A0A096LXC2_POEFO Loading...

WAS/WASL interacting protein family member 2

AlphaFold DB , UniProt , Accession A0A096LXC2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 432 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1F50.6Low72Confident256 Ų256134.6 Ų134.6100%1.12374%0.738SS**  0137.20-62.6-84.1000108.9
2P65Low73.2Confident126 Ų126130.8 Ų130.882%0.81872%0.715SS**  trans-65.7142.9170.929-33.9000110.2A4P2-A4 PolarHBondContact O-N 3.22Å
3Q68.6Low74Confident195 Ų195129 Ų12991%0.91172%0.718SS**  trans-73.4114.3179.5-176.6174.1-5.200109.8N5Q3-N5 PolarHBondContact O-N 3.5Å
4A70.6Confident74.6Confident79 Ų79126.3 Ų126.365%0.65371%0.713SS**  trans-63.5129.9177.400000110.6P2 T6P2-A4 PolarHBondContact O-N 3.22Å; A4-T6 PolarHBondContact O-N 3.49Å; A4-T6 VanDerWaalsContact O-N 3.15Å
5N71.8Confident75.4Confident130 Ų130123.9 Ų123.970%0.69569%0.693SS**  trans-70.9109.7175.7-177.23.2000109.7Q3 T7Q3-N5 PolarHBondContact O-N 3.5Å; N5-T7 PolarHBondContact ND2-OG1 3.15Å; N5-T7 WeakPolarHBondContact OD1-CB 3.22Å; N5-T7 PolarHBondContact OD1-N 3.38Å; N5-T7 PolarHBondContact OD1-OG1 3.4Å
6T78.8Confident76.2Confident133 Ų133119.4 Ų119.482%0.81668%0.677SS**  trans-89.7-2179.957.30000113.9A4A4-T6 PolarHBondContact O-N 3.49Å; A4-T6 VanDerWaalsContact O-N 3.15Å
7T74.6Confident76.9Confident96 Ų96122.5 Ų122.559%0.58968%0.681SS**SBendtrans-75.9126.3-18062.60000110.8N5N5-T7 PolarHBondContact ND2-OG1 3.15Å; N5-T7 WeakPolarHBondContact OD1-CB 3.22Å; N5-T7 PolarHBondContact OD1-N 3.38Å; N5-T7 PolarHBondContact OD1-OG1 3.4Å
8P72.8Confident77.8Confident107 Ų107117.9 Ų117.970%0.69567%0.666SS**PPolyproline II helixtrans-69.1136.9177.927.7-33.5000110.1K10P8-K10 PolarHBondContact O-N 3.3Å
9P77.1Confident78.7Confident97 Ų97118.5 Ų118.563%0.6366%0.657SS**PPolyproline II helixtrans-60.3134.6179.124-33.4000110.8L11P9-L11 HydrophobicContact CB-CD2 4.23Å; P9-L11 HydrophobicContact CG-CD2 4.21Å; P9-L11 PolarHBondContact O-N 2.85Å
10K82.4Confident79.5Confident212 Ų212114.6 Ų114.692%0.92265%0.645SS**  trans-81.381.5-172.6-167.8173.8-176.6176.90110.9P8P8-K10 PolarHBondContact O-N 3.3Å
11L80.1Confident80.2Confident50 Ų50111.5 Ų111.526%0.26263%0.634SS.*  trans-62.7149.4-178.5-47.1-173000111.9P9 E15 R19P9-L11 HydrophobicContact CB-CD2 4.23Å; P9-L11 HydrophobicContact CG-CD2 4.21Å; P9-L11 PolarHBondContact O-N 2.85Å; L11-E15 WeakPolarHBondContact CA-OE2 3.46Å; L11-E15 HydrophobicContact CB-CB 4.4Å; L11-E15 HydrophobicContact CB-CG 4.09Å; L11-E15 WeakPolarHBondContact CB-OE2 3.23Å; L11-E15 HydrophobicContact CD1-CG 4.34Å; L11-E15 HydrophobicContact CD2-CG 4.38Å; L11-E15 HydrophobicContact CG-CG 4.48Å; L11-R19 HydrophobicContact CD1-CB 4.4Å
12N85.9Confident82.3Confident88 Ų88104.2 Ų104.247%0.47161%0.606SS.*  trans-80.5171.1172.566.871.3000111.7S14 E15 A16N12-S14 PolarHBondContact O-N 3.12Å; N12-S14 PolarHBondContact OD1-N 3.18Å; N12-S14 PolarHBondContact OD1-OG 3.48Å; N12-E15 PolarHBondContact N-OE2 2.68Å; N12-E15 VanDerWaalsContact N-OE2 3.16Å; N12-E15 WeakPolarHBondContact ND2-CB 3.42Å; N12-E15 PolarHBondContact ND2-OE2 3.38Å; N12-E15 PolarHBondContact O-N 2.86Å; N12-E15 VanDerWaalsContact OD1-CB 3.26Å; N12-E15 WeakPolarHBondContact OD1-CB 3.36Å; N12-E15 PolarHBondContact OD1-N 2.66Å; N12-A16 WeakPolarHBondContact O-CB 3.33Å; N12-A16 PolarHBondContact O-N 3.25Å
13S83.2Confident83.8Confident108 Ų108102.3 Ų102.376%0.75559%0.588SS**Hα-helixtrans-63.9-42.6-171.7-173.40000114.1K17S13-K17 PolarHBondContact O-N 3.1Å; S13-K17 VanDerWaalsContact O-N 3.15Å
14S83.3Confident85.1Confident91 Ų9195.1 Ų95.164%0.63656%0.56SS**Hα-helixtrans-70.7-38.9177.439.90000111.8N12 K17 G18N12-S14 PolarHBondContact O-N 3.12Å; N12-S14 PolarHBondContact OD1-N 3.18Å; N12-S14 PolarHBondContact OD1-OG 3.48Å; S14-K17 PolarHBondContact O-N 3.45Å; S14-G18 PolarHBondContact O-N 2.98Å
15E86.7Confident86.3Confident91 Ų9195.5 Ų95.543%0.42555%0.551SS.*Hα-helixtrans-64.8-41.1174.1-177.2-177.7-157.300112.5L11 N12 K17 G18 R19L11-E15 WeakPolarHBondContact CA-OE2 3.46Å; L11-E15 HydrophobicContact CB-CB 4.4Å; L11-E15 HydrophobicContact CB-CG 4.09Å; L11-E15 WeakPolarHBondContact CB-OE2 3.23Å; L11-E15 HydrophobicContact CD1-CG 4.34Å; L11-E15 HydrophobicContact CD2-CG 4.38Å; L11-E15 HydrophobicContact CG-CG 4.48Å; N12-E15 PolarHBondContact N-OE2 2.68Å; N12-E15 VanDerWaalsContact N-OE2 3.16Å; N12-E15 WeakPolarHBondContact ND2-CB 3.42Å; N12-E15 PolarHBondContact ND2-OE2 3.38Å; N12-E15 PolarHBondContact O-N 2.86Å; N12-E15 VanDerWaalsContact OD1-CB 3.26Å; N12-E15 WeakPolarHBondContact OD1-CB 3.36Å; N12-E15 PolarHBondContact OD1-N 2.66Å; E15-K17 VanDerWaalsContact C-N 3.32Å; E15-K17 PolarHBondContact O-N 3.29Å; E15-G18 PolarHBondContact O-N 3.04Å; E15-R19 WeakPolarHBondContact O-CB 3.26Å; E15-R19 PolarHBondContact O-N 3.27Å
16A87.4Confident87.5Confident52 Ų5294.7 Ų94.743%0.4355%0.545SS..Hα-helixtrans-61.3-40.9173.900000111.6N12 G20N12-A16 WeakPolarHBondContact O-CB 3.33Å; N12-A16 PolarHBondContact O-N 3.25Å; A16-G20 PolarHBondContact O-N 2.86Å
17K87.9Confident88.3Confident171 Ų17193.8 Ų93.874%0.74354%0.543SS*.Hα-helixtrans-67.1-41.7174.4-170.8172.4-178.6176.50112.2S13 S14 E15 G20 A21S13-K17 PolarHBondContact O-N 3.1Å; S13-K17 VanDerWaalsContact O-N 3.15Å; S14-K17 PolarHBondContact O-N 3.45Å; E15-K17 VanDerWaalsContact C-N 3.32Å; E15-K17 PolarHBondContact O-N 3.29Å; K17-G20 PolarHBondContact O-N 3.15Å; K17-A21 PolarHBondContact O-N 3.33Å; K17-A21 VanDerWaalsContact O-N 3.1Å
18G93Very high89.4Confident41 Ų4195.9 Ų95.942%0.42354%0.544SS..Hα-helixtrans-62.8-44.2174.700000112.7S14 E15 G20 A21 L22S14-G18 PolarHBondContact O-N 2.98Å; E15-G18 PolarHBondContact O-N 3.04Å; G18-G20 VanDerWaalsContact C-N 3.33Å; G18-G20 PolarHBondContact O-N 3.44Å; G18-A21 PolarHBondContact O-N 2.82Å; G18-L22 WeakPolarHBondContact O-CB 3.26Å; G18-L22 PolarHBondContact O-N 2.83Å
19R94.9Very high90.4Very high128 Ų12893.2 Ų93.248%0.48354%0.536SS..Hα-helixtrans-61.2-39.4173.1-178.6176.3176.7-169.10.7111.9L11 E15 L22 L23L11-R19 HydrophobicContact CD1-CB 4.4Å; E15-R19 WeakPolarHBondContact O-CB 3.26Å; E15-R19 PolarHBondContact O-N 3.27Å; R19-L22 PolarHBondContact O-N 2.82Å; R19-L23 HydrophobicContact CG-CD1 3.92Å; R19-L23 HydrophobicContact CG-CG 4.24Å; R19-L23 WeakPolarHBondContact O-CB 3.36Å; R19-L23 VanDerWaalsContact O-CG 3.25Å; R19-L23 WeakPolarHBondContact O-CG 3.25Å; R19-L23 PolarHBondContact O-N 2.95Å
20G94.8Very high91.3Very high41 Ų4192.8 Ų92.842%0.42354%0.541SS..Hα-helixtrans-59.8-45.2174.300000112.7A16 K17 G18 S24A16-G20 PolarHBondContact O-N 2.86Å; K17-G20 PolarHBondContact O-N 3.15Å; G18-G20 VanDerWaalsContact C-N 3.33Å; G18-G20 PolarHBondContact O-N 3.44Å; G20-S24 PolarHBondContact O-N 3.38Å; G20-S24 VanDerWaalsContact O-N 3.11Å
21A94.6Very high91.8Very high49 Ų4993.1 Ų93.141%0.40554%0.542SS..Hα-helixtrans-62.5-51.6174.500000111.6K17 G18 L23 S24 D25K17-A21 PolarHBondContact O-N 3.33Å; K17-A21 VanDerWaalsContact O-N 3.1Å; G18-A21 PolarHBondContact O-N 2.82Å; A21-L23 PolarHBondContact O-N 2.92Å; A21-S24 WeakPolarHBondContact O-CA 3.32Å; A21-S24 WeakPolarHBondContact O-CB 3.45Å; A21-S24 PolarHBondContact O-N 2.93Å; A21-S24 PolarHBondContact O-OG 3.48Å; A21-D25 PolarHBondContact O-N 3.13Å
22L95.7Very high92.4Very high104 Ų10498.3 Ų98.355%0.54557%0.569SS.*Hα-helixtrans-56.2-45.8178.9175.861.9000112.6G18 R19 S24 D25 I26G18-L22 WeakPolarHBondContact O-CB 3.26Å; G18-L22 PolarHBondContact O-N 2.83Å; R19-L22 PolarHBondContact O-N 2.82Å; L22-S24 VanDerWaalsContact C-N 3.3Å; L22-S24 PolarHBondContact O-N 3.35Å; L22-D25 PolarHBondContact O-N 3.18Å; L22-I26 HydrophobicContact CD1-CD1 4.09Å; L22-I26 HydrophobicContact CD1-CG1 4.37Å; L22-I26 HydrophobicContact CG-CD1 3.97Å; L22-I26 WeakPolarHBondContact O-CG1 3.49Å; L22-I26 PolarHBondContact O-N 3.11Å
23L96.3Very high92.8Very high85 Ų85103.5 Ų103.545%0.44559%0.588SS.*Hα-helixtrans-61.9-39175.3-72.9171.9000111.4R19 A21 D25 I26 C27R19-L23 HydrophobicContact CG-CD1 3.92Å; R19-L23 HydrophobicContact CG-CG 4.24Å; R19-L23 WeakPolarHBondContact O-CB 3.36Å; R19-L23 VanDerWaalsContact O-CG 3.25Å; R19-L23 WeakPolarHBondContact O-CG 3.25Å; R19-L23 PolarHBondContact O-N 2.95Å; A21-L23 PolarHBondContact O-N 2.92Å; L23-D25 VanDerWaalsContact C-N 3.32Å; L23-D25 PolarHBondContact O-N 3.11Å; L23-I26 PolarHBondContact O-N 3.01Å; L23-C27 WeakPolarHBondContact O-CB 3.33Å; L23-C27 PolarHBondContact O-N 3.26Å; L23-C27 PolarHBondContact O-SG 2.93Å
24S95.8Very high93.2Very high45 Ų45107.3 Ų107.332%0.31559%0.591SS.*Hα-helixtrans-63.6-37.2175.186.20000112.3G20 A21 L22 C27 K28G20-S24 PolarHBondContact O-N 3.38Å; G20-S24 VanDerWaalsContact O-N 3.11Å; A21-S24 WeakPolarHBondContact O-CA 3.32Å; A21-S24 WeakPolarHBondContact O-CB 3.45Å; A21-S24 PolarHBondContact O-N 2.93Å; A21-S24 PolarHBondContact O-OG 3.48Å; L22-S24 VanDerWaalsContact C-N 3.3Å; L22-S24 PolarHBondContact O-N 3.35Å; S24-C27 PolarHBondContact O-N 3.27Å; S24-K28 WeakPolarHBondContact O-CD 3.32Å; S24-K28 WeakPolarHBondContact O-CE 3.44Å; S24-K28 VanDerWaalsContact O-CG 3.23Å; S24-K28 WeakPolarHBondContact O-CG 3.48Å; S24-K28 PolarHBondContact O-N 3.32Å; S24-K28 PolarHBondContact OG-NZ 3.39Å
25D96.3Very high93.5Very high86 Ų86107.6 Ų107.646%0.4659%0.588SS.*Hα-helixtrans-74.8-35.4179.1-65.6-33.5000112.1A21 L22 L23 C27 K28 G29A21-D25 PolarHBondContact O-N 3.13Å; L22-D25 PolarHBondContact O-N 3.18Å; L23-D25 VanDerWaalsContact C-N 3.32Å; L23-D25 PolarHBondContact O-N 3.11Å; D25-C27 VanDerWaalsContact C-N 3.33Å; D25-K28 PolarHBondContact O-N 2.98Å; D25-K28 IonicContact OD1-NZ 2.66Å; D25-K28 PolarHBondContact OD1-NZ 2.97Å; D25-G29 PolarHBondContact O-N 2.92Å
26I95.6Very high93.4Very high113 Ų113109.7 Ų109.758%0.57961%0.607SS**Hα-helixtrans-60.8-42.7168.8-68.4164.8000110.6L22 L23 G29L22-I26 HydrophobicContact CD1-CD1 4.09Å; L22-I26 HydrophobicContact CD1-CG1 4.37Å; L22-I26 HydrophobicContact CG-CD1 3.97Å; L22-I26 WeakPolarHBondContact O-CG1 3.49Å; L22-I26 PolarHBondContact O-N 3.11Å; L23-I26 PolarHBondContact O-N 3.01Å; I26-G29 PolarHBondContact O-N 3.43Å
27C95.7Very high93.2Very high114 Ų114114.1 Ų114.177%0.7762%0.619SS**Hα-helixtrans-70.6-28.5177.3-68.40000114.1L23 S24 D25L23-C27 WeakPolarHBondContact O-CB 3.33Å; L23-C27 PolarHBondContact O-N 3.26Å; L23-C27 PolarHBondContact O-SG 2.93Å; S24-C27 PolarHBondContact O-N 3.27Å; D25-C27 VanDerWaalsContact C-N 3.33Å
28K97.3Very high92.8Very high141 Ų141111.2 Ų111.261%0.61362%0.615SS**Hα-helixtrans-72.7-33170.3-68.6160.3-145159.10111.7S24 D25S24-K28 WeakPolarHBondContact O-CD 3.32Å; S24-K28 WeakPolarHBondContact O-CE 3.44Å; S24-K28 VanDerWaalsContact O-CG 3.23Å; S24-K28 WeakPolarHBondContact O-CG 3.48Å; S24-K28 PolarHBondContact O-N 3.32Å; S24-K28 PolarHBondContact OG-NZ 3.39Å; D25-K28 PolarHBondContact O-N 2.98Å; D25-K28 IonicContact OD1-NZ 2.66Å; D25-K28 PolarHBondContact OD1-NZ 2.97Å
29G95Very high91.8Very high50 Ų50113.9 Ų113.952%0.51562%0.62SS.*  trans74.4169.1-174.300000113.3D25 I26D25-G29 PolarHBondContact O-N 2.92Å; I26-G29 PolarHBondContact O-N 3.43Å
30A94.9Very high90.9Very high89 Ų89112.1 Ų112.174%0.73662%0.62SS**  trans-133.1141.2178.500000111L32A30-L32 PolarHBondContact O-N 2.98Å
31K93.8Very high90Very high218 Ų218120.4 Ų120.495%0.94864%0.639SS**  trans-79.3112.1173.7-74.1-172.8174.6-179.80110.1
32L92.3Very high89.1Confident160 Ų160122.8 Ų122.884%0.83865%0.653SS**PPolyproline II helixtrans-79151.4171.9-56.7-178.6000110.8A30A30-L32 PolarHBondContact O-N 2.98Å
33K93.5Very high87.9Confident197 Ų197120.7 Ų120.786%0.85765%0.65SS**PPolyproline II helixtrans-70.1132.1171.7-68.2-179.464.2-1790109.4V35K33-V35 PolarHBondContact O-N 3.19Å
34K93Very high86.4Confident188 Ų188121.9 Ų121.982%0.81766%0.663SS**PPolyproline II helixtrans-64.7116.1169.7-176.4176.2-179.5-179.60109.1
35V89.3Confident84.8Confident96 Ų96125.5 Ų125.558%0.58268%0.683SS**PPolyproline II helixtrans-78.1124.7166.4177.70000107.4K33 E37 V38K33-V35 PolarHBondContact O-N 3.19Å; V35-E37 WeakPolarHBondContact CG1-O 3.47Å; V35-V38 HydrophobicContact CG1-CG2 4.01Å
36T85.4Confident83.3Confident135 Ų135128.5 Ų128.583%0.82870%0.698SS**SBendtrans-93.7-25.4178.146.20000112.8
37E82.9Confident81.2Confident145 Ų145129.1 Ų129.168%0.67870%0.703SS**  trans-113.597.9175.6-172.7-170.5156.900108.8V35V35-E37 WeakPolarHBondContact CG1-O 3.47Å
38V78.8Confident79.1Confident110 Ų110130.1 Ų130.167%0.66771%0.705SS**  trans-96.2111.8167.1-1730000106.3V35 D40V35-V38 HydrophobicContact CG1-CG2 4.01Å; V38-D40 HydrophobicContact CG1-CB 4.1Å; V38-D40 PolarHBondContact O-N 3.45Å
39N72.8Confident76.6Confident97 Ų97132.9 Ų132.952%0.51972%0.718SS.*  trans-78.257179.2-150.9-70.1000110.2R41N39-R41 PolarHBondContact O-N 2.99Å; N39-R41 VanDerWaalsContact O-N 3.1Å; N39-R41 PolarHBondContact OD1-NE 2.88Å; N39-R41 PolarHBondContact OD1-NH2 3.44Å
40D76.3Confident74.2Confident91 Ų91140 Ų14049%0.48773%0.734SS.*  trans-78.193.3-177.4-170.2-9.9000110.6V38 S42V38-D40 HydrophobicContact CG1-CB 4.1Å; V38-D40 PolarHBondContact O-N 3.45Å; D40-S42 PolarHBondContact O-N 3.43Å; D40-S42 VanDerWaalsContact OD1-CB 3.3Å; D40-S42 WeakPolarHBondContact OD1-CB 3.48Å; D40-S42 PolarHBondContact OD1-N 2.93Å; D40-S42 PolarHBondContact OD1-OG 3.11Å
41R74.1Confident71.8Confident215 Ų215145.6 Ų145.681%0.81174%0.742SS**THydrogen-bonded Turntrans-83.38.8176.7-55.9-174.4-171.5-176.52.5113.4N39N39-R41 PolarHBondContact O-N 2.99Å; N39-R41 VanDerWaalsContact O-N 3.1Å; N39-R41 PolarHBondContact OD1-NE 2.88Å; N39-R41 PolarHBondContact OD1-NH2 3.44Å
42S77.6Confident69.3Low100 Ų100140.5 Ų140.570%0.69973%0.734SS**THydrogen-bonded Turntrans-90.6-17.5173.576.70000113D40D40-S42 PolarHBondContact O-N 3.43Å; D40-S42 VanDerWaalsContact OD1-CB 3.3Å; D40-S42 WeakPolarHBondContact OD1-CB 3.48Å; D40-S42 PolarHBondContact OD1-N 2.93Å; D40-S42 PolarHBondContact OD1-OG 3.11Å
43A69.3Low67.1Low59 Ų59141 Ų14149%0.48874%0.738SS.*SBendtrans-66.9128.7172.600000110.7V45A43-V45 PolarHBondContact O-N 2.79Å
44P64.6Low64.7Low111 Ų111139.5 Ų139.572%0.72174%0.738SS**  trans-66.713117827.2-33.8000110.6L46P44-L46 PolarHBondContact O-N 2.98Å
45V62.8Low62.3Low121 Ų121134.8 Ų134.873%0.73373%0.734SS**  trans-72.198.1175.8-178.30000108.9A43 D47A43-V45 PolarHBondContact O-N 2.79Å; V45-D47 PolarHBondContact O-N 3.15Å
46L64.4Low60.4Low148 Ų148134 Ų13478%0.77574%0.737SS**  trans-81.294.7167.8-66.2177.9000108.6P44 T48P44-L46 PolarHBondContact O-N 2.98Å; L46-T48 PolarHBondContact O-N 3.4Å
47D52.3Low58.8Low127 Ų127138.7 Ų138.768%0.67974%0.74SS**  trans-62.794.8175.2-80.3-40.8000110.7V45 F49V45-D47 PolarHBondContact O-N 3.15Å; D47-F49 WeakPolarHBondContact O-CD2 3.14Å; D47-F49 PolarHBondContact O-N 2.72Å
48T51.3Low56.9Low134 Ų134137.9 Ų137.982%0.82275%0.746SS**  trans-69.799.3173.253.80000109.5L46 K50L46-T48 PolarHBondContact O-N 3.4Å; T48-K50 PolarHBondContact O-N 2.99Å; T48-K50 VanDerWaalsContact O-N 3.09Å
49F43.6Very low55.6Low200 Ų200139.7 Ų139.788%0.87776%0.757SS**  trans-50.5118.9179.5-76.6-87.9000111.4D47 K51D47-F49 WeakPolarHBondContact O-CD2 3.14Å; D47-F49 PolarHBondContact O-N 2.72Å; F49-K51 PolarHBondContact O-N 3.16Å
50K45.5Very low54.6Low198 Ų198142.3 Ų142.386%0.86177%0.77SS**  trans-62.8122.7-179.1-177.8179.2179.1-178.20109.3T48 S52T48-K50 PolarHBondContact O-N 2.99Å; T48-K50 VanDerWaalsContact O-N 3.09Å; K50-S52 PolarHBondContact O-N 3.38Å
51K44.9Very low53.2Low208 Ų208144.4 Ų144.490%0.90478%0.78SS**  trans-46.6111.3-179.5-66.4178.3179.1178.50112.2F49F49-K51 PolarHBondContact O-N 3.16Å
52S40Very low51.7Low110 Ų110140.6 Ų140.677%0.76977%0.774SS**  trans-105143.2152.947.60000108.3K50 L54K50-S52 PolarHBondContact O-N 3.38Å; S52-L54 PolarHBondContact O-N 2.99Å
53N47.3Very low50.4Low171 Ų171142 Ų14291%0.91478%0.784SS**  trans-77.1123.8174.2-77.3-22.5000109.5
54L41.8Very low49.1Very low165 Ų165143.9 Ų143.986%0.86479%0.79SS**  trans-137.7126.4151.7-174.558.3000107.5S52S52-L54 PolarHBondContact O-N 2.99Å
55A44.6Very low48.4Very low90 Ų90149.3 Ų149.374%0.74480%0.802SS**  trans-101.1144.3-178.500000110.4
56A49.2Very low47.8Very low78 Ų78148.4 Ų148.465%0.64580%0.796SS**  trans62.3151.4-167.100000113
57W50.7Low47.2Very low234 Ų234144.1 Ų144.189%0.88679%0.788SS**  cis-127.5-173.115.7-74.158.9000112.2
58T42.7Very low47.3Very low129 Ų129147.4 Ų147.479%0.79180%0.802SS**  trans70.8102.4166.556.20000118.9L60T58-L60 PolarHBondContact O-N 2.67Å; T58-L60 VanDerWaalsContact O-N 3.11Å
59T51.3Low47.5Very low148 Ų148143.5 Ų143.591%0.90879%0.788SS**  trans-81.172.5177.9-500000112.9
60L53.6Low48.1Very low152 Ų152136.9 Ų136.980%0.79677%0.77SS**  trans-161125165.7-135.269.1000106.3T58T58-L60 PolarHBondContact O-N 2.67Å; T58-L60 VanDerWaalsContact O-N 3.11Å
61I44.9Very low48.8Very low135 Ų135134.5 Ų134.569%0.69277%0.766SS**SBendcis-138.3138.834.3-71.4-85.3000110.5
62I43.3Very low49.4Very low135 Ų135133 Ų13369%0.69276%0.76SS**  trans25.7116.5153.7-55.6171.5000118.5T64I62-T64 HydrophobicContact CG2-CG2 3.89Å; I62-T64 PolarHBondContact O-N 3.46Å
63S50.2Low50.3Low129 Ų129135.1 Ų135.190%0.90276%0.758SS**  trans-68.594.8164.9-71.40000112.9
64T41.5Very low50.9Low99 Ų99130.1 Ų130.161%0.60775%0.746SS**  trans-128.993.6165.641.90000112.7I62 V66I62-T64 HydrophobicContact CG2-CG2 3.89Å; I62-T64 PolarHBondContact O-N 3.46Å; T64-V66 HydrophobicContact CG2-CG2 3.82Å; T64-V66 PolarHBondContact O-N 2.98Å
65K50.8Low52.2Low224 Ų224125.4 Ų125.497%0.97474%0.737SS**  trans-71.362.7149.9-79.1-176.3176.5174.60109.6
66V50.4Low53.5Low102 Ų102127.6 Ų127.662%0.61874%0.741SS**  trans-98105.8171.6173.50000107.3T64 M68T64-V66 HydrophobicContact CG2-CG2 3.82Å; T64-V66 PolarHBondContact O-N 2.98Å; V66-M68 PolarHBondContact O-N 2.92Å
67G51Low54.2Low58 Ų58129.2 Ų129.260%0.59875%0.745SS**  trans-63.5133.8170.200000109.8G69G67-G69 PolarHBondContact O-N 2.91Å
68M54.4Low55Low197 Ų197127.6 Ų127.697%0.9775%0.745SS**THydrogen-bonded Turntrans-69.424.6-176.6-65.4165.358.900114.5V66V66-M68 PolarHBondContact O-N 2.92Å
69G55.3Low55.9Low52 Ų52128.7 Ų128.754%0.53675%0.745SS.*THydrogen-bonded Turntrans-96.6-11.7179.600000115.3G67G67-G69 PolarHBondContact O-N 2.91Å
70A56.3Low56.8Low60 Ų60131.9 Ų131.950%0.49674%0.74SS.*G310 helixtrans-80.1-20.6-171.100000115.1F72 Q73A70-F72 PolarHBondContact O-N 3.03Å; A70-Q73 PolarHBondContact O-N 3.07Å; A70-Q73 VanDerWaalsContact O-N 3.07Å
71L60.3Low57.2Low148 Ų148130.8 Ų130.878%0.77574%0.742SS**G310 helixtrans-62.8-19.5-167.9-167.762000114.2
72F58.7Low57.7Low178 Ų178131 Ų13178%0.78175%0.749SS**G310 helixtrans-107.95.3179.9-60.5-77.1000114.4A70A70-F72 PolarHBondContact O-N 3.03Å
73Q58.8Low57.9Low154 Ų154126.7 Ų126.772%0.7274%0.738SS**THydrogen-bonded Turntrans-75.1-28.5172.2-101.687.596.200112.6A70 G75A70-Q73 PolarHBondContact O-N 3.07Å; A70-Q73 VanDerWaalsContact O-N 3.07Å; Q73-G75 PolarHBondContact O-N 2.73Å; Q73-G75 VanDerWaalsContact O-N 3.09Å
74G60.2Low58Low65 Ų65128.7 Ų128.767%0.6774%0.739SS**SBendtrans-76.389170.900000110.7
75G68.9Low57.9Low66 Ų66127.6 Ų127.668%0.6875%0.748SS**PPolyproline II helixtrans-54.7142.9-178.400000113.1Q73Q73-G75 PolarHBondContact O-N 2.73Å; Q73-G75 VanDerWaalsContact O-N 3.09Å
76V70.9Confident57.9Low136 Ų136122.5 Ų122.582%0.82474%0.74SS**PPolyproline II helixtrans-47.3131.3-171.6-70.90000113K78V76-K78 PolarHBondContact O-N 3.16Å; V76-K78 VanDerWaalsContact O-N 3.11Å
77P63.8Low57.9Low113 Ų113122.1 Ų122.173%0.73475%0.748SS**PPolyproline II helixtrans-60.5120.4-177.223.5-32.9000110L79P77-L79 PolarHBondContact O-N 3.34Å
78K68.1Low57.5Low200 Ų200129.8 Ų129.887%0.8777%0.765SS**  trans-68.390.1-176.5-172.585.9175.9-172.10109.7V76 R80V76-K78 PolarHBondContact O-N 3.16Å; V76-K78 VanDerWaalsContact O-N 3.11Å; K78-R80 PolarHBondContact O-N 3.02Å
79L61.4Low57.2Low152 Ų152123.8 Ų123.880%0.79675%0.754SS**PPolyproline II helixtrans-53.8127.9173.5-62.3-178.4000109.4P77P77-L79 PolarHBondContact O-N 3.34Å
80R70.3Confident56.8Low215 Ų215126.7 Ų126.781%0.81177%0.766SS**PPolyproline II helixtrans-65.6132.3173.7-65.9-175.9-71.1108.8-4.9108.1K78 V82K78-R80 PolarHBondContact O-N 3.02Å; R80-V82 PolarHBondContact O-N 3.23Å; R80-V82 VanDerWaalsContact O-N 3.15Å
81P62.2Low56.6Low129 Ų129130.7 Ų130.784%0.83878%0.784SS**PPolyproline II helixtrans-56.1121.4165.9-22.233.5000109G83P81-G83 PolarHBondContact O-N 3.49Å
82V55.6Low55.8Low138 Ų138127.1 Ų127.184%0.83678%0.783SS**  trans-83.2104.1167.6178.30000105.8R80R80-V82 PolarHBondContact O-N 3.23Å; R80-V82 VanDerWaalsContact O-N 3.15Å
83G47.3Very low55.2Low45 Ų45130.4 Ų130.446%0.46479%0.79SS.*  trans-74.1137.6176.100000111.7P81 G85P81-G83 PolarHBondContact O-N 3.49Å; G83-G85 PolarHBondContact O-N 2.79Å
84D52.1Low54.6Low171 Ų171129.4 Ų129.491%0.91480%0.8SS**  63.843.4125.8-41.2-31.1000117.4
85G39.6Very low53.8Low77 Ų77130.2 Ų130.279%0.79480%0.801SS**  trans-87.6118157.400000110.8G83G83-G85 PolarHBondContact O-N 2.79Å
86S50.6Low52.8Low117 Ų117135.5 Ų135.582%0.81881%0.812SS**  trans-88.4159.4-179.560.40000113.3
87A50.9Low51.8Low94 Ų94139.7 Ų139.778%0.77781%0.813SS**SBendtrans76153.2173.700000118.1
88F42.6Very low51.2Low218 Ų218138.8 Ų138.896%0.95681%0.807SS**  trans57.7129.1-173-102.6-103.2000116.4
89G47.3Very low50.2Low72 Ų72135.6 Ų135.674%0.74281%0.807SS**  trans-137.2160.3-177.100000112.9
90S47.4Very low49.8Very low113 Ų113131.9 Ų131.979%0.7981%0.806SS**  trans-159.3139.5158.6-165.40000111.4
91V51Low48.6Very low144 Ų144126.1 Ų126.187%0.87380%0.798SS**  trans27.1102.7156.7-175.50000117.8
92G45Very low48Very low73 Ų73131.2 Ų131.275%0.75380%0.801SS**  trans-156.153.9-176.400000118
93R44.6Very low47.3Very low246 Ų246130.6 Ų130.693%0.92880%0.8SS**  trans50.671.5160.2-62176.6173.5-114.4-2117.5
94S46.4Very low47Very low134 Ų134133.3 Ų133.394%0.93782%0.817SS**  trans-77.3120.2158.9-172.70000110.1
95A44.1Very low46.6Very low82 Ų82129.6 Ų129.668%0.67881%0.811SS**  trans-135.3119.4-179.100000112.3
96L48.5Very low46.8Very low177 Ų177131.9 Ų131.993%0.92781%0.812SS**  trans5859.9156.8-55177.3000117.7
97R49.5Very low46.9Very low223 Ų223137.6 Ų137.684%0.84282%0.815SS**  trans-96.4115.7152-178.8179.7176.2-173.4-0.5109.7
98P49.9Very low46.6Very low94 Ų94138.4 Ų138.461%0.6181%0.813SS**  trans-67.9140.5174.2-19.432.3000112
99P48.2Very low46.7Very low134 Ų134134.1 Ų134.187%0.8781%0.807SS**THydrogen-bonded Turntrans-76.5125.8169.830.8-32.1000110.4
100G52.5Low46.2Very low74 Ų74137 Ų13776%0.76382%0.815SS**THydrogen-bonded Turntrans143.6-21.7166.900000117.2R102G100-R102 PolarHBondContact O-N 3.32Å
101S45.7Very low45.6Very low93 Ų93135.2 Ų135.265%0.6582%0.815SS**  trans-77.889.9-176.544.70000113.3
102R50.1Low44.8Very low236 Ų236132.2 Ų132.289%0.89181%0.813SS**PPolyproline II helixtrans-70.2130.2158.7-70.1-175.3175.7-167.2-1.4109.2G100 A104G100-R102 PolarHBondContact O-N 3.32Å; R102-A104 PolarHBondContact O-N 3.47Å
103P39.3Very low44.2Very low126 Ų126134 Ų13482%0.81881%0.814SS**PPolyproline II helixtrans-67.1131.3167.628.5-32.6000109.5
104A41.3Very low43.7Very low101 Ų101128.6 Ų128.684%0.83581%0.809SS**PPolyproline II helixtrans-75.6134.8176.900000110.6R102R102-A104 PolarHBondContact O-N 3.47Å
105A44.5Very low43Very low94 Ų94127.8 Ų127.878%0.77780%0.803SS**PPolyproline II helixtrans-71.414417600000111.3
106P43.9Very low43.2Very low125 Ų125129.5 Ų129.581%0.81281%0.807SS**PPolyproline II helixtrans-69.2134.5176.228.8-34000111.1
107R52.2Low42.4Very low236 Ų236127.7 Ų127.789%0.89180%0.799SS**PPolyproline II helixtrans-73.1141.1165.8-84.6-179.1161.2-165.1-5.8110.1
108P45.3Very low41.6Very low112 Ų112124.9 Ų124.973%0.72780%0.799SS**PPolyproline II helixtrans-69.6153165.231.3-34.4000110.8
109P44.6Very low40.9Very low127 Ų127123.8 Ų123.883%0.82580%0.798SS**PPolyproline II helixtrans-71.3143.4171.431-34.2000110.9
110S36.6Very low40.2Very low132 Ų132125.3 Ų125.392%0.92380%0.799SS**  trans-86.1111.3169.1-165.50000108.9
111G33.6Very low39.3Very low76 Ų76131.3 Ų131.378%0.78480%0.804SS**  trans-116.1143.1174.100000110.2
112G35.5Very low39.2Very low81 Ų81132 Ų13284%0.83581%0.806SS**  trans-123.4147.8-175.400000114.2
113S32.2Very low38.2Very low111 Ų111126 Ų12678%0.77680%0.8SS**  trans-155.5133.415843.10000106.8
114T33.3Very low37.7Very low133 Ų133125.7 Ų125.782%0.81680%0.801SS**  70.777.759.948.30000117.3
115S31.3Very low37.5Very low117 Ų117126 Ų12682%0.81880%0.797SS**  trans69.5165.2144.4-88.90000120.2
116P48.7Very low37Very low117 Ų117128.1 Ų128.176%0.7680%0.796SS**  cis-127.3154.2-2.735.7-18.8000117.6
117N31.8Very low36.8Very low140 Ų140130.1 Ų130.175%0.74979%0.794SS**  trans9.5131.5145.3-170.333.4000122
118L33.5Very low36.1Very low163 Ų163126.3 Ų126.385%0.85379%0.786SS**  -163.2164.7121.6-106.9169.2000113.3
119A35.3Very low35.8Very low72 Ų72131.7 Ų131.760%0.59579%0.792SS**  trans-87.1151-156.600000117.3
120N33.2Very low35.3Very low166 Ų166130.4 Ų130.489%0.88879%0.786SS**  -174.3165.9114.5-92.5-28.2000114.2
121K34.2Very low35.4Very low200 Ų200132.9 Ų132.987%0.8778%0.783SS**  trans-126.8179.1179.9-95.3-169.9177.6-174.40108.9
122P43.2Very low35.8Very low106 Ų106140.3 Ų140.369%0.68879%0.787SS**  cis-131.5-174.1-2.136-16.4000115.3
123S28.4Very low36.3Very low110 Ų110142.5 Ų142.577%0.76979%0.786SS**  trans66.8140.2163.269.30000117.2
124S30.1Very low36.8Very low120 Ų120142.5 Ų142.584%0.83979%0.787SS**  cis-156.6-179.1-7-90.70000107.7
125S37.1Very low37.7Very low107 Ų107143.9 Ų143.975%0.74879%0.788SS**  cis-146.8-177.210.365.60000111.6
126D32.8Very low38.6Very low139 Ų139143.7 Ų143.774%0.74378%0.784SS**  trans-61.4145.2164.8-59.9-96.9000113.5
127H40.6Very low38.1Very low168 Ų168145.5 Ų145.578%0.77879%0.787SS**  -172.9150.4119.6-104.751.7000113.7
128Q37.2Very low39.1Very low155 Ų155146 Ų14672%0.72479%0.789SS**  trans64.7105167.2-56.5-46.6-47.100120.7
129R38.4Very low39.2Very low226 Ų226143 Ų14385%0.85378%0.782SS**  trans-75.2131.6163.4-95-178.3168.6-144.72.2111.9
130S34.5Very low39.5Very low100 Ų100151.1 Ų151.170%0.69980%0.797SS**  trans44.310614463.20000120.2
131H38.6Very low40.1Very low184 Ų184149 Ų14985%0.85279%0.792SS**  trans-114.984.6153.8-72-57.4000111.4
132R41.7Very low40.2Very low231 Ų231144.4 Ų144.487%0.87279%0.791SS**PPolyproline II helixtrans-85.2122163.9-179.1-174.2-173-174.53.5107.3S134R132-S134 PolarHBondContact O-N 3.18Å
133P46.1Very low39.7Very low127 Ų127142.9 Ų142.983%0.82580%0.795SS**PPolyproline II helixtrans-69.5117.7179.127.2-33000110.3
134S43.3Very low40.1Very low112 Ų112146 Ų14678%0.78380%0.803SS**PPolyproline II helixtrans-94.3153.6171.750.60000111.2R132R132-S134 PolarHBondContact O-N 3.18Å
135L52.2Low40.3Very low161 Ų161146.1 Ų146.184%0.84380%0.804SS**PPolyproline II helixtrans-68.3156.1175.4-71.3161000111.2D137L135-D137 PolarHBondContact O-N 3.15Å
136P50Low40.4Very low113 Ų113146.9 Ų146.973%0.73481%0.809SS**PPolyproline II helixtrans-67.8130.8173.428.9-34.2000110.6
137D39Very low40.7Very low155 Ų155145.9 Ų145.983%0.82981%0.813SS**PPolyproline II helixtrans-81.5148.2175-157.7-14.7000110.7L135L135-D137 PolarHBondContact O-N 3.15Å
138I51.4Low40.6Very low151 Ų151144.2 Ų144.277%0.77482%0.82SS**  trans-128.583.5-170.8-51175.2000108.7
139S36Very low40.6Very low101 Ų101140.3 Ų140.371%0.70682%0.822SS**  trans-154119.8173.4-910000115.3
140R41.3Very low40.6Very low242 Ų242133.3 Ų133.391%0.91382%0.82SS**  trans81.9153.1154.6-64.3-176.2178.5-127.7-3.7118
141P46.3Very low41.1Very low120 Ų120136.8 Ų136.878%0.77983%0.827SS**  trans-136.3-171.9-13645-28.7000116.6
142A36.3Very low41.7Very low105 Ų105136.8 Ų136.887%0.86883%0.825SS**  trans82.6133.416300000117.9
143G32.5Very low41.9Very low74 Ų74133.1 Ų133.176%0.76382%0.817SS**  trans153.491.1178.800000112.3
144N36.3Very low41.5Very low175 Ų175132.6 Ų132.694%0.93682%0.816SS**  trans-76.4129.5176.5-83.55.6000111.6
145S34.4Very low41.6Very low123 Ų123133.1 Ų133.186%0.8682%0.815SS**  trans-158.1150.6148.555.20000111
146S39.2Very low41.4Very low122 Ų122131.7 Ų131.785%0.85382%0.818SS**  trans-101.2130.1-171530000113.5
147S39Very low41.8Very low119 Ų119129.6 Ų129.683%0.83281%0.811SS**  trans-148.4129.5161.261.80000111.3
148S39.7Very low42.9Very low132 Ų132127.9 Ų127.992%0.92381%0.808SS**  trans-74.6141.3176.443.30000112
149G36.5Very low43.6Very low74 Ų74126.3 Ų126.376%0.76381%0.808SS**  trans-154.1105.6176.300000110.7M151G149-M151 PolarHBondContact O-N 3.26Å
150G39.1Very low45.3Very low79 Ų79127 Ų12781%0.81481%0.81SS**  trans-71.7126.9-167.700000114.5K152G150-K152 PolarHBondContact O-N 3.26Å
151M45.1Very low46.4Very low172 Ų172121 Ų12185%0.84780%0.802SS**  trans-66.3115.5163.9-67.2168.9172.800109.4G149G149-M151 PolarHBondContact O-N 3.26Å
152K50.2Low47.3Very low185 Ų185120.4 Ų120.480%0.80480%0.799SS**  trans-115.7106.1169.273.1-176.5-166.9-64.30110.6G150G150-K152 PolarHBondContact O-N 3.26Å
153H45.1Very low48.8Very low154 Ų154120.6 Ų120.671%0.71379%0.791SS**  trans-92.9111.1171.3-50.9-64.1000107.9T155H153-T155 VanDerWaalsContact C-N 3.33Å; H153-T155 PolarHBondContact O-N 2.92Å
154S39.1Very low50Low115 Ų115126.4 Ų126.480%0.80480%0.796SS**  trans-76.679.8-176.4-610000111.7S156S154-S156 PolarHBondContact O-N 3.35Å
155T45Very low50.7Low123 Ų123125 Ų12576%0.75579%0.788SS**  trans-72.693.9175.6-53.10000110.6H153 A157H153-T155 VanDerWaalsContact C-N 3.33Å; H153-T155 PolarHBondContact O-N 2.92Å; T155-A157 HydrophobicContact CG2-CB 4.28Å; T155-A157 PolarHBondContact O-N 3.05Å; T155-A157 VanDerWaalsContact O-N 3.15Å
156S48.9Very low51.6Low131 Ų131129 Ų12992%0.91679%0.79SS**  trans-78.792.3167.6-168.90000109.6S154S154-S156 PolarHBondContact O-N 3.35Å
157A57.1Low51.9Low69 Ų69128.4 Ų128.457%0.5779%0.786SS**  trans-143.7136167.900000108.7T155T155-A157 HydrophobicContact CG2-CB 4.28Å; T155-A157 PolarHBondContact O-N 3.05Å; T155-A157 VanDerWaalsContact O-N 3.15Å
158P62.6Low51.8Low120 Ų120126.4 Ų126.478%0.77978%0.784SS**PPolyproline II helixtrans-66.9150.3173.529.6-34.4000110.4
159P66.6Low52.3Low117 Ų117132.7 Ų132.776%0.7679%0.787SS**PPolyproline II helixtrans-63.7147.5175.728-34.8000111
160P70.3Confident52.7Low115 Ų115132.5 Ų132.575%0.74779%0.785SS**PPolyproline II helixtrans-66.2152.4174.229.6-35.1000111.1
161P64.4Low52.6Low117 Ų117136.7 Ų136.776%0.7679%0.789SS**PPolyproline II helixtrans-64.5152.6174.828.6-35.2000111.5
162P66.2Low52.6Low108 Ų108133 Ų13370%0.70179%0.785SS**PPolyproline II helixtrans-65.2151.3179.927.9-35.3000112.1
163P67.6Low52.5Low109 Ų109129.6 Ų129.671%0.70878%0.783SS**PPolyproline II helixtrans-68.5139.8-179.928.6-34.9000112N165P163-N165 PolarHBondContact O-N 3.16Å
164F57.8Low52.6Low196 Ų196128.2 Ų128.286%0.8679%0.787SS**  trans-72.9106.9172.7-69.4-83.1000110.7K166F164-K166 PolarHBondContact O-N 3.38Å
165N50.3Low52.9Low144 Ų144129.2 Ų129.277%0.7779%0.788SS**  trans-66.986.1177.1-73.3-16.4000112.1P163 S167P163-N165 PolarHBondContact O-N 3.16Å; N165-S167 PolarHBondContact O-N 3.27Å
166K53.4Low52.7Low207 Ų207129.5 Ų129.590%0.979%0.793SS**  trans-78.361.1172.3-76-170.5172.3-176.50112.4F164F164-K166 PolarHBondContact O-N 3.38Å
167S45.2Very low52.3Low110 Ų110130 Ų13077%0.76979%0.785SS**  trans-153.467175.162.10000112.5N165N165-S167 PolarHBondContact O-N 3.27Å
168G38Very low51.5Low77 Ų77133.5 Ų133.579%0.79479%0.789SS**  trans-145.9123.3169.900000109.7
169R49.1Very low50.2Low265 Ų265136.6 Ų136.6100%179%0.791SS**  trans-88138.9178.5-65.7-175.6178.9-1541.3110
170G44.5Very low48.7Very low69 Ų69134.4 Ų134.471%0.71179%0.789SS**  trans-178.4138170.400000112.3
171N38.1Very low47.2Very low167 Ų167135.5 Ų135.589%0.89380%0.796SS**  trans53.282.4165.6-58.4-4.8000117.4
172A46Very low45.7Very low94 Ų94134.9 Ų134.978%0.77780%0.795SS**PPolyproline II helixtrans-82.1140148.600000109.5
173P46.6Very low44.2Very low115 Ų115139.9 Ų139.975%0.74780%0.801SS**PPolyproline II helixtrans-72.9148.6168.631.2-33.6000110.7
174P46.8Very low42.5Very low125 Ų125141.5 Ų141.581%0.81280%0.804SS**PPolyproline II helixtrans-77.3146.9-177.231.5-35.6000112.7P176P174-P176 WeakPolarHBondContact O-CD 3.38Å
175T47.3Very low41.4Very low135 Ų135142.8 Ų142.883%0.82880%0.803SS**PPolyproline II helixtrans-84121.4169.551.20000111
176P39.9Very low40.8Very low130 Ų130140.3 Ų140.384%0.84479%0.79SS**PPolyproline II helixtrans-82.4128168.132-30.9000110.6P174P174-P176 WeakPolarHBondContact O-CD 3.38Å
177N41.3Very low40.2Very low142 Ų142139 Ų13976%0.75978%0.784SS**  trans-134.3115.5169.8177.88.8000109.1
178Q39.9Very low40Very low141 Ų141139.8 Ų139.866%0.65978%0.784SS**  trans163.9137.4141.9-95.2-179.464.600112.7
179K34.1Very low40.4Very low185 Ų185144 Ų14480%0.80479%0.787SS**  trans67.8139.1150.5-65.3161.6178158.30118.8
180G35.7Very low40.4Very low71 Ų71137.1 Ų137.173%0.73278%0.777SS**  trans-91-167178.400000114
181P39.2Very low40.6Very low138 Ų138138.8 Ų138.890%0.89678%0.776SS**  -144.1-173.778.441.7-26.1000116.8
182S31.9Very low40.8Very low104 Ų104137.4 Ų137.473%0.72777%0.774SS**  trans-65.2135.9-173.3177.50000117.9
183Y35.4Very low40.6Very low213 Ų213138.7 Ų138.784%0.83577%0.774SS**  -163.1121.2121.145.9-101.5000109.1
184N31.6Very low40.3Very low143 Ų143138.5 Ų138.577%0.76578%0.775SS**  73.196.773.8-169.65.7000115
185R35.7Very low39.5Very low223 Ų223145 Ų14584%0.84278%0.784SS**  trans-153.5120140.2-136.1-155.8166.5137.66.2114.7
186D36.9Very low38.6Very low93 Ų93141.3 Ų141.350%0.49777%0.773SS.*  trans55.3102.2147.2-67.6-39.6000123.4
187K41Very low38.2Very low178 Ų178141.1 Ų141.177%0.77477%0.774SS**  trans66.1105.7139.1-41.3-52172.4-175.70118.4
188V41Very low37.6Very low127 Ų127139.1 Ų139.177%0.7777%0.772SS**  98.3114.853.5165.80000113.1
189L45.6Very low37.2Very low165 Ų165137 Ų13786%0.86477%0.772SS**  trans-127.7138.6154.8-72.4173.5000107.7
190P50.5Low36.9Very low121 Ų121133.2 Ų133.279%0.78677%0.769SS**  trans-83.2139.3-17832.1-34000112.8
191P49.2Very low36.7Very low105 Ų105135.1 Ų135.168%0.68277%0.771SS**  trans-104.8136.4178.736.5-31.1000114.6
192T41.8Very low36.2Very low138 Ų138133.6 Ų133.685%0.84776%0.764SS**  trans62.9-178.2154.178.30000114.6
193P42.1Very low36.2Very low120 Ų120133.8 Ų133.878%0.77977%0.765SS**  cis-128.8169.913.443.8-26.8000118.4
194S39.3Very low36Very low112 Ų112128.8 Ų128.878%0.78376%0.761SS**  trans-80.6150166.953.40000113.2
195R30.8Very low35.9Very low260 Ų260127.2 Ų127.298%0.98176%0.762SS**  trans-151.6155154.3-118.5-179.8-179.8-158.4-1.2110.5
196G28.8Very low35.7Very low58 Ų58121.4 Ų121.460%0.59876%0.755SS**  trans-141.6-173178.100000112.1
197S31.1Very low35.6Very low126 Ų126121.7 Ų121.788%0.88177%0.765SS**  trans65.6143.8-172.874.60000113.7
198S28.1Very low35.1Very low101 Ų101120.4 Ų120.471%0.70677%0.766SS**  cis-161-179.520.1560000113.5
199S30.9Very low34.9Very low95 Ų95121.3 Ų121.366%0.66477%0.772SS**  trans62.3101.5144.865.70000123.1
200S29.5Very low34.3Very low106 Ų106122.7 Ų122.774%0.74177%0.765SS**  54152.4119.362.10000124.8
201S29.7Very low33.5Very low111 Ų111122.8 Ų122.878%0.77677%0.769SS**  trans67.1150.3158.137.50000118.5
202S30.5Very low32.7Very low106 Ų106122 Ų12274%0.74176%0.759SS**  cis-164.3154-13.645.50000112.4
203S30Very low32.3Very low109 Ų109124 Ų12476%0.76276%0.759SS**  trans-5.3123.7162.856.80000122.8
204S31.6Very low31.8Very low107 Ų107123.5 Ų123.575%0.74876%0.758SS**  trans-173.3138.5130.241.90000108.7
205S29.1Very low31.8Very low110 Ų110123.5 Ų123.577%0.76976%0.758SS**  cis74.1118.448.3-56.10000111.5
206S32.4Very low31.9Very low102 Ų102116.9 Ų116.971%0.71375%0.751SS**  cis-157.9172.614.5-64.50000112.9
207S33.9Very low32.8Very low99 Ų99123.3 Ų123.369%0.69276%0.763SS**  trans37.5137.9142.259.20000121.1
208N31.7Very low33.6Very low150 Ų150123.1 Ų123.180%0.80276%0.759SS**  cis-155.1160.44.6-90.6-26.5000106.1
209V37.3Very low34.6Very low146 Ų146124.2 Ų124.289%0.88576%0.763SS**  -149.9154.468.7165.90000110.3
210R32.5Very low35.2Very low194 Ų194126 Ų12673%0.73278%0.776SS**  trans-111.4134.9-167.5-179.8-177.8179.7-169.61.2112.1N212R210-N212 PolarHBondContact NE-OD1 3.15Å; R210-N212 PolarHBondContact NH2-OD1 3.4Å; R210-N212 VanDerWaalsContact NH2-OD1 3.11Å
211S33.3Very low35.4Very low124 Ų124124.4 Ų124.487%0.86778%0.776SS**  trans-133.9125.5158-73.10000109
212N32.7Very low36.1Very low88 Ų88123 Ų12347%0.47178%0.779SS.*  trans-83.7157.6-176.4-64.7-38.9000110.1R210R210-N212 PolarHBondContact NE-OD1 3.15Å; R210-N212 PolarHBondContact NH2-OD1 3.4Å; R210-N212 VanDerWaalsContact NH2-OD1 3.11Å
213H32.8Very low36.5Very low181 Ų181123.3 Ų123.384%0.83878%0.781SS**  -160.9156.257.1-92.9-84.7000113.7
214S32.8Very low37.5Very low108 Ų108124.2 Ų124.276%0.75579%0.787SS**  trans-96.2147.6-178.9-50.20000113.3
215S38.3Very low38.6Very low113 Ų113127.1 Ų127.179%0.7979%0.791SS**  trans40.6125140.164.10000120.8
216S32.7Very low40.4Very low120 Ų120126.9 Ų126.984%0.83979%0.787SS**  trans-134.8137.6138.855.60000110.7
217K47.5Very low41.9Very low194 Ų194127.5 Ų127.584%0.84379%0.789SS**PPolyproline II helixtrans-95.1141.1162.7-65.6176178.5177.40107.2
218P47.4Very low43.4Very low122 Ų122128.4 Ų128.479%0.79279%0.792SS**PPolyproline II helixtrans-72.3140.9165.630.9-32.7000110.3
219P49.6Very low45.1Very low124 Ų124126.2 Ų126.281%0.80579%0.786SS**PPolyproline II helixtrans-81.8166172.834.4-35.1000112
220S42.9Very low46.4Very low132 Ų132124.4 Ų124.492%0.92378%0.777SS**PPolyproline II helixtrans-72.4132.1166.6-176.90000110.6
221G35Very low47.8Very low72 Ų72121.2 Ų121.274%0.74278%0.782SS**  trans-157.1121.5173.100000109.3
222G43.5Very low48.3Very low83 Ų83125.7 Ų125.786%0.85678%0.781SS**  trans-93.7128.4-16700000114.4
223S40Very low49Very low112 Ų112132.2 Ų132.278%0.78380%0.799SS**  trans-160.997.1155.241.60000110.3M225S223-M225 PolarHBondContact O-N 3.29Å; S223-M225 VanDerWaalsContact O-N 3.17Å
224S50.7Low49.6Very low127 Ų127129.9 Ų129.989%0.88880%0.8SS**  trans-78.598.3174.8-172.90000109.8
225M55.1Low49.9Very low169 Ų169130.5 Ų130.583%0.83380%0.804SS**PPolyproline II helixtrans-93.8129.4162.6-68.9-160.27500109.4S223S223-M225 PolarHBondContact O-N 3.29Å; S223-M225 VanDerWaalsContact O-N 3.17Å
226P65.2Low50Low105 Ų105128.3 Ų128.368%0.68280%0.8SS**PPolyproline II helixtrans-66.7150.5171.929.3-34000110.5
227P65.3Low50.4Low115 Ų115129.2 Ų129.275%0.74780%0.8SS**PPolyproline II helixtrans-62.3148.6174.228-34.9000111
228P64.8Low50Low117 Ų117124 Ų12476%0.7679%0.794SS**PPolyproline II helixtrans-63.4144.7-179.226.8-34.8000111.5
229P66.7Low49.6Very low104 Ų104126.4 Ų126.468%0.67580%0.8SS**PPolyproline II helixtrans-65.4148.6178.428-34.8000111.3
230P64.9Low48.8Very low108 Ų108123.9 Ų123.970%0.70180%0.796SS**PPolyproline II helixtrans-64.4150.5176.728.3-35.1000111.2Y232P230-Y232 PolarHBondContact O-N 3.2Å
231P62Low48.7Very low127 Ų127123.9 Ų123.983%0.82579%0.794SS**PPolyproline II helixtrans-62.9126.3-176.925.1-34.2000111.5R233P231-R233 PolarHBondContact O-N 3.43Å
232Y43.8Very low49.2Very low218 Ų218125.8 Ų125.886%0.85580%0.795SS**PPolyproline II helixtrans-56124.5177.3-74.8-93.5000111.3P230P230-Y232 PolarHBondContact O-N 3.2Å
233R48.8Very low49Very low226 Ų226130.4 Ų130.485%0.85380%0.795SS**PPolyproline II helixtrans-79.9137.9153.2-77.6-173.9173-168.4-3.7108.3P231 S235P231-R233 PolarHBondContact O-N 3.43Å; R233-S235 PolarHBondContact O-N 3.18Å
234P45.4Very low49.5Very low131 Ų131131.5 Ų131.585%0.85180%0.796SS**PPolyproline II helixtrans-68.3117.5178.427.2-33.4000110.4
235S38.4Very low49Very low121 Ų121132.7 Ų132.785%0.84679%0.793SS**PPolyproline II helixtrans-74.4134.5170.8-66.50000110.5R233 T237R233-S235 PolarHBondContact O-N 3.18Å; S235-T237 PolarHBondContact O-N 2.98Å
236G40.2Very low48.6Very low68 Ų68130 Ų13070%0.70179%0.79SS**PPolyproline II helixtrans-73.9120.717500000112.5
237T41.1Very low47.7Very low138 Ų138128.7 Ų128.785%0.84780%0.796SS**  trans43.7115.6143.756.60000120.6S235S235-T237 PolarHBondContact O-N 2.98Å
238A39.8Very low46.5Very low86 Ų86127.5 Ų127.571%0.71181%0.805SS**  trans82.7110.5134.100000121.5
239N38.4Very low45.8Very low171 Ų171126.1 Ų126.191%0.91480%0.803SS**  trans63.7104.7130.5-55.3-9000120.5
240G33.5Very low45.4Very low71 Ų71127 Ų12773%0.73281%0.809SS**  trans-171.8139.1159.400000110.2
241P40.8Very low44.9Very low133 Ų133128.9 Ų128.986%0.86481%0.809SS**  trans-76.3155.1-17130.6-35.6000113.5Q243P241-Q243 PolarHBondContact O-N 3.11Å
242S45.3Very low45Very low112 Ų112129.9 Ų129.978%0.78381%0.806SS**  trans-66.3125.2178.852.70000113
243Q38.2Very low45.8Very low180 Ų180125.2 Ų125.284%0.84180%0.802SS**  trans-123.4125.3153.6-97.7-68.4-2.400107.8P241P241-Q243 PolarHBondContact O-N 3.11Å
244V50.2Low46.5Very low134 Ų134121.6 Ų121.681%0.81280%0.795SS**  trans-109104.5-179-83.10000108.8
245D41Very low46.9Very low153 Ų153126.7 Ų126.782%0.81880%0.797SS**  trans-143.6162.4158.2-155.22.4000111.7
246S46.9Very low47.9Very low111 Ų111131 Ų13178%0.77680%0.801SS**SBendtrans-75.2153.9-156.4-47.40000114.2
247G45.9Very low48.7Very low78 Ų78134.5 Ų134.580%0.80480%0.804SS**  trans98.660.6161.200000116.1A249G247-A249 PolarHBondContact O-N 3.25Å; G247-A249 VanDerWaalsContact O-N 3.16Å
248G40.8Very low49.1Very low91 Ų91131.6 Ų131.694%0.93879%0.789SS**  trans-68.1107.8179.600000114.7
249A50.6Low49.9Very low87 Ų87135.4 Ų135.472%0.71980%0.796SS**  trans-119.9131157.700000109.1G247 E251G247-A249 PolarHBondContact O-N 3.25Å; G247-A249 VanDerWaalsContact O-N 3.16Å; A249-E251 PolarHBondContact O-N 2.86Å
250P56.7Low50.4Low124 Ų124137.4 Ų137.481%0.80579%0.791SS**PPolyproline II helixtrans-71.8122.1-177.828.2-33.5000111L252P250-L252 PolarHBondContact O-N 3.09Å
251E55.7Low51.1Low147 Ų147143.6 Ų143.669%0.68780%0.798SS**PPolyproline II helixtrans-65.4122178.7-166.8-175.5179.700110.9A249 Q254A249-E251 PolarHBondContact O-N 2.86Å; E251-Q254 WeakPolarHBondContact OE1-CG 3.23Å; E251-Q254 PolarHBondContact OE1-NE2 3.23Å
252L63.3Low51.2Low147 Ų147145 Ų14577%0.7779%0.791SS**PPolyproline II helixtrans-71.5135173.8-67.7174.6000110P250 Q254P250-L252 PolarHBondContact O-N 3.09Å; L252-Q254 PolarHBondContact O-N 3.07Å
253P62Low51.2Low120 Ų120148.8 Ų148.878%0.77980%0.796SS**  trans-52.8108.2-178.7-29.535.7000113R255P253-R255 PolarHBondContact O-N 3.11Å
254Q62.2Low51.1Low150 Ų150145.2 Ų145.270%0.70179%0.786SS**  trans-61.1104.1-175.5-67.7-166.423.200111.1E251 L252 K256E251-Q254 WeakPolarHBondContact OE1-CG 3.23Å; E251-Q254 PolarHBondContact OE1-NE2 3.23Å; L252-Q254 PolarHBondContact O-N 3.07Å; Q254-K256 PolarHBondContact O-N 2.87Å
255R53.8Low50.6Low238 Ų238144.9 Ų144.990%0.89879%0.79SS**  trans-69.8101.4176.4-61.6-17672.7178.23.7108.5P253 N257P253-R255 PolarHBondContact O-N 3.11Å; R255-N257 PolarHBondContact O-N 3.1Å
256K59.8Low50.4Low212 Ų212141.5 Ų141.592%0.92279%0.792SS**  trans-65.368-179.2-60-177.1-176.7179.60112.6Q254Q254-K256 PolarHBondContact O-N 2.87Å
257N57Low49.8Very low142 Ų142140.2 Ų140.276%0.75980%0.795SS**  trans-124.381.5174.3-173.125.3000109.7R255R255-N257 PolarHBondContact O-N 3.1Å
258S49.6Very low49.4Very low76 Ų76140.7 Ų140.753%0.53180%0.8SS.*  trans-131.7101.2178.8-161.70000108.5R260S258-R260 PolarHBondContact O-N 3.36Å; S258-R260 VanDerWaalsContact OG-CG 3.26Å; S258-R260 WeakPolarHBondContact OG-CG 3.35Å; S258-R260 PolarHBondContact OG-NE 3.15Å; S258-R260 VanDerWaalsContact OG-NE 3.13Å
259L56.9Low49Very low166 Ų166140.1 Ų140.187%0.86979%0.794SS**  trans-74.266.6177.3-131.198.5000109.8K261L259-K261 VanDerWaalsContact C-N 3.27Å; L259-K261 PolarHBondContact O-N 3.4Å
260R48Very low48.8Very low213 Ų213145.6 Ų145.680%0.80481%0.805SS**  trans-74.877.2-176.1-63.6-161178.7-155.22111.2S258 K262S258-R260 PolarHBondContact O-N 3.36Å; S258-R260 VanDerWaalsContact OG-CG 3.26Å; S258-R260 WeakPolarHBondContact OG-CG 3.35Å; S258-R260 PolarHBondContact OG-NE 3.15Å; S258-R260 VanDerWaalsContact OG-NE 3.13Å; R260-K262 PolarHBondContact O-N 3.02Å
261K48.7Very low48Very low202 Ų202142.9 Ų142.988%0.87880%0.8SS**  trans-73.962.2170.7-163.3179.4-176.9-179.50110.8L259L259-K261 VanDerWaalsContact C-N 3.27Å; L259-K261 PolarHBondContact O-N 3.4Å
262K42.4Very low47.7Very low163 Ų163146.1 Ų146.171%0.70981%0.806SS**  trans-94.5111.8170.1-162-169-175.8-166.40108.6R260 T264R260-K262 PolarHBondContact O-N 3.02Å; K262-T264 HydrophobicContact CD-CG2 3.77Å; K262-T264 VanDerWaalsContact CE-CG2 3.42Å; K262-T264 HydrophobicContact CG-CG2 4.15Å
263Q45.7Very low46.6Very low191 Ų191146.8 Ų146.889%0.89381%0.81SS**  trans-74.5122160.1-73.8178-4900107.9
264T35.2Very low45.8Very low104 Ų104149 Ų14964%0.63881%0.81SS**  trans-133.8118.4161.840.50000107.8K262K262-T264 HydrophobicContact CD-CG2 3.77Å; K262-T264 VanDerWaalsContact CE-CG2 3.42Å; K262-T264 HydrophobicContact CG-CG2 4.15Å
265S41.5Very low45.4Very low127 Ų127145.9 Ų145.989%0.88881%0.81SS**  trans-77.9137.6178.846.60000112.1
266G36.3Very low45.5Very low83 Ų83140.2 Ų140.286%0.85680%0.803SS**  trans90.8147160.700000116.6
267G34Very low45.7Very low83 Ų83135.7 Ų135.786%0.85680%0.796SS**  trans111.411016600000114.5
268G36.7Very low46Very low88 Ų88134.3 Ų134.391%0.90779%0.794SS**  trans-66.7167.2-172.300000117.3
269G34Very low46.3Very low79 Ų79136.5 Ų136.581%0.81481%0.807SS**  trans174.2128.6174.600000110
270Q44.7Very low45.9Very low202 Ų202137.5 Ų137.594%0.94481%0.809SS**  trans-83.9146.5-176.7-65.6-169.55.400112.3
271G40.3Very low46.2Very low67 Ų67133.8 Ų133.869%0.69181%0.81SS**  trans-170.260.3-179.500000113.1N273G271-N273 PolarHBondContact O-N 2.85Å; G271-N273 VanDerWaalsContact O-N 3.15Å
272R49.2Very low46.4Very low216 Ų216129 Ų12982%0.81580%0.8SS**  trans-64.1110.3178.2-78.6177.8170.9161.5-3.9111.2
273N41.6Very low46.9Very low161 Ų161127.4 Ų127.486%0.86181%0.806SS**  trans-138.284.3160.6-81.6-62.1000108.2G271 A275G271-N273 PolarHBondContact O-N 2.85Å; G271-N273 VanDerWaalsContact O-N 3.15Å; N273-A275 PolarHBondContact O-N 2.97Å
274H45.4Very low46.4Very low166 Ų166123.8 Ų123.877%0.76980%0.802SS**  trans-80.8109.7-178.6-72.6-90000110.6
275A53.3Low46.6Very low85 Ų85124 Ų12470%0.70281%0.808SS**PPolyproline II helixtrans-72.3148.1155.500000109.4N273N273-A275 PolarHBondContact O-N 2.97Å
276P55.5Low46.8Very low118 Ų118122.9 Ų122.977%0.76680%0.8SS**PPolyproline II helixtrans-66.2146.8177.428-34.8000111.4
277P64.4Low47.2Very low117 Ų117128.1 Ų128.176%0.7680%0.802SS**PPolyproline II helixtrans-67.2152.1172.330.1-34.8000111
278P61.9Low47.9Very low113 Ų113133.3 Ų133.373%0.73480%0.804SS**PPolyproline II helixtrans-66150.7173.329.6-35.1000111.1
279P56.5Low48.2Very low123 Ų123135.7 Ų135.780%0.79980%0.801SS**PPolyproline II helixtrans-64.9138-179.827-34.7000111.6
280M48.3Very low49.1Very low186 Ų186137.7 Ų137.792%0.91680%0.802SS**PPolyproline II helixtrans-77.8132.7175.1-62.6-179.872.200110.2
281V53.6Low49.3Very low136 Ų136139.2 Ų139.282%0.82480%0.799SS**PPolyproline II helixtrans-86.9129.1177.1-164.80000108.9
282P54.1Low50Low102 Ų102141 Ų14166%0.66280%0.799SS**PPolyproline II helixtrans-71.5144.5-18029-35000111.8
283P52.8Low50.9Low128 Ų128136 Ų13683%0.83180%0.795SS**PPolyproline II helixtrans-78.9124.7170.731.8-31.5000110.2
284S35.5Very low51.6Low116 Ų116134 Ų13481%0.81179%0.79SS**  trans-135.2120.4165.6-85.20000111.8
285S38Very low52.3Low109 Ų109132.1 Ų132.176%0.76279%0.792SS**  trans-54.113117547.10000114.4
286S46.8Very low52.4Low103 Ų103132.6 Ų132.672%0.7280%0.796SS**  trans29.7115.3138.560.30000119.6
287Q44Very low52.2Low193 Ų193138.7 Ų138.790%0.90280%0.804SS**  -129.3146.3129.9-70.2-161.629.800109.6
288Q49.7Very low51.7Low192 Ų192141.2 Ų141.290%0.89781%0.806SS**  trans-94.4125177.1-66.9-176.3-12.500109.9
289V42.4Very low51.3Low138 Ų138141.3 Ų141.384%0.83681%0.807SS**  trans-131.9120.4159.2-175.50000109.2
290S52.1Low50.6Low121 Ų121142 Ų14285%0.84681%0.811SS**  trans-49.8129.3-173.9-51.70000114.5
291R50.6Low50.6Low234 Ų234136.7 Ų136.788%0.88380%0.804SS**  trans-119.3120.5157.7-155.3174.9-159-92.42108
292P54.6Low50.4Low104 Ų104142.1 Ų142.168%0.67581%0.809SS**PPolyproline II helixtrans-67.5148.5-174.127.2-34.6000111.4
293P66.9Low49.5Very low112 Ų112146.7 Ų146.773%0.72782%0.819SS**PPolyproline II helixtrans-64.3150.5170.129.2-34.6000110.4
294P57.5Low48.7Very low118 Ų118146.9 Ų146.977%0.76682%0.818SS**PPolyproline II helixtrans-63.6143.2175.228.1-34.5000110.5A296P294-A296 PolarHBondContact O-N 3.3Å
295P60.8Low48.7Very low126 Ų126146 Ų14682%0.81882%0.818SS**PPolyproline II helixtrans-63.5131.8-176.125.1-34000111.6R297P295-R297 PolarHBondContact O-N 2.75Å
296A54.5Low48.8Very low95 Ų95147 Ų14779%0.78582%0.821SS**  trans-66114.1176.500000110.1P294 E298P294-A296 PolarHBondContact O-N 3.3Å; A296-E298 PolarHBondContact O-N 3.26Å; A296-E298 VanDerWaalsContact O-N 3.12Å
297R51.7Low48.6Very low247 Ų247150.8 Ų150.893%0.93283%0.828SS**  trans-84.884.8-179-167.1176.3-168.8164.44.3110.2P295P295-R297 PolarHBondContact O-N 2.75Å
298E52.8Low48Very low169 Ų169149.6 Ų149.679%0.7983%0.827SS**  trans-58.2143.3176.1-64.8-161.3142.300112.2A296A296-E298 PolarHBondContact O-N 3.26Å; A296-E298 VanDerWaalsContact O-N 3.12Å
299P53.7Low47.6Very low116 Ų116145.4 Ų145.475%0.75382%0.816SS**  trans-73.2129.3172.329.9-32.8000110.2G301P299-G301 PolarHBondContact O-N 3.2Å; P299-G301 VanDerWaalsContact O-N 3.11Å
300P43.3Very low47.8Very low137 Ų137145.1 Ų145.189%0.8982%0.817SS**SBendtrans-70.2110.1-177.728-34.1000110.8
301G47.3Very low47Very low74 Ų74144.5 Ų144.576%0.76381%0.813SS**  trans-179.416.3-177.700000118.8P299P299-G301 PolarHBondContact O-N 3.2Å; P299-G301 VanDerWaalsContact O-N 3.11Å
302R49.8Very low46.4Very low250 Ų250138.7 Ų138.794%0.94381%0.808SS**  trans-129.4113.4176.9-72.5-172.4171.9-166.8-3.5112.6
303K35Very low45.8Very low198 Ų198139 Ų13986%0.86181%0.813SS**  trans-132.4116.2163.7-72.4-168.5175.8-172.70109.7
304T35.9Very low44.5Very low132 Ų132145.2 Ų145.281%0.8182%0.822SS**  trans43.8109145.354.80000121.6
305A34.9Very low43.5Very low98 Ų98147.3 Ų147.381%0.8183%0.826SS**  trans67.7163.4131.400000119.9
306P40.4Very low42.4Very low129 Ų129145 Ų14584%0.83883%0.826SS**  cis-121.5-174.12.642-27.7000115.9
307Q42.1Very low41.8Very low184 Ų184143.9 Ų143.986%0.8682%0.824SS**  trans-78166.4174.1-84-166.1-17.100114
308L31.1Very low41.6Very low167 Ų167143.4 Ų143.487%0.87482%0.822SS**  trans-157.5178.7135.2-101.1179.4000109.2
309P42.6Very low41.3Very low104 Ų104142.8 Ų142.868%0.67582%0.824SS**  trans-95.9169.1-136.238.9-40000117.2
310P45.9Very low41.4Very low132 Ų132141.6 Ų141.686%0.85782%0.824SS**  trans-84.2127.6177.132.9-34000113.6
311S36.5Very low42Very low109 Ų109140.9 Ų140.976%0.76282%0.819SS**  trans-107.7105.3173.961.10000113
312S36.2Very low42.7Very low112 Ų112142.8 Ų142.878%0.78382%0.818SS**  trans40113.9147.661.40000120.5
313S43.4Very low43.1Very low110 Ų110136.4 Ų136.477%0.76981%0.809SS**  trans-28.7138.9148.9176.40000115.9
314R38Very low44Very low242 Ų242132.6 Ų132.691%0.91380%0.804SS**  trans-151.2130142.7-113.4171.6-172.3-169.90.7111.5
315N36.9Very low44.9Very low162 Ų162132.3 Ų132.387%0.86681%0.805SS**  trans-82.6155.8170.1-82.1-42.4000110.9
316G37.7Very low45.2Very low79 Ų79139.2 Ų139.281%0.81481%0.812SS**  trans101144.117900000112.6
317G42.2Very low45.3Very low71 Ų71144.2 Ų144.273%0.73281%0.814SS**  cis136.5128.8-3.700000112.1
318R48.1Very low45Very low236 Ų236138.7 Ų138.789%0.89181%0.807SS**  trans85.1158176.3-52.8-175.8175.9-179.8-1117.5
319D45.3Very low45.3Very low156 Ų156138.1 Ų138.183%0.83480%0.799SS**  trans71119.3159.4-50.7-36.6000120.5
320A56.6Low44.9Very low91 Ų91138.2 Ų138.275%0.75280%0.802SS**PPolyproline II helixtrans-99.4155.7170.800000109.7
321P56.2Low44.5Very low122 Ų122138.5 Ų138.579%0.79280%0.802SS**PPolyproline II helixtrans-69.1146.5-173.427.6-35.6000113.4
322P62.7Low44.4Very low115 Ų115136.7 Ų136.775%0.74780%0.8SS**PPolyproline II helixtrans-75.6157.6179.231.8-36.2000113.2
323P58.5Low44.3Very low115 Ų115137.8 Ų137.875%0.74780%0.802SS**PPolyproline II helixtrans-75.2157.9175.432.2-35.7000113
324P53.3Low43.8Very low118 Ų118137.3 Ų137.377%0.76680%0.799SS**PPolyproline II helixtrans-75.1155.3-177.931.1-36.2000113.6
325P54.8Low43.3Very low127 Ų127133.5 Ų133.583%0.82579%0.791SS**PPolyproline II helixtrans-80.7144.4-174.732.1-35.8000114.1
326Y41.8Very low43Very low243 Ų243132.2 Ų132.295%0.95378%0.78SS**PPolyproline II helixtrans-76.3150165.3-101.2-102.7000111.5
327R42.5Very low42.7Very low233 Ų233136.8 Ų136.888%0.87978%0.78SS**  trans-133.1124.1178.4-165.9-176.4-161.7-145.25108.5
328G35.6Very low42.2Very low69 Ų69136.9 Ų136.971%0.71178%0.781SS**  trans150.742.4-176.900000119.4
329H36.1Very low41.8Very low154 Ų154137.3 Ų137.371%0.71378%0.782SS**  trans-40155.1144.111.6-102.6000112
330S34.9Very low41.4Very low106 Ų106136.3 Ų136.374%0.74178%0.781SS**  cis-173.1177.410.3-96.60000107.7
331T36.2Very low40.8Very low139 Ų139141.1 Ų141.185%0.85379%0.786SS**  cis-168.2164.3-2.816.90000109.3
332G34.5Very low39.9Very low70 Ų70141.3 Ų141.372%0.72279%0.787SS**  trans117.9143.8163.400000115.6
333V34.4Very low38.8Very low135 Ų135143.9 Ų143.982%0.81879%0.793SS**  cis152.5134.8-31.7160.50000108.5
334S32.6Very low38.4Very low100 Ų100143.7 Ų143.770%0.69979%0.792SS**  trans66.5156.8171-73.50000118.8
335E29.2Very low38.1Very low162 Ų162143.7 Ų143.776%0.75779%0.792SS**  cis-161.3-177.8-28-163.9147-178.200111.6
336Q30.6Very low37.6Very low135 Ų135143.8 Ų143.863%0.63179%0.793SS**  trans-56.9175.7-161.5-58.7-174.214.800121.6
337H31.8Very low37.7Very low176 Ų176137.3 Ų137.382%0.81578%0.783SS**  trans80149.3163.6-41.6-61.2000117
338G30.9Very low37.7Very low73 Ų73132.1 Ų132.175%0.75378%0.779SS**  cis-172.9-169.5-1.600000113.1
339R39.8Very low38.1Very low245 Ų245133.8 Ų133.893%0.92578%0.78SS**  trans-57.6158.7165.5-85.2172160.7170.6-7.7109.7
340V35.7Very low38.9Very low134 Ų134131.3 Ų131.381%0.81278%0.778SS**  cis-156.1169.645-147.10000111.9
341K44.4Very low39Very low193 Ų193135.1 Ų135.184%0.83978%0.781SS**  trans-102.2142164.2-70-179.5177.2179.30111.6
342P38.8Very low39.2Very low125 Ų125135.3 Ų135.381%0.81278%0.776SS**  trans-96.2169.3152.6-7.127.2000112.7
343L38.1Very low39.1Very low169 Ų169136.8 Ų136.889%0.88578%0.775SS**  trans-122.8166.6177.2-82.1172.4000111.4
344P51.4Low39.1Very low111 Ų111135.8 Ų135.872%0.72178%0.775SS**  trans-103162.1-16039.2-36.4000116.3
345P46Very low39.3Very low119 Ų119137.1 Ų137.177%0.77378%0.784SS**  trans-103.9176.6161.638.4-28.6000112.1
346P45Very low39.6Very low129 Ų129134.2 Ų134.284%0.83878%0.782SS**  trans-117.4177-132.535.3-21.4000117.4
347S43.2Very low39.9Very low106 Ų106132.6 Ų132.674%0.74179%0.785SS**  trans-105.5142.7176.1-177.30000112
348P43.7Very low40.8Very low125 Ų125135.7 Ų135.781%0.81279%0.789SS**  trans-116.1116.3161.334.3-21.9000112.1
349S43.5Very low41.4Very low104 Ų104138.4 Ų138.473%0.72779%0.792SS**  trans-118.3139.517058.60000110.6
350P53Low41.7Very low101 Ų101132.9 Ų132.966%0.65679%0.787SS**  trans-120.5118.6167.116.15.4000114.1
351F36.2Very low42.6Very low187 Ų187131.2 Ų131.282%0.8279%0.788SS**  trans66.5143133.8-51.3-42000120.8
352L40.3Very low43.2Very low143 Ų143124.8 Ų124.875%0.74978%0.776SS**  cis-155.9140.6-4.8-114.1167.1000112.6
353S33.8Very low44.7Very low100 Ų100124.7 Ų124.770%0.69978%0.776SS**  trans28.2128.7151.4-60.70000123.9
354S32.5Very low46.2Very low115 Ų115122.2 Ų122.280%0.80477%0.77SS**  -179.5133.1101.3-780000115.3
355S38.3Very low47.2Very low127 Ų127122.5 Ų122.589%0.88877%0.772SS**  trans62.7143.3154.1-153.60000119.5
356S35.8Very low48.4Very low102 Ų102122.2 Ų122.271%0.71377%0.77SS**  cis-165.7173.2-25.6-174.20000109.7
357S36.5Very low49.7Very low101 Ų101121 Ų12171%0.70676%0.762SS**  trans65.481.1160.2-650000121.5
358R49.2Very low51.2Low240 Ų240121.1 Ų121.191%0.90676%0.76SS**  40.196.1127.3-62.7-179.4172.3-146.4-1.9119.6
359T43.8Very low52.4Low130 Ų130120.8 Ų120.880%0.79876%0.758SS**  -172.3143.6123.714.30000109.8A361T359-A361 PolarHBondContact O-N 2.98Å; T359-A361 VanDerWaalsContact O-N 3.11Å
360P46.3Very low52.9Low129 Ų129125.2 Ų125.284%0.83877%0.765SS**  trans-73.6100.7165.830.2-30.2000108.1G362P360-G362 PolarHBondContact O-N 2.97Å
361A54Low52.8Low99 Ų99128.9 Ų128.982%0.81877%0.765SS**PPolyproline II helixtrans-59.1120.9176.300000109.6T359T359-A361 PolarHBondContact O-N 2.98Å; T359-A361 VanDerWaalsContact O-N 3.11Å
362G58Low53.5Low58 Ų58127.2 Ų127.260%0.59877%0.765SS**PPolyproline II helixtrans-63.3165.7172.700000111.5P360P360-G362 PolarHBondContact O-N 2.97Å
363P69.6Low54.1Low124 Ų124124.1 Ų124.181%0.80577%0.768SS**PPolyproline II helixtrans-54.8145.2172.925.8-34.6000110.2
364P70.2Confident54.8Low117 Ų117124.8 Ų124.876%0.7676%0.76SS**PPolyproline II helixtrans-57.6145.7-177.524.7-34.4000110.7
365P71.9Confident55.2Low117 Ų117123.4 Ų123.476%0.7675%0.75SS**PPolyproline II helixtrans-58.5143.3-18025.4-34.3000110.3
366P71.9Confident56Low113 Ų113124.4 Ų124.473%0.73475%0.751SS**PPolyproline II helixtrans-59.9147.2178.526.4-34.7000110.4
367P72.9Confident56.6Low102 Ų102121.4 Ų121.466%0.66274%0.736SS**PPolyproline II helixtrans-58.1143.7178.225.3-34.4000110.4
368P73.6Confident57.3Low109 Ų109122.5 Ų122.571%0.70874%0.741SS**PPolyproline II helixtrans-59.3141.4-179.425.3-34.3000110.3F370P368-F370 PolarHBondContact O-N 3.28Å
369P68.5Low57.5Low119 Ų119115.5 Ų115.577%0.77373%0.729SS**PPolyproline II helixtrans-60.3131.7-17724.9-34.2000110.3R371P369-R371 PolarHBondContact O-N 3.25Å
370F53.8Low57.8Low197 Ų197113 Ų11386%0.86472%0.717SS**  trans-59.993.4-178.5-65-77.4000111.3P368 N372P368-F370 PolarHBondContact O-N 3.28Å; F370-N372 PolarHBondContact O-N 2.93Å; F370-N372 VanDerWaalsContact O-N 3.07Å
371R51.3Low58.2Low177 Ų177114.5 Ų114.567%0.66871%0.71SS**  trans-75.297.2178.6-173.7173.4-173.9-96.9-4.7109P369 G373 H374P369-R371 PolarHBondContact O-N 3.25Å; R371-G373 PolarHBondContact O-N 3.48Å; R371-H374 PolarHBondContact NH1-CD2 2.91Å; R371-H374 PolarHBondContact NH1-CE1 3.1Å; R371-H374 VanDerWaalsContact NH1-CE1 3.34Å; R371-H374 PolarHBondContact NH1-ND1 3.41Å; R371-H374 PolarHBondContact NH1-NE2 2.59Å; R371-H374 VanDerWaalsContact NH1-NE2 3.16Å; R371-H374 PolarHBondContact O-N 3.29Å
372N52Low58.3Low152 Ų152112.5 Ų112.581%0.81369%0.69SS**THydrogen-bonded Turntrans-39.5126.5178.8-96.233.9000112.5F370 H374F370-N372 PolarHBondContact O-N 2.93Å; F370-N372 VanDerWaalsContact O-N 3.07Å; N372-H374 PolarHBondContact O-ND1 2.79Å
373G52.1Low58.3Low79 Ų79116.3 Ų116.381%0.81470%0.695SS**THydrogen-bonded Turntrans78.418.5166.600000117.5R371R371-G373 PolarHBondContact O-N 3.48Å
374H47.9Very low57.7Low113 Ų113116.6 Ų116.652%0.52369%0.687SS.*  trans-132.663-179.2-64.182.7000113.5R371 N372 T376R371-H374 PolarHBondContact NH1-CD2 2.91Å; R371-H374 PolarHBondContact NH1-CE1 3.1Å; R371-H374 VanDerWaalsContact NH1-CE1 3.34Å; R371-H374 PolarHBondContact NH1-ND1 3.41Å; R371-H374 PolarHBondContact NH1-NE2 2.59Å; R371-H374 VanDerWaalsContact NH1-NE2 3.16Å; R371-H374 PolarHBondContact O-N 3.29Å; N372-H374 PolarHBondContact O-ND1 2.79Å; H374-T376 PolarHBondContact O-N 2.8Å
375S42Very low57.5Low86 Ų86115.5 Ų115.560%0.60168%0.675SS**  trans-75.884172-61.10000111.3G377S375-G377 PolarHBondContact O-N 3.24Å
376T53.9Low57.7Low149 Ų149114.2 Ų114.291%0.91466%0.662SS**  trans-75.968.8162.751.70000109.5H374H374-T376 PolarHBondContact O-N 2.8Å
377G48.3Very low57.9Low39 Ų39114.9 Ų114.940%0.40265%0.653SS.*SBendtrans-165.7154.9-178.900000110.2S375 S379S375-G377 PolarHBondContact O-N 3.24Å; G377-S379 PolarHBondContact O-N 3.34Å
378P52.4Low57.9Low124 Ų124114.5 Ų114.581%0.80564%0.643SS**G310 helixtrans-66.1-13.4-158.923.1-34000116.1S380 K381P378-S380 PolarHBondContact O-N 3.46Å; P378-K381 PolarHBondContact O-N 3.3Å
379S52.6Low57.9Low93 Ų93113.5 Ų113.565%0.6564%0.639SS**G310 helixtrans-63.6-19.3-177.1-172.60000115G377 K381 S382G377-S379 PolarHBondContact O-N 3.34Å; S379-K381 PolarHBondContact O-N 2.77Å; S379-K381 VanDerWaalsContact O-N 3.15Å; S379-S382 PolarHBondContact O-N 3.44Å
380S50.8Low58.4Low78 Ų78114.4 Ų114.455%0.54563%0.63SS.*G310 helixtrans-71.1-3180-72.90000114.8P378P378-S380 PolarHBondContact O-N 3.46Å
381K54.3Low59.6Low160 Ų160110 Ų11070%0.69661%0.611SS**G310 helixtrans-82.4-32.9172.3-66-171.5176.3-1710113.7P378 S379 I383 M384 D385P378-K381 PolarHBondContact O-N 3.3Å; S379-K381 PolarHBondContact O-N 2.77Å; S379-K381 VanDerWaalsContact O-N 3.15Å; K381-I383 VanDerWaalsContact C-N 3.26Å; K381-I383 PolarHBondContact O-N 3.12Å; K381-I383 VanDerWaalsContact O-N 3.11Å; K381-M384 WeakPolarHBondContact O-CB 3.3Å; K381-M384 PolarHBondContact O-N 3.04Å; K381-D385 PolarHBondContact O-N 2.64Å; K381-D385 VanDerWaalsContact O-N 3.1Å
382S56.8Low61.1Low56 Ų56108.9 Ų108.939%0.39262%0.618SS.*Hα-helixtrans-62.6-30.1-16483.90000113.8S379 M384 D385 D386S379-S382 PolarHBondContact O-N 3.44Å; S382-M384 PolarHBondContact O-N 2.88Å; S382-D385 CarbonylContact O-C 3.54Å; S382-D385 PolarHBondContact O-N 2.95Å; S382-D386 WeakPolarHBondContact O-CB 3.35Å; S382-D386 PolarHBondContact O-N 3.48Å
383I56.7Low62.5Low139 Ų139108.2 Ų108.271%0.71361%0.608SS**Hα-helixtrans-71.8-15.3179.3-157.563.8000113.7K381K381-I383 VanDerWaalsContact C-N 3.26Å; K381-I383 PolarHBondContact O-N 3.12Å; K381-I383 VanDerWaalsContact O-N 3.11Å
384M58.5Low64.1Low129 Ų129110.2 Ų110.264%0.63560%0.596SS**Hα-helixtrans-88.8-47.4168.9-155.69615300109.3K381 S382 D386 F387 E388K381-M384 WeakPolarHBondContact O-CB 3.3Å; K381-M384 PolarHBondContact O-N 3.04Å; S382-M384 PolarHBondContact O-N 2.88Å; M384-D386 PolarHBondContact O-N 3.08Å; M384-F387 PolarHBondContact O-N 3Å; M384-E388 VanDerWaalsContact CG-OE1 3.23Å; M384-E388 WeakPolarHBondContact CG-OE1 3.24Å; M384-E388 PolarHBondContact O-N 3.41Å
385D65.4Low65.9Low95 Ų95108.5 Ų108.551%0.50860%0.595SS.*Hα-helixtrans-56.9-33.4177.5-134.526000112.3K381 S382 F387 E388 S389K381-D385 PolarHBondContact O-N 2.64Å; K381-D385 VanDerWaalsContact O-N 3.1Å; S382-D385 CarbonylContact O-C 3.54Å; S382-D385 PolarHBondContact O-N 2.95Å; D385-F387 PolarHBondContact O-N 3.14Å; D385-E388 PolarHBondContact O-N 2.72Å; D385-S389 WeakPolarHBondContact O-CB 3.12Å; D385-S389 PolarHBondContact O-N 2.75Å; D385-S389 PolarHBondContact O-OG 2.89Å
386D76.6Confident67.7Low90 Ų90110.6 Ų110.648%0.48160%0.598SS.*Hα-helixtrans-65.4-22.8175.9-75.6-21.4000112.9S382 M384 K390S382-D386 WeakPolarHBondContact O-CB 3.35Å; S382-D386 PolarHBondContact O-N 3.48Å; M384-D386 PolarHBondContact O-N 3.08Å; D386-K390 VanDerWaalsContact O-CD 3.24Å; D386-K390 WeakPolarHBondContact O-CD 3.46Å; D386-K390 WeakPolarHBondContact O-CG 3.25Å
387F76.3Confident69.2Low126 Ų126111 Ų11155%0.55359%0.59SS**Hα-helixtrans-89.4-43172.5-175.9-92.8000111.4M384 D385 K390 F391M384-F387 PolarHBondContact O-N 3Å; D385-F387 PolarHBondContact O-N 3.14Å; F387-K390 PolarHBondContact O-N 2.82Å; F387-F391 HydrophobicContact CE2-CE2 4.32Å; F387-F391 HydrophobicContact CZ-CE2 4.14Å
388E73Confident71.2Confident95 Ų95113.8 Ų113.844%0.44460%0.596SS.*Hα-helixtrans-69-44.5-177.6-68.1171.8-146.500111.1M384 D385 K390 F391M384-E388 VanDerWaalsContact CG-OE1 3.23Å; M384-E388 WeakPolarHBondContact CG-OE1 3.24Å; M384-E388 PolarHBondContact O-N 3.41Å; D385-E388 PolarHBondContact O-N 2.72Å; E388-K390 PolarHBondContact O-N 3.35Å; E388-K390 VanDerWaalsContact O-N 3.14Å; E388-F391 CarbonylContact O-C 3.53Å; E388-F391 PolarHBondContact O-N 3.28Å; E388-F391 VanDerWaalsContact O-N 3.08Å
389S73.1Confident72.9Confident88 Ų88112.8 Ų112.862%0.61558%0.583SS**THydrogen-bonded Turntrans-62.8-19.2176.461.30000115.2D385 F391D385-S389 WeakPolarHBondContact O-CB 3.12Å; D385-S389 PolarHBondContact O-N 2.75Å; D385-S389 PolarHBondContact O-OG 2.89Å; S389-F391 VanDerWaalsContact C-N 3.27Å; S389-F391 PolarHBondContact O-N 3.33Å
390K79.1Confident74.6Confident137 Ų137113.4 Ų113.460%0.59659%0.585SS**THydrogen-bonded Turntrans-77.9-9.9175.3-75.3173.553.5-78.30113.9D386 F387 E388D386-K390 VanDerWaalsContact O-CD 3.24Å; D386-K390 WeakPolarHBondContact O-CD 3.46Å; D386-K390 WeakPolarHBondContact O-CG 3.25Å; F387-K390 PolarHBondContact O-N 2.82Å; E388-K390 PolarHBondContact O-N 3.35Å; E388-K390 VanDerWaalsContact O-N 3.14Å
391F77.9Confident76.4Confident104 Ų104115.4 Ų115.446%0.45660%0.596SS.*SBendtrans-135.6113.6179.9-67.1-76.3000108F387 E388 S389 F393F387-F391 HydrophobicContact CE2-CE2 4.32Å; F387-F391 HydrophobicContact CZ-CE2 4.14Å; E388-F391 CarbonylContact O-C 3.53Å; E388-F391 PolarHBondContact O-N 3.28Å; E388-F391 VanDerWaalsContact O-N 3.08Å; S389-F391 VanDerWaalsContact C-N 3.27Å; S389-F391 PolarHBondContact O-N 3.33Å; F391-F393 HydrophobicContact CB-CD2 3.9Å; F391-F393 HydrophobicContact CB-CE2 3.49Å; F391-F393 VanDerWaalsContact CB-CE2 3.49Å; F391-F393 HydrophobicContact CB-CZ 3.92Å; F391-F393 HydrophobicContact CD2-CE2 4.44Å; F391-F393 HydrophobicContact CG-CE2 4.29Å; F391-F393 HydrophobicContact CG-CZ 4.43Å; F391-F393 VanDerWaalsContact O-CD2 3.25Å; F391-F393 WeakPolarHBondContact O-CD2 3.48Å; F391-F393 PolarHBondContact O-N 2.69Å
392N82.8Confident77.9Confident154 Ų154113.7 Ų113.782%0.82460%0.601SS**  trans-71.477.3178.8-168.2105.1000110.3
393F82.6Confident79.4Confident138 Ų138120.2 Ų120.261%0.60563%0.625SS**PPolyproline II helixtrans-65.7134.8173.9-71.1-73.9000109.8F391F391-F393 HydrophobicContact CB-CD2 3.9Å; F391-F393 HydrophobicContact CB-CE2 3.49Å; F391-F393 VanDerWaalsContact CB-CE2 3.49Å; F391-F393 HydrophobicContact CB-CZ 3.92Å; F391-F393 HydrophobicContact CD2-CE2 4.44Å; F391-F393 HydrophobicContact CG-CE2 4.29Å; F391-F393 HydrophobicContact CG-CZ 4.43Å; F391-F393 VanDerWaalsContact O-CD2 3.25Å; F391-F393 WeakPolarHBondContact O-CD2 3.48Å; F391-F393 PolarHBondContact O-N 2.69Å
394H85.8Confident80.9Confident122 Ų122120.2 Ų120.257%0.56562%0.622SS**PPolyproline II helixtrans-66.5136.8164.8-68.9-101.4000108.4D398H394-D398 HydrophobicContact CB-CB 4.39Å; H394-D398 IonicContact CE1-OD2 3.76Å; H394-D398 IonicContact CG-OD2 3.57Å; H394-D398 IonicContact ND1-OD2 2.71Å; H394-D398 PolarHBondContact ND1-OD2 3.3Å
395P85.4Confident82.3Confident77 Ų77121.7 Ų121.750%0.563%0.626SS.*PPolyproline II helixtrans-64.4157.417730.2-35.5000110E397 D398P395-E397 WeakPolarHBondContact CB-OE2 3.1Å; P395-E397 PolarHBondContact O-N 3.09Å; P395-E397 VanDerWaalsContact O-N 3.12Å; P395-D398 HydrophobicContact CG-CB 3.84Å; P395-D398 PolarHBondContact O-N 3Å
396I79.7Confident83.2Confident129 Ų129125.8 Ų125.866%0.66263%0.634SS**G310 helixtrans-64.2-22.4-174.5-169.8165.8000112.3D398 L399I396-D398 VanDerWaalsContact C-N 3.34Å; I396-L399 HydrophobicContact CG1-CD1 4.28Å; I396-L399 PolarHBondContact O-N 3.27Å
397E85.3Confident83.6Confident158 Ų158126.8 Ų126.874%0.73865%0.645SS**G310 helixtrans-73.1-18.5174.2-60.876.6-170.400114.1P395P395-E397 WeakPolarHBondContact CB-OE2 3.1Å; P395-E397 PolarHBondContact O-N 3.09Å; P395-E397 VanDerWaalsContact O-N 3.12Å
398D90.4Very high83.7Confident98 Ų98124.6 Ų124.652%0.52465%0.646SS.*G310 helixtrans-96.7-1.6176.2-16944.4000111.9H394 P395 I396H394-D398 HydrophobicContact CB-CB 4.39Å; H394-D398 IonicContact CE1-OD2 3.76Å; H394-D398 IonicContact CG-OD2 3.57Å; H394-D398 IonicContact ND1-OD2 2.71Å; H394-D398 PolarHBondContact ND1-OD2 3.3Å; P395-D398 HydrophobicContact CG-CB 3.84Å; P395-D398 PolarHBondContact O-N 3Å; I396-D398 VanDerWaalsContact C-N 3.34Å
399L87.4Confident84.1Confident102 Ų102127.8 Ų127.853%0.53467%0.666SS.*SBendtrans-78.2138167.7-57.8-176.5000109.6I396I396-L399 HydrophobicContact CG1-CD1 4.28Å; I396-L399 PolarHBondContact O-N 3.27Å
400P88.9Confident84.5Confident107 Ų107131.4 Ų131.470%0.69567%0.666SS**PPolyproline II helixtrans-60.8144.8174.926.5-34.3000110.3
401P88.2Confident84.5Confident119 Ų119130.3 Ų130.377%0.77367%0.671SS**PPolyproline II helixtrans-50.3133.9174.8-28.335.4000111.2E403P401-E403 PolarHBondContact O-N 3.28Å
402P86.5Confident84.4Confident125 Ų125131 Ų13181%0.81267%0.671SS**PPolyproline II helixtrans-54.2132.7-178.6-27.534.8000111.8E404P402-E404 PolarHBondContact O-N 2.81Å
403E86.9Confident83.8Confident192 Ų192129.5 Ų129.590%0.89767%0.67SS**PPolyproline II helixtrans-53.6129.5177.2-67.6-174.6174.500110.5P401 F405P401-E403 PolarHBondContact O-N 3.28Å; E403-F405 PolarHBondContact O-N 2.97Å
404E88.7Confident83Confident140 Ų140127.9 Ų127.965%0.65468%0.676SS**PPolyproline II helixtrans-53134.4174-65.1-176.7153.200110P402 R406P402-E404 PolarHBondContact O-N 2.81Å; E404-R406 PolarHBondContact O-N 2.88Å; E404-R406 IonicContact OE2-CZ 3.56Å; E404-R406 IonicContact OE2-NE 3.64Å; E404-R406 IonicContact OE2-NH2 2.69Å; E404-R406 PolarHBondContact OE2-NH2 2.85Å
405F87.6Confident81.9Confident160 Ų160130 Ų13070%0.70268%0.683SS**  trans-63.995.1178.6176.1-104000111.1E403 P407E403-F405 PolarHBondContact O-N 2.97Å; F405-P407 HydrophobicContact CD1-CG 4.34Å; F405-P407 HydrophobicContact CE1-CB 4.25Å; F405-P407 HydrophobicContact CE1-CG 3.95Å; F405-P407 WeakPolarHBondContact O-CD 3.36Å
406R85.9Confident80.9Confident180 Ų180129.8 Ų129.868%0.67968%0.684SS**  trans-81118.3170.5-66.9-72.5159.2164.7-7108.6E404 S408E404-R406 PolarHBondContact O-N 2.88Å; E404-R406 IonicContact OE2-CZ 3.56Å; E404-R406 IonicContact OE2-NE 3.64Å; E404-R406 IonicContact OE2-NH2 2.69Å; E404-R406 PolarHBondContact OE2-NH2 2.85Å; R406-S408 PolarHBondContact O-N 2.71Å
407P84.4Confident79.8Confident111 Ų111130.1 Ų130.172%0.72169%0.687SS**  trans-66.791.6178.4-20.634000111.2F405F405-P407 HydrophobicContact CD1-CG 4.34Å; F405-P407 HydrophobicContact CE1-CB 4.25Å; F405-P407 HydrophobicContact CE1-CG 3.95Å; F405-P407 WeakPolarHBondContact O-CD 3.36Å
408S79Confident78.5Confident81 Ų81134.1 Ų134.157%0.56670%0.695SS**  trans-82.4137.2175.349.10000110.9R406 R410R406-S408 PolarHBondContact O-N 2.71Å; S408-R410 PolarHBondContact O-N 3.17Å
409N80.9Confident77Confident161 Ų161132 Ų13286%0.86170%0.697SS**  trans-67.394.7171.4-85.7-38.1000109.4T411N409-T411 VanDerWaalsContact C-N 3.27Å; N409-T411 PolarHBondContact O-N 3.04Å
410R81.1Confident75.6Confident164 Ų164133.4 Ų133.462%0.61971%0.709SS**  trans-70.682.6176.6-66.8-176.5179.7173-1.6110.4S408 Y412S408-R410 PolarHBondContact O-N 3.17Å; R410-Y412 HydrophobicContact CB-CD2 4.14Å; R410-Y412 HydrophobicContact CB-CE2 3.62Å; R410-Y412 WeakPolarHBondContact CD-OH 3.47Å; R410-Y412 WeakPolarHBondContact O-CD2 3.5Å; R410-Y412 PolarHBondContact O-N 3.12Å
411T78.2Confident74.2Confident115 Ų115136.8 Ų136.871%0.70672%0.718SS**  trans-69.482.8167.9-55.80000109.1N409N409-T411 VanDerWaalsContact C-N 3.27Å; N409-T411 PolarHBondContact O-N 3.04Å
412Y76.4Confident72.7Confident118 Ų118142.9 Ų142.946%0.46373%0.725SS.*  trans-59.1137.9170.9-68.4-84.9000109.6R410 S414 K415R410-Y412 HydrophobicContact CB-CD2 4.14Å; R410-Y412 HydrophobicContact CB-CE2 3.62Å; R410-Y412 WeakPolarHBondContact CD-OH 3.47Å; R410-Y412 WeakPolarHBondContact O-CD2 3.5Å; R410-Y412 PolarHBondContact O-N 3.12Å; Y412-S414 PolarHBondContact O-N 3.49Å; Y412-K415 WeakPolarHBondContact O-CA 3.48Å; Y412-K415 PolarHBondContact O-N 3.12Å
413P70.4Confident71.7Confident122 Ų122139.7 Ų139.779%0.79272%0.716SS**THydrogen-bonded Turntrans-59.7-12.4176.2-27.335.9000115.2S416P413-S416 PolarHBondContact O-OG 3.5Å; P413-S416 VanDerWaalsContact O-OG 3.12Å
414S66.5Low70.7Confident105 Ų105135.1 Ų135.173%0.73471%0.71SS**THydrogen-bonded Turntrans-87-4.8171.6550000114.4Y412Y412-S414 PolarHBondContact O-N 3.49Å
415K62.3Low69.6Low165 Ų165134 Ų13472%0.71772%0.715SS**  trans-117.36.2179.6-76.1-162.7172.2-1680113.8Y412 D417Y412-K415 WeakPolarHBondContact O-CA 3.48Å; Y412-K415 PolarHBondContact O-N 3.12Å; K415-D417 PolarHBondContact O-N 3.11Å
416S63.5Low68.9Low74 Ų74132.4 Ų132.452%0.51772%0.721SS.*SBendtrans-59.6124.4157.440.80000107.9P413 R418P413-S416 PolarHBondContact O-OG 3.5Å; P413-S416 VanDerWaalsContact O-OG 3.12Å; S416-R418 PolarHBondContact O-N 3.35Å
417D57.2Low68.1Low135 Ų135128.1 Ų128.172%0.72272%0.724SS**  trans-62.4138.9179.3-178.331.3000110K415 G419K415-D417 PolarHBondContact O-N 3.11Å; D417-G419 PolarHBondContact O-N 2.93Å; D417-G419 VanDerWaalsContact O-N 3.12Å
418R58.2Low67.5Low243 Ų243128.1 Ų128.192%0.91772%0.724SS**THydrogen-bonded Turntrans-81.517.9-178-59.4-175-172.91722112.2S416S416-R418 PolarHBondContact O-N 3.35Å
419G58.9Low67.3Low54 Ų54130.4 Ų130.456%0.55774%0.737SS**THydrogen-bonded Turntrans-85.3-10.2-179.100000115.6D417 M421D417-G419 PolarHBondContact O-N 2.93Å; D417-G419 VanDerWaalsContact O-N 3.12Å; G419-M421 PolarHBondContact O-N 3.48Å
420V57Low66.7Low130 Ų130129.3 Ų129.379%0.78874%0.736SS**SBendtrans-80.7113.4174.3-171.60000109.7R422V420-R422 PolarHBondContact O-N 2.95Å
421M60.6Low66.1Low179 Ų179124.9 Ų124.988%0.88274%0.742SS**  trans-52.5102.6175.6-70.3-70.7-173.900111.2G419 G423G419-M421 PolarHBondContact O-N 3.48Å; M421-G423 VanDerWaalsContact C-N 3.3Å; M421-G423 PolarHBondContact O-N 3.3Å
422R57.2Low65.3Low246 Ų246134.9 Ų134.993%0.92877%0.766SS**  trans-7391.8166.2-167.1179.9-168.3-162.43.1107.3V420V420-R422 PolarHBondContact O-N 2.95Å
423G65Low64.7Low59 Ų59135.7 Ų135.761%0.60878%0.781SS**PPolyproline II helixtrans-50.1153-179.100000112.6M421M421-G423 VanDerWaalsContact C-N 3.3Å; M421-G423 PolarHBondContact O-N 3.3Å
424A65.9Low64.4Low95 Ų95136.4 Ų136.479%0.78578%0.781SS**PPolyproline II helixtrans-52139.9-176.100000111.2
425P64.8Low64.3Low117 Ų117138.2 Ų138.276%0.7678%0.783SS**PPolyproline II helixtrans-58.9143.8179.326.1-34.4000110.2A427P425-A427 PolarHBondContact O-N 3.11Å
426P73.6Confident64.4Low127 Ų127136.6 Ų136.683%0.82579%0.787SS**PPolyproline II helixtrans-59.3140.2-179.525.5-34.3000110.5
427A69.6Low64.5Low90 Ų90140.5 Ų140.574%0.74480%0.804SS**PPolyproline II helixtrans-61144.817900000111P425P425-A427 PolarHBondContact O-N 3.11Å
428P71.3Confident65Low111 Ų111140.9 Ų140.972%0.72181%0.81SS**PPolyproline II helixtrans-62.814917627.8-34.9000110.8V430P428-V430 PolarHBondContact O-N 2.76Å
429P74Confident65.5Low129 Ų129133.6 Ų133.684%0.83880%0.802SS**PPolyproline II helixtrans-63.7125.9179.226.8-34.1000110.6
430V69.9Low66Low138 Ų138139.7 Ų139.784%0.83682%0.821SS**PPolyproline II helixtrans-74.8126.4172.3-175.30000108.2P428P428-V430 PolarHBondContact O-N 2.76Å
431G67.8Low66.7Low71 Ų71140.5 Ų140.573%0.73282%0.823SS**PPolyproline II helixtrans-63.2153.5176.800000112.7
432R60.9Low67.3Low324 Ų324137 Ų137100%1.22382%0.818SS**  trans-117.30166.2-74.1-174.2172.8-164.8-2108.7

Retrieved 432 of 432 residues in 532.9 ms (Link to these results)