A0A087XAT5_POEFO Loading...

WAS/WASL interacting protein family member 3

AlphaFold DB , UniProt , Accession A0A087XAT5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 411 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
1E37.9Very low55.3Low179 Ų179117.7 Ų117.784%0.83677%0.766SS**  0133.90-143.9-161.2129.600110.6R27E1-R27 PolarHBondContact O-NH1 3.08Å; E1-R27 PolarHBondContact O-NH2 3.23Å
2P49.3Very low57.8Low90 Ų90111.8 Ų111.858%0.58474%0.742SS**  trans-71.2153.2150.134.1-32.8000109.1Q4P2-Q4 PolarHBondContact O-N 2.83Å; P2-Q4 VanDerWaalsContact O-N 3.14Å
3P56.6Low60.5Low97 Ų97118.1 Ų118.163%0.6374%0.741SS**  trans-64.1118.2173.128-32.6000109.2L5P3-L5 PolarHBondContact O-N 2.97Å
4Q52.2Low62.7Low160 Ų160118.6 Ų118.675%0.74874%0.736SS**  trans-64.5110168.3-72.1-165.8-1.300109.2P2 Q6P2-Q4 PolarHBondContact O-N 2.83Å; P2-Q4 VanDerWaalsContact O-N 3.14Å; Q4-Q6 PolarHBondContact O-N 3.11Å
5L60.8Low64.7Low164 Ų164113.5 Ų113.586%0.85971%0.71SS**  trans-65.6111.4157-64.4177.6000106.3P3 S7P3-L5 PolarHBondContact O-N 2.97Å; L5-S7 PolarHBondContact O-N 3.13Å
6Q56.8Low66.5Low183 Ų183113.2 Ų113.286%0.85570%0.701SS**  trans-63.4107.5174.5-76.7-176-27.500108.5Q4 G8Q4-Q6 PolarHBondContact O-N 3.11Å; Q6-G8 PolarHBondContact O-N 3.32Å
7S58.6Low68.1Low132 Ų132110.4 Ų110.492%0.92368%0.68SS**  trans-75.758.1171.4-159.50000110.2L5L5-S7 PolarHBondContact O-N 3.13Å
8G50.8Low69.5Low60 Ų60107.2 Ų107.262%0.61967%0.666SS**  trans-80.8124.1169.100000109.2Q6Q6-G8 PolarHBondContact O-N 3.32Å
9G59.4Low70.8Confident85 Ų85106.2 Ų106.288%0.87666%0.656SS**THydrogen-bonded Turntrans-62.2151-176.700000113.5
10G63Low71.9Confident85 Ų85106.6 Ų106.688%0.87665%0.653SS**THydrogen-bonded Turntrans107.1-2.517400000116.3G12G10-G12 PolarHBondContact O-N 3.47Å
11G63.3Low73Confident60 Ų60109.6 Ų109.662%0.61966%0.659SS**  trans-74.376.7179.900000115.1
12G85.4Confident75.7Confident46 Ų46108.5 Ų108.547%0.47465%0.652SS.*  trans-66.6176.6170.700000113.6G10 N14 A15 L16G10-G12 PolarHBondContact O-N 3.47Å; G12-N14 PolarHBondContact O-N 3.36Å; G12-A15 WeakPolarHBondContact O-CB 3.5Å; G12-A15 PolarHBondContact O-N 2.94Å; G12-L16 PolarHBondContact O-N 3.43Å
13R92.6Very high77.8Confident194 Ų194106.2 Ų106.273%0.73264%0.644SS**Hα-helixtrans-45.2-36.9-177.7179.4177.3177.5-1164.4114.3L16 L17R13-L16 PolarHBondContact O-N 3Å; R13-L17 HydrophobicContact CG-CD1 4.09Å; R13-L17 HydrophobicContact CG-CG 4.42Å; R13-L17 WeakPolarHBondContact O-CG 3.47Å; R13-L17 PolarHBondContact O-N 3.07Å
14N91.6Very high79.5Confident126 Ų126105.9 Ų105.967%0.67465%0.65SS**Hα-helixtrans-68.2-32.6-179.1-61.9-15.8000113G12 A18G12-N14 PolarHBondContact O-N 3.36Å; N14-A18 PolarHBondContact O-N 3.3Å
15A92.5Very high81.3Confident41 Ų41108.4 Ų108.434%0.33966%0.658SS.*Hα-helixtrans-69-45.217400000111G12 L17 A18 D19G12-A15 WeakPolarHBondContact O-CB 3.5Å; G12-A15 PolarHBondContact O-N 2.94Å; A15-L17 VanDerWaalsContact C-N 3.31Å; A15-L17 PolarHBondContact O-N 3.06Å; A15-A18 WeakPolarHBondContact O-CB 3.27Å; A15-A18 PolarHBondContact O-N 3.13Å; A15-A18 VanDerWaalsContact O-N 3.09Å; A15-D19 PolarHBondContact O-N 3.12Å
16L92.7Very high82.7Confident109 Ų109108.3 Ų108.357%0.57166%0.658SS**Hα-helixtrans-58.3-41.917417761.3000112G12 R13 D19 I20G12-L16 PolarHBondContact O-N 3.43Å; R13-L16 PolarHBondContact O-N 3Å; L16-D19 PolarHBondContact O-N 2.98Å; L16-I20 HydrophobicContact CD1-CD1 4.06Å; L16-I20 HydrophobicContact CD1-CG1 4.36Å; L16-I20 HydrophobicContact CG-CD1 3.98Å; L16-I20 WeakPolarHBondContact O-CD1 3.27Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.47Å; L16-I20 PolarHBondContact O-N 3.35Å
17L94.9Very high84.4Confident65 Ų65107.7 Ų107.734%0.3465%0.648SS.*Hα-helixtrans-63.4-39.3174.7-71.9171.4000112.3R13 A15 I20 Q21R13-L17 HydrophobicContact CG-CD1 4.09Å; R13-L17 HydrophobicContact CG-CG 4.42Å; R13-L17 WeakPolarHBondContact O-CG 3.47Å; R13-L17 PolarHBondContact O-N 3.07Å; A15-L17 VanDerWaalsContact C-N 3.31Å; A15-L17 PolarHBondContact O-N 3.06Å; L17-I20 PolarHBondContact O-N 3.16Å; L17-Q21 VanDerWaalsContact O-CG 3.29Å; L17-Q21 WeakPolarHBondContact O-CG 3.1Å; L17-Q21 PolarHBondContact O-N 3.28Å
18A92.5Very high85.9Confident53 Ų53110.3 Ų110.344%0.43864%0.643SS.*Hα-helixtrans-66-41.2175.500000112.3N14 A15 Q21 K22N14-A18 PolarHBondContact O-N 3.3Å; A15-A18 WeakPolarHBondContact O-CB 3.27Å; A15-A18 PolarHBondContact O-N 3.13Å; A15-A18 VanDerWaalsContact O-N 3.09Å; A18-Q21 PolarHBondContact O-N 2.88Å; A18-K22 VanDerWaalsContact O-CB 3.23Å; A18-K22 WeakPolarHBondContact O-CB 3.46Å; A18-K22 PolarHBondContact O-N 3.46Å
19D93.6Very high87.6Confident89 Ų89112.2 Ų112.248%0.47664%0.642SS.*Hα-helixtrans-68-35.1176.1-89.6-41.4000113A15 L16 K22 G23A15-D19 PolarHBondContact O-N 3.12Å; L16-D19 PolarHBondContact O-N 2.98Å; D19-K22 PolarHBondContact O-N 2.92Å; D19-K22 IonicContact OD1-NZ 2.92Å; D19-K22 PolarHBondContact OD1-NZ 3.38Å; D19-G23 PolarHBondContact O-N 3.02Å
20I93.1Very high88.7Confident114 Ų114114.6 Ų114.659%0.58564%0.639SS**Hα-helixtrans-63.9-43.1171.8-70165000110.8L16 L17 G23L16-I20 HydrophobicContact CD1-CD1 4.06Å; L16-I20 HydrophobicContact CD1-CG1 4.36Å; L16-I20 HydrophobicContact CG-CD1 3.98Å; L16-I20 WeakPolarHBondContact O-CD1 3.27Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.47Å; L16-I20 PolarHBondContact O-N 3.35Å; L17-I20 PolarHBondContact O-N 3.16Å; I20-G23 PolarHBondContact O-N 3.15Å
21Q94.7Very high89.4Confident169 Ų169118.2 Ų118.279%0.7963%0.633SS**Hα-helixtrans-68.1-36.4177.1-72.2173.715.900112.9L17 A18L17-Q21 VanDerWaalsContact O-CG 3.29Å; L17-Q21 WeakPolarHBondContact O-CG 3.1Å; L17-Q21 PolarHBondContact O-N 3.28Å; A18-Q21 PolarHBondContact O-N 2.88Å
22K95.2Very high90.1Very high157 Ų157120.7 Ų120.768%0.68364%0.637SS**Hα-helixtrans-70.3-32.8175.2171.6169.9138.2-740112.4A18 D19A18-K22 VanDerWaalsContact O-CB 3.23Å; A18-K22 WeakPolarHBondContact O-CB 3.46Å; A18-K22 PolarHBondContact O-N 3.46Å; D19-K22 PolarHBondContact O-N 2.92Å; D19-K22 IonicContact OD1-NZ 2.92Å; D19-K22 PolarHBondContact OD1-NZ 3.38Å
23G92.6Very high89.4Confident41 Ų41124.2 Ų124.242%0.42365%0.645SS.*  trans73169177.600000114.4D19 I20D19-G23 PolarHBondContact O-N 3.02Å; I20-G23 PolarHBondContact O-N 3.15Å
24A92.6Very high88.6Confident91 Ų91119.2 Ų119.275%0.75263%0.632SS**  trans-137.2138.9178.700000111.2L26A24-L26 PolarHBondContact O-N 2.92Å
25K91.5Very high87.7Confident213 Ų213123.9 Ų123.993%0.92664%0.641SS**  trans-81111.2174.2-76.2-176.4175.6177.10110.2
26L90Very high86.9Confident161 Ų161126.9 Ų126.984%0.84366%0.659SS**  trans-71.7149.2169.6-56.5-178.2000110.4A24A24-L26 PolarHBondContact O-N 2.92Å
27R90.9Very high85.8Confident170 Ų170124.5 Ų124.564%0.64266%0.655SS**  trans-72133.7174.351.5-91-146.3116.74.8110.7E1 V29E1-R27 PolarHBondContact O-NH1 3.08Å; E1-R27 PolarHBondContact O-NH2 3.23Å; R27-V29 PolarHBondContact O-N 3.41Å; R27-V29 VanDerWaalsContact O-N 3.13Å
28K91.1Very high84.2Confident188 Ų188126.7 Ų126.782%0.81767%0.673SS**  trans-68.4107.6179-177.1176.8-179.3178.70110T30K28-T30 PolarHBondContact O-N 3.09Å
29V86.6Confident82.7Confident100 Ų100128.4 Ų128.461%0.60669%0.687SS**  trans-69.1114.5168.1177.90000107.9R27 Q31 V32R27-V29 PolarHBondContact O-N 3.41Å; R27-V29 VanDerWaalsContact O-N 3.13Å; V29-Q31 VanDerWaalsContact CG1-O 3.27Å; V29-Q31 WeakPolarHBondContact CG1-O 3.48Å; V29-V32 HydrophobicContact CG1-CG2 4.23Å
30T82.1Confident81.2Confident134 Ų134129.5 Ų129.582%0.82270%0.697SS**SBendtrans-84.8-26178.1460000112.7K28K28-T30 PolarHBondContact O-N 3.09Å
31Q77.9Confident79.5Confident161 Ų161131 Ų13175%0.75271%0.706SS**  trans-116.793177.4-174.9179.88.900109.4V29V29-Q31 VanDerWaalsContact CG1-O 3.27Å; V29-Q31 WeakPolarHBondContact CG1-O 3.48Å
32V77.3Confident77.7Confident113 Ų113132 Ų13269%0.68571%0.708SS**  trans-80.6120163.2-174.20000106.6V29 D34V29-V32 HydrophobicContact CG1-CG2 4.23Å; V32-D34 HydrophobicContact CG1-CB 4.09Å; V32-D34 PolarHBondContact O-N 3.32Å
33N70.3Confident75.3Confident120 Ų120129.9 Ų129.964%0.64271%0.713SS**  trans-78.554176.6-174.127.3000110.7R35N33-R35 PolarHBondContact O-N 3.41Å; N33-R35 VanDerWaalsContact O-N 3.16Å
34D76.3Confident73.1Confident89 Ų89136.4 Ų136.448%0.47673%0.73SS.*  trans-78.395.5176.4-175.6-3.7000109.4V32 S36 A37V32-D34 HydrophobicContact CG1-CB 4.09Å; V32-D34 PolarHBondContact O-N 3.32Å; D34-S36 PolarHBondContact O-N 3.13Å; D34-S36 WeakPolarHBondContact OD1-CA 3.41Å; D34-S36 WeakPolarHBondContact OD1-CB 3.23Å; D34-S36 PolarHBondContact OD1-N 2.91Å; D34-S36 PolarHBondContact OD1-OG 3.09Å; D34-A37 PolarHBondContact OD1-N 3.15Å
35R73.3Confident70.6Confident224 Ų224137.8 Ų137.885%0.84573%0.729SS**THydrogen-bonded Turntrans-81.14176.6-68.1-176.7165.7-157.9-8.2113.7N33N33-R35 PolarHBondContact O-N 3.41Å; N33-R35 VanDerWaalsContact O-N 3.16Å
36S76.1Confident68Low103 Ų103133.9 Ų133.972%0.7272%0.718SS**THydrogen-bonded Turntrans-92-22.1175.577.10000113D34D34-S36 PolarHBondContact O-N 3.13Å; D34-S36 WeakPolarHBondContact OD1-CA 3.41Å; D34-S36 WeakPolarHBondContact OD1-CB 3.23Å; D34-S36 PolarHBondContact OD1-N 2.91Å; D34-S36 PolarHBondContact OD1-OG 3.09Å
37A68.3Low65.6Low60 Ų60132.9 Ų132.950%0.49672%0.719SS.*SBendtrans-69.7128.4175.800000111.2D34 A39D34-A37 PolarHBondContact OD1-N 3.15Å; A37-A39 PolarHBondContact O-N 3.02Å
38P63.1Low63Low111 Ų111128 Ų12872%0.72172%0.722SS**  trans-66.4135.3175.427.4-33.8000110.6V40P38-V40 PolarHBondContact O-N 3.1Å
39A60.8Low60.4Low88 Ų88126.5 Ų126.573%0.72772%0.722SS**  trans-68.192.8176.500000110.6A37 D41A37-A39 PolarHBondContact O-N 3.02Å; A39-D41 VanDerWaalsContact C-N 3.28Å; A39-D41 PolarHBondContact O-N 3.48Å; A39-D41 VanDerWaalsContact O-N 3.08Å
40V60.5Low58.3Low112 Ų112128.2 Ų128.268%0.67973%0.733SS**  trans-80.882169.5-177.40000108.2P38 K42P38-V40 PolarHBondContact O-N 3.1Å; V40-K42 PolarHBondContact O-N 3.08Å; V40-K42 VanDerWaalsContact O-N 3.13Å
41D58.6Low56Low146 Ų146125.3 Ų125.378%0.78173%0.73SS**  trans-62.2111.6172-77.2-43.4000109.9A39 S43A39-D41 VanDerWaalsContact C-N 3.28Å; A39-D41 PolarHBondContact O-N 3.48Å; A39-D41 VanDerWaalsContact O-N 3.08Å; D41-S43 PolarHBondContact O-N 2.73Å; D41-S43 VanDerWaalsContact O-N 3.15Å
42K55.9Low54Low190 Ų190123 Ų12383%0.82673%0.732SS**  trans-81.795.3-179.8-62.3176.9-173175.30108.3V40 K44V40-K42 PolarHBondContact O-N 3.08Å; V40-K42 VanDerWaalsContact O-N 3.13Å; K42-K44 PolarHBondContact O-N 2.81Å
43S45.7Very low52.4Low113 Ų113122.5 Ų122.579%0.7973%0.733SS**  trans-56.6103.2171.843.20000110.2D41 T45D41-S43 PolarHBondContact O-N 2.73Å; D41-S43 VanDerWaalsContact O-N 3.15Å; S43-T45 PolarHBondContact O-N 3.35Å; S43-T45 VanDerWaalsContact O-N 3.09Å
44K45.9Very low50.8Low178 Ų178126 Ų12677%0.77475%0.745SS**  trans-75.398.6174.8-178.6-179.6173.9-178.40108.4K42 N46K42-K44 PolarHBondContact O-N 2.81Å; K44-N46 PolarHBondContact O-N 3.4Å; K44-N46 VanDerWaalsContact O-N 3.09Å
45T41.4Very low49.1Very low119 Ų119128.4 Ų128.473%0.7376%0.758SS**  trans-54.5114169.7-55.10000110.2S43S43-T45 PolarHBondContact O-N 3.35Å; S43-T45 VanDerWaalsContact O-N 3.09Å
46N36.4Very low47.6Very low131 Ų131125.8 Ų125.870%0.70176%0.756SS**  trans-111140.4156.5-83.2-3000106.9K44K44-N46 PolarHBondContact O-N 3.4Å; K44-N46 VanDerWaalsContact O-N 3.09Å
47T39.5Very low46.1Very low140 Ų140126.2 Ų126.286%0.85976%0.759SS**  trans-102.1142.8-178.8-57.80000110.2
48G37Very low45Very low69 Ų69128.1 Ų128.171%0.71177%0.774SS**  trans104137.1-174.600000111.5
49D34.7Very low43.9Very low155 Ų155126.7 Ų126.783%0.82978%0.78SS**  cis-151.1-179.7-1.6-166.817000110.7
50V42.9Very low43.4Very low136 Ų136131.1 Ų131.182%0.82479%0.789SS**  trans-48.5139177.4171.30000113.7
51G34Very low42.6Very low73 Ų73128.9 Ų128.975%0.75379%0.789SS**  trans-175.1104.5171.100000115.9
52S35.3Very low42Very low114 Ų114128.3 Ų128.380%0.79779%0.793SS**  trans-31.1157174.4-168.50000119.9
53S44.4Very low42.1Very low101 Ų101126.2 Ų126.271%0.70680%0.796SS**  trans-58.9146.415653.60000113.5
54Q36Very low42.3Very low193 Ų193123.6 Ų123.690%0.90279%0.787SS**  -163.5176125-161.2138.5-71.600111.1
55N41.7Very low42.5Very low140 Ų140121.6 Ų121.675%0.74979%0.792SS**  trans-108.7167-174.7-170.415.9000111.6
56Q42.3Very low43.2Very low170 Ų170121 Ų12179%0.79479%0.793SS**  trans94127.2164.3-53.2-172.794.300121.3
57S44.5Very low44.3Very low112 Ų112123.7 Ų123.778%0.78381%0.806SS**  trans57127.2133.5-144.90000124.2
58A43.7Very low45.2Very low100 Ų100118.8 Ų118.883%0.82678%0.784SS**  trans40114.2144.400000121.4
59G40Very low46.4Very low81 Ų81118.6 Ų118.684%0.83578%0.781SS**  trans-171.8126.3167.400000114.5
60I50.7Low47.7Very low181 Ų181119 Ų11993%0.92878%0.782SS**  trans-66.5132.7-170.6-61.9160.4000115
61G44.2Very low48.5Very low64 Ų64119.6 Ų119.666%0.6677%0.774SS**  trans87.4173154.900000117.9
62P45.8Very low49.8Very low134 Ų134120.3 Ų120.387%0.8777%0.773SS**  cis-109.1-167.1-3.341.4-31.7000113.5
63T57.4Low51Low147 Ų147119.8 Ų119.890%0.90278%0.776SS**  trans-76.8130.8-168.851.40000116
64G49.5Very low52.4Low58 Ų58117.2 Ų117.260%0.59877%0.765SS**  trans-134.4159.8155.200000110.5S66G64-S66 VanDerWaalsContact C-N 3.28Å; G64-S66 PolarHBondContact O-N 3.16Å
65P51.8Low54Low135 Ų135116 Ų11688%0.87776%0.757SS**  trans-75.475.7-175.231.6-35.9000112.1L67P65-L67 PolarHBondContact O-N 3.28Å
66S55Low55.1Low106 Ų106114.4 Ų114.474%0.74176%0.755SS**  trans-69.8113.9176.1-175.90000111G64 G68G64-S66 VanDerWaalsContact C-N 3.28Å; G64-S66 PolarHBondContact O-N 3.16Å; S66-G68 PolarHBondContact O-N 2.56Å
67L59.8Low56.7Low189 Ų189112.7 Ų112.799%0.9976%0.756SS**SBendtrans-74.944.6171.5-72.4166.4000111.8P65P65-L67 PolarHBondContact O-N 3.28Å
68G59.1Low57.7Low37 Ų37114.8 Ų114.838%0.38176%0.758SS.*  trans-116.34.6-170.400000116S66 L70S66-G68 PolarHBondContact O-N 2.56Å; G68-L70 VanDerWaalsContact C-N 3.25Å; G68-L70 PolarHBondContact O-N 3.43Å; G68-L70 VanDerWaalsContact O-N 3.13Å
69G60.6Low59.2Low64 Ų64120.5 Ų120.566%0.6676%0.758SS**THydrogen-bonded Turntrans-62.4-21.7-170.500000116.3F71G69-F71 PolarHBondContact O-N 2.89Å
70L62.6Low60.4Low163 Ų163122.3 Ų122.385%0.85376%0.755SS**THydrogen-bonded Turntrans-75.3-17.8-173.6-68.7172.2000114.9G68G68-L70 VanDerWaalsContact C-N 3.25Å; G68-L70 PolarHBondContact O-N 3.43Å; G68-L70 VanDerWaalsContact O-N 3.13Å
71F60.4Low60.5Low149 Ų149121.9 Ų121.965%0.65475%0.752SS**THydrogen-bonded Turntrans-116.90.2178.3-60.9-69.9000113.3G69 A73 G74 F75G69-F71 PolarHBondContact O-N 2.89Å; F71-A73 PolarHBondContact O-N 2.88Å; F71-G74 PolarHBondContact O-N 3.48Å; F71-F75 HydrophobicContact CD1-CD2 4.2Å; F71-F75 HydrophobicContact CD1-CE2 4.19Å; F71-F75 HydrophobicContact CE1-CD2 4.28Å; F71-F75 AromaticContact CE1-CE2 3.81Å; F71-F75 HydrophobicContact CE1-CE2 3.81Å
72A61.6Low60.7Low89 Ų89121.9 Ų121.974%0.73675%0.752SS**THydrogen-bonded Turntrans-65.5-20.3-179.300000113.8G74A72-G74 VanDerWaalsContact C-N 3.31Å
73A58.8Low60.8Low103 Ų103122.7 Ų122.785%0.85175%0.745SS**THydrogen-bonded Turntrans-84.80.4173.300000113.9F71F71-A73 PolarHBondContact O-N 2.88Å
74G74.7Confident60.5Low47 Ų47127.3 Ų127.349%0.48575%0.745SS.*  trans79.8167.2-171.200000113.5F71 A72F71-G74 PolarHBondContact O-N 3.48Å; A72-G74 VanDerWaalsContact C-N 3.31Å
75F70.1Confident60.4Low166 Ų166130.5 Ų130.573%0.72875%0.749SS**  trans-80.3137.9171.1-129.3-92.1000109F71 T77F71-F75 HydrophobicContact CD1-CD2 4.2Å; F71-F75 HydrophobicContact CD1-CE2 4.19Å; F71-F75 HydrophobicContact CE1-CD2 4.28Å; F71-F75 AromaticContact CE1-CE2 3.81Å; F71-F75 HydrophobicContact CE1-CE2 3.81Å; F75-T77 PolarHBondContact O-N 2.87Å
76P65.6Low60.4Low107 Ų107132 Ų13270%0.69575%0.748SS**  trans-69.298.7178.427.2-34.1000110.8L78P76-L78 PolarHBondContact O-N 3.04Å
77T73.9Confident60.1Low134 Ų134133 Ų13382%0.82275%0.752SS**  trans-64.7106.3177.3-57.20000110.5F75 R79F75-T77 PolarHBondContact O-N 2.87Å; T77-R79 PolarHBondContact O-N 2.84Å
78L66.4Low59.3Low157 Ų157133.1 Ų133.182%0.82275%0.75SS**PPolyproline II helixtrans-65.3125.8170.2-62.9179.6000109.4P76P76-L78 PolarHBondContact O-N 3.04Å
79R74.9Confident58.2Low220 Ų220136.5 Ų136.583%0.8377%0.768SS**PPolyproline II helixtrans-58136.417459.9-174.6-70.2177.4-0.6110.3T77 I81T77-R79 PolarHBondContact O-N 2.84Å; R79-I81 PolarHBondContact O-N 2.9Å
80P66.4Low57.4Low118 Ų118144.5 Ų144.577%0.76678%0.778SS**PPolyproline II helixtrans-55130.2171-26.335.1000110.9G82P80-G82 PolarHBondContact O-N 3.13Å; P80-G82 VanDerWaalsContact O-N 3.07Å
81I51.6Low56.2Low172 Ų172142.2 Ų142.288%0.88278%0.776SS**  trans-80.591.5176.1-56.9177.1000107.3R79 H83R79-I81 PolarHBondContact O-N 2.9Å; I81-H83 PolarHBondContact O-N 3.08Å
82G48Very low55.2Low64 Ų64141.2 Ų141.266%0.6679%0.787SS**  trans-65.4101.7177.100000111.8P80 R84P80-G82 PolarHBondContact O-N 3.13Å; P80-G82 VanDerWaalsContact O-N 3.07Å; G82-R84 PolarHBondContact O-N 3.4Å
83H49.2Very low54Low152 Ų152142.3 Ų142.370%0.70479%0.79SS**  28.796.7129.7-17946.5000114.9I81 D85I81-H83 PolarHBondContact O-N 3.08Å; H83-D85 VanDerWaalsContact CE1-CG 3.4Å; H83-D85 IonicContact CE1-OD1 2.56Å; H83-D85 PolarHBondContact CE1-OD1 3.08Å; H83-D85 IonicContact CE1-OD2 3.15Å; H83-D85 PolarHBondContact CE1-OD2 2.95Å; H83-D85 IonicContact ND1-OD1 2.69Å; H83-D85 PolarHBondContact ND1-OD1 3.13Å; H83-D85 IonicContact ND1-OD2 2.92Å; H83-D85 PolarHBondContact ND1-OD2 3.39Å; H83-D85 IonicContact NE2-OD2 3.38Å
84R51Low53.1Low244 Ų244143.5 Ų143.592%0.92179%0.792SS**  trans-128.5113.7152.6-90.5-165.5169.3-164.5-3108G82 L86G82-R84 PolarHBondContact O-N 3.4Å; R84-L86 PolarHBondContact O-N 2.92Å
85D46.3Very low51.5Low125 Ų125145.2 Ų145.267%0.66880%0.802SS**  trans-82115.2177-41.5-57.3000109.5H83H83-D85 VanDerWaalsContact CE1-CG 3.4Å; H83-D85 IonicContact CE1-OD1 2.56Å; H83-D85 PolarHBondContact CE1-OD1 3.08Å; H83-D85 IonicContact CE1-OD2 3.15Å; H83-D85 PolarHBondContact CE1-OD2 2.95Å; H83-D85 IonicContact ND1-OD1 2.69Å; H83-D85 PolarHBondContact ND1-OD1 3.13Å; H83-D85 IonicContact ND1-OD2 2.92Å; H83-D85 PolarHBondContact ND1-OD2 3.39Å; H83-D85 IonicContact NE2-OD2 3.38Å
86L52.8Low50.1Low165 Ų165142.8 Ų142.886%0.86481%0.805SS**  trans-152.1141.2146.3-79.4-169.3000107.9R84R84-L86 PolarHBondContact O-N 2.92Å
87P47.8Very low49Very low127 Ų127145.8 Ų145.883%0.82582%0.815SS**  trans-81.4123-175.331.1-33.5000111.8
88M43.2Very low47.5Very low193 Ų193149.5 Ų149.595%0.95181%0.813SS**  trans-138.1146.3162.2-103.2-173.817600112.2
89S36.9Very low46.2Very low108 Ų108148.1 Ų148.176%0.75581%0.814SS**  trans-90.2145.3-160.2-60.50000114.4
90R43.4Very low44.5Very low231 Ų231144.5 Ų144.587%0.87281%0.806SS**  trans38.8101.7141.4-62.3171.662.6-171.60.4117.3
91S37.9Very low43Very low115 Ų115150.1 Ų150.180%0.80481%0.812SS**  -178112.7114.4-79.70000112
92S38Very low42.5Very low128 Ų128147.4 Ų147.490%0.89580%0.8SS**  trans-106.497.3171.5-62.80000109.7
93S37.7Very low42.3Very low113 Ų113148 Ų14879%0.7980%0.799SS**  trans-124.267.3179.8-60.30000111.4A95S93-A95 PolarHBondContact O-N 2.74Å
94S39.2Very low42Very low128 Ų128146.8 Ų146.890%0.89580%0.804SS**  trans-84.396.4167.7-168.10000109.1
95A40.3Very low41.4Very low83 Ų83141.9 Ų141.969%0.68680%0.801SS**  trans-73.4134.5-179.100000111.4S93 L97S93-A95 PolarHBondContact O-N 2.74Å; A95-L97 PolarHBondContact O-N 2.91Å
96S42.2Very low40.8Very low114 Ų114141.5 Ų141.580%0.79781%0.809SS**  trans-65.6119.3-180-174.80000111.8R98S96-R98 VanDerWaalsContact C-N 3.32Å; S96-R98 PolarHBondContact O-N 2.86Å
97L41.8Very low39.9Very low171 Ų171137.8 Ų137.890%0.89580%0.802SS**  trans-74.879.3179.4-68.6176.8000111.6A95A95-L97 PolarHBondContact O-N 2.91Å
98R43.4Very low39Very low212 Ų212139.9 Ų139.980%0.881%0.806SS**  trans-77.8122.2168.663.8-170.7-178-163.2-0.8110.6S96 Q100S96-R98 VanDerWaalsContact C-N 3.32Å; S96-R98 PolarHBondContact O-N 2.86Å; R98-Q100 PolarHBondContact O-N 3.33Å; R98-Q100 VanDerWaalsContact O-N 3.14Å
99P38.9Very low38.7Very low127 Ų127136.4 Ų136.483%0.82580%0.801SS**  trans-75.7102.7176.229.3-32.8000110.4W101P99-W101 PolarHBondContact O-N 2.92Å
100Q37.8Very low38.5Very low144 Ų144137.2 Ų137.267%0.67381%0.806SS**  trans-76.6103174.7-178.7176.9-40.900110.3R98 N102R98-Q100 PolarHBondContact O-N 3.33Å; R98-Q100 VanDerWaalsContact O-N 3.14Å; Q100-N102 PolarHBondContact NE2-OD1 3.14Å; Q100-N102 PolarHBondContact O-N 3.26Å; Q100-N102 VanDerWaalsContact O-N 3.16Å
101W36.2Very low37.9Very low236 Ų236131.7 Ų131.789%0.89480%0.803SS**  trans-78.495.7175-172.4-91.2000110.9P99P99-W101 PolarHBondContact O-N 2.92Å
102N41.4Very low37.7Very low116 Ų116133.3 Ų133.362%0.6280%0.802SS**PPolyproline II helixtrans-79.4124.2173-66.6-39.6000110.3Q100Q100-N102 PolarHBondContact NE2-OD1 3.14Å; Q100-N102 PolarHBondContact O-N 3.26Å; Q100-N102 VanDerWaalsContact O-N 3.16Å
103A42.9Very low37.9Very low77 Ų77133.1 Ų133.164%0.63680%0.797SS**PPolyproline II helixtrans-90.2137.4166.500000109.7T105A103-T105 PolarHBondContact O-N 3.13Å
104P42Very low37.5Very low125 Ų125135.6 Ų135.681%0.81280%0.796SS**PPolyproline II helixtrans-73.1128.9-17828.9-34000111.7
105T38.5Very low37Very low141 Ų141135 Ų13587%0.86579%0.792SS**  trans-91.3107.9167.550.70000110A103A103-T105 PolarHBondContact O-N 3.13Å
106S35.5Very low37Very low118 Ų118136.6 Ų136.683%0.82580%0.796SS**  trans-94.9109.1160.3-68.80000108.7
107A33.3Very low36.6Very low87 Ų87141.3 Ų141.372%0.71980%0.802SS**  trans-95.7134.315700000107.5
108D29.4Very low36.1Very low170 Ų170139.9 Ų139.991%0.90980%0.801SS**  trans-115.4126.2159.7-97.6-48.4000107.6
109S35.7Very low35.7Very low121 Ų121134.7 Ų134.785%0.84680%0.803SS**  trans-115.8120.7-179.6-66.30000108.7
110S32.1Very low35.3Very low124 Ų124136.3 Ų136.387%0.86780%0.799SS**  trans-118.2134.6168.855.20000110.8
111S31.4Very low35.5Very low116 Ų116137 Ų13781%0.81181%0.806SS**  trans-80.4154.6-164.148.90000114.9
112L34.6Very low35.4Very low149 Ų149132.9 Ų132.978%0.7880%0.797SS**  trans-59.5159.1160.6-145.378.4000110.8
113P41.7Very low34.9Very low123 Ų123133.8 Ų133.880%0.79980%0.802SS**  -144.8135.987.634-15.7000117
114E28.1Very low34.3Very low165 Ų165134.1 Ų134.177%0.77180%0.799SS**  trans42.7116.3131.8-161.8154.5108.700123.5
115S28.7Very low34.1Very low116 Ų116137.2 Ų137.281%0.81180%0.8SS**  -176.4154.8121.2-88.10000113.8
116P42.3Very low33.9Very low116 Ų116137.9 Ų137.975%0.75379%0.794SS**  trans-100.8168.5-168.739.2-37.2000115.6
117K32.5Very low33.8Very low214 Ų214141.9 Ų141.993%0.9379%0.791SS**  trans-156.5152.2156.2-112.6153.2-170.5168.90112.9
118T31.4Very low33.8Very low141 Ų141144.4 Ų144.487%0.86579%0.791SS**  trans-89.2152.6-171.435.20000113.9
119A34.9Very low34.2Very low103 Ų103143 Ų14385%0.85178%0.783SS**  trans-151.279.8163.500000109.8
120E30Very low34Very low160 Ų160143 Ų14375%0.74878%0.778SS**  trans-80.5124.2172.3-179.4-174.6154.800109.6
121I42.8Very low34Very low158 Ų158142.6 Ų142.681%0.8178%0.775SS**  trans-133.193.3164.2-58.2-177.5000108.4
122Q33.7Very low33.9Very low151 Ų151142.5 Ų142.571%0.70678%0.775SS**  trans-70.8139.1156.5-63.3-150.9-4.900109.3
123N30.9Very low33.8Very low134 Ų134140.2 Ų140.272%0.71778%0.777SS**  trans-145.592.7160.7-163.6-15.2000110.2
124S30.1Very low33.3Very low84 Ų84140 Ų14059%0.58778%0.779SS**  trans-129.580.7-176.6600000111.5
125F37.6Very low33.8Very low190 Ų190136.2 Ų136.283%0.83378%0.776SS**  trans-10896.5160.1-64.4-85.6000106.7
126Q34.3Very low34.6Very low156 Ų156136.5 Ų136.573%0.72978%0.775SS**  62.5147.377.2-74.1-1501100115.5
127R33.5Very low34.7Very low202 Ų202137 Ų13776%0.76278%0.778SS**  trans79.3121.3158.1-156.4174.4-67.5-84.6-7.6113.5
128L34.3Very low35Very low140 Ų140132.5 Ų132.573%0.73377%0.773SS**  cis-158.2174.3-6.2-76169.1000105.6
129L38.1Very low35.6Very low140 Ų140131.2 Ų131.273%0.73377%0.767SS**  cis-165.6173.4-14.1-105.2167.4000104.3
130T32Very low36Very low121 Ų121131.8 Ų131.874%0.74277%0.765SS**  cis-104.9-146.10.849.30000109.2
131S31Very low36.5Very low115 Ų115133.1 Ų133.180%0.80477%0.771SS**  cis-153.7-168.11.8-1550000111.1
132S29.2Very low36.3Very low115 Ų115128.7 Ų128.780%0.80476%0.764SS**  trans-122.2141.3-174-1790000114.2
133A32.2Very low37.1Very low100 Ų100127.7 Ų127.783%0.82677%0.774SS**  trans-159.6150.6147.500000110.2
134S31.5Very low37.6Very low120 Ų120130.7 Ų130.784%0.83978%0.78SS**  trans-87.8156-171.8-175.70000114.7
135A38.4Very low38.6Very low85 Ų85135.4 Ų135.470%0.70279%0.793SS**  trans-74.3165.8168.600000112.8
136P46.1Very low39.9Very low122 Ų122131.2 Ų131.279%0.79279%0.785SS**  -142.5175.598.237.1-20.8000114.8
137P44.8Very low41.2Very low127 Ų127129 Ų12983%0.82578%0.784SS**  trans-89.9177.9-171.636.3-37.5000116.3
138S38.4Very low42.7Very low118 Ų118125.2 Ų125.283%0.82579%0.785SS**  trans-62.5143.7-169.7-45.40000117.1
139P44.6Very low43.7Very low115 Ų115127.9 Ų127.975%0.74779%0.791SS**  trans-98.5126.2162.934.8-28.5000112.7
140S43.4Very low44.7Very low115 Ų115127 Ų12780%0.80479%0.794SS**  trans-86.9113167.4-67.70000110.8
141H39.3Very low45.7Very low188 Ų188125.8 Ų125.887%0.8780%0.796SS**  trans-150.3136.2170.2-84.7-59.6000115.1
142G39.5Very low46.8Very low64 Ų64125.9 Ų125.966%0.6680%0.797SS**  trans88.685.6134.100000117.9K144G142-K144 PolarHBondContact O-N 3.2Å
143S49.3Very low48.6Very low131 Ų131125.4 Ų125.492%0.91679%0.793SS**  trans-57.9105.1161.8-53.10000111.1
144K42.6Very low50.6Low196 Ų196126 Ų12685%0.85279%0.789SS**  trans-135.3102.3167.1-68.7-171179.3-177.50108.9G142G142-K144 PolarHBondContact O-N 3.2Å
145H50.2Low52.4Low184 Ų184126.3 Ų126.385%0.85279%0.788SS**PPolyproline II helixtrans-59.1138.9169.8-94.6-101.9000109.9
146P65.6Low54Low102 Ų102128.3 Ų128.366%0.66279%0.792SS**PPolyproline II helixtrans-63.8146.9157.230.6-33.2000108.8
147P60.7Low55.4Low110 Ų110127.9 Ų127.971%0.71479%0.789SS**PPolyproline II helixtrans-61.8141.4171.727.8-34000109.6F149P147-F149 PolarHBondContact O-N 3.38Å
148P64.8Low56.9Low121 Ų121127.3 Ų127.379%0.78679%0.786SS**PPolyproline II helixtrans-63.7137.3173.927.7-33.7000109.8
149F55.9Low58.6Low197 Ų197127.6 Ų127.686%0.86478%0.784SS**PPolyproline II helixtrans-59.6140.5170.1-63.1-86.9000109.6P147 A151P147-F149 PolarHBondContact O-N 3.38Å; F149-A151 PolarHBondContact O-N 2.61Å; F149-A151 VanDerWaalsContact O-N 3.17Å
150P59.2Low59.9Low120 Ų120126.4 Ų126.478%0.77978%0.784SS**PPolyproline II helixtrans-62.3120.9173.326.5-33.1000108.9S152P150-S152 PolarHBondContact O-N 3.17Å
151A52.4Low61.3Low96 Ų96126.2 Ų126.279%0.79378%0.78SS**PPolyproline II helixtrans-64.2128.317700000109.8F149 S153F149-A151 PolarHBondContact O-N 2.61Å; F149-A151 VanDerWaalsContact O-N 3.17Å; A151-S153 PolarHBondContact O-N 3.29Å
152S54.9Low62.7Low117 Ų117123 Ų12382%0.81878%0.776SS**PPolyproline II helixtrans-58.6125.9174.7-57.80000110.2P150P150-S152 PolarHBondContact O-N 3.17Å
153S67.7Low63.9Low105 Ų105125.7 Ų125.773%0.73479%0.785SS**PPolyproline II helixtrans-52.9142.1172.8-52.70000110.8A151A151-S153 PolarHBondContact O-N 3.29Å
154P73.3Confident64.7Low113 Ų113125.7 Ų125.773%0.73478%0.779SS**PPolyproline II helixtrans-59.9145.7172.427-34.4000110T156P154-T156 PolarHBondContact O-N 2.85Å
155P70.1Confident66.2Low126 Ų126121.3 Ų121.382%0.81877%0.771SS**PPolyproline II helixtrans-61.9136.9178.626.7-34.3000110.3
156T71.6Confident67.3Low128 Ų128118 Ų11879%0.78577%0.765SS**PPolyproline II helixtrans-64.2143.4173.837.50000110.8P154P154-T156 PolarHBondContact O-N 2.85Å
157P74.6Confident67.5Low113 Ų113118.6 Ų118.673%0.73477%0.769SS**PPolyproline II helixtrans-63.1150.6173.628.2-34.8000110.5
158P76.4Confident67.9Low115 Ų115118.7 Ų118.775%0.74777%0.77SS**PPolyproline II helixtrans-62.9149.6175.927.9-35000110.9
159P74.2Confident68.2Low123 Ų123118.2 Ų118.280%0.79977%0.767SS**PPolyproline II helixtrans-61.9140.6176.427-34.5000110.7
160A71.8Confident68.4Low91 Ų91114.6 Ų114.675%0.75276%0.763SS**PPolyproline II helixtrans-63.3143.2175.300000110.8
161P72.6Confident67.7Low110 Ų110118 Ų11871%0.71477%0.768SS**PPolyproline II helixtrans-64150.9173.828.8-35000110.7S163P161-S163 PolarHBondContact O-N 3.46Å
162P69.1Low67.2Low121 Ų121122.8 Ų122.879%0.78677%0.774SS**PPolyproline II helixtrans-63128.3179.226.3-34.2000110.9V164P162-V164 PolarHBondContact O-N 3.22Å; P162-V164 VanDerWaalsContact O-N 3.17Å
163S64.3Low66.6Low121 Ų121122 Ų12285%0.84678%0.775SS**  trans-61.8115.6177.6-61.40000111.2P161P161-S163 PolarHBondContact O-N 3.46Å
164V66.9Low65.8Low131 Ų131125.5 Ų125.579%0.79478%0.78SS**PPolyproline II helixtrans-67.2128.8169.7-178.10000108.3P162P162-V164 PolarHBondContact O-N 3.22Å; P162-V164 VanDerWaalsContact O-N 3.17Å
165P74.8Confident64.1Low103 Ų103131.6 Ų131.667%0.66979%0.788SS**PPolyproline II helixtrans-64.8147.9177.227.2-34.6000110.9
166P73Confident62.8Low114 Ų114131.5 Ų131.574%0.7479%0.787SS**PPolyproline II helixtrans-62.7148.8177.427.5-34.9000111
167P69Low61.7Low115 Ų115129.8 Ų129.875%0.74779%0.786SS**PPolyproline II helixtrans-63.1148.2176.927.8-34.9000111
168P69.8Low59.9Low113 Ų113131.7 Ų131.773%0.73479%0.79SS**PPolyproline II helixtrans-63.7149.2177.827.6-34.9000111.3
169P70Confident58.2Low110 Ų110131.6 Ų131.671%0.71479%0.787SS**PPolyproline II helixtrans-64.2146.5176.928.1-34.9000111H171P169-H171 PolarHBondContact O-N 3.16Å
170P60.6Low56.5Low121 Ų121131.7 Ų131.779%0.78679%0.786SS**PPolyproline II helixtrans-65.4133.418027.2-34.3000111.1Q172P170-Q172 PolarHBondContact O-N 2.97Å
171H45.4Very low55Low192 Ų192137.6 Ų137.689%0.88979%0.789SS**PPolyproline II helixtrans-59.4121.4175.8-64.3-81.8000110.7P169 A173P169-H171 PolarHBondContact O-N 3.16Å; H171-A173 PolarHBondContact O-N 2.89Å
172Q42Very low53.7Low197 Ų197137.9 Ų137.992%0.92179%0.791SS**  trans-75.1113.5175.7-69.1-176.7-39.900109.6P170P170-Q172 PolarHBondContact O-N 2.97Å
173A42.3Very low52.4Low100 Ų100137 Ų13783%0.82678%0.783SS**  trans-83.5123.4169.300000109.9H171 R175H171-A173 PolarHBondContact O-N 2.89Å; A173-R175 PolarHBondContact O-N 3.43Å
174E49.7Very low51.4Low179 Ų179142.9 Ų142.984%0.83679%0.787SS**  trans-43.2128.9175.2-71.7-81.5113.600114
175R37Very low50.6Low240 Ų240143.6 Ų143.691%0.90679%0.785SS**  trans-171.8162.9139-102.4-167.3-154.999.39.7111.9A173A173-R175 PolarHBondContact O-N 3.43Å
176P44Very low49Very low125 Ų125144.9 Ų144.981%0.81279%0.793SS**  trans-101.6174.9-138.739.3-39.8000116.2
177A47.5Very low47.4Very low92 Ų92144.8 Ų144.876%0.7679%0.79SS**  trans-84.1134.1-166.800000116
178N37.3Very low46.1Very low152 Ų152147.7 Ų147.781%0.81379%0.794SS**  trans-170.5146.8144.3-113.4-109.9000107.1
179V40.7Very low44.6Very low113 Ų113149.7 Ų149.769%0.68579%0.793SS**  cis-166.5157.8-20.3111.50000106.8
180T37.7Very low43.2Very low126 Ų126149.6 Ų149.677%0.77380%0.796SS**  trans57.9111.7170.7-59.50000118.9
181R40.4Very low42.1Very low215 Ų215151.4 Ų151.481%0.81179%0.793SS**  trans-108.5152.8150.2-56.7172.676.2174.85.4108.3
182P45.3Very low41.9Very low116 Ų116151.7 Ų151.775%0.75379%0.794SS**  trans-93138.5141.131.9-28.7000109.7
183T42.8Very low41.7Very low101 Ų101148.5 Ų148.562%0.6279%0.789SS**  trans-101.9125.1-174.2-63.30000111.3
184W42.7Very low41.9Very low246 Ų246149.5 Ų149.593%0.93279%0.789SS**  trans-134.9104.7159-78.6104000109.3
185L50.8Low41.6Very low145 Ų145148.2 Ų148.276%0.75979%0.787SS**  trans152.2102.8158.9-88.3-176.6000108.2V187L185-V187 PolarHBondContact O-N 3.04Å
186P40.7Very low42.1Very low130 Ų130142.4 Ų142.484%0.84478%0.781SS**  trans-77.899.9169.630.7-30.9000109.7
187V40.1Very low42.4Very low112 Ų112144.9 Ų144.968%0.67978%0.782SS**  trans-75.8144.6165.2173.40000109.1L185 H189L185-V187 PolarHBondContact O-N 3.04Å; V187-H189 PolarHBondContact O-CD2 3.3Å; V187-H189 VanDerWaalsContact O-CD2 3.29Å; V187-H189 PolarHBondContact O-N 3.29Å
188Q42.1Very low42.3Very low176 Ų176146.3 Ų146.382%0.82278%0.783SS**  trans-50.9129.3-178.1-62.2-97.7-83.200112.9
189H37.5Very low43Very low155 Ų155144.6 Ų144.672%0.71878%0.783SS**  trans-122.7110.7165.1-76.2-87000109.5V187 H191V187-H189 PolarHBondContact O-CD2 3.3Å; V187-H189 VanDerWaalsContact O-CD2 3.29Å; V187-H189 PolarHBondContact O-N 3.29Å; H189-H191 PolarHBondContact O-N 3.16Å
190S40.9Very low44.1Very low109 Ų109145.2 Ų145.276%0.76279%0.787SS**  trans-79.9114.3-179-55.50000111.2
191H37.3Very low45.6Very low158 Ų158144.3 Ų144.373%0.73178%0.784SS**  trans-127.8128.1171.2-60.2-48.8000109.6H189H189-H191 PolarHBondContact O-N 3.16Å
192H41.9Very low47.1Very low198 Ų198139.6 Ų139.692%0.91778%0.781SS**  trans-69.3133.2-179.9-78.4-120.6000110.7
193T37.8Very low48.5Very low131 Ų131139.6 Ų139.680%0.80478%0.781SS**  trans-137.9124.8161.3-63.80000107.9
194S46.4Very low49.9Very low120 Ų120140.4 Ų140.484%0.83979%0.788SS**  trans-89.5111.6-175.7178.70000110.9
195L41.5Very low51.5Low152 Ų152134.1 Ų134.180%0.79678%0.779SS**  trans-143.8158.3165.6-86.7-179.5000109.3
196P48Very low52.5Low118 Ų118132.6 Ų132.677%0.76678%0.777SS**PPolyproline II helixtrans-77.2165.8-153.729.3-36.6000115.6
197Q51.1Low53.7Low177 Ų177132 Ų13283%0.82777%0.774SS**PPolyproline II helixtrans-55.6142.1179.6-65.4173.4-103.200113.1
198P44.8Very low54.6Low122 Ų122133.8 Ų133.879%0.79278%0.779SS**PPolyproline II helixtrans-68.1132.1154.230.9-31.9000109.1
199S52.5Low55.2Low117 Ų117132 Ų13282%0.81878%0.78SS**PPolyproline II helixtrans-63.2135.9178-57.70000111.7
200T64.4Low56Low126 Ų126132.4 Ų132.477%0.77378%0.782SS**PPolyproline II helixtrans-57.1134.6166.3-28.50000109.4
201P68.3Low56.9Low107 Ų107132.5 Ų132.570%0.69578%0.78SS**PPolyproline II helixtrans-61.2146.716827.2-34.2000109.7
202P72.1Confident57.6Low115 Ų115130 Ų13075%0.74778%0.778SS**PPolyproline II helixtrans-63151.2175.228-34.7000110.6
203P74.2Confident57.7Low117 Ų117127.2 Ų127.276%0.7678%0.777SS**PPolyproline II helixtrans-61.7150.3175.127.8-35000110.9
204P73.7Confident57.9Low117 Ų117125.3 Ų125.376%0.7677%0.769SS**PPolyproline II helixtrans-62.2150.3175.927.7-35000110.9
205P74.5Confident57.4Low115 Ų115124.8 Ų124.875%0.74777%0.766SS**PPolyproline II helixtrans-62.6150.9174.928.2-35.1000110.9
206P72.8Confident57.6Low112 Ų112125.1 Ų125.173%0.72777%0.766SS**PPolyproline II helixtrans-61.4147.7174.427.7-34.9000110.6L208P206-L208 PolarHBondContact O-N 3.23Å
207P65.5Low57.6Low118 Ų118125.4 Ų125.477%0.76677%0.768SS**PPolyproline II helixtrans-62.6135179.726.5-34.4000110.7T209P207-T209 PolarHBondContact O-N 3.14Å
208L59.4Low57.1Low150 Ų150123.7 Ų123.779%0.78577%0.765SS**PPolyproline II helixtrans-64120.5174-68173.4000109.4P206 H210P206-L208 PolarHBondContact O-N 3.23Å; L208-H210 VanDerWaalsContact C-N 3.34Å; L208-H210 PolarHBondContact O-CD2 3.18Å; L208-H210 VanDerWaalsContact O-CD2 3.28Å; L208-H210 PolarHBondContact O-N 2.99Å
209T55.4Low57Low137 Ų137128 Ų12884%0.8477%0.765SS**  trans-74.186.3177.244.50000110.5P207 P211P207-T209 PolarHBondContact O-N 3.14Å; T209-P211 WeakPolarHBondContact O-CD 3.38Å
210H52.7Low56.2Low164 Ų164128 Ų12876%0.75977%0.765SS**PPolyproline II helixtrans-58.8123.4168-71.1-95000109.9L208L208-H210 VanDerWaalsContact C-N 3.34Å; L208-H210 PolarHBondContact O-CD2 3.18Å; L208-H210 VanDerWaalsContact O-CD2 3.28Å; L208-H210 PolarHBondContact O-N 2.99Å
211P61.4Low55.2Low112 Ų112128 Ų12873%0.72777%0.77SS**PPolyproline II helixtrans-69.1147.8169.729.9-33.8000110T209T209-P211 WeakPolarHBondContact O-CD 3.38Å
212P51.3Low53.8Low106 Ų106125.9 Ų125.969%0.68877%0.767SS**PPolyproline II helixtrans-68.8134.2178.828.3-34000110.9S214P212-S214 VanDerWaalsContact C-N 3.26Å; P212-S214 PolarHBondContact O-N 3.07Å
213P44.3Very low52.1Low138 Ų138130.7 Ų130.790%0.89677%0.772SS**  trans-75.878.617431.5-34.4000110.6
214S41.3Very low50.9Low92 Ų92134.9 Ų134.964%0.64378%0.779SS**  trans-74.7145.5169.9-71.80000111.7P212P212-S214 VanDerWaalsContact C-N 3.26Å; P212-S214 PolarHBondContact O-N 3.07Å
215S37Very low49.1Very low109 Ų109136.9 Ų136.976%0.76278%0.776SS**  trans58.1113.9163.249.70000118.6P217S215-P217 WeakPolarHBondContact O-CD 3.44Å
216I45.4Very low47.4Very low159 Ų159142.8 Ų142.882%0.81579%0.785SS**  trans-49.5139.2153.6-60.1152000110.6
217P47.8Very low45.8Very low124 Ų124142 Ų14281%0.80578%0.783SS**  trans-110143.3135.7-12.131000112.5S215S215-P217 WeakPolarHBondContact O-CD 3.44Å
218D40.1Very low45Very low140 Ų140142 Ų14275%0.74978%0.783SS**  trans-93.6172.6177.8175.735.7000111.3
219R42.2Very low44.8Very low214 Ų214140.7 Ų140.781%0.80878%0.783SS**  trans90.3108.1159.2-50.2177.869.1-174.31.1119.3
220S37.4Very low44.6Very low116 Ų116139.1 Ų139.181%0.81178%0.775SS**  96.6143.5119.2-162.90000121.2
221S42.2Very low43.7Very low126 Ų126140.4 Ų140.488%0.88178%0.779SS**  trans82.5144164.4-153.10000118
222G39.2Very low42.6Very low62 Ų62140.3 Ų140.364%0.63978%0.781SS**  trans130.728.6172.100000118.7F224G222-F224 PolarHBondContact O-N 3.47Å
223Y37.3Very low41.9Very low217 Ų217142.7 Ų142.785%0.85178%0.783SS**  trans-62.3121.4169.5-102.3-98.1000111
224F47.4Very low42.1Very low204 Ų204142.2 Ų142.290%0.89578%0.78SS**  trans-137.4140.8159-87.1-76.2000111.3G222G222-F224 PolarHBondContact O-N 3.47Å
225F36.3Very low42.1Very low160 Ų160141.2 Ų141.270%0.70277%0.773SS**  trans-87144.1-167.8-78.6-116.4000112.7
226Y38.3Very low42.1Very low238 Ų238147.5 Ų147.593%0.93378%0.78SS**  -145.8138.4128.9-87.7-69.7000109.4
227S40.7Very low41.9Very low97 Ų97147.7 Ų147.768%0.67878%0.775SS**  trans-108.1146.4-175.4-58.90000112.1
228P48.3Very low42Very low118 Ų118147.9 Ų147.977%0.76678%0.776SS**  trans-82.2160175.134.7-35.7000112.7
229P54.3Low42.5Very low122 Ų122148.1 Ų148.179%0.79278%0.776SS**  trans-77.1158.3173.132.3-35000113.2
230P52.4Low42.6Very low103 Ų103145.6 Ų145.667%0.66978%0.778SS**  trans-104.3-160.6-170.442-37.3000114.6
231F33.5Very low42.8Very low191 Ų191149.4 Ų149.484%0.83877%0.774SS**  trans85131.6-179.7-57.5-70.9000115.3
232S37.9Very low43.2Very low111 Ų111149.8 Ų149.878%0.77677%0.766SS**  cis-149.8157-2.6-870000112.7
233E36.2Very low43.8Very low156 Ų156151.5 Ų151.573%0.72977%0.768SS**  trans-85.4167.3171.4-141.5-161.190.500111.4S235E233-S235 WeakPolarHBondContact OE1-CB 3.19Å; E233-S235 PolarHBondContact OE1-N 3.4Å
234P48.2Very low44.6Very low128 Ų128147.5 Ų147.583%0.83177%0.769SS**  -142.1146.77836.5-19.2000116.5
235S42.8Very low45.3Very low71 Ų71144.9 Ų144.950%0.49776%0.764SS.*  trans-75.2151.2-178.5175.20000114.9E233E233-S235 WeakPolarHBondContact OE1-CB 3.19Å; E233-S235 PolarHBondContact OE1-N 3.4Å
236R35.7Very low46.8Very low240 Ų240140.3 Ų140.391%0.90676%0.762SS**  trans-15179.8145.5-166.4176.6-64.8165.72.1112.3
237F41.7Very low48.5Very low163 Ų163134.9 Ų134.972%0.71576%0.756SS**  trans-81.5163.9154.7-66.8-79.8000110
238P50.8Low50.1Low128 Ų128135.7 Ų135.783%0.83176%0.759SS**  -121.2157.888.936.6-34.3000113.9
239I48.7Very low51.3Low146 Ų146135.6 Ų135.675%0.74976%0.758SS**  trans-87.1135.8-178.5-64.1153.4000109.7
240L44.5Very low52.5Low161 Ų161135.2 Ų135.284%0.84376%0.756SS**  trans-148.5107.9154.3-156.570.4000113.8
241R42.8Very low53.8Low195 Ų195135.9 Ų135.974%0.73676%0.76SS**  trans63.3110.8152.2-67.4-70.2174.6-178.2-0.1120.7
242D50.2Low55.8Low134 Ų134132.3 Ų132.372%0.71776%0.756SS**  trans22.1105.7133.3-52.6-78000118.1
243S51Low57.6Low98 Ų98132.2 Ų132.269%0.68575%0.753SS**  trans-152.5138.2151.6-79.60000109.2L245S243-L245 PolarHBondContact O-N 3.29Å; S243-L245 VanDerWaalsContact O-N 3.13Å
244P55.1Low59.4Low133 Ų133130.9 Ų130.986%0.86476%0.758SS**SBendtrans-78.58.5-174.433.4-37.4000113.8
245L62.2Low60.3Low149 Ų149132.4 Ų132.478%0.7876%0.758SS**SBendtrans-110.7127.7176.2-58.5177.5000107.5S243S243-L245 PolarHBondContact O-N 3.29Å; S243-L245 VanDerWaalsContact O-N 3.13Å
246G67.7Low61Low64 Ų64134.5 Ų134.566%0.6677%0.77SS**  trans-64.7176-176.200000113.9
247P73.3Confident61.7Low124 Ų124128.6 Ų128.681%0.80576%0.76SS**PPolyproline II helixtrans-55.1140.7178.824.7-34.5000110.9
248P74Confident61.6Low115 Ų115126.2 Ų126.275%0.74776%0.764SS**PPolyproline II helixtrans-61.2146.2-178.326.1-34.6000110.7
249P74.4Confident61.2Low116 Ų116129.4 Ų129.475%0.75377%0.765SS**PPolyproline II helixtrans-61.6148.8177.427.2-34.8000110.8
250P78.9Confident60.8Low114 Ų114128.6 Ų128.674%0.7477%0.768SS**PPolyproline II helixtrans-61.5150.8176.827.3-35.1000111.1
251P79.4Confident60.5Low117 Ų117126.3 Ų126.376%0.7676%0.762SS**PPolyproline II helixtrans-62.3147.2178.527-34.9000111.2
252P75.9Confident60.2Low115 Ų115122.6 Ų122.675%0.74777%0.766SS**PPolyproline II helixtrans-64.8150.2177.428.3-35.1000111.1
253P75.8Confident59.6Low110 Ų110120.8 Ų120.871%0.71476%0.763SS**PPolyproline II helixtrans-63.1148.6175.228.1-35000110.9L255P253-L255 PolarHBondContact O-N 3.46Å
254P74.8Confident59.3Low128 Ų128121.8 Ų121.883%0.83177%0.767SS**PPolyproline II helixtrans-62.2128.9177.826.3-34000110.4
255L66.1Low58.5Low159 Ų159120.7 Ų120.783%0.83276%0.758SS**PPolyproline II helixtrans-65.4139.5173.8-66.6172.9000109.8P253 T257P253-L255 PolarHBondContact O-N 3.46Å; L255-T257 PolarHBondContact O-N 3.42Å
256P58Low58Low116 Ų116120.1 Ų120.175%0.75376%0.761SS**PPolyproline II helixtrans-62.6130.9174.826.9-33.9000109.8S258P256-S258 PolarHBondContact O-N 3.49Å; P256-S258 VanDerWaalsContact O-N 3.12Å
257T49.9Very low57.4Low115 Ų115123.7 Ų123.771%0.70676%0.764SS**  trans-62.6112.7176.748.30000110.2L255 F259L255-T257 PolarHBondContact O-N 3.42Å; T257-F259 WeakPolarHBondContact O-CD2 3.44Å; T257-F259 PolarHBondContact O-N 3.49Å
258S39.6Very low56.6Low114 Ų114123 Ų12380%0.79776%0.76SS**  trans-58.8107.5173.9-68.10000110.4P256 T260P256-S258 PolarHBondContact O-N 3.49Å; P256-S258 VanDerWaalsContact O-N 3.12Å; S258-T260 PolarHBondContact O-N 3.29Å; S258-T260 VanDerWaalsContact O-N 3.16Å
259F43.2Very low56.1Low194 Ų194123.1 Ų123.185%0.85176%0.76SS**  trans-58.9116.7171.5-71.7-95.1000109.3T257 P261T257-F259 WeakPolarHBondContact O-CD2 3.44Å; T257-F259 PolarHBondContact O-N 3.49Å; F259-P261 VanDerWaalsContact O-CD 3.27Å; F259-P261 WeakPolarHBondContact O-CD 3.33Å
260T39.6Very low55.3Low130 Ų130123.1 Ų123.180%0.79876%0.76SS**  trans-80.9113170.840.10000109.1S258 S262S258-T260 PolarHBondContact O-N 3.29Å; S258-T260 VanDerWaalsContact O-N 3.16Å; T260-S262 PolarHBondContact O-N 3.13Å; T260-S262 VanDerWaalsContact O-N 3.11Å
261P39.2Very low54.4Low112 Ų112123.2 Ų123.273%0.72776%0.761SS**  trans-68.4112.4172.927.7-32.6000109.1F259 C263F259-P261 VanDerWaalsContact O-CD 3.27Å; F259-P261 WeakPolarHBondContact O-CD 3.33Å; P261-C263 PolarHBondContact O-N 3.49Å; P261-C263 VanDerWaalsContact O-N 3.13Å
262S36.3Very low53.3Low118 Ų118123.5 Ų123.583%0.82576%0.763SS**  trans-71.2103.1173.9-175.30000109.8T260 P264T260-S262 PolarHBondContact O-N 3.13Å; T260-S262 VanDerWaalsContact O-N 3.11Å; S262-P264 WeakPolarHBondContact O-CD 3.47Å
263C37.8Very low51.9Low95 Ų95128.1 Ų128.164%0.64277%0.771SS**  trans-91.1115.4174.4-66.20000110P261 T265P261-C263 PolarHBondContact O-N 3.49Å; P261-C263 VanDerWaalsContact O-N 3.13Å; C263-T265 PolarHBondContact O-N 2.83Å
264P44Very low50.9Low120 Ų120129.4 Ų129.478%0.77978%0.777SS**  trans-7885.8-178.831.5-34.9000111.4S262 T266S262-P264 WeakPolarHBondContact O-CD 3.47Å; P264-T266 PolarHBondContact O-N 2.83Å; P264-T266 VanDerWaalsContact O-N 3.08Å
265T39.2Very low49.6Very low109 Ų109127.4 Ų127.467%0.66977%0.771SS**  trans-79.188.2176.3-62.10000111.2C263 L267C263-T265 PolarHBondContact O-N 2.83Å; T265-L267 HydrophobicContact CG2-CB 4.35Å; T265-L267 HydrophobicContact CG2-CD1 3.6Å; T265-L267 HydrophobicContact CG2-CG 3.72Å; T265-L267 PolarHBondContact O-N 3.11Å
266T52Low48.5Very low138 Ų138126 Ų12685%0.84777%0.771SS**  trans-75.7104.2161.1-58.90000109.2P264P264-T266 PolarHBondContact O-N 2.83Å; P264-T266 VanDerWaalsContact O-N 3.08Å
267L55Low47.9Very low138 Ų138126.6 Ų126.672%0.72377%0.773SS**  trans-128142.2167.9-75.7174000109.9T265T265-L267 HydrophobicContact CG2-CB 4.35Å; T265-L267 HydrophobicContact CG2-CD1 3.6Å; T265-L267 HydrophobicContact CG2-CG 3.72Å; T265-L267 PolarHBondContact O-N 3.11Å
268P56.3Low47.7Very low110 Ų110127.1 Ų127.171%0.71478%0.778SS**PPolyproline II helixtrans-70.4152.7178.630.2-35.2000111.7
269P62.7Low47.6Very low117 Ų117127 Ų12776%0.7678%0.777SS**PPolyproline II helixtrans-67148.7177.828.6-35.1000111.9
270P58.4Low47.9Very low116 Ų116122.8 Ų122.875%0.75378%0.778SS**PPolyproline II helixtrans-71.1149.6178.130.1-35.2000112.1
271P58.4Low48.1Very low117 Ų117120.7 Ų120.776%0.7677%0.774SS**PPolyproline II helixtrans-69.6155.2-179.829.1-35.6000113.1
272P56.3Low48.3Very low123 Ų123124.2 Ų124.280%0.79978%0.783SS**PPolyproline II helixtrans-67.4149.6-177.427.7-35.3000113V274P272-V274 PolarHBondContact O-N 3.46Å
273K47Very low48.6Very low212 Ų212129.8 Ų129.892%0.92279%0.786SS**  trans-93.695.4-166.7-159.7176.5-169.7177.50111.5
274V54.3Low48.8Very low136 Ų136130.8 Ų130.882%0.82479%0.794SS**PPolyproline II helixtrans-79.6151.4174-65.10000112.2P272P272-V274 PolarHBondContact O-N 3.46Å
275A49Very low48.8Very low86 Ų86132.8 Ų132.871%0.71180%0.797SS**PPolyproline II helixtrans-78.4151.7-175.200000113V277A275-V277 PolarHBondContact O-N 2.69Å
276P41.6Very low49.3Very low129 Ų129132.9 Ų132.984%0.83880%0.8SS**PPolyproline II helixtrans-75.3121.2-178.1-13.329.6000112.6
277V45.7Very low49.4Very low129 Ų129132.6 Ų132.678%0.78280%0.8SS**PPolyproline II helixtrans-79.4130.8162.9172.40000109A275 S279A275-V277 PolarHBondContact O-N 2.69Å; V277-S279 PolarHBondContact O-N 3.45Å; V277-S279 VanDerWaalsContact O-N 3.1Å
278P46.1Very low48.7Very low127 Ų127131.1 Ų131.183%0.82580%0.801SS**  trans-74.3100176.129.8-33.5000110.6
279S37.8Very low47.9Very low111 Ų111135.8 Ų135.878%0.77681%0.806SS**  trans-76.1136.4178.4-167.70000112.3V277 A281V277-S279 PolarHBondContact O-N 3.45Å; V277-S279 VanDerWaalsContact O-N 3.1Å; S279-A281 PolarHBondContact O-N 2.85Å
280A50.2Low47.2Very low106 Ų106135.3 Ų135.388%0.87680%0.803SS**  trans-78.887-17100000112.8
281A42.8Very low46.2Very low85 Ų85134.9 Ų134.970%0.70280%0.801SS**  trans-12127.2178.800000114.3S279 R283S279-A281 PolarHBondContact O-N 2.85Å; A281-R283 PolarHBondContact O-N 3.3Å
282M42.9Very low45.7Very low186 Ų186136.4 Ų136.492%0.91680%0.803SS**  trans-72.571.5172.5-77.7-66.9-7200111.7
283R43.7Very low44.8Very low236 Ų236136.2 Ų136.289%0.89179%0.794SS**  trans-99.794.7165.7-86.6-176.5162.3-102.6-2.3109.8A281 L285A281-R283 PolarHBondContact O-N 3.3Å; R283-L285 PolarHBondContact O-N 3.23Å
284S41.2Very low44.4Very low116 Ų116132.2 Ų132.281%0.81179%0.79SS**PPolyproline II helixtrans-62.3123.5169.637.20000110.7
285L45.3Very low43.8Very low162 Ų162130.9 Ų130.985%0.84878%0.783SS**PPolyproline II helixtrans-86.9145.9165.3-71.6171.6000109.5R283R283-L285 PolarHBondContact O-N 3.23Å
286P49.5Very low43.7Very low110 Ų110138.4 Ų138.471%0.71479%0.793SS**PPolyproline II helixtrans-70.6147.4-176.828.9-35.2000112.1S288P286-S288 PolarHBondContact O-N 2.97Å
287P53.4Low43.9Very low133 Ų133142.9 Ų142.986%0.86479%0.793SS**PPolyproline II helixtrans-70.2117.4176.728.5-33.5000111.1Y289P287-Y289 PolarHBondContact O-N 3.32Å
288S39.7Very low43.7Very low106 Ų106142.3 Ų142.374%0.74179%0.792SS**  trans-84.8110.1179.6-173.20000111.8P286P286-S288 PolarHBondContact O-N 2.97Å
289Y39.1Very low43.5Very low209 Ų209141.9 Ų141.982%0.8279%0.789SS**  trans52138.7163-71.3-91000120.4P287P287-Y289 PolarHBondContact O-N 3.32Å
290P49.1Very low43.7Very low106 Ų106141.4 Ų141.469%0.68879%0.792SS**  trans-73.1129.5173.130.8-33.8000111.6N292P290-N292 PolarHBondContact O-N 2.91Å
291C37.3Very low43.4Very low107 Ų107142.4 Ų142.472%0.72379%0.786SS**  trans-83.9107.5170.6-166.50000109.7I293C291-I293 VanDerWaalsContact C-N 3.28Å; C291-I293 PolarHBondContact O-N 3.39Å
292N47.5Very low43.3Very low150 Ų150144 Ų14480%0.80279%0.79SS**  trans-74.473.8-176.3-74-18.8000112.5P290P290-N292 PolarHBondContact O-N 2.91Å
293I37.6Very low43.6Very low118 Ų118146.9 Ų146.961%0.60579%0.791SS**  trans-94.9117.2170.4-64.6163.9000108.6C291 T295C291-I293 VanDerWaalsContact C-N 3.28Å; C291-I293 PolarHBondContact O-N 3.39Å; I293-T295 PolarHBondContact O-N 3.48Å; I293-T295 PolarHBondContact O-OG1 2.98Å
294P39.3Very low43.3Very low129 Ų129140.9 Ų140.984%0.83878%0.784SS**  trans-67.472.1179.8-23.236.2000114.2R296P294-R296 PolarHBondContact O-N 3.41Å; P294-R296 VanDerWaalsContact O-N 3.17Å
295T42Very low43.2Very low108 Ų108143.6 Ų143.666%0.66379%0.789SS**  trans-73.8108.1178.9-57.50000109.6I293 R297I293-T295 PolarHBondContact O-N 3.48Å; I293-T295 PolarHBondContact O-OG1 2.98Å; T295-R297 VanDerWaalsContact C-N 3.3Å; T295-R297 PolarHBondContact O-N 2.87Å
296R45.7Very low42.7Very low244 Ų244140.6 Ų140.692%0.92179%0.788SS**  trans-7168.1-168.6-163.9-174.3-169.1-83.44.2114.2P294P294-R296 PolarHBondContact O-N 3.41Å; P294-R296 VanDerWaalsContact O-N 3.17Å
297R46.6Very low42.4Very low223 Ų223144.4 Ų144.484%0.84279%0.793SS**  trans-104.4133.2164.2-85.1-172.5172.6-175.9-1.9110.6T295T295-R297 VanDerWaalsContact C-N 3.3Å; T295-R297 PolarHBondContact O-N 2.87Å
298P41.9Very low41.7Very low117 Ų117145 Ų14576%0.7679%0.794SS**PPolyproline II helixtrans-72.7141.3166.631.4-32.8000110.2
299P42Very low42Very low118 Ų118147.8 Ų147.877%0.76679%0.793SS**PPolyproline II helixtrans-72.4144.7170.430.5-33.7000110.9
300A40.3Very low41.9Very low101 Ų101145.1 Ų145.184%0.83579%0.793SS**PPolyproline II helixtrans-77.6139.2170.400000110.3
301V44.5Very low42.5Very low126 Ų126144.8 Ų144.876%0.76479%0.791SS**PPolyproline II helixtrans-101.8122.7-175-172.40000110.5
302P41.7Very low43Very low120 Ų120148.5 Ų148.578%0.77980%0.797SS**PPolyproline II helixtrans-65.8149170.8-19.532.8000112.2
303R48Very low42.7Very low246 Ų246149 Ų14993%0.92880%0.798SS**  trans-107.9113.2178-71-172.4178.798.7-7.2112.6
304S37Very low42.8Very low109 Ų109146.3 Ų146.376%0.76280%0.799SS**  trans-162.7121.5157.4480000106.5
305L40.1Very low43.5Very low173 Ų173146.2 Ų146.291%0.90680%0.799SS**  cis70.382.448.2-156.6162.3000112.8
306A34.7Very low43.5Very low100 Ų100148.9 Ų148.983%0.82680%0.804SS**  trans-158.5153149.300000108.4
307K42.7Very low43.8Very low189 Ų189142.3 Ų142.382%0.82280%0.795SS**  trans-144.7119.4-177.7172.7-177.8174.4-178.90109.6
308V40Very low43.8Very low145 Ų145138.7 Ų138.788%0.87980%0.797SS**  trans-138.6144.1172.3-175.60000109.2
309F45.3Very low44Very low166 Ų166136 Ų13673%0.72879%0.792SS**  trans-88.8148.1179.3-113.1-118.7000111.2
310N37.9Very low44.6Very low153 Ų153142 Ų14282%0.81880%0.799SS**  -175.3149.397.7-145.818.7000111.2
311P60.5Low45.1Very low98 Ų98145 Ų14564%0.63680%0.8SS**  trans-114.6113.6179.435.7-22.8000113.9
312H47.3Very low45.7Very low185 Ų185146.3 Ų146.386%0.85680%0.802SS**  trans-160.4165.8153.6-145.9-107.8000112.9
313I42.7Very low46.9Very low161 Ų161144.8 Ų144.883%0.82680%0.799SS**  trans72.4130.6-176.2-52.9177.8000113.1
314G38.1Very low48Very low61 Ų61138.5 Ų138.563%0.62979%0.79SS**  trans-101.3-146-171.400000114.4
315P55.7Low49.5Very low128 Ų128138.8 Ų138.883%0.83179%0.79SS**  -129.399.2-111.833.5-15.7000112.7
316E41.8Very low51.1Low164 Ų164136.6 Ų136.677%0.76679%0.785SS**  trans-128.4133.4178.1-81.7-60.2164.100115.1
317S51.4Low52.7Low105 Ų105136 Ų13673%0.73478%0.781SS**  trans33.478.5156.352.70000121.1
318V47.7Very low53.8Low147 Ų147132.4 Ų132.489%0.89178%0.777SS**  trans-147.4131.2142.9-112.50000113.6
319G44.8Very low55.3Low62 Ų62131.4 Ų131.464%0.63977%0.773SS**  trans6998.5155.900000117.7L321G319-L321 PolarHBondContact O-N 3.45Å
320R54.3Low56.1Low244 Ų244128.3 Ų128.392%0.92178%0.778SS**  trans-67.372.9145.6-88.5-173.5168.9-124.81.7109.2L322R320-L322 PolarHBondContact O-N 3.47Å
321L50.9Low56.9Low163 Ų163132.7 Ų132.785%0.85378%0.783SS**  trans-64.7103162.9-71.6175.5000106.9G319 A323G319-L321 PolarHBondContact O-N 3.45Å; L321-A323 PolarHBondContact O-N 2.86Å
322L58.3Low56.4Low154 Ų154131.5 Ų131.581%0.80678%0.778SS**  trans-57.5110.7172.9-65.4171.7000107.4R320R320-L322 PolarHBondContact O-N 3.47Å
323A66.2Low56.6Low88 Ų88128.5 Ų128.573%0.72777%0.774SS**PPolyproline II helixtrans-56.8136.6-177.700000109.6L321L321-A323 PolarHBondContact O-N 2.86Å
324P70.2Confident56.8Low114 Ų114126.1 Ų126.174%0.7477%0.768SS**PPolyproline II helixtrans-58.9143.8176.126.1-33.9000109.4
325P69.6Low57.3Low115 Ų115128.9 Ų128.975%0.74777%0.772SS**PPolyproline II helixtrans-58.4147.9178.325.7-34.5000110.2A327P325-A327 PolarHBondContact O-N 2.73Å
326P73Confident56.9Low126 Ų126131.5 Ų131.582%0.81877%0.773SS**PPolyproline II helixtrans-56.3138.8179.824.4-34.1000110.3
327A69.1Low57.2Low89 Ų89130.6 Ų130.674%0.73677%0.773SS**PPolyproline II helixtrans-59.2139.3179.100000110.2P325P325-A327 PolarHBondContact O-N 2.73Å
328P65.9Low57.2Low113 Ų113131.7 Ų131.773%0.73478%0.781SS**PPolyproline II helixtrans-60.4148.9174.927.2-34.7000109.9A330P328-A330 PolarHBondContact O-N 3.45Å
329P71.6Confident57.3Low124 Ų124129.8 Ų129.881%0.80577%0.77SS**PPolyproline II helixtrans-51.1130.4179.8-2835.1000111.7R331P329-R331 PolarHBondContact O-N 2.96Å; P329-R331 VanDerWaalsContact O-N 3.1Å
330A61.6Low57.6Low100 Ų100138 Ų13883%0.82678%0.781SS**PPolyproline II helixtrans-59.7117.8175.900000108.8P328 S332P328-A330 PolarHBondContact O-N 3.45Å; A330-S332 PolarHBondContact O-N 2.86Å
331R53.5Low57.4Low245 Ų245133.6 Ų133.693%0.92578%0.775SS**  trans-57.3114.7170.6-85.4-177.4160.9-164.6-6.6108P329P329-R331 PolarHBondContact O-N 2.96Å; P329-R331 VanDerWaalsContact O-N 3.1Å
332S50.4Low58.3Low74 Ų74133.1 Ų133.152%0.51777%0.772SS.*  trans-63.3144.917753.90000110.1A330 T334A330-S332 PolarHBondContact O-N 2.86Å; S332-T334 WeakPolarHBondContact CB-OG1 3.45Å; S332-T334 PolarHBondContact O-N 3.41Å; S332-T334 PolarHBondContact OG-OG1 3.44Å
333P52.3Low58.9Low122 Ų122130.7 Ų130.779%0.79277%0.766SS**SBendtrans-7633.4176.834.5-37.3000111.9
334T46.2Very low59.2Low111 Ų111131.8 Ų131.868%0.68177%0.765SS**  trans-11537.8-167.363.70000111.6S332S332-T334 WeakPolarHBondContact CB-OG1 3.45Å; S332-T334 PolarHBondContact O-N 3.41Å; S332-T334 PolarHBondContact OG-OG1 3.44Å
335T49Very low59.4Low119 Ų119131.7 Ų131.773%0.7376%0.764SS**  trans-113.119.6166.9-174.70000111.5L337T335-L337 PolarHBondContact O-N 2.99Å
336E47.9Very low59.9Low182 Ų182131.6 Ų131.685%0.8576%0.764SS**  trans-67.789.1157.2-61.3-143.7140.300108.2S338E336-S338 PolarHBondContact O-N 2.93Å; E336-S338 VanDerWaalsContact O-N 3.15Å
337L47.7Very low60.1Low146 Ų146131.1 Ų131.176%0.76476%0.761SS**  trans-60.1117.6167.2-69.5176.5000107.4T335 T339T335-L337 PolarHBondContact O-N 2.99Å; L337-T339 PolarHBondContact O-N 3.09Å; L337-T339 PolarHBondContact O-OG1 3.37Å
338S51.4Low60.6Low128 Ų128132.2 Ų132.290%0.89576%0.76SS**  trans-69.869.1177.3-170.20000110.7E336 R340E336-S338 PolarHBondContact O-N 2.93Å; E336-S338 VanDerWaalsContact O-N 3.15Å; S338-R340 PolarHBondContact O-N 3.05Å
339T48.5Very low61.2Low107 Ų107132.1 Ų132.166%0.65676%0.76SS**  trans-73105.8169.4-53.90000106.3L337 I341L337-T339 PolarHBondContact O-N 3.09Å; L337-T339 PolarHBondContact O-OG1 3.37Å; T339-I341 WeakPolarHBondContact O-CG1 3.28Å; T339-I341 PolarHBondContact O-N 3.03Å
340R52.5Low61.2Low234 Ų234130.8 Ų130.888%0.88375%0.751SS**  trans-58.5107.4173.5-130.4-168.8-62.7-152.42.2107.9S338 L342S338-R340 PolarHBondContact O-N 3.05Å; R340-L342 VanDerWaalsContact C-N 3.32Å; R340-L342 PolarHBondContact O-N 3.3Å
341I50Low61.7Low152 Ų152131 Ų13178%0.77974%0.744SS**  trans-72.790.1-175-53.1179.5000108.6T339T339-I341 WeakPolarHBondContact O-CG1 3.28Å; T339-I341 PolarHBondContact O-N 3.03Å
342L69.4Low62.4Low152 Ų152124.5 Ų124.580%0.79673%0.734SS**PPolyproline II helixtrans-61137.2143.5-66.8175.4000106.7R340R340-L342 VanDerWaalsContact C-N 3.32Å; R340-L342 PolarHBondContact O-N 3.3Å
343P71.1Confident62.5Low104 Ų104130 Ų13068%0.67575%0.749SS**PPolyproline II helixtrans-56.4144.7171.426.2-33.9000108.8
344P72.3Confident62.8Low111 Ų111128.3 Ų128.372%0.72174%0.74SS**PPolyproline II helixtrans-56.2143.217625.5-34.1000109.2
345P75.4Confident63.2Low111 Ų111130.5 Ų130.572%0.72175%0.746SS**PPolyproline II helixtrans-55.8148.817425.9-34.3000109.3
346P78.2Confident63.5Low113 Ų113136 Ų13673%0.73475%0.754SS**PPolyproline II helixtrans-54.1144.5174.325.3-34.3000109.2
347P78.3Confident63.8Low117 Ų117133.8 Ų133.876%0.7675%0.748SS**PPolyproline II helixtrans-54.7143.7176.525.3-34.2000109.1
348P79.4Confident64.1Low111 Ų111129.1 Ų129.172%0.72174%0.735SS**PPolyproline II helixtrans-54.5146.5174.125.4-34.2000108.8
349P77.8Confident64.3Low112 Ų112128.9 Ų128.973%0.72772%0.719SS**PPolyproline II helixtrans-53.1140.7175.324.6-33.9000108.6
350P72.3Confident64.8Low96 Ų96130.3 Ų130.362%0.62372%0.722SS**PPolyproline II helixtrans-53.5141.3174.525.1-33.8000108.1
351P72.6Confident65.2Low104 Ų104126.2 Ų126.268%0.67571%0.713SS**PPolyproline II helixtrans-52.6143.3174.424.8-34000108.2F353P351-F353 PolarHBondContact O-N 3.17Å
352P67Low65.9Low109 Ų109122.4 Ų122.471%0.70870%0.7SS**PPolyproline II helixtrans-51.1140.2177.323.9-34.1000108.4S354P352-S354 PolarHBondContact O-N 3.24Å; P352-S354 PolarHBondContact O-OG 2.8Å
353F54.3Low65.7Low190 Ų190120.3 Ų120.383%0.83369%0.689SS**  trans-69.772.5-178.6-69.6-79.8000110.3P351 L355P351-F353 PolarHBondContact O-N 3.17Å; F353-L355 PolarHBondContact O-N 3.28Å
354S57.4Low65.7Low86 Ų86119.6 Ų119.660%0.60168%0.682SS**  trans-50.9114.2171.8-66.30000107.7P352 R356P352-S354 PolarHBondContact O-N 3.24Å; P352-S354 PolarHBondContact O-OG 2.8Å; S354-R356 PolarHBondContact O-N 2.68Å
355L55.5Low65.9Low157 Ų157119.4 Ų119.482%0.82268%0.675SS**  trans-47.7130.8-173.2-63.3170.2000109.3F353 N357 G358F353-L355 PolarHBondContact O-N 3.28Å; L355-N357 PolarHBondContact O-N 3.29Å; L355-G358 PolarHBondContact O-N 3.43Å
356R55.4Low66.1Low235 Ų235117.9 Ų117.989%0.88766%0.661SS**THydrogen-bonded Turntrans-68.824.1-150.8-151.9-166.770.3-166.41.1116.3S354S354-R356 PolarHBondContact O-N 2.68Å
357N52.8Low66.3Low134 Ų134118.6 Ų118.672%0.71765%0.653SS**THydrogen-bonded Turntrans-127.9-20.1-172.8-68.551.9000112.9L355L355-N357 PolarHBondContact O-N 3.29Å
358G55.2Low66.3Low48 Ų48118.8 Ų118.850%0.49564%0.644SS.*SBendtrans-88.3-42.8-17400000115.7L355 L360 H361L355-G358 PolarHBondContact O-N 3.43Å; G358-L360 PolarHBondContact O-N 3.41Å; G358-H361 PolarHBondContact O-N 3.3Å
359H55.1Low66.3Low124 Ų124117.5 Ų117.557%0.57464%0.637SS**Hα-helixtrans-69.3-28.5-163.8-173.643.9000114.9H361 S362 L363H359-H361 PolarHBondContact O-N 3.27Å; H359-S362 PolarHBondContact O-N 3.39Å; H359-L363 PolarHBondContact O-N 3.37Å
360L59.2Low66.6Low137 Ų137118.2 Ų118.272%0.71763%0.629SS**Hα-helixtrans-65.9-38.3-179.8-66.2177.9000112.5G358 L363 V364G358-L360 PolarHBondContact O-N 3.41Å; L360-L363 PolarHBondContact O-N 3.49Å; L360-V364 PolarHBondContact O-N 3.46Å
361H61.4Low67.1Low148 Ų148119.2 Ų119.269%0.68562%0.624SS**Hα-helixtrans-64.2-46.5175.7-72.5-75.5000111G358 H359 L363 V364 D365G358-H361 PolarHBondContact O-N 3.3Å; H359-H361 PolarHBondContact O-N 3.27Å; H361-L363 PolarHBondContact O-N 3.17Å; H361-V364 PolarHBondContact O-N 3.06Å; H361-V364 VanDerWaalsContact O-N 3.17Å; H361-D365 VanDerWaalsContact O-CB 3.27Å; H361-D365 WeakPolarHBondContact O-CB 3.25Å; H361-D365 PolarHBondContact O-N 2.83Å
362S64.4Low67.7Low72 Ų72122.9 Ų122.950%0.50363%0.632SS.*Hα-helixtrans-60.1-26.7178.4179.60000114.1H359 D366H359-S362 PolarHBondContact O-N 3.39Å; S362-D366 WeakPolarHBondContact O-CB 3.41Å; S362-D366 PolarHBondContact O-N 3.3Å
363L65.1Low68.6Low108 Ų108123.7 Ų123.757%0.56562%0.624SS**Hα-helixtrans-85.6-27.9178.6-172.5144.1000113H359 L360 H361 F367H359-L363 PolarHBondContact O-N 3.37Å; L360-L363 PolarHBondContact O-N 3.49Å; H361-L363 PolarHBondContact O-N 3.17Å; L363-F367 PolarHBondContact O-N 2.89Å
364V69.8Low70.2Confident88 Ų88121.2 Ų121.253%0.53362%0.615SS.*Hα-helixtrans-71.4-47.3168.5176.30000109.6L360 H361 D366 F367 E368L360-V364 PolarHBondContact O-N 3.46Å; H361-V364 PolarHBondContact O-N 3.06Å; H361-V364 VanDerWaalsContact O-N 3.17Å; V364-D366 PolarHBondContact O-N 2.88Å; V364-F367 WeakPolarHBondContact O-CB 3.46Å; V364-F367 PolarHBondContact O-N 3.18Å; V364-E368 WeakPolarHBondContact O-CB 3.45Å; V364-E368 PolarHBondContact O-N 2.67Å
365D76.7Confident71.6Confident107 Ų107120.8 Ų120.857%0.57261%0.61SS**Hα-helixtrans-62.6-39.8179.6-165.190.2000112.5H361 F367 E368 S369H361-D365 VanDerWaalsContact O-CB 3.27Å; H361-D365 WeakPolarHBondContact O-CB 3.25Å; H361-D365 PolarHBondContact O-N 2.83Å; D365-F367 VanDerWaalsContact C-N 3.27Å; D365-F367 PolarHBondContact O-N 3.41Å; D365-E368 PolarHBondContact O-N 3.36Å; D365-S369 WeakPolarHBondContact O-CB 3.23Å; D365-S369 PolarHBondContact O-N 3.48Å; D365-S369 PolarHBondContact O-OG 2.74Å
366D80.3Confident72.9Confident80 Ų80118.4 Ų118.443%0.42860%0.602SS.*Hα-helixtrans-69-19.2173.5178.174.5000113.8S362 V364 K370S362-D366 WeakPolarHBondContact O-CB 3.41Å; S362-D366 PolarHBondContact O-N 3.3Å; V364-D366 PolarHBondContact O-N 2.88Å; D366-K370 WeakPolarHBondContact O-CD 3.1Å; D366-K370 WeakPolarHBondContact O-CE 3.45Å; D366-K370 VanDerWaalsContact O-CG 3.3Å; D366-K370 WeakPolarHBondContact O-CG 3.34Å; D366-K370 PolarHBondContact O-NZ 3.33Å; D366-K370 WeakPolarHBondContact OD1-CE 3.29Å; D366-K370 IonicContact OD1-NZ 2.69Å; D366-K370 PolarHBondContact OD1-NZ 3.28Å; D366-K370 IonicContact OD2-NZ 2.63Å; D366-K370 PolarHBondContact OD2-NZ 2.89Å
367F82.4Confident74.5Confident127 Ų127114.7 Ų114.756%0.55760%0.595SS**Hα-helixtrans-86.4-45.2170.6179.7-95.5000111.4L363 V364 D365 K370 F371L363-F367 PolarHBondContact O-N 2.89Å; V364-F367 WeakPolarHBondContact O-CB 3.46Å; V364-F367 PolarHBondContact O-N 3.18Å; D365-F367 VanDerWaalsContact C-N 3.27Å; D365-F367 PolarHBondContact O-N 3.41Å; F367-K370 PolarHBondContact O-N 2.92Å; F367-F371 HydrophobicContact CE2-CD2 4.38Å; F367-F371 HydrophobicContact CE2-CE2 4.15Å; F367-F371 HydrophobicContact CZ-CD2 4.41Å; F367-F371 HydrophobicContact CZ-CE2 4.49Å
368E77.8Confident76.4Confident122 Ų122113.2 Ų113.257%0.5759%0.587SS**Hα-helixtrans-68.4-37.7-178.3-165.8160.5-165.200111.9V364 D365 K370 F371V364-E368 WeakPolarHBondContact O-CB 3.45Å; V364-E368 PolarHBondContact O-N 2.67Å; D365-E368 PolarHBondContact O-N 3.36Å; E368-K370 VanDerWaalsContact C-N 3.28Å; E368-K370 PolarHBondContact O-N 3.05Å; E368-F371 CarbonylContact O-C 3.41Å; E368-F371 PolarHBondContact O-N 3.24Å
369S80.5Confident78Confident84 Ų84116 Ų11659%0.58759%0.59SS**THydrogen-bonded Turntrans-69.4-18174.158.90000114.8D365D365-S369 WeakPolarHBondContact O-CB 3.23Å; D365-S369 PolarHBondContact O-N 3.48Å; D365-S369 PolarHBondContact O-OG 2.74Å
370K83.8Confident79.7Confident126 Ų126115.2 Ų115.255%0.54860%0.596SS.*THydrogen-bonded Turntrans-85.4-13.3176.2-73.4173-165.2161.40113.6D366 F367 E368D366-K370 WeakPolarHBondContact O-CD 3.1Å; D366-K370 WeakPolarHBondContact O-CE 3.45Å; D366-K370 VanDerWaalsContact O-CG 3.3Å; D366-K370 WeakPolarHBondContact O-CG 3.34Å; D366-K370 PolarHBondContact O-NZ 3.33Å; D366-K370 WeakPolarHBondContact OD1-CE 3.29Å; D366-K370 IonicContact OD1-NZ 2.69Å; D366-K370 PolarHBondContact OD1-NZ 3.28Å; D366-K370 IonicContact OD2-NZ 2.63Å; D366-K370 PolarHBondContact OD2-NZ 2.89Å; F367-K370 PolarHBondContact O-N 2.92Å; E368-K370 VanDerWaalsContact C-N 3.28Å; E368-K370 PolarHBondContact O-N 3.05Å
371F83Confident81.2Confident118 Ų118114.3 Ų114.352%0.51860%0.598SS.*SBendtrans-134.298178.1-66.3-79000108.8F367 E368 F373F367-F371 HydrophobicContact CE2-CD2 4.38Å; F367-F371 HydrophobicContact CE2-CE2 4.15Å; F367-F371 HydrophobicContact CZ-CD2 4.41Å; F367-F371 HydrophobicContact CZ-CE2 4.49Å; E368-F371 CarbonylContact O-C 3.41Å; E368-F371 PolarHBondContact O-N 3.24Å; F371-F373 HydrophobicContact CB-CD2 3.98Å; F371-F373 HydrophobicContact CB-CE1 4.48Å; F371-F373 HydrophobicContact CB-CE2 3.42Å; F371-F373 VanDerWaalsContact CB-CE2 3.42Å; F371-F373 HydrophobicContact CB-CZ 3.71Å; F371-F373 HydrophobicContact CG-CE2 4.34Å; F371-F373 HydrophobicContact CG-CZ 4.31Å; F371-F373 WeakPolarHBondContact O-CD2 3.48Å; F371-F373 PolarHBondContact O-N 3.22Å
372Q85.8Confident82.6Confident181 Ų181113.3 Ų113.385%0.84661%0.605SS**  trans-66.385.5174-173.464.278.800109.9
373F84.9Confident83.8Confident125 Ų125117.8 Ų117.855%0.54862%0.623SS.*PPolyproline II helixtrans-70.8146.9170.4-66.1-73.3000109.6F371F371-F373 HydrophobicContact CB-CD2 3.98Å; F371-F373 HydrophobicContact CB-CE1 4.48Å; F371-F373 HydrophobicContact CB-CE2 3.42Å; F371-F373 VanDerWaalsContact CB-CE2 3.42Å; F371-F373 HydrophobicContact CB-CZ 3.71Å; F371-F373 HydrophobicContact CG-CE2 4.34Å; F371-F373 HydrophobicContact CG-CZ 4.31Å; F371-F373 WeakPolarHBondContact O-CD2 3.48Å; F371-F373 PolarHBondContact O-N 3.22Å
374H88.3Confident85.1Confident138 Ų138119.7 Ų119.764%0.63963%0.629SS**PPolyproline II helixtrans-73.4142161.4-59.490.1000107.8D378H374-D378 HydrophobicContact CB-CB 4.3Å; H374-D378 IonicContact CD2-OD2 3.32Å; H374-D378 PolarHBondContact CD2-OD2 3.43Å; H374-D378 IonicContact CG-OD2 3.67Å
375P86.8Confident86.1Confident78 Ų78122.4 Ų122.451%0.50663%0.634SS.*PPolyproline II helixtrans-62.8154.7176.428.6-34.4000110.2E377 D378P375-E377 PolarHBondContact O-N 2.69Å; P375-E377 VanDerWaalsContact O-N 3.11Å; P375-D378 HydrophobicContact CG-CB 3.98Å; P375-D378 WeakPolarHBondContact O-CB 3.27Å; P375-D378 PolarHBondContact O-N 3.03Å
376V82.7Confident86.7Confident107 Ų107123.5 Ų123.565%0.64863%0.634SS**THydrogen-bonded Turntrans-66-17.9-176.6-62.80000112.7D378 L379V376-D378 VanDerWaalsContact C-N 3.35Å; V376-L379 HydrophobicContact CB-CD1 4.42Å; V376-L379 WeakPolarHBondContact O-CB 3.47Å; V376-L379 PolarHBondContact O-N 2.63Å
377E88.2Confident87.2Confident157 Ų157125 Ų12573%0.73465%0.648SS**THydrogen-bonded Turntrans-73.6-18.7173-64.672.9-163.500114.1P375P375-E377 PolarHBondContact O-N 2.69Å; P375-E377 VanDerWaalsContact O-N 3.11Å
378D92.5Very high87.5Confident102 Ų102125.6 Ų125.655%0.54565%0.651SS.*SBendtrans-89.6-9.6174.8-169.550.4000111.9H374 P375 V376H374-D378 HydrophobicContact CB-CB 4.3Å; H374-D378 IonicContact CD2-OD2 3.32Å; H374-D378 PolarHBondContact CD2-OD2 3.43Å; H374-D378 IonicContact CG-OD2 3.67Å; P375-D378 HydrophobicContact CG-CB 3.98Å; P375-D378 WeakPolarHBondContact O-CB 3.27Å; P375-D378 PolarHBondContact O-N 3.03Å; V376-D378 VanDerWaalsContact C-N 3.35Å
379L89.4Confident88Confident106 Ų106125.1 Ų125.156%0.55566%0.658SS**SBendtrans-73.5133.8171.1-56.9177.9000109.6V376V376-L379 HydrophobicContact CB-CD1 4.42Å; V376-L379 WeakPolarHBondContact O-CB 3.47Å; V376-L379 PolarHBondContact O-N 2.63Å
380P91.3Very high88.3Confident108 Ų108128.9 Ų128.970%0.70166%0.659SS**PPolyproline II helixtrans-61.1144.6175.726.2-34.2000110.4
381P90.6Very high88.3Confident119 Ų119128.9 Ų128.977%0.77367%0.67SS**PPolyproline II helixtrans-51.5133.5174.7-27.835.3000111.3D383P381-D383 PolarHBondContact O-N 3.33Å
382P90.3Very high88.3Confident127 Ų127129.2 Ų129.283%0.82567%0.668SS**PPolyproline II helixtrans-57.3138.5-179-26.534.6000112.5E384P382-E384 PolarHBondContact O-N 3.17Å
383D89.9Confident87.9Confident166 Ų166125.6 Ų125.689%0.88866%0.661SS**PPolyproline II helixtrans-51.8132.7177.7-78.5-48.5000112P381 F385P381-D383 PolarHBondContact O-N 3.33Å; D383-F385 PolarHBondContact O-N 3Å
384E91.9Very high87.6Confident147 Ų147124.9 Ų124.969%0.68767%0.671SS**PPolyproline II helixtrans-56.5121.8174.9-63.5179.3160.600110.5P382 K386P382-E384 PolarHBondContact O-N 3.17Å; E384-K386 WeakPolarHBondContact O-CD 3.2Å; E384-K386 WeakPolarHBondContact O-CE 3.43Å; E384-K386 WeakPolarHBondContact O-CG 3.43Å; E384-K386 PolarHBondContact O-N 3.02Å; E384-K386 IonicContact OE2-NZ 3.84Å; E384-K386 PolarHBondContact OE2-NZ 2.67Å
385F90.9Very high86.6Confident145 Ų145126.3 Ų126.364%0.63668%0.675SS**  trans-56.5105.2-179.6174.2-103.9000111.8D383 P387D383-F385 PolarHBondContact O-N 3Å; F385-P387 HydrophobicContact CD1-CG 4.34Å; F385-P387 HydrophobicContact CE1-CB 4.21Å; F385-P387 HydrophobicContact CE1-CG 3.9Å; F385-P387 WeakPolarHBondContact O-CD 3.49Å
386K90.6Very high85.9Confident130 Ų130128.7 Ų128.757%0.56568%0.68SS**  trans-88118.9171.7-51.9-52.5174.5-178.60109E384 F388E384-K386 WeakPolarHBondContact O-CD 3.2Å; E384-K386 WeakPolarHBondContact O-CE 3.43Å; E384-K386 WeakPolarHBondContact O-CG 3.43Å; E384-K386 PolarHBondContact O-N 3.02Å; E384-K386 IonicContact OE2-NZ 3.84Å; E384-K386 PolarHBondContact OE2-NZ 2.67Å; K386-F388 PolarHBondContact O-N 2.82Å
387P90.4Very high85Confident113 Ų113131 Ų13173%0.73469%0.689SS**  trans-65.7107.3175.9-19.432.2000111F385F385-P387 HydrophobicContact CD1-CG 4.34Å; F385-P387 HydrophobicContact CE1-CB 4.21Å; F385-P387 HydrophobicContact CE1-CG 3.9Å; F385-P387 WeakPolarHBondContact O-CD 3.49Å
388F87.8Confident83.9Confident139 Ų139133.9 Ų133.961%0.6169%0.693SS**  trans-99.7149.5174.360.3-93.5000111.5K386 R390K386-F388 PolarHBondContact O-N 2.82Å; F388-R390 HydrophobicContact CD2-CG 4.47Å; F388-R390 HydrophobicContact CE2-CG 4.15Å; F388-R390 PolarHBondContact O-N 3.33Å; F388-R390 VanDerWaalsContact O-N 3.13Å
389P88.2Confident82.5Confident112 Ų112135.2 Ų135.273%0.72770%0.704SS**  trans-64.3114.7176.126.1-33.7000110.5V391P389-V391 VanDerWaalsContact C-N 3.32Å; P389-V391 PolarHBondContact O-N 3.5Å
390R87.8Confident80.9Confident163 Ų163136.9 Ų136.962%0.61571%0.714SS**  trans-75.782.3177.4-65.6-176.4-178164.60.3110.7F388 Y392F388-R390 HydrophobicContact CD2-CG 4.47Å; F388-R390 HydrophobicContact CE2-CG 4.15Å; F388-R390 PolarHBondContact O-N 3.33Å; F388-R390 VanDerWaalsContact O-N 3.13Å; R390-Y392 HydrophobicContact CB-CD2 4.29Å; R390-Y392 HydrophobicContact CB-CE2 3.69Å; R390-Y392 VanDerWaalsContact O-CD2 3.23Å; R390-Y392 WeakPolarHBondContact O-CD2 3.16Å; R390-Y392 PolarHBondContact O-N 3.27Å; R390-Y392 VanDerWaalsContact O-N 3.08Å
391V84.1Confident79.4Confident126 Ų126136.9 Ų136.976%0.76471%0.714SS**  trans-74.293.3171-175.40000108.9P389P389-V391 VanDerWaalsContact C-N 3.32Å; P389-V391 PolarHBondContact O-N 3.5Å
392Y82.7Confident78.1Confident124 Ų124140.2 Ų140.249%0.48672%0.716SS.*  trans-73.2134.6168.9-63.3-85.3000109.4R390 S394 K395R390-Y392 HydrophobicContact CB-CD2 4.29Å; R390-Y392 HydrophobicContact CB-CE2 3.69Å; R390-Y392 VanDerWaalsContact O-CD2 3.23Å; R390-Y392 WeakPolarHBondContact O-CD2 3.16Å; R390-Y392 PolarHBondContact O-N 3.27Å; R390-Y392 VanDerWaalsContact O-N 3.08Å; Y392-S394 PolarHBondContact O-N 3.42Å; Y392-K395 WeakPolarHBondContact O-CA 3.11Å; Y392-K395 WeakPolarHBondContact O-CB 3.11Å; Y392-K395 PolarHBondContact O-N 2.94Å
393P77.6Confident76.6Confident106 Ų106139 Ų13969%0.68871%0.708SS**G310 helixtrans-56.2-33.1175-28.336.1000113.2K395 E396P393-K395 PolarHBondContact O-N 3.45Å; P393-K395 VanDerWaalsContact O-N 3.13Å; P393-E396 WeakPolarHBondContact O-CB 3.3Å; P393-E396 VanDerWaalsContact O-CG 3.28Å; P393-E396 WeakPolarHBondContact O-CG 3.14Å; P393-E396 PolarHBondContact O-N 3.05Å; P393-E396 VanDerWaalsContact O-N 3.08Å
394S76.8Confident75Confident110 Ų110136.8 Ų136.877%0.76970%0.703SS**G310 helixtrans-68.7-3.9173.557.50000115.3Y392Y392-S394 PolarHBondContact O-N 3.42Å
395K67.6Low73.4Confident167 Ų167133.3 Ų133.373%0.72671%0.707SS**G310 helixtrans-104.95.5172.3-72.3-65.3-165176.40113Y392 P393 N397Y392-K395 WeakPolarHBondContact O-CA 3.11Å; Y392-K395 WeakPolarHBondContact O-CB 3.11Å; Y392-K395 PolarHBondContact O-N 2.94Å; P393-K395 PolarHBondContact O-N 3.45Å; P393-K395 VanDerWaalsContact O-N 3.13Å; K395-N397 PolarHBondContact O-N 2.87Å
396E71.9Confident71.8Confident129 Ų129134 Ų13460%0.60372%0.716SS**SBendtrans-57.7134.116378.4-169.516900109.1P393 R398P393-E396 WeakPolarHBondContact O-CB 3.3Å; P393-E396 VanDerWaalsContact O-CG 3.28Å; P393-E396 WeakPolarHBondContact O-CG 3.14Å; P393-E396 PolarHBondContact O-N 3.05Å; P393-E396 VanDerWaalsContact O-N 3.08Å; E396-R398 HydrophobicContact CG-CG 4.45Å; E396-R398 PolarHBondContact O-N 3.37Å
397N64.9Low70Confident155 Ų155137.3 Ų137.383%0.82972%0.724SS**  trans-67.5103.8169-79.2-33000106.9K395 V399K395-N397 PolarHBondContact O-N 2.87Å; N397-V399 PolarHBondContact O-N 3.1Å
398R64Low68.5Low218 Ų218137.9 Ų137.982%0.82373%0.726SS**  trans-6188.1171.1-76.4-175.2169-171.2-3.7109.1E396 N400E396-R398 HydrophobicContact CG-CG 4.45Å; E396-R398 PolarHBondContact O-N 3.37Å; R398-N400 PolarHBondContact O-N 3.28Å
399V63.3Low66.6Low130 Ų130137.8 Ų137.879%0.78873%0.727SS**  trans-55.9105.2169.7174.80000106.1N397 P401N397-V399 PolarHBondContact O-N 3.1Å; V399-P401 WeakPolarHBondContact O-CD 3.39Å
400N56Low64.9Low141 Ų141140.7 Ų140.775%0.75474%0.735SS**  trans-60108.9-165.3-171.5-8.2000109.2R398 K402R398-N400 PolarHBondContact O-N 3.28Å; N400-K402 PolarHBondContact O-N 2.73Å
401P60.7Low63Low107 Ų107147.5 Ų147.570%0.69576%0.761SS**  trans-71.998.7-173.628.6-32.1000107.8V399 P403V399-P401 WeakPolarHBondContact O-CD 3.39Å; P401-P403 WeakPolarHBondContact O-CD 3.42Å
402K62Low62Low189 Ų189148.6 Ų148.682%0.82276%0.761SS**  trans-44.6114.3174.5-176.584.6174.9-170.70107.6N400N400-K402 PolarHBondContact O-N 2.73Å
403P60.5Low60.9Low102 Ų102149.9 Ų149.966%0.66278%0.776SS**PPolyproline II helixtrans-60.5133.2-174.822.4-32.5000108.8P401 G405P401-P403 WeakPolarHBondContact O-CD 3.42Å; P403-G405 PolarHBondContact O-N 3.49Å
404P54.9Low60Low119 Ų119152.3 Ų152.377%0.77378%0.781SS**PPolyproline II helixtrans-59.5132.1-179.624.3-33.1000109.2I406P404-I406 PolarHBondContact O-N 2.77Å; P404-I406 VanDerWaalsContact O-N 3.16Å
405G58.1Low59Low75 Ų75154.8 Ų154.877%0.77378%0.781SS**PPolyproline II helixtrans-58.2119.7-173.400000111.5P403 R407P403-G405 PolarHBondContact O-N 3.49Å; G405-R407 PolarHBondContact O-N 3.15Å
406I57.8Low58.4Low160 Ų160154.1 Ų154.182%0.82179%0.785SS**  trans-69.496-178.5-50.2176.9000108.4P404 T408P404-I406 PolarHBondContact O-N 2.77Å; P404-I406 VanDerWaalsContact O-N 3.16Å; I406-T408 PolarHBondContact O-N 2.92Å
407R53.6Low57.5Low198 Ų198155.7 Ų155.775%0.74780%0.797SS**  trans-72.690.9177.9-176.1180174.3-151.9-0.2109.5G405 H409G405-R407 PolarHBondContact O-N 3.15Å; R407-H409 VanDerWaalsContact CZ-NE2 3.28Å; R407-H409 PolarHBondContact NE-NE2 3.17Å; R407-H409 PolarHBondContact NH1-NE2 3.22Å; R407-H409 PolarHBondContact O-CD2 3.48Å; R407-H409 PolarHBondContact O-N 2.86Å
408T57.9Low57Low126 Ų126155.8 Ų155.877%0.77380%0.795SS**  trans-62.8104.2175.250.60000110.5I406 L410I406-T408 PolarHBondContact O-N 2.92Å; T408-L410 PolarHBondContact O-N 3Å
409H49Very low56.5Low137 Ų137151 Ų15163%0.63479%0.792SS**  trans-80.1100.8167.7-81.9-93.5000109.1R407R407-H409 VanDerWaalsContact CZ-NE2 3.28Å; R407-H409 PolarHBondContact NE-NE2 3.17Å; R407-H409 PolarHBondContact NH1-NE2 3.22Å; R407-H409 PolarHBondContact O-CD2 3.48Å; R407-H409 PolarHBondContact O-N 2.86Å
410L51.4Low55.9Low172 Ų172152.8 Ų152.890%0.90179%0.793SS**  trans-66.3140.4165.5-171.168.7000109.2T408T408-L410 PolarHBondContact O-N 3Å
411R49.1Very low55.9Low307 Ų307153.8 Ų153.8100%1.15880%0.796SS**  trans-145.70170.7-174.6175.2-171.9172.55.1109.2

Retrieved 411 of 411 residues in 306.3 ms (Link to these results)