X5D2V8_HUMAN Loading...

Regulating synaptic membrane exocytosis 3 isoform C

AlphaFold DB , UniProt , Accession X5D2V8, Species HUMAN (Homo sapiens, Human), Gene RIMS3, Length 227 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
1M39.1Very low47.7Very low237 Ų237133.5 Ų133.5100%1.16782%0.821SS**  0103.10-72160.2147.100106.6
2F42.9Very low47.5Very low187 Ų187127.9 Ų127.982%0.8281%0.809SS**  trans-86.9121.817692.5-83000106.4G4F2-G4 PolarHBondContact O-N 3.19Å
3N46.7Very low47.9Very low162 Ų162123.5 Ų123.587%0.86679%0.792SS**  trans-82.999174.5-73.1-5.4000107.2
4G44.3Very low48.2Very low52 Ų52122.6 Ų122.654%0.53679%0.79SS.*  trans-91.1116.4164.600000109.6F2F2-G4 PolarHBondContact O-N 3.19Å
5E52.3Low48.8Very low178 Ų178126.3 Ų126.383%0.83278%0.782SS**  trans-133.4121.5159.1-114.9-72.6117.600106.4
6P57.4Low49.2Very low109 Ų109128.4 Ų128.471%0.70879%0.787SS**  trans-77.3142-174.331-32.3000111.5
7G49.8Very low49.3Very low68 Ų68126.1 Ų126.170%0.70177%0.773SS**  trans-69.6-156.9171.600000114.6
8P51.4Low49.5Very low131 Ų131126.2 Ų126.285%0.85177%0.773SS**  -87.1127-115.832.4-35.3000114.5S10P8-S10 PolarHBondContact O-N 3.48Å; P8-S10 VanDerWaalsContact O-N 3.17Å
9A42.7Very low49.9Very low104 Ų104130.7 Ų130.786%0.8677%0.774SS**  trans-83.388.4166.300000110.6S11A9-S11 PolarHBondContact O-N 3.13Å
10S51.1Low50Low120 Ų120129.8 Ų129.884%0.83978%0.775SS**  trans-60.8109150.11710000108.7P8P8-S10 PolarHBondContact O-N 3.48Å; P8-S10 VanDerWaalsContact O-N 3.17Å
11S47.2Very low50.5Low121 Ų121129.4 Ų129.485%0.84678%0.779SS**  trans-15595163-143.90000105.3A9A9-S11 PolarHBondContact O-N 3.13Å
12G45.2Very low51.4Low66 Ų66123.1 Ų123.168%0.6876%0.758SS**  113.282.472.100000107.1S14G12-S14 PolarHBondContact O-N 3.01Å
13A52.3Low52.1Low71 Ų71122.1 Ų122.159%0.58776%0.759SS**  trans35.281.3152.100000118.2R15A13-R15 PolarHBondContact O-N 3.33Å
14S52.1Low52.6Low110 Ų110119 Ų11977%0.76975%0.751SS**  trans-95.961.8150.452.10000109.7G12 N16G12-S14 PolarHBondContact O-N 3.01Å; S14-N16 PolarHBondContact O-N 3.18Å
15R56.9Low53.1Low178 Ų178119.3 Ų119.367%0.67275%0.753SS**  trans-53.2103.1157.851.9177.1-176.5-93.1-7.7107.4A13 V17A13-R15 PolarHBondContact O-N 3.33Å; R15-V17 HydrophobicContact CB-CG2 3.53Å; R15-V17 HydrophobicContact CG-CG2 3.63Å; R15-V17 PolarHBondContact O-N 3.38Å
16N56.3Low53.2Low160 Ų160118.8 Ų118.886%0.85675%0.751SS**  trans-70.966.1161-73.4-40.1000107.5S14 V18S14-N16 PolarHBondContact O-N 3.18Å; N16-V18 VanDerWaalsContact C-N 3.32Å; N16-V18 PolarHBondContact O-N 3.19Å; N16-V18 VanDerWaalsContact O-N 3.14Å
17V50.8Low53.3Low90 Ų90122.1 Ų122.155%0.54576%0.761SS.*  trans-74.499.2162.2-1540000103.4R15 R19R15-V17 HydrophobicContact CB-CG2 3.53Å; R15-V17 HydrophobicContact CG-CG2 3.63Å; R15-V17 PolarHBondContact O-N 3.38Å; V17-R19 PolarHBondContact O-N 3.11Å
18V52.5Low53Low128 Ų128124.2 Ų124.278%0.77676%0.764SS**  trans-58.598.1151.4170.20000104.1N16 S20N16-V18 VanDerWaalsContact C-N 3.32Å; N16-V18 PolarHBondContact O-N 3.19Å; N16-V18 VanDerWaalsContact O-N 3.14Å; V18-S20 VanDerWaalsContact C-N 3.34Å; V18-S20 PolarHBondContact O-N 3.4Å
19R57.4Low52.8Low211 Ų211121.4 Ų121.480%0.79676%0.759SS**  trans-55.5103.5172.5-70.9-179.3166.6111.7-6.8105.2V17 S21V17-R19 PolarHBondContact O-N 3.11Å; R19-S21 PolarHBondContact O-N 3.22Å
20S51.7Low53Low113 Ų113122.5 Ų122.579%0.7976%0.76SS**  trans-58.8116.1170.6-54.50000106.6V18 S22V18-S20 VanDerWaalsContact C-N 3.34Å; V18-S20 PolarHBondContact O-N 3.4Å; S20-S22 PolarHBondContact O-N 3.49Å
21S60.6Low52.6Low122 Ų122124.7 Ų124.785%0.85376%0.757SS**  trans-60.8102.7167.3-56.40000107R19 I23R19-S21 PolarHBondContact O-N 3.22Å; S21-I23 PolarHBondContact O-N 3.27Å; S21-I23 VanDerWaalsContact O-N 3.15Å
22S58.5Low52.5Low105 Ų105126.8 Ų126.873%0.73475%0.753SS**  trans-66.5109.7164.9-179.70000106.6S20 S24S20-S22 PolarHBondContact O-N 3.49Å; S22-S24 PolarHBondContact O-N 3.3Å
23I57.9Low52.5Low166 Ų166128.4 Ų128.485%0.85176%0.76SS**  trans-73.991.8158.4-172.9141.5000106.3S21 G25S21-I23 PolarHBondContact O-N 3.27Å; S21-I23 VanDerWaalsContact O-N 3.15Å; I23-G25 PolarHBondContact O-N 3.42Å
24S56.6Low51.9Low97 Ų97128.7 Ų128.768%0.67877%0.77SS**  trans-62.691.5166178.20000107.3S22 E26S22-S24 PolarHBondContact O-N 3.3Å; S24-E26 VanDerWaalsContact C-N 3.32Å; S24-E26 PolarHBondContact O-N 3.02Å
25G55.4Low51.5Low58 Ų58127.8 Ų127.860%0.59878%0.778SS**  trans-69.596164.200000107.7I23 I27I23-G25 PolarHBondContact O-N 3.42Å; G25-I27 PolarHBondContact O-N 2.7Å
26E53.8Low50.8Low167 Ų167123 Ų12378%0.7879%0.785SS**  trans-42.6107.4161.557.1-162.296.400110.1S24 C28S24-E26 VanDerWaalsContact C-N 3.32Å; S24-E26 PolarHBondContact O-N 3.02Å; E26-C28 PolarHBondContact O-N 3.12Å; E26-C28 VanDerWaalsContact O-N 3.14Å
27I59.1Low50.8Low178 Ų178120.9 Ų120.991%0.91379%0.789SS**  trans-83.761.6161.445.9157.4000107.6G25G25-I27 PolarHBondContact O-N 2.7Å
28C44.1Very low50.4Low113 Ų113119.9 Ų119.976%0.76480%0.797SS**  trans-105.6112.7170.4-155.40000109.7E26E26-C28 PolarHBondContact O-N 3.12Å; E26-C28 VanDerWaalsContact O-N 3.14Å
29G46Very low50.6Low72 Ų72120.5 Ų120.574%0.74280%0.801SS**  trans91.287.5149.700000117.1
30S46.5Very low50.1Low126 Ų126116.4 Ų116.488%0.88180%0.8SS**  -147.587.2118.7-165.10000109.8Q32S30-Q32 PolarHBondContact O-N 3.23Å
31Q44.4Very low49.8Very low167 Ų167116.9 Ų116.978%0.7880%0.798SS**  trans-43.6118.3150175.1130.933.100110.4
32Q44.2Very low49.5Very low164 Ų164116.2 Ų116.277%0.76680%0.8SS**SBendtrans52.4122.9139.3-160.2171.580.300119.7S30S30-Q32 PolarHBondContact O-N 3.23Å
33A44.9Very low48.9Very low101 Ų101119.2 Ų119.284%0.83580%0.8SS**  trans63.7121.6143.600000119.6
34G39.3Very low48.9Very low76 Ų76121.2 Ų121.278%0.78480%0.802SS**  trans156.8107.2162.500000110.2
35G44.7Very low49.6Very low91 Ų91127.2 Ų127.294%0.93881%0.81SS**  trans-61156177.300000112.5
36G41.3Very low50.5Low79 Ų79135.7 Ų135.781%0.81482%0.824SS**  trans156.5116168.900000112.8
37A56.4Low51.6Low115 Ų115130.8 Ų130.895%0.9581%0.808SS**  trans-41.7136.117500000114.4
38G42.6Very low52.4Low69 Ų69125.9 Ų125.971%0.71179%0.79SS**  trans-155.490174.300000111T40G38-T40 PolarHBondContact O-N 3.09Å
39T57.8Low53.9Low140 Ų140127.2 Ų127.286%0.85979%0.788SS**  trans-48.6120.2172.248.80000112.6
40T45.4Very low55.6Low125 Ų125125.9 Ų125.977%0.76778%0.775SS**  trans-151.8111.2150.249.10000110.5G38G38-T40 PolarHBondContact O-N 3.09Å
41T47.2Very low57.2Low123 Ų123122 Ų12276%0.75575%0.751SS**  trans48105157.767.10000116.4K43T41-K43 PolarHBondContact O-N 3.42Å
42A53.4Low58.9Low109 Ų109119.2 Ų119.290%0.90174%0.736SS**  trans-64.868.1157.300000109.5K44A42-K44 VanDerWaalsContact C-N 3.34Å; A42-K44 PolarHBondContact O-N 3.36Å
43K46Very low60.6Low168 Ų168117.3 Ų117.373%0.7373%0.729SS**  trans-58106.4162-173.8164.2-176.5158.40103.1T41 R45T41-K43 PolarHBondContact O-N 3.42Å; K43-R45 PolarHBondContact O-N 3.46Å
44K57.2Low62.2Low208 Ų208117.5 Ų117.590%0.90472%0.719SS**  trans-57.284.5164.7-86.3-172.3176.7-175.40105.7A42 R46A42-K44 VanDerWaalsContact C-N 3.34Å; A42-K44 PolarHBondContact O-N 3.36Å; K44-R46 PolarHBondContact O-N 3.25Å
45R70.8Confident63.8Low222 Ų222117 Ų11784%0.83871%0.707SS**  trans-60.2108.8173.4-72.3175.972.3-178.42.9102.7K43 S47K43-R45 PolarHBondContact O-N 3.46Å; R45-S47 PolarHBondContact O-N 2.84Å
46R74.5Confident65Low236 Ų236118.5 Ų118.589%0.89169%0.693SS**PPolyproline II helixtrans-49120170.3-150.5171.2-169.8172.20.8104.8K44 S48K44-R46 PolarHBondContact O-N 3.25Å; R46-S48 PolarHBondContact O-N 2.84Å
47S78.1Confident66.2Low64 Ų64120 Ų12045%0.44869%0.686SS.*PPolyproline II helixtrans-49.5130.1-17832.80000108R45 K52R45-S47 PolarHBondContact O-N 2.84Å; S47-K52 VanDerWaalsContact OG-CG 3.25Å; S47-K52 WeakPolarHBondContact OG-CG 3.1Å
48S76.6Confident66.5Low75 Ų75117.5 Ų117.552%0.52467%0.671SS.*PPolyproline II helixtrans-55.9151.6179.662.20000109R46 G50 A51 K52R46-S48 PolarHBondContact O-N 2.84Å; S48-G50 PolarHBondContact O-N 3.18Å; S48-G50 VanDerWaalsContact O-N 3.14Å; S48-A51 CarbonylContact O-C 3.58Å; S48-A51 WeakPolarHBondContact O-CA 3.2Å; S48-A51 WeakPolarHBondContact O-CB 3.06Å; S48-A51 PolarHBondContact O-N 2.97Å; S48-A51 VanDerWaalsContact OG-CB 3.31Å; S48-A51 WeakPolarHBondContact OG-CB 3.41Å; S48-A51 PolarHBondContact OG-N 3.27Å; S48-A51 VanDerWaalsContact OG-N 3.11Å; S48-K52 PolarHBondContact O-N 3.08Å
49L73.6Confident67.3Low141 Ų141121.1 Ų121.174%0.73867%0.673SS**Hα-helixtrans-51.5-39.8177.4-174.171000111.1K52 M53L49-K52 PolarHBondContact O-N 3.14Å; L49-M53 VanDerWaalsContact O-CG 3.22Å; L49-M53 WeakPolarHBondContact O-CG 3.47Å; L49-M53 PolarHBondContact O-N 3.09Å
50G83.3Confident67.5Low44 Ų44120.3 Ų120.345%0.45467%0.669SS.*Hα-helixtrans-59.3-47.5170.900000113.3S48 K52 M53 V54S48-G50 PolarHBondContact O-N 3.18Å; S48-G50 VanDerWaalsContact O-N 3.14Å; G50-K52 VanDerWaalsContact C-N 3.29Å; G50-K52 PolarHBondContact O-N 3.34Å; G50-M53 PolarHBondContact O-N 3Å; G50-V54 VanDerWaalsContact O-CG2 3.29Å; G50-V54 WeakPolarHBondContact O-CG2 3.49Å; G50-V54 PolarHBondContact O-N 2.88Å
51A79.6Confident68Low46 Ų46123.1 Ų123.138%0.3867%0.673SS.*Hα-helixtrans-62.6-34.8176.600000112.9S48 A55S48-A51 CarbonylContact O-C 3.58Å; S48-A51 WeakPolarHBondContact O-CA 3.2Å; S48-A51 WeakPolarHBondContact O-CB 3.06Å; S48-A51 PolarHBondContact O-N 2.97Å; S48-A51 VanDerWaalsContact OG-CB 3.31Å; S48-A51 WeakPolarHBondContact OG-CB 3.41Å; S48-A51 PolarHBondContact OG-N 3.27Å; S48-A51 VanDerWaalsContact OG-N 3.11Å; A51-A55 WeakPolarHBondContact O-CB 3.47Å; A51-A55 PolarHBondContact O-N 2.95Å
52K80.4Confident68.1Low108 Ų108126.6 Ų126.647%0.4767%0.672SS.*Hα-helixtrans-71-39.9175.6-64.1-178.777-170.40111.8S47 S48 L49 G50 A55 I56S47-K52 VanDerWaalsContact OG-CG 3.25Å; S47-K52 WeakPolarHBondContact OG-CG 3.1Å; S48-K52 PolarHBondContact O-N 3.08Å; L49-K52 PolarHBondContact O-N 3.14Å; G50-K52 VanDerWaalsContact C-N 3.29Å; G50-K52 PolarHBondContact O-N 3.34Å; K52-A55 PolarHBondContact O-N 2.8Å; K52-I56 WeakPolarHBondContact O-CD1 3.36Å; K52-I56 VanDerWaalsContact O-CG1 3.3Å; K52-I56 WeakPolarHBondContact O-CG1 3.29Å; K52-I56 PolarHBondContact O-N 3.04Å
53M80.3Confident68.3Low124 Ų124127.2 Ų127.261%0.61167%0.67SS**Hα-helixtrans-66.2-42.2175.8-69.7-113.2-77.100111.7L49 G50 A55 I56 V57L49-M53 VanDerWaalsContact O-CG 3.22Å; L49-M53 WeakPolarHBondContact O-CG 3.47Å; L49-M53 PolarHBondContact O-N 3.09Å; G50-M53 PolarHBondContact O-N 3Å; M53-A55 VanDerWaalsContact C-N 3.35Å; M53-A55 PolarHBondContact O-N 2.87Å; M53-I56 PolarHBondContact O-N 3.42Å; M53-V57 WeakPolarHBondContact O-CB 3.47Å; M53-V57 WeakPolarHBondContact O-CG2 3.3Å; M53-V57 PolarHBondContact O-N 3.37Å
54V78.1Confident68.5Low105 Ų105126.7 Ų126.764%0.63667%0.668SS**Hα-helixtrans-62.6-40.7174.7171.30000111.4G50 I56 V57 G58G50-V54 VanDerWaalsContact O-CG2 3.29Å; G50-V54 WeakPolarHBondContact O-CG2 3.49Å; G50-V54 PolarHBondContact O-N 2.88Å; V54-I56 VanDerWaalsContact C-N 3.27Å; V54-I56 PolarHBondContact O-N 3Å; V54-V57 PolarHBondContact O-N 3.06Å; V54-G58 PolarHBondContact O-N 2.98Å
55A73.6Confident67.8Low65 Ų65122.5 Ų122.554%0.53767%0.665SS.*Hα-helixtrans-64.2-30.1176.300000113.2A51 K52 M53A51-A55 WeakPolarHBondContact O-CB 3.47Å; A51-A55 PolarHBondContact O-N 2.95Å; K52-A55 PolarHBondContact O-N 2.8Å; M53-A55 VanDerWaalsContact C-N 3.35Å; M53-A55 PolarHBondContact O-N 2.87Å
56I69.8Low66.9Low123 Ų123117 Ų11763%0.63166%0.655SS**Hα-helixtrans-80.1-43.5175.6-65.1163.9000110.8K52 M53 V54 G58 L59K52-I56 WeakPolarHBondContact O-CD1 3.36Å; K52-I56 VanDerWaalsContact O-CG1 3.3Å; K52-I56 WeakPolarHBondContact O-CG1 3.29Å; K52-I56 PolarHBondContact O-N 3.04Å; M53-I56 PolarHBondContact O-N 3.42Å; V54-I56 VanDerWaalsContact C-N 3.27Å; V54-I56 PolarHBondContact O-N 3Å; I56-G58 PolarHBondContact O-N 2.93Å; I56-L59 PolarHBondContact O-N 3.49Å
57V66.3Low65.8Low110 Ų110112.7 Ų112.767%0.66765%0.649SS**Hα-helixtrans-60.6-34176.1159.90000111.5M53 V54 L59 T60M53-V57 WeakPolarHBondContact O-CB 3.47Å; M53-V57 WeakPolarHBondContact O-CG2 3.3Å; M53-V57 PolarHBondContact O-N 3.37Å; V54-V57 PolarHBondContact O-N 3.06Å; V57-L59 VanDerWaalsContact C-N 3.32Å; V57-T60 PolarHBondContact O-OG1 2.91Å
58G61.9Low64.3Low62 Ų62118.6 Ų118.664%0.63967%0.67SS**THydrogen-bonded Turntrans-78.3-8.317400000115.2V54 I56 T60V54-G58 PolarHBondContact O-N 2.98Å; I56-G58 PolarHBondContact O-N 2.93Å; G58-T60 VanDerWaalsContact C-N 3.31Å
59L59.3Low62.6Low146 Ų146122 Ų12276%0.76468%0.682SS**THydrogen-bonded Turntrans-93.317.7179.3-148.274.3000112.8I56 V57 Q61I56-L59 PolarHBondContact O-N 3.49Å; V57-L59 VanDerWaalsContact C-N 3.32Å; L59-Q61 PolarHBondContact O-N 3.47Å; L59-Q61 VanDerWaalsContact O-N 3.14Å
60T62.3Low61.1Low123 Ų123120.7 Ų120.776%0.75568%0.681SS**  trans-7819.1174.153.80000113.8V57 G58 W62V57-T60 PolarHBondContact O-OG1 2.91Å; G58-T60 VanDerWaalsContact C-N 3.31Å; T60-W62 VanDerWaalsContact C-N 3.33Å; T60-W62 PolarHBondContact O-N 3.38Å; T60-W62 VanDerWaalsContact O-N 3.09Å
61Q55.9Low59.6Low183 Ų183127.2 Ų127.286%0.85570%0.7SS**SBendtrans-85.181169.6-166.4172.5-47.700110.2L59L59-Q61 PolarHBondContact O-N 3.47Å; L59-Q61 VanDerWaalsContact O-N 3.14Å
62W49.8Very low57.7Low196 Ų196130.6 Ų130.674%0.74272%0.718SS**  trans36.299.4152.2-166.8-65.1000116.4T60 K64T60-W62 VanDerWaalsContact C-N 3.33Å; T60-W62 PolarHBondContact O-N 3.38Å; T60-W62 VanDerWaalsContact O-N 3.09Å; W62-K64 HydrophobicContact CG-CG 4.37Å; W62-K64 PolarHBondContact O-N 2.76Å
63S57.4Low55.9Low122 Ų122133.7 Ų133.785%0.85374%0.735SS**  trans-74.399.8157.3-68.60000109.2S65S63-S65 VanDerWaalsContact C-N 3.31Å; S63-S65 PolarHBondContact O-N 3.5Å
64K49.8Very low54.6Low158 Ų158130.9 Ų130.969%0.68774%0.737SS**  trans-70.989.1166.2-86.7-166.6171.4-179.10107.1W62 T66W62-K64 HydrophobicContact CG-CG 4.37Å; W62-K64 PolarHBondContact O-N 2.76Å; K64-T66 VanDerWaalsContact C-N 3.26Å; K64-T66 HydrophobicContact CB-CG2 3.91Å; K64-T66 PolarHBondContact O-N 3.36Å
65S43.5Very low52.9Low120 Ų120130.2 Ų130.284%0.83974%0.743SS**  trans-69.788.1162.7-171.70000108S63S63-S65 VanDerWaalsContact C-N 3.31Å; S63-S65 PolarHBondContact O-N 3.5Å
66T50.9Low52.1Low105 Ų105133.9 Ų133.964%0.64476%0.759SS**  trans-96.388.2172.473.60000108.7K64K64-T66 VanDerWaalsContact C-N 3.26Å; K64-T66 HydrophobicContact CB-CG2 3.91Å; K64-T66 PolarHBondContact O-N 3.36Å
67L52.5Low51.3Low146 Ų146137.1 Ų137.176%0.76477%0.768SS**  trans-138.460.7156.4-71177.7000108.7L69L67-L69 HydrophobicContact CD2-CD2 4.24Å
68Q45.4Very low51Low188 Ų188141.8 Ų141.888%0.87978%0.78SS**  trans-72.3116.9135.9-68.6-175.76.900104.3P70Q68-P70 WeakPolarHBondContact O-CD 3.31Å
69L41.6Very low50.7Low147 Ų147146.6 Ų146.677%0.7779%0.79SS**  trans-81.9109.7175-66.1164.6000107.8L67L67-L69 HydrophobicContact CD2-CD2 4.24Å
70P42.5Very low50.6Low113 Ų113149.9 Ų149.973%0.73479%0.792SS**  trans-77.9116.6151.23.816.1000105.8Q68 P72Q68-P70 WeakPolarHBondContact O-CD 3.31Å; P70-P72 WeakPolarHBondContact O-CD 3.22Å
71Q49.9Very low50.3Low181 Ų181147.7 Ų147.785%0.84678%0.782SS**  trans-55.8117.5162.4177-174.620.500108.7
72P41Very low50.4Low117 Ų117145.5 Ų145.576%0.7678%0.776SS**  trans-99.6112.4158.78.415.4000106.7P70P70-P72 WeakPolarHBondContact O-CD 3.22Å
73E43.2Very low50.7Low174 Ų174141.9 Ų141.981%0.81377%0.77SS**  trans-48.6138.5163.2-161.8-92.515700110.1
74G51.6Low51Low65 Ų65146.7 Ų146.767%0.6777%0.769SS**  trans74.684.2166.300000118.2
75A43.6Very low51.3Low91 Ų91149.3 Ų149.375%0.75278%0.775SS**  trans-171.9112.9141.600000112.6K77A75-K77 PolarHBondContact O-N 3.21Å; A75-K77 VanDerWaalsContact O-N 3.08Å
76T55.5Low52.2Low142 Ų142149.1 Ų149.187%0.87177%0.774SS**  trans-57.295.7170.242.40000113.3
77K53.6Low52.6Low190 Ų190149.4 Ų149.483%0.82678%0.775SS**  trans-140.799.5156.3-60.9-174.7-173.6177.50109.6A75 L79A75-K77 PolarHBondContact O-N 3.21Å; A75-K77 VanDerWaalsContact O-N 3.08Å; K77-L79 PolarHBondContact O-N 3.17Å
78K59.2Low53.2Low209 Ų209151.3 Ų151.391%0.90978%0.78SS**  trans-58.987.8167.3-57176.7-177-179.30107.8R80K78-R80 PolarHBondContact O-N 2.8Å
79L55.8Low53.9Low162 Ų162148.1 Ų148.185%0.84877%0.774SS**  trans-75.480.3159.7-169.864.7000105.7K77 S81K77-L79 PolarHBondContact O-N 3.17Å; L79-S81 PolarHBondContact O-N 2.89Å
80R57.3Low54.9Low215 Ų215143.6 Ų143.681%0.81176%0.763SS**  trans-52.3100.7162.4-179.6176.8-175.6-172.91.7104.7K78 N82K78-R80 PolarHBondContact O-N 2.8Å; R80-N82 VanDerWaalsContact C-N 3.29Å; R80-N82 PolarHBondContact O-N 2.78Å
81S55.6Low55.6Low78 Ų78145.3 Ų145.355%0.54576%0.764SS.*  trans-61.899178.760.40000106.1L79 I83L79-S81 PolarHBondContact O-N 2.89Å; S81-I83 PolarHBondContact O-N 3.14Å
82N59.4Low56.1Low136 Ų136140.6 Ų140.673%0.72776%0.756SS**  trans-76.945.3167.6-141.8-48.7000108.5R80 R84R80-N82 VanDerWaalsContact C-N 3.29Å; R80-N82 PolarHBondContact O-N 2.78Å; N82-R84 PolarHBondContact O-N 3.11Å
83I56.3Low56.9Low121 Ų121140.2 Ų140.262%0.62175%0.751SS**  trans-69.593.5164.7-62.5165000102.9S81 R85S81-I83 PolarHBondContact O-N 3.14Å; I83-R85 HydrophobicContact CG2-CB 4.42Å; I83-R85 HydrophobicContact CG2-CG 3.69Å; I83-R85 PolarHBondContact O-N 2.93Å
84R62.9Low57.7Low222 Ų222139.9 Ų139.984%0.83875%0.75SS**  trans-58.888.9148.7-78.5174.172.2-173.53104.3N82 S86N82-R84 PolarHBondContact O-N 3.11Å; R84-S86 PolarHBondContact O-N 3.37Å
85R55.3Low57.9Low214 Ų214145.5 Ų145.581%0.80876%0.761SS**  trans-55.1115.2168.6-64.7177.194.4178.15.6102.7I83 T87I83-R85 HydrophobicContact CG2-CB 4.42Å; I83-R85 HydrophobicContact CG2-CG 3.69Å; I83-R85 PolarHBondContact O-N 2.93Å; R85-T87 PolarHBondContact O-N 3.31Å
86S62.5Low58.6Low116 Ų116152.1 Ų152.181%0.81177%0.766SS**  trans-46.8111.8176.7-42.30000106.2R84 E88R84-S86 PolarHBondContact O-N 3.37Å; S86-E88 PolarHBondContact O-N 2.88Å; S86-E88 VanDerWaalsContact O-N 3.16Å
87T60Low58.9Low111 Ų111149.8 Ų149.868%0.68176%0.756SS**  trans-51.9122.5164.945.90000104.9R85 T89R85-T87 PolarHBondContact O-N 3.31Å; T87-T89 VanDerWaalsContact C-N 3.31Å; T87-T89 PolarHBondContact O-N 3.24Å; T87-T89 PolarHBondContact O-OG1 2.86Å
88E65.2Low59.1Low186 Ų186151.2 Ų151.287%0.86976%0.756SS**  trans-47.495175.8-179.3-174.4155.200109.1S86 G90S86-E88 PolarHBondContact O-N 2.88Å; S86-E88 VanDerWaalsContact O-N 3.16Å; E88-G90 PolarHBondContact O-N 3.25Å
89T59.7Low58.9Low121 Ų121147.8 Ų147.874%0.74275%0.752SS**  trans-100.488.5-175.8-41.60000106.9T87T87-T89 VanDerWaalsContact C-N 3.31Å; T87-T89 PolarHBondContact O-N 3.24Å; T87-T89 PolarHBondContact O-OG1 2.86Å
90G63.2Low58.9Low52 Ų52145.7 Ų145.754%0.53675%0.746SS.*SBendtrans68.551.4132.200000119.2E88E88-G90 PolarHBondContact O-N 3.25Å
91I58Low58.8Low148 Ų148146.6 Ų146.676%0.75975%0.75SS**SBendtrans-115.5-5.4159.8-46.2-74.9000112
92A59.7Low58.5Low82 Ų82151.3 Ų151.368%0.67876%0.763SS**SBendtrans-97.214.5174.900000113.8
93V56.8Low58.6Low109 Ų109148 Ų14866%0.66176%0.761SS**SBendtrans-107.4-12.4178.2147.80000113.6M95V93-M95 VanDerWaalsContact C-N 3.33Å
94E61.2Low58.4Low168 Ų168147.3 Ų147.379%0.78577%0.767SS**G310 helixtrans-82.7-11.3174.8-69.8-173152.700113.4R96E94-R96 PolarHBondContact O-N 3.15Å
95M55.2Low58.1Low183 Ų183146.6 Ų146.690%0.90176%0.764SS**G310 helixtrans-8317.2171.5-66.6-16570.900113.6V93V93-M95 VanDerWaalsContact C-N 3.33Å
96R59.3Low58Low230 Ų230143.1 Ų143.187%0.86876%0.757SS**G310 helixtrans-109.711.3179.3-133.1174.3-177.5161.20.3115E94E94-R96 PolarHBondContact O-N 3.15Å
97S60Low57.7Low93 Ų93142.5 Ų142.565%0.6575%0.753SS**SBendtrans-152.6124177.9-1670000113.6
98R59Low57.2Low220 Ų220143.5 Ų143.583%0.8376%0.759SS**  trans9245.8179.6-62.5-176.2-102.9-105.3-0.6118.8T100R98-T100 VanDerWaalsContact C-N 3.31Å
99V54.4Low56.8Low136 Ų136142.5 Ų142.582%0.82476%0.76SS**  -94.380.3126171.40000106R101V99-R101 PolarHBondContact O-N 3.48Å
100T55.7Low56.8Low118 Ų118140 Ų14072%0.72476%0.758SS**  trans-64.4116.1148.52.10000103.8R98 Q102R98-T100 VanDerWaalsContact C-N 3.31Å; T100-Q102 PolarHBondContact O-N 3.3Å
101R56.4Low56.3Low235 Ų235142.5 Ų142.589%0.88777%0.767SS**  trans-49.998.7166.5-72.9172159.4-93.30.4106.5V99 G103V99-R101 PolarHBondContact O-N 3.48Å; R101-G103 PolarHBondContact O-N 2.98Å; R101-G103 VanDerWaalsContact O-N 3.1Å
102Q47.7Very low56.3Low176 Ų176142.3 Ų142.382%0.82277%0.773SS**  trans-72.9108.5174.5-155.9-175.4-2.600104.6T100 S104T100-Q102 PolarHBondContact O-N 3.3Å; Q102-S104 VanDerWaalsContact C-N 3.3Å; Q102-S104 PolarHBondContact O-N 2.92Å
103G62.4Low55.9Low66 Ų66145.1 Ų145.168%0.6878%0.776SS**  trans-66.197.2164.700000107.1R101 R105R101-G103 PolarHBondContact O-N 2.98Å; R101-G103 VanDerWaalsContact O-N 3.1Å; G103-R105 PolarHBondContact O-N 3.29Å
104S51.5Low55.5Low107 Ų107145.8 Ų145.875%0.74879%0.786SS**  trans-76.767.8160.932.80000108.6Q102Q102-S104 VanDerWaalsContact C-N 3.3Å; Q102-S104 PolarHBondContact O-N 2.92Å
105R56.9Low55.2Low208 Ų208145 Ų14579%0.78579%0.787SS**  trans-98111.2148.6-151.8-160155.2171.2-4.5101.5G103G103-R105 PolarHBondContact O-N 3.29Å
106E53.7Low55Low141 Ų141140.4 Ų140.466%0.65977%0.773SS**  cis-139.1115.832.3-94.569.2-160.400108.7
107S55.1Low55Low102 Ų102135.3 Ų135.371%0.71377%0.773SS**  trans-104.196.6158.949.90000108
108T50.7Low54.5Low133 Ų133137.7 Ų137.782%0.81678%0.778SS**  trans33.3102.8149-31.70000117.1
109D56.8Low54.2Low165 Ų165130.4 Ų130.488%0.88277%0.771SS**SBendtrans-4.1120.9143.8-173.216.4000116.5
110G59.3Low54.2Low68 Ų68129.6 Ų129.670%0.70177%0.767SS**  trans102.452.6149.900000119.1
111S51.8Low54Low105 Ų105132.3 Ų132.373%0.73477%0.769SS**  trans-135.383.1150.165.50000112.3N113S111-N113 VanDerWaalsContact C-N 3.34Å; S111-N113 PolarHBondContact O-N 3.35Å; S111-N113 VanDerWaalsContact O-N 3.1Å
112T59.5Low54.1Low143 Ų143128 Ų12888%0.87776%0.762SS**  trans-73.387.7162.9470000109.4
113N51.3Low54Low141 Ų141127.3 Ų127.375%0.75476%0.757SS**  trans-174.861.2148.958.38.4000113.3S111 N115S111-N113 VanDerWaalsContact C-N 3.34Å; S111-N113 PolarHBondContact O-N 3.35Å; S111-N113 VanDerWaalsContact O-N 3.1Å; N113-N115 PolarHBondContact O-N 3.21Å
114S47.9Very low53.5Low123 Ų123130.1 Ų130.186%0.8676%0.763SS**  trans-82.8105.6154.5-66.90000108.7
115N55.3Low53.5Low153 Ų153131.1 Ų131.182%0.81877%0.765SS**  trans-142.2132.2154.7-152.737000111.8N113N113-N115 PolarHBondContact O-N 3.21Å
116S50.4Low53.2Low85 Ų85125.6 Ų125.659%0.59475%0.754SS**  trans77.983.5168.8-51.30000117.2D118S116-D118 PolarHBondContact O-N 3.02Å
117S58.5Low53.2Low124 Ų124130.1 Ų130.187%0.86777%0.765SS**  trans-50.6107.7143.248.70000111.8
118D50.9Low53.1Low142 Ų142131.5 Ų131.576%0.75976%0.764SS**  trans-120.3127.4156.1-79.3-54.7000108.1S116 T120S116-D118 PolarHBondContact O-N 3.02Å; D118-T120 PolarHBondContact O-N 3.17Å
119G51.1Low53.4Low67 Ų67127.1 Ų127.169%0.69175%0.745SS**  trans-40117.2-16300000115F121G119-F121 VanDerWaalsContact C-N 3.27Å; G119-F121 PolarHBondContact O-N 3.4Å
120T55.3Low53.4Low119 Ų119122.8 Ų122.873%0.7373%0.732SS**  trans-62.787.3171.8-52.80000109.6D118 I122D118-T120 PolarHBondContact O-N 3.17Å; T120-I122 HydrophobicContact CG2-CD1 3.47Å; T120-I122 VanDerWaalsContact CG2-CD1 3.47Å; T120-I122 HydrophobicContact CG2-CG1 4.24Å; T120-I122 PolarHBondContact O-N 3.02Å
121F51.4Low53.4Low176 Ų176128 Ų12877%0.77274%0.738SS**  trans-63.4105.7157.3-81.1-79.9000107.3G119 F123G119-F121 VanDerWaalsContact C-N 3.27Å; G119-F121 PolarHBondContact O-N 3.4Å; F121-F123 HydrophobicContact CB-CD2 4.26Å; F121-F123 HydrophobicContact CD1-CE2 4.3Å; F121-F123 PolarHBondContact O-N 2.79Å
122I57.9Low53.9Low144 Ų144126.5 Ų126.574%0.73873%0.728SS**  trans-69.881173.8-56-71.5000107.7T120T120-I122 HydrophobicContact CG2-CD1 3.47Å; T120-I122 VanDerWaalsContact CG2-CD1 3.47Å; T120-I122 HydrophobicContact CG2-CG1 4.24Å; T120-I122 PolarHBondContact O-N 3.02Å
123F47Very low54.2Low162 Ų162125.9 Ų125.971%0.71172%0.715SS**  trans-131133.3160.7-69-74.8000108.1F121 T125F121-F123 HydrophobicContact CB-CD2 4.26Å; F121-F123 HydrophobicContact CD1-CE2 4.3Å; F121-F123 PolarHBondContact O-N 2.79Å; F123-T125 PolarHBondContact O-N 2.88Å
124P51.5Low54.8Low124 Ų124123.9 Ų123.981%0.80570%0.699SS**SBendtrans-65.2107.1176.927.1-30.5000108.8
125T50.7Low55.8Low129 Ų129120.7 Ų120.779%0.79168%0.677SS**SBendtrans43.386.4153.8-50.30000116.4F123F123-T125 PolarHBondContact O-N 2.88Å
126T52.1Low56.7Low92 Ų92118.9 Ų118.956%0.56467%0.668SS**  trans-140.565.9145.141.40000108.5L128T126-L128 VanDerWaalsContact C-N 3.27Å; T126-L128 PolarHBondContact O-N 2.91Å; T126-L128 VanDerWaalsContact O-N 3.08Å
127R53.8Low57.8Low236 Ų236118 Ų11889%0.89165%0.653SS**  trans-72.196.6155.5-72.4-167.1-164-963.1105.4G129R127-G129 PolarHBondContact O-N 3.33Å
128L53.1Low58.5Low131 Ų131115.9 Ų115.969%0.68663%0.632SS**  trans-66.983.2170.2-66171.1000107.9T126 F134T126-L128 VanDerWaalsContact C-N 3.27Å; T126-L128 PolarHBondContact O-N 2.91Å; T126-L128 VanDerWaalsContact O-N 3.08Å; L128-F134 HydrophobicContact CD2-CB 3.98Å; L128-F134 HydrophobicContact CD2-CD2 3.9Å; L128-F134 HydrophobicContact CD2-CG 4.18Å
129G57Low59.7Low40 Ų40115.9 Ų115.941%0.41263%0.632SS.*  trans-105.3115.4166.700000108R127R127-G129 PolarHBondContact O-N 3.33Å
130A56.8Low60.7Low74 Ų74115.5 Ų115.561%0.61263%0.628SS**SBendtrans58.4121.7-176.600000114.5S132 Q133A130-S132 PolarHBondContact O-N 3.2Å; A130-Q133 PolarHBondContact O-N 3.27Å; A130-Q133 VanDerWaalsContact O-N 3.07Å
131E58.3Low61.5Low178 Ų178110.9 Ų110.983%0.83260%0.599SS**THydrogen-bonded Turntrans-41.6-16-179.6-49.6-68.9118.900116.3S135E131-S135 PolarHBondContact O-OG 2.89Å
132S61.7Low62.4Low74 Ų74104 Ų10452%0.51758%0.577SS.*Hα-helixtrans-76.1-36.7176.860.30000114.5A130 F134 S135 D136A130-S132 PolarHBondContact O-N 3.2Å; S132-F134 VanDerWaalsContact C-N 3.28Å; S132-F134 PolarHBondContact O-N 3.02Å; S132-S135 WeakPolarHBondContact O-CB 3.36Å; S132-S135 PolarHBondContact O-N 3.07Å; S132-D136 PolarHBondContact O-N 3.16Å
133Q67.4Low62.6Low130 Ų130102.9 Ų102.961%0.60758%0.579SS**Hα-helixtrans-70.9-23.3-176.6-89.3-173.535.300113.7A130 F137A130-Q133 PolarHBondContact O-N 3.27Å; A130-Q133 VanDerWaalsContact O-N 3.07Å; Q133-F137 WeakPolarHBondContact O-CB 3.41Å; Q133-F137 PolarHBondContact O-N 3.31Å
134F63.6Low63.1Low98 Ų9899.3 Ų99.343%0.4358%0.58SS.*Hα-helixtrans-73.9-33.4174.3-178-111.8000111.6L128 S132 F137 L138L128-F134 HydrophobicContact CD2-CB 3.98Å; L128-F134 HydrophobicContact CD2-CD2 3.9Å; L128-F134 HydrophobicContact CD2-CG 4.18Å; S132-F134 VanDerWaalsContact C-N 3.28Å; S132-F134 PolarHBondContact O-N 3.02Å; F134-F137 HydrophobicContact CD2-CD1 4.34Å; F134-F137 HydrophobicContact CE2-CD1 4.39Å; F134-F137 WeakPolarHBondContact O-CB 3.4Å; F134-F137 PolarHBondContact O-N 3.33Å; F134-L138 HydrophobicContact CD1-CD1 4.15Å; F134-L138 HydrophobicContact CE1-CD1 3.66Å; F134-L138 HydrophobicContact CE1-CG 4.16Å; F134-L138 HydrophobicContact CE2-CD2 4.49Å; F134-L138 HydrophobicContact CZ-CD1 4.07Å; F134-L138 HydrophobicContact CZ-CD2 4.14Å; F134-L138 HydrophobicContact CZ-CG 4.19Å; F134-L138 WeakPolarHBondContact O-CG 3.44Å; F134-L138 PolarHBondContact O-N 2.72Å
135S68.9Low63.7Low57 Ų5798.7 Ų98.740%0.39957%0.566SS.*Hα-helixtrans-69.5-47.8178.5-550000111.2E131 S132 F137 L138 D139E131-S135 PolarHBondContact O-OG 2.89Å; S132-S135 WeakPolarHBondContact O-CB 3.36Å; S132-S135 PolarHBondContact O-N 3.07Å; S135-F137 PolarHBondContact O-N 2.84Å; S135-L138 PolarHBondContact O-N 3.08Å; S135-D139 PolarHBondContact O-N 3Å
136D72.9Confident64.1Low114 Ų11497.5 Ų97.561%0.6155%0.554SS**Hα-helixtrans-60.1-31.5174.8-66.6-26.7000112.2S132 G140S132-D136 PolarHBondContact O-N 3.16Å; D136-G140 PolarHBondContact O-N 2.82Å
137F73.8Confident64.4Low67 Ų6798.6 Ų98.629%0.29456%0.56SS.*Hα-helixtrans-68.8-44.6173.4168.7-98.8000112Q133 F134 S135 G140 L141Q133-F137 WeakPolarHBondContact O-CB 3.41Å; Q133-F137 PolarHBondContact O-N 3.31Å; F134-F137 HydrophobicContact CD2-CD1 4.34Å; F134-F137 HydrophobicContact CE2-CD1 4.39Å; F134-F137 WeakPolarHBondContact O-CB 3.4Å; F134-F137 PolarHBondContact O-N 3.33Å; S135-F137 PolarHBondContact O-N 2.84Å; F137-G140 PolarHBondContact O-N 3.14Å; F137-L141 HydrophobicContact CD1-CD1 4.36Å; F137-L141 HydrophobicContact CE1-CD1 3.67Å; F137-L141 HydrophobicContact CE1-CG 4.22Å; F137-L141 HydrophobicContact CE2-CD2 4.02Å; F137-L141 HydrophobicContact CE2-CG 4.31Å; F137-L141 HydrophobicContact CZ-CD1 3.77Å; F137-L141 HydrophobicContact CZ-CD2 3.8Å; F137-L141 HydrophobicContact CZ-CG 3.97Å; F137-L141 WeakPolarHBondContact O-CG 3.49Å; F137-L141 PolarHBondContact O-N 3.37Å; F137-L141 VanDerWaalsContact O-N 3.15Å
138L74.1Confident64.6Low79 Ų7990.5 Ų90.541%0.41455%0.55SS..Hα-helixtrans-64-40.7176.2-69.6-179.1000112.2F134 S135 G140 L141F134-L138 HydrophobicContact CD1-CD1 4.15Å; F134-L138 HydrophobicContact CE1-CD1 3.66Å; F134-L138 HydrophobicContact CE1-CG 4.16Å; F134-L138 HydrophobicContact CE2-CD2 4.49Å; F134-L138 HydrophobicContact CZ-CD1 4.07Å; F134-L138 HydrophobicContact CZ-CD2 4.14Å; F134-L138 HydrophobicContact CZ-CG 4.19Å; F134-L138 WeakPolarHBondContact O-CG 3.44Å; F134-L138 PolarHBondContact O-N 2.72Å; S135-L138 PolarHBondContact O-N 3.08Å; L138-G140 VanDerWaalsContact C-N 3.29Å; L138-G140 PolarHBondContact O-N 3Å; L138-L141 HydrophobicContact CD2-CD1 4.18Å; L138-L141 PolarHBondContact O-N 2.62Å
139D74.8Confident64.9Low142 Ų14291.6 Ų91.676%0.75955%0.545SS*.Hα-helixtrans-70.2-28177.5-70.9-16.4000112.1S135S135-D139 PolarHBondContact O-N 3Å
140G72.3Confident65.1Low59 Ų5997.8 Ų97.861%0.60856%0.563SS**Hα-helixtrans-79.5-12.9173.300000114.9D136 F137 L138 G142D136-G140 PolarHBondContact O-N 2.82Å; F137-G140 PolarHBondContact O-N 3.14Å; L138-G140 VanDerWaalsContact C-N 3.29Å; L138-G140 PolarHBondContact O-N 3Å; G140-G142 PolarHBondContact O-N 2.93Å
141L71.8Confident64.8Low23 Ų23100.2 Ų100.212%0.1257%0.57CS.*SBendtrans-77.5109.3175.3-72.2174.1000109.4F137 L138 Q145 I146F137-L141 HydrophobicContact CD1-CD1 4.36Å; F137-L141 HydrophobicContact CE1-CD1 3.67Å; F137-L141 HydrophobicContact CE1-CG 4.22Å; F137-L141 HydrophobicContact CE2-CD2 4.02Å; F137-L141 HydrophobicContact CE2-CG 4.31Å; F137-L141 HydrophobicContact CZ-CD1 3.77Å; F137-L141 HydrophobicContact CZ-CD2 3.8Å; F137-L141 HydrophobicContact CZ-CG 3.97Å; F137-L141 WeakPolarHBondContact O-CG 3.49Å; F137-L141 PolarHBondContact O-N 3.37Å; F137-L141 VanDerWaalsContact O-N 3.15Å; L138-L141 HydrophobicContact CD2-CD1 4.18Å; L138-L141 PolarHBondContact O-N 2.62Å; L141-Q145 HydrophobicContact CB-CB 4.37Å; L141-Q145 HydrophobicContact CD2-CB 3.97Å; L141-I146 HydrophobicContact CB-CG1 3.95Å; L141-I146 HydrophobicContact CD1-CG1 4.4Å
142G70.1Confident64.7Low30 Ų3099.9 Ų99.931%0.30957%0.573SS.*  trans-55.9152.2174.400000111.3G140 A144 Q145G140-G142 PolarHBondContact O-N 2.93Å; G142-A144 PolarHBondContact O-N 2.94Å; G142-Q145 WeakPolarHBondContact O-CB 3.45Å; G142-Q145 PolarHBondContact O-N 2.94Å
143P62.2Low64.2Low121 Ų12199.7 Ų99.779%0.78658%0.576SS**THydrogen-bonded Turntrans-51.7-26.4-174.9-28.233.4000114.9
144A58.1Low63.4Low88 Ų8899.4 Ų99.473%0.72758%0.583SS**THydrogen-bonded Turntrans-79.7-19.317700000114.6G142G142-A144 PolarHBondContact O-N 2.94Å
145Q64.4Low62.8Low110 Ų11099.9 Ų99.951%0.51460%0.597SS.*THydrogen-bonded Turntrans-88.1-23.8-175.7-64.7-176.7-21.500113L141 G142 V147 G148L141-Q145 HydrophobicContact CB-CB 4.37Å; L141-Q145 HydrophobicContact CD2-CB 3.97Å; G142-Q145 WeakPolarHBondContact O-CB 3.45Å; G142-Q145 PolarHBondContact O-N 2.94Å; Q145-V147 VanDerWaalsContact C-N 3.28Å; Q145-V147 PolarHBondContact O-N 3.04Å; Q145-G148 PolarHBondContact O-N 2.79Å
146I59.9Low61.8Low104 Ų104102.9 Ų102.953%0.53361%0.614SS.*G310 helixtrans-68.2-30175.7-57.4174.2000110.9L141 G148L141-I146 HydrophobicContact CB-CG1 3.95Å; L141-I146 HydrophobicContact CD1-CG1 4.4Å; I146-G148 VanDerWaalsContact C-N 3.33Å; I146-G148 PolarHBondContact O-N 2.75Å
147V58.4Low61Low116 Ų116105.7 Ų105.770%0.70363%0.626SS**G310 helixtrans-80.8-12.9-179.9-171.20000112.7Q145Q145-V147 VanDerWaalsContact C-N 3.28Å; Q145-V147 PolarHBondContact O-N 3.04Å
148G56.3Low60.1Low65 Ų65104.6 Ų104.667%0.6763%0.634SS**G310 helixtrans-86.9-6.5-178.200000115.5Q145 I146Q145-G148 PolarHBondContact O-N 2.79Å; I146-G148 VanDerWaalsContact C-N 3.33Å; I146-G148 PolarHBondContact O-N 2.75Å
149R60.6Low58.9Low155 Ų155107.8 Ų107.859%0.58565%0.651SS**  trans-105.577178.9-64.7-176.2176.7-143.9-4.3109.4T151R149-T151 PolarHBondContact O-N 2.68Å
150Q59.9Low57.7Low170 Ų170111.1 Ų111.179%0.79465%0.653SS**  trans-67104.4168.7-63.6-169.41.900108.6L152Q150-L152 PolarHBondContact O-N 2.9Å
151T51.9Low56.8Low124 Ų124114.9 Ų114.976%0.76166%0.658SS**  trans-66.196.2170.6-61.30000108.8R149 A153R149-T151 PolarHBondContact O-N 2.68Å; T151-A153 PolarHBondContact O-N 3.25Å
152L55.2Low55.8Low172 Ų172116.9 Ų116.990%0.90169%0.685SS**  trans-7954.8176.7-129157.4000110.4Q150Q150-L152 PolarHBondContact O-N 2.9Å
153A52.4Low55.2Low70 Ų70126.3 Ų126.358%0.57971%0.711SS**SBendtrans-170.187.7169.600000108.9T151T151-A153 PolarHBondContact O-N 3.25Å
154T50.8Low54.8Low123 Ų123127 Ų12776%0.75571%0.707SS**  trans161107.8149.2-67.80000107.2
155P49.7Very low54.4Low109 Ų109131.4 Ų131.471%0.70871%0.706SS**  trans-61.7132.8162.725.1-29.4000107.7M157P155-M157 PolarHBondContact O-N 3.03Å
156P49.2Very low54Low119 Ų119131.5 Ų131.577%0.77372%0.716SS**  trans-60.9104.1177.424.6-32.2000108.6G158P156-G158 PolarHBondContact O-N 2.67Å
157M55.5Low53.9Low173 Ų173133.6 Ų133.685%0.85272%0.723SS**THydrogen-bonded Turntrans-69.860.1154.9-82.3-151.3-59.600108.4P155P155-M157 PolarHBondContact O-N 3.03Å
158G53.9Low53.5Low44 Ų44130 Ų13045%0.45471%0.71SS.*THydrogen-bonded Turntrans-109.5-27.717900000112.9P156 R160 L161P156-G158 PolarHBondContact O-N 2.67Å; G158-R160 PolarHBondContact O-N 3.44Å; G158-L161 PolarHBondContact O-N 3.31Å
159D50.4Low53.1Low147 Ų147132.8 Ų132.879%0.78672%0.716SS**THydrogen-bonded Turntrans-81.12.6-177.4-90.8-1.5000114.6
160R49.7Very low52.5Low212 Ų212134.2 Ų134.280%0.873%0.729SS**THydrogen-bonded Turntrans-105.30.1173-80.8-157.7-93.9-176.3-6.2115G158G158-R160 PolarHBondContact O-N 3.44Å
161L51.8Low52Low137 Ų137133.3 Ų133.372%0.71774%0.735SS**THydrogen-bonded Turntrans-96.8-24.1172.2-140.576.8000112.8G158 R163 L164G158-L161 PolarHBondContact O-N 3.31Å; L161-R163 VanDerWaalsContact C-N 3.28Å; L161-R163 PolarHBondContact O-N 2.94Å; L161-L164 PolarHBondContact O-N 3.15Å
162G51.3Low51.6Low66 Ų66134.8 Ų134.868%0.6874%0.738SS**THydrogen-bonded Turntrans-73.7-11.3176.300000115.3
163R56.8Low51.1Low227 Ų227134.6 Ų134.686%0.85773%0.732SS**THydrogen-bonded Turntrans-103.510.3175.1-58-165.6-159.3-88.5-0113.9L161L161-R163 VanDerWaalsContact C-N 3.28Å; L161-R163 PolarHBondContact O-N 2.94Å
164L54.9Low50.5Low135 Ų135135.3 Ų135.371%0.70775%0.746SS**SBendtrans-111.9-2.8174.4-170.258.7000112.5L161L161-L164 PolarHBondContact O-N 3.15Å
165W50.1Low50.4Low182 Ų182138 Ų13869%0.68975%0.75SS**  trans-12878.1177.7-160.3-97.9000111.6H167 G168W165-H167 PolarHBondContact NE1-O 2.89Å; W165-H167 PolarHBondContact O-N 3.02Å; W165-H167 VanDerWaalsContact O-N 3.12Å; W165-G168 VanDerWaalsContact NE1-CA 3.35Å
166P55.6Low49.7Very low112 Ų112136 Ų13673%0.72775%0.748SS**SBendtrans-68.8-2.4177.426.3-30.9000113.9
167H57.3Low49.9Very low147 Ų147135.3 Ų135.368%0.68174%0.744SS**  trans-138.570.8-176.4-66.3-64.4000113.3W165W165-H167 PolarHBondContact NE1-O 2.89Å; W165-H167 PolarHBondContact O-N 3.02Å; W165-H167 VanDerWaalsContact O-N 3.12Å
168G49.8Very low49.4Very low42 Ų42134 Ų13443%0.43374%0.74SS.*  trans-51.6147.9162.700000111.2W165 Q170W165-G168 VanDerWaalsContact NE1-CA 3.35Å; G168-Q170 PolarHBondContact O-N 3.04Å
169P48.2Very low49.2Very low123 Ų123141.4 Ų141.480%0.79976%0.763SS**  trans-63.8113.5-17426.8-32.3000109.5V171P169-V171 PolarHBondContact O-N 3.25Å; P169-V171 VanDerWaalsContact O-N 3.09Å
170Q47.2Very low48.9Very low184 Ų184139.4 Ų139.486%0.8677%0.767SS**  trans-67.2106.8170.3-55.2-159.393.200107G168 L172G168-Q170 PolarHBondContact O-N 3.04Å; Q170-L172 PolarHBondContact O-N 3.17Å
171V49.5Very low48.6Very low152 Ų152132.9 Ų132.992%0.92177%0.765SS**  trans-63.2122.4172.4-113.60000108.3P169P169-V171 PolarHBondContact O-N 3.25Å; P169-V171 VanDerWaalsContact O-N 3.09Å
172L43.6Very low48.2Very low155 Ų155138.2 Ų138.281%0.81278%0.776SS**  trans-65.9129.7-168.7-174.869000112.2Q170Q170-L172 PolarHBondContact O-N 3.17Å
173H46.1Very low47.9Very low168 Ų168140 Ų14078%0.77878%0.784SS**  trans25.7108.8149.2-77.572000118.6
174G39.2Very low47.2Very low85 Ų85132.6 Ų132.688%0.87678%0.779SS**  trans-116.392.9152.300000109.6
175H48.5Very low46.9Very low180 Ų180132.2 Ų132.283%0.83378%0.784SS**  trans-83127.8171.3-153.8-86.3000108.3
176G34.9Very low46.7Very low66 Ų66132.1 Ų132.168%0.6879%0.791SS**  trans-151.2122.4174.600000109.7
177P53.2Low46.3Very low104 Ų104138.3 Ų138.368%0.67580%0.8SS**  trans-90.3155.3-160.735.4-34.4000114.4
178D45.3Very low46Very low146 Ų146142.4 Ų142.478%0.78181%0.81SS**  trans50.999.4144.9-61.9-42.1000120
179H49.3Very low45.8Very low199 Ų199143.5 Ų143.592%0.92182%0.821SS**  trans-129.6113.5134.2-86.8-55.5000111.1
180A45.3Very low45.8Very low106 Ų106145.4 Ų145.488%0.87682%0.819SS**  trans-54.9138.4169.800000111.9
181G41.9Very low45.8Very low74 Ų74147.7 Ų147.776%0.76382%0.819SS**  trans-173.860.7-178.400000116.3
182R44Very low45.6Very low250 Ų250147 Ų14794%0.94381%0.81SS**  trans69.5123.7138.8-158.7168.1178.7-154.6-0.3119.9
183A44.3Very low46.1Very low103 Ų103144.2 Ų144.285%0.85180%0.799SS**  trans-49.814917500000118.1
184G41.8Very low46.3Very low72 Ų72144.2 Ų144.274%0.74280%0.799SS**  trans-164.1132.7156.500000110.9
185P48.8Very low46.6Very low127 Ų127146 Ų14683%0.82579%0.794SS**  trans-93.8143.3-164.935.4-33.1000115.2
186Q46.8Very low46.5Very low180 Ų180143.5 Ų143.584%0.84179%0.786SS**  trans21117.5135.9-168.4176.76700118.9
187R47.7Very low47.4Very low242 Ų242146 Ų14691%0.91379%0.79SS**  trans-164.798.1141.9-106.6162.5-172.3-94.8-0.1111
188R49.5Very low47.4Very low233 Ų233147.8 Ų147.888%0.87979%0.789SS**  42.689.3110.6-97.4-172.2172.1-175.4-0.8114.3H190R188-H190 PolarHBondContact O-CE1 3.43Å
189G46.3Very low47.2Very low65 Ų65148.4 Ų148.467%0.6779%0.792SS**  trans-109.382.6163.100000111.3R191G189-R191 PolarHBondContact O-N 3.25Å
190H48.5Very low47Very low162 Ų162146.9 Ų146.975%0.7579%0.789SS**  trans13.399.9152.11.2-77.3000117.6R188 L192R188-H190 PolarHBondContact O-CE1 3.43Å; H190-L192 PolarHBondContact O-N 3.42Å; H190-L192 VanDerWaalsContact O-N 3.13Å
191R47Very low47Very low232 Ų232147.2 Ų147.288%0.87579%0.785SS**  trans-6994.5157.8-167.7-173.8-176.5-179.11107.9G189 V193G189-R191 PolarHBondContact O-N 3.25Å; R191-V193 VanDerWaalsContact C-N 3.25Å; R191-V193 HydrophobicContact CG-CG2 3.84Å; R191-V193 PolarHBondContact O-N 2.77Å
192L45.9Very low47Very low138 Ų138147.3 Ų147.372%0.72379%0.786SS**  trans-76.184.4167.7-99156.1000108.5H190 Q194H190-L192 PolarHBondContact O-N 3.42Å; H190-L192 VanDerWaalsContact O-N 3.13Å; L192-Q194 VanDerWaalsContact C-N 3.31Å; L192-Q194 HydrophobicContact CD2-CG 3.76Å; L192-Q194 PolarHBondContact O-N 2.81Å
193V54.5Low47.1Very low97 Ų97145.3 Ų145.359%0.58878%0.779SS**  trans-71.994.3156.5-171.80000105.3R191R191-V193 VanDerWaalsContact C-N 3.25Å; R191-V193 HydrophobicContact CG-CG2 3.84Å; R191-V193 PolarHBondContact O-N 2.77Å
194Q48.7Very low47Very low167 Ų167148.3 Ų148.378%0.7878%0.779SS**  trans-90.8104163.8-75.5-163.928.600108.7L192L192-Q194 VanDerWaalsContact C-N 3.31Å; L192-Q194 HydrophobicContact CD2-CG 3.76Å; L192-Q194 PolarHBondContact O-N 2.81Å
195T47.2Very low47.3Very low123 Ų123152.4 Ų152.476%0.75578%0.779SS**  trans-60.7137.2170.8-25.80000110.3
196L45.1Very low47.3Very low128 Ų128152.2 Ų152.267%0.6778%0.776SS**  trans-51.8147.5170.6-167.563.4000112.4H198L196-H198 WeakPolarHBondContact CD2-ND1 3.25Å; L196-H198 WeakPolarHBondContact CG-ND1 3.42Å
197P55Low47.1Very low119 Ų119155.2 Ų155.277%0.77378%0.779SS**  trans-123.5128.8130.333.5-27.9000112.5
198H52.2Low47.4Very low141 Ų141150.3 Ų150.365%0.65377%0.77SS**  trans-79.7120.1172.114.1-85.6000108.7L196L196-H198 WeakPolarHBondContact CD2-ND1 3.25Å; L196-H198 WeakPolarHBondContact CG-ND1 3.42Å
199L41.7Very low47.3Very low159 Ų159145 Ų14583%0.83277%0.765SS**  trans-170.9112.3153.2-143.368.1000109.9
200L45.2Very low47.5Very low166 Ų166150.8 Ų150.887%0.86978%0.775SS**  -167.5119.6116.2-150.463000111.1G202L200-G202 PolarHBondContact O-N 2.94Å
201S45.8Very low47.4Very low114 Ų114151.7 Ų151.780%0.79778%0.779SS**  trans-50.4116.5169.1-63.10000112.9
202G40.8Very low47.6Very low76 Ų76144.9 Ų144.978%0.78477%0.773SS**  trans-10286.8162.900000110.3L200 L204L200-G202 PolarHBondContact O-N 2.94Å; G202-L204 PolarHBondContact O-N 3.14Å
203R45.5Very low48.1Very low208 Ų208144.4 Ų144.479%0.78578%0.778SS**  trans-50.9119.6179.2-158.1179.5-169.6-163.13.7111.9H205R203-H205 PolarHBondContact O-N 3.43Å
204L43.7Very low48.3Very low165 Ų165146 Ų14686%0.86479%0.787SS**  trans-62111.2168.2-73.1163.3000109.2G202 T206G202-L204 PolarHBondContact O-N 3.14Å; L204-T206 PolarHBondContact O-N 3.01Å
205H46.7Very low48.6Very low158 Ų158143 Ų14373%0.73178%0.783SS**  trans-83104.9164.6-80.493.1000108.6R203 R207R203-H205 PolarHBondContact O-N 3.43Å; H205-R207 PolarHBondContact O-N 2.74Å; H205-R207 VanDerWaalsContact O-N 3.11Å
206T48.9Very low49.1Very low124 Ų124143.6 Ų143.676%0.76179%0.785SS**  trans-61.6102.9162.548.90000108.6L204 I208L204-T206 PolarHBondContact O-N 3.01Å; T206-I208 PolarHBondContact O-N 3.1Å
207R42.5Very low49.5Very low243 Ų243146.3 Ų146.392%0.91779%0.792SS**  trans-72.4107165.5-94.2-167.1-175-1602.7108.4H205H205-R207 PolarHBondContact O-N 2.74Å; H205-R207 VanDerWaalsContact O-N 3.11Å
208I53.9Low49.6Very low139 Ų139146.6 Ų146.671%0.71379%0.794SS**  trans-72.3125.5162.4-59.7168000106.9T206 H210T206-I208 PolarHBondContact O-N 3.1Å; I208-H210 PolarHBondContact O-N 3.1Å
209P48.4Very low49.4Very low121 Ų121143 Ų14379%0.78680%0.795SS**  trans-74.4112.6170.228.2-29.7000109.3Q211P209-Q211 PolarHBondContact O-N 3.28Å
210H51.2Low49.7Very low186 Ų186143.6 Ų143.686%0.86179%0.793SS**PPolyproline II helixtrans-65.7127.1170.8-122.5-86.4000109.4I208I208-H210 PolarHBondContact O-N 3.1Å
211Q46.4Very low49.8Very low182 Ų182141.3 Ų141.385%0.8579%0.79SS**PPolyproline II helixtrans-51.6136.5168.8-87.3177.15.300110.9P209P209-Q211 PolarHBondContact O-N 3.28Å
212A50.7Low50.2Low89 Ų89143.5 Ų143.574%0.73679%0.787SS**PPolyproline II helixtrans-70143.8171.300000110.9
213P55.8Low50.6Low127 Ų127148.5 Ų148.583%0.82579%0.79SS**PPolyproline II helixtrans-74.9137.1176.8-0.415.4000111.6
214V58.9Low51.3Low131 Ų131143.4 Ų143.479%0.79478%0.784SS**PPolyproline II helixtrans-69.4132.3171.4-138.90000109.2V216V214-V216 PolarHBondContact O-N 3.24Å
215P56.1Low51.8Low105 Ų105144 Ų14468%0.68279%0.787SS**PPolyproline II helixtrans-73.2117.8174.627-30.7000110.6
216V57.3Low52.4Low134 Ų134144.1 Ų144.181%0.81279%0.79SS**PPolyproline II helixtrans-79.1117.4169.2175.20000108V214 P218V214-V216 PolarHBondContact O-N 3.24Å; V216-P218 WeakPolarHBondContact O-CD 3.4Å
217F52.8Low52.7Low186 Ų186149.9 Ų149.982%0.81682%0.815SS**PPolyproline II helixtrans-80.7121.4169.1-71.7-86.5000109.2G219F217-G219 PolarHBondContact O-N 2.97Å
218P56.8Low53.2Low124 Ų124145.2 Ų145.281%0.80581%0.81SS**PPolyproline II helixtrans-75.7120.2168.528.5-28.6000109.4V216V216-P218 WeakPolarHBondContact O-CD 3.4Å
219G49.4Very low53.2Low65 Ų65145.5 Ų145.567%0.6782%0.815SS**PPolyproline II helixtrans-80.1166165.600000112.3F217F217-G219 PolarHBondContact O-N 2.97Å
220E47.6Very low53.5Low172 Ų172146.9 Ų146.980%0.80482%0.816SS**  trans77.7138.5170.7-55.2-144.198.700115.4
221C47.6Very low53.6Low118 Ų118144.6 Ų144.680%0.79781%0.814SS**  cis-148.8148.444.8-59.80000113.9
222H52.3Low54Low160 Ų160142.3 Ų142.374%0.74181%0.811SS**  trans-36.7142163.2-84.287.9000115.7
223Q50.6Low54.3Low182 Ų182145.8 Ų145.885%0.8582%0.816SS**  trans-123.7117.3145.6-73.6-88.34700107.4
224P59.7Low54.2Low100 Ų100147.1 Ų147.165%0.64982%0.816SS**  trans-86.7126.716832.4-26.3000108.7
225L55.2Low53.8Low177 Ų177148.4 Ų148.493%0.92782%0.818SS**  trans-114.2117.7161.2-133.1109.8000108.7
226M59.1Low53.6Low162 Ų162152 Ų15280%0.79883%0.829SS**  trans-82.9149.7-178.9-71.1-100.7-72.600111.2
227L54.8Low53.3Low244 Ų244153.6 Ų153.6100%1.27783%0.83SS**  trans760172-107.278.2000118.1

Retrieved 227 of 227 residues in 68.2 ms (Link to these results)