0.93678%0.779SS**  trans-78.399.1178.8-157.9-10.4000108
86G31.3Very low33.3Very low56 Ų56122.4 Ų122.458%0.57778%0.784SS**SBendtrans127.2106.8170.300000114.2C84 D88C84-G86 PolarHBondContact O-N 3.2Å; G86-D88 VanDerWaalsContact C-N 3.27Å; G86-D88 PolarHBondContact O-N 3.32Å
87G38.2Very low32.7Very low80 Ų80114.6 Ų114.683%0.82578%0.775SS**SBendtrans66-47.5139.100000120.4
88D36Very low32.4Very low155 Ų155115.3 Ų115.383%0.82978%0.783SS**  trans-139.743.9-153-67.4-55.1000113.4G86 G90G86-D88 VanDerWaalsContact C-N 3.27Å; G86-D88 PolarHBondContact O-N 3.32Å; D88-G90 PolarHBondContact O-N 3.11Å
89C37.3Very low32.1Very low95 Ų95114.7 Ų114.764%0.64278%0.776SS**  trans-78.870.4159.5-71.40000109.6C84 N91C84-C89 WeakPolarHBondContact CB-SG 3.34Å; C84-C89 PolarHBondContact SG-SG 3.19Å; C89-N91 PolarHBondContact O-N 3.34Å
90G31.6Very low32.2Very low53 Ų53120 Ų12055%0.54679%0.789SS.*  trans-60.4117.7168.700000110.7D88D88-G90 PolarHBondContact O-N 3.11Å
91N39.1Very low31.8Very low157 Ų157111.5 Ų111.584%0.8478%0.779SS**  60.567.1128-142.126.8000116.7C89C89-N91 PolarHBondContact O-N 3.34Å
92Y33.8Very low31.7Very low233 Ų233111.7 Ų111.791%0.91478%0.781SS**  trans-139.5113.2155.7-72.6-79.8000111.1
93G29.7Very low31.8Very low83 Ų83112.5 Ų112.586%0.85679%0.789SS**SBendtrans105.395174.200000111
94G26.3Very low31.8Very low69 Ų69108.9 Ų108.971%0.71178%0.776SS**  cis119.49642.500000106
95G26.1Very low32.1Very low70 Ų70110.3 Ų110.372%0.72279%0.787SS**  trans-170.971.5-172.200000111.2G97G95-G97 PolarHBondContact O-N 2.89Å
96Y28Very low32.2Very low232 Ų232106.1 Ų106.191%0.9179%0.786SS**  trans-40.4117.6170-26.2-89.7000111.5
97G25.3Very low32.3Very low73 Ų73105.9 Ų105.975%0.75378%0.783SS**  trans163.5107.7174.100000111.4G95G95-G97 PolarHBondContact O-N 2.89Å
98G25.1Very low32.3Very low89 Ų89109.9 Ų109.992%0.91879%0.786SS**  trans-65.9155.5-169.100000115.4
99G26.2Very low32.6Very low71 Ų71107.6 Ų107.673%0.73278%0.781SS**  trans151.7112.717200000109.1G101G99-G101 PolarHBondContact O-N 3.02Å; G99-G101 VanDerWaalsContact O-N 3.1Å
100N31.3Very low32.4Very low176 Ų176106.4 Ų106.494%0.94179%0.785SS**  trans-27.8112.9170.6-70.2-18.2000111.2
101G31.2Very low32.4Very low77 Ų77107.2 Ų107.279%0.79479%0.793SS**  93.9100.565.700000108.5G99G99-G101 PolarHBondContact O-N 3.02Å; G99-G101 VanDerWaalsContact O-N 3.1Å
102G31Very low32.2Very low72 Ų72103.3 Ų103.374%0.74279%0.79SS**  trans106106.4163.500000114.7C104G102-C104 PolarHBondContact O-N 3.38Å
103G35.3Very low32.3Very low83 Ų83100.9 Ų100.986%0.85678%0.784SS**  trans-59122.7171.400000112.1S105G103-S105 PolarHBondContact O-N 3.33Å; G103-S105 VanDerWaalsContact O-N 3.16Å
104C34.5Very low32.7Very low94 Ų94103.3 Ų103.364%0.63578%0.777SS**  trans-82.685.3165.2-66.90000108.7G102 G106 C109G102-C104 PolarHBondContact O-N 3.38Å; C104-G106 PolarHBondContact O-N 3.19Å; C104-C109 WeakPolarHBondContact CB-SG 2.87Å; C104-C109 VanDerWaalsContact SG-SG 3.67Å
105S40Very low33.3Very low123 Ų123109 Ų10986%0.8679%0.786SS**  trans-72.7105.8165.472.10000108.9G103G103-S105 PolarHBondContact O-N 3.33Å; G103-S105 VanDerWaalsContact O-N 3.16Å
106G38.4Very low33.9Very low87 Ų87109.5 Ų109.590%0.89778%0.783SS**SBendtrans96.218.3153.200000118.9C104C104-G106 PolarHBondContact O-N 3.19Å
107G34.9Very low34.2Very low51 Ų51106.9 Ų106.953%0.52678%0.776SS.*SBendtrans-157.712317300000112C109G107-C109 PolarHBondContact O-N 3.01Å; G107-C109 VanDerWaalsContact O-N 3.15Å
108N36.6Very low34.7Very low165 Ų165108.9 Ų108.988%0.88278%0.776SS**  trans3.692.6165-60.911.4000115.4G110N108-G110 PolarHBondContact O-N 2.8Å
109C42.8Very low35.3Very low106 Ų106108.1 Ų108.172%0.71676%0.761SS**  trans-73.673157.7-61.50000108.2C104 G107C104-C109 WeakPolarHBondContact CB-SG 2.87Å; C104-C109 VanDerWaalsContact SG-SG 3.67Å; G107-C109 PolarHBondContact O-N 3.01Å; G107-C109 VanDerWaalsContact O-N 3.15Å
110G33.2Very low35.6Very low71 Ų71110.3 Ų110.373%0.73276%0.763SS**  trans-79.7131.2161.200000108.5N108N108-G110 PolarHBondContact O-N 2.8Å
111G32Very low35.6Very low70 Ų70113.1 Ų113.172%0.72276%0.762SS**  trans94.566.2164.600000115
112G35Very low35.6Very low74 Ų74112.2 Ų112.276%0.76375%0.753SS**  trans-125.860.6153.600000107.9D114G112-D114 PolarHBondContact O-N 3.17Å
113F36Very low35.6Very low182 Ų182112 Ų11280%0.79875%0.751SS**  trans-68.6108159.1-69.2-84.6000104.7E115F113-E115 VanDerWaalsContact C-N 3.33Å; F113-E115 PolarHBondContact O-N 2.79Å
114D37Very low35.8Very low134 Ų134115.1 Ų115.172%0.71775%0.748SS**  trans-58.8103.9164.2-87.7-53.8000106.6G112 A116 F117G112-D114 PolarHBondContact O-N 3.17Å; D114-A116 PolarHBondContact O-N 3.27Å; D114-F117 PolarHBondContact O-N 2.88Å
115E38.4Very low35.8Very low189 Ų189120.5 Ų120.588%0.88376%0.756SS**THydrogen-bonded Turntrans-53.8-11.4178.3-138.396.9-158.600113F113F113-E115 VanDerWaalsContact C-N 3.33Å; F113-E115 PolarHBondContact O-N 2.79Å
116A39.8Very low35.7Very low80 Ų80118.3 Ų118.366%0.66175%0.753SS**THydrogen-bonded Turntrans-79.9-14.2177.800000114.5D114D114-A116 PolarHBondContact O-N 3.27Å
117F33.4Very low35.6Very low177 Ų177121.5 Ų121.578%0.77675%0.749SS**  trans-131.699.7177-79.1-85.6000111.1D114 A119D114-F117 PolarHBondContact O-N 2.88Å; F117-A119 PolarHBondContact O-N 2.98Å; F117-A119 VanDerWaalsContact O-N 3.09Å
118P36.4Very low35.7Very low115 Ų115122.3 Ų122.375%0.74776%0.758SS**PPolyproline II helixtrans-58.2116.5162.1-16.128.7000108.1P120P118-P120 WeakPolarHBondContact O-CD 2.97Å; P118-P120 VanDerWaalsContact O-N 3.14Å
119A37Very low35.6Very low73 Ų73117.6 Ų117.660%0.60375%0.748SS**PPolyproline II helixtrans-56.5119.9175.800000108.9F117 Y121F117-A119 PolarHBondContact O-N 2.98Å; F117-A119 VanDerWaalsContact O-N 3.09Å; A119-Y121 PolarHBondContact O-N 3.11Å; A119-Y121 VanDerWaalsContact O-N 3.14Å
120P32.8Very low35.2Very low118 Ų118119.1 Ų119.177%0.76675%0.749SS**SBendtrans-67.5118.3177.625.9-30.5000108.2P118P118-P120 WeakPolarHBondContact O-CD 2.97Å; P118-P120 VanDerWaalsContact O-N 3.14Å
121Y32.1Very low35.5Very low234 Ų234119.1 Ų119.192%0.91875%0.75SS**SBendtrans58.1104.4168.5-78.3-94.8000116.4A119A119-Y121 PolarHBondContact O-N 3.11Å; A119-Y121 VanDerWaalsContact O-N 3.14Å
122G31.7Very low35.7Very low59 Ų59125.2 Ų125.261%0.60876%0.756SS**  trans102.526.4148.800000117.3D124G122-D124 PolarHBondContact O-N 2.95Å
123G30.4Very low35.9Very low68 Ų68124.9 Ų124.970%0.70175%0.753SS**  trans-70.337.6172.500000115.5
124D39.2Very low35.9Very low147 Ų147125.9 Ų125.979%0.78676%0.757SS**  trans-112.249168.9-74.5-34.2000110.3G122G122-D124 PolarHBondContact O-N 2.95Å
125Y35Very low35.8Very low208 Ų208123.2 Ų123.282%0.81676%0.761SS**  trans-138.436169.3-65.3-76.6000112.1N127Y125-N127 PolarHBondContact O-N 3.01Å; Y125-N127 VanDerWaalsContact O-N 3.09Å
126G37.3Very low35.5Very low77 Ų77117.6 Ų117.679%0.79475%0.754SS**  trans-79.764.2160.100000110.1G128G126-G128 PolarHBondContact O-N 3.15Å
127N35.8Very low35.2Very low153 Ų153119.5 Ų119.582%0.81876%0.763SS**  trans-59.799.9159.2-92.6-21.1000105.7Y125 G129Y125-N127 PolarHBondContact O-N 3.01Å; Y125-N127 VanDerWaalsContact O-N 3.09Å; N127-G129 PolarHBondContact O-N 3.33Å
128G37.2Very low35.2Very low69 Ų69121 Ų12171%0.71177%0.768SS**  trans-46.9111.3175.500000108G126 N130G126-G128 PolarHBondContact O-N 3.15Å; G128-N130 PolarHBondContact O-N 3.46Å
129G35.7Very low35.1Very low66 Ų66118.1 Ų118.168%0.6876%0.76SS**  trans-51.5139.4-178.900000109.2N127 G131N127-G129 PolarHBondContact O-N 3.33Å; G129-G131 VanDerWaalsContact C-N 3.31Å; G129-G131 PolarHBondContact O-N 3.48Å
130N34.6Very low34.7Very low137 Ų137121.2 Ų121.273%0.73377%0.767SS**  trans-51.9101.7169.9-69.3-3.5000107.4G128 F132G128-N130 PolarHBondContact O-N 3.46Å; N130-F132 VanDerWaalsContact C-N 3.35Å; N130-F132 PolarHBondContact O-N 3.26Å
131G38.3Very low34.7Very low72 Ų72123.4 Ų123.474%0.74277%0.772SS**  trans-63.297.1-177.200000108.9G129 G133G129-G131 VanDerWaalsContact C-N 3.31Å; G129-G131 PolarHBondContact O-N 3.48Å; G131-G133 PolarHBondContact O-N 2.73Å
132F37.3Very low34.7Very low197 Ų197123 Ų12386%0.86477%0.77SS**  trans-69.676.4152.1-67.3-82.7000106.2N130 K134N130-F132 VanDerWaalsContact C-N 3.35Å; N130-F132 PolarHBondContact O-N 3.26Å; F132-K134 PolarHBondContact O-N 2.95Å
133G38.8Very low34.7Very low67 Ų67123.2 Ų123.269%0.69177%0.773SS**  trans-56107.9163.500000106.2G131 G135G131-G133 PolarHBondContact O-N 2.73Å; G133-G135 PolarHBondContact O-N 3.11Å
134K35.3Very low35Very low204 Ų204129.6 Ų129.689%0.88778%0.781SS**  trans-52.4116.1167.8-79.8-175.6176177.70105.5F132 G136F132-K134 PolarHBondContact O-N 2.95Å; K134-G136 PolarHBondContact O-N 2.8Å; K134-G136 VanDerWaalsContact O-N 3.12Å
135G35.3Very low34.8Very low77 Ų77125.8 Ų125.879%0.79478%0.777SS**  trans-44.5123.6178.900000109.2G133G133-G135 PolarHBondContact O-N 3.11Å
136G32.6Very low34.8Very low71 Ų71126.5 Ų126.573%0.73278%0.78SS**  trans-49.5144.4-175.200000111.8K134 K138K134-G136 PolarHBondContact O-N 2.8Å; K134-G136 VanDerWaalsContact O-N 3.12Å; G136-K138 PolarHBondContact O-N 3.42Å; G136-K138 VanDerWaalsContact O-N 3.14Å
137S34.1Very low34.4Very low121 Ų121126.4 Ų126.485%0.84678%0.779SS**  trans-29.3113.6170.6-49.90000111.9G139S137-G139 PolarHBondContact O-N 3.27Å
138K32.7Very low34.1Very low207 Ų207122.9 Ų122.990%0.978%0.778SS**  trans-66.892.3155.9-96.8-177.5179.2172.40106.2G136 N140G136-K138 PolarHBondContact O-N 3.42Å; G136-K138 VanDerWaalsContact O-N 3.14Å; K138-N140 PolarHBondContact O-N 3.45Å
139G33.1Very low33.7Very low55 Ų55123 Ų12357%0.56778%0.78SS**  trans-52.4129.9168.800000110.2S137S137-G139 PolarHBondContact O-N 3.27Å
140N28.7Very low33.8Very low139 Ų139126.6 Ų126.674%0.74380%0.795SS**  trans24.3106137.8-50.213.3000114.8K138K138-N140 PolarHBondContact O-N 3.45Å
141N32.6Very low33.8Very low163 Ų163123.2 Ų123.287%0.87279%0.792SS**  trans-132.7104.8147.6-107.3-5.2000109.2G143N141-G143 PolarHBondContact O-N 3.4Å; N141-G143 VanDerWaalsContact O-N 3.11Å
142Y32.8Very low33.8Very low225 Ų225129.8 Ų129.888%0.88280%0.8SS**  trans-46110.4159.5-72.1-95.8000109
143G32.8Very low33.7Very low65 Ų65123.4 Ų123.467%0.6779%0.79SS**  trans-15591177.600000109.8N141 G145N141-G143 PolarHBondContact O-N 3.4Å; N141-G143 VanDerWaalsContact O-N 3.11Å; G143-G145 PolarHBondContact O-N 2.69Å
144K36.1Very low33.5Very low201 Ų201129.9 Ų129.987%0.87480%0.799SS**  trans-62.180.4158.1-81-177.6172.4179.40107.8Y146K144-Y146 PolarHBondContact O-N 3.16Å
145G35.7Very low33.7Very low68 Ų68124.1 Ų124.170%0.70180%0.798SS**  trans-92.286.1173.200000109.3G143 G147G143-G145 PolarHBondContact O-N 2.69Å; G145-G147 PolarHBondContact O-N 1.97Å
146Y34.6Very low33.7Very low222 Ų222124.6 Ų124.687%0.87180%0.803SS**  trans-69.3118.6157.8-77.3-93.3000107.3K144K144-Y146 PolarHBondContact O-N 3.16Å
147G29.3Very low33.7Very low75 Ų75124.7 Ų124.777%0.77380%0.803SS**SBendtrans92143.8173.300000113.9G145G145-G147 PolarHBondContact O-N 1.97Å
148G28.5Very low33.9Very low79 Ų79129.5 Ų129.581%0.81481%0.809SS**  trans116.298.9155.800000113.7
149G29.5Very low34.3Very low73 Ų73123.4 Ų123.475%0.75381%0.805SS**  trans92.7117.5132.800000114.2G151G149-G151 PolarHBondContact O-N 3.35Å
150S36.7Very low34.4Very low140 Ų140124.3 Ų124.398%0.97981%0.814SS**  trans-52.675.1149.4-46.40000109.7
151G34.2Very low34.9Very low66 Ų66127.8 Ų127.868%0.6882%0.823SS**  trans-103.584.6176.900000109.3G149G149-G151 PolarHBondContact O-N 3.35Å
152K38.8Very low35.5Very low210 Ų210123.2 Ų123.291%0.91381%0.814SS**  trans-128.469.6148.1-83.1-171.6179.9175.60108.1
153G36.2Very low35.7Very low63 Ų63116 Ų11665%0.64981%0.808SS**  trans-63.8167144.100000110.2
154K32.9Very low35.9Very low204 Ų204123 Ų12389%0.88782%0.82SS**  trans86.8102171.6-50.8-169.5-179.8-1720112.2
155G40.2Very low36.4Very low83 Ų83116.9 Ų116.986%0.85681%0.814SS**  cis68.310532.100000109.3
156G35.6Very low36.5Very low87 Ų87117.2 Ų117.290%0.89782%0.817SS**  trans138.7104.6179.800000108.4
157G32.4Very low36.7Very low72 Ų72112.7 Ų112.774%0.74281%0.813SS**  cis160.6134.112.700000103.7G159G157-G159 PolarHBondContact O-N 3.32Å
158K37.6Very low37.4Very low223 Ų223118 Ų11897%0.9781%0.811SS**  trans-61.8101.4-176.6-68.9176.6175.3178.80109.7G160K158-G160 PolarHBondContact O-N 3.02Å
159G42Very low37.8Very low78 Ų78122.5 Ų122.580%0.80481%0.808SS**  trans-70.9117.8167.300000109.3G157G157-G159 PolarHBondContact O-N 3.32Å
160G35.7Very low38.6Very low75 Ų75123.8 Ų123.877%0.77380%0.803SS**  trans-67.7167.3-167.400000116.2K158 G162K158-G160 PolarHBondContact O-N 3.02Å; G160-G162 PolarHBondContact O-N 2.83Å
161K38.6Very low38.8Very low212 Ų212121.3 Ų121.392%0.92279%0.785SS**  trans-54.6110.8179.9-64179176.6-179.70111.1G163K161-G163 PolarHBondContact O-N 2.95Å
162G45.2Very low39.1Very low67 Ų67127.3 Ų127.369%0.69180%0.796SS**  trans-61.5121.7162.400000109.2G160G160-G162 PolarHBondContact O-N 2.83Å
163G36.6Very low39.2Very low73 Ų73127.6 Ų127.675%0.75379%0.792SS**  trans-60.4150.7-17400000113.3K161 G165K161-G163 PolarHBondContact O-N 2.95Å; G163-G165 PolarHBondContact O-N 2.89Å; G163-G165 VanDerWaalsContact O-N 3.08Å
164K38.1Very low39Very low213 Ų213127.7 Ų127.793%0.92679%0.793SS**  trans-57.5112.4175.6-67.3-179.1176.7-178.40109.1G166K164-G166 PolarHBondContact O-N 2.83Å; K164-G166 VanDerWaalsContact O-N 3.16Å
165G45.8Very low38.9Very low71 Ų71122 Ų12273%0.73279%0.792SS**  trans-56118.9164.800000108.2G163 T167G163-G165 PolarHBondContact O-N 2.89Å; G163-G165 VanDerWaalsContact O-N 3.08Å; G165-T167 PolarHBondContact O-N 3.12Å
166G38Very low38.8Very low75 Ų75121 Ų12177%0.77378%0.783SS**  trans-58.2127.4-178.400000110.4K164 Y168K164-G166 PolarHBondContact O-N 2.83Å; K164-G166 VanDerWaalsContact O-N 3.16Å; G166-Y168 PolarHBondContact O-N 2.94Å
167T38.9Very low39.3Very low127 Ų127131.3 Ų131.378%0.77980%0.797SS**  trans-59.5109.5171.1-530000108.6G165 K169G165-T167 PolarHBondContact O-N 3.12Å; T167-K169 PolarHBondContact O-N 3.43Å; T167-K169 VanDerWaalsContact O-N 3.11Å
168Y43.4Very low39.6Very low188 Ų188134.3 Ų134.374%0.73780%0.799SS**  trans-65.4109.3166.3-177.7-100.9000107.7G166 P170G166-Y168 PolarHBondContact O-N 2.94Å; Y168-P170 HydrophobicContact CE1-CB 4.32Å; Y168-P170 WeakPolarHBondContact O-CD 2.81Å
169K38.2Very low39.8Very low173 Ų173129.6 Ų129.675%0.75279%0.79SS**PPolyproline II helixtrans-84.1117.2165.2-71.7-167.2-179-175.40106.8T167 S171T167-K169 PolarHBondContact O-N 3.43Å; T167-K169 VanDerWaalsContact O-N 3.11Å; K169-S171 PolarHBondContact O-N 3.11Å; K169-S171 VanDerWaalsContact O-N 3.11Å
170P45.9Very low39.6Very low99 Ų99132.5 Ų132.564%0.64379%0.789SS**PPolyproline II helixtrans-57.5121.1170.1-9.820.4000108Y168 H172Y168-P170 HydrophobicContact CE1-CB 4.32Å; Y168-P170 WeakPolarHBondContact O-CD 2.81Å; P170-H172 PolarHBondContact O-N 2Å
171S40.7Very low39.9Very low88 Ų88135.9 Ų135.962%0.61579%0.79SS**PPolyproline II helixtrans-62.1120.3172.2-49.50000108.2K169 Y173K169-S171 PolarHBondContact O-N 3.11Å; K169-S171 VanDerWaalsContact O-N 3.11Å; S171-Y173 VanDerWaalsContact C-N 3.28Å; S171-Y173 PolarHBondContact O-N 2.75Å
172H40.5Very low39.9Very low193 Ų193131.1 Ų131.189%0.89478%0.782SS**  trans-60.992.5163.6-73.8-66.4000108.5P170 G174P170-H172 PolarHBondContact O-N 2Å; H172-G174 WeakPolarHBondContact O-CA 3.09Å
173Y40.2Very low39.6Very low216 Ų216135.4 Ų135.485%0.84779%0.788SS**  trans-74.8106.1150.5-84.7-89.9000105.4S171S171-Y173 VanDerWaalsContact C-N 3.28Å; S171-Y173 PolarHBondContact O-N 2.75Å
174G32Very low39.8Very low65 Ų65139.9 Ų139.967%0.6779%0.791SS**  cis76.771.214.800000111.2H172H172-G174 WeakPolarHBondContact O-CA 3.09Å
175G31.9Very low39.9Very low84 Ų84134.2 Ų134.287%0.86678%0.78SS**  trans107.1119.7152.300000116.9
176G37.4Very low39.4Very low63 Ų63139.5 Ų139.565%0.64979%0.785SS**  trans174.180.3167.800000108.5
177Y46.3Very low39.6Very low303 Ų303145.4 Ų145.4100%1.18879%0.786SS**  trans-210170.942.5-90.2000116.8

Retrieved 177 of 177 residues in 122.6 ms (Link to these results)