A0A096NDI0_PAPAN Loading...

Intraflagellar transport protein 57 homolog

AlphaFold DB (A0A2K5X5U5), UniProt , Accession A0A096NDI0, Species PAPAN (Papio anubis, Olive baboon), Gene IFT57, Length 429 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
1M40.5Very low31.8Very low239 Ų239136.1 Ų136.1100%1.17786%0.861SS**  099.90-75.8-178.6-168.300107.3
2T29.6Very low31.5Very low145 Ų145131.1 Ų131.189%0.8986%0.855SS**  trans-137.8109.7-174.229.50000106.6
3A32Very low31.5Very low106 Ų106134.4 Ų134.488%0.87686%0.859SS**PPolyproline II helixtrans-85.4139.9-176.800000110.8
4A31.5Very low31.4Very low101 Ų101138 Ų13884%0.83586%0.859SS**PPolyproline II helixtrans-79.9139-167.800000113.8
5L31.3Very low31.3Very low171 Ų171140.3 Ų140.390%0.89586%0.864SS**PPolyproline II helixtrans-81123.6155.9-92.3104.4000108.9
6A32.3Very low31.2Very low98 Ų98136 Ų13681%0.8186%0.856SS**  trans-97.8105.416900000109.8
7V32Very low31.1Very low121 Ų121135.8 Ų135.873%0.73385%0.852SS**  trans-76.5129.7159.8172.20000107.1T9V7-T9 HydrophobicContact CG1-CG2 4.3Å
8V29.5Very low31.5Very low137 Ų137134.9 Ų134.983%0.8385%0.849SS**  trans-122.4114.9165.3178.40000109.1
9T28.8Very low31.4Very low115 Ų115140.4 Ų140.471%0.70685%0.851SS**  trans-74.5149.4-179.343.40000112.8V7V7-T9 HydrophobicContact CG1-CG2 4.3Å
10T31.9Very low31.3Very low147 Ų147139.3 Ų139.390%0.90285%0.85SS**  trans-65.1133.2167.545.30000111.5
11S30.1Very low31.5Very low117 Ų117144 Ų14482%0.81885%0.852SS**  trans-121113.9166.2640000110.2
12G28.9Very low30.9Very low76 Ų76136 Ų13678%0.78483%0.831SS**  trans-77.4151.6166.400000111.3
13L30.7Very low31.3Very low174 Ų174138 Ų13891%0.91183%0.83SS**  trans-138.3109.1159.2-96.6157.7000106.8
14E30.4Very low31.1Very low185 Ų185136.4 Ų136.486%0.86482%0.824SS**  trans-70138.9165-64.4178.3142.300109
15D29.3Very low31.6Very low173 Ų173139.1 Ų139.193%0.92583%0.83SS**  trans-142.8115.7152.3-109.8-23000107.9
16G30.1Very low31.5Very low71 Ų71133.7 Ų133.773%0.73282%0.815SS**  trans-102.7132-179.900000111.9
17V29.6Very low31.6Very low132 Ų132137.8 Ų137.880%0.882%0.818SS**  trans-146.1131.1148-179.70000108.7
18P38.2Very low31.6Very low121 Ų121138 Ų13879%0.78682%0.819SS**  trans-90.7135.5-17734.7-30.5000111.4
19R30.3Very low32.1Very low239 Ų239137 Ų13790%0.90281%0.813SS**  trans-140.6108.2164.3-86.4-169.7165.4161-3.9113
20S28.9Very low32.8Very low117 Ų117136.7 Ų136.782%0.81881%0.811SS**  trans38.9109.7142-61.70000120.6G22S20-G22 PolarHBondContact O-N 3.42Å
21R35.2Very low33.1Very low239 Ų239138.9 Ų138.990%0.90281%0.81SS**  trans-8.8109.3136.9-166.6174.5173.6175.9-2.3114.7
22G27.4Very low34.6Very low71 Ų71140.6 Ų140.673%0.73280%0.799SS**  trans-138.6114.4160.500000108.1S20 G24S20-G22 PolarHBondContact O-N 3.42Å; G22-G24 PolarHBondContact O-N 3.46Å
23E38.5Very low36.5Very low188 Ų188139 Ų13988%0.87978%0.783SS**  trans-61.4129.6170.5-72.5167.4156.100109.3
24G28.8Very low38.2Very low71 Ų71137 Ų13773%0.73278%0.781SS**  trans-17399177.400000109.6G22 G26G22-G24 PolarHBondContact O-N 3.46Å; G24-G26 PolarHBondContact O-N 3.42Å
25T41.7Very low40Very low159 Ų159130.6 Ų130.698%0.97576%0.764SS**  trans-57.3101.8168.945.90000109.5
26G29.6Very low42Very low56 Ų56123.6 Ų123.658%0.57773%0.73SS**  trans-140.9108.817200000107.8G24 V28G24-G26 PolarHBondContact O-N 3.42Å; G26-V28 PolarHBondContact O-N 3.4Å
27E34.1Very low43.9Very low185 Ų185123.8 Ų123.886%0.86472%0.724SS**  trans-51.7110.7170.1-162.9172.1-162.200107.8V29E27-V29 PolarHBondContact O-N 3.21Å
28V31.2Very low46.3Very low124 Ų124125 Ų12575%0.75272%0.716SS**  trans-70.889.3177.1-177.50000106.5G26 V30G26-V28 PolarHBondContact O-N 3.4Å; V28-V30 HydrophobicContact CG1-CG2 4.11Å; V28-V30 PolarHBondContact O-N 2.98Å
29V40.2Very low48.3Very low118 Ų118123.9 Ų123.972%0.71570%0.7SS**  trans-68.989.7166.1-178.50000106E27 E31E27-V29 PolarHBondContact O-N 3.21Å; V29-E31 PolarHBondContact O-N 3.34Å; V29-E31 VanDerWaalsContact O-N 3.12Å
30V43.5Very low50.8Low108 Ų108114.1 Ų114.166%0.65567%0.665SS**  trans-56.8115.8164.3-179.90000105.7V28 R32V28-V30 HydrophobicContact CG1-CG2 4.11Å; V28-V30 PolarHBondContact O-N 2.98Å; V30-R32 VanDerWaalsContact C-N 3.25Å; V30-R32 PolarHBondContact O-N 3.1Å
31E38.8Very low53.5Low192 Ų192111.2 Ų111.290%0.89764%0.638SS**  trans-5792.6174.6-92.1-170.9148.400108.9V29 G33V29-E31 PolarHBondContact O-N 3.34Å; V29-E31 VanDerWaalsContact O-N 3.12Å; E31-G33 PolarHBondContact O-N 3.47Å
32R61.4Low56Low153 Ų153104 Ų10458%0.57762%0.62SS**  trans-68.7116.6175.9-105.7178-179.4-1650.8106.9V30 A36 E142V30-R32 VanDerWaalsContact C-N 3.25Å; V30-R32 PolarHBondContact O-N 3.1Å; R32-A36 HydrophobicContact CB-CB 3.48Å; R32-A36 VanDerWaalsContact CB-CB 3.48Å; R32-A36 HydrophobicContact CG-CB 3.54Å; R32-E142 IonicContact CZ-OE1 3.29Å; R32-E142 VanDerWaalsContact CZ-OE1 3.25Å; R32-E142 IonicContact CZ-OE2 2.99Å; R32-E142 VanDerWaalsContact NH1-CD 3.27Å; R32-E142 IonicContact NH1-OE1 3.45Å; R32-E142 PolarHBondContact NH1-OE1 2.83Å; R32-E142 IonicContact NH1-OE2 2.93Å; R32-E142 PolarHBondContact NH1-OE2 3.15Å; R32-E142 IonicContact NH2-OE1 3.94Å; R32-E142 PolarHBondContact NH2-OE1 2.94Å; R32-E142 IonicContact NH2-OE2 3.54Å
33G69.6Low58.8Low44 Ų44101.7 Ų101.745%0.45459%0.592SS.*  trans-54.2163.2178.600000112.6E31 G35 A36E31-G33 PolarHBondContact O-N 3.47Å; G33-G35 PolarHBondContact O-N 3.24Å; G33-A36 WeakPolarHBondContact O-CB 3.32Å; G33-A36 PolarHBondContact O-N 2.79Å
34P66Low61.1Low132 Ų13292.8 Ų92.886%0.85755%0.55SS**THydrogen-bonded Turntrans-58.6-20.4-170.120-31.5000114.8
35G67.8Low63.9Low49 Ų4992.9 Ų92.951%0.50553%0.531SS..THydrogen-bonded Turntrans-80-14.7174.100000115.3G33 A37 Y38 H39G33-G35 PolarHBondContact O-N 3.24Å; G35-A37 VanDerWaalsContact C-N 3.28Å; G35-A37 PolarHBondContact O-N 2.84Å; G35-Y38 PolarHBondContact O-N 3.35Å; G35-H39 PolarHBondContact O-N 2.99Å
36A71.3Confident66Low26 Ų2688.4 Ų88.422%0.21550%0.502CS..G310 helixtrans-67.3-29.1-174.800000113.1R32 G33 Y38 H39R32-A36 HydrophobicContact CB-CB 3.48Å; R32-A36 VanDerWaalsContact CB-CB 3.48Å; R32-A36 HydrophobicContact CG-CB 3.54Å; G33-A36 WeakPolarHBondContact O-CB 3.32Å; G33-A36 PolarHBondContact O-N 2.79Å; A36-Y38 PolarHBondContact O-N 3.45Å; A36-H39 WeakPolarHBondContact O-CB 3.35Å; A36-H39 PolarHBondContact O-N 3.42Å
37A69.8Low68.8Low75 Ų7585.7 Ų85.762%0.6247%0.474SS*.G310 helixtrans-61.9-25.1172.300000112.5G35G35-A37 VanDerWaalsContact C-N 3.28Å; G35-A37 PolarHBondContact O-N 2.84Å
38Y80.6Confident71.4Confident157 Ų15777.4 Ų77.462%0.61644%0.436SS*.G310 helixtrans-96-9.4-179.1-60-82.7000113.7G35 A36 M40 F41G35-Y38 PolarHBondContact O-N 3.35Å; A36-Y38 PolarHBondContact O-N 3.45Å; Y38-M40 PolarHBondContact O-N 2.82Å; Y38-F41 HydrophobicContact CD1-CD2 4.19Å; Y38-F41 HydrophobicContact CD1-CE2 4.26Å; Y38-F41 WeakPolarHBondContact O-CB 3.35Å; Y38-F41 PolarHBondContact O-N 3Å
39H80.7Confident74Confident99 Ų9976.1 Ų76.146%0.45842%0.422SS..Hα-helixtrans-57.9-36.6-177.4-175.957.1000112.6G35 A36 F41 V42 V43G35-H39 PolarHBondContact O-N 2.99Å; A36-H39 WeakPolarHBondContact O-CB 3.35Å; A36-H39 PolarHBondContact O-N 3.42Å; H39-F41 PolarHBondContact O-N 2.96Å; H39-V42 WeakPolarHBondContact O-CB 3.32Å; H39-V42 PolarHBondContact O-N 3.22Å; H39-V42 VanDerWaalsContact O-N 3.09Å; H39-V43 WeakPolarHBondContact O-CG2 3.36Å; H39-V43 PolarHBondContact O-N 3.38Å
40M81.9Confident76.3Confident34 Ų3471.3 Ų71.317%0.16739%0.391CS..Hα-helixtrans-58.1-32.3176.4177.4177.961.200113.5Y38 M44 A75 G141 E142Y38-M40 PolarHBondContact O-N 2.82Å; M40-M44 WeakPolarHBondContact O-CB 3.41Å; M40-M44 PolarHBondContact O-N 2.87Å; M40-A75 HydrophobicContact CE-CB 4.11Å; M40-A75 WeakPolarHBondContact CE-O 3.38Å; M40-A75 HydrophobicContact CG-CB 4.01Å; M40-A75 HydrophobicContact SD-CB 4.3Å; M40-G141 VanDerWaalsContact SD-CA 3.59Å; M40-E142 HydrophobicContact SD-CB 4.28Å; M40-E142 PolarHBondContact SD-N 3.46Å
41F86.3Confident78.3Confident55 Ų5566.1 Ų66.124%0.24136%0.36CS..Hα-helixtrans-73.3-37177-61.8-74000111.7Y38 H39 M44 E45 H72 A75 L76Y38-F41 HydrophobicContact CD1-CD2 4.19Å; Y38-F41 HydrophobicContact CD1-CE2 4.26Å; Y38-F41 WeakPolarHBondContact O-CB 3.35Å; Y38-F41 PolarHBondContact O-N 3Å; H39-F41 PolarHBondContact O-N 2.96Å; F41-M44 PolarHBondContact O-N 3.49Å; F41-E45 WeakPolarHBondContact O-CB 3.36Å; F41-E45 PolarHBondContact O-N 3.27Å; F41-H72 AromaticContact CD1-CD2 3.65Å; F41-H72 AromaticContact CE1-CD2 3.93Å; F41-A75 HydrophobicContact CD1-CB 3.62Å; F41-A75 HydrophobicContact CE1-CB 3.67Å; F41-L76 HydrophobicContact CE1-CD2 3.99Å; F41-L76 HydrophobicContact CE1-CG 4.02Å; F41-L76 HydrophobicContact CZ-CD2 3.92Å; F41-L76 HydrophobicContact CZ-CG 4.46Å
42V86.1Confident80.5Confident87 Ų8762.7 Ų62.753%0.52734%0.342SS..Hα-helixtrans-64.4-45.4175.4-176.70000110.3H39 M44 E45 D46H39-V42 WeakPolarHBondContact O-CB 3.32Å; H39-V42 PolarHBondContact O-N 3.22Å; H39-V42 VanDerWaalsContact O-N 3.09Å; V42-M44 VanDerWaalsContact C-N 3.32Å; V42-M44 PolarHBondContact O-N 3.09Å; V42-E45 PolarHBondContact O-N 3.05Å; V42-D46 PolarHBondContact O-N 2.86Å
43V86.3Confident81.6Confident24 Ų2458.6 Ų58.615%0.14533%0.331CS..Hα-helixtrans-63.4-39.2176.9178.10000111.2H39 L47 C145 D149H39-V43 WeakPolarHBondContact O-CG2 3.36Å; H39-V43 PolarHBondContact O-N 3.38Å; V43-L47 VanDerWaalsContact O-CB 3.24Å; V43-L47 WeakPolarHBondContact O-CB 3.37Å; V43-L47 PolarHBondContact O-N 3.46Å; V43-C145 HydrophobicContact CG1-CB 3.96Å; V43-D149 HydrophobicContact CG1-CB 3.95Å
44M87.6Confident82.3Confident0 Ų056.9 Ų56.90%031%0.311CS..Hα-helixtrans-66.7-38.9176.3-178.361.1-165.400112.2M40 F41 V42 L47 V48 P69 S70 R71 F74 A75M40-M44 WeakPolarHBondContact O-CB 3.41Å; M40-M44 PolarHBondContact O-N 2.87Å; F41-M44 PolarHBondContact O-N 3.49Å; V42-M44 VanDerWaalsContact C-N 3.32Å; V42-M44 PolarHBondContact O-N 3.09Å; M44-L47 PolarHBondContact O-N 3.32Å; M44-L47 HydrophobicContact SD-CD2 4.05Å; M44-V48 HydrophobicContact CE-CG2 3.64Å; M44-V48 WeakPolarHBondContact O-CG2 3.45Å; M44-V48 PolarHBondContact O-N 3.4Å; M44-P69 HydrophobicContact CE-CB 4.41Å; M44-S70 WeakPolarHBondContact CE-O 3.38Å; M44-R71 WeakPolarHBondContact CG-O 3.49Å; M44-F74 HydrophobicContact CE-CB 4.47Å; M44-F74 HydrophobicContact CE-CD2 3.73Å; M44-F74 HydrophobicContact SD-CB 3.83Å; M44-F74 HydrophobicContact SD-CD2 3.82Å; M44-F74 HydrophobicContact SD-CG 4.32Å; M44-A75 HydrophobicContact CB-CB 4.38Å
45E87.2Confident83Confident73 Ų7357.6 Ų57.634%0.34130%0.297SS..Hα-helixtrans-63.4-49.3176.5-175.3172.7-169.100111.4F41 V42 L47 V48 E49 R71F41-E45 WeakPolarHBondContact O-CB 3.36Å; F41-E45 PolarHBondContact O-N 3.27Å; V42-E45 PolarHBondContact O-N 3.05Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.86Å; E45-V48 PolarHBondContact O-N 3.3Å; E45-V48 VanDerWaalsContact O-N 3.15Å; E45-E49 PolarHBondContact O-N 3.43Å; E45-E49 VanDerWaalsContact O-N 3.09Å; E45-R71 IonicContact OE1-CZ 3.99Å; E45-R71 IonicContact OE1-NE 2.61Å; E45-R71 IonicContact OE1-NH2 2.65Å; E45-R71 PolarHBondContact OE1-NH2 2.88Å
46D86.6Confident83.7Confident65 Ų6555.4 Ų55.435%0.34827%0.274SS..Hα-helixtrans-59.9-42.6175.5-171.924.3000111.5V42 V48 E49 K50V42-D46 PolarHBondContact O-N 2.86Å; D46-V48 PolarHBondContact O-N 2.9Å; D46-E49 PolarHBondContact O-N 2.71Å; D46-E49 VanDerWaalsContact O-N 3.16Å; D46-K50 VanDerWaalsContact CG-CE 3.46Å; D46-K50 WeakPolarHBondContact O-CG 3.29Å; D46-K50 PolarHBondContact O-N 3.42Å; D46-K50 VanDerWaalsContact OD1-CE 3.29Å; D46-K50 WeakPolarHBondContact OD1-CE 3.32Å; D46-K50 IonicContact OD1-NZ 3.83Å; D46-K50 WeakPolarHBondContact OD2-CE 3.48Å; D46-K50 IonicContact OD2-NZ 2.67Å; D46-K50 PolarHBondContact OD2-NZ 2.85Å
47L88.5Confident84Confident0 Ų058.9 Ų58.90%029%0.285CS..Hα-helixtrans-57.4-45.8173.6172.862.7000112V43 M44 E45 E49 K50 L51 L148 A152V43-L47 VanDerWaalsContact O-CB 3.24Å; V43-L47 WeakPolarHBondContact O-CB 3.37Å; V43-L47 PolarHBondContact O-N 3.46Å; M44-L47 PolarHBondContact O-N 3.32Å; M44-L47 HydrophobicContact SD-CD2 4.05Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.86Å; L47-E49 VanDerWaalsContact C-N 3.28Å; L47-E49 PolarHBondContact O-N 2.98Å; L47-K50 PolarHBondContact O-N 3.39Å; L47-L51 HydrophobicContact CD1-CD1 4.06Å; L47-L51 HydrophobicContact CD1-CD2 4.49Å; L47-L51 HydrophobicContact CD1-CG 3.99Å; L47-L51 HydrophobicContact CG-CD1 4Å; L47-L51 HydrophobicContact CG-CG 4.35Å; L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 WeakPolarHBondContact O-CG 3.43Å; L47-L51 PolarHBondContact O-N 2.87Å; L47-L148 HydrophobicContact CD1-CB 3.96Å; L47-L148 HydrophobicContact CD2-CB 3.57Å; L47-L148 HydrophobicContact CD2-CD1 3.98Å; L47-L148 HydrophobicContact CD2-CG 4.45Å; L47-L148 HydrophobicContact CG-CB 4.44Å; L47-A152 HydrophobicContact CD1-CB 3.87Å
48V87.5Confident84.2Confident10 Ų1060 Ų606%0.06128%0.278CS..Hα-helixtrans-62.7-38178.5169.80000111.2M44 E45 D46 L51 K52M44-V48 HydrophobicContact CE-CG2 3.64Å; M44-V48 WeakPolarHBondContact O-CG2 3.45Å; M44-V48 PolarHBondContact O-N 3.4Å; E45-V48 PolarHBondContact O-N 3.3Å; E45-V48 VanDerWaalsContact O-N 3.15Å; D46-V48 PolarHBondContact O-N 2.9Å; V48-L51 PolarHBondContact O-N 2.85Å; V48-K52 HydrophobicContact CG1-CD 4.47Å; V48-K52 WeakPolarHBondContact O-CG 3.27Å; V48-K52 PolarHBondContact O-N 2.84Å
49E87.4Confident84.1Confident97 Ų9754.7 Ų54.745%0.45326%0.259SS..Hα-helixtrans-66.1-47.8175.1-67.7-175.6-179.600111.7E45 D46 L47 L51 K52 L53E45-E49 PolarHBondContact O-N 3.43Å; E45-E49 VanDerWaalsContact O-N 3.09Å; D46-E49 PolarHBondContact O-N 2.71Å; D46-E49 VanDerWaalsContact O-N 3.16Å; L47-E49 VanDerWaalsContact C-N 3.28Å; L47-E49 PolarHBondContact O-N 2.98Å; E49-L51 VanDerWaalsContact C-N 3.29Å; E49-L51 PolarHBondContact O-N 3.28Å; E49-K52 WeakPolarHBondContact O-CB 3.49Å; E49-K52 PolarHBondContact O-N 2.89Å; E49-K52 VanDerWaalsContact O-N 3.1Å; E49-L53 WeakPolarHBondContact O-CG 3.26Å; E49-L53 PolarHBondContact O-N 3.38Å
50K87.1Confident84Confident17 Ų1750.2 Ų50.27%0.07424%0.238CC..Hα-helixtrans-56.2-42.8174-70.4170.4-1781630111.6D46 L47 L53 L54 D149 A152 E153 L156D46-K50 VanDerWaalsContact CG-CE 3.46Å; D46-K50 WeakPolarHBondContact O-CG 3.29Å; D46-K50 PolarHBondContact O-N 3.42Å; D46-K50 VanDerWaalsContact OD1-CE 3.29Å; D46-K50 WeakPolarHBondContact OD1-CE 3.32Å; D46-K50 IonicContact OD1-NZ 3.83Å; D46-K50 WeakPolarHBondContact OD2-CE 3.48Å; D46-K50 IonicContact OD2-NZ 2.67Å; D46-K50 PolarHBondContact OD2-NZ 2.85Å; L47-K50 PolarHBondContact O-N 3.39Å; K50-L53 WeakPolarHBondContact O-CB 3.41Å; K50-L53 PolarHBondContact O-N 3.35Å; K50-L54 WeakPolarHBondContact O-CG 3.32Å; K50-L54 PolarHBondContact O-N 3.36Å; K50-L54 VanDerWaalsContact O-N 3.09Å; K50-D149 WeakPolarHBondContact CD-OD1 3.33Å; K50-D149 IonicContact NZ-OD1 2.98Å; K50-D149 PolarHBondContact NZ-OD1 3.3Å; K50-D149 IonicContact NZ-OD2 3.52Å; K50-D149 PolarHBondContact NZ-OD2 2.83Å; K50-A152 HydrophobicContact CB-CB 4.09Å; K50-A152 HydrophobicContact CD-CB 4.47Å; K50-E153 HydrophobicContact CD-CG 4.11Å; K50-E153 IonicContact NZ-OE1 2.68Å; K50-E153 PolarHBondContact NZ-OE1 3.15Å; K50-L156 HydrophobicContact CB-CD1 3.76Å; K50-L156 HydrophobicContact CD-CD1 4.46Å; K50-L156 HydrophobicContact CG-CD1 3.72Å
51L85.8Confident83.7Confident0 Ų049.4 Ų49.40%023%0.234CC..Hα-helixtrans-63.4-41.7176-72173.9000112.4L47 V48 E49 L53 L54 R55 Y56 L90 W93 L94L47-L51 HydrophobicContact CD1-CD1 4.06Å; L47-L51 HydrophobicContact CD1-CD2 4.49Å; L47-L51 HydrophobicContact CD1-CG 3.99Å; L47-L51 HydrophobicContact CG-CD1 4Å; L47-L51 HydrophobicContact CG-CG 4.35Å; L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 WeakPolarHBondContact O-CG 3.43Å; L47-L51 PolarHBondContact O-N 2.87Å; V48-L51 PolarHBondContact O-N 2.85Å; E49-L51 VanDerWaalsContact C-N 3.29Å; E49-L51 PolarHBondContact O-N 3.28Å; L51-L53 VanDerWaalsContact C-N 3.33Å; L51-L53 PolarHBondContact O-N 2.97Å; L51-L54 CarbonylContact O-C 3.6Å; L51-L54 WeakPolarHBondContact O-CA 3.33Å; L51-L54 WeakPolarHBondContact O-CB 3.46Å; L51-L54 PolarHBondContact O-N 2.92Å; L51-L54 VanDerWaalsContact O-N 3.12Å; L51-R55 PolarHBondContact O-N 2.88Å; L51-Y56 HydrophobicContact CB-CD1 3.66Å; L51-Y56 HydrophobicContact CB-CD2 4.31Å; L51-Y56 HydrophobicContact CB-CE1 4.08Å; L51-Y56 HydrophobicContact CB-CG 3.79Å; L51-Y56 WeakPolarHBondContact O-CB 3.34Å; L51-Y56 WeakPolarHBondContact O-CD1 3.25Å; L51-Y56 PolarHBondContact O-N 3.35Å; L51-L90 HydrophobicContact CD1-CD2 4.04Å; L51-L90 HydrophobicContact CD2-CD1 3.93Å; L51-W93 HydrophobicContact CD2-CZ3 4.16Å; L51-L94 HydrophobicContact CD2-CD1 4.4Å; L51-L94 HydrophobicContact CD2-CD2 3.97Å
52K86Confident83.1Confident119 Ų11955.1 Ų55.152%0.51725%0.254SS..Hα-helixtrans-61.3-41.6174.4-75.3173.7179.4-179.90111.8V48 E49 L54 R55 Y56V48-K52 HydrophobicContact CG1-CD 4.47Å; V48-K52 WeakPolarHBondContact O-CG 3.27Å; V48-K52 PolarHBondContact O-N 2.84Å; E49-K52 WeakPolarHBondContact O-CB 3.49Å; E49-K52 PolarHBondContact O-N 2.89Å; E49-K52 VanDerWaalsContact O-N 3.1Å; K52-L54 PolarHBondContact O-N 3.36Å; K52-R55 PolarHBondContact O-N 2.79Å; K52-Y56 HydrophobicContact CG-CE1 3.96Å
53L84.3Confident82.6Confident67 Ų6759.2 Ų59.235%0.35127%0.265SS..Hα-helixtrans-60.6-33.7174.3-65176.8000112E49 K50 L51 R55 L156 F161 W163E49-L53 WeakPolarHBondContact O-CG 3.26Å; E49-L53 PolarHBondContact O-N 3.38Å; K50-L53 WeakPolarHBondContact O-CB 3.41Å; K50-L53 PolarHBondContact O-N 3.35Å; L51-L53 VanDerWaalsContact C-N 3.33Å; L51-L53 PolarHBondContact O-N 2.97Å; L53-R55 PolarHBondContact O-N 3.12Å; L53-L156 HydrophobicContact CB-CD2 3.92Å; L53-F161 HydrophobicContact CD1-CD1 4.39Å; L53-F161 HydrophobicContact CD1-CE1 3.84Å; L53-F161 HydrophobicContact CD1-CE2 4.47Å; L53-F161 HydrophobicContact CD1-CZ 3.89Å; L53-F161 HydrophobicContact CD2-CE1 4.46Å; L53-F161 HydrophobicContact CD2-CE2 3.89Å; L53-F161 HydrophobicContact CD2-CZ 3.66Å; L53-F161 HydrophobicContact CG-CZ 4.29Å; L53-W163 HydrophobicContact CD1-CH2 4.24Å
54L83.6Confident81.7Confident8 Ų860.1 Ų60.14%0.04227%0.272CS..THydrogen-bonded Turntrans-79.43.6174.6-64.4171.2000114.1K50 L51 K52 Y56 W93 L94 A152 A155 L156 I159K50-L54 WeakPolarHBondContact O-CG 3.32Å; K50-L54 PolarHBondContact O-N 3.36Å; K50-L54 VanDerWaalsContact O-N 3.09Å; L51-L54 CarbonylContact O-C 3.6Å; L51-L54 WeakPolarHBondContact O-CA 3.33Å; L51-L54 WeakPolarHBondContact O-CB 3.46Å; L51-L54 PolarHBondContact O-N 2.92Å; L51-L54 VanDerWaalsContact O-N 3.12Å; K52-L54 PolarHBondContact O-N 3.36Å; L54-Y56 PolarHBondContact O-N 3.41Å; L54-W93 HydrophobicContact CB-CH2 3.8Å; L54-W93 HydrophobicContact CB-CZ3 4.29Å; L54-W93 HydrophobicContact CD1-CZ3 4.41Å; L54-L94 HydrophobicContact CD1-CD2 3.66Å; L54-A152 HydrophobicContact CD1-CB 4.39Å; L54-A155 HydrophobicContact CD1-CB 4Å; L54-A155 HydrophobicContact CD2-CB 4.21Å; L54-L156 HydrophobicContact CD1-CG 4.28Å; L54-L156 HydrophobicContact CD2-CD2 3.52Å; L54-L156 HydrophobicContact CD2-CG 3.82Å; L54-L156 HydrophobicContact CG-CD2 3.75Å; L54-L156 HydrophobicContact CG-CG 3.96Å; L54-I159 HydrophobicContact CD2-CD1 3.27Å
55R81.2Confident80.9Confident147 Ų14767.7 Ų67.756%0.55531%0.312SS*.THydrogen-bonded Turntrans51.440.5-176.1-59.3-172.6-60.3-151-0.2113.5L51 K52 L53 E57 E58 E59L51-R55 PolarHBondContact O-N 2.88Å; K52-R55 PolarHBondContact O-N 2.79Å; L53-R55 PolarHBondContact O-N 3.12Å; R55-E57 PolarHBondContact O-N 2.67Å; R55-E57 VanDerWaalsContact O-N 3.14Å; R55-E58 PolarHBondContact O-N 3.43Å; R55-E58 VanDerWaalsContact O-N 3.17Å; R55-E59 HydrophobicContact CB-CG 4.48Å; R55-E59 IonicContact CZ-OE1 2.62Å; R55-E59 IonicContact NE-OE1 3.87Å; R55-E59 PolarHBondContact NE-OE1 2.86Å; R55-E59 IonicContact NH2-OE1 3.57Å; R55-E59 PolarHBondContact NH2-OE1 3.27Å; R55-E59 PolarHBondContact O-N 2.84Å; R55-E59 VanDerWaalsContact O-N 3.07Å
56Y81.4Confident80.4Confident4 Ų466.2 Ų66.22%0.01631%0.307CS..Hα-helixtrans-59.4-26.5-178.186.4-66.7000113.4L51 K52 L54 E58 F60 L61 P69L51-Y56 HydrophobicContact CB-CD1 3.66Å; L51-Y56 HydrophobicContact CB-CD2 4.31Å; L51-Y56 HydrophobicContact CB-CE1 4.08Å; L51-Y56 HydrophobicContact CB-CG 3.79Å; L51-Y56 WeakPolarHBondContact O-CB 3.34Å; L51-Y56 WeakPolarHBondContact O-CD1 3.25Å; L51-Y56 PolarHBondContact O-N 3.35Å; K52-Y56 HydrophobicContact CG-CE1 3.96Å; L54-Y56 PolarHBondContact O-N 3.41Å; Y56-E58 PolarHBondContact O-N 3Å; Y56-F60 WeakPolarHBondContact O-CA 3.31Å; Y56-F60 VanDerWaalsContact O-CB 3.28Å; Y56-F60 WeakPolarHBondContact O-CB 3.36Å; Y56-F60 PolarHBondContact O-N 3.49Å; Y56-L61 HydrophobicContact CD2-CD1 4.14Å; Y56-L61 HydrophobicContact CD2-CD2 4.35Å; Y56-L61 HydrophobicContact CD2-CG 3.99Å; Y56-L61 HydrophobicContact CE2-CD1 3.61Å; Y56-L61 HydrophobicContact CE2-CD2 4.2Å; Y56-L61 HydrophobicContact CE2-CG 3.92Å; Y56-L61 PolarHBondContact O-N 3.17Å; Y56-P69 HydrophobicContact CE2-CG 4Å
57E77.6Confident79.9Confident99 Ų9971.8 Ų71.846%0.46333%0.328SS..Iπ-helixtrans-66.2-38.4178.5-56.5-173.4171.400112.7R55 L61 R62R55-E57 PolarHBondContact O-N 2.67Å; R55-E57 VanDerWaalsContact O-N 3.14Å; E57-L61 HydrophobicContact CB-CD1 4.26Å; E57-L61 HydrophobicContact CG-CD1 4.05Å; E57-R62 PolarHBondContact O-N 3.23Å
58E75.3Confident79.2Confident98 Ų9874.1 Ų74.146%0.45835%0.348SS..Iπ-helixtrans-86.9-39.6-179.2-54.7-159.4121.100112.1R55 Y56 R62R55-E58 PolarHBondContact O-N 3.43Å; R55-E58 VanDerWaalsContact O-N 3.17Å; Y56-E58 PolarHBondContact O-N 3Å; E58-R62 WeakPolarHBondContact O-CB 3.37Å; E58-R62 IonicContact OE1-NH1 3.36Å; E58-R62 IonicContact OE1-NH2 3.29Å; E58-R62 PolarHBondContact OE1-NH2 3.49Å
59E77.8Confident78.7Confident46 Ų4674.1 Ų74.122%0.21535%0.348CS..Iπ-helixtrans-93.4-24-168.9-62.2-167.8-160.600113.7R55 K63 W93 K97R55-E59 HydrophobicContact CB-CG 4.48Å; R55-E59 IonicContact CZ-OE1 2.62Å; R55-E59 IonicContact NE-OE1 3.87Å; R55-E59 PolarHBondContact NE-OE1 2.86Å; R55-E59 IonicContact NH2-OE1 3.57Å; R55-E59 PolarHBondContact NH2-OE1 3.27Å; R55-E59 PolarHBondContact O-N 2.84Å; R55-E59 VanDerWaalsContact O-N 3.07Å; E59-K63 WeakPolarHBondContact O-CD 3.43Å; E59-W93 HydrophobicContact CB-CZ2 4.19Å; E59-K97 WeakPolarHBondContact OE2-CE 3.44Å; E59-K97 IonicContact OE2-NZ 3.74Å; E59-K97 PolarHBondContact OE2-NZ 2.83Å
60F77.7Confident78.3Confident4 Ų472.7 Ų72.72%0.01835%0.348CS..Iπ-helixtrans-115.1-59.8179.7175.1-105.1000111.9Y56 R62 K63 S64 L66 L90 W93Y56-F60 WeakPolarHBondContact O-CA 3.31Å; Y56-F60 VanDerWaalsContact O-CB 3.28Å; Y56-F60 WeakPolarHBondContact O-CB 3.36Å; Y56-F60 PolarHBondContact O-N 3.49Å; F60-R62 PolarHBondContact O-N 2.89Å; F60-K63 PolarHBondContact O-N 3.38Å; F60-K63 VanDerWaalsContact O-N 3.1Å; F60-S64 PolarHBondContact O-N 3.43Å; F60-S64 PolarHBondContact O-OG 3.36Å; F60-L66 HydrophobicContact CE1-CD1 3.99Å; F60-L66 HydrophobicContact CZ-CD1 3.87Å; F60-L90 HydrophobicContact CD1-CD1 4.19Å; F60-L90 HydrophobicContact CE1-CB 4.5Å; F60-L90 HydrophobicContact CE1-CD1 4Å; F60-L90 HydrophobicContact CZ-CB 4.3Å; F60-L90 HydrophobicContact CZ-CD1 4.4Å; F60-W93 HydrophobicContact CB-CD2 3.93Å; F60-W93 HydrophobicContact CB-CG 4.11Å; F60-W93 HydrophobicContact CB-CZ2 4.2Å; F60-W93 HydrophobicContact CD2-CB 3.63Å; F60-W93 AromaticContact CD2-CD1 3.76Å; F60-W93 HydrophobicContact CD2-CD2 4.16Å; F60-W93 AromaticContact CD2-CG 3.56Å; F60-W93 HydrophobicContact CD2-CG 3.56Å; F60-W93 HydrophobicContact CE2-CB 3.86Å; F60-W93 HydrophobicContact CE2-CG 4.3Å; F60-W93 HydrophobicContact CG-CB 4.48Å; F60-W93 HydrophobicContact CG-CD2 4.21Å; F60-W93 HydrophobicContact CG-CG 4.1Å
61L77.3Confident78Confident17 Ų1778.8 Ų78.89%0.08937%0.371CS..Iπ-helixtrans-61.5-41.3-173.5-62.5-177.8000112.9Y56 E57 K63 S64 N65 L66 A68Y56-L61 HydrophobicContact CD2-CD1 4.14Å; Y56-L61 HydrophobicContact CD2-CD2 4.35Å; Y56-L61 HydrophobicContact CD2-CG 3.99Å; Y56-L61 HydrophobicContact CE2-CD1 3.61Å; Y56-L61 HydrophobicContact CE2-CD2 4.2Å; Y56-L61 HydrophobicContact CE2-CG 3.92Å; Y56-L61 PolarHBondContact O-N 3.17Å; E57-L61 HydrophobicContact CB-CD1 4.26Å; E57-L61 HydrophobicContact CG-CD1 4.05Å; L61-K63 VanDerWaalsContact C-N 3.31Å; L61-K63 PolarHBondContact O-N 2.96Å; L61-S64 PolarHBondContact O-N 3.02Å; L61-N65 WeakPolarHBondContact O-CA 3.45Å; L61-N65 PolarHBondContact O-N 3.35Å; L61-L66 HydrophobicContact CD2-CB 3.96Å; L61-L66 PolarHBondContact O-N 2.88Å; L61-A68 HydrophobicContact CD1-CB 3.68Å
62R73.2Confident78Confident176 Ų17683.2 Ų83.266%0.66439%0.391SS*.Hα-helixtrans-66.5-30.1178.2-164179.5-67.1156.43113.1E57 E58 F60E57-R62 PolarHBondContact O-N 3.23Å; E58-R62 WeakPolarHBondContact O-CB 3.37Å; E58-R62 IonicContact OE1-NH1 3.36Å; E58-R62 IonicContact OE1-NH2 3.29Å; E58-R62 PolarHBondContact OE1-NH2 3.49Å; F60-R62 PolarHBondContact O-N 2.89Å
63K74.2Confident78Confident172 Ų17278.8 Ų78.875%0.74837%0.371SS*.Hα-helixtrans-83.1-35.3178.5-68.4-172.2-175.3171.90112.5E59 F60 L61E59-K63 WeakPolarHBondContact O-CD 3.43Å; F60-K63 PolarHBondContact O-N 3.38Å; F60-K63 VanDerWaalsContact O-N 3.1Å; L61-K63 VanDerWaalsContact C-N 3.31Å; L61-K63 PolarHBondContact O-N 2.96Å
64S68.1Low78.1Confident43 Ų4375.6 Ų75.630%0.30136%0.355SS..Hα-helixtrans-94.4-2.4-176.8-580000113.6F60 L61 L66F60-S64 PolarHBondContact O-N 3.43Å; F60-S64 PolarHBondContact O-OG 3.36Å; L61-S64 PolarHBondContact O-N 3.02Å; S64-L66 PolarHBondContact O-N 2.9Å
65N71.9Confident78.3Confident159 Ų15975.4 Ų75.485%0.8536%0.355SS*.THydrogen-bonded Turntrans51.734.6-175.4-161.336.5000113.4L61L61-N65 WeakPolarHBondContact O-CA 3.45Å; L61-N65 PolarHBondContact O-N 3.35Å
66L75.3Confident78.5Confident43 Ų4372.3 Ų72.323%0.22535%0.348CS..PPolyproline II helixtrans-96.3146.3-178.4-67.8174.1000110.7F60 L61 S64 Y85 M86F60-L66 HydrophobicContact CE1-CD1 3.99Å; F60-L66 HydrophobicContact CZ-CD1 3.87Å; L61-L66 HydrophobicContact CD2-CB 3.96Å; L61-L66 PolarHBondContact O-N 2.88Å; S64-L66 PolarHBondContact O-N 2.9Å; L66-Y85 HydrophobicContact CD2-CE1 4.37Å; L66-M86 HydrophobicContact CD1-CG 4.44Å
67K76.3Confident78.8Confident181 Ų18176 Ų7679%0.78737%0.373SS*.PPolyproline II helixtrans-74.7142.4176-170.8175.3179.3179.70110.3
68A74.6Confident79.1Confident50 Ų5076 Ų7641%0.41338%0.379SS..PPolyproline II helixtrans-58126.5176.100000111.1L61 S70L61-A68 HydrophobicContact CD1-CB 3.68Å; A68-S70 PolarHBondContact O-N 3.43Å
69P76.1Confident79.5Confident10 Ų1075 Ų757%0.06538%0.377CS..PPolyproline II helixtrans-63.3131.9176.525.9-30.5000109.6M44 Y56 Y73 M86M44-P69 HydrophobicContact CE-CB 4.41Å; Y56-P69 HydrophobicContact CE2-CG 4Å; P69-Y73 HydrophobicContact CB-CD1 3.97Å; P69-Y73 HydrophobicContact CB-CG 3.82Å; P69-M86 HydrophobicContact CB-CE 4.27Å; P69-M86 HydrophobicContact CB-SD 4.14Å; P69-M86 HydrophobicContact CG-SD 4.43Å
70S79.7Confident79.9Confident66 Ų6675.8 Ų75.846%0.46239%0.387SS..PPolyproline II helixtrans-69164.1172.176.80000110.9M44 A68 H72 Y73M44-S70 WeakPolarHBondContact CE-O 3.38Å; A68-S70 PolarHBondContact O-N 3.43Å; S70-H72 PolarHBondContact O-N 2.88Å; S70-H72 PolarHBondContact OG-N 3.39Å; S70-Y73 VanDerWaalsContact O-CB 3.31Å; S70-Y73 WeakPolarHBondContact O-CB 3.45Å; S70-Y73 PolarHBondContact O-N 3.32Å; S70-Y73 PolarHBondContact OG-N 3.44Å
71R80.8Confident80.2Confident145 Ų14577.9 Ų77.955%0.54741%0.41SS..THydrogen-bonded Turntrans-54.7-13.3176.9-65.2173.299.5164.87.2114.6M44 E45M44-R71 WeakPolarHBondContact CG-O 3.49Å; E45-R71 IonicContact OE1-CZ 3.99Å; E45-R71 IonicContact OE1-NE 2.61Å; E45-R71 IonicContact OE1-NH2 2.65Å; E45-R71 PolarHBondContact OE1-NH2 2.88Å
72H85Confident80.6Confident94 Ų9481.8 Ų81.844%0.43543%0.428SS..THydrogen-bonded Turntrans-120.77.3-178.2-49.585.9000112.6F41 S70 F74 A75 L76F41-H72 AromaticContact CD1-CD2 3.65Å; F41-H72 AromaticContact CE1-CD2 3.93Å; S70-H72 PolarHBondContact O-N 2.88Å; S70-H72 PolarHBondContact OG-N 3.39Å; H72-F74 PolarHBondContact O-N 3.08Å; H72-A75 PolarHBondContact O-N 3.01Å; H72-A75 VanDerWaalsContact O-N 3.12Å; H72-L76 HydrophobicContact CB-CD1 4.05Å; H72-L76 HydrophobicContact CB-CG 4.36Å; H72-L76 PolarHBondContact O-N 3.29Å
73Y86.5Confident81.3Confident25 Ų2573.4 Ų73.410%0.09840%0.396CS..THydrogen-bonded Turntrans-61.5-43.2-165.4-173.8-92.5000114P69 S70 E82 Q83 M86P69-Y73 HydrophobicContact CB-CD1 3.97Å; P69-Y73 HydrophobicContact CB-CG 3.82Å; S70-Y73 VanDerWaalsContact O-CB 3.31Å; S70-Y73 WeakPolarHBondContact O-CB 3.45Å; S70-Y73 PolarHBondContact O-N 3.32Å; S70-Y73 PolarHBondContact OG-N 3.44Å; Y73-E82 PolarHBondContact OH-OE1 3.47Å; Y73-Q83 HydrophobicContact CE1-CB 4.5Å; Y73-Q83 HydrophobicContact CE1-CG 3.86Å; Y73-Q83 PolarHBondContact O-NE2 2.93Å; Y73-M86 HydrophobicContact CD1-CE 3.78Å; Y73-M86 HydrophobicContact CD1-SD 3.87Å; Y73-M86 HydrophobicContact CD2-CE 4.4Å; Y73-M86 HydrophobicContact CE1-CB 4.27Å; Y73-M86 HydrophobicContact CE1-CE 3.13Å; Y73-M86 HydrophobicContact CE1-CG 4.48Å; Y73-M86 HydrophobicContact CE1-SD 3.47Å; Y73-M86 WeakPolarHBondContact CE1-SD 3.38Å; Y73-M86 HydrophobicContact CE2-CE 3.83Å; Y73-M86 HydrophobicContact CG-CE 4.37Å; Y73-M86 WeakPolarHBondContact OH-CE 3.42Å
74F87.1Confident82Confident1 Ų166.9 Ų66.90%0.00437%0.368CS..THydrogen-bonded Turntrans-91.7-11.8175.2-66.3-69000113.1M44 H72 M86 F87 L90 G139 Y140 G141 V144 L148M44-F74 HydrophobicContact CE-CB 4.47Å; M44-F74 HydrophobicContact CE-CD2 3.73Å; M44-F74 HydrophobicContact SD-CB 3.83Å; M44-F74 HydrophobicContact SD-CD2 3.82Å; M44-F74 HydrophobicContact SD-CG 4.32Å; H72-F74 PolarHBondContact O-N 3.08Å; F74-M86 HydrophobicContact CE1-CB 4.44Å; F74-M86 HydrophobicContact CE1-SD 4.41Å; F74-M86 HydrophobicContact CE2-SD 4.02Å; F74-M86 HydrophobicContact CZ-CB 4.21Å; F74-M86 HydrophobicContact CZ-CG 4.19Å; F74-M86 HydrophobicContact CZ-SD 3.53Å; F74-M86 VanDerWaalsContact CZ-SD 3.53Å; F74-F87 HydrophobicContact CE1-CB 4.04Å; F74-L90 HydrophobicContact CE2-CD2 3.97Å; F74-L90 HydrophobicContact CZ-CD2 4.25Å; F74-G139 WeakPolarHBondContact CD1-O 3.39Å; F74-Y140 CarbonylContact O-C 3.59Å; F74-Y140 WeakPolarHBondContact O-CA 3.11Å; F74-Y140 WeakPolarHBondContact O-CB 3.44Å; F74-G141 PolarHBondContact O-N 3.28Å; F74-V144 HydrophobicContact CB-CG1 4.4Å; F74-V144 HydrophobicContact CD1-CG1 3.91Å; F74-V144 HydrophobicContact CG-CG1 4.33Å; F74-L148 HydrophobicContact CD1-CD1 4.45Å; F74-L148 HydrophobicContact CD2-CD1 3.84Å; F74-L148 HydrophobicContact CE1-CD1 4.34Å; F74-L148 HydrophobicContact CE2-CD1 3.73Å; F74-L148 HydrophobicContact CG-CD1 4.22Å; F74-L148 HydrophobicContact CZ-CD1 3.98Å
75A86.4Confident83Confident4 Ų469.2 Ų69.23%0.03337%0.37CS..THydrogen-bonded Turntrans-81.7-33-179.700000112.5M40 F41 M44 H72M40-A75 HydrophobicContact CE-CB 4.11Å; M40-A75 WeakPolarHBondContact CE-O 3.38Å; M40-A75 HydrophobicContact CG-CB 4.01Å; M40-A75 HydrophobicContact SD-CB 4.3Å; F41-A75 HydrophobicContact CD1-CB 3.62Å; F41-A75 HydrophobicContact CE1-CB 3.67Å; M44-A75 HydrophobicContact CB-CB 4.38Å; H72-A75 PolarHBondContact O-N 3.01Å; H72-A75 VanDerWaalsContact O-N 3.12Å
76L86.5Confident83.7Confident81 Ų8162 Ų6242%0.42433%0.332SS..SBendtrans-111.9145.8-179.7-64.5176.8000111.6F41 H72 T78 Q83F41-L76 HydrophobicContact CE1-CD2 3.99Å; F41-L76 HydrophobicContact CE1-CG 4.02Å; F41-L76 HydrophobicContact CZ-CD2 3.92Å; F41-L76 HydrophobicContact CZ-CG 4.46Å; H72-L76 HydrophobicContact CB-CD1 4.05Å; H72-L76 HydrophobicContact CB-CG 4.36Å; H72-L76 PolarHBondContact O-N 3.29Å; L76-T78 PolarHBondContact O-N 3.06Å; L76-T78 PolarHBondContact O-OG1 3.45Å; L76-Q83 PolarHBondContact O-NE2 3.43Å
77P87.1Confident84.4Confident81 Ų8160 Ų6053%0.52632%0.321SS..  trans-66.3120.7170.926.6-31.6000109.6Y140P77-Y140 HydrophobicContact CB-CD1 4.14Å; P77-Y140 HydrophobicContact CB-CD2 4.04Å; P77-Y140 HydrophobicContact CB-CE1 3.88Å; P77-Y140 HydrophobicContact CB-CE2 3.75Å; P77-Y140 HydrophobicContact CB-CG 4.25Å; P77-Y140 HydrophobicContact CG-CE2 4.3Å
78T83.4Confident85.1Confident99 Ų9951.5 Ų51.561%0.60729%0.285SS*.SBendtrans-116.2-70.1174.7-31.70000108.9L76 Q83L76-T78 PolarHBondContact O-N 3.06Å; L76-T78 PolarHBondContact O-OG1 3.45Å; T78-Q83 PolarHBondContact OG1-NE2 2.98Å
79N85Confident85.7Confident77 Ų7749.4 Ų49.441%0.41227%0.267SS..  trans-140103.3173.3-178.8-7.9000107.7G81 E82 Q83N79-G81 PolarHBondContact O-N 2.96Å; N79-G81 VanDerWaalsContact O-N 3.16Å; N79-G81 PolarHBondContact OD1-N 3.22Å; N79-E82 HydrophobicContact CB-CB 3.99Å; N79-E82 PolarHBondContact O-N 3.49Å; N79-Q83 VanDerWaalsContact O-CB 3.3Å; N79-Q83 WeakPolarHBondContact O-CB 3.46Å; N79-Q83 WeakPolarHBondContact O-CG 3.42Å; N79-Q83 PolarHBondContact O-N 3.26Å; N79-Q83 PolarHBondContact O-OE1 3.33Å
80P84.8Confident86.3Confident63 Ų6349 Ų4941%0.40926%0.264SS..Hα-helixtrans-56.7-35.3-171.9-26.734.1000114.1F84 S138 Y140P80-F84 WeakPolarHBondContact O-CB 3.45Å; P80-F84 PolarHBondContact O-N 3Å; P80-S138 WeakPolarHBondContact CA-O 3.35Å; P80-Y140 HydrophobicContact CB-CE1 4.21Å; P80-Y140 HydrophobicContact CG-CE1 3.96Å
81G84.1Confident86.8Confident49 Ų4945.9 Ų45.951%0.50524%0.242SC..Hα-helixtrans-70.7-46179.400000112.8N79 F84 Y85N79-G81 PolarHBondContact O-N 2.96Å; N79-G81 VanDerWaalsContact O-N 3.16Å; N79-G81 PolarHBondContact OD1-N 3.22Å; G81-F84 PolarHBondContact O-N 2.75Å; G81-Y85 PolarHBondContact O-N 3Å
82E86.3Confident87.2Confident99 Ų9939 Ų3946%0.46322%0.216SC..Hα-helixtrans-66.5-41.7176.6-171.1-170.2155.200111.4Y73 N79 F84 Y85 M86Y73-E82 PolarHBondContact OH-OE1 3.47Å; N79-E82 HydrophobicContact CB-CB 3.99Å; N79-E82 PolarHBondContact O-N 3.49Å; E82-F84 VanDerWaalsContact C-N 3.34Å; E82-F84 PolarHBondContact O-N 3.46Å; E82-Y85 PolarHBondContact O-N 2.93Å; E82-M86 WeakPolarHBondContact O-CB 3.44Å; E82-M86 PolarHBondContact O-N 3.29Å
83Q88.8Confident87.4Confident0 Ų035.5 Ų35.50%020%0.199CC..Hα-helixtrans-64.1-39.5177-72.3175.2-56.400111.4Y73 L76 T78 N79 M86 F87 G139Y73-Q83 HydrophobicContact CE1-CB 4.5Å; Y73-Q83 HydrophobicContact CE1-CG 3.86Å; Y73-Q83 PolarHBondContact O-NE2 2.93Å; L76-Q83 PolarHBondContact O-NE2 3.43Å; T78-Q83 PolarHBondContact OG1-NE2 2.98Å; N79-Q83 VanDerWaalsContact O-CB 3.3Å; N79-Q83 WeakPolarHBondContact O-CB 3.46Å; N79-Q83 WeakPolarHBondContact O-CG 3.42Å; N79-Q83 PolarHBondContact O-N 3.26Å; N79-Q83 PolarHBondContact O-OE1 3.33Å; Q83-M86 PolarHBondContact O-N 3.42Å; Q83-F87 VanDerWaalsContact O-CB 3.3Å; Q83-F87 WeakPolarHBondContact O-CB 3.14Å; Q83-F87 PolarHBondContact O-N 3.3Å; Q83-G139 WeakPolarHBondContact CB-O 3.22Å
84F89.2Confident87.5Confident35 Ų3534.3 Ų34.315%0.15420%0.195CC..Hα-helixtrans-65.4-44.8175-178.6-106.3000112.1P80 G81 E82 M86 F87 C88 P111 I115P80-F84 WeakPolarHBondContact O-CB 3.45Å; P80-F84 PolarHBondContact O-N 3Å; G81-F84 PolarHBondContact O-N 2.75Å; E82-F84 VanDerWaalsContact C-N 3.34Å; E82-F84 PolarHBondContact O-N 3.46Å; F84-M86 PolarHBondContact O-N 2.84Å; F84-F87 HydrophobicContact CD2-CD1 4.35Å; F84-F87 HydrophobicContact CE2-CD1 4.35Å; F84-F87 WeakPolarHBondContact O-CB 3.36Å; F84-F87 PolarHBondContact O-N 3.46Å; F84-C88 WeakPolarHBondContact CZ-SG 3.31Å; F84-C88 PolarHBondContact O-N 3.22Å; F84-C88 PolarHBondContact O-SG 2.92Å; F84-C88 VanDerWaalsContact O-SG 3.39Å; F84-P111 HydrophobicContact CE1-CB 3.79Å; F84-P111 HydrophobicContact CE1-CG 4.25Å; F84-P111 HydrophobicContact CZ-CB 3.7Å; F84-I115 HydrophobicContact CE2-CD1 3.67Å; F84-I115 HydrophobicContact CE2-CG1 3.82Å; F84-I115 HydrophobicContact CZ-CD1 4.02Å; F84-I115 HydrophobicContact CZ-CG1 4.06Å
85Y87.9Confident87.5Confident91 Ų9134.3 Ų34.336%0.35719%0.194SC..Hα-helixtrans-61.3-44.5175.1178.8-104.1000111.8L66 G81 E82 F87 C88 T89 E107L66-Y85 HydrophobicContact CD2-CE1 4.37Å; G81-Y85 PolarHBondContact O-N 3Å; E82-Y85 PolarHBondContact O-N 2.93Å; Y85-F87 PolarHBondContact O-N 2.65Å; Y85-C88 PolarHBondContact O-N 2.92Å; Y85-T89 HydrophobicContact CD1-CG2 4.44Å; Y85-T89 HydrophobicContact CD2-CG2 4.28Å; Y85-T89 HydrophobicContact CE1-CG2 4.03Å; Y85-T89 HydrophobicContact CE2-CG2 3.84Å; Y85-T89 WeakPolarHBondContact O-CB 3Å; Y85-T89 WeakPolarHBondContact O-CG2 3.46Å; Y85-T89 PolarHBondContact O-N 3.44Å; Y85-T89 PolarHBondContact O-OG1 2.89Å; Y85-E107 HydrophobicContact CD2-CG 4.31Å; Y85-E107 HydrophobicContact CE2-CG 4Å
86M87.1Confident87.6Confident8 Ų837.2 Ų37.24%0.03921%0.209CC..Hα-helixtrans-64.9-39.6177-157.1-148.4-83.300111.6L66 P69 Y73 F74 E82 Q83 F84 T89 L90L66-M86 HydrophobicContact CD1-CG 4.44Å; P69-M86 HydrophobicContact CB-CE 4.27Å; P69-M86 HydrophobicContact CB-SD 4.14Å; P69-M86 HydrophobicContact CG-SD 4.43Å; Y73-M86 HydrophobicContact CD1-CE 3.78Å; Y73-M86 HydrophobicContact CD1-SD 3.87Å; Y73-M86 HydrophobicContact CD2-CE 4.4Å; Y73-M86 HydrophobicContact CE1-CB 4.27Å; Y73-M86 HydrophobicContact CE1-CE 3.13Å; Y73-M86 HydrophobicContact CE1-CG 4.48Å; Y73-M86 HydrophobicContact CE1-SD 3.47Å; Y73-M86 WeakPolarHBondContact CE1-SD 3.38Å; Y73-M86 HydrophobicContact CE2-CE 3.83Å; Y73-M86 HydrophobicContact CG-CE 4.37Å; Y73-M86 WeakPolarHBondContact OH-CE 3.42Å; F74-M86 HydrophobicContact CE1-CB 4.44Å; F74-M86 HydrophobicContact CE1-SD 4.41Å; F74-M86 HydrophobicContact CE2-SD 4.02Å; F74-M86 HydrophobicContact CZ-CB 4.21Å; F74-M86 HydrophobicContact CZ-CG 4.19Å; F74-M86 HydrophobicContact CZ-SD 3.53Å; F74-M86 VanDerWaalsContact CZ-SD 3.53Å; E82-M86 WeakPolarHBondContact O-CB 3.44Å; E82-M86 PolarHBondContact O-N 3.29Å; Q83-M86 PolarHBondContact O-N 3.42Å; F84-M86 PolarHBondContact O-N 2.84Å; M86-T89 WeakPolarHBondContact CA-OG1 3.29Å; M86-T89 PolarHBondContact O-OG1 3.28Å; M86-T89 VanDerWaalsContact O-OG1 3.11Å; M86-L90 WeakPolarHBondContact O-CB 3.45Å; M86-L90 PolarHBondContact O-N 2.85Å
87F90.8Very high87.6Confident0 Ų036 Ų360%020%0.201CC..Hα-helixtrans-58.7-51.1174163-108.4000111.7F74 Q83 F84 Y85 L90 A91 I118 L136 V144 V147 L148F74-F87 HydrophobicContact CE1-CB 4.04Å; Q83-F87 VanDerWaalsContact O-CB 3.3Å; Q83-F87 WeakPolarHBondContact O-CB 3.14Å; Q83-F87 PolarHBondContact O-N 3.3Å; F84-F87 HydrophobicContact CD2-CD1 4.35Å; F84-F87 HydrophobicContact CE2-CD1 4.35Å; F84-F87 WeakPolarHBondContact O-CB 3.36Å; F84-F87 PolarHBondContact O-N 3.46Å; Y85-F87 PolarHBondContact O-N 2.65Å; F87-L90 PolarHBondContact O-N 2.87Å; F87-A91 VanDerWaalsContact O-CB 3.23Å; F87-A91 WeakPolarHBondContact O-CB 3.5Å; F87-A91 PolarHBondContact O-N 2.89Å; F87-I118 HydrophobicContact CE1-CD1 4.24Å; F87-I118 HydrophobicContact CZ-CD1 4.48Å; F87-L136 HydrophobicContact CE1-CB 4.32Å; F87-L136 HydrophobicContact CZ-CD1 4.17Å; F87-L136 HydrophobicContact CZ-CD2 4.29Å; F87-V144 HydrophobicContact CB-CG1 4.27Å; F87-V144 HydrophobicContact CD2-CG1 3.54Å; F87-V144 HydrophobicContact CE2-CG1 4.09Å; F87-V144 HydrophobicContact CG-CG1 4.01Å; F87-V147 HydrophobicContact CE2-CB 4.31Å; F87-V147 HydrophobicContact CE2-CG1 4.07Å; F87-V147 HydrophobicContact CZ-CG1 4.2Å; F87-L148 HydrophobicContact CD2-CD1 3.98Å; F87-L148 HydrophobicContact CD2-CD2 3.84Å; F87-L148 HydrophobicContact CD2-CG 3.79Å; F87-L148 HydrophobicContact CE2-CD2 4.1Å; F87-L148 HydrophobicContact CE2-CG 4.03Å
88C89Confident87.5Confident4 Ų432.6 Ų32.63%0.02718%0.179CC..Hα-helixtrans-62.6-44.9-178.4-74.30000112.2F84 Y85 A92 P105 T114F84-C88 WeakPolarHBondContact CZ-SG 3.31Å; F84-C88 PolarHBondContact O-N 3.22Å; F84-C88 PolarHBondContact O-SG 2.92Å; F84-C88 VanDerWaalsContact O-SG 3.39Å; Y85-C88 PolarHBondContact O-N 2.92Å; C88-A92 VanDerWaalsContact O-CB 3.3Å; C88-A92 WeakPolarHBondContact O-CB 3.37Å; C88-A92 PolarHBondContact O-N 3.35Å; C88-P105 HydrophobicContact CB-CB 4.29Å; C88-P105 HydrophobicContact CB-CG 4.11Å; C88-T114 HydrophobicContact CB-CG2 4.29Å
89T88.3Confident87.3Confident5 Ų529.8 Ų29.83%0.03117%0.17CC..Hα-helixtrans-69.1-39179.350.50000112.3Y85 M86 W93Y85-T89 HydrophobicContact CD1-CG2 4.44Å; Y85-T89 HydrophobicContact CD2-CG2 4.28Å; Y85-T89 HydrophobicContact CE1-CG2 4.03Å; Y85-T89 HydrophobicContact CE2-CG2 3.84Å; Y85-T89 WeakPolarHBondContact O-CB 3Å; Y85-T89 WeakPolarHBondContact O-CG2 3.46Å; Y85-T89 PolarHBondContact O-N 3.44Å; Y85-T89 PolarHBondContact O-OG1 2.89Å; M86-T89 WeakPolarHBondContact CA-OG1 3.29Å; M86-T89 PolarHBondContact O-OG1 3.28Å; M86-T89 VanDerWaalsContact O-OG1 3.11Å; T89-W93 WeakPolarHBondContact O-CB 3.22Å; T89-W93 PolarHBondContact O-N 2.94Å
90L88.5Confident87.2Confident3 Ų330.8 Ų30.82%0.01617%0.168CC..Hα-helixtrans-68.9-43.9176.6-175.463.4000111.7L51 F60 F74 M86 F87 A92 W93 L94 L148L51-L90 HydrophobicContact CD1-CD2 4.04Å; L51-L90 HydrophobicContact CD2-CD1 3.93Å; F60-L90 HydrophobicContact CD1-CD1 4.19Å; F60-L90 HydrophobicContact CE1-CB 4.5Å; F60-L90 HydrophobicContact CE1-CD1 4Å; F60-L90 HydrophobicContact CZ-CB 4.3Å; F60-L90 HydrophobicContact CZ-CD1 4.4Å; F74-L90 HydrophobicContact CE2-CD2 3.97Å; F74-L90 HydrophobicContact CZ-CD2 4.25Å; M86-L90 WeakPolarHBondContact O-CB 3.45Å; M86-L90 PolarHBondContact O-N 2.85Å; F87-L90 PolarHBondContact O-N 2.87Å; L90-A92 VanDerWaalsContact C-N 3.34Å; L90-A92 PolarHBondContact O-N 3.02Å; L90-W93 HydrophobicContact CD1-CE3 4.12Å; L90-W93 PolarHBondContact O-N 2.84Å; L90-L94 HydrophobicContact CG-CD1 4.3Å; L90-L94 WeakPolarHBondContact O-CG 3.49Å; L90-L94 PolarHBondContact O-N 2.95Å; L90-L148 HydrophobicContact CB-CD2 4.28Å; L90-L148 HydrophobicContact CD2-CD1 3.97Å; L90-L148 HydrophobicContact CD2-CD2 4Å; L90-L148 HydrophobicContact CG-CD2 4.07Å
91A89.6Confident86.9Confident0 Ų033.7 Ų33.70%019%0.187CC..Hα-helixtrans-60.1-45175.400000111.3F87 W93 L94 I95 I118 L148 L151F87-A91 VanDerWaalsContact O-CB 3.23Å; F87-A91 WeakPolarHBondContact O-CB 3.5Å; F87-A91 PolarHBondContact O-N 2.89Å; A91-W93 VanDerWaalsContact C-N 3.32Å; A91-W93 PolarHBondContact O-N 3.47Å; A91-L94 PolarHBondContact O-N 2.86Å; A91-I95 WeakPolarHBondContact O-CD1 3.28Å; A91-I95 VanDerWaalsContact O-CG1 3.23Å; A91-I95 WeakPolarHBondContact O-CG1 3.22Å; A91-I95 PolarHBondContact O-N 2.77Å; A91-I118 HydrophobicContact CB-CD1 3.85Å; A91-I118 HydrophobicContact CB-CG1 4.24Å; A91-I118 HydrophobicContact CB-CG2 4.03Å; A91-L148 HydrophobicContact CB-CD2 4.11Å; A91-L151 HydrophobicContact CB-CD1 3.89Å
92A89.3Confident87Confident0 Ų032.7 Ų32.70%017%0.169CC..Hα-helixtrans-58-43.7174.400000112.2C88 L90 N96 F102 P105C88-A92 VanDerWaalsContact O-CB 3.3Å; C88-A92 WeakPolarHBondContact O-CB 3.37Å; C88-A92 PolarHBondContact O-N 3.35Å; L90-A92 VanDerWaalsContact C-N 3.34Å; L90-A92 PolarHBondContact O-N 3.02Å; A92-N96 PolarHBondContact O-N 3.32Å; A92-N96 VanDerWaalsContact O-N 3.09Å; A92-N96 PolarHBondContact O-ND2 2.85Å; A92-F102 HydrophobicContact CB-CD1 3.43Å; A92-F102 VanDerWaalsContact CB-CD1 3.43Å; A92-F102 HydrophobicContact CB-CE1 3.67Å; A92-P105 HydrophobicContact CB-CG 4.48Å
93W89.4Confident86.6Confident21 Ų2136.4 Ų36.48%0.0819%0.186CC..Hα-helixtrans-64.3-43.6177.1178.979.8000112.3L51 L54 E59 F60 T89 L90 A91 N96 K97L51-W93 HydrophobicContact CD2-CZ3 4.16Å; L54-W93 HydrophobicContact CB-CH2 3.8Å; L54-W93 HydrophobicContact CB-CZ3 4.29Å; L54-W93 HydrophobicContact CD1-CZ3 4.41Å; E59-W93 HydrophobicContact CB-CZ2 4.19Å; F60-W93 HydrophobicContact CB-CD2 3.93Å; F60-W93 HydrophobicContact CB-CG 4.11Å; F60-W93 HydrophobicContact CB-CZ2 4.2Å; F60-W93 HydrophobicContact CD2-CB 3.63Å; F60-W93 AromaticContact CD2-CD1 3.76Å; F60-W93 HydrophobicContact CD2-CD2 4.16Å; F60-W93 AromaticContact CD2-CG 3.56Å; F60-W93 HydrophobicContact CD2-CG 3.56Å; F60-W93 HydrophobicContact CE2-CB 3.86Å; F60-W93 HydrophobicContact CE2-CG 4.3Å; F60-W93 HydrophobicContact CG-CB 4.48Å; F60-W93 HydrophobicContact CG-CD2 4.21Å; F60-W93 HydrophobicContact CG-CG 4.1Å; T89-W93 WeakPolarHBondContact O-CB 3.22Å; T89-W93 PolarHBondContact O-N 2.94Å; L90-W93 HydrophobicContact CD1-CE3 4.12Å; L90-W93 PolarHBondContact O-N 2.84Å; A91-W93 VanDerWaalsContact C-N 3.32Å; A91-W93 PolarHBondContact O-N 3.47Å; W93-N96 PolarHBondContact O-N 3.44Å; W93-K97 HydrophobicContact CD2-CG 4.09Å; W93-K97 HydrophobicContact CE3-CG 4.49Å; W93-K97 HydrophobicContact CH2-CG 4.35Å; W93-K97 HydrophobicContact CZ2-CD 4.33Å; W93-K97 HydrophobicContact CZ2-CG 3.92Å; W93-K97 WeakPolarHBondContact O-CB 3.46Å; W93-K97 WeakPolarHBondContact O-CG 3.33Å; W93-K97 PolarHBondContact O-N 3.26Å
94L88.2Confident86.2Confident0 Ų041.5 Ų41.50%021%0.21CC..Hα-helixtrans-63.8-41.1177.9-70.6173.3000112.4L51 L54 L90 A91 K97 A98 L148 L151 A152 A155L51-L94 HydrophobicContact CD2-CD1 4.4Å; L51-L94 HydrophobicContact CD2-CD2 3.97Å; L54-L94 HydrophobicContact CD1-CD2 3.66Å; L90-L94 HydrophobicContact CG-CD1 4.3Å; L90-L94 WeakPolarHBondContact O-CG 3.49Å; L90-L94 PolarHBondContact O-N 2.95Å; A91-L94 PolarHBondContact O-N 2.86Å; L94-K97 CarbonylContact O-C 3.59Å; L94-K97 WeakPolarHBondContact O-CB 3.39Å; L94-K97 PolarHBondContact O-N 2.62Å; L94-A98 PolarHBondContact O-N 2.94Å; L94-L148 HydrophobicContact CD1-CD2 4.19Å; L94-L151 HydrophobicContact CB-CB 3.89Å; L94-L151 HydrophobicContact CD1-CB 3.91Å; L94-A152 HydrophobicContact CD1-CB 4.24Å; L94-A152 HydrophobicContact CD2-CB 4.23Å; L94-A155 HydrophobicContact CD2-CB 4.32Å
95I88.8Confident85.7Confident0 Ų040.4 Ų40.40%021%0.206CC..Hα-helixtrans-63.4-44.6176.5-65.6162.7000110.7A91 K97 A98 G99 R100 F102 I118 E121 L151A91-I95 WeakPolarHBondContact O-CD1 3.28Å; A91-I95 VanDerWaalsContact O-CG1 3.23Å; A91-I95 WeakPolarHBondContact O-CG1 3.22Å; A91-I95 PolarHBondContact O-N 2.77Å; I95-K97 VanDerWaalsContact C-N 3.27Å; I95-K97 PolarHBondContact O-N 2.91Å; I95-A98 PolarHBondContact O-N 2.78Å; I95-A98 VanDerWaalsContact O-N 3.15Å; I95-G99 PolarHBondContact O-N 3.37Å; I95-R100 CarbonylContact C-O 3.59Å; I95-R100 HydrophobicContact CG2-CB 3.9Å; I95-R100 PolarHBondContact O-N 3.44Å; I95-F102 HydrophobicContact CB-CB 4.05Å; I95-F102 HydrophobicContact CB-CG 4.32Å; I95-F102 HydrophobicContact CD1-CD2 3.86Å; I95-F102 HydrophobicContact CD1-CE2 4Å; I95-F102 HydrophobicContact CD1-CG 4.12Å; I95-F102 HydrophobicContact CD1-CZ 4.4Å; I95-F102 HydrophobicContact CG2-CB 3.66Å; I95-F102 HydrophobicContact CG2-CD2 4.13Å; I95-F102 HydrophobicContact CG2-CG 4.12Å; I95-I118 HydrophobicContact CD1-CG1 4.44Å; I95-I118 HydrophobicContact CD1-CG2 4.45Å; I95-E121 HydrophobicContact CD1-CB 3.92Å; I95-E121 HydrophobicContact CD1-CG 4.25Å; I95-E121 HydrophobicContact CG1-CB 4.33Å; I95-E121 HydrophobicContact CG2-CB 4.29Å; I95-E121 HydrophobicContact CG2-CG 4.17Å; I95-L151 HydrophobicContact CD1-CD1 4.4Å; I95-L151 HydrophobicContact CD1-CD2 4.45Å; I95-L151 HydrophobicContact CG1-CD1 4.2Å; I95-L151 HydrophobicContact CG1-CD2 3.74Å
96N88.6Confident85.1Confident65 Ų6542 Ų4235%0.34822%0.217SC..Hα-helixtrans-60.9-38173.9-77.9-62000112.1A92 W93 A98 G99 R100 F102A92-N96 PolarHBondContact O-N 3.32Å; A92-N96 VanDerWaalsContact O-N 3.09Å; A92-N96 PolarHBondContact O-ND2 2.85Å; W93-N96 PolarHBondContact O-N 3.44Å; N96-A98 VanDerWaalsContact C-N 3.33Å; N96-G99 PolarHBondContact O-N 2.78Å; N96-G99 VanDerWaalsContact O-N 3.15Å; N96-R100 VanDerWaalsContact CA-O 3.28Å; N96-R100 WeakPolarHBondContact CA-O 3.43Å; N96-R100 PolarHBondContact OD1-O 3.21Å; N96-F102 PolarHBondContact ND2-O 3.23Å; N96-F102 PolarHBondContact OD1-N 2.88Å; N96-F102 PolarHBondContact OD1-O 2.88Å
97K85Confident84.2Confident57 Ų5748.5 Ų48.525%0.24825%0.247CC..Hα-helixtrans-68.6-30175.8-79.2-67.7-173.7-179.30113.8E59 W93 L94 I95 G99 A155 Y158E59-K97 WeakPolarHBondContact OE2-CE 3.44Å; E59-K97 IonicContact OE2-NZ 3.74Å; E59-K97 PolarHBondContact OE2-NZ 2.83Å; W93-K97 HydrophobicContact CD2-CG 4.09Å; W93-K97 HydrophobicContact CE3-CG 4.49Å; W93-K97 HydrophobicContact CH2-CG 4.35Å; W93-K97 HydrophobicContact CZ2-CD 4.33Å; W93-K97 HydrophobicContact CZ2-CG 3.92Å; W93-K97 WeakPolarHBondContact O-CB 3.46Å; W93-K97 WeakPolarHBondContact O-CG 3.33Å; W93-K97 PolarHBondContact O-N 3.26Å; L94-K97 CarbonylContact O-C 3.59Å; L94-K97 WeakPolarHBondContact O-CB 3.39Å; L94-K97 PolarHBondContact O-N 2.62Å; I95-K97 VanDerWaalsContact C-N 3.27Å; I95-K97 PolarHBondContact O-N 2.91Å; K97-G99 PolarHBondContact O-N 2.9Å; K97-A155 HydrophobicContact CB-CB 4.04Å; K97-Y158 VanDerWaalsContact O-CD1 3.25Å; K97-Y158 WeakPolarHBondContact O-CD1 3.42Å
98A85.3Confident83.3Confident8 Ų858.8 Ų58.87%0.06629%0.288CS..THydrogen-bonded Turntrans-77.37.8171.500000113.5L94 I95 N96 F125 A155L94-A98 PolarHBondContact O-N 2.94Å; I95-A98 PolarHBondContact O-N 2.78Å; I95-A98 VanDerWaalsContact O-N 3.15Å; N96-A98 VanDerWaalsContact C-N 3.33Å; A98-F125 HydrophobicContact CB-CE1 4.02Å; A98-F125 HydrophobicContact CB-CE2 4.44Å; A98-F125 HydrophobicContact CB-CZ 3.65Å; A98-A155 HydrophobicContact CB-CB 4.46Å
99G79.5Confident82.8Confident41 Ų4162.1 Ų62.142%0.42331%0.305SS..THydrogen-bonded Turntrans86.211172.600000115.3I95 N96 K97I95-G99 PolarHBondContact O-N 3.37Å; N96-G99 PolarHBondContact O-N 2.78Å; N96-G99 VanDerWaalsContact O-N 3.15Å; K97-G99 PolarHBondContact O-N 2.9Å
100R82.9Confident82.6Confident98 Ų9866 Ų6637%0.3733%0.326SS..  trans-106.8131.5175.3-65.8-168.8-178-98.10.7111.1I95 N96 F102 E121 S124 F125I95-R100 CarbonylContact C-O 3.59Å; I95-R100 HydrophobicContact CG2-CB 3.9Å; I95-R100 PolarHBondContact O-N 3.44Å; N96-R100 VanDerWaalsContact CA-O 3.28Å; N96-R100 WeakPolarHBondContact CA-O 3.43Å; N96-R100 PolarHBondContact OD1-O 3.21Å; R100-F102 PolarHBondContact O-N 3.39Å; R100-E121 WeakPolarHBondContact CD-OE2 3.3Å; R100-E121 IonicContact NE-OE2 2.76Å; R100-S124 VanDerWaalsContact CZ-OG 3.23Å; R100-S124 PolarHBondContact NE-OG 2.76Å; R100-S124 PolarHBondContact NH2-OG 2.83Å; R100-F125 HydrophobicContact CB-CZ 4.45Å; R100-F125 VanDerWaalsContact CD-CZ 3.44Å; R100-F125 HydrophobicContact CG-CE1 4.05Å; R100-F125 HydrophobicContact CG-CZ 3.86Å
101P79.6Confident82.3Confident124 Ų12468.4 Ų68.481%0.80534%0.342SS*.  trans-67.7120.6177.728.3-32.9000109.9
102F85.4Confident82.1Confident27 Ų2771.2 Ų71.212%0.11836%0.357CS..  trans-133.8124.3176.4-167.6-86.6000109.9A92 I95 N96 R100 P105 N117 I118 E121A92-F102 HydrophobicContact CB-CD1 3.43Å; A92-F102 VanDerWaalsContact CB-CD1 3.43Å; A92-F102 HydrophobicContact CB-CE1 3.67Å; I95-F102 HydrophobicContact CB-CB 4.05Å; I95-F102 HydrophobicContact CB-CG 4.32Å; I95-F102 HydrophobicContact CD1-CD2 3.86Å; I95-F102 HydrophobicContact CD1-CE2 4Å; I95-F102 HydrophobicContact CD1-CG 4.12Å; I95-F102 HydrophobicContact CD1-CZ 4.4Å; I95-F102 HydrophobicContact CG2-CB 3.66Å; I95-F102 HydrophobicContact CG2-CD2 4.13Å; I95-F102 HydrophobicContact CG2-CG 4.12Å; N96-F102 PolarHBondContact ND2-O 3.23Å; N96-F102 PolarHBondContact OD1-N 2.88Å; N96-F102 PolarHBondContact OD1-O 2.88Å; R100-F102 PolarHBondContact O-N 3.39Å; F102-P105 HydrophobicContact CE1-CG 4.15Å; F102-N117 HydrophobicContact CE2-CB 4.04Å; F102-N117 HydrophobicContact CZ-CB 4.24Å; F102-I118 HydrophobicContact CE1-CG1 4.36Å; F102-I118 HydrophobicContact CE2-CG1 4.34Å; F102-I118 HydrophobicContact CZ-CG1 3.69Å; F102-E121 HydrophobicContact CD2-CG 3.92Å; F102-E121 HydrophobicContact CE2-CG 4.14Å
103E78.5Confident82Confident178 Ų17873.3 Ų73.383%0.83237%0.374SS*.PPolyproline II helixtrans-70.2138.9179.1-67.7-173.2165.500110.8P105E103-P105 VanDerWaalsContact O-CD 3.32Å; E103-P105 WeakPolarHBondContact O-CD 3.47Å
104Q78.8Confident81.9Confident106 Ų10672.9 Ų72.950%0.49537%0.374SS..PPolyproline II helixtrans-68.3122.6176.6-76.1-174.43.900109.7Q106Q104-Q106 PolarHBondContact O-N 2.98Å
105P78.9Confident81.9Confident12 Ų1272.9 Ų72.98%0.07837%0.374CS..PPolyproline II helixtrans-62.1131.9179.6-22.234.1000111C88 A92 F102 E103 D109 T114C88-P105 HydrophobicContact CB-CB 4.29Å; C88-P105 HydrophobicContact CB-CG 4.11Å; A92-P105 HydrophobicContact CB-CG 4.48Å; F102-P105 HydrophobicContact CE1-CG 4.15Å; E103-P105 VanDerWaalsContact O-CD 3.32Å; E103-P105 WeakPolarHBondContact O-CD 3.47Å; P105-D109 WeakPolarHBondContact CA-OD2 3.36Å; P105-T114 HydrophobicContact CB-CG2 3.64Å; P105-T114 HydrophobicContact CG-CG2 3.47Å; P105-T114 VanDerWaalsContact CG-CG2 3.47Å
106Q75.8Confident81.9Confident125 Ų12575.3 Ų75.358%0.58439%0.391SS*.PPolyproline II helixtrans-86.7158.3174.5-61.7-62.8-43.900110.8Q104 Y108 D109Q104-Q106 PolarHBondContact O-N 2.98Å; Q106-Y108 PolarHBondContact O-N 3.24Å; Q106-Y108 VanDerWaalsContact O-N 3.08Å; Q106-D109 PolarHBondContact N-OD2 3.25Å; Q106-D109 WeakPolarHBondContact O-CB 3.37Å; Q106-D109 PolarHBondContact O-N 3.42Å; Q106-D109 VanDerWaalsContact O-N 3.1Å
107E68.3Low81.9Confident145 Ų14576.4 Ų76.468%0.67840%0.396SS*.THydrogen-bonded Turntrans-60.4-20.4179.7-67.4-177.4174.700114Y85Y85-E107 HydrophobicContact CD2-CG 4.31Å; Y85-E107 HydrophobicContact CE2-CG 4Å
108Y71.3Confident82.1Confident215 Ų21573.7 Ų73.784%0.84339%0.385SS*.THydrogen-bonded Turntrans-97.3-2.6-179.4-57.6-77.6000114Q106Q106-Y108 PolarHBondContact O-N 3.24Å; Q106-Y108 VanDerWaalsContact O-N 3.08Å
109D79.7Confident82.2Confident75 Ų7574 Ų7440%0.40139%0.385SS..SBendtrans-71.3145.6-179.8-69.3-20.9000110.9P105 Q106 P111P105-D109 WeakPolarHBondContact CA-OD2 3.36Å; Q106-D109 PolarHBondContact N-OD2 3.25Å; Q106-D109 WeakPolarHBondContact O-CB 3.37Å; Q106-D109 PolarHBondContact O-N 3.42Å; Q106-D109 VanDerWaalsContact O-N 3.1Å; D109-P111 VanDerWaalsContact O-CD 3.23Å; D109-P111 WeakPolarHBondContact O-CD 3.37Å
110D82.5Confident82.6Confident86 Ų8674.1 Ų74.146%0.4638%0.38SS..  trans-62.4120.3178.4174.863.9000110.4N112 A113 T114D110-N112 PolarHBondContact O-N 3.32Å; D110-N112 VanDerWaalsContact O-N 3.15Å; D110-N112 WeakPolarHBondContact OD2-CB 3.49Å; D110-N112 PolarHBondContact OD2-N 2.89Å; D110-A113 HydrophobicContact CB-CB 3.99Å; D110-A113 PolarHBondContact O-N 3.32Å; D110-A113 VanDerWaalsContact O-N 3.11Å; D110-A113 PolarHBondContact OD2-N 2.93Å; D110-T114 PolarHBondContact O-N 2.88Å; D110-T114 PolarHBondContact O-OG1 2.75Å
111P82.9Confident82.8Confident54 Ų5471.6 Ų71.635%0.35137%0.372SS..Hα-helixtrans-57.5-34.4-176.6-29.537000113.7F84 D109 I115F84-P111 HydrophobicContact CE1-CB 3.79Å; F84-P111 HydrophobicContact CE1-CG 4.25Å; F84-P111 HydrophobicContact CZ-CB 3.7Å; D109-P111 VanDerWaalsContact O-CD 3.23Å; D109-P111 WeakPolarHBondContact O-CD 3.37Å; P111-I115 WeakPolarHBondContact O-CB 3.35Å; P111-I115 WeakPolarHBondContact O-CD1 3.3Å; P111-I115 WeakPolarHBondContact O-CG1 3.49Å; P111-I115 PolarHBondContact O-N 2.94Å; P111-I115 VanDerWaalsContact O-N 3.13Å
112N86.4Confident83.2Confident59 Ų5965.8 Ų65.832%0.31633%0.334SS..Hα-helixtrans-72.4-40.8179.3-60.4-76.6000111.8D110 I115 S116 K137D110-N112 PolarHBondContact O-N 3.32Å; D110-N112 VanDerWaalsContact O-N 3.15Å; D110-N112 WeakPolarHBondContact OD2-CB 3.49Å; D110-N112 PolarHBondContact OD2-N 2.89Å; N112-I115 PolarHBondContact O-N 3.41Å; N112-S116 VanDerWaalsContact O-CB 3.3Å; N112-S116 WeakPolarHBondContact O-CB 3.33Å; N112-S116 PolarHBondContact O-N 2.93Å; N112-S116 PolarHBondContact O-OG 3.47Å; N112-K137 VanDerWaalsContact CG-CE 3.49Å; N112-K137 VanDerWaalsContact CG-NZ 3.31Å; N112-K137 PolarHBondContact ND2-NZ 3.37Å; N112-K137 WeakPolarHBondContact OD1-CE 3.45Å; N112-K137 PolarHBondContact OD1-NZ 3.28Å
113A86.5Confident83.3Confident44 Ų4472.3 Ų72.336%0.36436%0.358SS..Hα-helixtrans-61.3-47.4177.300000110.7D110 I115 S116 N117D110-A113 HydrophobicContact CB-CB 3.99Å; D110-A113 PolarHBondContact O-N 3.32Å; D110-A113 VanDerWaalsContact O-N 3.11Å; D110-A113 PolarHBondContact OD2-N 2.93Å; A113-I115 PolarHBondContact O-N 3.45Å; A113-S116 WeakPolarHBondContact O-CB 3.33Å; A113-S116 PolarHBondContact O-N 3.34Å; A113-S116 VanDerWaalsContact O-N 3.16Å; A113-N117 VanDerWaalsContact O-CG 3.24Å; A113-N117 PolarHBondContact O-N 2.71Å; A113-N117 PolarHBondContact O-ND2 3.11Å
114T86.9Confident83.7Confident12 Ų1266.3 Ų66.37%0.07434%0.336CS..Hα-helixtrans-60-47.4177.1-580000112C88 P105 D110 S116 N117 I118C88-T114 HydrophobicContact CB-CG2 4.29Å; P105-T114 HydrophobicContact CB-CG2 3.64Å; P105-T114 HydrophobicContact CG-CG2 3.47Å; P105-T114 VanDerWaalsContact CG-CG2 3.47Å; D110-T114 PolarHBondContact O-N 2.88Å; D110-T114 PolarHBondContact O-OG1 2.75Å; T114-S116 VanDerWaalsContact C-N 3.3Å; T114-S116 PolarHBondContact O-N 3.32Å; T114-N117 PolarHBondContact O-N 2.88Å; T114-I118 HydrophobicContact CG2-CD1 4.08Å; T114-I118 WeakPolarHBondContact O-CG1 3.48Å; T114-I118 PolarHBondContact O-N 2.89Å
115I88.6Confident83.9Confident0 Ų062.9 Ų62.90%032%0.319CS..Hα-helixtrans-60.9-41.8176.1-66.4163000110.8F84 P111 N112 A113 N117 I118 L119 P133 L136 K137F84-I115 HydrophobicContact CE2-CD1 3.67Å; F84-I115 HydrophobicContact CE2-CG1 3.82Å; F84-I115 HydrophobicContact CZ-CD1 4.02Å; F84-I115 HydrophobicContact CZ-CG1 4.06Å; P111-I115 WeakPolarHBondContact O-CB 3.35Å; P111-I115 WeakPolarHBondContact O-CD1 3.3Å; P111-I115 WeakPolarHBondContact O-CG1 3.49Å; P111-I115 PolarHBondContact O-N 2.94Å; P111-I115 VanDerWaalsContact O-N 3.13Å; N112-I115 PolarHBondContact O-N 3.41Å; A113-I115 PolarHBondContact O-N 3.45Å; I115-N117 VanDerWaalsContact C-N 3.33Å; I115-N117 PolarHBondContact O-N 3.46Å; I115-I118 PolarHBondContact O-N 2.92Å; I115-L119 HydrophobicContact CG2-CD1 3.91Å; I115-L119 HydrophobicContact CG2-CG 4.28Å; I115-L119 WeakPolarHBondContact O-CB 2.99Å; I115-L119 VanDerWaalsContact O-CG 3.32Å; I115-L119 WeakPolarHBondContact O-CG 3.32Å; I115-L119 PolarHBondContact O-N 3.49Å; I115-P133 HydrophobicContact CB-CB 4.48Å; I115-P133 HydrophobicContact CG2-CB 3.76Å; I115-L136 HydrophobicContact CD1-CB 4.11Å; I115-L136 HydrophobicContact CG1-CB 4.3Å; I115-L136 HydrophobicContact CG2-CB 4.03Å; I115-L136 HydrophobicContact CG2-CD1 3.54Å; I115-L136 HydrophobicContact CG2-CG 4.36Å; I115-K137 HydrophobicContact CD1-CG 3.72Å
116S88Confident83.9Confident50 Ų5065.5 Ų65.535%0.3535%0.348SS..Hα-helixtrans-64.3-38.8-179.7-600000111.9N112 A113 T114 L119 S120N112-S116 VanDerWaalsContact O-CB 3.3Å; N112-S116 WeakPolarHBondContact O-CB 3.33Å; N112-S116 PolarHBondContact O-N 2.93Å; N112-S116 PolarHBondContact O-OG 3.47Å; A113-S116 WeakPolarHBondContact O-CB 3.33Å; A113-S116 PolarHBondContact O-N 3.34Å; A113-S116 VanDerWaalsContact O-N 3.16Å; T114-S116 VanDerWaalsContact C-N 3.3Å; T114-S116 PolarHBondContact O-N 3.32Å; S116-L119 PolarHBondContact O-N 3.29Å; S116-S120 PolarHBondContact O-N 3.16Å; S116-S120 PolarHBondContact O-OG 3.15Å
117N88.6Confident84.3Confident88 Ų8863.5 Ų63.547%0.47134%0.335SS..Hα-helixtrans-66.5-42.8175.1-67.3-16.6000111.7F102 A113 T114 I115 L119 S120 E121F102-N117 HydrophobicContact CE2-CB 4.04Å; F102-N117 HydrophobicContact CZ-CB 4.24Å; A113-N117 VanDerWaalsContact O-CG 3.24Å; A113-N117 PolarHBondContact O-N 2.71Å; A113-N117 PolarHBondContact O-ND2 3.11Å; T114-N117 PolarHBondContact O-N 2.88Å; I115-N117 VanDerWaalsContact C-N 3.33Å; I115-N117 PolarHBondContact O-N 3.46Å; N117-L119 VanDerWaalsContact C-N 3.33Å; N117-L119 PolarHBondContact O-N 3.06Å; N117-S120 WeakPolarHBondContact CA-OG 3.47Å; N117-S120 PolarHBondContact O-N 3.2Å; N117-S120 PolarHBondContact O-OG 3.32Å; N117-E121 WeakPolarHBondContact O-CG 3.39Å; N117-E121 PolarHBondContact O-N 3.2Å; N117-E121 VanDerWaalsContact O-N 3.07Å
118I89Confident84.7Confident0 Ų062 Ų620%034%0.336CS..Hα-helixtrans-61.3-43.5174.7-66.9165.5000110.4F87 A91 I95 F102 T114 I115 E121 L122 V147 L151F87-I118 HydrophobicContact CE1-CD1 4.24Å; F87-I118 HydrophobicContact CZ-CD1 4.48Å; A91-I118 HydrophobicContact CB-CD1 3.85Å; A91-I118 HydrophobicContact CB-CG1 4.24Å; A91-I118 HydrophobicContact CB-CG2 4.03Å; I95-I118 HydrophobicContact CD1-CG1 4.44Å; I95-I118 HydrophobicContact CD1-CG2 4.45Å; F102-I118 HydrophobicContact CE1-CG1 4.36Å; F102-I118 HydrophobicContact CE2-CG1 4.34Å; F102-I118 HydrophobicContact CZ-CG1 3.69Å; T114-I118 HydrophobicContact CG2-CD1 4.08Å; T114-I118 WeakPolarHBondContact O-CG1 3.48Å; T114-I118 PolarHBondContact O-N 2.89Å; I115-I118 PolarHBondContact O-N 2.92Å; I118-E121 PolarHBondContact O-N 2.78Å; I118-L122 WeakPolarHBondContact O-CB 3.5Å; I118-L122 PolarHBondContact O-N 3.34Å; I118-V147 HydrophobicContact CG2-CG1 4.02Å; I118-L151 HydrophobicContact CG2-CD1 4.24Å
119L88.4Confident85.1Confident14 Ų1453.1 Ų53.17%0.07331%0.307CS..Hα-helixtrans-70.9-27.5178.5-70.1177.5000113.4I115 S116 N117 L122 R123 A129 F131 P133 L136 V147I115-L119 HydrophobicContact CG2-CD1 3.91Å; I115-L119 HydrophobicContact CG2-CG 4.28Å; I115-L119 WeakPolarHBondContact O-CB 2.99Å; I115-L119 VanDerWaalsContact O-CG 3.32Å; I115-L119 WeakPolarHBondContact O-CG 3.32Å; I115-L119 PolarHBondContact O-N 3.49Å; S116-L119 PolarHBondContact O-N 3.29Å; N117-L119 VanDerWaalsContact C-N 3.33Å; N117-L119 PolarHBondContact O-N 3.06Å; L119-L122 HydrophobicContact CD2-CD2 4.19Å; L119-R123 WeakPolarHBondContact O-CG 3.28Å; L119-R123 PolarHBondContact O-N 3.5Å; L119-R123 VanDerWaalsContact O-N 3.17Å; L119-R123 PolarHBondContact O-NE 2.97Å; L119-A129 HydrophobicContact CD2-CB 3.8Å; L119-F131 HydrophobicContact CD2-CE2 4.41Å; L119-F131 HydrophobicContact CD2-CZ 4.5Å; L119-P133 HydrophobicContact CD1-CB 4.5Å; L119-P133 HydrophobicContact CD1-CG 4.16Å; L119-L136 HydrophobicContact CD1-CD1 4.19Å; L119-L136 HydrophobicContact CD2-CD1 4.03Å; L119-L136 HydrophobicContact CG-CD1 4.21Å; L119-V147 HydrophobicContact CD2-CG2 4.23Å
120S87.9Confident85Confident45 Ų4557.4 Ų57.432%0.31533%0.33SS..Hα-helixtrans-69.7-41.2170.752.80000111.6S116 N117 R123 S124S116-S120 PolarHBondContact O-N 3.16Å; S116-S120 PolarHBondContact O-OG 3.15Å; N117-S120 WeakPolarHBondContact CA-OG 3.47Å; N117-S120 PolarHBondContact O-N 3.2Å; N117-S120 PolarHBondContact O-OG 3.32Å; S120-R123 PolarHBondContact O-N 3Å; S120-S124 PolarHBondContact O-N 3.34Å
121E87.4Confident85.1Confident45 Ų4554.9 Ų54.921%0.2132%0.315CS..Hα-helixtrans-64.8-42.5175.6-69.1-55.3139.600111.4I95 R100 F102 N117 I118 R123 S124 F125I95-E121 HydrophobicContact CD1-CB 3.92Å; I95-E121 HydrophobicContact CD1-CG 4.25Å; I95-E121 HydrophobicContact CG1-CB 4.33Å; I95-E121 HydrophobicContact CG2-CB 4.29Å; I95-E121 HydrophobicContact CG2-CG 4.17Å; R100-E121 WeakPolarHBondContact CD-OE2 3.3Å; R100-E121 IonicContact NE-OE2 2.76Å; F102-E121 HydrophobicContact CD2-CG 3.92Å; F102-E121 HydrophobicContact CE2-CG 4.14Å; N117-E121 WeakPolarHBondContact O-CG 3.39Å; N117-E121 PolarHBondContact O-N 3.2Å; N117-E121 VanDerWaalsContact O-N 3.07Å; I118-E121 PolarHBondContact O-N 2.78Å; E121-R123 VanDerWaalsContact C-N 3.3Å; E121-R123 PolarHBondContact O-N 3.1Å; E121-S124 WeakPolarHBondContact O-CA 3.47Å; E121-S124 WeakPolarHBondContact O-CB 3.47Å; E121-S124 PolarHBondContact O-N 3.48Å; E121-S124 PolarHBondContact O-OG 3.19Å; E121-F125 WeakPolarHBondContact O-CD2 3.09Å; E121-F125 PolarHBondContact O-N 3.25Å
122L87.4Confident85.1Confident1 Ų155.6 Ų55.61%0.00532%0.32CS..Hα-helixtrans-55.8-43.7173.7-169.778.5000112.2I118 L119 S124 F125 R127 A129 V147 C150 L151I118-L122 WeakPolarHBondContact O-CB 3.5Å; I118-L122 PolarHBondContact O-N 3.34Å; L119-L122 HydrophobicContact CD2-CD2 4.19Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.17Å; L122-F125 PolarHBondContact O-N 2.66Å; L122-R127 HydrophobicContact CD1-CB 4.26Å; L122-R127 HydrophobicContact CG-CB 4.03Å; L122-R127 PolarHBondContact O-N 2.98Å; L122-A129 HydrophobicContact CD2-CB 3.9Å; L122-V147 HydrophobicContact CD2-CG2 4.27Å; L122-C150 HydrophobicContact CD1-CB 3.72Å; L122-L151 HydrophobicContact CD1-CD2 3.95Å; L122-L151 HydrophobicContact CD1-CG 4Å
123R88.4Confident85Confident165 Ų16554.9 Ų54.962%0.62332%0.318SS*.Hα-helixtrans-66.2-34175.4-77.2-178.4-70.8166.8-1.9112.6L119 S120 E121 F125 G126 R127L119-R123 WeakPolarHBondContact O-CG 3.28Å; L119-R123 PolarHBondContact O-N 3.5Å; L119-R123 VanDerWaalsContact O-N 3.17Å; L119-R123 PolarHBondContact O-NE 2.97Å; S120-R123 PolarHBondContact O-N 3Å; E121-R123 VanDerWaalsContact C-N 3.3Å; E121-R123 PolarHBondContact O-N 3.1Å; R123-F125 PolarHBondContact O-N 3.5Å; R123-G126 PolarHBondContact O-N 3.01Å; R123-R127 WeakPolarHBondContact CA-O 3.32Å
124S85.3Confident84.9Confident52 Ų5256 Ų5636%0.36432%0.324SS..Hα-helixtrans-65-25.9176.288.30000112.9R100 S120 E121 L122 G126R100-S124 VanDerWaalsContact CZ-OG 3.23Å; R100-S124 PolarHBondContact NE-OG 2.76Å; R100-S124 PolarHBondContact NH2-OG 2.83Å; S120-S124 PolarHBondContact O-N 3.34Å; E121-S124 WeakPolarHBondContact O-CA 3.47Å; E121-S124 WeakPolarHBondContact O-CB 3.47Å; E121-S124 PolarHBondContact O-N 3.48Å; E121-S124 PolarHBondContact O-OG 3.19Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.17Å; S124-G126 VanDerWaalsContact C-N 3.25Å; S124-G126 PolarHBondContact O-N 3.49Å
125F83.6Confident84.9Confident34 Ų3460.8 Ų60.815%0.14934%0.343CS..THydrogen-bonded Turntrans-833.9172.1-62-58.5000113.3A98 R100 E121 L122 R123 L151 E154A98-F125 HydrophobicContact CB-CE1 4.02Å; A98-F125 HydrophobicContact CB-CE2 4.44Å; A98-F125 HydrophobicContact CB-CZ 3.65Å; R100-F125 HydrophobicContact CB-CZ 4.45Å; R100-F125 VanDerWaalsContact CD-CZ 3.44Å; R100-F125 HydrophobicContact CG-CE1 4.05Å; R100-F125 HydrophobicContact CG-CZ 3.86Å; E121-F125 WeakPolarHBondContact O-CD2 3.09Å; E121-F125 PolarHBondContact O-N 3.25Å; L122-F125 PolarHBondContact O-N 2.66Å; R123-F125 PolarHBondContact O-N 3.5Å; F125-L151 HydrophobicContact CD2-CD2 4.15Å; F125-L151 HydrophobicContact CE2-CD2 4.06Å; F125-E154 HydrophobicContact CB-CG 4.04Å; F125-E154 HydrophobicContact CD1-CG 3.54Å; F125-E154 HydrophobicContact CD2-CG 4.38Å; F125-E154 HydrophobicContact CE1-CG 4Å; F125-E154 HydrophobicContact CG-CG 3.76Å
126G79.3Confident84.8Confident66 Ų6660.8 Ų60.868%0.6834%0.343SS*.THydrogen-bonded Turntrans79.415.217800000114.7R123 S124R123-G126 PolarHBondContact O-N 3.01Å; S124-G126 VanDerWaalsContact C-N 3.25Å; S124-G126 PolarHBondContact O-N 3.49Å
127R83.7Confident84.7Confident83 Ų8362.6 Ų62.631%0.31335%0.345SS..  trans-98.2136.7175-62.3-66.8-162.7-176.46.8110.4L122 R123 C150 E153L122-R127 HydrophobicContact CD1-CB 4.26Å; L122-R127 HydrophobicContact CG-CB 4.03Å; L122-R127 PolarHBondContact O-N 2.98Å; R123-R127 WeakPolarHBondContact CA-O 3.32Å; R127-C150 HydrophobicContact CG-CB 4.29Å; R127-E153 IonicContact CZ-OE2 2.76Å; R127-E153 IonicContact NH2-OE2 3.25Å; R127-E153 PolarHBondContact NH2-OE2 3.46Å
128T77.6Confident84.5Confident113 Ų11360.2 Ų60.269%0.69334%0.335SS*.  trans-101.2123.7-178.9530000111.2Y146T128-Y146 PolarHBondContact O-OH 2.94Å
129A79.1Confident84.3Confident29 Ų2960.2 Ų60.224%0.2434%0.335CS..  trans-105.7102.717000000109.6L119 L122 F131L119-A129 HydrophobicContact CD2-CB 3.8Å; L122-A129 HydrophobicContact CD2-CB 3.9Å; A129-F131 VanDerWaalsContact C-N 3.34Å; A129-F131 HydrophobicContact CB-CD1 4.25Å; A129-F131 HydrophobicContact CB-CE1 3.65Å; A129-F131 HydrophobicContact CB-CE2 4.38Å; A129-F131 HydrophobicContact CB-CZ 3.72Å; A129-F131 PolarHBondContact O-N 3.33Å
130D77.5Confident84.2Confident165 Ų16563.1 Ų63.188%0.88235%0.346SS*.  trans-93.462.3179.7-168.221000111.3
131F84.7Confident84.2Confident34 Ų3461.7 Ų61.715%0.14934%0.338CS..SBendtrans-156.9153.2175.952.2-95.5000111.1L119 A129 K135 L136 H143 Y146 V147L119-F131 HydrophobicContact CD2-CE2 4.41Å; L119-F131 HydrophobicContact CD2-CZ 4.5Å; A129-F131 VanDerWaalsContact C-N 3.34Å; A129-F131 HydrophobicContact CB-CD1 4.25Å; A129-F131 HydrophobicContact CB-CE1 3.65Å; A129-F131 HydrophobicContact CB-CE2 4.38Å; A129-F131 HydrophobicContact CB-CZ 3.72Å; A129-F131 PolarHBondContact O-N 3.33Å; F131-K135 HydrophobicContact CD2-CB 4.41Å; F131-L136 HydrophobicContact CE2-CD1 3.83Å; F131-L136 HydrophobicContact CE2-CD2 4.03Å; F131-L136 HydrophobicContact CE2-CG 3.86Å; F131-H143 AromaticContact CD1-CD2 3.51Å; F131-H143 HydrophobicContact CD2-CB 4.23Å; F131-H143 AromaticContact CD2-CD2 3.94Å; F131-H143 HydrophobicContact CE1-CB 4.35Å; F131-H143 AromaticContact CE1-CD2 3.98Å; F131-H143 HydrophobicContact CE2-CB 3.96Å; F131-H143 AromaticContact CG-CD2 3.47Å; F131-H143 VanDerWaalsContact CG-CD2 3.47Å; F131-H143 WeakPolarHBondContact CG-CD2 3.46Å; F131-H143 HydrophobicContact CZ-CB 4.01Å; F131-Y146 HydrophobicContact CE1-CD1 4.11Å; F131-Y146 HydrophobicContact CE1-CE1 4.49Å; F131-V147 HydrophobicContact CE2-CG2 4.44Å; F131-V147 HydrophobicContact CZ-CG2 3.73Å
132P83.6Confident84.3Confident68 Ų6862.6 Ų62.644%0.44234%0.342SS..  trans-72.3147.2-17827.2-32.6000112S134 K135P132-S134 PolarHBondContact O-N 3.28Å; P132-K135 HydrophobicContact CG-CG 3.99Å; P132-K135 WeakPolarHBondContact O-CB 3.41Å; P132-K135 PolarHBondContact O-N 3.17Å
133P83.9Confident84.3Confident45 Ų4565.4 Ų65.429%0.29236%0.355SS..G310 helixtrans-53.3-26177.5-29.335.7000114.6I115 L119 K135 L136I115-P133 HydrophobicContact CB-CB 4.48Å; I115-P133 HydrophobicContact CG2-CB 3.76Å; L119-P133 HydrophobicContact CD1-CB 4.5Å; L119-P133 HydrophobicContact CD1-CG 4.16Å; P133-K135 PolarHBondContact O-N 3.3Å; P133-L136 PolarHBondContact O-N 3.27Å; P133-L136 VanDerWaalsContact O-N 3.16Å
134S85.1Confident84.4Confident68 Ų6857.6 Ų57.648%0.47633%0.326SS..G310 helixtrans-58.9-25.917755.40000113.7P132 L136 K137P132-S134 PolarHBondContact O-N 3.28Å; S134-L136 VanDerWaalsContact C-N 3.29Å; S134-L136 PolarHBondContact O-N 3.34Å; S134-K137 PolarHBondContact O-N 3.29Å
135K86.1Confident84.6Confident112 Ų11255.1 Ų55.149%0.48731%0.309SS..G310 helixtrans-74.1-15.9179.6-66.8-72.6-1741730113.9F131 P132 P133 S138F131-K135 HydrophobicContact CD2-CB 4.41Å; P132-K135 HydrophobicContact CG-CG 3.99Å; P132-K135 WeakPolarHBondContact O-CB 3.41Å; P132-K135 PolarHBondContact O-N 3.17Å; P133-K135 PolarHBondContact O-N 3.3Å; K135-S138 PolarHBondContact O-OG 3.24Å
136L86.2Confident84.9Confident0 Ų057.4 Ų57.40%032%0.317CS..G310 helixtrans-94.7-12.4178.3-64.9173.3000112.9F87 I115 L119 F131 P133 S134 S138 G139 H143 V144 V147F87-L136 HydrophobicContact CE1-CB 4.32Å; F87-L136 HydrophobicContact CZ-CD1 4.17Å; F87-L136 HydrophobicContact CZ-CD2 4.29Å; I115-L136 HydrophobicContact CD1-CB 4.11Å; I115-L136 HydrophobicContact CG1-CB 4.3Å; I115-L136 HydrophobicContact CG2-CB 4.03Å; I115-L136 HydrophobicContact CG2-CD1 3.54Å; I115-L136 HydrophobicContact CG2-CG 4.36Å; L119-L136 HydrophobicContact CD1-CD1 4.19Å; L119-L136 HydrophobicContact CD2-CD1 4.03Å; L119-L136 HydrophobicContact CG-CD1 4.21Å; F131-L136 HydrophobicContact CE2-CD1 3.83Å; F131-L136 HydrophobicContact CE2-CD2 4.03Å; F131-L136 HydrophobicContact CE2-CG 3.86Å; P133-L136 PolarHBondContact O-N 3.27Å; P133-L136 VanDerWaalsContact O-N 3.16Å; S134-L136 VanDerWaalsContact C-N 3.29Å; S134-L136 PolarHBondContact O-N 3.34Å; L136-S138 PolarHBondContact O-N 3.34Å; L136-G139 PolarHBondContact O-N 3.07Å; L136-G139 VanDerWaalsContact O-N 3.08Å; L136-H143 HydrophobicContact CD2-CB 3.88Å; L136-V144 HydrophobicContact CD2-CB 4.3Å; L136-V144 HydrophobicContact CD2-CG2 3.64Å; L136-V147 HydrophobicContact CD1-CG2 4.3Å; L136-V147 HydrophobicContact CD2-CG2 4.25Å
137K86.3Confident85.4Confident88 Ų8854.3 Ų54.338%0.38328%0.284SS..THydrogen-bonded Turntrans-64-27.1-179.1-73-171.4175.5-175.20114.3N112 I115 S134 G139N112-K137 VanDerWaalsContact CG-CE 3.49Å; N112-K137 VanDerWaalsContact CG-NZ 3.31Å; N112-K137 PolarHBondContact ND2-NZ 3.37Å; N112-K137 WeakPolarHBondContact OD1-CE 3.45Å; N112-K137 PolarHBondContact OD1-NZ 3.28Å; I115-K137 HydrophobicContact CD1-CG 3.72Å; S134-K137 PolarHBondContact O-N 3.29Å; K137-G139 PolarHBondContact O-N 3.45Å
138S84.4Confident85.7Confident37 Ų3750.3 Ų50.326%0.25927%0.27SS..THydrogen-bonded Turntrans-63.9-22.3176.246.50000111.9P80 K135 L136 Y140P80-S138 WeakPolarHBondContact CA-O 3.35Å; K135-S138 PolarHBondContact O-OG 3.24Å; L136-S138 PolarHBondContact O-N 3.34Å; S138-Y140 WeakPolarHBondContact O-CD1 3.35Å; S138-Y140 WeakPolarHBondContact O-CE1 3.47Å; S138-Y140 PolarHBondContact O-N 2.92Å; S138-Y140 VanDerWaalsContact O-N 3.15Å; S138-Y140 PolarHBondContact OG-O 3.31Å
139G83.5Confident86.4Confident0 Ų045.8 Ų45.80%024%0.241CC..SBendtrans71.7-2.8-175.800000113.9F74 Q83 L136 K137F74-G139 WeakPolarHBondContact CD1-O 3.39Å; Q83-G139 WeakPolarHBondContact CB-O 3.22Å; L136-G139 PolarHBondContact O-N 3.07Å; L136-G139 VanDerWaalsContact O-N 3.08Å; K137-G139 PolarHBondContact O-N 3.45Å
140Y87.2Confident86.9Confident76 Ų7644.7 Ų44.730%0.29823%0.232SC..  trans-139.5157176.466.2-91.9000110.6F74 P77 P80 S138F74-Y140 CarbonylContact O-C 3.59Å; F74-Y140 WeakPolarHBondContact O-CA 3.11Å; F74-Y140 WeakPolarHBondContact O-CB 3.44Å; P77-Y140 HydrophobicContact CB-CD1 4.14Å; P77-Y140 HydrophobicContact CB-CD2 4.04Å; P77-Y140 HydrophobicContact CB-CE1 3.88Å; P77-Y140 HydrophobicContact CB-CE2 3.75Å; P77-Y140 HydrophobicContact CB-CG 4.25Å; P77-Y140 HydrophobicContact CG-CE2 4.3Å; P80-Y140 HydrophobicContact CB-CE1 4.21Å; P80-Y140 HydrophobicContact CG-CE1 3.96Å; S138-Y140 WeakPolarHBondContact O-CD1 3.35Å; S138-Y140 WeakPolarHBondContact O-CE1 3.47Å; S138-Y140 PolarHBondContact O-N 2.92Å; S138-Y140 VanDerWaalsContact O-N 3.15Å; S138-Y140 PolarHBondContact OG-O 3.31Å
141G88.3Confident87.4Confident15 Ų1536.9 Ų36.916%0.15519%0.19CC..SBendtrans119.5176.6175.800000113.9M40 F74 H143 V144 C145M40-G141 VanDerWaalsContact SD-CA 3.59Å; F74-G141 PolarHBondContact O-N 3.28Å; G141-H143 VanDerWaalsContact C-N 3.32Å; G141-H143 PolarHBondContact O-N 3.3Å; G141-V144 WeakPolarHBondContact O-CB 2.76Å; G141-V144 PolarHBondContact O-N 2.91Å; G141-C145 PolarHBondContact O-N 3.4Å; G141-C145 VanDerWaalsContact O-N 3.15Å
142E88.3Confident87.7Confident63 Ų6335.3 Ų35.329%0.29418%0.183SC..Hα-helixtrans-55.7-43.8-173.3-176.1-178169.800113R32 M40 V144 C145 Y146R32-E142 IonicContact CZ-OE1 3.29Å; R32-E142 VanDerWaalsContact CZ-OE1 3.25Å; R32-E142 IonicContact CZ-OE2 2.99Å; R32-E142 VanDerWaalsContact NH1-CD 3.27Å; R32-E142 IonicContact NH1-OE1 3.45Å; R32-E142 PolarHBondContact NH1-OE1 2.83Å; R32-E142 IonicContact NH1-OE2 2.93Å; R32-E142 PolarHBondContact NH1-OE2 3.15Å; R32-E142 IonicContact NH2-OE1 3.94Å; R32-E142 PolarHBondContact NH2-OE1 2.94Å; R32-E142 IonicContact NH2-OE2 3.54Å; M40-E142 HydrophobicContact SD-CB 4.28Å; M40-E142 PolarHBondContact SD-N 3.46Å; E142-V144 VanDerWaalsContact C-N 3.31Å; E142-V144 PolarHBondContact O-N 3.5Å; E142-C145 PolarHBondContact O-N 2.88Å; E142-Y146 WeakPolarHBondContact O-CB 3.48Å; E142-Y146 PolarHBondContact O-N 3.35Å
143H89.2Confident87.9Confident61 Ų6134.5 Ų34.528%0.28217%0.173SC..Hα-helixtrans-64-35.9-179.8-51.989.7000112.4F131 L136 G141 V147F131-H143 AromaticContact CD1-CD2 3.51Å; F131-H143 HydrophobicContact CD2-CB 4.23Å; F131-H143 AromaticContact CD2-CD2 3.94Å; F131-H143 HydrophobicContact CE1-CB 4.35Å; F131-H143 AromaticContact CE1-CD2 3.98Å; F131-H143 HydrophobicContact CE2-CB 3.96Å; F131-H143 AromaticContact CG-CD2 3.47Å; F131-H143 VanDerWaalsContact CG-CD2 3.47Å; F131-H143 WeakPolarHBondContact CG-CD2 3.46Å; F131-H143 HydrophobicContact CZ-CB 4.01Å; L136-H143 HydrophobicContact CD2-CB 3.88Å; G141-H143 VanDerWaalsContact C-N 3.32Å; G141-H143 PolarHBondContact O-N 3.3Å; H143-V147 VanDerWaalsContact O-CG2 3.31Å; H143-V147 WeakPolarHBondContact O-CG2 3.32Å; H143-V147 PolarHBondContact O-N 2.96Å; H143-V147 VanDerWaalsContact O-N 3.16Å
144V89.8Confident88.1Confident0 Ų034.4 Ų34.40%017%0.169CC..Hα-helixtrans-69.3-47.3178.6175.20000109.9F74 F87 L136 G141 E142 Y146 V147 L148F74-V144 HydrophobicContact CB-CG1 4.4Å; F74-V144 HydrophobicContact CD1-CG1 3.91Å; F74-V144 HydrophobicContact CG-CG1 4.33Å; F87-V144 HydrophobicContact CB-CG1 4.27Å; F87-V144 HydrophobicContact CD2-CG1 3.54Å; F87-V144 HydrophobicContact CE2-CG1 4.09Å; F87-V144 HydrophobicContact CG-CG1 4.01Å; L136-V144 HydrophobicContact CD2-CB 4.3Å; L136-V144 HydrophobicContact CD2-CG2 3.64Å; G141-V144 WeakPolarHBondContact O-CB 2.76Å; G141-V144 PolarHBondContact O-N 2.91Å; E142-V144 VanDerWaalsContact C-N 3.31Å; E142-V144 PolarHBondContact O-N 3.5Å; V144-Y146 VanDerWaalsContact C-N 3.34Å; V144-Y146 PolarHBondContact O-N 2.92Å; V144-V147 PolarHBondContact O-N 2.81Å; V144-L148 HydrophobicContact CG1-CD1 4.2Å; V144-L148 WeakPolarHBondContact O-CG 3.29Å; V144-L148 PolarHBondContact O-N 3.4Å; V144-L148 VanDerWaalsContact O-N 3.14Å
145C89.6Confident88.2Confident1 Ų131.2 Ų31.21%0.00715%0.146CC..Hα-helixtrans-58.9-45.2175.5-640000111.5V43 G141 E142 V147 L148 D149V43-C145 HydrophobicContact CG1-CB 3.96Å; G141-C145 PolarHBondContact O-N 3.4Å; G141-C145 VanDerWaalsContact O-N 3.15Å; E142-C145 PolarHBondContact O-N 2.88Å; C145-V147 PolarHBondContact O-N 3Å; C145-L148 PolarHBondContact O-N 3.13Å; C145-D149 WeakPolarHBondContact O-CB 3.23Å; C145-D149 PolarHBondContact O-N 3.16Å
146Y89.5Confident88.2Confident82 Ų8226.9 Ų26.932%0.32213%0.128SC..Hα-helixtrans-58.7-46179174.3-101.1000113.1T128 F131 E142 V144 D149 C150T128-Y146 PolarHBondContact O-OH 2.94Å; F131-Y146 HydrophobicContact CE1-CD1 4.11Å; F131-Y146 HydrophobicContact CE1-CE1 4.49Å; E142-Y146 WeakPolarHBondContact O-CB 3.48Å; E142-Y146 PolarHBondContact O-N 3.35Å; V144-Y146 VanDerWaalsContact C-N 3.34Å; V144-Y146 PolarHBondContact O-N 2.92Å; Y146-D149 PolarHBondContact O-N 2.79Å; Y146-C150 VanDerWaalsContact CZ-SG 3.6Å; Y146-C150 WeakPolarHBondContact O-CB 3.46Å; Y146-C150 PolarHBondContact O-N 3.41Å; Y146-C150 PolarHBondContact O-SG 2.81Å
147V90.3Very high88.2Confident0 Ų032.4 Ų32.40%015%0.152CC..Hα-helixtrans-64.5-47.2-179.8171.90000110.8F87 I118 L119 L122 F131 L136 H143 V144 C145 D149 C150 L151F87-V147 HydrophobicContact CE2-CB 4.31Å; F87-V147 HydrophobicContact CE2-CG1 4.07Å; F87-V147 HydrophobicContact CZ-CG1 4.2Å; I118-V147 HydrophobicContact CG2-CG1 4.02Å; L119-V147 HydrophobicContact CD2-CG2 4.23Å; L122-V147 HydrophobicContact CD2-CG2 4.27Å; F131-V147 HydrophobicContact CE2-CG2 4.44Å; F131-V147 HydrophobicContact CZ-CG2 3.73Å; L136-V147 HydrophobicContact CD1-CG2 4.3Å; L136-V147 HydrophobicContact CD2-CG2 4.25Å; H143-V147 VanDerWaalsContact O-CG2 3.31Å; H143-V147 WeakPolarHBondContact O-CG2 3.32Å; H143-V147 PolarHBondContact O-N 2.96Å; H143-V147 VanDerWaalsContact O-N 3.16Å; V144-V147 PolarHBondContact O-N 2.81Å; C145-V147 PolarHBondContact O-N 3Å; V147-D149 VanDerWaalsContact C-N 3.33Å; V147-D149 PolarHBondContact O-N 3.18Å; V147-C150 PolarHBondContact O-N 3.08Å; V147-L151 HydrophobicContact CG1-CD1 4.02Å; V147-L151 VanDerWaalsContact O-CG 3.29Å; V147-L151 WeakPolarHBondContact O-CG 3.25Å; V147-L151 PolarHBondContact O-N 3.34Å; V147-L151 VanDerWaalsContact O-N 3.07Å
148L90.7Very high88.2Confident0 Ų035.7 Ų35.70%016%0.164CC..Hα-helixtrans-64-39.9178.9-70.7175.5000111.9L47 F74 F87 L90 A91 L94 V144 C145 L151 A152L47-L148 HydrophobicContact CD1-CB 3.96Å; L47-L148 HydrophobicContact CD2-CB 3.57Å; L47-L148 HydrophobicContact CD2-CD1 3.98Å; L47-L148 HydrophobicContact CD2-CG 4.45Å; L47-L148 HydrophobicContact CG-CB 4.44Å; F74-L148 HydrophobicContact CD1-CD1 4.45Å; F74-L148 HydrophobicContact CD2-CD1 3.84Å; F74-L148 HydrophobicContact CE1-CD1 4.34Å; F74-L148 HydrophobicContact CE2-CD1 3.73Å; F74-L148 HydrophobicContact CG-CD1 4.22Å; F74-L148 HydrophobicContact CZ-CD1 3.98Å; F87-L148 HydrophobicContact CD2-CD1 3.98Å; F87-L148 HydrophobicContact CD2-CD2 3.84Å; F87-L148 HydrophobicContact CD2-CG 3.79Å; F87-L148 HydrophobicContact CE2-CD2 4.1Å; F87-L148 HydrophobicContact CE2-CG 4.03Å; L90-L148 HydrophobicContact CB-CD2 4.28Å; L90-L148 HydrophobicContact CD2-CD1 3.97Å; L90-L148 HydrophobicContact CD2-CD2 4Å; L90-L148 HydrophobicContact CG-CD2 4.07Å; A91-L148 HydrophobicContact CB-CD2 4.11Å; L94-L148 HydrophobicContact CD1-CD2 4.19Å; V144-L148 HydrophobicContact CG1-CD1 4.2Å; V144-L148 WeakPolarHBondContact O-CG 3.29Å; V144-L148 PolarHBondContact O-N 3.4Å; V144-L148 VanDerWaalsContact O-N 3.14Å; C145-L148 PolarHBondContact O-N 3.13Å; L148-L151 PolarHBondContact O-N 3.33Å; L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 2.69Å
149D90.5Very high88.1Confident18 Ų1838.2 Ų38.210%0.09617%0.173CC..Hα-helixtrans-62.1-48.2178-173.656.6000111.8V43 K50 C145 Y146 V147 L151 A152 E153V43-D149 HydrophobicContact CG1-CB 3.95Å; K50-D149 WeakPolarHBondContact CD-OD1 3.33Å; K50-D149 IonicContact NZ-OD1 2.98Å; K50-D149 PolarHBondContact NZ-OD1 3.3Å; K50-D149 IonicContact NZ-OD2 3.52Å; K50-D149 PolarHBondContact NZ-OD2 2.83Å; C145-D149 WeakPolarHBondContact O-CB 3.23Å; C145-D149 PolarHBondContact O-N 3.16Å; Y146-D149 PolarHBondContact O-N 2.79Å; V147-D149 VanDerWaalsContact C-N 3.33Å; V147-D149 PolarHBondContact O-N 3.18Å; D149-L151 VanDerWaalsContact C-N 3.32Å; D149-L151 PolarHBondContact O-N 3.04Å; D149-A152 PolarHBondContact O-N 2.73Å; D149-E153 WeakPolarHBondContact O-CG 3.5Å; D149-E153 PolarHBondContact O-N 3.29Å
150C89.6Confident87.9Confident6 Ų640.6 Ų40.64%0.04120%0.197CC..Hα-helixtrans-60.1-41175.8-72.80000112.7L122 R127 Y146 V147 E154L122-C150 HydrophobicContact CD1-CB 3.72Å; R127-C150 HydrophobicContact CG-CB 4.29Å; Y146-C150 VanDerWaalsContact CZ-SG 3.6Å; Y146-C150 WeakPolarHBondContact O-CB 3.46Å; Y146-C150 PolarHBondContact O-N 3.41Å; Y146-C150 PolarHBondContact O-SG 2.81Å; V147-C150 PolarHBondContact O-N 3.08Å; C150-E154 PolarHBondContact O-N 3.15Å; C150-E154 VanDerWaalsContact O-N 3.17Å
151L89.4Confident87.5Confident1 Ų140.7 Ų40.71%0.00520%0.2CC..Hα-helixtrans-68.5-37.9177.2-70.4174.2000111.8A91 L94 I95 I118 L122 F125 V147 L148 D149 E154 A155A91-L151 HydrophobicContact CB-CD1 3.89Å; L94-L151 HydrophobicContact CB-CB 3.89Å; L94-L151 HydrophobicContact CD1-CB 3.91Å; I95-L151 HydrophobicContact CD1-CD1 4.4Å; I95-L151 HydrophobicContact CD1-CD2 4.45Å; I95-L151 HydrophobicContact CG1-CD1 4.2Å; I95-L151 HydrophobicContact CG1-CD2 3.74Å; I118-L151 HydrophobicContact CG2-CD1 4.24Å; L122-L151 HydrophobicContact CD1-CD2 3.95Å; L122-L151 HydrophobicContact CD1-CG 4Å; F125-L151 HydrophobicContact CD2-CD2 4.15Å; F125-L151 HydrophobicContact CE2-CD2 4.06Å; V147-L151 HydrophobicContact CG1-CD1 4.02Å; V147-L151 VanDerWaalsContact O-CG 3.29Å; V147-L151 WeakPolarHBondContact O-CG 3.25Å; V147-L151 PolarHBondContact O-N 3.34Å; V147-L151 VanDerWaalsContact O-N 3.07Å; L148-L151 PolarHBondContact O-N 3.33Å; D149-L151 VanDerWaalsContact C-N 3.32Å; D149-L151 PolarHBondContact O-N 3.04Å; L151-E154 PolarHBondContact O-N 2.89Å; L151-A155 WeakPolarHBondContact O-CB 3.45Å; L151-A155 PolarHBondContact O-N 2.9Å
152A89.4Confident86.9Confident0 Ų045 Ų450%022%0.223CC..Hα-helixtrans-66.3-41176.700000111.9L47 K50 L54 L94 L148 D149 E154 A155 L156L47-A152 HydrophobicContact CD1-CB 3.87Å; K50-A152 HydrophobicContact CB-CB 4.09Å; K50-A152 HydrophobicContact CD-CB 4.47Å; L54-A152 HydrophobicContact CD1-CB 4.39Å; L94-A152 HydrophobicContact CD1-CB 4.24Å; L94-A152 HydrophobicContact CD2-CB 4.23Å; L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 2.69Å; D149-A152 PolarHBondContact O-N 2.73Å; A152-E154 VanDerWaalsContact C-N 3.34Å; A152-E154 PolarHBondContact O-N 3.39Å; A152-A155 PolarHBondContact O-N 2.94Å; A152-L156 WeakPolarHBondContact O-CB 3.49Å; A152-L156 WeakPolarHBondContact O-CG 3.48Å; A152-L156 PolarHBondContact O-N 3.01Å
153E89.6Confident86.2Confident52 Ų5251.9 Ų51.924%0.24325%0.246CC..Hα-helixtrans-60.2-43.6173.1-74.1-175.817100112.3K50 R127 D149 L156 K157K50-E153 HydrophobicContact CD-CG 4.11Å; K50-E153 IonicContact NZ-OE1 2.68Å; K50-E153 PolarHBondContact NZ-OE1 3.15Å; R127-E153 IonicContact CZ-OE2 2.76Å; R127-E153 IonicContact NH2-OE2 3.25Å; R127-E153 PolarHBondContact NH2-OE2 3.46Å; D149-E153 WeakPolarHBondContact O-CG 3.5Å; D149-E153 PolarHBondContact O-N 3.29Å; E153-L156 PolarHBondContact O-N 2.99Å; E153-K157 WeakPolarHBondContact O-CG 3.31Å; E153-K157 PolarHBondContact O-N 2.91Å
154E87.5Confident85.4Confident43 Ų4357.4 Ų57.420%0.20127%0.269CS..Hα-helixtrans-69.7-37.1-179.3-157.759.9-154.700111.9F125 C150 L151 A152 K157 Y158F125-E154 HydrophobicContact CB-CG 4.04Å; F125-E154 HydrophobicContact CD1-CG 3.54Å; F125-E154 HydrophobicContact CD2-CG 4.38Å; F125-E154 HydrophobicContact CE1-CG 4Å; F125-E154 HydrophobicContact CG-CG 3.76Å; C150-E154 PolarHBondContact O-N 3.15Å; C150-E154 VanDerWaalsContact O-N 3.17Å; L151-E154 PolarHBondContact O-N 2.89Å; A152-E154 VanDerWaalsContact C-N 3.34Å; A152-E154 PolarHBondContact O-N 3.39Å; E154-K157 PolarHBondContact O-N 3.34Å; E154-K157 WeakPolarHBondContact OE2-CD 3.47Å; E154-K157 IonicContact OE2-NZ 3.36Å; E154-K157 PolarHBondContact OE2-NZ 3.18Å; E154-Y158 WeakPolarHBondContact O-CB 3.49Å; E154-Y158 PolarHBondContact O-N 3.1Å
155A87.1Confident84.3Confident0 Ų068.2 Ų68.20%031%0.31CS..Hα-helixtrans-61.3-42.5170.700000111.9L54 L94 K97 A98 L151 A152 Y158 I159L54-A155 HydrophobicContact CD1-CB 4Å; L54-A155 HydrophobicContact CD2-CB 4.21Å; L94-A155 HydrophobicContact CD2-CB 4.32Å; K97-A155 HydrophobicContact CB-CB 4.04Å; A98-A155 HydrophobicContact CB-CB 4.46Å; L151-A155 WeakPolarHBondContact O-CB 3.45Å; L151-A155 PolarHBondContact O-N 2.9Å; A152-A155 PolarHBondContact O-N 2.94Å; A155-Y158 PolarHBondContact O-N 3Å; A155-I159 WeakPolarHBondContact O-CD1 3.23Å; A155-I159 WeakPolarHBondContact O-CG1 3.29Å; A155-I159 PolarHBondContact O-N 3.38Å
156L86.6Confident83.1Confident21 Ų2172.9 Ų72.911%0.1134%0.341CS..Hα-helixtrans-65.1-39.9176.5-77.5170000112.6K50 L53 L54 A152 E153 I159 G160 F161K50-L156 HydrophobicContact CB-CD1 3.76Å; K50-L156 HydrophobicContact CD-CD1 4.46Å; K50-L156 HydrophobicContact CG-CD1 3.72Å; L53-L156 HydrophobicContact CB-CD2 3.92Å; L54-L156 HydrophobicContact CD1-CG 4.28Å; L54-L156 HydrophobicContact CD2-CD2 3.52Å; L54-L156 HydrophobicContact CD2-CG 3.82Å; L54-L156 HydrophobicContact CG-CD2 3.75Å; L54-L156 HydrophobicContact CG-CG 3.96Å; A152-L156 WeakPolarHBondContact O-CB 3.49Å; A152-L156 WeakPolarHBondContact O-CG 3.48Å; A152-L156 PolarHBondContact O-N 3.01Å; E153-L156 PolarHBondContact O-N 2.99Å; L156-I159 PolarHBondContact O-N 2.88Å; L156-G160 PolarHBondContact O-N 3.48Å; L156-G160 VanDerWaalsContact O-N 3.14Å; L156-F161 HydrophobicContact CD2-CB 3.96Å; L156-F161 HydrophobicContact CD2-CG 4.19Å; L156-F161 PolarHBondContact O-N 3.25Å; L156-F161 VanDerWaalsContact O-N 3.15Å
157K86Confident81.8Confident116 Ų11676.3 Ų76.350%0.50436%0.363SS..Hα-helixtrans-62.2-44.4173.8-73179.8-153.9156.70111.5E153 E154 I159 G160E153-K157 WeakPolarHBondContact O-CG 3.31Å; E153-K157 PolarHBondContact O-N 2.91Å; E154-K157 PolarHBondContact O-N 3.34Å; E154-K157 WeakPolarHBondContact OE2-CD 3.47Å; E154-K157 IonicContact OE2-NZ 3.36Å; E154-K157 PolarHBondContact OE2-NZ 3.18Å; K157-I159 VanDerWaalsContact C-N 3.32Å; K157-I159 PolarHBondContact O-N 2.98Å; K157-G160 PolarHBondContact O-N 3.47Å
158Y85.9Confident80.5Confident158 Ų15885.3 Ų85.362%0.6240%0.398SS*.Hα-helixtrans-63.7-38179-175-98000112.4K97 E154 A155 G160K97-Y158 VanDerWaalsContact O-CD1 3.25Å; K97-Y158 WeakPolarHBondContact O-CD1 3.42Å; E154-Y158 WeakPolarHBondContact O-CB 3.49Å; E154-Y158 PolarHBondContact O-N 3.1Å; A155-Y158 PolarHBondContact O-N 3Å; Y158-G160 PolarHBondContact O-N 2.92Å
159I83.4Confident79.3Confident90 Ų9090.9 Ų90.946%0.46243%0.434SS..Hα-helixtrans-72-14.5175.5-70.1161.4000112L54 A155 L156 K157L54-I159 HydrophobicContact CD2-CD1 3.27Å; A155-I159 WeakPolarHBondContact O-CD1 3.23Å; A155-I159 WeakPolarHBondContact O-CG1 3.29Å; A155-I159 PolarHBondContact O-N 3.38Å; L156-I159 PolarHBondContact O-N 2.88Å; K157-I159 VanDerWaalsContact C-N 3.32Å; K157-I159 PolarHBondContact O-N 2.98Å
160G79.2Confident77.9Confident49 Ų4996.3 Ų96.351%0.50547%0.468SS..THydrogen-bonded Turntrans68.936.1-178.700000112.1L156 K157 Y158 T162L156-G160 PolarHBondContact O-N 3.48Å; L156-G160 VanDerWaalsContact O-N 3.14Å; K157-G160 PolarHBondContact O-N 3.47Å; Y158-G160 PolarHBondContact O-N 2.92Å; G160-T162 PolarHBondContact O-N 2.91Å
161F78.7Confident76Confident79 Ų79104.1 Ų104.135%0.34650%0.504SS..  trans-62.1123.4-179.8178.2-94.9000110.8L53 L156 W163L53-F161 HydrophobicContact CD1-CD1 4.39Å; L53-F161 HydrophobicContact CD1-CE1 3.84Å; L53-F161 HydrophobicContact CD1-CE2 4.47Å; L53-F161 HydrophobicContact CD1-CZ 3.89Å; L53-F161 HydrophobicContact CD2-CE1 4.46Å; L53-F161 HydrophobicContact CD2-CE2 3.89Å; L53-F161 HydrophobicContact CD2-CZ 3.66Å; L53-F161 HydrophobicContact CG-CZ 4.29Å; L156-F161 HydrophobicContact CD2-CB 3.96Å; L156-F161 HydrophobicContact CD2-CG 4.19Å; L156-F161 PolarHBondContact O-N 3.25Å; L156-F161 VanDerWaalsContact O-N 3.15Å; F161-W163 AromaticContact CE1-CD2 3.87Å; F161-W163 HydrophobicContact CE1-CD2 3.87Å; F161-W163 AromaticContact CE1-CE2 3.97Å; F161-W163 HydrophobicContact CE1-CE3 4.13Å; F161-W163 HydrophobicContact CE1-CG 4.24Å; F161-W163 HydrophobicContact CE1-CZ2 4.33Å; F161-W163 HydrophobicContact CE1-CZ3 4.47Å; F161-W163 HydrophobicContact CZ-CD2 4.39Å; F161-W163 HydrophobicContact CZ-CE3 4.22Å; F161-W163 HydrophobicContact CZ-CZ3 4.5Å
162T74.5Confident73.9Confident104 Ų104113 Ų11364%0.63855%0.545SS*.  trans-118.3135.2171.357.90000109.4G160 K164G160-T162 PolarHBondContact O-N 2.91Å; T162-K164 PolarHBondContact O-N 3.41Å
163W74.9Confident71.9Confident208 Ų208120.5 Ų120.579%0.78858%0.584SS**  trans-56.8112.1171.6-66.1100.7000109.9L53 F161L53-W163 HydrophobicContact CD1-CH2 4.24Å; F161-W163 AromaticContact CE1-CD2 3.87Å; F161-W163 HydrophobicContact CE1-CD2 3.87Å; F161-W163 AromaticContact CE1-CE2 3.97Å; F161-W163 HydrophobicContact CE1-CE3 4.13Å; F161-W163 HydrophobicContact CE1-CG 4.24Å; F161-W163 HydrophobicContact CE1-CZ2 4.33Å; F161-W163 HydrophobicContact CE1-CZ3 4.47Å; F161-W163 HydrophobicContact CZ-CD2 4.39Å; F161-W163 HydrophobicContact CZ-CE3 4.22Å; F161-W163 HydrophobicContact CZ-CZ3 4.5Å
164K70.6Confident69.6Low177 Ų177126.8 Ų126.877%0.7761%0.614SS**PPolyproline II helixtrans-70.9145.5170-65.7-175.3179.7-179.10108T162T162-K164 PolarHBondContact O-N 3.41Å
165R68.2Low67.3Low228 Ų228133.8 Ų133.886%0.8665%0.646SS**PPolyproline II helixtrans-55.1136.4172.1-70-173.7178.2-160.4-0.4108.5I167R165-I167 PolarHBondContact O-N 3.09Å
166P64.3Low65Low99 Ų99141.7 Ų141.764%0.64368%0.684SS**PPolyproline II helixtrans-51.4118.5175.4-25.933.9000109.5Y168P166-Y168 HydrophobicContact CB-CE2 4.4Å; P166-Y168 PolarHBondContact O-N 3.36Å
167I61Low62.8Low154 Ų154147.3 Ų147.379%0.7972%0.719SS**  trans-85.699.3169.5-58.5172.1000103.9R165R165-I167 PolarHBondContact O-N 3.09Å
168Y64.4Low60.5Low189 Ų189147.7 Ų147.774%0.74173%0.73SS**  trans-59.1130.3168.2-63.8-82000106.9P166 V170P166-Y168 HydrophobicContact CB-CE2 4.4Å; P166-Y168 PolarHBondContact O-N 3.36Å; Y168-V170 PolarHBondContact O-N 2.91Å
169P63.8Low58.4Low117 Ų117144.2 Ų144.276%0.7673%0.734SS**  trans-53.2116.1168.2-17.829.2000106.2E171P169-E171 PolarHBondContact O-N 3.26Å; P169-E171 VanDerWaalsContact O-N 3.11Å
170V61.2Low56.5Low132 Ų132149.3 Ų149.380%0.876%0.756SS**  trans-61.9115.9159.5-178.30000102.5Y168 E172Y168-V170 PolarHBondContact O-N 2.91Å; V170-E172 PolarHBondContact O-N 3.02Å
171E50.5Low54.4Low169 Ų169154.4 Ų154.479%0.7977%0.772SS**  trans-47.4117.4168.1-74.9177.4153.800105.7P169 L173P169-E171 PolarHBondContact O-N 3.26Å; P169-E171 VanDerWaalsContact O-N 3.11Å; E171-L173 PolarHBondContact O-N 3.21Å
172E45.5Very low53Low189 Ų189158.5 Ų158.588%0.88380%0.797SS**  trans-61.288.9164.7-76.4177.2168.700104.7V170 E174V170-E172 PolarHBondContact O-N 3.02Å; E172-E174 PolarHBondContact O-N 3.41Å
173L47.5Very low51.9Low156 Ų156157.2 Ų157.282%0.81780%0.798SS**  trans-50.8105.3148.9-85.7150.7000103.1E171 E175E171-L173 PolarHBondContact O-N 3.21Å; L173-E175 PolarHBondContact O-N 3.47Å
174E41.9Very low50.5Low185 Ų185156.4 Ų156.486%0.86480%0.803SS**  trans-40.1119.9170-68.7177.7155.500106.3E172 E176E172-E174 PolarHBondContact O-N 3.41Å; E174-E176 PolarHBondContact O-N 3Å
175E38.8Very low49.1Very low189 Ų189156 Ų15688%0.88381%0.808SS**  trans-62.481.8171-75.9-179.2162.100106.9L173 T177L173-E175 PolarHBondContact O-N 3.47Å; E175-T177 PolarHBondContact O-N 2.86Å; E175-T177 VanDerWaalsContact O-N 3.17Å
176E38.9Very low47.8Very low167 Ų167150.4 Ų150.478%0.7880%0.799SS**  trans-59.3116.6156.2-159.9170.4-153.500104.1E174 V178E174-E176 PolarHBondContact O-N 3Å; E176-V178 WeakPolarHBondContact O-CG2 3.5Å; E176-V178 PolarHBondContact O-N 3.43Å
177T39.3Very low46.9Very low139 Ų139152.9 Ų152.985%0.85381%0.806SS**  trans-6681.3178.433.90000108E175 A179E175-T177 PolarHBondContact O-N 2.86Å; E175-T177 VanDerWaalsContact O-N 3.17Å; T177-A179 PolarHBondContact O-N 3.08Å; T177-A179 VanDerWaalsContact O-N 3.13Å
178V38.5Very low46.1Very low123 Ų123152.7 Ų152.775%0.74581%0.807SS**  trans-72.6106.4171.7-164.20000105.8E176 E180E176-V178 WeakPolarHBondContact O-CG2 3.5Å; E176-V178 PolarHBondContact O-N 3.43Å; V178-E180 PolarHBondContact O-N 3.28Å
179A42.4Very low45.4Very low85 Ų85152.2 Ų152.270%0.70281%0.809SS**  trans-49.3130.816600000108.7T177 D181T177-A179 PolarHBondContact O-N 3.08Å; T177-A179 VanDerWaalsContact O-N 3.13Å; A179-D181 PolarHBondContact O-N 3.48Å; A179-D181 VanDerWaalsContact O-N 3.11Å
180E43Very low44.4Very low197 Ų197151.6 Ų151.692%0.92180%0.802SS**  trans-37.6111.3177.6-63.4170.2156.400111.9V178V178-E180 PolarHBondContact O-N 3.28Å
181D34.6Very low43.4Very low156 Ų156153 Ų15383%0.83481%0.806SS**  trans-120.1105.3156.5-151.410000107.4A179 A183A179-D181 PolarHBondContact O-N 3.48Å; A179-D181 VanDerWaalsContact O-N 3.11Å; D181-A183 PolarHBondContact O-N 3.43Å
182D49.8Very low43.1Very low165 Ų165153.8 Ų153.888%0.88281%0.809SS**  trans-80.875.8-170.1-165.918.5000109.8
183A51Low42.9Very low78 Ų78153 Ų15365%0.64581%0.806SS**  trans-159.564.8174.200000114.1D181D181-A183 PolarHBondContact O-N 3.43Å
184E44.9Very low42.3Very low191 Ų191155.3 Ų155.389%0.89381%0.809SS**  trans-116.999.6155.6-72.6-153.9168.100111.4T186E184-T186 PolarHBondContact O-N 3.43Å
185L40.9Very low42.2Very low169 Ų169152.1 Ų152.189%0.88580%0.802SS**  trans-51.8114.6167.4-88.9127.5000110.7L187L185-L187 PolarHBondContact O-N 3.07Å; L185-L187 VanDerWaalsContact O-N 3.08Å
186T40.9Very low42.6Very low109 Ų109152.1 Ų152.167%0.66980%0.802SS**  trans-65.3104.7171.5-37.70000110E184 N188E184-T186 PolarHBondContact O-N 3.43Å; T186-N188 HydrophobicContact CG2-CB 4.37Å; T186-N188 PolarHBondContact O-N 2.99Å
187L46.5Very low42.4Very low151 Ų151152.4 Ų152.479%0.79180%0.803SS**THydrogen-bonded Turntrans-6816.1178.8-111.9160.2000115.2L185L185-L187 PolarHBondContact O-N 3.07Å; L185-L187 VanDerWaalsContact O-N 3.08Å
188N44.1Very low42.6Very low150 Ų150155.3 Ų155.380%0.80281%0.807SS**THydrogen-bonded Turntrans-11015.7-175.8-69.6-24.3000114T186T186-N188 HydrophobicContact CG2-CB 4.37Å; T186-N188 PolarHBondContact O-N 2.99Å
189K48.7Very low42.4Very low180 Ų180154.2 Ų154.278%0.78380%0.801SS**SBendtrans-126.312.1179.2-101.5179.4177.81760114.8
190V43.7Very low42.6Very low103 Ų103156.9 Ų156.962%0.62480%0.804SS**SBendtrans-92.9-10.6-178.8-1710000112.5
191D40.9Very low42.4Very low163 Ų163154.4 Ų154.487%0.87280%0.797SS**SBendtrans-88.8-5-178.9-83.4-11.1000114.9
192E44.3Very low42.8Very low184 Ų184155 Ų15586%0.8679%0.794SS**SBendtrans-114.64.5-178-91.1-177.2168.200115.2
193E39.6Very low42.5Very low174 Ų174155.7 Ų155.781%0.81379%0.792SS**  trans-11439.5174.4-153.9169.7-157.200111.4V195E193-V195 PolarHBondContact O-N 3.39Å
194F36.8Very low42.5Very low204 Ų204159.5 Ų159.590%0.89580%0.802SS**  trans-94.542.8164.2-124-87.4000110.4
195V39.7Very low42.7Very low118 Ų118158.5 Ų158.572%0.71580%0.795SS**  trans-93108.3171.2-179.30000107.6E193 E197E193-V195 PolarHBondContact O-N 3.39Å; V195-E197 PolarHBondContact O-N 3.37Å; V195-E197 VanDerWaalsContact O-N 3.08Å
196E45.4Very low43.3Very low188 Ų188156.5 Ų156.588%0.87978%0.784SS**  trans-6.593.7158.8-64.2172.9162.100115.3
197E35Very low44.1Very low173 Ų173154.3 Ų154.381%0.80877%0.768SS**  trans-107.2108.7144.4-76.9-162.2161.200107.5V195 T199V195-E197 PolarHBondContact O-N 3.37Å; V195-E197 VanDerWaalsContact O-N 3.08Å; E197-T199 VanDerWaalsContact C-N 3.27Å; E197-T199 PolarHBondContact O-N 2.97Å
198E44Very low44.6Very low200 Ų200152.9 Ų152.994%0.93576%0.761SS**  trans-5793.2160.9-74.9-166.9150.400108.7
199T34.8Very low45.5Very low101 Ų101151 Ų15162%0.6275%0.751SS**  trans-103.696.2156.858.50000108E197 N201E197-T199 VanDerWaalsContact C-N 3.27Å; E197-T199 PolarHBondContact O-N 2.97Å; T199-N201 VanDerWaalsContact C-N 3.34Å; T199-N201 PolarHBondContact O-N 3.49Å
200D45.8Very low46.2Very low141 Ų141146.2 Ų146.275%0.75474%0.736SS**  trans-4695.9158.8-165.316.4000109.5
201N38.7Very low47Very low145 Ų145145.3 Ų145.378%0.77573%0.727SS**  trans-133.478.7168.9-93.7-25.2000106.6T199 E203T199-N201 VanDerWaalsContact C-N 3.34Å; T199-N201 PolarHBondContact O-N 3.49Å; N201-E203 PolarHBondContact O-N 3.31Å
202E43.1Very low48Very low168 Ų168143.6 Ų143.679%0.78571%0.712SS**  trans-42.3136.7160.6-74.5-179.1144.600110.7N204E202-N204 PolarHBondContact O-N 2.81Å
203E44.8Very low48.8Very low179 Ų179137.7 Ų137.784%0.83670%0.695SS**  trans-47.995.2173.3-60.5171.6143.900112.1N201 F205N201-E203 PolarHBondContact O-N 3.31Å; E203-F205 PolarHBondContact O-N 3.5Å
204N51.1Low49.6Very low158 Ų158135 Ų13585%0.84568%0.682SS**  trans-79.959.1154.7-100.56.6000109.5E202 I206E202-N204 PolarHBondContact O-N 2.81Å; N204-I206 VanDerWaalsContact C-N 3.34Å; N204-I206 PolarHBondContact O-N 3.29Å; N204-I206 VanDerWaalsContact O-N 3.11Å
205F48.8Very low50.6Low170 Ų170128.9 Ų128.975%0.74666%0.662SS**  trans-73.195.6160.5-167.7-94.9000106.8E203 D207E203-F205 PolarHBondContact O-N 3.5Å; F205-D207 VanDerWaalsContact C-N 3.3Å; F205-D207 HydrophobicContact CD1-CB 4.45Å; F205-D207 PolarHBondContact O-N 3.34Å
206I52.6Low51.4Low127 Ų127131.3 Ų131.365%0.65166%0.659SS**  trans-64.595.9171.9-61.1172.8000107N204 L208 L211N204-I206 VanDerWaalsContact C-N 3.34Å; N204-I206 PolarHBondContact O-N 3.29Å; N204-I206 VanDerWaalsContact O-N 3.11Å; I206-L208 PolarHBondContact O-N 3.04Å; I206-L208 VanDerWaalsContact O-N 3.08Å; I206-L211 HydrophobicContact CG2-CD1 3.4Å; I206-L211 VanDerWaalsContact CG2-CD1 3.4Å; I206-L211 HydrophobicContact CG2-CG 4.4Å
207D57.9Low51.9Low64 Ų64129.3 Ų129.334%0.34265%0.649SS.*  trans-65.3109.8177.5-176.42.8000109.4F205 N209 V210 L211F205-D207 VanDerWaalsContact C-N 3.3Å; F205-D207 HydrophobicContact CD1-CB 4.45Å; F205-D207 PolarHBondContact O-N 3.34Å; D207-N209 PolarHBondContact O-N 3.45Å; D207-N209 WeakPolarHBondContact OD1-CB 3.33Å; D207-N209 PolarHBondContact OD1-N 2.67Å; D207-V210 HydrophobicContact CB-CB 4.33Å; D207-V210 HydrophobicContact CB-CG2 3.87Å; D207-V210 WeakPolarHBondContact O-CB 3.35Å; D207-V210 PolarHBondContact O-N 2.85Å; D207-L211 PolarHBondContact O-N 3.02Å
208L57Low52.8Low121 Ų121126.4 Ų126.463%0.63464%0.639SS**Hα-helixtrans-55.9-22.2177.9-172.262000112.3I206 K212I206-L208 PolarHBondContact O-N 3.04Å; I206-L208 VanDerWaalsContact O-N 3.08Å; L208-K212 PolarHBondContact O-N 3.14Å
209N62.6Low53.2Low111 Ų111121.1 Ų121.159%0.59462%0.617SS**Hα-helixtrans-78-30.7174.6-66-35.1000113.2D207 K212 A213D207-N209 PolarHBondContact O-N 3.45Å; D207-N209 WeakPolarHBondContact OD1-CB 3.33Å; D207-N209 PolarHBondContact OD1-N 2.67Å; N209-K212 PolarHBondContact O-N 3.42Å; N209-A213 WeakPolarHBondContact O-CB 3.23Å; N209-A213 PolarHBondContact O-N 3.04Å
210V63.7Low54.1Low79 Ų79123.1 Ų123.148%0.47962%0.621SS.*Hα-helixtrans-70.2-40.5175.1175.60000110.7D207 A213 Q214D207-V210 HydrophobicContact CB-CB 4.33Å; D207-V210 HydrophobicContact CB-CG2 3.87Å; D207-V210 WeakPolarHBondContact O-CB 3.35Å; D207-V210 PolarHBondContact O-N 2.85Å; V210-A213 PolarHBondContact O-N 3.36Å; V210-Q214 PolarHBondContact O-N 3.36Å
211L60.8Low54.3Low83 Ų83122 Ų12244%0.43562%0.615SS.*Hα-helixtrans-62.4-42.8172.7-87.5159.2000112.1I206 D207 Q214 T215I206-L211 HydrophobicContact CG2-CD1 3.4Å; I206-L211 VanDerWaalsContact CG2-CD1 3.4Å; I206-L211 HydrophobicContact CG2-CG 4.4Å; D207-L211 PolarHBondContact O-N 3.02Å; L211-Q214 PolarHBondContact O-N 2.91Å; L211-T215 PolarHBondContact O-N 2.88Å; L211-T215 PolarHBondContact O-OG1 3.34Å
212K62.7Low54.8Low128 Ų128122 Ų12256%0.55761%0.611SS**Hα-helixtrans-63.7-43.1174.3-94.3-179175.5175.80112.2L208 N209 Q214 T215 Y216L208-K212 PolarHBondContact O-N 3.14Å; N209-K212 PolarHBondContact O-N 3.42Å; K212-Q214 VanDerWaalsContact C-N 3.34Å; K212-Q214 PolarHBondContact O-N 3.28Å; K212-T215 PolarHBondContact O-N 2.93Å; K212-Y216 VanDerWaalsContact O-CD2 3.24Å; K212-Y216 WeakPolarHBondContact O-CD2 3.28Å; K212-Y216 PolarHBondContact O-N 2.96Å; K212-Y216 VanDerWaalsContact O-N 3.09Å
213A60Low55.3Low60 Ų60119.5 Ų119.550%0.49661%0.607SS.*Hα-helixtrans-63.8-38.1178.300000112.4N209 V210 T215 Y216 H217N209-A213 WeakPolarHBondContact O-CB 3.23Å; N209-A213 PolarHBondContact O-N 3.04Å; V210-A213 PolarHBondContact O-N 3.36Å; A213-T215 VanDerWaalsContact C-N 3.35Å; A213-Y216 PolarHBondContact O-N 2.96Å; A213-H217 WeakPolarHBondContact O-CB 3.3Å; A213-H217 PolarHBondContact O-N 3.15Å; A213-H217 VanDerWaalsContact O-N 3.09Å
214Q57.5Low55.7Low116 Ų116115 Ų11554%0.54260%0.6SS.*Hα-helixtrans-65.1-37.2172.4-80.6179.1-17.500112.5V210 L211 K212 H217 L218V210-Q214 PolarHBondContact O-N 3.36Å; L211-Q214 PolarHBondContact O-N 2.91Å; K212-Q214 VanDerWaalsContact C-N 3.34Å; K212-Q214 PolarHBondContact O-N 3.28Å; Q214-H217 PolarHBondContact O-N 3.48Å; Q214-L218 WeakPolarHBondContact O-CD1 3.45Å; Q214-L218 WeakPolarHBondContact O-CG 3.49Å; Q214-L218 PolarHBondContact O-N 3.17Å
215T56.3Low55.6Low77 Ų77116 Ų11647%0.47260%0.597SS.*Hα-helixtrans-65.1-42.8178.2-42.40000111.2L211 K212 A213 H217 L218 D219L211-T215 PolarHBondContact O-N 2.88Å; L211-T215 PolarHBondContact O-OG1 3.34Å; K212-T215 PolarHBondContact O-N 2.93Å; A213-T215 VanDerWaalsContact C-N 3.35Å; T215-H217 VanDerWaalsContact C-N 3.33Å; T215-H217 PolarHBondContact O-N 3.38Å; T215-L218 PolarHBondContact O-N 2.93Å; T215-D219 PolarHBondContact O-N 3.41Å
216Y57.6Low55.5Low169 Ų169116.3 Ų116.366%0.66360%0.601SS**Hα-helixtrans-69.1-27.6174.7-79-73.5000113.8K212 A213 M220K212-Y216 VanDerWaalsContact O-CD2 3.24Å; K212-Y216 WeakPolarHBondContact O-CD2 3.28Å; K212-Y216 PolarHBondContact O-N 2.96Å; K212-Y216 VanDerWaalsContact O-N 3.09Å; A213-Y216 PolarHBondContact O-N 2.96Å; Y216-M220 WeakPolarHBondContact O-CG 3.4Å; Y216-M220 PolarHBondContact O-N 3.34Å
217H55.8Low55.4Low145 Ų145119.3 Ų119.367%0.67161%0.612SS**Hα-helixtrans-79.3-22.3177.7-150.1-65.2000112.9A213 Q214 T215A213-H217 WeakPolarHBondContact O-CB 3.3Å; A213-H217 PolarHBondContact O-N 3.15Å; A213-H217 VanDerWaalsContact O-N 3.09Å; Q214-H217 PolarHBondContact O-N 3.48Å; T215-H217 VanDerWaalsContact C-N 3.33Å; T215-H217 PolarHBondContact O-N 3.38Å
218L53.3Low54.9Low112 Ų112122.7 Ų122.759%0.58663%0.63SS**Hα-helixtrans-76.7-44.9171.1-77.8154.6000111Q214 T215 M220 N221 E222Q214-L218 WeakPolarHBondContact O-CD1 3.45Å; Q214-L218 WeakPolarHBondContact O-CG 3.49Å; Q214-L218 PolarHBondContact O-N 3.17Å; T215-L218 PolarHBondContact O-N 2.93Å; L218-M220 VanDerWaalsContact C-N 3.27Å; L218-M220 PolarHBondContact O-N 3.07Å; L218-N221 PolarHBondContact O-N 3.19Å; L218-E222 PolarHBondContact O-N 3.37Å
219D51.8Low54.9Low90 Ų90123.8 Ų123.848%0.48164%0.635SS.*Hα-helixtrans-62.1-29.9179.2-84.6-16.8000113.8T215T215-D219 PolarHBondContact O-N 3.41Å
220M54.5Low54.8Low143 Ų143126.9 Ų126.970%0.70465%0.651SS**Hα-helixtrans-83-9.9177.7-69.6-79.981.100114.3Y216 L218Y216-M220 WeakPolarHBondContact O-CG 3.4Å; Y216-M220 PolarHBondContact O-N 3.34Å; L218-M220 VanDerWaalsContact C-N 3.27Å; L218-M220 PolarHBondContact O-N 3.07Å
221N49.1Very low54.2Low118 Ų118130.7 Ų130.763%0.63166%0.664SS**Hα-helixtrans-109.3-13.6-178.9-138.617000112.8L218L218-N221 PolarHBondContact O-N 3.19Å
222E50.2Low53.9Low145 Ų145131.1 Ų131.168%0.67867%0.674SS**Hα-helixtrans-85.8-20.7173.8-79-168.3152.800114L218 A224L218-E222 PolarHBondContact O-N 3.37Å; E222-A224 PolarHBondContact O-N 3.3Å
223T52.8Low53.8Low114 Ų114131.9 Ų131.970%0.69969%0.689SS**THydrogen-bonded Turntrans-76.6-5.2-179.841.20000114.7
224A54.2Low53.9Low85 Ų85132.6 Ų132.670%0.70269%0.687SS**THydrogen-bonded Turntrans-111.53.4-177.700000115E222E222-A224 PolarHBondContact O-N 3.3Å
225K48.9Very low54.7Low180 Ų180131.5 Ų131.578%0.78369%0.685SS**SBendtrans-119.497.7170-74.5-177.7-178.7176.30108.7E227K225-E227 PolarHBondContact O-N 3.02Å
226Q46.4Very low55.7Low176 Ų176131.7 Ų131.782%0.82269%0.694SS**  trans-20.8120.6157.4-164.2162.9-14.700111.5D228Q226-D228 PolarHBondContact O-N 3.46Å
227E50.5Low56.5Low190 Ų190126.1 Ų126.189%0.88868%0.684SS**  trans-5986.6169.2-68.8-170.7168.300108.6K225 I229K225-E227 PolarHBondContact O-N 3.02Å; E227-I229 PolarHBondContact O-N 2.98Å
228D48Very low57.7Low135 Ų135125 Ų12572%0.72268%0.679SS**  trans-61.7119.3154.2-81.1-24.2000105.4Q226 L230Q226-D228 PolarHBondContact O-N 3.46Å; D228-L230 PolarHBondContact O-N 3.45Å
229I56.8Low59Low144 Ų144127.9 Ų127.974%0.73868%0.682SS**  trans-44113.4176-64.6165000107.5E227 E231E227-I229 PolarHBondContact O-N 2.98Å; I229-E231 HydrophobicContact CG2-CG 4.15Å; I229-E231 PolarHBondContact O-N 3.39Å
230L59.5Low60.5Low175 Ų175126.4 Ų126.492%0.91668%0.678SS**  trans-65.386.2173.4-72.3164.4000107.6D228 S232D228-L230 PolarHBondContact O-N 3.45Å; L230-S232 PolarHBondContact O-N 2.8Å; L230-S232 VanDerWaalsContact O-N 3.16Å
231E52.5Low61.9Low160 Ų160125 Ų12575%0.74867%0.673SS**  trans-69.3109.5168.5-68.7-173178.100107.5I229 T233I229-E231 HydrophobicContact CG2-CG 4.15Å; I229-E231 PolarHBondContact O-N 3.39Å; E231-T233 PolarHBondContact O-N 2.86Å
232S54.5Low63.5Low92 Ų92123.4 Ų123.464%0.64366%0.662SS**  trans-57.4100.2170.9167.50000108.9L230 T234L230-S232 PolarHBondContact O-N 2.8Å; L230-S232 VanDerWaalsContact O-N 3.16Å; S232-T234 PolarHBondContact O-N 3.48Å; S232-T234 PolarHBondContact OG-N 2.87Å; S232-T234 PolarHBondContact OG-O 3.14Å; S232-T234 PolarHBondContact OG-OG1 3.4Å
233T59.3Low65.2Low144 Ų144119.2 Ų119.288%0.88365%0.646SS**  trans-75.31.8166.945.90000112.2E231 D235E231-T233 PolarHBondContact O-N 2.86Å; T233-D235 PolarHBondContact O-N 3.39Å
234T62.8Low66.6Low75 Ų75120 Ų12046%0.4664%0.642SS.*  trans-74.9119.7175.45.60000111.1S232S232-T234 PolarHBondContact O-N 3.48Å; S232-T234 PolarHBondContact OG-N 2.87Å; S232-T234 PolarHBondContact OG-O 3.14Å; S232-T234 PolarHBondContact OG-OG1 3.4Å
235D74.4Confident68.2Low93 Ų93122.6 Ų122.650%0.49763%0.634SS.*  trans-63.1136.5173-179.621.6000110.3T233 A237 E238 W239T233-D235 PolarHBondContact O-N 3.39Å; D235-A237 PolarHBondContact O-N 3.16Å; D235-E238 HydrophobicContact CB-CB 4.33Å; D235-E238 HydrophobicContact CB-CG 4.09Å; D235-E238 PolarHBondContact O-N 3.37Å; D235-E238 VanDerWaalsContact O-N 3.08Å; D235-W239 PolarHBondContact O-N 3.45Å
236A76.3Confident69.8Low80 Ų80115.8 Ų115.866%0.66161%0.607SS**Hα-helixtrans-60.6-28.9-178.200000111.9S240A236-S240 WeakPolarHBondContact O-CB 3.49Å; A236-S240 PolarHBondContact O-N 3.07Å
237A75.8Confident71.4Confident53 Ų53112.7 Ų112.744%0.43860%0.596SS.*Hα-helixtrans-71.3-41.9175.400000112.3D235 W239 S240 L241D235-A237 PolarHBondContact O-N 3.16Å; A237-W239 VanDerWaalsContact C-N 3.34Å; A237-S240 PolarHBondContact O-N 3.46Å; A237-L241 WeakPolarHBondContact O-CG 3.21Å; A237-L241 PolarHBondContact O-N 2.93Å
238E79.2Confident72.7Confident122 Ų122108 Ų10857%0.5758%0.581SS**Hα-helixtrans-65.1-38.9175.8-68.4-175.2163.200111.5D235 L241 E242D235-E238 HydrophobicContact CB-CB 4.33Å; D235-E238 HydrophobicContact CB-CG 4.09Å; D235-E238 PolarHBondContact O-N 3.37Å; D235-E238 VanDerWaalsContact O-N 3.08Å; E238-L241 PolarHBondContact O-N 3.15Å; E238-E242 WeakPolarHBondContact O-CB 3.44Å; E238-E242 PolarHBondContact O-N 2.96Å
239W82Confident73.8Confident171 Ų171108.3 Ų108.365%0.64858%0.579SS**Hα-helixtrans-67.2-39.9175.7-160.179.3000112.2D235 A237 L241 E242 V243D235-W239 PolarHBondContact O-N 3.45Å; A237-W239 VanDerWaalsContact C-N 3.34Å; W239-L241 VanDerWaalsContact C-N 3.34Å; W239-L241 PolarHBondContact O-N 3.4Å; W239-E242 PolarHBondContact O-N 3.36Å; W239-V243 HydrophobicContact CD2-CG2 4.06Å; W239-V243 HydrophobicContact CE3-CG2 3.81Å; W239-V243 HydrophobicContact CH2-CG2 3.97Å; W239-V243 HydrophobicContact CZ2-CG2 4.2Å; W239-V243 HydrophobicContact CZ3-CG2 3.76Å; W239-V243 VanDerWaalsContact O-CG2 3.31Å; W239-V243 WeakPolarHBondContact O-CG2 3.36Å; W239-V243 PolarHBondContact O-N 2.76Å
240S81.9Confident74.7Confident59 Ų59107.4 Ų107.441%0.41358%0.575SS.*Hα-helixtrans-62.8-40.9174.6-170.40000112A236 A237 E242 V243 E244A236-S240 WeakPolarHBondContact O-CB 3.49Å; A236-S240 PolarHBondContact O-N 3.07Å; A237-S240 PolarHBondContact O-N 3.46Å; S240-E242 VanDerWaalsContact C-N 3.33Å; S240-V243 PolarHBondContact O-N 2.83Å; S240-E244 WeakPolarHBondContact O-CG 3.47Å; S240-E244 PolarHBondContact O-N 3.13Å
241L83.8Confident75.2Confident114 Ų114106.3 Ų106.360%0.59756%0.563SS**Hα-helixtrans-65.5-38.3176.2-74.9171000111.7A237 E238 W239 E244 R245A237-L241 WeakPolarHBondContact O-CG 3.21Å; A237-L241 PolarHBondContact O-N 2.93Å; E238-L241 PolarHBondContact O-N 3.15Å; W239-L241 VanDerWaalsContact C-N 3.34Å; W239-L241 PolarHBondContact O-N 3.4Å; L241-E244 PolarHBondContact O-N 3.26Å; L241-R245 VanDerWaalsContact O-CB 3.27Å; L241-R245 WeakPolarHBondContact O-CB 3.45Å; L241-R245 PolarHBondContact O-N 3.48Å
242E83.7Confident75.9Confident84 Ų84104.5 Ų104.539%0.39356%0.562SS.*Hα-helixtrans-68.3-39.9176.5-173.360.7-166.100111.9E238 W239 S240 R245 V246E238-E242 WeakPolarHBondContact O-CB 3.44Å; E238-E242 PolarHBondContact O-N 2.96Å; W239-E242 PolarHBondContact O-N 3.36Å; S240-E242 VanDerWaalsContact C-N 3.33Å; E242-R245 WeakPolarHBondContact O-CB 3.48Å; E242-R245 PolarHBondContact O-N 3.29Å; E242-R245 IonicContact OE1-CZ 3.53Å; E242-R245 IonicContact OE1-NE 2.76Å; E242-R245 PolarHBondContact OE1-NE 2.9Å; E242-R245 IonicContact OE1-NH2 2.8Å; E242-R245 PolarHBondContact OE1-NH2 2.98Å; E242-R245 IonicContact OE2-CZ 2.58Å; E242-R245 IonicContact OE2-NE 2.96Å; E242-R245 PolarHBondContact OE2-NE 2.89Å; E242-R245 IonicContact OE2-NH2 3.81Å; E242-R245 PolarHBondContact OE2-NH2 2.91Å; E242-V246 WeakPolarHBondContact O-CB 3.37Å; E242-V246 VanDerWaalsContact O-CG2 3.28Å; E242-V246 WeakPolarHBondContact O-CG2 3.36Å; E242-V246 PolarHBondContact O-N 2.58Å
243V84.9Confident76.3Confident58 Ų58104.5 Ų104.535%0.35256%0.558SS.*Hα-helixtrans-62-45.6172.5169.30000110.8W239 S240 R245 V246 L247W239-V243 HydrophobicContact CD2-CG2 4.06Å; W239-V243 HydrophobicContact CE3-CG2 3.81Å; W239-V243 HydrophobicContact CH2-CG2 3.97Å; W239-V243 HydrophobicContact CZ2-CG2 4.2Å; W239-V243 HydrophobicContact CZ3-CG2 3.76Å; W239-V243 VanDerWaalsContact O-CG2 3.31Å; W239-V243 WeakPolarHBondContact O-CG2 3.36Å; W239-V243 PolarHBondContact O-N 2.76Å; S240-V243 PolarHBondContact O-N 2.83Å; V243-R245 VanDerWaalsContact C-N 3.3Å; V243-R245 PolarHBondContact O-N 3.32Å; V243-V246 PolarHBondContact O-N 3.11Å; V243-L247 HydrophobicContact CG1-CD1 4.27Å; V243-L247 VanDerWaalsContact O-CB 3.31Å; V243-L247 WeakPolarHBondContact O-CB 3.43Å; V243-L247 PolarHBondContact O-N 2.85Å
244E83.2Confident76.4Confident131 Ų131104.2 Ų104.261%0.61255%0.55SS**Hα-helixtrans-64.9-33.2176.2-75-171.3172.500112.7S240 L241 P248S240-E244 WeakPolarHBondContact O-CG 3.47Å; S240-E244 PolarHBondContact O-N 3.13Å; L241-E244 PolarHBondContact O-N 3.26Å; E244-P248 VanDerWaalsContact O-CD 3.31Å; E244-P248 WeakPolarHBondContact O-CD 3.43Å
245R86.9Confident76.3Confident138 Ų138110.6 Ų110.652%0.52157%0.566SS.*Hα-helixtrans-68.7-38.5175.6-170.6-175.476.881.8-2.6112.3L241 E242 V243 P248L241-R245 VanDerWaalsContact O-CB 3.27Å; L241-R245 WeakPolarHBondContact O-CB 3.45Å; L241-R245 PolarHBondContact O-N 3.48Å; E242-R245 WeakPolarHBondContact O-CB 3.48Å; E242-R245 PolarHBondContact O-N 3.29Å; E242-R245 IonicContact OE1-CZ 3.53Å; E242-R245 IonicContact OE1-NE 2.76Å; E242-R245 PolarHBondContact OE1-NE 2.9Å; E242-R245 IonicContact OE1-NH2 2.8Å; E242-R245 PolarHBondContact OE1-NH2 2.98Å; E242-R245 IonicContact OE2-CZ 2.58Å; E242-R245 IonicContact OE2-NE 2.96Å; E242-R245 PolarHBondContact OE2-NE 2.89Å; E242-R245 IonicContact OE2-NH2 3.81Å; E242-R245 PolarHBondContact OE2-NH2 2.91Å; V243-R245 VanDerWaalsContact C-N 3.3Å; V243-R245 PolarHBondContact O-N 3.32Å; R245-P248 WeakPolarHBondContact O-CD 3.43Å
246V83.5Confident75.7Confident37 Ų37112.2 Ų112.222%0.22458%0.579CS.*Hα-helixtrans-91.5-20.2-175.8-179.50000112.1E242 V243 P248 Q249 L250E242-V246 WeakPolarHBondContact O-CB 3.37Å; E242-V246 VanDerWaalsContact O-CG2 3.28Å; E242-V246 WeakPolarHBondContact O-CG2 3.36Å; E242-V246 PolarHBondContact O-N 2.58Å; V243-V246 PolarHBondContact O-N 3.11Å; V246-P248 VanDerWaalsContact C-N 3.33Å; V246-Q249 WeakPolarHBondContact O-CA 3.32Å; V246-Q249 WeakPolarHBondContact O-CB 3.47Å; V246-Q249 PolarHBondContact O-N 2.85Å; V246-L250 HydrophobicContact CG1-CD1 3.78Å; V246-L250 HydrophobicContact CG1-CG 3.87Å; V246-L250 PolarHBondContact O-N 3.15Å
247L79.3Confident75Confident112 Ų112112.7 Ų112.759%0.58657%0.571SS**Hα-helixtrans-48.7-44.2176.4-15092.8000113.9V243 Q249 L250 K251V243-L247 HydrophobicContact CG1-CD1 4.27Å; V243-L247 VanDerWaalsContact O-CB 3.31Å; V243-L247 WeakPolarHBondContact O-CB 3.43Å; V243-L247 PolarHBondContact O-N 2.85Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; L247-Q249 PolarHBondContact O-N 3.46Å; L247-L250 PolarHBondContact O-N 3.41Å; L247-K251 PolarHBondContact O-N 3.49Å; L247-K251 VanDerWaalsContact O-N 3.09Å
248P77.7Confident74.3Confident90 Ų90115.7 Ų115.758%0.58458%0.579SS**Hα-helixtrans-70.1-27.5178.4-17.232.6000112.8E244 R245 V246E244-P248 VanDerWaalsContact O-CD 3.31Å; E244-P248 WeakPolarHBondContact O-CD 3.43Å; R245-P248 WeakPolarHBondContact O-CD 3.43Å; V246-P248 VanDerWaalsContact C-N 3.33Å
249Q72.6Confident73.6Confident142 Ų142118.2 Ų118.266%0.66459%0.588SS**Hα-helixtrans-79.7-28.8178-57.6-175.72.800111.9V246 L247V246-Q249 WeakPolarHBondContact O-CA 3.32Å; V246-Q249 WeakPolarHBondContact O-CB 3.47Å; V246-Q249 PolarHBondContact O-N 2.85Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; L247-Q249 PolarHBondContact O-N 3.46Å
250L74.4Confident73.4Confident126 Ų126111.6 Ų111.666%0.6657%0.566SS**Hα-helixtrans-83.3-14173.5-70.6169.4000113.3V246 L247 V252V246-L250 HydrophobicContact CG1-CD1 3.78Å; V246-L250 HydrophobicContact CG1-CG 3.87Å; V246-L250 PolarHBondContact O-N 3.15Å; L247-L250 PolarHBondContact O-N 3.41Å; L250-V252 PolarHBondContact O-N 2.94Å
251K71.1Confident73.5Confident152 Ų152116.2 Ų116.266%0.66157%0.574SS**  trans-71.985.8173.7-167175.2-177.7176.80108.7L247 T253L247-K251 PolarHBondContact O-N 3.49Å; L247-K251 VanDerWaalsContact O-N 3.09Å; K251-T253 HydrophobicContact CG-CG2 4.39Å; K251-T253 PolarHBondContact O-N 3.42Å
252V66.1Low73.4Confident122 Ų122117.4 Ų117.474%0.73957%0.571SS**  trans-65.885.9172.4-176.20000108.2L250 I254L250-V252 PolarHBondContact O-N 2.94Å; V252-I254 HydrophobicContact CG1-CG1 4.11Å; V252-I254 PolarHBondContact O-N 3.1Å; V252-I254 VanDerWaalsContact O-N 3.1Å
253T63Low73.5Confident92 Ų92116.2 Ų116.256%0.56457%0.566SS**  trans-73.497.5164.146.80000106.8K251 R255K251-T253 HydrophobicContact CG-CG2 4.39Å; K251-T253 PolarHBondContact O-N 3.42Å; T253-R255 VanDerWaalsContact C-N 3.26Å; T253-R255 PolarHBondContact O-N 3.39Å
254I61.7Low73.5Confident138 Ų138117.8 Ų117.871%0.70857%0.57SS**  trans-61.996.4166.3-56.5171.6000105.7V252 T256V252-I254 HydrophobicContact CG1-CG1 4.11Å; V252-I254 PolarHBondContact O-N 3.1Å; V252-I254 VanDerWaalsContact O-N 3.1Å; I254-T256 PolarHBondContact O-N 2.94Å
255R61Low73.9Confident209 Ų209113.9 Ų113.979%0.78956%0.555SS**  trans-72.3123.1169.2-66-167.5177.9-153.51.2105.6T253 D257T253-R255 VanDerWaalsContact C-N 3.26Å; T253-R255 PolarHBondContact O-N 3.39Å; R255-D257 PolarHBondContact O-N 3.48Å
256T61.6Low74Confident127 Ų127112.5 Ų112.578%0.77956%0.557SS**  trans-66.782.8169.147.50000107.5I254I254-T256 PolarHBondContact O-N 2.94Å
257D60.6Low74.3Confident90 Ų90114.3 Ų114.348%0.48156%0.563SS.*  trans-87144.8176.1-160.2-10.3000108.3R255 K259 D260R255-D257 PolarHBondContact O-N 3.48Å; D257-K259 PolarHBondContact O-N 2.86Å; D257-D260 VanDerWaalsContact O-CB 3.28Å; D257-D260 WeakPolarHBondContact O-CB 3.44Å; D257-D260 PolarHBondContact O-N 3.32Å
258N61.7Low75Confident115 Ų115114.6 Ų114.662%0.61556%0.563SS**THydrogen-bonded Turntrans-68.3-0.2178.7-157.816.5000112.4H264N258-H264 PolarHBondContact O-NE2 2.76Å
259K65.2Low75.9Confident175 Ų175115.5 Ų115.576%0.76156%0.56SS**THydrogen-bonded Turntrans-95.24.6170.4-61178.8179.8179.90112.8D257 W261D257-K259 PolarHBondContact O-N 2.86Å; K259-W261 PolarHBondContact O-N 3.21Å
260D77.3Confident77Confident33 Ų33115.4 Ų115.418%0.17656%0.559CS.*  trans-71111.7174.1-167.3-9.5000108.9D257 R262 I263D257-D260 VanDerWaalsContact O-CB 3.28Å; D257-D260 WeakPolarHBondContact O-CB 3.44Å; D257-D260 PolarHBondContact O-N 3.32Å; D260-R262 PolarHBondContact O-N 3.16Å; D260-R262 WeakPolarHBondContact OD1-CB 3.49Å; D260-R262 WeakPolarHBondContact OD1-CG 3.35Å; D260-R262 PolarHBondContact OD1-N 3.43Å; D260-R262 VanDerWaalsContact OD1-N 3.11Å; D260-I263 HydrophobicContact CB-CD1 4.28Å; D260-I263 HydrophobicContact CB-CG1 4.36Å; D260-I263 PolarHBondContact O-N 2.96Å
261W83.8Confident78Confident155 Ų155115.3 Ų115.359%0.58756%0.555SS**Hα-helixtrans-53.2-23.4177.165.6-90.8000112.6K259 H264 V265K259-W261 PolarHBondContact O-N 3.21Å; W261-H264 PolarHBondContact O-N 2.72Å; W261-V265 HydrophobicContact CE3-CG2 3.78Å; W261-V265 HydrophobicContact CZ3-CG2 4.13Å; W261-V265 VanDerWaalsContact O-CG2 3.32Å; W261-V265 WeakPolarHBondContact O-CG2 3.2Å; W261-V265 PolarHBondContact O-N 2.68Å
262R83.1Confident79.3Confident139 Ų139113.8 Ų113.853%0.52555%0.549SS..Hα-helixtrans-60.7-42.7174.1-68.3176.3159.982.21.8112.5D260 H264 V265 D266D260-R262 PolarHBondContact O-N 3.16Å; D260-R262 WeakPolarHBondContact OD1-CB 3.49Å; D260-R262 WeakPolarHBondContact OD1-CG 3.35Å; D260-R262 PolarHBondContact OD1-N 3.43Å; D260-R262 VanDerWaalsContact OD1-N 3.11Å; R262-H264 VanDerWaalsContact C-N 3.34Å; R262-V265 PolarHBondContact O-N 2.99Å; R262-D266 PolarHBondContact O-N 3.22Å
263I85.2Confident80.7Confident59 Ų59111.7 Ų111.730%0.30354%0.539SS..Hα-helixtrans-65.3-42.1178.5-61.4173000109.6D260 V265 D266 Q267D260-I263 HydrophobicContact CB-CD1 4.28Å; D260-I263 HydrophobicContact CB-CG1 4.36Å; D260-I263 PolarHBondContact O-N 2.96Å; I263-V265 VanDerWaalsContact C-N 3.35Å; I263-V265 PolarHBondContact O-N 3.33Å; I263-D266 PolarHBondContact O-N 3.12Å; I263-Q267 HydrophobicContact CG2-CG 4.49Å; I263-Q267 WeakPolarHBondContact O-CB 3.35Å; I263-Q267 VanDerWaalsContact O-CG 3.26Å; I263-Q267 WeakPolarHBondContact O-CG 3.31Å; I263-Q267 PolarHBondContact O-N 3.12Å
264H85.3Confident82.3Confident92 Ų92109.2 Ų109.243%0.42653%0.532SS..Hα-helixtrans-64.9-36.6175.4-62.7-45.6000112.9N258 W261 R262 Q267 M268N258-H264 PolarHBondContact O-NE2 2.76Å; W261-H264 PolarHBondContact O-N 2.72Å; R262-H264 VanDerWaalsContact C-N 3.34Å; H264-Q267 PolarHBondContact ND1-OE1 2.68Å; H264-Q267 PolarHBondContact O-N 2.71Å; H264-M268 WeakPolarHBondContact O-CB 3.39Å; H264-M268 PolarHBondContact O-N 3.36Å
265V90.4Very high84Confident49 Ų49108 Ų10830%0.29753%0.526SS..Hα-helixtrans-67.3-41.1174.7169.10000111.1W261 R262 I263 M268 H269W261-V265 HydrophobicContact CE3-CG2 3.78Å; W261-V265 HydrophobicContact CZ3-CG2 4.13Å; W261-V265 VanDerWaalsContact O-CG2 3.32Å; W261-V265 WeakPolarHBondContact O-CG2 3.2Å; W261-V265 PolarHBondContact O-N 2.68Å; R262-V265 PolarHBondContact O-N 2.99Å; I263-V265 VanDerWaalsContact C-N 3.35Å; I263-V265 PolarHBondContact O-N 3.33Å; V265-M268 PolarHBondContact O-N 3.37Å; V265-H269 PolarHBondContact O-N 3.49Å; V265-H269 PolarHBondContact O-ND1 3.32Å
266D88.8Confident85.7Confident108 Ų108103.3 Ų103.358%0.57851%0.513SS*.Hα-helixtrans-66-41.8175.9-72.7-20.4000111.4R262 I263 M268 H269 Q270R262-D266 PolarHBondContact O-N 3.22Å; I263-D266 PolarHBondContact O-N 3.12Å; D266-M268 VanDerWaalsContact C-N 3.35Å; D266-M268 PolarHBondContact O-N 3.34Å; D266-H269 PolarHBondContact O-N 2.85Å; D266-Q270 PolarHBondContact O-N 3.4Å
267Q91.3Very high87.4Confident75 Ų75100.9 Ų100.935%0.3550%0.501SS..Hα-helixtrans-58.8-43.5171.6-74.4170.1-16.700111.7I263 H264 H269 Q270 H271I263-Q267 HydrophobicContact CG2-CG 4.49Å; I263-Q267 WeakPolarHBondContact O-CB 3.35Å; I263-Q267 VanDerWaalsContact O-CG 3.26Å; I263-Q267 WeakPolarHBondContact O-CG 3.31Å; I263-Q267 PolarHBondContact O-N 3.12Å; H264-Q267 PolarHBondContact ND1-OE1 2.68Å; H264-Q267 PolarHBondContact O-N 2.71Å; Q267-H269 VanDerWaalsContact C-N 3.34Å; Q267-H269 PolarHBondContact O-N 3.09Å; Q267-Q270 WeakPolarHBondContact O-CB 3.08Å; Q267-Q270 PolarHBondContact O-N 3.24Å; Q267-Q270 VanDerWaalsContact O-N 3.16Å; Q267-H271 PolarHBondContact O-CD2 3.07Å; Q267-H271 PolarHBondContact O-N 3.44Å
268M93.9Very high89.1Confident119 Ų11999 Ų9959%0.58650%0.497SS*.Hα-helixtrans-61.9-40.5177.3-171.3-178.372.300112H264 V265 D266 K272H264-M268 WeakPolarHBondContact O-CB 3.39Å; H264-M268 PolarHBondContact O-N 3.36Å; V265-M268 PolarHBondContact O-N 3.37Å; D266-M268 VanDerWaalsContact C-N 3.35Å; D266-M268 PolarHBondContact O-N 3.34Å; M268-K272 VanDerWaalsContact O-CB 3.28Å; M268-K272 WeakPolarHBondContact O-CB 3.28Å; M268-K272 PolarHBondContact O-N 3.17Å
269H96.1Very high90.8Very high109 Ų10999.1 Ų99.151%0.50550%0.497SS..Hα-helixtrans-66-39.1174.2-72.996.6000112V265 D266 Q267 K272 S273V265-H269 PolarHBondContact O-N 3.49Å; V265-H269 PolarHBondContact O-ND1 3.32Å; D266-H269 PolarHBondContact O-N 2.85Å; Q267-H269 VanDerWaalsContact C-N 3.34Å; Q267-H269 PolarHBondContact O-N 3.09Å; H269-K272 PolarHBondContact O-N 3.14Å; H269-S273 PolarHBondContact O-N 3.29Å
270Q96.1Very high92.3Very high140 Ų14098.9 Ų98.965%0.65450%0.496SS*.Hα-helixtrans-63-48.4175.9-173.9175.50.700111.6D266 Q267 S273 G274D266-Q270 PolarHBondContact O-N 3.4Å; Q267-Q270 WeakPolarHBondContact O-CB 3.08Å; Q267-Q270 PolarHBondContact O-N 3.24Å; Q267-Q270 VanDerWaalsContact O-N 3.16Å; Q270-S273 PolarHBondContact O-N 3.18Å; Q270-G274 PolarHBondContact O-N 2.83Å
271H95.6Very high93.2Very high123 Ų123102.8 Ų102.857%0.56951%0.514SS*.Hα-helixtrans-62.3-43.4175.9-67.2-49.5000111.9Q267 S273 G274 I275Q267-H271 PolarHBondContact O-CD2 3.07Å; Q267-H271 PolarHBondContact O-N 3.44Å; H271-S273 VanDerWaalsContact C-N 3.33Å; H271-S273 PolarHBondContact O-N 3.29Å; H271-G274 PolarHBondContact O-N 2.93Å; H271-G274 VanDerWaalsContact O-N 3.13Å; H271-I275 VanDerWaalsContact O-CG1 3.29Å; H271-I275 WeakPolarHBondContact O-CG1 3.3Å; H271-I275 PolarHBondContact O-N 3.29Å
272K96.9Very high93.8Very high121 Ų12199.7 Ų99.753%0.52651%0.512SS..Hα-helixtrans-56.8-47.1175.2179-179.3172.8-178.10111.5M268 H269 G274 I275 E276M268-K272 VanDerWaalsContact O-CB 3.28Å; M268-K272 WeakPolarHBondContact O-CB 3.28Å; M268-K272 PolarHBondContact O-N 3.17Å; H269-K272 PolarHBondContact O-N 3.14Å; K272-G274 VanDerWaalsContact C-N 3.31Å; K272-G274 PolarHBondContact O-N 2.96Å; K272-I275 PolarHBondContact O-N 3.27Å; K272-E276 WeakPolarHBondContact CE-OE1 3.3Å; K272-E276 IonicContact NZ-OE1 3.36Å; K272-E276 WeakPolarHBondContact O-CG 3.46Å; K272-E276 PolarHBondContact O-N 3.28Å
273S97.1Very high94.5Very high77 Ų7799.3 Ų99.354%0.53851%0.514SS..Hα-helixtrans-64.1-37.1177.4-174.30000112.2H269 Q270 H271 S277H269-S273 PolarHBondContact O-N 3.29Å; Q270-S273 PolarHBondContact O-N 3.18Å; H271-S273 VanDerWaalsContact C-N 3.33Å; H271-S273 PolarHBondContact O-N 3.29Å; S273-S277 WeakPolarHBondContact O-CB 3.4Å; S273-S277 PolarHBondContact O-N 2.91Å
274G96.7Very high95Very high40 Ų4098 Ų9841%0.41252%0.515SS..Hα-helixtrans-62.4-47.7174.500000111.8Q270 H271 K272 E276 S277 A278Q270-G274 PolarHBondContact O-N 2.83Å; H271-G274 PolarHBondContact O-N 2.93Å; H271-G274 VanDerWaalsContact O-N 3.13Å; K272-G274 VanDerWaalsContact C-N 3.31Å; K272-G274 PolarHBondContact O-N 2.96Å; G274-E276 PolarHBondContact O-N 3.38Å; G274-S277 PolarHBondContact O-N 3.29Å; G274-A278 WeakPolarHBondContact O-CB 2.99Å; G274-A278 PolarHBondContact O-N 3.31Å
275I96.4Very high95.5Very high114 Ų11499 Ų9959%0.58552%0.518SS*.Hα-helixtrans-61.3-44.7176.9-67.5164.8000110.8H271 K272 S277 A278 L279H271-I275 VanDerWaalsContact O-CG1 3.29Å; H271-I275 WeakPolarHBondContact O-CG1 3.3Å; H271-I275 PolarHBondContact O-N 3.29Å; K272-I275 PolarHBondContact O-N 3.27Å; I275-S277 VanDerWaalsContact C-N 3.32Å; I275-S277 PolarHBondContact O-N 2.81Å; I275-A278 PolarHBondContact O-N 3.39Å; I275-L279 WeakPolarHBondContact O-CB 3.4Å; I275-L279 PolarHBondContact O-N 3.5Å
276E97.4Very high95.9Very high110 Ų110102.1 Ų102.151%0.51453%0.532SS..Hα-helixtrans-62.6-38.7178.1-76.8177.8-177.700112.3K272 G274 K280K272-E276 WeakPolarHBondContact CE-OE1 3.3Å; K272-E276 IonicContact NZ-OE1 3.36Å; K272-E276 WeakPolarHBondContact O-CG 3.46Å; K272-E276 PolarHBondContact O-N 3.28Å; G274-E276 PolarHBondContact O-N 3.38Å; E276-K280 WeakPolarHBondContact O-CB 3.43Å; E276-K280 PolarHBondContact O-N 3.49Å
277S97.1Very high96.3Very high76 Ų76100.8 Ų100.853%0.53153%0.525SS..Hα-helixtrans-67.1-49.9175.8-172.10000111.7S273 G274 I275 L279 K280 E281S273-S277 WeakPolarHBondContact O-CB 3.4Å; S273-S277 PolarHBondContact O-N 2.91Å; G274-S277 PolarHBondContact O-N 3.29Å; I275-S277 VanDerWaalsContact C-N 3.32Å; I275-S277 PolarHBondContact O-N 2.81Å; S277-L279 VanDerWaalsContact C-N 3.34Å; S277-L279 PolarHBondContact O-N 3.16Å; S277-K280 WeakPolarHBondContact O-CB 3.38Å; S277-K280 PolarHBondContact O-N 3.26Å; S277-E281 PolarHBondContact O-N 3.36Å
278A95.9Very high96.6Very high49 Ų49104 Ų10441%0.40554%0.538SS..Hα-helixtrans-59.3-46177.800000110.9G274 I275 K280 E281 T282G274-A278 WeakPolarHBondContact O-CB 2.99Å; G274-A278 PolarHBondContact O-N 3.31Å; I275-A278 PolarHBondContact O-N 3.39Å; A278-K280 VanDerWaalsContact C-N 3.31Å; A278-K280 PolarHBondContact O-N 2.92Å; A278-E281 PolarHBondContact O-N 2.89Å; A278-E281 VanDerWaalsContact O-N 3.12Å; A278-T282 PolarHBondContact O-N 3.18Å; A278-T282 PolarHBondContact O-OG1 2.78Å
279L96.6Very high96.7Very high118 Ų118102.7 Ų102.762%0.61853%0.533SS*.Hα-helixtrans-59.1-41.9177.2-178.865.8000112.2I275 S277 E281 K283I275-L279 WeakPolarHBondContact O-CB 3.4Å; I275-L279 PolarHBondContact O-N 3.5Å; S277-L279 VanDerWaalsContact C-N 3.34Å; S277-L279 PolarHBondContact O-N 3.16Å; L279-E281 VanDerWaalsContact C-N 3.33Å; L279-K283 VanDerWaalsContact O-CB 3.22Å; L279-K283 WeakPolarHBondContact O-CB 3.49Å; L279-K283 PolarHBondContact O-N 2.97Å
280K97.3Very high96.8Very high170 Ų170102.9 Ų102.974%0.73953%0.534SS*.Hα-helixtrans-63.2-41.4177-176.9-179178.3-176.30111.4E276 S277 A278 G284E276-K280 WeakPolarHBondContact O-CB 3.43Å; E276-K280 PolarHBondContact O-N 3.49Å; S277-K280 WeakPolarHBondContact O-CB 3.38Å; S277-K280 PolarHBondContact O-N 3.26Å; A278-K280 VanDerWaalsContact C-N 3.31Å; A278-K280 PolarHBondContact O-N 2.92Å; K280-G284 PolarHBondContact O-N 3.36Å; K280-G284 VanDerWaalsContact O-N 3.11Å
281E96.7Very high96.9Very high115 Ų115100.4 Ų100.454%0.53753%0.525SS..Hα-helixtrans-68-49.9178.3-170.7177-179.600111.7S277 A278 L279 K283 G284 F285S277-E281 PolarHBondContact O-N 3.36Å; A278-E281 PolarHBondContact O-N 2.89Å; A278-E281 VanDerWaalsContact O-N 3.12Å; L279-E281 VanDerWaalsContact C-N 3.33Å; E281-K283 VanDerWaalsContact C-N 3.3Å; E281-K283 PolarHBondContact O-N 3.27Å; E281-G284 WeakPolarHBondContact O-CA 3.19Å; E281-G284 PolarHBondContact O-N 2.71Å; E281-F285 HydrophobicContact CG-CD2 4.08Å; E281-F285 HydrophobicContact CG-CE2 3.48Å; E281-F285 VanDerWaalsContact CG-CE2 3.48Å; E281-F285 HydrophobicContact CG-CZ 4.01Å; E281-F285 WeakPolarHBondContact O-CD2 3.34Å; E281-F285 PolarHBondContact O-N 3.49Å; E281-F285 WeakPolarHBondContact OE1-CE2 3.2Å; E281-F285 WeakPolarHBondContact OE1-CZ 3.47Å
282T96.1Very high97Very high90 Ų90100.9 Ų100.955%0.55253%0.528SS*.Hα-helixtrans-58.4-42.2176.9-49.80000111.6A278 G284 F285 L286A278-T282 PolarHBondContact O-N 3.18Å; A278-T282 PolarHBondContact O-OG1 2.78Å; T282-G284 VanDerWaalsContact C-N 3.31Å; T282-G284 PolarHBondContact O-N 3.05Å; T282-F285 PolarHBondContact O-N 3.32Å; T282-L286 PolarHBondContact O-N 2.84Å
283K97.3Very high97.1Very high132 Ų13299 Ų9957%0.57452%0.523SS*.Hα-helixtrans-60.3-41.7174.3-175.4176.8179.1178.50111.6L279 E281 F285 L286 D287L279-K283 VanDerWaalsContact O-CB 3.22Å; L279-K283 WeakPolarHBondContact O-CB 3.49Å; L279-K283 PolarHBondContact O-N 2.97Å; E281-K283 VanDerWaalsContact C-N 3.3Å; E281-K283 PolarHBondContact O-N 3.27Å; K283-F285 PolarHBondContact O-N 3.21Å; K283-L286 PolarHBondContact O-N 3.29Å; K283-D287 WeakPolarHBondContact O-CB 3.29Å; K283-D287 PolarHBondContact O-N 2.98Å
284G97Very high97.1Very high30 Ų3097.6 Ų97.631%0.30951%0.511SS..Hα-helixtrans-62.4-39.7175.100000113.3K280 E281 T282 K288K280-G284 PolarHBondContact O-N 3.36Å; K280-G284 VanDerWaalsContact O-N 3.11Å; E281-G284 WeakPolarHBondContact O-CA 3.19Å; E281-G284 PolarHBondContact O-N 2.71Å; T282-G284 VanDerWaalsContact C-N 3.31Å; T282-G284 PolarHBondContact O-N 3.05Å; G284-K288 VanDerWaalsContact O-CG 3.31Å; G284-K288 WeakPolarHBondContact O-CG 3.36Å; G284-K288 PolarHBondContact O-N 3.02Å; G284-K288 VanDerWaalsContact O-N 3.12Å
285F96Very high97.2Very high114 Ų114103.7 Ų103.750%0.552%0.521SS..Hα-helixtrans-65.3-43.8173.1-68.3-51.2000112E281 T282 K283 D287 K288 L289E281-F285 HydrophobicContact CG-CD2 4.08Å; E281-F285 HydrophobicContact CG-CE2 3.48Å; E281-F285 VanDerWaalsContact CG-CE2 3.48Å; E281-F285 HydrophobicContact CG-CZ 4.01Å; E281-F285 WeakPolarHBondContact O-CD2 3.34Å; E281-F285 PolarHBondContact O-N 3.49Å; E281-F285 WeakPolarHBondContact OE1-CE2 3.2Å; E281-F285 WeakPolarHBondContact OE1-CZ 3.47Å; T282-F285 PolarHBondContact O-N 3.32Å; K283-F285 PolarHBondContact O-N 3.21Å; F285-D287 PolarHBondContact O-N 2.94Å; F285-K288 PolarHBondContact O-N 3.38Å; F285-L289 WeakPolarHBondContact O-CB 3.45Å; F285-L289 PolarHBondContact O-N 2.93Å
286L97Very high97.2Very high114 Ų114101 Ų10160%0.59751%0.511SS*.Hα-helixtrans-63.1-42.2178.3-172.363.7000111.8T282 K283 K288 L289 H290T282-L286 PolarHBondContact O-N 2.84Å; K283-L286 PolarHBondContact O-N 3.29Å; L286-K288 VanDerWaalsContact C-N 3.34Å; L286-K288 PolarHBondContact O-N 3.09Å; L286-L289 PolarHBondContact O-N 3.25Å; L286-H290 WeakPolarHBondContact O-CB 3.32Å; L286-H290 PolarHBondContact O-N 2.98Å
287D97.7Very high97.2Very high80 Ų80100.9 Ų100.943%0.42851%0.513SS..Hα-helixtrans-63.9-39.2176.4-77.3-25.4000111.6K283 F285 N291K283-D287 WeakPolarHBondContact O-CB 3.29Å; K283-D287 PolarHBondContact O-N 2.98Å; F285-D287 PolarHBondContact O-N 2.94Å; D287-N291 WeakPolarHBondContact O-CB 3.45Å; D287-N291 VanDerWaalsContact O-CG 3.26Å; D287-N291 PolarHBondContact O-N 3.26Å; D287-N291 PolarHBondContact O-ND2 3.44Å
288K97.4Very high97.3Very high142 Ų142103.3 Ų103.362%0.61752%0.516SS*.Hα-helixtrans-62.5-47.3174.4-74.9171.5-175.9173.60111.2G284 F285 L286 N291 E292G284-K288 VanDerWaalsContact O-CG 3.31Å; G284-K288 WeakPolarHBondContact O-CG 3.36Å; G284-K288 PolarHBondContact O-N 3.02Å; G284-K288 VanDerWaalsContact O-N 3.12Å; F285-K288 PolarHBondContact O-N 3.38Å; L286-K288 VanDerWaalsContact C-N 3.34Å; L286-K288 PolarHBondContact O-N 3.09Å; K288-N291 PolarHBondContact O-N 3.49Å; K288-E292 PolarHBondContact O-N 3.23Å
289L97.4Very high97.4Very high92 Ų92106.7 Ų106.748%0.48252%0.521SS..Hα-helixtrans-63-44179.1-171.3154.3000110.9F285 L286 N291 E292 I293F285-L289 WeakPolarHBondContact O-CB 3.45Å; F285-L289 PolarHBondContact O-N 2.93Å; L286-L289 PolarHBondContact O-N 3.25Å; L289-N291 VanDerWaalsContact C-N 3.33Å; L289-N291 PolarHBondContact O-N 3.37Å; L289-E292 PolarHBondContact O-N 3.25Å; L289-I293 HydrophobicContact CD2-CD1 3.36Å; L289-I293 HydrophobicContact CD2-CG1 4.04Å; L289-I293 HydrophobicContact CG-CD1 4.42Å; L289-I293 WeakPolarHBondContact O-CG1 3.17Å; L289-I293 PolarHBondContact O-N 3.09Å
290H97.6Very high97.4Very high114 Ų114104.9 Ų104.953%0.52851%0.511SS..Hα-helixtrans-58.2-44.9175.1179.475.2000112.1L286 I293 T294L286-H290 WeakPolarHBondContact O-CB 3.32Å; L286-H290 PolarHBondContact O-N 2.98Å; H290-I293 PolarHBondContact O-N 3.39Å; H290-T294 WeakPolarHBondContact O-CB 3.19Å; H290-T294 PolarHBondContact O-N 3.32Å; H290-T294 PolarHBondContact O-OG1 2.97Å
291N98.1Very high97.5Very high88 Ų8897.9 Ų97.947%0.47149%0.488SS..Hα-helixtrans-67-38.1178-75.9-49.4000112.4D287 K288 L289 R295D287-N291 WeakPolarHBondContact O-CB 3.45Å; D287-N291 VanDerWaalsContact O-CG 3.26Å; D287-N291 PolarHBondContact O-N 3.26Å; D287-N291 PolarHBondContact O-ND2 3.44Å; K288-N291 PolarHBondContact O-N 3.49Å; L289-N291 VanDerWaalsContact C-N 3.33Å; L289-N291 PolarHBondContact O-N 3.37Å; N291-R295 WeakPolarHBondContact O-CB 3.39Å; N291-R295 VanDerWaalsContact O-CG 3.28Å; N291-R295 WeakPolarHBondContact O-CG 3.24Å; N291-R295 PolarHBondContact O-N 3.1Å
292E98Very high97.5Very high132 Ų13295.7 Ų95.762%0.61749%0.485SS*.Hα-helixtrans-65.4-48.9175.7-175169.4-171.200111.2K288 L289 T294 R295 T296K288-E292 PolarHBondContact O-N 3.23Å; L289-E292 PolarHBondContact O-N 3.25Å; E292-T294 VanDerWaalsContact C-N 3.33Å; E292-T294 PolarHBondContact O-N 2.9Å; E292-R295 PolarHBondContact O-N 2.86Å; E292-T296 WeakPolarHBondContact O-CG2 3.42Å; E292-T296 PolarHBondContact O-N 3.16Å
293I97.7Very high97.5Very high83 Ų8399.1 Ų99.143%0.42649%0.488SS..Hα-helixtrans-56.5-49.1175.3-70.1-177.8000110.2L289 H290 R295 T296 L297L289-I293 HydrophobicContact CD2-CD1 3.36Å; L289-I293 HydrophobicContact CD2-CG1 4.04Å; L289-I293 HydrophobicContact CG-CD1 4.42Å; L289-I293 WeakPolarHBondContact O-CG1 3.17Å; L289-I293 PolarHBondContact O-N 3.09Å; H290-I293 PolarHBondContact O-N 3.39Å; I293-R295 VanDerWaalsContact C-N 3.32Å; I293-R295 PolarHBondContact O-N 3.15Å; I293-T296 WeakPolarHBondContact CA-OG1 3.47Å; I293-T296 PolarHBondContact O-N 2.99Å; I293-T296 PolarHBondContact O-OG1 3.44Å; I293-L297 HydrophobicContact CG2-CD1 3.89Å; I293-L297 HydrophobicContact CG2-CG 4.27Å; I293-L297 WeakPolarHBondContact O-CG 3.34Å; I293-L297 PolarHBondContact O-N 3.47Å
294T98.4Very high97.5Very high47 Ų4798.1 Ų98.129%0.28849%0.485SS..Hα-helixtrans-56.3-46.4178.9-58.20000111.5H290 E292 T296 L297 E298H290-T294 WeakPolarHBondContact O-CB 3.19Å; H290-T294 PolarHBondContact O-N 3.32Å; H290-T294 PolarHBondContact O-OG1 2.97Å; E292-T294 VanDerWaalsContact C-N 3.33Å; E292-T294 PolarHBondContact O-N 2.9Å; T294-T296 VanDerWaalsContact C-N 3.33Å; T294-T296 PolarHBondContact O-N 3.36Å; T294-L297 PolarHBondContact O-N 3.02Å; T294-E298 WeakPolarHBondContact O-CG 3.48Å; T294-E298 PolarHBondContact O-N 3.22Å
295R98.1Very high97.5Very high167 Ų167103.9 Ų103.963%0.6350%0.502SS*.Hα-helixtrans-63-37.4175.7-73.6172178.9-177.71.2112.8N291 E292 I293 K299N291-R295 WeakPolarHBondContact O-CB 3.39Å; N291-R295 VanDerWaalsContact O-CG 3.28Å; N291-R295 WeakPolarHBondContact O-CG 3.24Å; N291-R295 PolarHBondContact O-N 3.1Å; E292-R295 PolarHBondContact O-N 2.86Å; I293-R295 VanDerWaalsContact C-N 3.32Å; I293-R295 PolarHBondContact O-N 3.15Å; R295-K299 VanDerWaalsContact O-CG 3.3Å; R295-K299 WeakPolarHBondContact O-CG 3.35Å; R295-K299 PolarHBondContact O-N 2.93Å; R295-K299 VanDerWaalsContact O-N 3.08Å
296T97.3Very high97.6Very high59 Ų59105.3 Ų105.336%0.36251%0.505SS..Hα-helixtrans-68.2-40.1176.662.30000111.7E292 I293 T294 K299 I300E292-T296 WeakPolarHBondContact O-CG2 3.42Å; E292-T296 PolarHBondContact O-N 3.16Å; I293-T296 WeakPolarHBondContact CA-OG1 3.47Å; I293-T296 PolarHBondContact O-N 2.99Å; I293-T296 PolarHBondContact O-OG1 3.44Å; T294-T296 VanDerWaalsContact C-N 3.33Å; T294-T296 PolarHBondContact O-N 3.36Å; T296-K299 WeakPolarHBondContact O-CB 3.33Å; T296-K299 PolarHBondContact O-N 3.05Å; T296-I300 VanDerWaalsContact O-CG1 3.29Å; T296-I300 WeakPolarHBondContact O-CG1 3.42Å; T296-I300 PolarHBondContact O-N 3.15Å
297L97.6Very high97.5Very high106 Ų106103.9 Ų103.956%0.55550%0.497SS*.Hα-helixtrans-63.7-41.8175.7-72.2173.4000111.7I293 T294 K299 I300 G301I293-L297 HydrophobicContact CG2-CD1 3.89Å; I293-L297 HydrophobicContact CG2-CG 4.27Å; I293-L297 WeakPolarHBondContact O-CG 3.34Å; I293-L297 PolarHBondContact O-N 3.47Å; T294-L297 PolarHBondContact O-N 3.02Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 2.86Å; L297-I300 PolarHBondContact O-N 2.88Å; L297-G301 PolarHBondContact O-N 2.92Å
298E97.9Very high97.5Very high128 Ų128104.5 Ų104.560%0.59850%0.5SS*.Hα-helixtrans-62.7-39.6174-72174.817100112.4T294 S302T294-E298 WeakPolarHBondContact O-CG 3.48Å; T294-E298 PolarHBondContact O-N 3.22Å; E298-S302 WeakPolarHBondContact O-CB 3.42Å; E298-S302 PolarHBondContact O-N 3Å; E298-S302 PolarHBondContact O-OG 3.49Å
299K97.9Very high97.4Very high120 Ų120103.3 Ų103.352%0.52250%0.5SS..Hα-helixtrans-65.7-37.7173.8-75173.8-176.7177.30112.1R295 T296 L297 S302 R303R295-K299 VanDerWaalsContact O-CG 3.3Å; R295-K299 WeakPolarHBondContact O-CG 3.35Å; R295-K299 PolarHBondContact O-N 2.93Å; R295-K299 VanDerWaalsContact O-N 3.08Å; T296-K299 WeakPolarHBondContact O-CB 3.33Å; T296-K299 PolarHBondContact O-N 3.05Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 2.86Å; K299-S302 WeakPolarHBondContact CA-OG 3.48Å; K299-S302 PolarHBondContact O-OG 3.12Å; K299-R303 WeakPolarHBondContact O-CB 3.34Å; K299-R303 VanDerWaalsContact O-CG 3.31Å; K299-R303 WeakPolarHBondContact O-CG 3.47Å; K299-R303 PolarHBondContact O-N 3Å; K299-R303 VanDerWaalsContact O-N 3.13Å
300I97.6Very high97.3Very high79 Ų79103.9 Ų103.941%0.40550%0.501SS..Hα-helixtrans-66.9-52175.7-70.6165.4000109T296 L297 S302 R303 E304T296-I300 VanDerWaalsContact O-CG1 3.29Å; T296-I300 WeakPolarHBondContact O-CG1 3.42Å; T296-I300 PolarHBondContact O-N 3.15Å; L297-I300 PolarHBondContact O-N 2.88Å; I300-S302 VanDerWaalsContact C-N 3.3Å; I300-S302 PolarHBondContact O-N 3.37Å; I300-R303 CarbonylContact O-C 3.58Å; I300-R303 WeakPolarHBondContact O-CB 3.22Å; I300-R303 PolarHBondContact O-N 2.87Å; I300-E304 HydrophobicContact CG2-CG 4.23Å; I300-E304 WeakPolarHBondContact CG2-OE1 3.34Å; I300-E304 WeakPolarHBondContact O-CG 3.42Å; I300-E304 PolarHBondContact O-N 3.32Å
301G97.9Very high97.2Very high24 Ų24102.7 Ų102.725%0.24750%0.498CS..Hα-helixtrans-61.5-34-179.800000113.8L297 K305L297-G301 PolarHBondContact O-N 2.92Å; G301-K305 WeakPolarHBondContact O-CB 3.22Å; G301-K305 WeakPolarHBondContact O-CG 3.45Å; G301-K305 PolarHBondContact O-N 3.43Å
302S97.6Very high97.1Very high68 Ų68104 Ų10448%0.47650%0.501SS..Hα-helixtrans-70-39.417351.70000112.7E298 K299 I300 K305 Y306E298-S302 WeakPolarHBondContact O-CB 3.42Å; E298-S302 PolarHBondContact O-N 3Å; E298-S302 PolarHBondContact O-OG 3.49Å; K299-S302 WeakPolarHBondContact CA-OG 3.48Å; K299-S302 PolarHBondContact O-OG 3.12Å; I300-S302 VanDerWaalsContact C-N 3.3Å; I300-S302 PolarHBondContact O-N 3.37Å; S302-K305 PolarHBondContact O-N 2.93Å; S302-Y306 WeakPolarHBondContact O-CB 3.45Å; S302-Y306 PolarHBondContact O-N 2.62Å
303R96.9Very high97Very high163 Ų163102.4 Ų102.462%0.61550%0.497SS*.Hα-helixtrans-66.3-40.9173.5-76.3173.6173.3136.4-4.8112.4K299 I300 Y306 I307K299-R303 WeakPolarHBondContact O-CB 3.34Å; K299-R303 VanDerWaalsContact O-CG 3.31Å; K299-R303 WeakPolarHBondContact O-CG 3.47Å; K299-R303 PolarHBondContact O-N 3Å; K299-R303 VanDerWaalsContact O-N 3.13Å; I300-R303 CarbonylContact O-C 3.58Å; I300-R303 WeakPolarHBondContact O-CB 3.22Å; I300-R303 PolarHBondContact O-N 2.87Å; R303-Y306 WeakPolarHBondContact O-CB 3.4Å; R303-Y306 PolarHBondContact O-N 3.45Å; R303-I307 VanDerWaalsContact O-CG1 3.31Å; R303-I307 WeakPolarHBondContact O-CG1 3.4Å; R303-I307 PolarHBondContact O-N 3.45Å
304E96.6Very high96.9Very high110 Ų110103.5 Ų103.551%0.51450%0.503SS..Hα-helixtrans-60.3-48174.4-74175.3174.700111I300 Y306 I307 N308I300-E304 HydrophobicContact CG2-CG 4.23Å; I300-E304 WeakPolarHBondContact CG2-OE1 3.34Å; I300-E304 WeakPolarHBondContact O-CG 3.42Å; I300-E304 PolarHBondContact O-N 3.32Å; E304-Y306 VanDerWaalsContact C-N 3.29Å; E304-Y306 PolarHBondContact O-N 3.19Å; E304-I307 PolarHBondContact O-N 2.95Å; E304-N308 VanDerWaalsContact O-CB 3.3Å; E304-N308 WeakPolarHBondContact O-CB 3.03Å; E304-N308 PolarHBondContact O-N 3.3Å; E304-N308 PolarHBondContact O-ND2 2.96Å
305K97.4Very high96.8Very high151 Ų151104.4 Ų104.466%0.65751%0.508SS*.Hα-helixtrans-58.4-41.2174.4-76.5176.9-178.1179.70112.3G301 S302 N309G301-K305 WeakPolarHBondContact O-CB 3.22Å; G301-K305 WeakPolarHBondContact O-CG 3.45Å; G301-K305 PolarHBondContact O-N 3.43Å; S302-K305 PolarHBondContact O-N 2.93Å; K305-N309 WeakPolarHBondContact O-CB 3.4Å; K305-N309 VanDerWaalsContact O-CG 3.29Å; K305-N309 PolarHBondContact O-N 3.01Å
306Y97Very high96.7Very high144 Ų144102.6 Ų102.657%0.56551%0.507SS*.Hα-helixtrans-63.5-48.5177.2178.9-98.4000112S302 R303 E304 N309 Q310S302-Y306 WeakPolarHBondContact O-CB 3.45Å; S302-Y306 PolarHBondContact O-N 2.62Å; R303-Y306 WeakPolarHBondContact O-CB 3.4Å; R303-Y306 PolarHBondContact O-N 3.45Å; E304-Y306 VanDerWaalsContact C-N 3.29Å; E304-Y306 PolarHBondContact O-N 3.19Å; Y306-N309 PolarHBondContact O-N 3.16Å; Y306-Q310 VanDerWaalsContact CE1-CD 3.48Å; Y306-Q310 HydrophobicContact CE1-CG 4.21Å; Y306-Q310 WeakPolarHBondContact O-CG 3.12Å; Y306-Q310 PolarHBondContact O-N 3.34Å; Y306-Q310 PolarHBondContact OH-NE2 2.96Å
307I96.2Very high96.7Very high85 Ų85106.1 Ų106.144%0.43652%0.519SS..Hα-helixtrans-62.5-46.1178.1-68.7166.7000110.4R303 E304 N309 Q310 L311R303-I307 VanDerWaalsContact O-CG1 3.31Å; R303-I307 WeakPolarHBondContact O-CG1 3.4Å; R303-I307 PolarHBondContact O-N 3.45Å; E304-I307 PolarHBondContact O-N 2.95Å; I307-N309 VanDerWaalsContact C-N 3.34Å; I307-N309 PolarHBondContact O-N 2.95Å; I307-Q310 PolarHBondContact O-N 2.94Å; I307-Q310 VanDerWaalsContact O-N 3.11Å; I307-L311 HydrophobicContact CG2-CD1 3.65Å; I307-L311 HydrophobicContact CG2-CG 4.18Å; I307-L311 WeakPolarHBondContact O-CB 3.43Å; I307-L311 WeakPolarHBondContact O-CG 3.35Å; I307-L311 PolarHBondContact O-N 3.48Å
308N96.3Very high96.7Very high93 Ų93108.5 Ų108.550%0.49752%0.522SS..Hα-helixtrans-58.7-46.5177.9-72.4-16.6000111E304 Q310 L311 E312E304-N308 VanDerWaalsContact O-CB 3.3Å; E304-N308 WeakPolarHBondContact O-CB 3.03Å; E304-N308 PolarHBondContact O-N 3.3Å; E304-N308 PolarHBondContact O-ND2 2.96Å; N308-Q310 VanDerWaalsContact C-N 3.29Å; N308-Q310 PolarHBondContact O-N 3.42Å; N308-L311 PolarHBondContact O-N 2.94Å; N308-L311 VanDerWaalsContact O-N 3.16Å; N308-E312 WeakPolarHBondContact O-CB 3.34Å; N308-E312 PolarHBondContact O-N 3.34Å
309N96.4Very high96.7Very high116 Ų116110.5 Ų110.562%0.6252%0.524SS*.Hα-helixtrans-61.5-35.3176.3-77.7-5.4000113.1K305 Y306 I307K305-N309 WeakPolarHBondContact O-CB 3.4Å; K305-N309 VanDerWaalsContact O-CG 3.29Å; K305-N309 PolarHBondContact O-N 3.01Å; Y306-N309 PolarHBondContact O-N 3.16Å; I307-N309 VanDerWaalsContact C-N 3.34Å; I307-N309 PolarHBondContact O-N 2.95Å
310Q95.3Very high96.6Very high105 Ų105107.2 Ų107.249%0.49152%0.519SS..Hα-helixtrans-69.8-39.9175.1-72.4-164.5-43.300112.1Y306 I307 N308 L314Y306-Q310 VanDerWaalsContact CE1-CD 3.48Å; Y306-Q310 HydrophobicContact CE1-CG 4.21Å; Y306-Q310 WeakPolarHBondContact O-CG 3.12Å; Y306-Q310 PolarHBondContact O-N 3.34Å; Y306-Q310 PolarHBondContact OH-NE2 2.96Å; I307-Q310 PolarHBondContact O-N 2.94Å; I307-Q310 VanDerWaalsContact O-N 3.11Å; N308-Q310 VanDerWaalsContact C-N 3.29Å; N308-Q310 PolarHBondContact O-N 3.42Å; Q310-L314 WeakPolarHBondContact O-CD1 3.42Å
311L94.9Very high96.6Very high88 Ų88106 Ų10646%0.46152%0.521SS..Hα-helixtrans-80.2-24-177.8-65.8178.2000113.1I307 N308 N313 L314 V315I307-L311 HydrophobicContact CG2-CD1 3.65Å; I307-L311 HydrophobicContact CG2-CG 4.18Å; I307-L311 WeakPolarHBondContact O-CB 3.43Å; I307-L311 WeakPolarHBondContact O-CG 3.35Å; I307-L311 PolarHBondContact O-N 3.48Å; N308-L311 PolarHBondContact O-N 2.94Å; N308-L311 VanDerWaalsContact O-N 3.16Å; L311-N313 VanDerWaalsContact C-N 3.34Å; L311-N313 PolarHBondContact O-N 3.4Å; L311-L314 PolarHBondContact O-N 3.38Å; L311-L314 VanDerWaalsContact O-N 3.14Å; L311-V315 WeakPolarHBondContact O-CB 3.34Å; L311-V315 VanDerWaalsContact O-CG2 3.29Å; L311-V315 WeakPolarHBondContact O-CG2 3.36Å; L311-V315 PolarHBondContact O-N 2.92Å
312E96.4Very high96.6Very high117 Ų117109.9 Ų109.955%0.54753%0.533SS..Hα-helixtrans-51.7-51.3-177.6-165.387.5-136.200111.4N308 V315 Q316N308-E312 WeakPolarHBondContact O-CB 3.34Å; N308-E312 PolarHBondContact O-N 3.34Å; E312-V315 PolarHBondContact O-N 3.46Å; E312-Q316 WeakPolarHBondContact O-CB 3.4Å; E312-Q316 PolarHBondContact O-N 2.68Å
313N95.4Very high96.6Very high97 Ų97109.3 Ų109.352%0.51953%0.532SS..Hα-helixtrans-65.6-43.5179.7-69.7-37.5000111.8L311 V315 Q316 E317L311-N313 VanDerWaalsContact C-N 3.34Å; L311-N313 PolarHBondContact O-N 3.4Å; N313-V315 VanDerWaalsContact C-N 3.32Å; N313-V315 PolarHBondContact O-N 3.36Å; N313-Q316 PolarHBondContact O-N 2.98Å; N313-Q316 VanDerWaalsContact O-N 3.17Å; N313-E317 WeakPolarHBondContact O-CG 3.45Å; N313-E317 PolarHBondContact O-N 3.29Å
314L95.5Very high96.6Very high107 Ų107107.9 Ų107.956%0.5653%0.532SS*.Hα-helixtrans-63.1-39.4178.1-86.476.5000111.6Q310 L311 Q316 E317 Y318Q310-L314 WeakPolarHBondContact O-CD1 3.42Å; L311-L314 PolarHBondContact O-N 3.38Å; L311-L314 VanDerWaalsContact O-N 3.14Å; L314-Q316 VanDerWaalsContact C-N 3.33Å; L314-E317 PolarHBondContact O-N 2.9Å; L314-Y318 WeakPolarHBondContact O-CB 3.48Å; L314-Y318 PolarHBondContact O-N 2.85Å
315V96.4Very high96.6Very high65 Ų65107.2 Ų107.239%0.39453%0.532SS..Hα-helixtrans-65.6-39.6175.7170.50000110.3L311 E312 N313 Y318 R319L311-V315 WeakPolarHBondContact O-CB 3.34Å; L311-V315 VanDerWaalsContact O-CG2 3.29Å; L311-V315 WeakPolarHBondContact O-CG2 3.36Å; L311-V315 PolarHBondContact O-N 2.92Å; E312-V315 PolarHBondContact O-N 3.46Å; N313-V315 VanDerWaalsContact C-N 3.32Å; N313-V315 PolarHBondContact O-N 3.36Å; V315-Y318 PolarHBondContact O-N 3.32Å; V315-R319 WeakPolarHBondContact O-CB 3.31Å; V315-R319 WeakPolarHBondContact O-CG 3.47Å; V315-R319 PolarHBondContact O-N 3.05Å
316Q96.8Very high96.6Very high129 Ų129103.4 Ų103.460%0.60352%0.524SS*.Hα-helixtrans-67.1-42.3176.8-166.3167.97.800112E312 N313 L314 R319 A320E312-Q316 WeakPolarHBondContact O-CB 3.4Å; E312-Q316 PolarHBondContact O-N 2.68Å; N313-Q316 PolarHBondContact O-N 2.98Å; N313-Q316 VanDerWaalsContact O-N 3.17Å; L314-Q316 VanDerWaalsContact C-N 3.33Å; Q316-R319 PolarHBondContact O-N 3.47Å; Q316-A320 WeakPolarHBondContact O-CB 3.37Å; Q316-A320 PolarHBondContact O-N 2.99Å
317E97.2Very high96.7Very high133 Ų133101 Ų10162%0.62152%0.518SS*.Hα-helixtrans-61.6-44.3172.8-74.3176.8-16600111.6N313 L314 R319 A320 A321N313-E317 WeakPolarHBondContact O-CG 3.45Å; N313-E317 PolarHBondContact O-N 3.29Å; L314-E317 PolarHBondContact O-N 2.9Å; E317-R319 PolarHBondContact O-N 3.34Å; E317-A320 PolarHBondContact O-N 3.37Å; E317-A321 WeakPolarHBondContact O-CB 3.37Å; E317-A321 PolarHBondContact O-N 2.65Å
318Y96.6Very high96.7Very high156 Ų15699.6 Ų99.661%0.61252%0.519SS*.Hα-helixtrans-59.9-45.3175.4177.4-94.5000111.7L314 V315 A320 A321 Q322L314-Y318 WeakPolarHBondContact O-CB 3.48Å; L314-Y318 PolarHBondContact O-N 2.85Å; V315-Y318 PolarHBondContact O-N 3.32Å; Y318-A320 VanDerWaalsContact C-N 3.34Å; Y318-A320 PolarHBondContact O-N 3.4Å; Y318-A321 PolarHBondContact O-N 3.47Å; Y318-Q322 WeakPolarHBondContact O-CB 3.34Å; Y318-Q322 PolarHBondContact O-N 2.85Å
319R97.3Very high96.7Very high170 Ų170101.5 Ų101.564%0.64252%0.523SS*.Hα-helixtrans-61.4-42.2175.8-76.1177.6-179.2170.33.1111.7V315 Q316 E317 Q322 A323V315-R319 WeakPolarHBondContact O-CB 3.31Å; V315-R319 WeakPolarHBondContact O-CG 3.47Å; V315-R319 PolarHBondContact O-N 3.05Å; Q316-R319 PolarHBondContact O-N 3.47Å; E317-R319 PolarHBondContact O-N 3.34Å; R319-Q322 PolarHBondContact O-N 2.95Å; R319-A323 PolarHBondContact O-N 2.93Å
320A97.8Very high96.8Very high51 Ų51101.4 Ų101.442%0.42152%0.519SS..Hα-helixtrans-64.1-45.3176.900000111.6Q316 E317 Y318 Q322 A323 Q324Q316-A320 WeakPolarHBondContact O-CB 3.37Å; Q316-A320 PolarHBondContact O-N 2.99Å; E317-A320 PolarHBondContact O-N 3.37Å; Y318-A320 VanDerWaalsContact C-N 3.34Å; Y318-A320 PolarHBondContact O-N 3.4Å; A320-Q322 VanDerWaalsContact C-N 3.34Å; A320-Q322 PolarHBondContact O-N 3.44Å; A320-A323 PolarHBondContact O-N 3.23Å; A320-Q324 WeakPolarHBondContact O-CG 3.41Å; A320-Q324 PolarHBondContact O-N 2.93Å
321A97Very high96.8Very high54 Ų54104.1 Ų104.145%0.44653%0.525SS..Hα-helixtrans-63.2-39.3176.200000112.1E317 Y318 Q324 L325E317-A321 WeakPolarHBondContact O-CB 3.37Å; E317-A321 PolarHBondContact O-N 2.65Å; Y318-A321 PolarHBondContact O-N 3.47Å; A321-Q324 PolarHBondContact O-N 3.47Å; A321-L325 WeakPolarHBondContact O-CB 3.4Å; A321-L325 PolarHBondContact O-N 2.86Å
322Q97.2Very high96.9Very high106 Ų106108.1 Ų108.150%0.49554%0.535SS..Hα-helixtrans-64.8-40.7175.7-174.2174.75.800111.9Y318 R319 A320 L325 S326Y318-Q322 WeakPolarHBondContact O-CB 3.34Å; Y318-Q322 PolarHBondContact O-N 2.85Å; R319-Q322 PolarHBondContact O-N 2.95Å; A320-Q322 VanDerWaalsContact C-N 3.34Å; A320-Q322 PolarHBondContact O-N 3.44Å; Q322-L325 PolarHBondContact O-N 3.42Å; Q322-S326 PolarHBondContact O-N 2.84Å
323A97.6Very high96.9Very high55 Ų55109.3 Ų109.346%0.45554%0.54SS..Hα-helixtrans-62.3-46.4174.300000111.2R319 A320 L325 S326 E327R319-A323 PolarHBondContact O-N 2.93Å; A320-A323 PolarHBondContact O-N 3.23Å; A323-L325 VanDerWaalsContact C-N 3.32Å; A323-L325 PolarHBondContact O-N 3.37Å; A323-S326 PolarHBondContact O-N 2.97Å; A323-S326 VanDerWaalsContact O-N 3.16Å; A323-S326 PolarHBondContact O-OG 3.42Å; A323-E327 PolarHBondContact O-N 3.11Å
324Q97.7Very high96.9Very high134 Ų134110.6 Ų110.663%0.62654%0.543SS*.Hα-helixtrans-60.1-40.2175.5-71.5177.8-1.700112.4A320 A321 E327 A328A320-Q324 WeakPolarHBondContact O-CG 3.41Å; A320-Q324 PolarHBondContact O-N 2.93Å; A321-Q324 PolarHBondContact O-N 3.47Å; Q324-E327 PolarHBondContact O-N 2.89Å; Q324-A328 WeakPolarHBondContact O-CB 3.34Å; Q324-A328 PolarHBondContact O-N 3.34Å
325L96.9Very high96.9Very high96 Ų96107.4 Ų107.450%0.50354%0.537SS..Hα-helixtrans-63.1-43.8175.1-176.376.6000111.5A321 Q322 A323 E327 A328 K329A321-L325 WeakPolarHBondContact O-CB 3.4Å; A321-L325 PolarHBondContact O-N 2.86Å; Q322-L325 PolarHBondContact O-N 3.42Å; A323-L325 VanDerWaalsContact C-N 3.32Å; A323-L325 PolarHBondContact O-N 3.37Å; L325-E327 VanDerWaalsContact C-N 3.35Å; L325-A328 PolarHBondContact O-N 2.82Å; L325-K329 HydrophobicContact CG-CD 4.42Å; L325-K329 WeakPolarHBondContact O-CB 3.49Å; L325-K329 WeakPolarHBondContact O-CG 3.29Å; L325-K329 PolarHBondContact O-N 3.46Å
326S96.8Very high96.9Very high71 Ų71108.2 Ų108.250%0.49754%0.539SS..Hα-helixtrans-62.8-42.4177.764.40000111.9Q322 A323 K329 E330Q322-S326 PolarHBondContact O-N 2.84Å; A323-S326 PolarHBondContact O-N 2.97Å; A323-S326 VanDerWaalsContact O-N 3.16Å; A323-S326 PolarHBondContact O-OG 3.42Å; S326-K329 PolarHBondContact O-N 2.72Å; S326-E330 PolarHBondContact O-N 3.11Å
327E98.1Very high96.8Very high92 Ų92104 Ų10443%0.4353%0.53SS..Hα-helixtrans-63.9-44.4176.6-172.4-175.2174.800111.4A323 Q324 L325 K329 E330 R331A323-E327 PolarHBondContact O-N 3.11Å; Q324-E327 PolarHBondContact O-N 2.89Å; L325-E327 VanDerWaalsContact C-N 3.35Å; E327-K329 VanDerWaalsContact C-N 3.35Å; E327-K329 PolarHBondContact O-N 3.14Å; E327-E330 PolarHBondContact O-N 3.16Å; E327-R331 WeakPolarHBondContact O-CG 3.33Å; E327-R331 PolarHBondContact O-N 3.02Å; E327-R331 IonicContact OE1-CZ 3.49Å; E327-R331 VanDerWaalsContact OE1-CZ 3.29Å; E327-R331 IonicContact OE1-NE 3.39Å; E327-R331 PolarHBondContact OE1-NE 2.93Å; E327-R331 IonicContact OE1-NH2 3.36Å; E327-R331 PolarHBondContact OE1-NH2 2.8Å
328A97.2Very high96.8Very high56 Ų5698.8 Ų98.846%0.46351%0.511SS..Hα-helixtrans-63.4-40177.400000112.2Q324 L325 R331 Y332Q324-A328 WeakPolarHBondContact O-CB 3.34Å; Q324-A328 PolarHBondContact O-N 3.34Å; L325-A328 PolarHBondContact O-N 2.82Å; A328-R331 PolarHBondContact O-N 3.49Å; A328-Y332 WeakPolarHBondContact O-CB 3.47Å; A328-Y332 PolarHBondContact O-N 3.08Å
329K97Very high96.8Very high134 Ų13495.3 Ų95.358%0.58351%0.506SS*.Hα-helixtrans-63.8-42.9174.9-78.3-179.7177-177.30111.8L325 S326 E327 Y332 Q333L325-K329 HydrophobicContact CG-CD 4.42Å; L325-K329 WeakPolarHBondContact O-CB 3.49Å; L325-K329 WeakPolarHBondContact O-CG 3.29Å; L325-K329 PolarHBondContact O-N 3.46Å; S326-K329 PolarHBondContact O-N 2.72Å; E327-K329 VanDerWaalsContact C-N 3.35Å; E327-K329 PolarHBondContact O-N 3.14Å; K329-Y332 PolarHBondContact O-N 3.32Å; K329-Q333 WeakPolarHBondContact O-CB 3.36Å; K329-Q333 PolarHBondContact O-N 3.17Å
330E97.2Very high96.7Very high113 Ų11391.1 Ų91.153%0.52850%0.5SS..Hα-helixtrans-63.2-46.8177.3-168.8-176.6169.500111.1S326 E327 Y332 Q333 Q334S326-E330 PolarHBondContact O-N 3.11Å; E327-E330 PolarHBondContact O-N 3.16Å; E330-Y332 VanDerWaalsContact C-N 3.31Å; E330-Y332 PolarHBondContact O-N 3.33Å; E330-Q333 PolarHBondContact O-N 2.67Å; E330-Q333 VanDerWaalsContact O-N 3.15Å; E330-Q334 WeakPolarHBondContact O-CG 3.46Å; E330-Q334 PolarHBondContact O-N 3.17Å; E330-Q334 PolarHBondContact OE1-NE2 2.95Å
331R96.6Very high96.7Very high163 Ų16392.8 Ų92.862%0.61550%0.499SS*.Hα-helixtrans-59.1-41.3174.9-71.4180-176.1-1622.7112.2E327 A328 G335E327-R331 WeakPolarHBondContact O-CG 3.33Å; E327-R331 PolarHBondContact O-N 3.02Å; E327-R331 IonicContact OE1-CZ 3.49Å; E327-R331 VanDerWaalsContact OE1-CZ 3.29Å; E327-R331 IonicContact OE1-NE 3.39Å; E327-R331 PolarHBondContact OE1-NE 2.93Å; E327-R331 IonicContact OE1-NH2 3.36Å; E327-R331 PolarHBondContact OE1-NH2 2.8Å; A328-R331 PolarHBondContact O-N 3.49Å; R331-G335 PolarHBondContact O-N 3.02Å
332Y96.3Very high96.6Very high171 Ų17198.7 Ų98.767%0.67151%0.509SS*.Hα-helixtrans-63.5-44.1175.2178-96.3000111.6A328 K329 E330 G335 N336A328-Y332 WeakPolarHBondContact O-CB 3.47Å; A328-Y332 PolarHBondContact O-N 3.08Å; K329-Y332 PolarHBondContact O-N 3.32Å; E330-Y332 VanDerWaalsContact C-N 3.31Å; E330-Y332 PolarHBondContact O-N 3.33Å; Y332-G335 PolarHBondContact O-N 3.22Å; Y332-N336 WeakPolarHBondContact O-CB 3.48Å; Y332-N336 PolarHBondContact O-N 2.71Å
333Q95.9Very high96.6Very high142 Ų14297.4 Ų97.466%0.66451%0.509SS*.Hα-helixtrans-64.9-42.2178.9-170.5171.47.600112K329 E330 N336 G337K329-Q333 WeakPolarHBondContact O-CB 3.36Å; K329-Q333 PolarHBondContact O-N 3.17Å; E330-Q333 PolarHBondContact O-N 2.67Å; E330-Q333 VanDerWaalsContact O-N 3.15Å; Q333-N336 PolarHBondContact O-N 3.26Å; Q333-G337 PolarHBondContact O-N 3.05Å
334Q95.9Very high96.5Very high124 Ų124100.4 Ų100.458%0.57951%0.509SS*.Hα-helixtrans-61.1-45.8172.8-70176.713.300111.3E330 G337 G338E330-Q334 WeakPolarHBondContact O-CG 3.46Å; E330-Q334 PolarHBondContact O-N 3.17Å; E330-Q334 PolarHBondContact OE1-NE2 2.95Å; Q334-G337 PolarHBondContact O-N 3.21Å; Q334-G338 PolarHBondContact O-N 3.49Å
335G95.8Very high96.5Very high41 Ų4197.8 Ų97.842%0.42350%0.499SS..Hα-helixtrans-60.1-45.4175.400000112.6R331 Y332 G337 G338 V339R331-G335 PolarHBondContact O-N 3.02Å; Y332-G335 PolarHBondContact O-N 3.22Å; G335-G337 PolarHBondContact O-N 2.86Å; G335-G338 CarbonylContact O-C 3.57Å; G335-G338 PolarHBondContact O-N 2.93Å; G335-V339 WeakPolarHBondContact O-CG2 3.5Å; G335-V339 PolarHBondContact O-N 3.39Å
336N95.9Very high96.5Very high82 Ų8298.2 Ų98.244%0.43950%0.501SS..Hα-helixtrans-64.5-39.3177.9-168.854.9000112.2Y332 Q333 G338 V339 T340Y332-N336 WeakPolarHBondContact O-CB 3.48Å; Y332-N336 PolarHBondContact O-N 2.71Å; Q333-N336 PolarHBondContact O-N 3.26Å; N336-G338 VanDerWaalsContact C-N 3.35Å; N336-V339 PolarHBondContact O-N 2.82Å; N336-T340 WeakPolarHBondContact O-CB 3.4Å; N336-T340 PolarHBondContact O-N 2.88Å; N336-T340 PolarHBondContact O-OG1 2.82Å
337G95.6Very high96.5Very high40 Ų4097.6 Ų97.641%0.41250%0.497SS..Hα-helixtrans-60.3-44.4171.300000111.9Q333 Q334 G335 V339 T340 E341Q333-G337 PolarHBondContact O-N 3.05Å; Q334-G337 PolarHBondContact O-N 3.21Å; G335-G337 PolarHBondContact O-N 2.86Å; G337-V339 VanDerWaalsContact C-N 3.34Å; G337-V339 PolarHBondContact O-N 3Å; G337-T340 PolarHBondContact O-N 3.13Å; G337-E341 PolarHBondContact O-N 3.36Å
338G96Very high96.5Very high23 Ų2396.9 Ų96.924%0.23749%0.493CS..Hα-helixtrans-67.2-28.7176.300000114.7Q334 G335 N336 R342Q334-G338 PolarHBondContact O-N 3.49Å; G335-G338 CarbonylContact O-C 3.57Å; G335-G338 PolarHBondContact O-N 2.93Å; N336-G338 VanDerWaalsContact C-N 3.35Å; G338-R342 VanDerWaalsContact O-CG 3.31Å; G338-R342 WeakPolarHBondContact O-CG 3.4Å; G338-R342 PolarHBondContact O-N 3.29Å; G338-R342 PolarHBondContact O-NH1 3.03Å; G338-R342 VanDerWaalsContact O-NH1 3.16Å
339V97.1Very high96.5Very high84 Ų8498.6 Ų98.651%0.50950%0.498SS..Hα-helixtrans-72.6-47.1171170.90000109.9G335 N336 G337 E341 R342 T343G335-V339 WeakPolarHBondContact O-CG2 3.5Å; G335-V339 PolarHBondContact O-N 3.39Å; N336-V339 PolarHBondContact O-N 2.82Å; G337-V339 VanDerWaalsContact C-N 3.34Å; G337-V339 PolarHBondContact O-N 3Å; V339-E341 VanDerWaalsContact C-N 3.31Å; V339-E341 PolarHBondContact O-N 2.99Å; V339-R342 PolarHBondContact O-N 3.36Å; V339-R342 VanDerWaalsContact O-N 3.13Å; V339-T343 PolarHBondContact O-N 3.03Å; V339-T343 PolarHBondContact O-OG1 3.08Å; V339-T343 VanDerWaalsContact O-OG1 3.07Å
340T95.6Very high96.5Very high81 Ų8197.4 Ų97.450%0.49750%0.496SS..Hα-helixtrans-57.8-44.5179.6-53.40000111.3N336 G337 T343 R344N336-T340 WeakPolarHBondContact O-CB 3.4Å; N336-T340 PolarHBondContact O-N 2.88Å; N336-T340 PolarHBondContact O-OG1 2.82Å; G337-T340 PolarHBondContact O-N 3.13Å; T340-T343 PolarHBondContact O-N 3.24Å; T340-R344 WeakPolarHBondContact O-CB 3.46Å; T340-R344 PolarHBondContact O-N 3.06Å
341E96.3Very high96.5Very high86 Ų8699 Ų9940%0.40250%0.503SS..Hα-helixtrans-65.7-40.6177.2-173.460.5-168.500112.1G337 V339 T343 R344 L345G337-E341 PolarHBondContact O-N 3.36Å; V339-E341 VanDerWaalsContact C-N 3.31Å; V339-E341 PolarHBondContact O-N 2.99Å; E341-T343 VanDerWaalsContact C-N 3.35Å; E341-T343 PolarHBondContact O-N 2.97Å; E341-R344 WeakPolarHBondContact O-CB 3.38Å; E341-R344 PolarHBondContact O-N 3.11Å; E341-R344 IonicContact OE1-CZ 3.88Å; E341-R344 IonicContact OE1-NE 3.94Å; E341-R344 PolarHBondContact OE1-NE 3.32Å; E341-R344 IonicContact OE1-NH2 3.49Å; E341-R344 PolarHBondContact OE1-NH2 2.87Å; E341-R344 IonicContact OE2-CZ 2.98Å; E341-R344 IonicContact OE2-NE 2.81Å; E341-R344 PolarHBondContact OE2-NE 3.13Å; E341-R344 IonicContact OE2-NH2 2.69Å; E341-L345 HydrophobicContact CG-CD1 4.43Å; E341-L345 WeakPolarHBondContact O-CG 3.45Å; E341-L345 PolarHBondContact O-N 3.5Å
342R95.7Very high96.5Very high178 Ų17897.7 Ų97.767%0.67250%0.504SS*.Hα-helixtrans-64.6-38.2174.2-76.7178.4177.591.9-4.1112.4G338 V339 R344 L346G338-R342 VanDerWaalsContact O-CG 3.31Å; G338-R342 WeakPolarHBondContact O-CG 3.4Å; G338-R342 PolarHBondContact O-N 3.29Å; G338-R342 PolarHBondContact O-NH1 3.03Å; G338-R342 VanDerWaalsContact O-NH1 3.16Å; V339-R342 PolarHBondContact O-N 3.36Å; V339-R342 VanDerWaalsContact O-N 3.13Å; R342-R344 VanDerWaalsContact C-N 3.33Å; R342-L346 VanDerWaalsContact O-CB 3.28Å; R342-L346 WeakPolarHBondContact O-CB 3.29Å; R342-L346 PolarHBondContact O-N 3.24Å
343T96.4Very high96.5Very high80 Ų8095.2 Ų95.249%0.49150%0.502SS..Hα-helixtrans-65-38.4174.4-59.40000111.3V339 T340 E341 L346 S347V339-T343 PolarHBondContact O-N 3.03Å; V339-T343 PolarHBondContact O-OG1 3.08Å; V339-T343 VanDerWaalsContact O-OG1 3.07Å; T340-T343 PolarHBondContact O-N 3.24Å; E341-T343 VanDerWaalsContact C-N 3.35Å; E341-T343 PolarHBondContact O-N 2.97Å; T343-L346 PolarHBondContact O-N 3.33Å; T343-S347 PolarHBondContact O-N 2.7Å; T343-S347 PolarHBondContact O-OG 3.26Å
344R97.1Very high96.5Very high118 Ų11893 Ų9345%0.44549%0.491SS..Hα-helixtrans-62.3-52.4174.1-167.7178.980.180.59.3111.2T340 E341 R342 L346 S347 E348T340-R344 WeakPolarHBondContact O-CB 3.46Å; T340-R344 PolarHBondContact O-N 3.06Å; E341-R344 WeakPolarHBondContact O-CB 3.38Å; E341-R344 PolarHBondContact O-N 3.11Å; E341-R344 IonicContact OE1-CZ 3.88Å; E341-R344 IonicContact OE1-NE 3.94Å; E341-R344 PolarHBondContact OE1-NE 3.32Å; E341-R344 IonicContact OE1-NH2 3.49Å; E341-R344 PolarHBondContact OE1-NH2 2.87Å; E341-R344 IonicContact OE2-CZ 2.98Å; E341-R344 IonicContact OE2-NE 2.81Å; E341-R344 PolarHBondContact OE2-NE 3.13Å; E341-R344 IonicContact OE2-NH2 2.69Å; R342-R344 VanDerWaalsContact C-N 3.33Å; R344-L346 VanDerWaalsContact C-N 3.31Å; R344-L346 PolarHBondContact O-N 2.87Å; R344-S347 WeakPolarHBondContact O-CB 3.49Å; R344-S347 PolarHBondContact O-N 3.03Å; R344-S347 VanDerWaalsContact O-N 3.1Å; R344-E348 IonicContact CZ-OE1 3.76Å; R344-E348 IonicContact NH1-OE1 3.84Å; R344-E348 PolarHBondContact NH1-OE1 3.08Å; R344-E348 IonicContact NH2-OE1 2.68Å; R344-E348 PolarHBondContact O-N 3.23Å
345L97.3Very high96.5Very high79 Ų7993.4 Ų93.441%0.41449%0.491SS..Hα-helixtrans-59.8-40.2176.8-69.5172.2000112.3E341 S347 E348 V349E341-L345 HydrophobicContact CG-CD1 4.43Å; E341-L345 WeakPolarHBondContact O-CG 3.45Å; E341-L345 PolarHBondContact O-N 3.5Å; L345-S347 VanDerWaalsContact C-N 3.31Å; L345-S347 PolarHBondContact O-N 3.2Å; L345-E348 PolarHBondContact O-N 3.4Å; L345-V349 WeakPolarHBondContact O-CG2 3.41Å; L345-V349 PolarHBondContact O-N 3.41Å
346L97.1Very high96.6Very high104 Ų10495.7 Ų95.755%0.54550%0.497SS..Hα-helixtrans-63.3-40.1176.2-170.4150.2000111.1R342 T343 R344 V349 M350R342-L346 VanDerWaalsContact O-CB 3.28Å; R342-L346 WeakPolarHBondContact O-CB 3.29Å; R342-L346 PolarHBondContact O-N 3.24Å; T343-L346 PolarHBondContact O-N 3.33Å; R344-L346 VanDerWaalsContact C-N 3.31Å; R344-L346 PolarHBondContact O-N 2.87Å; L346-V349 PolarHBondContact O-N 2.81Å; L346-M350 HydrophobicContact CD2-CG 3.93Å; L346-M350 HydrophobicContact CD2-SD 3.73Å; L346-M350 WeakPolarHBondContact O-CB 3.31Å; L346-M350 VanDerWaalsContact O-CG 3.29Å; L346-M350 WeakPolarHBondContact O-CG 3.46Å; L346-M350 PolarHBondContact O-N 3.46Å
347S96.6Very high96.6Very high59 Ų5996.7 Ų96.741%0.41350%0.497SS..Hα-helixtrans-64.9-42.5176.4-55.10000111.7T343 R344 L345 M350 E351T343-S347 PolarHBondContact O-N 2.7Å; T343-S347 PolarHBondContact O-OG 3.26Å; R344-S347 WeakPolarHBondContact O-CB 3.49Å; R344-S347 PolarHBondContact O-N 3.03Å; R344-S347 VanDerWaalsContact O-N 3.1Å; L345-S347 VanDerWaalsContact C-N 3.31Å; L345-S347 PolarHBondContact O-N 3.2Å; S347-M350 PolarHBondContact O-N 2.9Å; S347-E351 PolarHBondContact O-N 2.97Å
348E97.5Very high96.6Very high77 Ų77100.2 Ų100.236%0.3650%0.503SS..Hα-helixtrans-59.8-48174-72.5174.7-18000111.3R344 L345 M350 E351 E352R344-E348 IonicContact CZ-OE1 3.76Å; R344-E348 IonicContact NH1-OE1 3.84Å; R344-E348 PolarHBondContact NH1-OE1 3.08Å; R344-E348 IonicContact NH2-OE1 2.68Å; R344-E348 PolarHBondContact O-N 3.23Å; L345-E348 PolarHBondContact O-N 3.4Å; E348-M350 VanDerWaalsContact C-N 3.32Å; E348-M350 PolarHBondContact O-N 2.86Å; E348-E351 PolarHBondContact O-N 2.87Å; E348-E351 VanDerWaalsContact O-N 3.15Å; E348-E352 WeakPolarHBondContact O-CG 3.31Å; E348-E352 PolarHBondContact O-N 2.9Å
349V97.5Very high96.5Very high91 Ų91103.1 Ų103.155%0.55251%0.51SS*.Hα-helixtrans-64.6-35.9177.8172.80000111.8L345 L346 E352 L353L345-V349 WeakPolarHBondContact O-CG2 3.41Å; L345-V349 PolarHBondContact O-N 3.41Å; L346-V349 PolarHBondContact O-N 2.81Å; V349-E352 PolarHBondContact O-N 3.29Å; V349-L353 WeakPolarHBondContact O-CB 3.47Å; V349-L353 PolarHBondContact O-N 2.97Å
350M96.4Very high96.2Very high110 Ų110105.8 Ų105.854%0.54252%0.519SS..Hα-helixtrans-66-38.4173.6-74.7-164.7-24.400112.1L346 S347 E348 L353 E354L346-M350 HydrophobicContact CD2-CG 3.93Å; L346-M350 HydrophobicContact CD2-SD 3.73Å; L346-M350 WeakPolarHBondContact O-CB 3.31Å; L346-M350 VanDerWaalsContact O-CG 3.29Å; L346-M350 WeakPolarHBondContact O-CG 3.46Å; L346-M350 PolarHBondContact O-N 3.46Å; S347-M350 PolarHBondContact O-N 2.9Å; E348-M350 VanDerWaalsContact C-N 3.32Å; E348-M350 PolarHBondContact O-N 2.86Å; M350-L353 PolarHBondContact O-N 2.92Å; M350-E354 PolarHBondContact O-N 3.26Å
351E97.2Very high96.1Very high147 Ų147108.2 Ų108.269%0.68752%0.524SS*.Hα-helixtrans-66.6-42.7176.3-171174.1-177.300111.2S347 E348 L353 E354 K355S347-E351 PolarHBondContact O-N 2.97Å; E348-E351 PolarHBondContact O-N 2.87Å; E348-E351 VanDerWaalsContact O-N 3.15Å; E351-L353 VanDerWaalsContact C-N 3.32Å; E351-L353 PolarHBondContact O-N 2.96Å; E351-E354 PolarHBondContact O-N 3.48Å; E351-K355 WeakPolarHBondContact O-CB 3.3Å; E351-K355 PolarHBondContact O-N 2.96Å
352E97.2Very high95.8Very high134 Ų134110 Ų11063%0.62653%0.533SS*.Hα-helixtrans-60-42171.9-71.7-173.5166.900111.9E348 V349 K355 V356E348-E352 WeakPolarHBondContact O-CG 3.31Å; E348-E352 PolarHBondContact O-N 2.9Å; V349-E352 PolarHBondContact O-N 3.29Å; E352-K355 PolarHBondContact O-N 3.42Å; E352-V356 WeakPolarHBondContact O-CG2 3.39Å; E352-V356 PolarHBondContact O-N 3.47Å
353L96.4Very high95.4Very high120 Ų120108.3 Ų108.363%0.62853%0.531SS*.Hα-helixtrans-62.9-44.5176.8-17377.5000111.7V349 M350 E351 K355 V356 K357V349-L353 WeakPolarHBondContact O-CB 3.47Å; V349-L353 PolarHBondContact O-N 2.97Å; M350-L353 PolarHBondContact O-N 2.92Å; E351-L353 VanDerWaalsContact C-N 3.32Å; E351-L353 PolarHBondContact O-N 2.96Å; L353-K355 VanDerWaalsContact C-N 3.32Å; L353-V356 PolarHBondContact O-N 3.12Å; L353-K357 WeakPolarHBondContact O-CB 3.48Å; L353-K357 PolarHBondContact O-N 2.8Å
354E96.1Very high95Very high96 Ų96106.1 Ų106.145%0.44952%0.523SS..Hα-helixtrans-66.8-37178.6-16860-151.300111.1M350 E351 K357 Q358M350-E354 PolarHBondContact O-N 3.26Å; E351-E354 PolarHBondContact O-N 3.48Å; E354-K357 VanDerWaalsContact CD-NZ 3.3Å; E354-K357 PolarHBondContact O-N 3.21Å; E354-K357 IonicContact OE1-NZ 3.77Å; E354-K357 PolarHBondContact OE1-NZ 3.5Å; E354-K357 IonicContact OE2-NZ 3.93Å; E354-K357 PolarHBondContact OE2-NZ 3.27Å; E354-Q358 WeakPolarHBondContact O-CB 3.44Å; E354-Q358 PolarHBondContact O-N 2.77Å
355K96.7Very high94.4Very high131 Ų131103.9 Ų103.957%0.5753%0.526SS*.Hα-helixtrans-61-47.6172.1-174.7-178.6176.8-176.10111.8E351 E352 L353 K357 Q358 E359E351-K355 WeakPolarHBondContact O-CB 3.3Å; E351-K355 PolarHBondContact O-N 2.96Å; E352-K355 PolarHBondContact O-N 3.42Å; L353-K355 VanDerWaalsContact C-N 3.32Å; K355-K357 VanDerWaalsContact C-N 3.29Å; K355-K357 PolarHBondContact O-N 2.82Å; K355-Q358 PolarHBondContact O-N 3.3Å; K355-E359 WeakPolarHBondContact CE-OE1 3.38Å; K355-E359 WeakPolarHBondContact O-CG 3.47Å; K355-E359 PolarHBondContact O-N 2.9Å
356V96.5Very high93.7Very high90 Ų90104.1 Ų104.155%0.54553%0.534SS..Hα-helixtrans-62.1-39.2176.6171.10000111.1E352 L353 E359 M360E352-V356 WeakPolarHBondContact O-CG2 3.39Å; E352-V356 PolarHBondContact O-N 3.47Å; L353-V356 PolarHBondContact O-N 3.12Å; V356-E359 PolarHBondContact O-N 3.02Å; V356-M360 WeakPolarHBondContact O-CB 3.38Å; V356-M360 PolarHBondContact O-N 2.93Å
357K95.9Very high92.8Very high102 Ų102107.4 Ų107.444%0.44355%0.549SS..Hα-helixtrans-63.7-43.4175.5177.6171.2151.1-1110111.7L353 E354 K355 M360 E361L353-K357 WeakPolarHBondContact O-CB 3.48Å; L353-K357 PolarHBondContact O-N 2.8Å; E354-K357 VanDerWaalsContact CD-NZ 3.3Å; E354-K357 PolarHBondContact O-N 3.21Å; E354-K357 IonicContact OE1-NZ 3.77Å; E354-K357 PolarHBondContact OE1-NZ 3.5Å; E354-K357 IonicContact OE2-NZ 3.93Å; E354-K357 PolarHBondContact OE2-NZ 3.27Å; K355-K357 VanDerWaalsContact C-N 3.29Å; K355-K357 PolarHBondContact O-N 2.82Å; K357-M360 WeakPolarHBondContact O-CB 3.37Å; K357-M360 PolarHBondContact O-N 2.99Å; K357-E361 WeakPolarHBondContact O-CB 3.46Å; K357-E361 PolarHBondContact O-N 2.88Å
358Q95.3Very high91.9Very high115 Ų115110.1 Ų110.154%0.53756%0.563SS.*Hα-helixtrans-64.3-43.7175.9-170.7169.611.500111.6E354 K355 M360 E361 E362E354-Q358 WeakPolarHBondContact O-CB 3.44Å; E354-Q358 PolarHBondContact O-N 2.77Å; K355-Q358 PolarHBondContact O-N 3.3Å; Q358-M360 VanDerWaalsContact C-N 3.29Å; Q358-M360 PolarHBondContact O-N 2.91Å; Q358-E361 PolarHBondContact O-N 3.4Å; Q358-E362 WeakPolarHBondContact O-CB 3.3Å; Q358-E362 PolarHBondContact O-N 3.1Å
359E94.7Very high91Very high84 Ų84110.7 Ų110.739%0.39357%0.569SS.*Hα-helixtrans-61.4-37.3173.2-72.9-178.8-16500112.1K355 V356 K363K355-E359 WeakPolarHBondContact CE-OE1 3.38Å; K355-E359 WeakPolarHBondContact O-CG 3.47Å; K355-E359 PolarHBondContact O-N 2.9Å; V356-E359 PolarHBondContact O-N 3.02Å; E359-K363 WeakPolarHBondContact O-CB 3.37Å; E359-K363 VanDerWaalsContact O-CG 3.3Å; E359-K363 WeakPolarHBondContact O-CG 3.46Å; E359-K363 PolarHBondContact O-N 3.41Å
360M91.5Very high90.1Very high139 Ų139108.1 Ų108.169%0.68556%0.561SS**Hα-helixtrans-67.9-38.9175.8-165.7-177.887.900111.6V356 K357 Q358 G364V356-M360 WeakPolarHBondContact O-CB 3.38Å; V356-M360 PolarHBondContact O-N 2.93Å; K357-M360 WeakPolarHBondContact O-CB 3.37Å; K357-M360 PolarHBondContact O-N 2.99Å; Q358-M360 VanDerWaalsContact C-N 3.29Å; Q358-M360 PolarHBondContact O-N 2.91Å; M360-G364 PolarHBondContact O-N 2.91Å
361E91.9Very high89.4Confident132 Ų132105.3 Ų105.362%0.61756%0.555SS**Hα-helixtrans-71.9-37.5177.3-167.8168.2-168.300112.1K357 Q358 G364 S365K357-E361 WeakPolarHBondContact O-CB 3.46Å; K357-E361 PolarHBondContact O-N 2.88Å; Q358-E361 PolarHBondContact O-N 3.4Å; E361-G364 PolarHBondContact O-N 3.42Å; E361-S365 WeakPolarHBondContact O-CB 3.32Å; E361-S365 PolarHBondContact O-N 2.83Å; E361-S365 PolarHBondContact O-OG 3.05Å
362E90.3Very high88.6Confident123 Ų123101.8 Ų101.858%0.57555%0.545SS*.Hα-helixtrans-63.3-45.2169.9-79.6-173.7167.800111.7Q358 G364 S365 S366Q358-E362 WeakPolarHBondContact O-CB 3.3Å; Q358-E362 PolarHBondContact O-N 3.1Å; E362-G364 VanDerWaalsContact C-N 3.34Å; E362-S365 WeakPolarHBondContact CA-OG 3.44Å; E362-S365 PolarHBondContact O-OG 3.22Å; E362-S366 VanDerWaalsContact O-CB 3.22Å; E362-S366 WeakPolarHBondContact O-CB 3.42Å; E362-S366 PolarHBondContact O-N 2.93Å
363K88.4Confident87.9Confident144 Ų144101.7 Ų101.763%0.62655%0.548SS*.Hα-helixtrans-65-39.7174.2-76175.1-177.3165.10111.7E359 S366 M367E359-K363 WeakPolarHBondContact O-CB 3.37Å; E359-K363 VanDerWaalsContact O-CG 3.3Å; E359-K363 WeakPolarHBondContact O-CG 3.46Å; E359-K363 PolarHBondContact O-N 3.41Å; K363-S366 PolarHBondContact O-N 3.45Å; K363-M367 VanDerWaalsContact O-CB 3.28Å; K363-M367 WeakPolarHBondContact O-CB 3.41Å; K363-M367 PolarHBondContact O-N 2.84Å
364G88.1Confident87.4Confident33 Ų3399.7 Ų99.734%0.3454%0.54SS..Hα-helixtrans-63.2-49.2176.800000111.7M360 E361 E362 M367 T368M360-G364 PolarHBondContact O-N 2.91Å; E361-G364 PolarHBondContact O-N 3.42Å; E362-G364 VanDerWaalsContact C-N 3.34Å; G364-M367 PolarHBondContact O-N 3.12Å; G364-T368 WeakPolarHBondContact O-CB 3.39Å; G364-T368 PolarHBondContact O-N 3.35Å; G364-T368 PolarHBondContact O-OG1 3.03Å
365S84.8Confident87Confident71 Ų71102.2 Ų102.250%0.49755%0.55SS..Hα-helixtrans-63.5-42175.656.90000111.7E361 E362 M367 T368 D369E361-S365 WeakPolarHBondContact O-CB 3.32Å; E361-S365 PolarHBondContact O-N 2.83Å; E361-S365 PolarHBondContact O-OG 3.05Å; E362-S365 WeakPolarHBondContact CA-OG 3.44Å; E362-S365 PolarHBondContact O-OG 3.22Å; S365-M367 PolarHBondContact O-N 3.26Å; S365-T368 CarbonylContact O-C 3.6Å; S365-T368 PolarHBondContact O-N 3.48Å; S365-D369 WeakPolarHBondContact O-CA 3.34Å; S365-D369 WeakPolarHBondContact O-CB 3.48Å; S365-D369 PolarHBondContact O-N 3.34Å
366S82.6Confident86.6Confident85 Ų85101.3 Ų101.359%0.59455%0.55SS**Hα-helixtrans-62.3-37.6173.2171.70000113.3E362 K363E362-S366 VanDerWaalsContact O-CB 3.22Å; E362-S366 WeakPolarHBondContact O-CB 3.42Å; E362-S366 PolarHBondContact O-N 2.93Å; K363-S366 PolarHBondContact O-N 3.45Å
367M76.3Confident86.3Confident172 Ų172104.1 Ų104.185%0.84756%0.555SS**Hα-helixtrans-77.3-27.3179.8-157.6-179.990.400112K363 G364 S365K363-M367 VanDerWaalsContact O-CB 3.28Å; K363-M367 WeakPolarHBondContact O-CB 3.41Å; K363-M367 PolarHBondContact O-N 2.84Å; G364-M367 PolarHBondContact O-N 3.12Å; S365-M367 PolarHBondContact O-N 3.26Å
368T79.1Confident86.1Confident116 Ų116105.3 Ų105.371%0.71256%0.562SS**Hα-helixtrans-90.4-16.3177.2-36.40000112.2G364 S365 G370G364-T368 WeakPolarHBondContact O-CB 3.39Å; G364-T368 PolarHBondContact O-N 3.35Å; G364-T368 PolarHBondContact O-OG1 3.03Å; S365-T368 CarbonylContact O-C 3.6Å; S365-T368 PolarHBondContact O-N 3.48Å; T368-G370 PolarHBondContact O-N 3Å
369D77.3Confident86Confident90 Ų90102.9 Ų102.948%0.48156%0.558SS.*  trans-68.198.4174.6-174.814.7000109.4S365 A371 P372S365-D369 WeakPolarHBondContact O-CA 3.34Å; S365-D369 WeakPolarHBondContact O-CB 3.48Å; S365-D369 PolarHBondContact O-N 3.34Å; D369-A371 PolarHBondContact O-N 3.5Å; D369-A371 WeakPolarHBondContact OD1-CB 3.28Å; D369-A371 PolarHBondContact OD1-N 2.9Å; D369-P372 WeakPolarHBondContact O-CD 3.49Å
370G80.5Confident85.9Confident37 Ų37103.5 Ų103.538%0.38156%0.563SS.*  trans-73-4.3173.100000113.3T368 P372 L373 V374T368-G370 PolarHBondContact O-N 3Å; G370-P372 VanDerWaalsContact C-CD 3.48Å; G370-L373 CarbonylContact O-C 3.56Å; G370-L373 WeakPolarHBondContact O-CA 3.36Å; G370-L373 VanDerWaalsContact O-CB 3.29Å; G370-L373 WeakPolarHBondContact O-CB 3.47Å; G370-L373 PolarHBondContact O-N 3.11Å; G370-V374 WeakPolarHBondContact O-CG2 3.47Å; G370-V374 PolarHBondContact O-N 3.48Å
371A79.8Confident86Confident51 Ų51100.5 Ų100.542%0.42155%0.553SS.*Hα-helixtrans-56.9-41.1-177.700000114D369 L373 V374 K375D369-A371 PolarHBondContact O-N 3.5Å; D369-A371 WeakPolarHBondContact OD1-CB 3.28Å; D369-A371 PolarHBondContact OD1-N 2.9Å; A371-L373 VanDerWaalsContact C-N 3.3Å; A371-L373 PolarHBondContact O-N 3.2Å; A371-V374 PolarHBondContact O-N 2.98Å; A371-K375 WeakPolarHBondContact O-CB 3.17Å; A371-K375 PolarHBondContact O-N 2.89Å
372P80.9Confident86.2Confident73 Ų73100.6 Ų100.647%0.47455%0.551SS.*Hα-helixtrans-60.4-41.2173-21.133.5000111.7D369 G370 K375 I376D369-P372 WeakPolarHBondContact O-CD 3.49Å; G370-P372 VanDerWaalsContact C-CD 3.48Å; P372-K375 PolarHBondContact O-N 3.22Å; P372-I376 VanDerWaalsContact O-CG1 3.31Å; P372-I376 WeakPolarHBondContact O-CG1 3.22Å; P372-I376 PolarHBondContact O-N 3.34Å
373L82.1Confident86.4Confident132 Ų13299.7 Ų99.769%0.69155%0.55SS**Hα-helixtrans-65.5-41.9178.2-146.387.8000111.5G370 A371 I376 K377G370-L373 CarbonylContact O-C 3.56Å; G370-L373 WeakPolarHBondContact O-CA 3.36Å; G370-L373 VanDerWaalsContact O-CB 3.29Å; G370-L373 WeakPolarHBondContact O-CB 3.47Å; G370-L373 PolarHBondContact O-N 3.11Å; A371-L373 VanDerWaalsContact C-N 3.3Å; A371-L373 PolarHBondContact O-N 3.2Å; L373-I376 PolarHBondContact O-N 2.89Å; L373-K377 WeakPolarHBondContact O-CB 3.41Å; L373-K377 PolarHBondContact O-N 3.5Å
374V86.4Confident86.7Confident77 Ų7799.3 Ų99.347%0.46755%0.548SS..Hα-helixtrans-63.4-41.6174.6173.70000110.7G370 A371 K377 Q378G370-V374 WeakPolarHBondContact O-CG2 3.47Å; G370-V374 PolarHBondContact O-N 3.48Å; A371-V374 PolarHBondContact O-N 2.98Å; V374-K377 WeakPolarHBondContact O-CB 3.29Å; V374-K377 PolarHBondContact O-N 2.88Å; V374-Q378 HydrophobicContact CG1-CG 4.46Å; V374-Q378 WeakPolarHBondContact O-CG 3.41Å; V374-Q378 PolarHBondContact O-N 3.3Å
375K87.9Confident87Confident150 Ų150104.4 Ų104.465%0.65256%0.563SS**Hα-helixtrans-65.2-41.6177.9-150.8173.5-169176.30111.9A371 P372 Q378 S379A371-K375 WeakPolarHBondContact O-CB 3.17Å; A371-K375 PolarHBondContact O-N 2.89Å; P372-K375 PolarHBondContact O-N 3.22Å; K375-Q378 PolarHBondContact O-N 2.86Å; K375-S379 WeakPolarHBondContact O-CB 3.31Å; K375-S379 PolarHBondContact O-N 3.42Å; K375-S379 PolarHBondContact O-OG 3.13Å
376I88.6Confident87.5Confident112 Ų112105.4 Ų105.457%0.57456%0.56SS**Hα-helixtrans-60.7-46.9171.2-68.4165.7000110.1P372 L373 Q378 S379 L380P372-I376 VanDerWaalsContact O-CG1 3.31Å; P372-I376 WeakPolarHBondContact O-CG1 3.22Å; P372-I376 PolarHBondContact O-N 3.34Å; L373-I376 PolarHBondContact O-N 2.89Å; I376-Q378 PolarHBondContact O-N 3.16Å; I376-S379 WeakPolarHBondContact O-CB 3.47Å; I376-S379 PolarHBondContact O-N 2.91Å; I376-L380 WeakPolarHBondContact O-CB 3.28Å; I376-L380 PolarHBondContact O-N 3.41Å
377K91Very high88Confident149 Ų149104.8 Ų104.865%0.64855%0.553SS**Hα-helixtrans-59.8-46178.6-172.9-179.5177.9-1780112L373 V374 S379 L380 T381L373-K377 WeakPolarHBondContact O-CB 3.41Å; L373-K377 PolarHBondContact O-N 3.5Å; V374-K377 WeakPolarHBondContact O-CB 3.29Å; V374-K377 PolarHBondContact O-N 2.88Å; K377-S379 PolarHBondContact O-N 3.45Å; K377-L380 WeakPolarHBondContact O-CB 3.48Å; K377-L380 PolarHBondContact O-N 2.84Å; K377-T381 PolarHBondContact O-N 3.33Å; K377-T381 PolarHBondContact O-OG1 3.3Å
378Q91.8Very high88.9Confident126 Ų126100.6 Ų100.659%0.58954%0.537SS*.Hα-helixtrans-60.7-43.3175.6-75.4176.3-6.800112V374 K375 I376 L380 T381 K382V374-Q378 HydrophobicContact CG1-CG 4.46Å; V374-Q378 WeakPolarHBondContact O-CG 3.41Å; V374-Q378 PolarHBondContact O-N 3.3Å; K375-Q378 PolarHBondContact O-N 2.86Å; I376-Q378 PolarHBondContact O-N 3.16Å; Q378-L380 VanDerWaalsContact C-N 3.33Å; Q378-L380 PolarHBondContact O-N 2.95Å; Q378-T381 PolarHBondContact O-N 3.46Å; Q378-K382 PolarHBondContact O-N 3.31Å
379S92.1Very high89.6Confident65 Ų6599.6 Ų99.646%0.45552%0.524SS..Hα-helixtrans-61.3-42.7176.8-51.20000111.4K375 I376 K377 K382 L383K375-S379 WeakPolarHBondContact O-CB 3.31Å; K375-S379 PolarHBondContact O-N 3.42Å; K375-S379 PolarHBondContact O-OG 3.13Å; I376-S379 WeakPolarHBondContact O-CB 3.47Å; I376-S379 PolarHBondContact O-N 2.91Å; K377-S379 PolarHBondContact O-N 3.45Å; S379-K382 PolarHBondContact O-N 3.04Å; S379-L383 PolarHBondContact O-N 3.43Å
380L93.1Very high90.4Very high96 Ų96100.7 Ų100.750%0.50353%0.528SS..Hα-helixtrans-64.2-41.6176.1-162.6100.8000111.7I376 K377 Q378 K382 L383 K384I376-L380 WeakPolarHBondContact O-CB 3.28Å; I376-L380 PolarHBondContact O-N 3.41Å; K377-L380 WeakPolarHBondContact O-CB 3.48Å; K377-L380 PolarHBondContact O-N 2.84Å; Q378-L380 VanDerWaalsContact C-N 3.33Å; Q378-L380 PolarHBondContact O-N 2.95Å; L380-K382 VanDerWaalsContact C-N 3.35Å; L380-L383 PolarHBondContact O-N 2.93Å; L380-K384 WeakPolarHBondContact O-CG 3.39Å; L380-K384 PolarHBondContact O-N 2.9Å
381T93.8Very high91.1Very high76 Ų76103.4 Ų103.447%0.46653%0.533SS..Hα-helixtrans-63.2-42.2175.5-55.30000111.2K377 Q378 K384 Q385K377-T381 PolarHBondContact O-N 3.33Å; K377-T381 PolarHBondContact O-OG1 3.3Å; Q378-T381 PolarHBondContact O-N 3.46Å; T381-K384 WeakPolarHBondContact O-CB 3.26Å; T381-K384 PolarHBondContact O-N 3.45Å; T381-Q385 PolarHBondContact O-N 2.94Å
382K95.1Very high91.7Very high135 Ų135105.9 Ų105.959%0.58754%0.538SS*.Hα-helixtrans-61.5-46.7175.9-171.1-176.9176.6-169.10111.8Q378 S379 L380 K384 Q385 E386Q378-K382 PolarHBondContact O-N 3.31Å; S379-K382 PolarHBondContact O-N 3.04Å; L380-K382 VanDerWaalsContact C-N 3.35Å; K382-K384 VanDerWaalsContact C-N 3.31Å; K382-K384 PolarHBondContact O-N 3Å; K382-Q385 WeakPolarHBondContact O-CB 3.43Å; K382-Q385 PolarHBondContact O-N 2.8Å; K382-Q385 VanDerWaalsContact O-N 3.08Å; K382-E386 VanDerWaalsContact CE-OE1 3.31Å; K382-E386 WeakPolarHBondContact CE-OE1 3.46Å; K382-E386 IonicContact NZ-OE1 2.71Å; K382-E386 PolarHBondContact O-N 2.97Å
383L94.8Very high92.2Very high104 Ų104109.7 Ų109.755%0.54554%0.543SS..Hα-helixtrans-58.9-40.8175.2-86.8167.8000112.4S379 L380 Q385 E386 T387S379-L383 PolarHBondContact O-N 3.43Å; L380-L383 PolarHBondContact O-N 2.93Å; L383-Q385 VanDerWaalsContact C-N 3.3Å; L383-Q385 PolarHBondContact O-N 3.11Å; L383-E386 PolarHBondContact O-N 3.25Å; L383-T387 PolarHBondContact O-N 2.9Å; L383-T387 PolarHBondContact O-OG1 2.78Å
384K94.4Very high92.8Very high135 Ų135106.9 Ų106.959%0.58753%0.528SS*.Hα-helixtrans-61.7-40.8174.4-76.4-176.1176.8-171.90111.8L380 T381 K382 T387 V388L380-K384 WeakPolarHBondContact O-CG 3.39Å; L380-K384 PolarHBondContact O-N 2.9Å; T381-K384 WeakPolarHBondContact O-CB 3.26Å; T381-K384 PolarHBondContact O-N 3.45Å; K382-K384 VanDerWaalsContact C-N 3.31Å; K382-K384 PolarHBondContact O-N 3Å; K384-T387 WeakPolarHBondContact O-CB 3.28Å; K384-T387 PolarHBondContact O-N 3.47Å; K384-V388 WeakPolarHBondContact O-CG2 3.41Å; K384-V388 PolarHBondContact O-N 3.25Å
385Q94.4Very high93.1Very high140 Ų140104.8 Ų104.865%0.65452%0.522SS*.Hα-helixtrans-68.2-42.9179.2-161.2131.81300112T381 K382 L383 T387 V388 E389T381-Q385 PolarHBondContact O-N 2.94Å; K382-Q385 WeakPolarHBondContact O-CB 3.43Å; K382-Q385 PolarHBondContact O-N 2.8Å; K382-Q385 VanDerWaalsContact O-N 3.08Å; L383-Q385 VanDerWaalsContact C-N 3.3Å; L383-Q385 PolarHBondContact O-N 3.11Å; Q385-T387 VanDerWaalsContact C-N 3.28Å; Q385-T387 PolarHBondContact O-N 2.92Å; Q385-V388 PolarHBondContact O-N 3.05Å; Q385-E389 PolarHBondContact O-N 3.11Å
386E95.3Very high93.3Very high93 Ų93102.5 Ų102.544%0.43552%0.516SS..Hα-helixtrans-60.3-37.8171.9-77.8175.6-176.100111.6K382 L383 E389 M390K382-E386 VanDerWaalsContact CE-OE1 3.31Å; K382-E386 WeakPolarHBondContact CE-OE1 3.46Å; K382-E386 IonicContact NZ-OE1 2.71Å; K382-E386 PolarHBondContact O-N 2.97Å; L383-E386 PolarHBondContact O-N 3.25Å; E386-E389 PolarHBondContact O-N 2.86Å; E386-M390 WeakPolarHBondContact O-CB 3.49Å; E386-M390 PolarHBondContact O-N 2.9Å
387T93.9Very high93.5Very high72 Ų72101.8 Ų101.844%0.44252%0.517SS..Hα-helixtrans-62.1-48.3175.4-52.40000111.3L383 K384 Q385 E389 M390 D391L383-T387 PolarHBondContact O-N 2.9Å; L383-T387 PolarHBondContact O-OG1 2.78Å; K384-T387 WeakPolarHBondContact O-CB 3.28Å; K384-T387 PolarHBondContact O-N 3.47Å; Q385-T387 VanDerWaalsContact C-N 3.28Å; Q385-T387 PolarHBondContact O-N 2.92Å; T387-E389 VanDerWaalsContact C-N 3.32Å; T387-E389 PolarHBondContact O-N 3.1Å; T387-M390 PolarHBondContact O-N 3.04Å; T387-D391 PolarHBondContact O-N 3.34Å
388V94.4Very high93.5Very high84 Ų84100.7 Ų100.751%0.50951%0.514SS..Hα-helixtrans-61.7-41.5177.5171.90000111.3K384 Q385 M390 D391 I392K384-V388 WeakPolarHBondContact O-CG2 3.41Å; K384-V388 PolarHBondContact O-N 3.25Å; Q385-V388 PolarHBondContact O-N 3.05Å; V388-M390 VanDerWaalsContact C-N 3.32Å; V388-M390 PolarHBondContact O-N 2.97Å; V388-D391 PolarHBondContact O-N 2.96Å; V388-I392 HydrophobicContact CG1-CD1 4.12Å; V388-I392 WeakPolarHBondContact O-CG1 3.36Å; V388-I392 PolarHBondContact O-N 2.85Å
389E94.9Very high93.4Very high95 Ų95100.4 Ų100.444%0.44451%0.512SS..Hα-helixtrans-62.9-41.8176.2-170-178.717100111.4Q385 E386 T387 I392 R393Q385-E389 PolarHBondContact O-N 3.11Å; E386-E389 PolarHBondContact O-N 2.86Å; T387-E389 VanDerWaalsContact C-N 3.32Å; T387-E389 PolarHBondContact O-N 3.1Å; E389-I392 PolarHBondContact O-N 2.79Å; E389-R393 WeakPolarHBondContact O-CG 3.39Å; E389-R393 PolarHBondContact O-N 3.46Å; E389-R393 IonicContact OE1-CZ 3.4Å; E389-R393 IonicContact OE1-NE 3.43Å; E389-R393 PolarHBondContact OE1-NE 3.09Å; E389-R393 IonicContact OE1-NH2 2.67Å; E389-R393 PolarHBondContact OE1-NH2 2.84Å
390M94.4Very high93.4Very high113 Ų113101 Ų10156%0.55751%0.513SS*.Hα-helixtrans-65.3-40.1177.1-154.3173.57400111.6E386 T387 V388 I392 R393 I394E386-M390 WeakPolarHBondContact O-CB 3.49Å; E386-M390 PolarHBondContact O-N 2.9Å; T387-M390 PolarHBondContact O-N 3.04Å; V388-M390 VanDerWaalsContact C-N 3.32Å; V388-M390 PolarHBondContact O-N 2.97Å; M390-I392 PolarHBondContact O-N 3.08Å; M390-R393 PolarHBondContact O-N 2.91Å; M390-I394 HydrophobicContact CG-CD1 4.42Å; M390-I394 VanDerWaalsContact O-CG1 3.25Å; M390-I394 WeakPolarHBondContact O-CG1 3.35Å; M390-I394 PolarHBondContact O-N 3.42Å
391D93.8Very high93.2Very high94 Ų94101.3 Ų101.350%0.50352%0.515SS..Hα-helixtrans-61.6-42174.3-73.4-21.9000112T387 V388 I394 G395T387-D391 PolarHBondContact O-N 3.34Å; V388-D391 PolarHBondContact O-N 2.96Å; D391-I394 PolarHBondContact O-N 2.97Å; D391-G395 PolarHBondContact O-N 3.47Å
392I92.4Very high93Very high102 Ų102102.8 Ų102.852%0.52352%0.519SS..Hα-helixtrans-62.6-44.9175.1-67.1165.4000110.2V388 E389 M390 G395 I396V388-I392 HydrophobicContact CG1-CD1 4.12Å; V388-I392 WeakPolarHBondContact O-CG1 3.36Å; V388-I392 PolarHBondContact O-N 2.85Å; E389-I392 PolarHBondContact O-N 2.79Å; M390-I392 PolarHBondContact O-N 3.08Å; I392-G395 PolarHBondContact O-N 3.43Å; I392-I396 HydrophobicContact CG2-CD1 3.9Å; I392-I396 HydrophobicContact CG2-CG1 4.47Å; I392-I396 WeakPolarHBondContact O-CG1 3.32Å; I392-I396 PolarHBondContact O-N 2.95Å
393R92.6Very high92.7Very high153 Ų153100.7 Ų100.758%0.57751%0.512SS*.Hα-helixtrans-62-43.6177.4-70.8175.3-175.2-159.74.2111.2E389 M390 I396 V397E389-R393 WeakPolarHBondContact O-CG 3.39Å; E389-R393 PolarHBondContact O-N 3.46Å; E389-R393 IonicContact OE1-CZ 3.4Å; E389-R393 IonicContact OE1-NE 3.43Å; E389-R393 PolarHBondContact OE1-NE 3.09Å; E389-R393 IonicContact OE1-NH2 2.67Å; E389-R393 PolarHBondContact OE1-NH2 2.84Å; M390-R393 PolarHBondContact O-N 2.91Å; R393-I396 PolarHBondContact O-N 3.32Å; R393-V397 VanDerWaalsContact O-CG2 3.27Å; R393-V397 WeakPolarHBondContact O-CG2 3.47Å; R393-V397 PolarHBondContact O-N 3.47Å
394I93.1Very high92.2Very high74 Ų7499.1 Ų99.138%0.37951%0.509SS..Hα-helixtrans-58.4-49.5174.2-69.7163.9000109.7M390 D391 I396 V397 E398M390-I394 HydrophobicContact CG-CD1 4.42Å; M390-I394 VanDerWaalsContact O-CG1 3.25Å; M390-I394 WeakPolarHBondContact O-CG1 3.35Å; M390-I394 PolarHBondContact O-N 3.42Å; D391-I394 PolarHBondContact O-N 2.97Å; I394-I396 PolarHBondContact O-N 2.94Å; I394-V397 CarbonylContact O-C 3.48Å; I394-V397 PolarHBondContact O-N 3.24Å; I394-V397 VanDerWaalsContact O-N 3.12Å; I394-E398 HydrophobicContact CG2-CG 4.18Å; I394-E398 WeakPolarHBondContact O-CB 3.34Å; I394-E398 WeakPolarHBondContact O-CG 3.42Å; I394-E398 PolarHBondContact O-N 3.04Å
395G93.3Very high91.7Very high33 Ų3398.9 Ų98.934%0.3451%0.508SS..Hα-helixtrans-60.4-39.217900000113.8D391 I392 H399D391-G395 PolarHBondContact O-N 3.47Å; I392-G395 PolarHBondContact O-N 3.43Å; G395-H399 WeakPolarHBondContact O-CB 3.36Å; G395-H399 PolarHBondContact O-N 2.69Å
396I93.1Very high91.3Very high101 Ų10197.3 Ų97.352%0.51850%0.504SS..Hα-helixtrans-65.3-43.9174.1-67.1166.2000110.6I392 R393 I394 H399 T400I392-I396 HydrophobicContact CG2-CD1 3.9Å; I392-I396 HydrophobicContact CG2-CG1 4.47Å; I392-I396 WeakPolarHBondContact O-CG1 3.32Å; I392-I396 PolarHBondContact O-N 2.95Å; R393-I396 PolarHBondContact O-N 3.32Å; I394-I396 PolarHBondContact O-N 2.94Å; I396-H399 PolarHBondContact O-N 2.61Å; I396-T400 VanDerWaalsContact O-CB 3.29Å; I396-T400 WeakPolarHBondContact O-CB 3.45Å; I396-T400 PolarHBondContact O-N 3.49Å; I396-T400 PolarHBondContact O-OG1 2.94Å
397V92.1Very high90.6Very high97 Ų9798.7 Ų98.759%0.58851%0.508SS*.Hα-helixtrans-63.7-44.8177.9170.50000110.5R393 I394 T400 L401R393-V397 VanDerWaalsContact O-CG2 3.27Å; R393-V397 WeakPolarHBondContact O-CG2 3.47Å; R393-V397 PolarHBondContact O-N 3.47Å; I394-V397 CarbonylContact O-C 3.48Å; I394-V397 PolarHBondContact O-N 3.24Å; I394-V397 VanDerWaalsContact O-N 3.12Å; V397-T400 PolarHBondContact O-N 3.36Å; V397-L401 VanDerWaalsContact O-CB 3.26Å; V397-L401 WeakPolarHBondContact O-CB 3.01Å; V397-L401 PolarHBondContact O-N 2.87Å
398E90.3Very high90Very high127 Ų127100.7 Ų100.759%0.59351%0.513SS*.Hα-helixtrans-60.3-46.7175.1-74.5-178.4165.200111.6I394 L401 L402I394-E398 HydrophobicContact CG2-CG 4.18Å; I394-E398 WeakPolarHBondContact O-CB 3.34Å; I394-E398 WeakPolarHBondContact O-CG 3.42Å; I394-E398 PolarHBondContact O-N 3.04Å; E398-L401 PolarHBondContact O-N 3.41Å; E398-L402 VanDerWaalsContact O-CB 3.32Å; E398-L402 WeakPolarHBondContact O-CB 3.31Å; E398-L402 PolarHBondContact O-N 3.43Å
399H91.1Very high89.2Confident120 Ų120103.7 Ų103.756%0.55652%0.519SS*.Hα-helixtrans-62.4-44.2176.6-176.375.4000112G395 I396 L402 Q403G395-H399 WeakPolarHBondContact O-CB 3.36Å; G395-H399 PolarHBondContact O-N 2.69Å; I396-H399 PolarHBondContact O-N 2.61Å; H399-L402 PolarHBondContact O-N 2.93Å; H399-Q403 WeakPolarHBondContact O-CB 3.38Å; H399-Q403 PolarHBondContact O-N 3.32Å
400T90.4Very high88.1Confident77 Ų77102.5 Ų102.547%0.47252%0.521SS..Hα-helixtrans-63.3-43.5178.3-56.10000110.9I396 V397 Q403 S404I396-T400 VanDerWaalsContact O-CB 3.29Å; I396-T400 WeakPolarHBondContact O-CB 3.45Å; I396-T400 PolarHBondContact O-N 3.49Å; I396-T400 PolarHBondContact O-OG1 2.94Å; V397-T400 PolarHBondContact O-N 3.36Å; T400-Q403 PolarHBondContact O-N 2.76Å; T400-S404 WeakPolarHBondContact O-CB 3.47Å; T400-S404 PolarHBondContact O-N 3.27Å
401L89.8Confident87.1Confident103 Ų103101.5 Ų101.554%0.53952%0.518SS..Hα-helixtrans-61.5-45.4174.7-175.277.7000111V397 E398 S404 K405V397-L401 VanDerWaalsContact O-CB 3.26Å; V397-L401 WeakPolarHBondContact O-CB 3.01Å; V397-L401 PolarHBondContact O-N 2.87Å; E398-L401 PolarHBondContact O-N 3.41Å; L401-S404 WeakPolarHBondContact O-CB 3.27Å; L401-S404 PolarHBondContact O-N 3.09Å; L401-K405 WeakPolarHBondContact O-CG 3.44Å; L401-K405 PolarHBondContact O-N 3.04Å
402L90.8Very high86Confident107 Ų107103 Ų10356%0.5652%0.523SS*.Hα-helixtrans-63.9-43.3179.1-156.4106.1000111.3E398 H399 S404 K405 L406E398-L402 VanDerWaalsContact O-CB 3.32Å; E398-L402 WeakPolarHBondContact O-CB 3.31Å; E398-L402 PolarHBondContact O-N 3.43Å; H399-L402 PolarHBondContact O-N 2.93Å; L402-S404 VanDerWaalsContact C-N 3.34Å; L402-K405 PolarHBondContact O-N 3.44Å; L402-L406 HydrophobicContact CD2-CD1 4.1Å; L402-L406 WeakPolarHBondContact O-CB 3.31Å; L402-L406 WeakPolarHBondContact O-CG 3.44Å; L402-L406 PolarHBondContact O-N 2.82Å
403Q87.3Confident84.7Confident90 Ų90101.8 Ų101.842%0.42152%0.521SS..Hα-helixtrans-64.3-39.5176-164.1-173.447.200111.5H399 T400 L406 K407H399-Q403 WeakPolarHBondContact O-CB 3.38Å; H399-Q403 PolarHBondContact O-N 3.32Å; T400-Q403 PolarHBondContact O-N 2.76Å; Q403-L406 PolarHBondContact O-N 3.49Å; Q403-K407 WeakPolarHBondContact O-CB 3.42Å; Q403-K407 WeakPolarHBondContact O-CG 3.46Å; Q403-K407 PolarHBondContact O-N 3.24Å
404S85.1Confident83.3Confident71 Ų71103.7 Ų103.750%0.49753%0.528SS..Hα-helixtrans-61.4-47.4173.2-169.90000111.3T400 L401 L402 L406 K407 E408T400-S404 WeakPolarHBondContact O-CB 3.47Å; T400-S404 PolarHBondContact O-N 3.27Å; L401-S404 WeakPolarHBondContact O-CB 3.27Å; L401-S404 PolarHBondContact O-N 3.09Å; L402-S404 VanDerWaalsContact C-N 3.34Å; S404-L406 VanDerWaalsContact C-N 3.34Å; S404-L406 PolarHBondContact O-N 3.37Å; S404-K407 PolarHBondContact O-N 3.2Å; S404-E408 WeakPolarHBondContact O-CB 3.28Å; S404-E408 PolarHBondContact O-N 3.17Å
405K84.4Confident81.8Confident131 Ų131105.6 Ų105.657%0.5754%0.539SS*.Hα-helixtrans-61.7-39.2176-75.9-171.2175.5-175.70112.7L401 L402 E408 K409L401-K405 WeakPolarHBondContact O-CG 3.44Å; L401-K405 PolarHBondContact O-N 3.04Å; L402-K405 PolarHBondContact O-N 3.44Å; K405-E408 PolarHBondContact O-N 3.09Å; K405-K409 WeakPolarHBondContact O-CB 3.24Å; K405-K409 PolarHBondContact O-N 2.99Å
406L84.3Confident80.1Confident107 Ų107110.5 Ų110.556%0.5656%0.555SS**Hα-helixtrans-67.7-41.4175.7-75.2170.5000112L402 Q403 S404 K409 S410L402-L406 HydrophobicContact CD2-CD1 4.1Å; L402-L406 WeakPolarHBondContact O-CB 3.31Å; L402-L406 WeakPolarHBondContact O-CG 3.44Å; L402-L406 PolarHBondContact O-N 2.82Å; Q403-L406 PolarHBondContact O-N 3.49Å; S404-L406 VanDerWaalsContact C-N 3.34Å; S404-L406 PolarHBondContact O-N 3.37Å; L406-K409 PolarHBondContact O-N 3.34Å; L406-S410 WeakPolarHBondContact O-CB 3.43Å; L406-S410 PolarHBondContact O-N 2.89Å
407K81.7Confident78.3Confident121 Ų121113 Ų11353%0.52656%0.564SS.*Hα-helixtrans-63-41.8173.6-78.4176.4178.31730111.7Q403 S404 S410 N411Q403-K407 WeakPolarHBondContact O-CB 3.42Å; Q403-K407 WeakPolarHBondContact O-CG 3.46Å; Q403-K407 PolarHBondContact O-N 3.24Å; S404-K407 PolarHBondContact O-N 3.2Å; K407-S410 PolarHBondContact O-N 3.4Å; K407-N411 WeakPolarHBondContact O-CB 3.31Å; K407-N411 VanDerWaalsContact O-CG 3.25Å; K407-N411 PolarHBondContact O-N 3.03Å
408E80.3Confident76.6Confident114 Ų114112.2 Ų112.253%0.53357%0.568SS.*Hα-helixtrans-60.8-46.6174.8-172.6179.6-170.700111.4S404 K405 S410 N411 M412S404-E408 WeakPolarHBondContact O-CB 3.28Å; S404-E408 PolarHBondContact O-N 3.17Å; K405-E408 PolarHBondContact O-N 3.09Å; E408-S410 PolarHBondContact O-N 3.29Å; E408-N411 PolarHBondContact O-N 3.49Å; E408-M412 PolarHBondContact O-N 3.25Å
409K77.7Confident74.8Confident148 Ų148111.5 Ų111.564%0.64357%0.572SS**Hα-helixtrans-62.4-40.6175.1-169.4176.6-179.1178.50112.6K405 L406 M412 T413K405-K409 WeakPolarHBondContact O-CB 3.24Å; K405-K409 PolarHBondContact O-N 2.99Å; L406-K409 PolarHBondContact O-N 3.34Å; K409-M412 PolarHBondContact O-N 3.43Å; K409-T413 PolarHBondContact O-N 3.18Å; K409-T413 PolarHBondContact O-OG1 3.49Å; K409-T413 VanDerWaalsContact O-OG1 3.09Å
410S72.9Confident72.9Confident69 Ų69110.9 Ų110.948%0.48358%0.577SS.*Hα-helixtrans-66.5-35.7174.8-1750000112.6L406 K407 E408 T413 R414L406-S410 WeakPolarHBondContact O-CB 3.43Å; L406-S410 PolarHBondContact O-N 2.89Å; K407-S410 PolarHBondContact O-N 3.4Å; E408-S410 PolarHBondContact O-N 3.29Å; S410-T413 WeakPolarHBondContact CA-OG1 3.38Å; S410-T413 PolarHBondContact O-OG1 2.97Å; S410-R414 VanDerWaalsContact O-CB 3.32Å; S410-R414 WeakPolarHBondContact O-CB 3.42Å; S410-R414 PolarHBondContact O-N 2.74Å
411N72.7Confident70.4Confident93 Ų93114.5 Ų114.550%0.49759%0.592SS.*Hα-helixtrans-71.2-37.1174.9-75.2-11.3000111K407 E408 R414 N415K407-N411 WeakPolarHBondContact O-CB 3.31Å; K407-N411 VanDerWaalsContact O-CG 3.25Å; K407-N411 PolarHBondContact O-N 3.03Å; E408-N411 PolarHBondContact O-N 3.49Å; N411-R414 PolarHBondContact O-N 3.37Å; N411-N415 WeakPolarHBondContact O-CB 3.44Å; N411-N415 VanDerWaalsContact O-CG 3.31Å; N411-N415 PolarHBondContact O-N 3.07Å
412M70.2Confident68.4Low124 Ų124115.3 Ų115.361%0.61160%0.603SS**Hα-helixtrans-60-46.3171-82.2-171.5174.400111.9E408 K409 N415 M416E408-M412 PolarHBondContact O-N 3.25Å; K409-M412 PolarHBondContact O-N 3.43Å; M412-N415 PolarHBondContact O-N 3.08Å; M412-M416 WeakPolarHBondContact O-CG 3.48Å; M412-M416 PolarHBondContact O-N 2.88Å
413T66.1Low65.9Low78 Ų78119.5 Ų119.548%0.47962%0.62SS.*Hα-helixtrans-68-34.1176.540.20000112.8K409 S410 M416 H417K409-T413 PolarHBondContact O-N 3.18Å; K409-T413 PolarHBondContact O-OG1 3.49Å; K409-T413 VanDerWaalsContact O-OG1 3.09Å; S410-T413 WeakPolarHBondContact CA-OG1 3.38Å; S410-T413 PolarHBondContact O-OG1 2.97Å; T413-M416 PolarHBondContact O-N 3.16Å; T413-H417 PolarHBondContact O-N 3.46Å; T413-H417 VanDerWaalsContact O-N 3.1Å
414R63.7Low63.9Low192 Ų192121.2 Ų121.273%0.72564%0.639SS**Hα-helixtrans-68.3-40.4174.2-168.8176.8173.3120.7-0.3112.2S410 N411 M416 H417 A418S410-R414 VanDerWaalsContact O-CB 3.32Å; S410-R414 WeakPolarHBondContact O-CB 3.42Å; S410-R414 PolarHBondContact O-N 2.74Å; N411-R414 PolarHBondContact O-N 3.37Å; R414-M416 VanDerWaalsContact C-N 3.34Å; R414-H417 PolarHBondContact O-N 3.46Å; R414-A418 PolarHBondContact O-N 3.32Å
415N60.2Low61.8Low114 Ų114121.8 Ų121.861%0.6165%0.648SS**Hα-helixtrans-64.8-37.4174.2-77-13.2000111.8N411 M412 H417 A418 T419N411-N415 WeakPolarHBondContact O-CB 3.44Å; N411-N415 VanDerWaalsContact O-CG 3.31Å; N411-N415 PolarHBondContact O-N 3.07Å; M412-N415 PolarHBondContact O-N 3.08Å; N415-H417 VanDerWaalsContact C-N 3.33Å; N415-H417 PolarHBondContact O-N 3.17Å; N415-A418 PolarHBondContact O-N 3.03Å; N415-T419 PolarHBondContact O-N 3.32Å; N415-T419 PolarHBondContact O-OG1 3.25Å
416M57.9Low59.9Low137 Ų137122.5 Ų122.568%0.67566%0.663SS**Hα-helixtrans-63.1-34.5172-77.2-78.7-64.500113.2M412 T413 R414 T419M412-M416 WeakPolarHBondContact O-CG 3.48Å; M412-M416 PolarHBondContact O-N 2.88Å; T413-M416 PolarHBondContact O-N 3.16Å; R414-M416 VanDerWaalsContact C-N 3.34Å; M416-T419 PolarHBondContact O-OG1 2.95Å
417H56.3Low57.7Low152 Ų152120.9 Ų120.970%0.70467%0.673SS**Hα-helixtrans-79.1-26.9175.7-91.5-69.9000113.7T413 R414 N415 T419 V420T413-H417 PolarHBondContact O-N 3.46Å; T413-H417 VanDerWaalsContact O-N 3.1Å; R414-H417 PolarHBondContact O-N 3.46Å; N415-H417 VanDerWaalsContact C-N 3.33Å; N415-H417 PolarHBondContact O-N 3.17Å; H417-T419 VanDerWaalsContact C-N 3.28Å; H417-T419 PolarHBondContact O-N 3.28Å; H417-V420 PolarHBondContact O-N 2.77Å
418A55.6Low55.9Low81 Ų81124.7 Ų124.767%0.66969%0.689SS**Hα-helixtrans-71-21.7175.400000113.2R414 N415 V420R414-A418 PolarHBondContact O-N 3.32Å; N415-A418 PolarHBondContact O-N 3.03Å; A418-V420 VanDerWaalsContact C-N 3.28Å; A418-V420 PolarHBondContact O-N 2.75Å
419T52.6Low54.1Low112 Ų112133.3 Ų133.369%0.68772%0.719SS**THydrogen-bonded Turntrans-78.7-0.6174.932.70000114.9N415 M416 H417N415-T419 PolarHBondContact O-N 3.32Å; N415-T419 PolarHBondContact O-OG1 3.25Å; M416-T419 PolarHBondContact O-OG1 2.95Å; H417-T419 VanDerWaalsContact C-N 3.28Å; H417-T419 PolarHBondContact O-N 3.28Å
420V50Low52.9Low108 Ų108132.6 Ų132.666%0.65572%0.723SS**  trans-128.265.6-173.7-169.30000111.5H417 A418H417-V420 PolarHBondContact O-N 2.77Å; A418-V420 VanDerWaalsContact C-N 3.28Å; A418-V420 PolarHBondContact O-N 2.75Å
421I39.1Very low51.8Low153 Ų153135.9 Ų135.979%0.78574%0.735SS**  trans-144.5129.6153-56.4-176.3000108.1
422P47.3Very low50.7Low120 Ų120138.3 Ų138.378%0.77975%0.749SS**  trans-89.3149.8-170.334.2-32.3000113.6
423E37.7Very low49.5Very low194 Ų194139.1 Ų139.191%0.90776%0.757SS**  trans-114.2147.4167.1-96.5-167.1158.300112.9
424P45.2Very low48.5Very low126 Ų126142.9 Ų142.982%0.81877%0.774SS**  trans-96.9179.7-165.539.4-32.6000114.5
425A42.5Very low47.5Very low83 Ų83139.7 Ų139.769%0.68678%0.777SS**  trans-69.9146-164.100000118.3
426T43.1Very low46.6Very low147 Ų147141.5 Ų141.590%0.90279%0.789SS**  trans63.3129.2141.351.50000122
427G38.8Very low45.7Very low73 Ų73141.8 Ų141.875%0.75380%0.798SS**  trans156.8117148.100000116.8
428F44.2Very low44.8Very low200 Ų200141 Ų14188%0.87781%0.806SS**  trans-28.3146.1167-70.8-98.4000116.8
429Y41.5Very low43.8Very low295 Ų295146.5 Ų146.5100%1.15782%0.819SS**  cis-141.5046.3-109.6-92.3000113.1

Retrieved 429 of 429 residues in 72.1 ms (Link to these results)