A0A077ZKX3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKX3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 311 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
1M51.5Low47.7Very low244 Ų244156.4 Ų156.4100%1.20281%0.814SS**  0101.50-70.3-65123.200107.8
2S40.4Very low47.9Very low111 Ų111152.4 Ų152.478%0.77681%0.809SS**  trans-112.3132.2174.164.50000108.9
3V50Low48.3Very low125 Ų125150.1 Ų150.176%0.75881%0.805SS**  trans-167105.9156.1-98.50000106.7
4H49.2Very low47.8Very low158 Ų158145.1 Ų145.173%0.73181%0.806SS**  87.1103.7103.9-76.2-38.5000112.7
5R44.6Very low47.8Very low221 Ų221140.7 Ų140.783%0.83479%0.789SS**  65.310294-100.4-170.1161.1128.9-1.2112
6V51Low48Very low133 Ų133139.2 Ų139.281%0.80679%0.791SS**  trans-140.6111.4131.2-177.60000106.9L8V6-L8 HydrophobicContact CG1-CG 4.08Å
7R46.4Very low47.9Very low204 Ų204141.4 Ų141.477%0.7779%0.79SS**  trans-93.4112.1169.3-178178.9171.7127.6-5.2105.1E9R7-E9 HydrophobicContact CG-CG 4.3Å; R7-E9 IonicContact CZ-OE1 3.73Å; R7-E9 IonicContact NE-OE1 3.49Å; R7-E9 PolarHBondContact NE-OE1 2.92Å; R7-E9 IonicContact NH2-OE1 3.21Å; R7-E9 PolarHBondContact NH2-OE1 2.96Å
8L56.2Low47.9Very low155 Ų155139.6 Ų139.681%0.81279%0.785SS**  trans-103110.1167-79.8173.2000107.5V6V6-L8 HydrophobicContact CG1-CG 4.08Å
9E41.8Very low47.9Very low137 Ų137137.4 Ų137.464%0.6479%0.787SS**  trans-84.9114.1166.7-69170.6153.700106.9R7R7-E9 HydrophobicContact CG-CG 4.3Å; R7-E9 IonicContact CZ-OE1 3.73Å; R7-E9 IonicContact NE-OE1 3.49Å; R7-E9 PolarHBondContact NE-OE1 2.92Å; R7-E9 IonicContact NH2-OE1 3.21Å; R7-E9 PolarHBondContact NH2-OE1 2.96Å
10S45.1Very low47.5Very low119 Ų119137.7 Ų137.783%0.83279%0.786SS**  trans-129.895.8161.7-700000107.5
11S48.9Very low47.2Very low113 Ų113135.6 Ų135.679%0.7978%0.78SS**  trans-67.3156.8167.7-68.20000111.3
12S49.8Very low47Very low109 Ų109128.2 Ų128.276%0.76276%0.757SS**  trans73.1110.8151.7-162.20000116.2
13T52.6Low47.3Very low122 Ų122131.7 Ų131.775%0.74876%0.758SS**  -178.2130.890.5-57.50000107.3S15T13-S15 PolarHBondContact O-N 3.38Å
14G41.8Very low47.2Very low80 Ų80131.6 Ų131.683%0.82576%0.76SS**  trans-57.2125.6170.600000110.2
15S47.7Very low46.9Very low79 Ų79129.6 Ų129.655%0.55276%0.759SS**  trans-134.899.6167.4176.60000107.5T13 F17T13-S15 PolarHBondContact O-N 3.38Å; S15-F17 WeakPolarHBondContact O-CD2 3.43Å; S15-F17 PolarHBondContact O-N 3.3Å; S15-F17 WeakPolarHBondContact OG-CE2 3.41Å
16S50.7Low46.9Very low117 Ų117124.9 Ų124.982%0.81876%0.757SS**  trans-48.8109.1160.745.90000110.2
17F46.9Very low46.1Very low176 Ų176125.8 Ų125.877%0.77276%0.757SS**  trans-97.7132.6160.5-78-82.4000108.4S15S15-F17 WeakPolarHBondContact O-CD2 3.43Å; S15-F17 PolarHBondContact O-N 3.3Å; S15-F17 WeakPolarHBondContact OG-CE2 3.41Å
18P47.9Very low45.5Very low109 Ų109120.3 Ų120.371%0.70876%0.755SS**  trans-72.9155-17032.1-33.6000109.9D20P18-D20 VanDerWaalsContact C-N 3.32Å; P18-D20 PolarHBondContact O-N 3.17Å
19A47.3Very low44.2Very low98 Ų98118.9 Ų118.981%0.8175%0.752SS**  trans-54101.4159.400000107.8S21A19-S21 PolarHBondContact O-N 3.22Å
20D40Very low43.5Very low143 Ų143117.9 Ų117.977%0.76576%0.755SS**  trans-68.494.4168.4-170.512.7000106.1P18 A22P18-D20 VanDerWaalsContact C-N 3.32Å; P18-D20 PolarHBondContact O-N 3.17Å; D20-A22 PolarHBondContact O-N 3.2Å
21S42.4Very low42.9Very low95 Ų95117.5 Ų117.566%0.66475%0.752SS**  trans-52.490.6161.834.90000107.7A19 K23A19-S21 PolarHBondContact O-N 3.22Å; S21-K23 VanDerWaalsContact C-N 3.29Å; S21-K23 PolarHBondContact O-N 2.85Å
22A46.5Very low42Very low88 Ų88117.5 Ų117.573%0.72774%0.743SS**  trans-55.496.3171.700000107.7D20D20-A22 PolarHBondContact O-N 3.2Å
23K46.7Very low41.2Very low184 Ų184115.8 Ų115.880%0.873%0.725SS**PPolyproline II helixtrans-52125.9168.5-71.8166.7-178.2166.60106.2S21 V25S21-K23 VanDerWaalsContact C-N 3.29Å; S21-K23 PolarHBondContact O-N 2.85Å; K23-V25 PolarHBondContact O-N 2.89Å
24P48.2Very low40.3Very low123 Ų123115.2 Ų115.280%0.79972%0.716SS**PPolyproline II helixtrans-58121.1-178.922.4-30.8000108.2
25V42.5Very low40.2Very low116 Ų116121.2 Ų121.270%0.70371%0.714SS**PPolyproline II helixtrans-52.4127.9169.51760000106.6K23 L27K23-V25 PolarHBondContact O-N 2.89Å; V25-L27 VanDerWaalsContact C-N 3.32Å; V25-L27 PolarHBondContact O-N 3.07Å
26P43.9Very low39.5Very low122 Ų122126.2 Ų126.279%0.79273%0.726SS**  trans-63.899.1176.524.6-30.7000108A28P26-A28 PolarHBondContact O-N 3.46Å; P26-A28 VanDerWaalsContact O-N 3.08Å
27L34Very low38.6Very low153 Ų153125.8 Ų125.880%0.80171%0.714SS**  trans-60.8113171.7-66.9177000106.6V25 V29V25-L27 VanDerWaalsContact C-N 3.32Å; V25-L27 PolarHBondContact O-N 3.07Å; L27-V29 PolarHBondContact O-N 2.77Å
28A33.8Very low38Very low88 Ų88121 Ų12173%0.72770%0.699SS**  trans-57105.617000000107.6P26 V30P26-A28 PolarHBondContact O-N 3.46Å; P26-A28 VanDerWaalsContact O-N 3.08Å; A28-V30 PolarHBondContact O-N 3.24Å
29V29.2Very low37.5Very low126 Ų126118.7 Ų118.776%0.76469%0.686SS**  trans-66.392.2171.1177.10000106.3L27 S31L27-V29 PolarHBondContact O-N 2.77Å; V29-S31 VanDerWaalsContact C-N 3.27Å; V29-S31 PolarHBondContact O-N 2.79Å
30V26.6Very low37.2Very low116 Ų116117.6 Ų117.670%0.70367%0.669SS**  trans-74.890.3167.7-177.60000106.1A28 L32A28-V30 PolarHBondContact O-N 3.24Å; V30-L32 HydrophobicContact CG1-CB 4.37Å; V30-L32 PolarHBondContact O-N 3.31Å
31S32.8Very low37.4Very low110 Ų110114.5 Ų114.577%0.76966%0.656SS**  trans-66.682.6164-90.10000108.3V29 D33V29-S31 VanDerWaalsContact C-N 3.27Å; V29-S31 PolarHBondContact O-N 2.79Å; S31-D33 PolarHBondContact O-N 3.45Å
32L30.6Very low37.3Very low114 Ų114114.2 Ų114.260%0.59765%0.651SS**  trans-77.2113.5172.5-164.263.1000108.2V30 I34 L37V30-L32 HydrophobicContact CG1-CB 4.37Å; V30-L32 PolarHBondContact O-N 3.31Å; L32-I34 PolarHBondContact O-N 3.17Å; L32-L37 HydrophobicContact CD2-CD1 3.49Å; L32-L37 VanDerWaalsContact CD2-CD1 3.49Å; L32-L37 HydrophobicContact CG-CD1 3.98Å
33D32.2Very low36.8Very low72 Ų72114.7 Ų114.739%0.38564%0.641SS.*  trans-71.594179.9-161.1-3.8000109.8S31 R35 F36S31-D33 PolarHBondContact O-N 3.45Å; D33-R35 PolarHBondContact O-N 3.33Å; D33-R35 WeakPolarHBondContact OD1-CB 3.5Å; D33-R35 WeakPolarHBondContact OD1-CD 3.41Å; D33-R35 WeakPolarHBondContact OD1-CG 3.04Å; D33-R35 IonicContact OD1-CZ 3.62Å; D33-R35 IonicContact OD1-NE 3.92Å; D33-R35 PolarHBondContact OD1-NE 3.43Å; D33-R35 IonicContact OD1-NH2 2.71Å; D33-R35 IonicContact OD2-CZ 2.64Å; D33-R35 IonicContact OD2-NE 3.57Å; D33-R35 PolarHBondContact OD2-NE 3.44Å; D33-R35 IonicContact OD2-NH2 2.91Å; D33-R35 PolarHBondContact OD2-NH2 2.9Å; D33-F36 PolarHBondContact O-N 3.45Å
34I35.3Very low36.5Very low110 Ų110108.7 Ų108.756%0.56462%0.621SS**THydrogen-bonded Turntrans-62.6-2.6-178-56.5173.4000111.9L32 F36 L37L32-I34 PolarHBondContact O-N 3.17Å; I34-F36 PolarHBondContact O-N 3.37Å; I34-F36 VanDerWaalsContact O-N 3.07Å; I34-L37 PolarHBondContact O-N 3.04Å
35R40Very low36.3Very low207 Ų207112.1 Ų112.178%0.78162%0.618SS**THydrogen-bonded Turntrans-57.2-19.3171.5-68.7-173.1-75.4-175.4-2.6113.8D33D33-R35 PolarHBondContact O-N 3.33Å; D33-R35 WeakPolarHBondContact OD1-CB 3.5Å; D33-R35 WeakPolarHBondContact OD1-CD 3.41Å; D33-R35 WeakPolarHBondContact OD1-CG 3.04Å; D33-R35 IonicContact OD1-CZ 3.62Å; D33-R35 IonicContact OD1-NE 3.92Å; D33-R35 PolarHBondContact OD1-NE 3.43Å; D33-R35 IonicContact OD1-NH2 2.71Å; D33-R35 IonicContact OD2-CZ 2.64Å; D33-R35 IonicContact OD2-NE 3.57Å; D33-R35 PolarHBondContact OD2-NE 3.44Å; D33-R35 IonicContact OD2-NH2 2.91Å; D33-R35 PolarHBondContact OD2-NH2 2.9Å
36F32.2Very low36.2Very low183 Ų183113 Ų11380%0.80362%0.618SS**THydrogen-bonded Turntrans-110-16.3-178.7-83-86.9000116.3D33 I34D33-F36 PolarHBondContact O-N 3.45Å; I34-F36 PolarHBondContact O-N 3.37Å; I34-F36 VanDerWaalsContact O-N 3.07Å
37L32Very low36.1Very low108 Ų108115.1 Ų115.157%0.56562%0.616SS**THydrogen-bonded Turntrans-88.9-5.8-168.2-78.2169.1000115.3L32 I34 S39L32-L37 HydrophobicContact CD2-CD1 3.49Å; L32-L37 VanDerWaalsContact CD2-CD1 3.49Å; L32-L37 HydrophobicContact CG-CD1 3.98Å; I34-L37 PolarHBondContact O-N 3.04Å; L37-S39 VanDerWaalsContact C-N 3.31Å; L37-S39 PolarHBondContact O-N 3.35Å
38V34.9Very low36.5Very low76 Ų76112.7 Ų112.746%0.46160%0.603SS.*  trans-96.669.5172.5-156.80000108.7V40 L43V38-V40 PolarHBondContact O-N 3.36Å; V38-L43 HydrophobicContact CG1-CD1 3.19Å; V38-L43 HydrophobicContact CG1-CD2 4.11Å; V38-L43 HydrophobicContact CG1-CG 3.35Å
39S36.6Very low36.7Very low60 Ų60112 Ų11242%0.4260%0.598SS.*  trans-57.1114.6165.668.40000107.3L37 P41 V42L37-S39 VanDerWaalsContact C-N 3.31Å; L37-S39 PolarHBondContact O-N 3.35Å; S39-P41 WeakPolarHBondContact O-CD 3.41Å; S39-V42 PolarHBondContact O-N 3.25Å
40V40.7Very low37.3Very low76 Ų76109.6 Ų109.646%0.46160%0.599SS.*Hα-helixtrans-34.9-33.9175.8-177.90000115V38 V42 S44 F280V38-V40 PolarHBondContact O-N 3.36Å; V40-V42 PolarHBondContact O-N 3.22Å; V40-S44 PolarHBondContact O-N 3.3Å; V40-S44 PolarHBondContact O-OG 3.21Å; V40-F280 HydrophobicContact CG1-CZ 4.23Å; V40-F280 HydrophobicContact CG2-CE1 4.4Å; V40-F280 HydrophobicContact CG2-CZ 4.48Å
41P44.1Very low38.1Very low77 Ų77113.2 Ų113.250%0.560%0.6SS.*Hα-helixtrans-64.6-26.6173.519.6-33.9000116.5S39S39-P41 WeakPolarHBondContact O-CD 3.41Å
42V39.7Very low38.4Very low90 Ų90113.1 Ų113.155%0.54560%0.599SS.*Hα-helixtrans-80-42.5-176.6179.90000111.6S39 V40 S44 R45 L46S39-V42 PolarHBondContact O-N 3.25Å; V40-V42 PolarHBondContact O-N 3.22Å; V42-S44 VanDerWaalsContact C-N 3.27Å; V42-S44 PolarHBondContact O-N 2.94Å; V42-R45 PolarHBondContact O-N 3.14Å; V42-L46 PolarHBondContact O-N 3.1Å
43L37.6Very low38.7Very low98 Ų98111.1 Ų111.151%0.51361%0.606SS.*Hα-helixtrans-62.6-35.6173.3-78.1178.5000112.4V38 R45 L46 F47V38-L43 HydrophobicContact CG1-CD1 3.19Å; V38-L43 HydrophobicContact CG1-CD2 4.11Å; V38-L43 HydrophobicContact CG1-CG 3.35Å; L43-R45 PolarHBondContact O-N 3.49Å; L43-L46 PolarHBondContact O-N 3.45Å; L43-F47 WeakPolarHBondContact O-CB 3.5Å; L43-F47 PolarHBondContact O-N 2.93Å
44S40.4Very low38.9Very low57 Ų57116.3 Ų116.340%0.39963%0.632SS.*Hα-helixtrans-65.8-27.4179.4-62.50000112.6V40 V42 N48V40-S44 PolarHBondContact O-N 3.3Å; V40-S44 PolarHBondContact O-OG 3.21Å; V42-S44 VanDerWaalsContact C-N 3.27Å; V42-S44 PolarHBondContact O-N 2.94Å; S44-N48 WeakPolarHBondContact O-CB 3.21Å; S44-N48 PolarHBondContact O-N 3.02Å; S44-N48 PolarHBondContact O-ND2 3.39Å
45R42.4Very low38.7Very low195 Ų195116.8 Ų116.874%0.73665%0.646SS**Hα-helixtrans-80.2-40173.6-64.6-174.5-159.3-154.46.2111.5V42 L43 F47 N48 A49V42-R45 PolarHBondContact O-N 3.14Å; L43-R45 PolarHBondContact O-N 3.49Å; R45-F47 VanDerWaalsContact C-N 3.29Å; R45-F47 PolarHBondContact O-N 2.76Å; R45-N48 PolarHBondContact O-N 2.96Å; R45-A49 WeakPolarHBondContact O-CB 3.08Å; R45-A49 PolarHBondContact O-N 3.22Å
46L40.8Very low38.3Very low134 Ų134118.6 Ų118.670%0.70265%0.653SS**Hα-helixtrans-60.4-40.6175.3-136.886.4000111.7V42 L43V42-L46 PolarHBondContact O-N 3.1Å; L43-L46 PolarHBondContact O-N 3.45Å
47F41.6Very low38.3Very low167 Ų167114.7 Ų114.773%0.73265%0.654SS**Hα-helixtrans-80.2-23.9-178.6-141.4-92.7000113.7L43 R45L43-F47 WeakPolarHBondContact O-CB 3.5Å; L43-F47 PolarHBondContact O-N 2.93Å; R45-F47 VanDerWaalsContact C-N 3.29Å; R45-F47 PolarHBondContact O-N 2.76Å
48N42.1Very low38.4Very low102 Ų102112.9 Ų112.955%0.54566%0.662SS.*Hα-helixtrans-85.5-29.8173.7-85.2-50.6000113S44 R45 G50 R51S44-N48 WeakPolarHBondContact O-CB 3.21Å; S44-N48 PolarHBondContact O-N 3.02Å; S44-N48 PolarHBondContact O-ND2 3.39Å; R45-N48 PolarHBondContact O-N 2.96Å; N48-G50 VanDerWaalsContact C-N 3.28Å; N48-G50 PolarHBondContact O-N 3.01Å; N48-R51 PolarHBondContact O-N 3.11Å
49A39.9Very low38.3Very low75 Ų75117.8 Ų117.862%0.6268%0.68SS**Hα-helixtrans-65.1-30.6176.600000112.7R45 R51R45-A49 WeakPolarHBondContact O-CB 3.08Å; R45-A49 PolarHBondContact O-N 3.22Å; A49-R51 PolarHBondContact O-N 3.13Å
50G41.2Very low37.9Very low75 Ų75119 Ų11977%0.77369%0.694SS**THydrogen-bonded Turntrans-77.75.1175.200000115.5N48N48-G50 VanDerWaalsContact C-N 3.28Å; N48-G50 PolarHBondContact O-N 3.01Å
51R44Very low37.6Very low191 Ų191122.9 Ų122.972%0.72171%0.706SS**THydrogen-bonded Turntrans-114.33.3-169.5-140.9173.5171167.1-3.4114.6N48 A49 G53N48-R51 PolarHBondContact O-N 3.11Å; A49-R51 PolarHBondContact O-N 3.13Å; R51-G53 PolarHBondContact O-N 3.08Å
52S38.9Very low37Very low109 Ų109125.4 Ų125.476%0.76272%0.72SS**THydrogen-bonded Turntrans-89.46.6-170.1-38.90000115.6
53G36.8Very low36.4Very low71 Ų71126 Ų12673%0.73274%0.735SS**THydrogen-bonded Turntrans-111.80.4-169.400000117.6R51R51-G53 PolarHBondContact O-N 3.08Å
54L35.7Very low35.9Very low181 Ų181129.2 Ų129.295%0.94875%0.747SS**  trans-133.578.2-173.7-73.9164.5000110.6
55S31.6Very low35.3Very low121 Ų121133.1 Ų133.185%0.84677%0.768SS**  trans-106.2138.6164.4-171.40000108.7
56R30.8Very low34.7Very low244 Ų244128.8 Ų128.892%0.92176%0.763SS**  trans103.778.5160.4-151175.7-167.3171.42.2117.6
57A33.5Very low34Very low102 Ų102132.7 Ų132.784%0.84377%0.769SS**  trans171.3112.8136.400000105.1
58G32.4Very low33.5Very low70 Ų70129.1 Ų129.172%0.72277%0.77SS**  106.8119.272.600000107.3
59Q33.3Very low32.9Very low178 Ų178132 Ų13283%0.83278%0.78SS**  trans71.7106.8165.2-77.1164.4-84.900119.6
60A27.6Very low32.4Very low87 Ų87133.4 Ų133.472%0.71979%0.792SS**  trans-46.8133.7144.600000110.8
61H35.2Very low31.9Very low156 Ų156134.7 Ų134.772%0.72279%0.789SS**  trans-164.7123.7140.5-79.6-60000108.4
62T31.2Very low31.4Very low130 Ų130133.3 Ų133.380%0.79880%0.795SS**  trans37.4123.5148.255.20000120.3E64T62-E64 PolarHBondContact O-N 2.79Å
63A27.7Very low31.4Very low103 Ų103134 Ų13485%0.85180%0.797SS**  trans-60115.3173.200000111.8
64E27.9Very low31.3Very low165 Ų165137.1 Ų137.177%0.77180%0.802SS**  trans-114.1128.6166.2-144.7-163.1158.600110T62 V66T62-E64 PolarHBondContact O-N 2.79Å; E64-V66 HydrophobicContact CB-CG2 4.35Å; E64-V66 HydrophobicContact CG-CG2 4.5Å; E64-V66 PolarHBondContact O-N 3.36Å; E64-V66 VanDerWaalsContact O-N 3.13Å
65V26.9Very low31.1Very low139 Ų139133 Ų13384%0.84279%0.794SS**  trans-79.386.1175.3174.70000107.2R67V65-R67 PolarHBondContact O-N 3.14Å
66V29.1Very low31.4Very low104 Ų104131.9 Ų131.963%0.6379%0.792SS**  trans-89.7102.9175.2179.30000109.5E64 A68E64-V66 HydrophobicContact CB-CG2 4.35Å; E64-V66 HydrophobicContact CG-CG2 4.5Å; E64-V66 PolarHBondContact O-N 3.36Å; E64-V66 VanDerWaalsContact O-N 3.13Å; V66-A68 VanDerWaalsContact C-N 3.33Å; V66-A68 PolarHBondContact O-N 3.05Å
67R27.5Very low31.8Very low217 Ų217124.8 Ų124.882%0.81978%0.78SS**  trans-70.485.4167.8-163-173.3-139.3112.3-2.5107.9V65 Q69V65-R67 PolarHBondContact O-N 3.14Å; R67-Q69 PolarHBondContact O-N 3.44Å
68A29.8Very low32.1Very low91 Ų91128 Ų12875%0.75278%0.778SS**  trans-76.891.7177.700000110.1V66 A70V66-A68 VanDerWaalsContact C-N 3.33Å; V66-A68 PolarHBondContact O-N 3.05Å; A68-A70 PolarHBondContact O-N 3.15Å
69Q30.7Very low32.2Very low162 Ų162132.8 Ų132.876%0.75778%0.781SS**  trans-65.9119157.7-70.7-175.5-4.600107.5R67 S71R67-Q69 PolarHBondContact O-N 3.44Å; Q69-S71 VanDerWaalsContact C-N 3.35Å; Q69-S71 PolarHBondContact O-N 2.74Å; Q69-S71 VanDerWaalsContact O-N 3.08Å
70A29.5Very low32.2Very low105 Ų105128.2 Ų128.287%0.86877%0.774SS**  trans-78.287.2172.500000108.9A68A68-A70 PolarHBondContact O-N 3.15Å
71S31Very low33Very low102 Ų102130.2 Ų130.271%0.71378%0.78SS**  trans-90.8108161.331.20000108.4Q69Q69-S71 VanDerWaalsContact C-N 3.35Å; Q69-S71 PolarHBondContact O-N 2.74Å; Q69-S71 VanDerWaalsContact O-N 3.08Å
72L33.6Very low32.9Very low162 Ų162133.8 Ų133.885%0.84879%0.787SS**PPolyproline II helixtrans-61.9130.4167-77.9133.9000109.7
73P38.8Very low33.5Very low124 Ų124135 Ų13581%0.80579%0.787SS**PPolyproline II helixtrans-86.5124.8160.930.4-25.7000110
74T34.2Very low34.2Very low136 Ų136141.1 Ų141.183%0.83479%0.788SS**PPolyproline II helixtrans-62.4146173.5-61.90000112.1
75A31.4Very low34.6Very low95 Ų95140.4 Ų140.479%0.78580%0.795SS**  trans-25.6136.7173.200000118.2
76A38.2Very low35.4Very low97 Ų97138.2 Ų138.280%0.80279%0.791SS**  trans-168.5123.813300000110.7
77S38.9Very low36.2Very low96 Ų96140.7 Ų140.767%0.67180%0.801SS**  trans44.1135143-115.90000122.7
78E38.6Very low36.8Very low169 Ų169136 Ų13679%0.7980%0.796SS**  trans61.5133.9139.6-83.1160.1122.400117.5
79E34.7Very low37.3Very low171 Ų171142.2 Ų142.280%0.79980%0.8SS**  cis-172.1140.819.6-177.7-176.7144.600104.5
80A33.7Very low38.1Very low82 Ų82143 Ų14368%0.67880%0.804SS**  trans-75.2157.4179.600000111.9
81P45.6Very low38.8Very low129 Ų129145.9 Ų145.984%0.83880%0.8SS**  trans-130.4125.7131.312.18.9000113.1
82R33.1Very low39.2Very low230 Ų230153 Ų15387%0.86881%0.811SS**  trans-67145165.9-59179.2162.7172.6-4.3110
83L42.2Very low39.7Very low155 Ų155156.6 Ų156.681%0.81281%0.813SS**  trans171.7137.8154-92168.7000107.7
84R43.6Very low39.9Very low232 Ų232154.8 Ų154.888%0.87582%0.817SS**  cis-163.8148.1-21.4-119.5-174.7-162.6-175.36.6106.6
85V35.5Very low40.3Very low151 Ų151152.4 Ų152.492%0.91581%0.811SS**  trans-87.4126.2174.1171.60000109.7
86A42.9Very low41.2Very low92 Ų92155.2 Ų155.276%0.7681%0.813SS**  trans174.2133.7155.400000105.4
87D47.1Very low42Very low156 Ų156159.6 Ų159.683%0.83481%0.814SS**  -163.6143.755.7-159.2-2.3000110.3
88V38.9Very low42.3Very low119 Ų119160.5 Ų160.572%0.72182%0.818SS**  trans-103.6124172.7169.80000105.1
89R40.7Very low42.5Very low221 Ų221164.1 Ų164.183%0.83482%0.824SS**  trans163.7148.2141.6-89.5153.2-172-165.42.4112.7
90Q48.6Very low42.8Very low179 Ų179159.8 Ų159.884%0.83682%0.817SS**  trans78.8123.8162.4-32.6-157.328.600113.5
91Q44.3Very low43.4Very low165 Ų165167.3 Ų167.377%0.77183%0.828SS**  cis-167.3103.744.8-176.5172.3-35.700109.4
92R38.7Very low43.6Very low251 Ų251165.8 Ų165.895%0.94782%0.821SS**  trans-79.6117.4153-75.5-172.6179.2-135.81.8106.7
93R43.5Very low44.4Very low238 Ų238166.3 Ų166.390%0.89882%0.823SS**  trans-178.5124.7160.2-102164.3-154.7-135.29.5108.9
94G43.8Very low44.9Very low86 Ų86164.8 Ų164.889%0.88782%0.822SS**  trans150.367.8168.300000114.2
95A42.7Very low45Very low86 Ų86159 Ų15971%0.71182%0.824SS**  trans-89.7158.3164.900000109.8
96D49.4Very low45.5Very low154 Ų154155 Ų15582%0.82481%0.813SS**  trans129.4139.2157.2-74-29.7000112.5
97K55.2Low45.7Very low189 Ų189159 Ų15982%0.82282%0.816SS**  cis-179.7149.8-18.1-158.6171.1-1751770105
98P46Very low45.6Very low116 Ų116158.1 Ų158.175%0.75381%0.812SS**  trans-104.6143.4-179.135.8-28000112.9
99R42.3Very low45.9Very low245 Ų245156.8 Ų156.893%0.92581%0.813SS**  trans167.8135.1143.3-109.6-178.2168.6-170.7-2.2116
100A40.5Very low46.5Very low79 Ų79152.6 Ų152.665%0.65381%0.812SS**  91.3141.2120.500000123.3
101R47.2Very low46.2Very low240 Ų240150.1 Ų150.191%0.90681%0.811SS**  trans80.4139.2153.1-75169.6-169.2-123.82.9116
102S49.8Very low46.2Very low98 Ų98145.6 Ų145.669%0.68581%0.81SS**  cis177.5145.28.535.40000109.3
103R48.6Very low46.6Very low240 Ų240143.5 Ų143.591%0.90681%0.807SS**  165.3139.3119-95.2179.5146136.9-4.9113.7
104P53.2Low46.3Very low124 Ų124144 Ų14481%0.80581%0.809SS**  trans-111.1168.8176.940.8-30.7000113.5
105A46.8Very low46.2Very low109 Ų109145.9 Ų145.990%0.90181%0.809SS**  trans164.5140.9138.400000113.6
106G45.7Very low46.2Very low68 Ų68146.6 Ų146.670%0.70181%0.808SS**  trans119.284.1164.400000114.5
107E46.3Very low46.1Very low177 Ų177144 Ų14483%0.82780%0.803SS**  55.7124.976.6-76.5-175.2162.700112.7
108N44.9Very low45.6Very low137 Ų137140.7 Ų140.773%0.73379%0.793SS**  cis-16415331.6-85.1-41.8000113.2
109A45Very low45.5Very low91 Ų91144.7 Ų144.775%0.75279%0.794SS**  trans39.6131.6144.400000121.1
110T53.5Low45.7Very low132 Ų132141.4 Ų141.481%0.8179%0.789SS**  -177.8144.665.2-47.60000110.4
111P42.9Very low45.7Very low127 Ų127143.2 Ų143.283%0.82580%0.796SS**  trans-107.3148.6176.436.8-27000113.7
112G43.9Very low45.4Very low71 Ų71135.8 Ų135.873%0.73279%0.786SS**  trans-173.9118.8173.400000118.5
113K47.2Very low44.9Very low207 Ų207137.8 Ų137.890%0.980%0.795SS**  trans71.9103.8147.3-53.7-169.4179.2-172.80118.3
114R37.7Very low44.8Very low249 Ų249130.6 Ų130.694%0.9479%0.786SS**  46.3113.780.9-76.1-170.5-176.3176.62115.2
115S41.7Very low44.4Very low125 Ų125129.8 Ų129.887%0.87478%0.782SS**  -171.1143.1116.2-1560000112.5
116S41.5Very low44.1Very low100 Ų100131.4 Ų131.470%0.69978%0.775SS**  trans-94.4175.3178.2490000112.8
117S49Very low43.7Very low101 Ų101134 Ų13471%0.70678%0.777SS**  trans94.2133.6171.887.50000113.9
118D44.9Very low43.5Very low118 Ų118132 Ų13263%0.63177%0.772SS**  cis-162.8131.547.5-88.4-59.3000110.1
119R43.9Very low43.1Very low201 Ų201135.9 Ų135.976%0.75878%0.776SS**  66.7115.196.4-82.1-177.9177.5157.9-2.1114.7
120Q46Very low42.7Very low176 Ų176136.2 Ų136.282%0.82277%0.773SS**  127.4151.2102.1-92163.4-11.600107.4
121S41.1Very low42.6Very low116 Ų116137.9 Ų137.981%0.81178%0.775SS**  cis-168.2164.80.7-174.70000108.3
122A39.1Very low42.2Very low84 Ų84136.7 Ų136.769%0.69477%0.77SS**  trans-64.9-179.6-173.600000118.1
123T40.3Very low42.2Very low140 Ų140139.7 Ų139.786%0.85978%0.776SS**  trans110.3128153.5-40.80000113.2
124A46.7Very low41.7Very low89 Ų89136.8 Ų136.874%0.73678%0.776SS**  cis-170.2173.31.700000108.4
125P44Very low41.8Very low108 Ų108127.8 Ų127.870%0.70176%0.761SS**  trans-104.4171.4-162.539.3-31.3000115.6
126N41.1Very low41.8Very low142 Ų142125.4 Ų125.476%0.75974%0.744SS**  trans114.9134.7148.7-66.8-28.1000119.7
127T36.7Very low41.7Very low122 Ų122125.7 Ų125.775%0.74875%0.752SS**  trans91.7130.3141.112.30000120.3
128L41.5Very low41.7Very low137 Ų137129 Ų12972%0.71776%0.762SS**  trans85.6130.8164.4-54163.4000115.9
129R36.7Very low41.7Very low217 Ų217133.3 Ų133.382%0.81977%0.769SS**  cis-179.8138.3-16.8-122.3179.6178.2151.9-8.7103.5
130S37.8Very low42Very low98 Ų98127.9 Ų127.969%0.68577%0.767SS**  trans37.5117.815362.60000118.3
131I51.1Low42.1Very low168 Ų168125.6 Ų125.686%0.86276%0.76SS**  -161.6130.684.4-77.6142.8000109.7
132S34.7Very low42.7Very low102 Ų102124.9 Ų124.971%0.71375%0.753SS**  trans-53.9148.1174.4-56.20000113.9
133P44.3Very low42.9Very low133 Ų133124.5 Ų124.586%0.86474%0.744SS**  -134.983.258.933.1-12.9000112.8
134T36.3Very low43.6Very low147 Ų147122.5 Ų122.590%0.90274%0.736SS**  trans-74.1123.5165.4-40.90000108.8
135G39.2Very low43.6Very low59 Ų59127.9 Ų127.961%0.60875%0.746SS**  trans166.161.816800000118
136S42.9Very low44.2Very low75 Ų75125.9 Ų125.952%0.52475%0.745SS.*  trans46.297.4142.652.70000118L138S136-L138 PolarHBondContact O-N 3.2Å
137A39Very low45Very low106 Ų106125.1 Ų125.188%0.87675%0.746SS**THydrogen-bonded Turntrans-63.813172.500000116.1
138L49.3Very low45.7Very low172 Ų172123 Ų12390%0.90173%0.73SS**THydrogen-bonded Turntrans-155.450.6178.4-70.3178000111.7S136 A140S136-L138 PolarHBondContact O-N 3.2Å; L138-A140 PolarHBondContact O-N 3.46Å
139R44.3Very low46.5Very low208 Ų208121 Ų12179%0.78572%0.724SS**  trans-87.4106.4175.4-134.2-177.7-171.5-113.93.2110
140A50.4Low47.4Very low87 Ų87118.6 Ų118.672%0.71972%0.72SS**  trans-48.3136.1170.900000110.8L138 P142L138-A140 PolarHBondContact O-N 3.46Å; A140-P142 VanDerWaalsContact O-CD 3.25Å; A140-P142 WeakPolarHBondContact O-CD 3.28Å
141N48.5Very low48.1Very low128 Ų128117.5 Ų117.568%0.68471%0.712SS**  trans-58.2113.6173.317924.5000109.6C143N141-C143 VanDerWaalsContact C-N 3.32Å; N141-C143 PolarHBondContact ND2-SG 3.02Å; N141-C143 PolarHBondContact O-N 3.42Å
142P52.9Low47.9Very low101 Ų101119.9 Ų119.966%0.65671%0.71SS**  trans-79.786.2172.831.9-26.8000107.8A140 S144A140-P142 VanDerWaalsContact O-CD 3.25Å; A140-P142 WeakPolarHBondContact O-CD 3.28Å; P142-S144 VanDerWaalsContact C-N 3.3Å; P142-S144 PolarHBondContact O-N 3.08Å
143C43.6Very low49Very low75 Ų75119.7 Ų119.751%0.50770%0.701SS.*  trans-66.1100.3157.5-68.20000106.3N141 E145N141-C143 VanDerWaalsContact C-N 3.32Å; N141-C143 PolarHBondContact ND2-SG 3.02Å; N141-C143 PolarHBondContact O-N 3.42Å; C143-E145 PolarHBondContact O-N 2.89Å
144S54.2Low49.5Very low98 Ų98117.2 Ų117.269%0.68569%0.685SS**  trans-63.5105171.742.50000108.4P142 G146P142-S144 VanDerWaalsContact C-N 3.3Å; P142-S144 PolarHBondContact O-N 3.08Å; S144-G146 PolarHBondContact O-N 2.85Å
145E48.3Very low50.4Low203 Ų203116.1 Ų116.195%0.94967%0.673SS**THydrogen-bonded Turntrans-49.493.3173.6-169.5159.2-166.500110.1C143C143-E145 PolarHBondContact O-N 2.89Å
146G55.7Low50.7Low66 Ų66117.6 Ų117.668%0.6867%0.674SS**THydrogen-bonded Turntrans168.8-26.5-179.600000117.7S144S144-G146 PolarHBondContact O-N 2.85Å
147T57.8Low51Low126 Ų126117.1 Ų117.177%0.77368%0.675SS**SBendtrans-130.1-6.9-167.2-27.20000115.4P149T147-P149 WeakPolarHBondContact O-CD 3.33Å
148D51.7Low51.4Low77 Ų77117.8 Ų117.841%0.41266%0.663SS.*  trans-107.7111.9-176.6-166-3.4000111.7F150 C151D148-F150 PolarHBondContact O-N 3.29Å; D148-F150 WeakPolarHBondContact OD1-CB 3.39Å; D148-F150 WeakPolarHBondContact OD1-CD2 3.1Å; D148-F150 PolarHBondContact OD1-N 3.05Å; D148-C151 HydrophobicContact CB-CB 4.3Å; D148-C151 PolarHBondContact O-N 3.41Å; D148-C151 VanDerWaalsContact O-N 3.1Å
149P58.8Low51.4Low94 Ų94117.7 Ų117.761%0.6166%0.655SS**G310 helixtrans-56.9-28.5173.8-21.631.9000112.8T147 C151 R152T147-P149 WeakPolarHBondContact O-CD 3.33Å; P149-C151 VanDerWaalsContact C-N 3.27Å; P149-C151 PolarHBondContact O-N 2.83Å; P149-R152 PolarHBondContact O-N 3.39Å
150F55.4Low51.1Low167 Ų167114.8 Ų114.873%0.73266%0.655SS**G310 helixtrans-72-21.4179.7-72.6-84000113D148 R152D148-F150 PolarHBondContact O-N 3.29Å; D148-F150 WeakPolarHBondContact OD1-CB 3.39Å; D148-F150 WeakPolarHBondContact OD1-CD2 3.1Å; D148-F150 PolarHBondContact OD1-N 3.05Å; F150-R152 VanDerWaalsContact C-N 3.33Å
151C52.4Low50.5Low76 Ų76121.9 Ų121.951%0.51466%0.664SS.*G310 helixtrans-85.1-4.1174.7-62.40000113.4D148 P149D148-C151 HydrophobicContact CB-CB 4.3Å; D148-C151 PolarHBondContact O-N 3.41Å; D148-C151 VanDerWaalsContact O-N 3.1Å; P149-C151 VanDerWaalsContact C-N 3.27Å; P149-C151 PolarHBondContact O-N 2.83Å
152R47Very low50Low217 Ų217120.3 Ų120.382%0.81966%0.66SS**SBendtrans-103.9-2.8175.4-77.8-157.4175.5-177.51.4114.7P149 F150 P154P149-R152 PolarHBondContact O-N 3.39Å; F150-R152 VanDerWaalsContact C-N 3.33Å; R152-P154 WeakPolarHBondContact O-CD 3.49Å
153L58Low49.4Very low98 Ų98122.6 Ų122.651%0.51366%0.662SS.*SBendtrans-69.7115168.7-97.592.6000108.2L155L153-L155 PolarHBondContact O-N 3.43Å
154P53.4Low49.5Very low81 Ų81122.9 Ų122.953%0.52667%0.67SS.*  trans-60.3112.116925.8-30.8000106.4R152 S156 A157R152-P154 WeakPolarHBondContact O-CD 3.49Å; P154-S156 PolarHBondContact O-N 3.07Å; P154-A157 HydrophobicContact CG-CB 4.29Å; P154-A157 WeakPolarHBondContact O-CB 3.18Å; P154-A157 PolarHBondContact O-N 3.38Å
155L55.2Low49.1Very low124 Ų124122.6 Ų122.665%0.64966%0.664SS**G310 helixtrans-47.9-27.8174.9-80.7160000111.3L153 A157 L158 F159L153-L155 PolarHBondContact O-N 3.43Å; L155-A157 PolarHBondContact O-N 3Å; L155-L158 PolarHBondContact O-N 2.84Å; L155-F159 WeakPolarHBondContact O-CD2 3.47Å
156S46.6Very low49.1Very low90 Ų90118.2 Ų118.263%0.62964%0.643SS**G310 helixtrans-59.5-21.8174.3-40.90000115.3P154P154-S156 PolarHBondContact O-N 3.07Å
157A48.2Very low48.8Very low66 Ų66120.4 Ų120.455%0.54564%0.639SS.*G310 helixtrans-82.2-18.5175.100000113.1P154 L155P154-A157 HydrophobicContact CG-CB 4.29Å; P154-A157 WeakPolarHBondContact O-CB 3.18Å; P154-A157 PolarHBondContact O-N 3.38Å; L155-A157 PolarHBondContact O-N 3Å
158L48.7Very low48.6Very low120 Ų120116.7 Ų116.763%0.62863%0.626SS**SBendtrans-89.4-7.9174.5-65.8172.3000112.6L155L155-L158 PolarHBondContact O-N 2.84Å
159F47.5Very low48.5Very low170 Ų170116.5 Ų116.575%0.74662%0.624SS**SBendtrans-11819.5-174.1-79.9-78.9000114.4L155L155-F159 WeakPolarHBondContact O-CD2 3.47Å
160N38.3Very low47.9Very low147 Ų147117.7 Ų117.779%0.78663%0.625SS**SBendtrans-138.426.4-177.4-126.5-13.4000114.6
161W39.1Very low47.9Very low236 Ų236115.4 Ų115.489%0.89462%0.62SS**SBendtrans-141.6134.7-174.6-165.2-99.6000112.4
162P37.3Very low47.9Very low94 Ų94121.2 Ų121.261%0.6163%0.631SS**  -76.5145.5-9438-25.6000112.2A164P162-A164 PolarHBondContact O-N 3.32Å
163E41.2Very low48Very low149 Ų149115.1 Ų115.170%0.69661%0.614SS**  trans19.582.3146.5-158.4151.6-165.400115.8V165E163-V165 HydrophobicContact CG-CB 3.96Å; E163-V165 HydrophobicContact CG-CG2 3.54Å; E163-V165 PolarHBondContact O-N 2.98Å
164A45.5Very low47.5Very low82 Ų82118.9 Ų118.968%0.67862%0.621SS**THydrogen-bonded Turntrans-66.931.4174.300000113.3P162 H166P162-A164 PolarHBondContact O-N 3.32Å; A164-H166 VanDerWaalsContact C-N 3.35Å
165V44Very low47.1Very low91 Ų91121.1 Ų121.155%0.55263%0.628SS**THydrogen-bonded Turntrans-77.9-24.3169.2179.10000110.2E163E163-V165 HydrophobicContact CG-CB 3.96Å; E163-V165 HydrophobicContact CG-CG2 3.54Å; E163-V165 PolarHBondContact O-N 2.98Å
166H50.1Low46.5Very low112 Ų112117.2 Ų117.252%0.51962%0.618SS.*SBendtrans-104.7-3.5-174.3-58.6-55.9000116A164 G168 D169 L170A164-H166 VanDerWaalsContact C-N 3.35Å; H166-G168 VanDerWaalsContact C-N 3.29Å; H166-G168 PolarHBondContact O-N 3.21Å; H166-D169 IonicContact ND1-OD2 2.96Å; H166-D169 PolarHBondContact ND1-OD2 3.07Å; H166-D169 PolarHBondContact O-N 2.84Å; H166-L170 PolarHBondContact O-N 3.2Å
167L48.1Very low46.1Very low112 Ų112120.3 Ų120.359%0.58662%0.621SS**Hα-helixtrans-67.9-32.7174.7-97.176.7000111.9D169 L170 L171L167-D169 VanDerWaalsContact C-N 3.31Å; L167-L170 PolarHBondContact O-N 3.29Å; L167-L171 PolarHBondContact O-N 3.2Å; L167-L171 VanDerWaalsContact O-N 3.15Å
168G54Low45.7Very low48 Ų48121.4 Ų121.450%0.49562%0.624SS.*Hα-helixtrans-63.6-39.1171.800000111.8H166 R172H166-G168 VanDerWaalsContact C-N 3.29Å; H166-G168 PolarHBondContact O-N 3.21Å; G168-R172 VanDerWaalsContact O-CB 3.28Å; G168-R172 WeakPolarHBondContact O-CB 3.43Å; G168-R172 PolarHBondContact O-N 3.48Å; G168-R172 VanDerWaalsContact O-N 3.13Å
169D48.6Very low44.9Very low72 Ų72125.6 Ų125.639%0.38563%0.632SS.*Hα-helixtrans-68.9-42.1176.9-62-30.2000111H166 L167 L171 R172 I173H166-D169 IonicContact ND1-OD2 2.96Å; H166-D169 PolarHBondContact ND1-OD2 3.07Å; H166-D169 PolarHBondContact O-N 2.84Å; L167-D169 VanDerWaalsContact C-N 3.31Å; D169-L171 PolarHBondContact O-N 3.39Å; D169-R172 CarbonylContact O-C 3.58Å; D169-R172 PolarHBondContact O-N 3.13Å; D169-R172 VanDerWaalsContact O-N 3.11Å; D169-I173 HydrophobicContact CB-CD1 4.4Å; D169-I173 WeakPolarHBondContact O-CB 3.11Å; D169-I173 WeakPolarHBondContact O-CD1 3.34Å; D169-I173 WeakPolarHBondContact O-CG1 3.41Å; D169-I173 PolarHBondContact O-N 2.91Å
170L46.2Very low44Very low119 Ų119122.9 Ų122.962%0.62363%0.629SS**Hα-helixtrans-64.3-40.2-179.3-141.172.1000112.8H166 L167 R172 W174H166-L170 PolarHBondContact O-N 3.2Å; L167-L170 PolarHBondContact O-N 3.29Å; L170-R172 VanDerWaalsContact C-N 3.34Å; L170-W174 WeakPolarHBondContact O-CB 3.46Å; L170-W174 PolarHBondContact O-N 3.37Å
171L56.2Low43.6Very low120 Ų120121.8 Ų121.863%0.62863%0.627SS**Hα-helixtrans-70.1-29.8173.7-86.5152000112.6L167 D169 L175L167-L171 PolarHBondContact O-N 3.2Å; L167-L171 VanDerWaalsContact O-N 3.15Å; D169-L171 PolarHBondContact O-N 3.39Å; L171-L175 WeakPolarHBondContact O-CB 3.32Å; L171-L175 PolarHBondContact O-N 2.93Å
172R52.3Low43.3Very low198 Ų198120.2 Ų120.275%0.74763%0.63SS**Hα-helixtrans-77.5-36.2176.9-153.9174-170.5-170.90.8112.1G168 D169 L170 G176G168-R172 VanDerWaalsContact O-CB 3.28Å; G168-R172 WeakPolarHBondContact O-CB 3.43Å; G168-R172 PolarHBondContact O-N 3.48Å; G168-R172 VanDerWaalsContact O-N 3.13Å; D169-R172 CarbonylContact O-C 3.58Å; D169-R172 PolarHBondContact O-N 3.13Å; D169-R172 VanDerWaalsContact O-N 3.11Å; L170-R172 VanDerWaalsContact C-N 3.34Å; R172-G176 PolarHBondContact O-N 2.64Å
173I49Very low43.1Very low88 Ų88120 Ų12045%0.45163%0.631SS.*Hα-helixtrans-61.9-48.9169.6-74.2168.9000108.9D169 G176 F177D169-I173 HydrophobicContact CB-CD1 4.4Å; D169-I173 WeakPolarHBondContact O-CB 3.11Å; D169-I173 WeakPolarHBondContact O-CD1 3.34Å; D169-I173 WeakPolarHBondContact O-CG1 3.41Å; D169-I173 PolarHBondContact O-N 2.91Å; I173-G176 CarbonylContact O-C 3.6Å; I173-G176 WeakPolarHBondContact O-CA 3.19Å; I173-G176 PolarHBondContact O-N 2.71Å; I173-G176 VanDerWaalsContact O-N 3.14Å; I173-F177 HydrophobicContact CG2-CD2 3.7Å; I173-F177 HydrophobicContact CG2-CE2 3.43Å; I173-F177 VanDerWaalsContact CG2-CE2 3.43Å; I173-F177 WeakPolarHBondContact O-CD2 3.35Å; I173-F177 PolarHBondContact O-N 3.07Å
174W48.8Very low42.7Very low178 Ų178118.5 Ų118.567%0.67463%0.632SS**Hα-helixtrans-68.8-38.2-179.8-161.6-3.7000113.7L170 G176 F177 S178L170-W174 WeakPolarHBondContact O-CB 3.46Å; L170-W174 PolarHBondContact O-N 3.37Å; W174-G176 PolarHBondContact O-N 2.89Å; W174-F177 PolarHBondContact O-N 2.92Å; W174-S178 PolarHBondContact O-N 3.33Å; W174-S178 PolarHBondContact O-OG 3.34Å; W174-S178 VanDerWaalsContact O-OG 3.1Å
175L44.3Very low42.3Very low127 Ų127120.4 Ų120.467%0.66564%0.637SS**Hα-helixtrans-70.7-21.2173.3-159.669.2000112.5L171L171-L175 WeakPolarHBondContact O-CB 3.32Å; L171-L175 PolarHBondContact O-N 2.93Å
176G41.6Very low41.7Very low43 Ų43123.1 Ų123.144%0.44365%0.649SS.*Hα-helixtrans-81.4-36.2173.100000113.9R172 I173 W174 S178 R179R172-G176 PolarHBondContact O-N 2.64Å; I173-G176 CarbonylContact O-C 3.6Å; I173-G176 WeakPolarHBondContact O-CA 3.19Å; I173-G176 PolarHBondContact O-N 2.71Å; I173-G176 VanDerWaalsContact O-N 3.14Å; W174-G176 PolarHBondContact O-N 2.89Å; G176-S178 PolarHBondContact O-N 3.01Å; G176-R179 PolarHBondContact O-N 3.44Å
177F39Very low41Very low155 Ų155121.8 Ų121.868%0.6866%0.657SS**Hα-helixtrans-73.9-9.6176.2-78.8-68000114.2I173 W174 R179I173-F177 HydrophobicContact CG2-CD2 3.7Å; I173-F177 HydrophobicContact CG2-CE2 3.43Å; I173-F177 VanDerWaalsContact CG2-CE2 3.43Å; I173-F177 WeakPolarHBondContact O-CD2 3.35Å; I173-F177 PolarHBondContact O-N 3.07Å; W174-F177 PolarHBondContact O-N 2.92Å; F177-R179 PolarHBondContact O-N 3.25Å
178S39.4Very low40.3Very low89 Ų89123.4 Ų123.462%0.62267%0.671SS**THydrogen-bonded Turntrans-87.612.9174.2-53.60000112.9W174 G176W174-S178 PolarHBondContact O-N 3.33Å; W174-S178 PolarHBondContact O-OG 3.34Å; W174-S178 VanDerWaalsContact O-OG 3.1Å; G176-S178 PolarHBondContact O-N 3.01Å
179R32.3Very low39.4Very low207 Ų207124 Ų12478%0.78168%0.677SS**SBendtrans-132.364.3-177.7-65.2-176.6179.3-112.3-0.3111.4G176 F177G176-R179 PolarHBondContact O-N 3.44Å; F177-R179 PolarHBondContact O-N 3.25Å
180T27.7Very low38.3Very low114 Ų114128.3 Ų128.370%0.69970%0.701SS**  trans-171.8113.5169.216.30000105.1
181V30.7Very low37.5Very low123 Ų123127.2 Ų127.275%0.74571%0.709SS**  -152.8103.667.9170.20000108.8
182E32.6Very low36.2Very low204 Ų204125.6 Ų125.695%0.95371%0.713SS**  trans-128.158.2150.8-82.8-159.5160.700107.1
183S32.6Very low35.1Very low89 Ų89126.3 Ų126.362%0.62272%0.721SS**  trans-104100.8161.960.90000107.2P185S183-P185 WeakPolarHBondContact O-CD 3.42Å
184V32.7Very low34Very low118 Ų118128.1 Ų128.172%0.71574%0.74SS**  trans-27.3117.6167.8178.50000112.4
185P38.5Very low33.1Very low122 Ų122122.8 Ų122.879%0.79274%0.741SS**  trans-98100155.431.7-19.1000107.3S183S183-P185 WeakPolarHBondContact O-CD 3.42Å
186N31.1Very low32.4Very low148 Ų148123.3 Ų123.379%0.79174%0.744SS**  trans-67.1136.6160.1-92.8-26000108
187A34.8Very low31.9Very low83 Ų83129.2 Ų129.269%0.68676%0.764SS**SBendtrans73.8108.1167.300000117.1
188T34.4Very low31.6Very low146 Ų146127.2 Ų127.290%0.89676%0.764SS**  74.3112.6129.7-46.40000117.8
189G33.9Very low31.3Very low60 Ų60127.6 Ų127.662%0.61977%0.773SS**  trans109.885.3152.700000115.2
190D25.1Very low31.1Very low164 Ų164125 Ų12588%0.87777%0.773SS**  35.7112.5124.8-46.2-10.6000118
191A30.2Very low31.4Very low96 Ų96125.2 Ų125.279%0.79378%0.779SS**  149.3127.8115.600000113.5
192A29.1Very low31.5Very low86 Ų86122.7 Ų122.771%0.71178%0.778SS**  trans64111.4143.500000119.3
193F28.4Very low31.2Very low212 Ų212122.2 Ų122.293%0.9378%0.776SS**  -165.691.5108.8-103.9-77.5000108.1
194C27.2Very low31.1Very low126 Ų126123.8 Ų123.885%0.85178%0.783SS**  trans-87.3115.8160.7-1640000106.1
195G30.3Very low31.1Very low67 Ų67121.3 Ų121.369%0.69178%0.782SS**  trans-132.8105.4179.600000109.1
196D28.2Very low30.8Very low137 Ų137121.4 Ų121.473%0.73379%0.786SS**  trans-55.8130.8-172-61.7-56.1000114.6
197I31Very low31.2Very low167 Ų167118.9 Ų118.986%0.85678%0.78SS**  trans-123.389153.2-56.7-179.5000107.1A199I197-A199 PolarHBondContact O-N 3.22Å
198V34.2Very low31Very low113 Ų113122.9 Ų122.969%0.68579%0.789SS**  trans-67.6116171.8169.90000109.2I200V198-I200 HydrophobicContact CG1-CG1 4.49Å; V198-I200 PolarHBondContact O-N 3.17Å
199A32.9Very low30.9Very low97 Ų97121.5 Ų121.580%0.80279%0.785SS**  trans-77.1105.1170.900000110.2I197 S201I197-A199 PolarHBondContact O-N 3.22Å; A199-S201 PolarHBondContact O-N 3.38Å
200I27.8Very low31.2Very low153 Ų153125 Ų12579%0.78579%0.794SS**  trans-81.899.3173.6-40.1170.2000108.3V198V198-I200 HydrophobicContact CG1-CG1 4.49Å; V198-I200 PolarHBondContact O-N 3.17Å
201S34.1Very low31.9Very low119 Ų119122.9 Ų122.983%0.83279%0.789SS**  trans-176.1111.4158.8168.90000113A199A199-S201 PolarHBondContact O-N 3.38Å
202G33Very low32.1Very low69 Ų69127.5 Ų127.571%0.71179%0.787SS**  trans98.697.8150.400000115.2P204G202-P204 WeakPolarHBondContact O-CD 3.47Å
203Q26Very low32.8Very low195 Ų195131.9 Ų131.991%0.91179%0.793SS**  trans-57.9140.1164.4-68.4-134.5-71.400111.8
204P30.8Very low33.2Very low121 Ų121128.4 Ų128.479%0.78678%0.78SS**  trans-127.1139.2132.226-9.9000110.2G202G202-P204 WeakPolarHBondContact O-CD 3.47Å
205G32.3Very low33.8Very low67 Ų67132 Ų13269%0.69178%0.781SS**  trans-64.2154-170.900000115.8
206S31.4Very low34.4Very low123 Ų123137.3 Ų137.386%0.8679%0.785SS**  42.595.1129.9-178.30000117.7
207S39.1Very low34.8Very low96 Ų96137.3 Ų137.367%0.67179%0.79SS**  -169.1126.5120.2630000109.1C209S207-C209 PolarHBondContact O-N 3.4Å
208D30.6Very low35.3Very low166 Ų166137.3 Ų137.389%0.88879%0.791SS**  trans-56.7122.2171.5-57.4-55.1000110.8
209C33Very low35.4Very low118 Ų118137.7 Ų137.780%0.79780%0.799SS**  trans-132.292.9167.8-80.30000108.4S207S207-C209 PolarHBondContact O-N 3.4Å
210V40.3Very low35.6Very low133 Ų133136.8 Ų136.881%0.80680%0.799SS**PPolyproline II helixtrans-74.4135.3165.41790000108.1Y212V210-Y212 PolarHBondContact O-N 2.93Å
211P39.4Very low36.1Very low119 Ų119136.4 Ų136.477%0.77380%0.804SS**PPolyproline II helixtrans-69.6129.8-177.227.8-32.9000111.3
212Y35Very low36.4Very low193 Ų193134.4 Ų134.476%0.75779%0.794SS**PPolyproline II helixtrans-82.1120.9175.2172.4-100000110.3V210 E214V210-Y212 PolarHBondContact O-N 2.93Å; Y212-E214 HydrophobicContact CD1-CB 4.46Å; Y212-E214 HydrophobicContact CE1-CB 3.68Å; Y212-E214 HydrophobicContact CE1-CG 4.21Å
213E44.8Very low36.7Very low179 Ų179139.1 Ų139.184%0.83680%0.803SS**PPolyproline II helixtrans-98.5119.6165.1-79.4-77.5142.300108.8
214E35.3Very low37.3Very low139 Ų139133.5 Ų133.565%0.6580%0.797SS**  trans-81.4113.5175.7-171.6-174.2164.500110.2Y212Y212-E214 HydrophobicContact CD1-CB 4.46Å; Y212-E214 HydrophobicContact CE1-CB 3.68Å; Y212-E214 HydrophobicContact CE1-CG 4.21Å
215K39.6Very low37.6Very low202 Ų202133.7 Ų133.788%0.87880%0.8SS**  trans-138.4105.9161.6-161.5175.1-179.3-177.50111.4
216K44.1Very low37.9Very low177 Ų177135.8 Ų135.877%0.7780%0.804SS**  trans-58.6126.8163.4-92.8170.5169.5163.90110.3
217T37Very low38.6Very low138 Ų138135.8 Ų135.885%0.84780%0.801SS**  177.6120.9106.3-63.30000108.6
218L39.7Very low38.4Very low167 Ų167136.3 Ų136.387%0.87481%0.805SS**  trans-52.9156.1171-63.5151.6000110.5
219S36.9Very low39.1Very low121 Ų121133 Ų13385%0.84680%0.795SS**  cis-162.7156.627.442.90000107.9
220G36.8Very low39.5Very low78 Ų78136.2 Ų136.280%0.80480%0.798SS**  trans163.886171.600000112.3
221T37.9Very low39.4Very low145 Ų145134.1 Ų134.189%0.8980%0.795SS**  trans-54.5146.2-174.3-36.80000113.9
222A40.7Very low39.5Very low76 Ų76136.3 Ų136.363%0.62880%0.799SS**  trans-56.6153.5175.900000113.3
223D40.9Very low40.1Very low169 Ų169132.3 Ų132.390%0.90480%0.797SS**  -172.1129.1112.6-87.7-25000110.4
224G37.9Very low40Very low76 Ų76135.9 Ų135.978%0.78480%0.803SS**  trans-118.9122.8161.800000108
225C37.1Very low40.4Very low125 Ų125133.5 Ų133.585%0.84581%0.807SS**  trans155.9109.6137.5-156.90000110.4
226S38.7Very low40.9Very low111 Ų111129.2 Ų129.278%0.77680%0.799SS**  trans15.1162.4147.7-610000123
227P45.2Very low41.2Very low124 Ų124127.1 Ų127.181%0.80580%0.801SS**  cis-133.8-176.3-10.232.2-10.4000114.2
228S35.6Very low41.9Very low107 Ų107125.2 Ų125.275%0.74879%0.791SS**  trans111.5110.9144.4-1500000118.1
229S44.9Very low42.1Very low96 Ų96128.9 Ų128.967%0.67179%0.793SS**  trans72.7106.2135.6-51.20000121.2
230E42.4Very low42.3Very low186 Ų186127.6 Ų127.687%0.86979%0.79SS**  81.2127.2128.3-66.9-165.8111.800122
231A37.8Very low42.8Very low89 Ų89128.8 Ų128.874%0.73679%0.786SS**  trans70.4132.5144.200000117.9
232L42.3Very low43.2Very low165 Ų165127 Ų12786%0.86478%0.78SS**  cis-168.3160.34-101165.3000105.8
233P47.2Very low43.4Very low109 Ų109134.5 Ų134.571%0.70879%0.792SS**  trans-100.9157.6-167.637.9-32000113.9
234R41.1Very low43.7Very low254 Ų254130.5 Ų130.596%0.95878%0.782SS**  trans-165.7122.4149.4-112.3169.1-165.2172.24.7113.6
235A45.4Very low44Very low89 Ų89133.5 Ų133.574%0.73678%0.78SS**  trans-70.7-168.3164.300000111
236P49.9Very low44.3Very low112 Ų112138.1 Ų138.173%0.72778%0.779SS**  cis-143.3169.64.5235.3000118.5
237V50.8Low44.5Very low133 Ų133137.4 Ų137.481%0.80678%0.78SS**  trans-8.6177147.6-107.60000121
238P51.2Low44.7Very low98 Ų98139.1 Ų139.164%0.63678%0.783SS**  cis-149.8-169.9-4.732.7-7000118.1
239R42.9Very low45.2Very low244 Ų244139.3 Ų139.392%0.92178%0.784SS**  trans92.8118.4137.2-89.7171.5-170171.22.3121.4
240A41.6Very low45.6Very low94 Ų94138 Ų13878%0.77779%0.786SS**  176.4108.2126.700000107.9
241S46.6Very low45.7Very low103 Ų103137.4 Ų137.472%0.7279%0.788SS**  100.6116.663.674.30000113.6
242S47.4Very low46.3Very low108 Ų108141 Ų14176%0.75579%0.79SS**  trans73.514914584.50000117.5
243R44.8Very low47.1Very low233 Ų233136.8 Ų136.888%0.87978%0.779SS**  cis-172.4152.212.2-145171.9179.9168.4-1.6108.9
244A46.1Very low47.5Very low84 Ų84137.9 Ų137.969%0.69479%0.786SS**  trans65113.9147.200000119.3
245N44.7Very low48.1Very low139 Ų139135.7 Ų135.774%0.74378%0.778SS**  82.8124.664.2-85.1-20.8000115.8
246R43.5Very low48.3Very low222 Ų222137.3 Ų137.384%0.83878%0.781SS**  trans96.6110.2148.5-72.9-178.3-171.5102.60.7119.8
247A43.8Very low48.2Very low96 Ų96143.3 Ų143.379%0.79379%0.789SS**  58.3110.9124.600000118.2
248D48.4Very low48Very low160 Ų160147 Ų14786%0.85679%0.794SS**  trans-152.2136.7133.2-146.1-5.6000111.6
249S46.7Very low47.5Very low112 Ų112153.6 Ų153.678%0.78381%0.807SS**  trans-77131.2175.743.60000110.2
250G52.9Low47.3Very low68 Ų68150.1 Ų150.170%0.70180%0.801SS**  trans-156.7124.517500000111.9E252G250-E252 PolarHBondContact O-N 3.26Å
251D45.4Very low47.2Very low173 Ų173150.9 Ų150.993%0.92580%0.798SS**  trans-38114.3177.8-73.5-57.2000115.8
252E49.6Very low46.5Very low164 Ų164152.6 Ų152.677%0.76680%0.795SS**  trans-100.5100.7164.6-169.282.8-166.100108.9G250G250-E252 PolarHBondContact O-N 3.26Å
253A58.5Low45.9Very low78 Ų78153.2 Ų153.265%0.64579%0.794SS**PPolyproline II helixtrans-60.7145.6177.700000112.3R255A253-R255 PolarHBondContact O-N 2.92Å
254P55.7Low45.1Very low131 Ų131150 Ų15085%0.85178%0.782SS**PPolyproline II helixtrans-69.6120.1-175.8-11.526.1000111.1
255R53Low44.2Very low208 Ų208151.6 Ų151.679%0.78578%0.783SS**PPolyproline II helixtrans-59.8139.2174.5-63.9-159.6-170.3-158.55.3111.4A253 R257A253-R255 PolarHBondContact O-N 2.92Å; R255-R257 PolarHBondContact O-N 3.35Å
256P50.8Low43.5Very low124 Ų124152.7 Ų152.781%0.80578%0.778SS**PPolyproline II helixtrans-67.7118.4-178.626.5-32.5000110.7K258P256-K258 PolarHBondContact O-N 3.33Å
257R46.6Very low42.8Very low238 Ų238149.1 Ų149.190%0.89877%0.774SS**PPolyproline II helixtrans-60.7119170.9-67.9-178.7177.6176.4-0.9108.8R255 R259R255-R257 PolarHBondContact O-N 3.35Å; R257-R259 PolarHBondContact O-N 3.27Å; R257-R259 VanDerWaalsContact O-N 3.07Å
258K47.3Very low42Very low209 Ų209153.1 Ų153.191%0.90977%0.774SS**  trans-55.7112.4169.9-72.9-175.1176.7-177.90108.4P256 Q260P256-K258 PolarHBondContact O-N 3.33Å; K258-Q260 PolarHBondContact O-N 2.93Å
259R39.9Very low41Very low237 Ų237151.4 Ų151.489%0.89477%0.768SS**  trans-67.3126.5174.5-73.7-174.1176.5-169.6-0.8109.1R257R257-R259 PolarHBondContact O-N 3.27Å; R257-R259 VanDerWaalsContact O-N 3.07Å
260Q39.8Very low40.1Very low171 Ų171150.2 Ų150.280%0.79976%0.76SS**  trans-61.4146.5169.6-72.6-86.3-0.600109.9K258 E262K258-Q260 PolarHBondContact O-N 2.93Å; Q260-E262 PolarHBondContact O-N 3.1Å
261P39.3Very low38.9Very low111 Ų111157.9 Ų157.972%0.72177%0.768SS**  trans-68.4112.8177.926.7-31000110.6T263P261-T263 PolarHBondContact O-N 3.33Å
262E32.5Very low38.2Very low138 Ų138156.1 Ų156.165%0.64575%0.752SS**  trans-61.2115.3169.5-71.8173.2-174.100109.7Q260 R264Q260-E262 PolarHBondContact O-N 3.1Å; E262-R264 PolarHBondContact O-N 3.22Å; E262-R264 IonicContact OE2-CZ 3.22Å; E262-R264 IonicContact OE2-NE 2.92Å; E262-R264 PolarHBondContact OE2-NE 3.22Å; E262-R264 IonicContact OE2-NH2 3.14Å; E262-R264 PolarHBondContact OE2-NH2 2.93Å
263T33.6Very low37.4Very low122 Ų122159.3 Ų159.375%0.74876%0.757SS**  trans-77106.1171.1-61.70000109P261P261-T263 PolarHBondContact O-N 3.33Å
264R29.1Very low36.1Very low165 Ų165160.7 Ų160.762%0.62375%0.754SS**PPolyproline II helixtrans-94.6117.6175.2-65.5-177.5-179-176.20.4110.2E262 Y266E262-R264 PolarHBondContact O-N 3.22Å; E262-R264 IonicContact OE2-CZ 3.22Å; E262-R264 IonicContact OE2-NE 2.92Å; E262-R264 PolarHBondContact OE2-NE 3.22Å; E262-R264 IonicContact OE2-NH2 3.14Å; E262-R264 PolarHBondContact OE2-NH2 2.93Å; R264-Y266 HydrophobicContact CB-CE2 3.88Å
265V27Very low35.1Very low117 Ų117161.2 Ų161.271%0.70974%0.743SS**PPolyproline II helixtrans-91.2117.2173.4-178.50000109.1
266Y28.7Very low34.1Very low162 Ų162158.9 Ų158.964%0.63575%0.746SS**PPolyproline II helixtrans-98.2117.1174.8-66.1-85.6000110.3R264R264-Y266 HydrophobicContact CB-CE2 3.88Å
267I28.9Very low33.3Very low148 Ų148163 Ų16376%0.75975%0.746SS**  trans-94.7107.4171.6-57175.2000107.9V269I267-V269 HydrophobicContact CG2-CG2 4.14Å; I267-V269 PolarHBondContact O-N 3.41Å
268F27.7Very low32.5Very low180 Ų180156 Ų15679%0.78973%0.725SS**  trans-83.2108.6174.1-74.6-88000110.4
269V26.7Very low31.6Very low123 Ų123150.3 Ų150.375%0.74571%0.71SS**  trans-98.694.6169.7-175.70000108.7I267 R271I267-V269 HydrophobicContact CG2-CG2 4.14Å; I267-V269 PolarHBondContact O-N 3.41Å; V269-R271 PolarHBondContact O-N 3.1Å
270S28.5Very low31.1Very low87 Ų87146.5 Ų146.561%0.60870%0.7SS**  trans-74.3107.4174.4-68.60000110.4F272S270-F272 PolarHBondContact O-N 3.21Å; S270-F272 VanDerWaalsContact O-N 3.1Å
271R27.8Very low30.8Very low229 Ų229149.9 Ų149.986%0.86471%0.705SS**  trans-70.598.4166.3-78.2-176.6-178.4166.70.4109.1V269 R273V269-R271 PolarHBondContact O-N 3.1Å; R271-R273 VanDerWaalsContact C-N 3.33Å; R271-R273 PolarHBondContact O-N 2.98Å
272F30Very low30.3Very low137 Ų137147.9 Ų147.960%0.60169%0.691SS**  trans-70.392.2166.3-72.8-85.4000109.5S270 N274 F275S270-F272 PolarHBondContact O-N 3.21Å; S270-F272 VanDerWaalsContact O-N 3.1Å; F272-N274 PolarHBondContact O-N 3.05Å; F272-F275 HydrophobicContact CB-CD2 3.53Å; F272-F275 HydrophobicContact CB-CE2 3.45Å; F272-F275 VanDerWaalsContact CB-CE2 3.45Å; F272-F275 AromaticContact CD2-CE2 3.97Å; F272-F275 HydrophobicContact CD2-CE2 3.97Å; F272-F275 HydrophobicContact CG-CD2 4.35Å; F272-F275 AromaticContact CG-CE2 3.84Å; F272-F275 HydrophobicContact CG-CE2 3.84Å
273R33.5Very low30.2Very low230 Ų230146.6 Ų146.687%0.86869%0.692SS**THydrogen-bonded Turntrans-65118.8159.4-77.9-178.9170.1177.1-2.3105.9R271R271-R273 VanDerWaalsContact C-N 3.33Å; R271-R273 PolarHBondContact O-N 2.98Å
274N31.1Very low30Very low108 Ų108152.1 Ų152.158%0.57870%0.699SS**THydrogen-bonded Turntrans92.147.3171.2-133.6-2.5000117.8F272 N276 R277F272-N274 PolarHBondContact O-N 3.05Å; N274-N276 PolarHBondContact O-N 3.47Å; N274-N276 VanDerWaalsContact O-N 3.16Å; N274-R277 PolarHBondContact O-N 2.95Å
275F34.9Very low29.9Very low142 Ų142152.8 Ų152.862%0.62370%0.702SS**G310 helixtrans-57.7-22.3168.7-109.1-82.2000114.2F272 R277 I278F272-F275 HydrophobicContact CB-CD2 3.53Å; F272-F275 HydrophobicContact CB-CE2 3.45Å; F272-F275 VanDerWaalsContact CB-CE2 3.45Å; F272-F275 AromaticContact CD2-CE2 3.97Å; F272-F275 HydrophobicContact CD2-CE2 3.97Å; F272-F275 HydrophobicContact CG-CD2 4.35Å; F272-F275 AromaticContact CG-CE2 3.84Å; F272-F275 HydrophobicContact CG-CE2 3.84Å; F275-R277 PolarHBondContact O-N 2.98Å; F275-I278 HydrophobicContact CD1-CD1 4.43Å
276N32.9Very low30.1Very low158 Ų158150.3 Ų150.385%0.84569%0.694SS**G310 helixtrans-76.81.1-175.4-74.8-29.5000115N274N274-N276 PolarHBondContact O-N 3.47Å; N274-N276 VanDerWaalsContact O-N 3.16Å
277R32.7Very low30.2Very low211 Ų211145.6 Ų145.680%0.79669%0.689SS**G310 helixtrans-126.916.7-178.1-92.3-168.6177.9-166.10.9114.7N274 F275 P279N274-R277 PolarHBondContact O-N 2.95Å; F275-R277 PolarHBondContact O-N 2.98Å; R277-P279 WeakPolarHBondContact O-CD 3.48Å
278I30.1Very low30.4Very low90 Ų90141.4 Ų141.446%0.46267%0.673SS.*  trans-91.1103177.9-53.4176.6000108.9F275 F280F275-I278 HydrophobicContact CD1-CD1 4.43Å; I278-F280 PolarHBondContact O-N 3.46Å
279P28.5Very low30.5Very low91 Ų91140.9 Ų140.959%0.59167%0.666SS**  trans-64.3122172.126.1-33000109.2R277 R281R277-P279 WeakPolarHBondContact O-CD 3.48Å; P279-R281 PolarHBondContact O-N 2.99Å
280F30.5Very low30.9Very low157 Ų157137.1 Ų137.169%0.68965%0.653SS**G310 helixtrans-62.310.9179.8-72.3-84.6000115.2V40 I278 T282V40-F280 HydrophobicContact CG1-CZ 4.23Å; V40-F280 HydrophobicContact CG2-CE1 4.4Å; V40-F280 HydrophobicContact CG2-CZ 4.48Å; I278-F280 PolarHBondContact O-N 3.46Å; F280-T282 VanDerWaalsContact C-N 3.34Å; F280-T282 PolarHBondContact O-N 3.31Å
281R32.8Very low31.1Very low241 Ų241137.8 Ų137.891%0.90965%0.646SS**G310 helixtrans-85.32.9-179.2-78.9-167.5172-174.2-1.4114.7P279P279-R281 PolarHBondContact O-N 2.99Å
282T28.8Very low31.3Very low70 Ų70133.2 Ų133.243%0.42964%0.635SS.*G310 helixtrans-135.734.7-172-1.70000114.6F280 R284 R285 A286F280-T282 VanDerWaalsContact C-N 3.34Å; F280-T282 PolarHBondContact O-N 3.31Å; T282-R284 PolarHBondContact O-N 3.44Å; T282-R285 HydrophobicContact CG2-CB 3.62Å; T282-R285 PolarHBondContact O-N 3.42Å; T282-A286 PolarHBondContact O-N 3.33Å
283V31.3Very low31.6Very low110 Ų110131.5 Ų131.567%0.66764%0.635SS**Hα-helixtrans-58.9-27.8172.9-175.60000111.8R285V283-R285 VanDerWaalsContact C-N 3.31Å; V283-R285 PolarHBondContact O-N 3Å
284R28.9Very low31.6Very low238 Ų238127.9 Ų127.990%0.89862%0.622SS**Hα-helixtrans-69.3-21.3172.5-74-171.2177.3-176.5-0.5114.6T282T282-R284 PolarHBondContact O-N 3.44Å
285R27.4Very low31.7Very low179 Ų179128.8 Ų128.868%0.67563%0.626SS**Hα-helixtrans-94.3-19.7179.3-166.8-179.2-91.1-166.4-5.9112.8T282 V283 S288 Y289T282-R285 HydrophobicContact CG2-CB 3.62Å; T282-R285 PolarHBondContact O-N 3.42Å; V283-R285 VanDerWaalsContact C-N 3.31Å; V283-R285 PolarHBondContact O-N 3Å; R285-S288 WeakPolarHBondContact CA-OG 3.46Å; R285-S288 PolarHBondContact O-N 3.33Å; R285-S288 PolarHBondContact O-OG 2.85Å; R285-Y289 PolarHBondContact O-N 3.37Å
286A30.8Very low31.7Very low66 Ų66129 Ų12955%0.54563%0.634SS.*Hα-helixtrans-71.3-34.1171.200000111.8T282 S288 Y289 G290T282-A286 PolarHBondContact O-N 3.33Å; A286-S288 VanDerWaalsContact C-N 3.32Å; A286-S288 PolarHBondContact O-N 2.87Å; A286-Y289 PolarHBondContact O-N 2.89Å; A286-G290 PolarHBondContact O-N 3.31Å
287A31.1Very low31.7Very low63 Ų63126.3 Ų126.352%0.52162%0.623SS.*Hα-helixtrans-61.3-38.5172.700000112.2G290 E291A287-G290 PolarHBondContact O-N 3.19Å; A287-E291 WeakPolarHBondContact O-CB 3.45Å; A287-E291 WeakPolarHBondContact O-CG 3.43Å; A287-E291 PolarHBondContact O-N 3.41Å
288S31.6Very low31.5Very low60 Ų60123 Ų12342%0.4263%0.627SS.*Hα-helixtrans-71.9-32.2176.652.70000113.5R285 A286 Q292R285-S288 WeakPolarHBondContact CA-OG 3.46Å; R285-S288 PolarHBondContact O-N 3.33Å; R285-S288 PolarHBondContact O-OG 2.85Å; A286-S288 VanDerWaalsContact C-N 3.32Å; A286-S288 PolarHBondContact O-N 2.87Å; S288-Q292 WeakPolarHBondContact O-CB 3.42Å; S288-Q292 PolarHBondContact O-N 2.93Å
289Y30.5Very low31.6Very low168 Ų168122.2 Ų122.266%0.65963%0.627SS**Hα-helixtrans-72.9-34.7174.8-128.2-91.7000111.7R285 A286 V293R285-Y289 PolarHBondContact O-N 3.37Å; A286-Y289 PolarHBondContact O-N 2.89Å; Y289-V293 WeakPolarHBondContact O-CG2 3.39Å; Y289-V293 PolarHBondContact O-N 3.49Å
290G35.1Very low31.6Very low45 Ų45125.5 Ų125.546%0.46464%0.639SS.*Hα-helixtrans-70.3-33.4173.200000113.4A286 A287 R294A286-G290 PolarHBondContact O-N 3.31Å; A287-G290 PolarHBondContact O-N 3.19Å; G290-R294 WeakPolarHBondContact O-CB 3.43Å; G290-R294 PolarHBondContact O-N 2.75Å
291E33.5Very low31.4Very low101 Ų101129.8 Ų129.847%0.47265%0.65SS.*Hα-helixtrans-69.6-39.9171.2-86.9-97.5127.900112.5A287 V293 R294 N295A287-E291 WeakPolarHBondContact O-CB 3.45Å; A287-E291 WeakPolarHBondContact O-CG 3.43Å; A287-E291 PolarHBondContact O-N 3.41Å; E291-V293 VanDerWaalsContact C-N 3.33Å; E291-V293 PolarHBondContact O-N 3.28Å; E291-R294 WeakPolarHBondContact O-CA 3.33Å; E291-R294 WeakPolarHBondContact O-CB 3.02Å; E291-R294 PolarHBondContact O-N 3.24Å; E291-R294 IonicContact OE1-NH1 3.31Å; E291-N295 PolarHBondContact O-N 3.22Å; E291-N295 PolarHBondContact O-ND2 3.47Å
292Q32.2Very low31.3Very low133 Ų133124.2 Ų124.262%0.62164%0.638SS**Hα-helixtrans-67.4-33.5-178.6-158.8156.641.200112.5S288 R294S288-Q292 WeakPolarHBondContact O-CB 3.42Å; S288-Q292 PolarHBondContact O-N 2.93Å; Q292-R294 VanDerWaalsContact C-N 3.31Å
293V34.5Very low31.3Very low100 Ų100124.5 Ų124.561%0.60666%0.655SS**Hα-helixtrans-75.6-21.4171.5178.10000112.1Y289 E291Y289-V293 WeakPolarHBondContact O-CG2 3.39Å; Y289-V293 PolarHBondContact O-N 3.49Å; E291-V293 VanDerWaalsContact C-N 3.33Å; E291-V293 PolarHBondContact O-N 3.28Å
294R34Very low31.2Very low155 Ų155128 Ų12859%0.58566%0.661SS**Hα-helixtrans-76.6-20.5-179.5-136.5175.1-177.4-165.41.1113.7G290 E291 Q292 P299G290-R294 WeakPolarHBondContact O-CB 3.43Å; G290-R294 PolarHBondContact O-N 2.75Å; E291-R294 WeakPolarHBondContact O-CA 3.33Å; E291-R294 WeakPolarHBondContact O-CB 3.02Å; E291-R294 PolarHBondContact O-N 3.24Å; E291-R294 IonicContact OE1-NH1 3.31Å; Q292-R294 VanDerWaalsContact C-N 3.31Å; R294-P299 HydrophobicContact CG-CG 4.09Å
295N34.4Very low31.1Very low126 Ų126127 Ų12767%0.67466%0.657SS**SBendtrans-88.1-19.6-177-70.8-54.2000113.5E291E291-N295 PolarHBondContact O-N 3.22Å; E291-N295 PolarHBondContact O-ND2 3.47Å
296D34.3Very low31.1Very low146 Ų146124.7 Ų124.778%0.78166%0.658SS**SBendtrans-96.1-5.5-178.4-72.9-24000113.8
297V32.9Very low31.1Very low102 Ų102127.2 Ų127.262%0.61867%0.666SS**SBendtrans-145.4108.7-178.8-175.70000109.6P299V297-P299 WeakPolarHBondContact O-CD 3.25Å
298T28.5Very low31Very low142 Ų142130.3 Ų130.387%0.87167%0.673SS**  trans-48.8106.1175.3-44.10000110.9L300T298-L300 PolarHBondContact O-N 3.16Å
299P32.1Very low30.7Very low73 Ų73137 Ų13747%0.47469%0.69SS.*  trans-90.6110-175.325.3-14.8000109.4R294 V297 R301R294-P299 HydrophobicContact CG-CG 4.09Å; V297-P299 WeakPolarHBondContact O-CD 3.25Å; P299-R301 PolarHBondContact O-N 2.98Å
300L27.9Very low30.8Very low160 Ų160136.2 Ų136.284%0.83870%0.695SS**  trans-47.7113.6157.6-85.2156.7000108T298 L302T298-L300 PolarHBondContact O-N 3.16Å; L300-L302 VanDerWaalsContact C-N 3.3Å; L300-L302 PolarHBondContact O-N 2.99Å
301R27.3Very low30.8Very low247 Ų247143.2 Ų143.293%0.93272%0.722SS**  trans-64.385178.6-75-174.3174.6-171.70.3110P299P299-R301 PolarHBondContact O-N 2.98Å
302L29.9Very low30.7Very low125 Ų125145.4 Ų145.465%0.65474%0.735SS**  trans-102.988.9169.7-136.875.6000109.1L300 F304L300-L302 VanDerWaalsContact C-N 3.3Å; L300-L302 PolarHBondContact O-N 2.99Å; L302-F304 HydrophobicContact CB-CE2 4.49Å; L302-F304 HydrophobicContact CD2-CE1 4.2Å; L302-F304 HydrophobicContact CD2-CE2 4.4Å; L302-F304 HydrophobicContact CD2-CZ 3.83Å; L302-F304 PolarHBondContact O-N 3.04Å
303G29.2Very low30.6Very low75 Ų75146 Ų14677%0.77374%0.74SS**  trans-76.1109.4169.500000109.6R305G303-R305 PolarHBondContact O-N 3.48Å
304F28.3Very low30.4Very low184 Ų184148.6 Ų148.681%0.80775%0.748SS**  trans-76109.9174.5-67.4-85.2000109.9L302L302-F304 HydrophobicContact CB-CE2 4.49Å; L302-F304 HydrophobicContact CD2-CE1 4.2Å; L302-F304 HydrophobicContact CD2-CE2 4.4Å; L302-F304 HydrophobicContact CD2-CZ 3.83Å; L302-F304 PolarHBondContact O-N 3.04Å
305R27.2Very low30.2Very low216 Ų216148.2 Ų148.282%0.81576%0.758SS**  trans-89.9101167.1-163.7179.5-169.4-174.93107.4G303 V307G303-R305 PolarHBondContact O-N 3.48Å; R305-V307 HydrophobicContact CG-CG2 4.43Å; R305-V307 PolarHBondContact O-N 2.81Å; R305-V307 VanDerWaalsContact O-N 3.14Å
306L28.3Very low29.9Very low131 Ų131149.6 Ų149.669%0.68676%0.763SS**  trans-71.4103.7173.8-16578.9000108.3L308L306-L308 HydrophobicContact CD2-CD1 3.51Å; L306-L308 HydrophobicContact CG-CD1 3.91Å
307V29.6Very low29.6Very low119 Ų119149.8 Ų149.872%0.72176%0.762SS**  trans-93.1102.6171179.60000107.2R305R305-V307 HydrophobicContact CG-CG2 4.43Å; R305-V307 PolarHBondContact O-N 2.81Å; R305-V307 VanDerWaalsContact O-N 3.14Å
308L28.9Very low29.4Very low128 Ų128153.2 Ų153.267%0.6777%0.772SS**  trans-82.5115163.2-89.4100.3000108.3L306L306-L308 HydrophobicContact CD2-CD1 3.51Å; L306-L308 HydrophobicContact CG-CD1 3.91Å
309R26.8Very low29.4Very low202 Ų202154.1 Ų154.176%0.76276%0.764SS**  trans-86.3122.9160-177.6175.9173.7149.8-0.8107.2D311R309-D311 IonicContact CZ-OD1 3.69Å; R309-D311 IonicContact NE-OD1 2.96Å; R309-D311 PolarHBondContact NE-OD1 2.89Å; R309-D311 IonicContact NH2-OD1 3.4Å; R309-D311 PolarHBondContact NH2-OD1 3.4Å
310I32.8Very low29.2Very low151 Ų151160.8 Ų160.877%0.77479%0.788SS**  trans-107.1115.8167.6-56.9175.1000104.1
311D34.3Very low29.3Very low192 Ų192160.9 Ų160.9100%1.02778%0.784SS**  trans-77.90165.4-78.1-35.3000110R309R309-D311 IonicContact CZ-OD1 3.69Å; R309-D311 IonicContact NE-OD1 2.96Å; R309-D311 PolarHBondContact NE-OD1 2.89Å; R309-D311 IonicContact NH2-OD1 3.4Å; R309-D311 PolarHBondContact NH2-OD1 3.4Å

Retrieved 311 of 311 residues in 48.9 ms (Link to these results)