A0A087YDB7_POEFO Loading...

Basal body orientation factor 1

AlphaFold DB , UniProt , Accession A0A087YDB7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 465 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M34.7Very low39.1Very low232 Ų232161.1 Ų161.1100%1.14385%0.851SS**  0143.90-69.8-62.6-163.400108.3
2P45.3Very low38.7Very low112 Ų112158 Ų15873%0.72783%0.829SS**  cis-90.3168.7-38.237.5-28.7000110.1
3S43.6Very low38.4Very low103 Ų103162 Ų16272%0.7284%0.835SS**  cis79.584.916.382.70000117.6
4T43.2Very low38.3Very low143 Ų143166.7 Ų166.788%0.87784%0.837SS**  trans-124.5109.1164.240.30000111.5
5K43Very low38Very low202 Ų202161 Ų16188%0.87884%0.837SS**  trans-108.3124.4167.1-68.9174.4179.2171.60108.7
6T36.4Very low38Very low142 Ų142163.7 Ų163.787%0.87184%0.84SS**  trans-174.4151.715521.30000109.2
7S36.8Very low37.7Very low111 Ų111157.8 Ų157.878%0.77683%0.829SS**  cis-148.6169-3.755.40000110.5
8K38.7Very low37.6Very low206 Ų206160.4 Ų160.490%0.89683%0.833SS**  trans-87.6145.8173.3-62.5166.5-179.1167.80110.1
9S36.1Very low37.5Very low124 Ų124161.5 Ų161.587%0.86783%0.83SS**  trans-127147.2146.367.70000109.6
10K35.9Very low37.1Very low195 Ų195158.7 Ų158.785%0.84883%0.825SS**  trans-160.4157.1-177.1-177.4173.6-179.8175.30107.5
11R36.2Very low36.9Very low202 Ų202156.7 Ų156.776%0.76283%0.825SS**  trans72.2148.5172.8-94-176.7148.5-174.1-23.2114.2
12E33.9Very low36.9Very low124 Ų124153.5 Ų153.558%0.57981%0.805SS**  cis-162.8150.8-9.1-155.4159.2-143.500110.4
13K35.9Very low36.7Very low210 Ų210156.2 Ų156.291%0.91381%0.808SS**  -172.4144.9122-103.2162-174.9175.80113.1
14R35.8Very low36.2Very low228 Ų228158.2 Ų158.286%0.8681%0.805SS**  trans-92.6140.8169.7-72.7168.2156.3178.6-5.3109.6
15G33.9Very low36.3Very low81 Ų81156.7 Ų156.784%0.83580%0.798SS**  trans-108.4140.2152.300000109.5
16K39.3Very low36.1Very low204 Ų204156.6 Ų156.689%0.88780%0.798SS**  trans-152.3104.4-175.5-171.3-179.5-178.9-179.30113.9
17G32.7Very low36.2Very low64 Ų64155.8 Ų155.866%0.6679%0.793SS**  trans-140.3138.5159.100000108.4
18K36.1Very low36.4Very low204 Ų204159.5 Ų159.589%0.88780%0.798SS**  62125.455.8-76.5-172.8175.3179.60112
19K35.3Very low37Very low182 Ų182158.9 Ų158.979%0.79180%0.795SS**  cis-163.5153.3-4.1-151-172.5-179.3-166.50110.8
20S29.4Very low37.7Very low104 Ų104161.5 Ų161.573%0.72779%0.794SS**  trans48.5110.2149.655.70000121.8
21S31.7Very low38.5Very low118 Ų118155.9 Ų155.983%0.82578%0.777SS**  -155.9102.7128.9-165.80000107.4
22K35.8Very low39.9Very low164 Ų164151.9 Ų151.971%0.71377%0.771SS**  76.612096.1-162.2-165.8173.9-139.70112.6E24K22-E24 IonicContact NZ-OE1 2.6Å; K22-E24 PolarHBondContact NZ-OE1 2.99Å
23H40.6Very low41.8Very low170 Ų170151.8 Ų151.879%0.78777%0.774SS**  trans-74.2134.5179.4-151.9-71000110.5
24E32.9Very low43.7Very low144 Ų144148.7 Ų148.767%0.67376%0.763SS**  trans-147.9122.4161.3-114.8161-123.600108K22 K26K22-E24 IonicContact NZ-OE1 2.6Å; K22-E24 PolarHBondContact NZ-OE1 2.99Å; E24-K26 PolarHBondContact O-N 3.32Å
25P46.8Very low45.8Very low111 Ų111141 Ų14172%0.72174%0.741SS**  trans-75.4111.9-178.930.5-31.7000108.8T27P25-T27 PolarHBondContact O-N 3.34Å; P25-T27 VanDerWaalsContact O-N 3.07Å
26K37.4Very low48Very low200 Ų200138.9 Ų138.987%0.8772%0.716SS**  trans-71.7106166.7-80.5-168.8173.6-176.10108.1E24 E28E24-K26 PolarHBondContact O-N 3.32Å; K26-E28 PolarHBondContact O-N 2.73Å
27T37.9Very low50.2Low126 Ų126137.5 Ų137.577%0.77371%0.705SS**  trans-34.8122.5167.435.10000111.1P25 K29P25-T27 PolarHBondContact O-N 3.34Å; P25-T27 VanDerWaalsContact O-N 3.07Å; T27-K29 PolarHBondContact O-N 3.22Å
28E41.3Very low52.6Low189 Ų189137.4 Ų137.488%0.88370%0.698SS**  trans-61.3102.2165.6-67.3173.813000107K26 E30K26-E28 PolarHBondContact O-N 2.73Å; E28-E30 VanDerWaalsContact C-N 3.33Å; E28-E30 PolarHBondContact O-N 2.99Å; E28-E30 VanDerWaalsContact O-N 3.1Å
29K52.8Low55.1Low192 Ų192132 Ų13284%0.83568%0.679SS**  trans-64.6107.8153.9-74.8-168.8175.5-171.90104.7T27 P31T27-K29 PolarHBondContact O-N 3.22Å; K29-P31 VanDerWaalsContact O-N 3.14Å
30E50.3Low57.7Low179 Ų179125.6 Ų125.684%0.83666%0.66SS**  trans-41.7119176.5-170.2168.8-146.200108.6E28 D32E28-E30 VanDerWaalsContact C-N 3.33Å; E28-E30 PolarHBondContact O-N 2.99Å; E28-E30 VanDerWaalsContact O-N 3.1Å; E30-D32 PolarHBondContact O-N 3.02Å
31P52.8Low60.6Low78 Ų78123.2 Ų123.251%0.50665%0.646SS.*  trans-67.4115.2-170.925.9-32.9000108.1K29 L33 A36K29-P31 VanDerWaalsContact O-N 3.14Å; P31-L33 PolarHBondContact O-N 3.46Å; P31-A36 HydrophobicContact CB-CB 4.33Å; P31-A36 HydrophobicContact CG-CB 4.31Å
32D65Low63.5Low117 Ų117121.5 Ų121.563%0.62663%0.627SS**  trans-42.5127177.1-170.2-7.3000109.2E30 E34 T35 A36E30-D32 PolarHBondContact O-N 3.02Å; D32-E34 PolarHBondContact O-N 3.39Å; D32-T35 HydrophobicContact CB-CG2 4.18Å; D32-T35 PolarHBondContact N-OG1 3.06Å; D32-T35 WeakPolarHBondContact O-CA 3.45Å; D32-T35 WeakPolarHBondContact O-CB 3.5Å; D32-T35 PolarHBondContact O-N 3.35Å; D32-T35 PolarHBondContact O-OG1 3.14Å; D32-A36 PolarHBondContact O-N 3.35Å; D32-A36 VanDerWaalsContact O-N 3.11Å
33L73.9Confident66.2Low122 Ų122121.5 Ų121.564%0.63962%0.623SS**Hα-helixtrans-58.7-28.5-156.7-78.7168.3000112.7P31 R37P31-L33 PolarHBondContact O-N 3.46Å; L33-R37 WeakPolarHBondContact O-CB 3.37Å; L33-R37 WeakPolarHBondContact O-CD 3.29Å; L33-R37 WeakPolarHBondContact O-CG 3.41Å; L33-R37 PolarHBondContact O-N 3Å
34E75.1Confident68.8Low146 Ų146118.3 Ų118.368%0.68261%0.609SS**Hα-helixtrans-69.7-37.4173.3-57.7-163.5144.600112.9D32 R37 A38D32-E34 PolarHBondContact O-N 3.39Å; E34-R37 PolarHBondContact O-N 3Å; E34-A38 VanDerWaalsContact O-CB 3.23Å; E34-A38 WeakPolarHBondContact O-CB 3.24Å; E34-A38 PolarHBondContact O-N 2.77Å
35T80Confident71.7Confident66 Ų66116.5 Ų116.541%0.40560%0.603SS.*Hα-helixtrans-68.7-36.2173.372.10000112D32 N39D32-T35 HydrophobicContact CB-CG2 4.18Å; D32-T35 PolarHBondContact N-OG1 3.06Å; D32-T35 WeakPolarHBondContact O-CA 3.45Å; D32-T35 WeakPolarHBondContact O-CB 3.5Å; D32-T35 PolarHBondContact O-N 3.35Å; D32-T35 PolarHBondContact O-OG1 3.14Å; T35-N39 WeakPolarHBondContact O-CB 3.19Å; T35-N39 PolarHBondContact O-N 3.26Å; T35-N39 PolarHBondContact O-ND2 3.23Å
36A81.9Confident74Confident37 Ų37116 Ų11631%0.30659%0.589SS.*Hα-helixtrans-64.3-47.6172.700000110.8P31 D32 N39 A40P31-A36 HydrophobicContact CB-CB 4.33Å; P31-A36 HydrophobicContact CG-CB 4.31Å; D32-A36 PolarHBondContact O-N 3.35Å; D32-A36 VanDerWaalsContact O-N 3.11Å; A36-N39 PolarHBondContact O-N 2.98Å; A36-A40 WeakPolarHBondContact O-CB 3.5Å; A36-A40 PolarHBondContact O-N 2.86Å
37R83.8Confident76.7Confident174 Ų174110.8 Ų110.866%0.65757%0.57SS**Hα-helixtrans-62.1-43.9175.9-73.9168.1179177.60.3113L33 E34 A40 A41L33-R37 WeakPolarHBondContact O-CB 3.37Å; L33-R37 WeakPolarHBondContact O-CD 3.29Å; L33-R37 WeakPolarHBondContact O-CG 3.41Å; L33-R37 PolarHBondContact O-N 3Å; E34-R37 PolarHBondContact O-N 3Å; R37-A40 PolarHBondContact O-N 3.38Å; R37-A41 WeakPolarHBondContact O-CB 3.35Å; R37-A41 PolarHBondContact O-N 3.33Å
38A84.5Confident79.4Confident62 Ų62110.2 Ų110.251%0.51256%0.557SS.*Hα-helixtrans-64.8-40.817900000111.9E34 L42E34-A38 VanDerWaalsContact O-CB 3.23Å; E34-A38 WeakPolarHBondContact O-CB 3.24Å; E34-A38 PolarHBondContact O-N 2.77Å; A38-L42 WeakPolarHBondContact O-CB 3.32Å; A38-L42 PolarHBondContact O-N 3.2Å
39N87.4Confident81.9Confident90 Ų90105.6 Ų105.648%0.48154%0.538SS..Hα-helixtrans-65.6-42173-77.3-56000111.8T35 A36 L42 W43T35-N39 WeakPolarHBondContact O-CB 3.19Å; T35-N39 PolarHBondContact O-N 3.26Å; T35-N39 PolarHBondContact O-ND2 3.23Å; A36-N39 PolarHBondContact O-N 2.98Å; N39-L42 PolarHBondContact O-N 3.01Å; N39-W43 PolarHBondContact O-N 3.31Å
40A89.8Confident83.9Confident48 Ų4899.6 Ų99.640%0.39752%0.518SS..Hα-helixtrans-60.3-48.8175.400000111.9A36 R37 L42 W43 E44A36-A40 WeakPolarHBondContact O-CB 3.5Å; A36-A40 PolarHBondContact O-N 2.86Å; R37-A40 PolarHBondContact O-N 3.38Å; A40-L42 VanDerWaalsContact C-N 3.29Å; A40-L42 PolarHBondContact O-N 2.9Å; A40-W43 CarbonylContact O-C 3.56Å; A40-W43 PolarHBondContact O-N 3.03Å; A40-W43 VanDerWaalsContact O-N 3.08Å; A40-E44 PolarHBondContact O-N 2.83Å
41A90.3Very high86Confident54 Ų5496 Ų9645%0.44650%0.501SS..Hα-helixtrans-60.8-35.5176.500000112.8R37 E44 L45R37-A41 WeakPolarHBondContact O-CB 3.35Å; R37-A41 PolarHBondContact O-N 3.33Å; A41-E44 PolarHBondContact O-N 3.04Å; A41-L45 WeakPolarHBondContact O-CB 3.27Å; A41-L45 PolarHBondContact O-N 3.18Å
42L92.6Very high88Confident82 Ų8297.2 Ų97.243%0.42950%0.5SS..Hα-helixtrans-69.5-34.6174.6-176.2149.5000112.3A38 N39 A40 K46A38-L42 WeakPolarHBondContact O-CB 3.32Å; A38-L42 PolarHBondContact O-N 3.2Å; N39-L42 PolarHBondContact O-N 3.01Å; A40-L42 VanDerWaalsContact C-N 3.29Å; A40-L42 PolarHBondContact O-N 2.9Å; L42-K46 HydrophobicContact CD2-CD 3.99Å; L42-K46 WeakPolarHBondContact O-CG 3.06Å; L42-K46 PolarHBondContact O-N 2.93Å; L42-K46 VanDerWaalsContact O-N 3.13Å
43W94.1Very high89.4Confident165 Ų16595.4 Ų95.463%0.62549%0.49SS*.Hα-helixtrans-72.5-39.3171.9-73.8118.2000112.5N39 A40 K46 L47N39-W43 PolarHBondContact O-N 3.31Å; A40-W43 CarbonylContact O-C 3.56Å; A40-W43 PolarHBondContact O-N 3.03Å; A40-W43 VanDerWaalsContact O-N 3.08Å; W43-K46 HydrophobicContact CE3-CD 3.81Å; W43-K46 HydrophobicContact CZ3-CD 3.9Å; W43-K46 PolarHBondContact O-N 2.83Å; W43-L47 WeakPolarHBondContact O-CB 3.42Å; W43-L47 PolarHBondContact O-N 2.83Å
44E93.6Very high90.4Very high103 Ų10394 Ų9448%0.48148%0.482SS..Hα-helixtrans-60.4-43171.2-78.2-172.9-145.200112.3A40 A41 L47 K48A40-E44 PolarHBondContact O-N 2.83Å; A41-E44 PolarHBondContact O-N 3.04Å; E44-L47 PolarHBondContact O-N 2.92Å; E44-K48 WeakPolarHBondContact O-CB 3.49Å; E44-K48 WeakPolarHBondContact O-CD 3.45Å; E44-K48 VanDerWaalsContact O-CG 3.27Å; E44-K48 WeakPolarHBondContact O-CG 3.25Å; E44-K48 PolarHBondContact O-N 3.32Å; E44-K48 IonicContact OE2-NZ 3.02Å; E44-K48 PolarHBondContact OE2-NZ 3.13Å
45L94.2Very high91.4Very high105 Ų10590.1 Ų90.155%0.5547%0.471SS..Hα-helixtrans-64.5-43.1178.1-179.161.4000111.1A41 K48 I49A41-L45 WeakPolarHBondContact O-CB 3.27Å; A41-L45 PolarHBondContact O-N 3.18Å; L45-K48 PolarHBondContact O-N 2.97Å; L45-I49 HydrophobicContact CD1-CD1 4.31Å; L45-I49 HydrophobicContact CG-CD1 4.11Å; L45-I49 WeakPolarHBondContact O-CD1 3.49Å; L45-I49 VanDerWaalsContact O-CG1 3.27Å; L45-I49 WeakPolarHBondContact O-CG1 3.43Å; L45-I49 PolarHBondContact O-N 3.11Å
46K94.6Very high92.1Very high101 Ų10191.1 Ų91.144%0.43947%0.474SS..Hα-helixtrans-61-43.8172.8-77.4173.9177.4174.20112.2L42 W43 I49 T50L42-K46 HydrophobicContact CD2-CD 3.99Å; L42-K46 WeakPolarHBondContact O-CG 3.06Å; L42-K46 PolarHBondContact O-N 2.93Å; L42-K46 VanDerWaalsContact O-N 3.13Å; W43-K46 HydrophobicContact CE3-CD 3.81Å; W43-K46 HydrophobicContact CZ3-CD 3.9Å; W43-K46 PolarHBondContact O-N 2.83Å; K46-I49 PolarHBondContact O-N 3.16Å; K46-T50 PolarHBondContact O-N 2.67Å; K46-T50 PolarHBondContact O-OG1 2.69Å
47L94.6Very high92.7Very high90 Ų9097.8 Ų97.847%0.47149%0.493SS..Hα-helixtrans-59-52.7177.7179.861.3000110.1W43 E44 I49 T50 E51W43-L47 WeakPolarHBondContact O-CB 3.42Å; W43-L47 PolarHBondContact O-N 2.83Å; E44-L47 PolarHBondContact O-N 2.92Å; L47-I49 VanDerWaalsContact C-N 3.3Å; L47-I49 PolarHBondContact O-N 2.88Å; L47-T50 WeakPolarHBondContact CA-OG1 3.26Å; L47-T50 CarbonylContact O-C 3.55Å; L47-T50 PolarHBondContact O-N 2.82Å; L47-T50 PolarHBondContact O-OG1 3.26Å; L47-E51 HydrophobicContact CD1-CG 4.08Å; L47-E51 HydrophobicContact CG-CG 4.26Å; L47-E51 WeakPolarHBondContact O-CB 3.27Å; L47-E51 WeakPolarHBondContact O-CG 3.43Å; L47-E51 PolarHBondContact O-N 3.34Å
48K95.6Very high93.3Very high114 Ų11498.2 Ų98.250%0.49649%0.494SS..Hα-helixtrans-56.2-40.4177.4-72.2160.5-175.4158.20112.7E44 L45 E51 Q52E44-K48 WeakPolarHBondContact O-CB 3.49Å; E44-K48 WeakPolarHBondContact O-CD 3.45Å; E44-K48 VanDerWaalsContact O-CG 3.27Å; E44-K48 WeakPolarHBondContact O-CG 3.25Å; E44-K48 PolarHBondContact O-N 3.32Å; E44-K48 IonicContact OE2-NZ 3.02Å; E44-K48 PolarHBondContact OE2-NZ 3.13Å; L45-K48 PolarHBondContact O-N 2.97Å; K48-E51 PolarHBondContact O-N 3.15Å; K48-Q52 WeakPolarHBondContact O-CB 3.46Å; K48-Q52 PolarHBondContact O-N 3.43Å
49I93.9Very high93.9Very high92 Ų9296.8 Ų96.847%0.47249%0.485SS..Hα-helixtrans-63.8-49.6173.6-68.4163.7000110.5L45 K46 L47 E51 Q52 D53L45-I49 HydrophobicContact CD1-CD1 4.31Å; L45-I49 HydrophobicContact CG-CD1 4.11Å; L45-I49 WeakPolarHBondContact O-CD1 3.49Å; L45-I49 VanDerWaalsContact O-CG1 3.27Å; L45-I49 WeakPolarHBondContact O-CG1 3.43Å; L45-I49 PolarHBondContact O-N 3.11Å; K46-I49 PolarHBondContact O-N 3.16Å; L47-I49 VanDerWaalsContact C-N 3.3Å; L47-I49 PolarHBondContact O-N 2.88Å; I49-E51 VanDerWaalsContact C-N 3.29Å; I49-E51 PolarHBondContact O-N 3.38Å; I49-Q52 WeakPolarHBondContact O-CB 3.31Å; I49-Q52 PolarHBondContact O-N 3.42Å; I49-D53 PolarHBondContact O-N 3.46Å
50T93Very high94.2Very high67 Ų6795 Ų9541%0.41148%0.483SS..Hα-helixtrans-67.4-27.5178.954.90000113.8K46 L47 L54K46-T50 PolarHBondContact O-N 2.67Å; K46-T50 PolarHBondContact O-OG1 2.69Å; L47-T50 WeakPolarHBondContact CA-OG1 3.26Å; L47-T50 CarbonylContact O-C 3.55Å; L47-T50 PolarHBondContact O-N 2.82Å; L47-T50 PolarHBondContact O-OG1 3.26Å; T50-L54 VanDerWaalsContact O-CB 3.27Å; T50-L54 WeakPolarHBondContact O-CB 3.48Å; T50-L54 WeakPolarHBondContact O-CD1 3.39Å; T50-L54 WeakPolarHBondContact O-CG 3.14Å; T50-L54 PolarHBondContact O-N 2.99Å
51E94.8Very high94.4Very high104 Ų10499 Ų9949%0.48649%0.493SS..Hα-helixtrans-71.4-39.7172.9-73.7173.1151.700111.2L47 K48 I49 S55L47-E51 HydrophobicContact CD1-CG 4.08Å; L47-E51 HydrophobicContact CG-CG 4.26Å; L47-E51 WeakPolarHBondContact O-CB 3.27Å; L47-E51 WeakPolarHBondContact O-CG 3.43Å; L47-E51 PolarHBondContact O-N 3.34Å; K48-E51 PolarHBondContact O-N 3.15Å; I49-E51 VanDerWaalsContact C-N 3.29Å; I49-E51 PolarHBondContact O-N 3.38Å; E51-S55 WeakPolarHBondContact O-CB 3.46Å; E51-S55 PolarHBondContact O-N 3.01Å
52Q95.4Very high94.7Very high103 Ų103102.8 Ų102.848%0.48150%0.502SS..Hα-helixtrans-63.9-51171.7-175.660.747.200111K48 I49 L54 S55 D56K48-Q52 WeakPolarHBondContact O-CB 3.46Å; K48-Q52 PolarHBondContact O-N 3.43Å; I49-Q52 WeakPolarHBondContact O-CB 3.31Å; I49-Q52 PolarHBondContact O-N 3.42Å; Q52-L54 VanDerWaalsContact C-N 3.3Å; Q52-L54 PolarHBondContact O-N 3.44Å; Q52-S55 WeakPolarHBondContact O-CA 3.42Å; Q52-S55 WeakPolarHBondContact O-CB 3.35Å; Q52-S55 PolarHBondContact O-N 3.32Å; Q52-D56 PolarHBondContact NE2-OD1 3.1Å; Q52-D56 PolarHBondContact NE2-OD2 3.14Å; Q52-D56 PolarHBondContact O-N 3.45Å
53D93.4Very high94.9Very high78 Ų78104.1 Ų104.142%0.41751%0.509SS..Hα-helixtrans-52.9-48.1175.2-67.9-29.4000110.9I49 S55 D56 Y57I49-D53 PolarHBondContact O-N 3.46Å; D53-S55 VanDerWaalsContact C-N 3.33Å; D53-S55 PolarHBondContact O-N 3.09Å; D53-D56 PolarHBondContact O-N 3.35Å; D53-Y57 HydrophobicContact CB-CD2 4.49Å; D53-Y57 HydrophobicContact CB-CE2 4.44Å; D53-Y57 WeakPolarHBondContact O-CB 3.4Å; D53-Y57 WeakPolarHBondContact O-CD2 3.4Å; D53-Y57 PolarHBondContact O-N 2.95Å
54L96.1Very high94.9Very high93 Ų93101.6 Ų101.649%0.48751%0.506SS..Hα-helixtrans-65.6-33177.9-76.5170.4000113.1T50 Q52 R58T50-L54 VanDerWaalsContact O-CB 3.27Å; T50-L54 WeakPolarHBondContact O-CB 3.48Å; T50-L54 WeakPolarHBondContact O-CD1 3.39Å; T50-L54 WeakPolarHBondContact O-CG 3.14Å; T50-L54 PolarHBondContact O-N 2.99Å; Q52-L54 VanDerWaalsContact C-N 3.3Å; Q52-L54 PolarHBondContact O-N 3.44Å; L54-R58 WeakPolarHBondContact O-CB 3.24Å; L54-R58 WeakPolarHBondContact O-CD 3.29Å; L54-R58 WeakPolarHBondContact O-CG 3.28Å; L54-R58 PolarHBondContact O-N 2.93Å; L54-R58 VanDerWaalsContact O-N 3.11Å
55S95.6Very high95Very high64 Ų6499.9 Ų99.945%0.44850%0.502SS..Hα-helixtrans-66.4-45.3172.8-174.60000110.9E51 Q52 D53 R58 G59E51-S55 WeakPolarHBondContact O-CB 3.46Å; E51-S55 PolarHBondContact O-N 3.01Å; Q52-S55 WeakPolarHBondContact O-CA 3.42Å; Q52-S55 WeakPolarHBondContact O-CB 3.35Å; Q52-S55 PolarHBondContact O-N 3.32Å; D53-S55 VanDerWaalsContact C-N 3.33Å; D53-S55 PolarHBondContact O-N 3.09Å; S55-R58 WeakPolarHBondContact O-CB 3.49Å; S55-R58 PolarHBondContact O-N 3.14Å; S55-G59 PolarHBondContact O-N 3.31Å
56D94.5Very high95.1Very high87 Ų8797 Ų9747%0.46549%0.491SS..Hα-helixtrans-70.7-38.1-178-65.7-28.1000111.7Q52 D53 R58 G59 A60Q52-D56 PolarHBondContact NE2-OD1 3.1Å; Q52-D56 PolarHBondContact NE2-OD2 3.14Å; Q52-D56 PolarHBondContact O-N 3.45Å; D53-D56 PolarHBondContact O-N 3.35Å; D56-R58 VanDerWaalsContact C-N 3.34Å; D56-R58 PolarHBondContact O-N 3.24Å; D56-G59 PolarHBondContact O-N 3.15Å; D56-A60 WeakPolarHBondContact O-CB 3.46Å; D56-A60 PolarHBondContact O-N 3.07Å
57Y94.7Very high95.1Very high177 Ų17796.9 Ų96.969%0.69449%0.493SS*.Hα-helixtrans-61.9-38.5169.2-78.4-59000112.6D53 H61D53-Y57 HydrophobicContact CB-CD2 4.49Å; D53-Y57 HydrophobicContact CB-CE2 4.44Å; D53-Y57 WeakPolarHBondContact O-CB 3.4Å; D53-Y57 WeakPolarHBondContact O-CD2 3.4Å; D53-Y57 PolarHBondContact O-N 2.95Å; Y57-H61 WeakPolarHBondContact O-CB 3.38Å; Y57-H61 PolarHBondContact O-N 2.94Å
58R96.3Very high95.1Very high184 Ų18496.8 Ų96.869%0.69449%0.493SS*.Hα-helixtrans-67.4-42.3174.7-75.2166.6-177-176.82.9111.6L54 S55 D56 H61 H62L54-R58 WeakPolarHBondContact O-CB 3.24Å; L54-R58 WeakPolarHBondContact O-CD 3.29Å; L54-R58 WeakPolarHBondContact O-CG 3.28Å; L54-R58 PolarHBondContact O-N 2.93Å; L54-R58 VanDerWaalsContact O-N 3.11Å; S55-R58 WeakPolarHBondContact O-CB 3.49Å; S55-R58 PolarHBondContact O-N 3.14Å; D56-R58 VanDerWaalsContact C-N 3.34Å; D56-R58 PolarHBondContact O-N 3.24Å; R58-H61 PolarHBondContact O-N 3.47Å; R58-H62 WeakPolarHBondContact O-CB 3.46Å; R58-H62 PolarHBondContact O-N 3.1Å
59G96.5Very high95.2Very high31 Ų3197 Ų9732%0.3250%0.496SS..Hα-helixtrans-60.9-49.4175.200000111.9S55 D56 H61 H62 N63S55-G59 PolarHBondContact O-N 3.31Å; D56-G59 PolarHBondContact O-N 3.15Å; G59-H61 PolarHBondContact O-N 3.48Å; G59-H62 PolarHBondContact O-N 3Å; G59-N63 WeakPolarHBondContact O-CB 3.37Å; G59-N63 PolarHBondContact O-N 3.23Å; G59-N63 PolarHBondContact O-ND2 3.38Å
60A94.5Very high95.3Very high53 Ų5397.3 Ų97.344%0.43850%0.495SS..Hα-helixtrans-58.7-44.3175.200000112.2D56 N63 M64D56-A60 WeakPolarHBondContact O-CB 3.46Å; D56-A60 PolarHBondContact O-N 3.07Å; A60-N63 PolarHBondContact O-N 2.82Å; A60-M64 WeakPolarHBondContact O-CB 3.46Å; A60-M64 WeakPolarHBondContact O-CG 3.49Å; A60-M64 PolarHBondContact O-N 2.73Å
61H94.2Very high95.4Very high132 Ų13297.9 Ų97.961%0.61150%0.495SS*.Hα-helixtrans-63.7-43176.2-173.6-72.3000112.2Y57 R58 G59 M64 V65Y57-H61 WeakPolarHBondContact O-CB 3.38Å; Y57-H61 PolarHBondContact O-N 2.94Å; R58-H61 PolarHBondContact O-N 3.47Å; G59-H61 PolarHBondContact O-N 3.48Å; H61-M64 PolarHBondContact O-N 3.41Å; H61-V65 WeakPolarHBondContact O-CG2 3.4Å; H61-V65 PolarHBondContact O-N 2.87Å
62H96.8Very high95.4Very high134 Ų13497.3 Ų97.362%0.6250%0.499SS*.Hα-helixtrans-65.2-42.1178.2-17260000111.9R58 G59 M64 V65 S66R58-H62 WeakPolarHBondContact O-CB 3.46Å; R58-H62 PolarHBondContact O-N 3.1Å; G59-H62 PolarHBondContact O-N 3Å; H62-M64 PolarHBondContact O-N 3.01Å; H62-V65 PolarHBondContact O-N 2.96Å; H62-S66 WeakPolarHBondContact O-CB 3.38Å; H62-S66 PolarHBondContact O-N 3.21Å
63N96.3Very high95.5Very high109 Ų10996.1 Ų96.158%0.58350%0.496SS*.Hα-helixtrans-61.4-42174.3-68.7-13.6000111.8G59 A60 S66 M67G59-N63 WeakPolarHBondContact O-CB 3.37Å; G59-N63 PolarHBondContact O-N 3.23Å; G59-N63 PolarHBondContact O-ND2 3.38Å; A60-N63 PolarHBondContact O-N 2.82Å; N63-S66 PolarHBondContact O-N 3.49Å; N63-M67 WeakPolarHBondContact O-CB 3.43Å; N63-M67 PolarHBondContact O-N 3.43Å
64M94.2Very high95.6Very high112 Ų11298.2 Ų98.255%0.55250%0.503SS*.Hα-helixtrans-65.5-38.5175.4-75.7-58.5-54.600112.9A60 H61 H62 N68A60-M64 WeakPolarHBondContact O-CB 3.46Å; A60-M64 WeakPolarHBondContact O-CG 3.49Å; A60-M64 PolarHBondContact O-N 2.73Å; H61-M64 PolarHBondContact O-N 3.41Å; H62-M64 PolarHBondContact O-N 3.01Å; M64-N68 WeakPolarHBondContact O-CB 3.28Å; M64-N68 PolarHBondContact O-N 3.4Å; M64-N68 PolarHBondContact O-ND2 2.95Å
65V95.9Very high95.5Very high68 Ų6898.9 Ų98.941%0.41251%0.507SS..Hα-helixtrans-64.3-47.6173.7170.10000110.8H61 H62 M67 N68 E69H61-V65 WeakPolarHBondContact O-CG2 3.4Å; H61-V65 PolarHBondContact O-N 2.87Å; H62-V65 PolarHBondContact O-N 2.96Å; V65-M67 VanDerWaalsContact C-N 3.35Å; V65-M67 PolarHBondContact O-N 3.01Å; V65-N68 PolarHBondContact O-N 3.26Å; V65-E69 WeakPolarHBondContact O-CB 3.46Å; V65-E69 PolarHBondContact O-N 3.45Å
66S96.1Very high95.6Very high45 Ų45101.9 Ų101.932%0.31551%0.512SS..Hα-helixtrans-61.2-40.3177.4-177.80000112.5H62 N63 E69 Q70H62-S66 WeakPolarHBondContact O-CB 3.38Å; H62-S66 PolarHBondContact O-N 3.21Å; N63-S66 PolarHBondContact O-N 3.49Å; S66-E69 PolarHBondContact O-N 3.05Å; S66-Q70 WeakPolarHBondContact O-CB 3.48Å; S66-Q70 VanDerWaalsContact O-CG 3.23Å; S66-Q70 WeakPolarHBondContact O-CG 2.93Å; S66-Q70 PolarHBondContact O-N 3.41Å; S66-Q70 PolarHBondContact OG-NE2 3.37Å; S66-Q70 VanDerWaalsContact OG-NE2 3.14Å
67M95.8Very high95.6Very high97 Ų97106 Ų10648%0.47852%0.521SS..Hα-helixtrans-66.5-44175.7-173.862.371.200111.8N63 V65 E69 Q70 L71N63-M67 WeakPolarHBondContact O-CB 3.43Å; N63-M67 PolarHBondContact O-N 3.43Å; V65-M67 VanDerWaalsContact C-N 3.35Å; V65-M67 PolarHBondContact O-N 3.01Å; M67-E69 PolarHBondContact O-N 2.8Å; M67-Q70 PolarHBondContact O-N 2.9Å; M67-L71 HydrophobicContact CG-CD1 4.12Å; M67-L71 WeakPolarHBondContact O-CB 3.44Å; M67-L71 VanDerWaalsContact O-CG 3.3Å; M67-L71 WeakPolarHBondContact O-CG 3.4Å; M67-L71 PolarHBondContact O-N 3.07Å
68N94.3Very high95.6Very high88 Ų88101.7 Ų101.747%0.47152%0.515SS..Hα-helixtrans-61.8-43.1175.7-74.8-17.5000111.5M64 V65 L71 T72M64-N68 WeakPolarHBondContact O-CB 3.28Å; M64-N68 PolarHBondContact O-N 3.4Å; M64-N68 PolarHBondContact O-ND2 2.95Å; V65-N68 PolarHBondContact O-N 3.26Å; N68-L71 PolarHBondContact O-N 3.39Å; N68-T72 WeakPolarHBondContact O-CB 3.37Å; N68-T72 PolarHBondContact O-N 3.26Å; N68-T72 PolarHBondContact O-OG1 2.9Å
69E96.6Very high95.5Very high119 Ų11998.7 Ų98.756%0.55651%0.509SS*.Hα-helixtrans-62.9-42.2176-177.2173.1-171.900111.9V65 S66 M67 T72 N73V65-E69 WeakPolarHBondContact O-CB 3.46Å; V65-E69 PolarHBondContact O-N 3.45Å; S66-E69 PolarHBondContact O-N 3.05Å; M67-E69 PolarHBondContact O-N 2.8Å; E69-T72 PolarHBondContact O-N 3.25Å; E69-N73 WeakPolarHBondContact O-CB 3.29Å; E69-N73 PolarHBondContact O-N 3.38Å; E69-N73 PolarHBondContact O-ND2 2.71Å
70Q96.4Very high95.5Very high98 Ų98101.2 Ų101.246%0.45851%0.513SS..Hα-helixtrans-62.4-44.5174.4-73.7171.939.800111.9S66 M67 N73 Q74S66-Q70 WeakPolarHBondContact O-CB 3.48Å; S66-Q70 VanDerWaalsContact O-CG 3.23Å; S66-Q70 WeakPolarHBondContact O-CG 2.93Å; S66-Q70 PolarHBondContact O-N 3.41Å; S66-Q70 PolarHBondContact OG-NE2 3.37Å; S66-Q70 VanDerWaalsContact OG-NE2 3.14Å; M67-Q70 PolarHBondContact O-N 2.9Å; Q70-N73 PolarHBondContact O-N 3.11Å; Q70-Q74 WeakPolarHBondContact O-CG 3.17Å; Q70-Q74 PolarHBondContact O-N 3.19Å
71L95.7Very high95.5Very high80 Ų80103.9 Ų103.942%0.41952%0.52SS..Hα-helixtrans-64.3-42.9176.8-71.5169.9000112M67 N68 N73 Q74 L75M67-L71 HydrophobicContact CG-CD1 4.12Å; M67-L71 WeakPolarHBondContact O-CB 3.44Å; M67-L71 VanDerWaalsContact O-CG 3.3Å; M67-L71 WeakPolarHBondContact O-CG 3.4Å; M67-L71 PolarHBondContact O-N 3.07Å; N68-L71 PolarHBondContact O-N 3.39Å; L71-N73 PolarHBondContact O-N 3.47Å; L71-Q74 PolarHBondContact O-N 3.37Å; L71-L75 WeakPolarHBondContact O-CG 3.35Å; L71-L75 PolarHBondContact O-N 2.97Å
72T95Very high95.4Very high92 Ų92101.3 Ų101.356%0.56452%0.516SS*.Hα-helixtrans-61.1-43.1174.9-58.30000111.5N68 E69 Q74 L75 F76N68-T72 WeakPolarHBondContact O-CB 3.37Å; N68-T72 PolarHBondContact O-N 3.26Å; N68-T72 PolarHBondContact O-OG1 2.9Å; E69-T72 PolarHBondContact O-N 3.25Å; T72-Q74 VanDerWaalsContact C-N 3.35Å; T72-Q74 PolarHBondContact O-N 2.94Å; T72-L75 PolarHBondContact O-N 3.2Å; T72-F76 WeakPolarHBondContact O-CB 3.47Å; T72-F76 PolarHBondContact O-N 3.08Å
73N96.6Very high95.4Very high77 Ų7799.5 Ų99.541%0.41251%0.514SS..Hα-helixtrans-66.1-33.7175.6-81.7-70.9000113.1E69 Q70 L71 R77E69-N73 WeakPolarHBondContact O-CB 3.29Å; E69-N73 PolarHBondContact O-N 3.38Å; E69-N73 PolarHBondContact O-ND2 2.71Å; Q70-N73 PolarHBondContact O-N 3.11Å; L71-N73 PolarHBondContact O-N 3.47Å; N73-R77 WeakPolarHBondContact O-CB 3.43Å; N73-R77 VanDerWaalsContact O-CG 3.28Å; N73-R77 WeakPolarHBondContact O-CG 3.45Å; N73-R77 PolarHBondContact O-N 3.18Å
74Q95.8Very high95.3Very high123 Ų12398.4 Ų98.458%0.57551%0.508SS*.Hα-helixtrans-69.8-43.4174.2-74.617621.600111.9Q70 L71 T72 R77 C78Q70-Q74 WeakPolarHBondContact O-CG 3.17Å; Q70-Q74 PolarHBondContact O-N 3.19Å; L71-Q74 PolarHBondContact O-N 3.37Å; T72-Q74 VanDerWaalsContact C-N 3.35Å; T72-Q74 PolarHBondContact O-N 2.94Å; Q74-R77 PolarHBondContact O-N 3.5Å; Q74-C78 WeakPolarHBondContact O-CB 3.47Å; Q74-C78 PolarHBondContact O-N 2.97Å
75L94.7Very high95.3Very high107 Ų10798.1 Ų98.156%0.5651%0.507SS*.Hα-helixtrans-60-52.1175.4-72.4171000111L71 T72 R77 C78 E79L71-L75 WeakPolarHBondContact O-CG 3.35Å; L71-L75 PolarHBondContact O-N 2.97Å; T72-L75 PolarHBondContact O-N 3.2Å; L75-R77 VanDerWaalsContact C-N 3.3Å; L75-R77 PolarHBondContact O-N 3.35Å; L75-C78 WeakPolarHBondContact O-CA 3.24Å; L75-C78 WeakPolarHBondContact O-CB 3.27Å; L75-C78 PolarHBondContact O-N 3.29Å; L75-E79 WeakPolarHBondContact O-CG 3.45Å; L75-E79 PolarHBondContact O-N 3.44Å
76F95.9Very high95.2Very high126 Ų12698.7 Ų98.755%0.55351%0.511SS*.Hα-helixtrans-57.1-40.8179.1178.9-104.6000112.9T72 Q80T72-F76 WeakPolarHBondContact O-CB 3.47Å; T72-F76 PolarHBondContact O-N 3.08Å; F76-Q80 WeakPolarHBondContact O-CB 3.23Å; F76-Q80 PolarHBondContact O-N 3.49Å
77R96.3Very high95.2Very high175 Ų17598.5 Ų98.566%0.6652%0.515SS*.Hα-helixtrans-67.4-36.2174.2-73.7176.1-178.7-158.31112.9N73 Q74 L75 N81N73-R77 WeakPolarHBondContact O-CB 3.43Å; N73-R77 VanDerWaalsContact O-CG 3.28Å; N73-R77 WeakPolarHBondContact O-CG 3.45Å; N73-R77 PolarHBondContact O-N 3.18Å; Q74-R77 PolarHBondContact O-N 3.5Å; L75-R77 VanDerWaalsContact C-N 3.3Å; L75-R77 PolarHBondContact O-N 3.35Å; R77-N81 VanDerWaalsContact O-CB 3.3Å; R77-N81 WeakPolarHBondContact O-CB 3.3Å; R77-N81 PolarHBondContact O-N 2.92Å; R77-N81 PolarHBondContact O-ND2 3.39Å
78C93.2Very high95.2Very high85 Ų85100.3 Ų100.357%0.57452%0.518SS*.Hα-helixtrans-67.8-43.9176.5-166.90000111.2Q74 L75 N81 C82Q74-C78 WeakPolarHBondContact O-CB 3.47Å; Q74-C78 PolarHBondContact O-N 2.97Å; L75-C78 WeakPolarHBondContact O-CA 3.24Å; L75-C78 WeakPolarHBondContact O-CB 3.27Å; L75-C78 PolarHBondContact O-N 3.29Å; C78-N81 PolarHBondContact O-N 2.98Å; C78-C82 VanDerWaalsContact O-CB 3.24Å; C78-C82 WeakPolarHBondContact O-CB 3.36Å; C78-C82 PolarHBondContact O-N 3.46Å
79E94.3Very high95.2Very high121 Ų121102.6 Ų102.657%0.56552%0.52SS*.Hα-helixtrans-59.8-49.9174.5-70.5171.316400111.3L75 C82 V83L75-E79 WeakPolarHBondContact O-CG 3.45Å; L75-E79 PolarHBondContact O-N 3.44Å; E79-C82 WeakPolarHBondContact O-CB 3.5Å; E79-C82 PolarHBondContact O-N 2.99Å; E79-V83 WeakPolarHBondContact O-CG2 3.37Å; E79-V83 PolarHBondContact O-N 3.49Å
80Q96.6Very high95.1Very high85 Ų85102.3 Ų102.340%0.39752%0.519SS..Hα-helixtrans-58.8-51.5176.6-175.561.353.500111.8F76 C82 V83 D84F76-Q80 WeakPolarHBondContact O-CB 3.23Å; F76-Q80 PolarHBondContact O-N 3.49Å; Q80-C82 PolarHBondContact O-N 3.35Å; Q80-V83 PolarHBondContact O-N 3.48Å; Q80-V83 VanDerWaalsContact O-N 3.15Å; Q80-D84 VanDerWaalsContact NE2-CG 3.25Å; Q80-D84 PolarHBondContact NE2-OD1 3.44Å; Q80-D84 PolarHBondContact NE2-OD2 2.72Å; Q80-D84 VanDerWaalsContact O-CG 3.27Å; Q80-D84 PolarHBondContact O-N 3.45Å
81N95.4Very high95.1Very high109 Ų109103.6 Ų103.658%0.58352%0.523SS*.Hα-helixtrans-59.3-34.4177.5-72-12.2000112.4R77 C78 M85R77-N81 VanDerWaalsContact O-CB 3.3Å; R77-N81 WeakPolarHBondContact O-CB 3.3Å; R77-N81 PolarHBondContact O-N 2.92Å; R77-N81 PolarHBondContact O-ND2 3.39Å; C78-N81 PolarHBondContact O-N 2.98Å; N81-M85 WeakPolarHBondContact O-CB 3.39Å; N81-M85 PolarHBondContact O-N 2.97Å
82C92.6Very high95.1Very high78 Ų78102.3 Ų102.353%0.52752%0.515SS..Hα-helixtrans-69.4-42.9177.1-171.60000111.6C78 E79 Q80 T86C78-C82 VanDerWaalsContact O-CB 3.24Å; C78-C82 WeakPolarHBondContact O-CB 3.36Å; C78-C82 PolarHBondContact O-N 3.46Å; E79-C82 WeakPolarHBondContact O-CB 3.5Å; E79-C82 PolarHBondContact O-N 2.99Å; Q80-C82 PolarHBondContact O-N 3.35Å; C82-T86 VanDerWaalsContact O-CB 3.29Å; C82-T86 WeakPolarHBondContact O-CB 3.3Å; C82-T86 PolarHBondContact O-N 2.94Å; C82-T86 PolarHBondContact O-OG1 3.43Å
83V95.4Very high95Very high95 Ų95101.5 Ų101.558%0.57651%0.509SS*.Hα-helixtrans-62.9-48174.2171.10000110.9E79 Q80 M85 T86 G87E79-V83 WeakPolarHBondContact O-CG2 3.37Å; E79-V83 PolarHBondContact O-N 3.49Å; Q80-V83 PolarHBondContact O-N 3.48Å; Q80-V83 VanDerWaalsContact O-N 3.15Å; V83-M85 PolarHBondContact O-N 3.4Å; V83-T86 PolarHBondContact O-N 2.85Å; V83-G87 PolarHBondContact O-N 3.08Å
84D95Very high95Very high87 Ų87102.2 Ų102.247%0.46551%0.51SS..Hα-helixtrans-62.7-43.8-179.4-66.1-28.3000111.7Q80 G87 Y88Q80-D84 VanDerWaalsContact NE2-CG 3.25Å; Q80-D84 PolarHBondContact NE2-OD1 3.44Å; Q80-D84 PolarHBondContact NE2-OD2 2.72Å; Q80-D84 VanDerWaalsContact O-CG 3.27Å; Q80-D84 PolarHBondContact O-N 3.45Å; D84-G87 PolarHBondContact O-N 3.46Å; D84-Y88 WeakPolarHBondContact O-CB 3.14Å; D84-Y88 PolarHBondContact O-N 3.39Å
85M94.4Very high95Very high106 Ų106100.3 Ų100.352%0.52250%0.504SS..Hα-helixtrans-64.4-40.4175.2-173.261.861.400111.8N81 V83 Y88 W89N81-M85 WeakPolarHBondContact O-CB 3.39Å; N81-M85 PolarHBondContact O-N 2.97Å; V83-M85 PolarHBondContact O-N 3.4Å; M85-Y88 PolarHBondContact O-N 3.34Å; M85-W89 PolarHBondContact O-N 3.5Å; M85-W89 PolarHBondContact SD-NE1 3.09Å
86T94Very high94.9Very high80 Ų80102 Ų10249%0.49150%0.503SS..Hα-helixtrans-66-43.8177.6-58.30000111.3C82 V83 Y88 W89 Q90C82-T86 VanDerWaalsContact O-CB 3.29Å; C82-T86 WeakPolarHBondContact O-CB 3.3Å; C82-T86 PolarHBondContact O-N 2.94Å; C82-T86 PolarHBondContact O-OG1 3.43Å; V83-T86 PolarHBondContact O-N 2.85Å; T86-Y88 PolarHBondContact O-N 2.98Å; T86-W89 PolarHBondContact O-N 3.45Å; T86-Q90 WeakPolarHBondContact O-CB 3.4Å; T86-Q90 PolarHBondContact O-N 3.39Å
87G94.9Very high94.8Very high40 Ų40100.8 Ų100.841%0.41250%0.499SS..Hα-helixtrans-63.6-38.2176.100000112.9V83 D84 K91V83-G87 PolarHBondContact O-N 3.08Å; D84-G87 PolarHBondContact O-N 3.46Å; G87-K91 PolarHBondContact O-N 2.84Å; G87-K91 VanDerWaalsContact O-N 3.14Å
88Y96.1Very high94.8Very high135 Ų13597.7 Ų97.753%0.52949%0.492SS..Hα-helixtrans-60.4-50.7171.8174.9-93.6000111.9D84 M85 T86 K91 E92D84-Y88 WeakPolarHBondContact O-CB 3.14Å; D84-Y88 PolarHBondContact O-N 3.39Å; M85-Y88 PolarHBondContact O-N 3.34Å; T86-Y88 PolarHBondContact O-N 2.98Å; Y88-K91 PolarHBondContact O-N 3.15Å; Y88-E92 PolarHBondContact O-N 3.39Å
89W95.1Very high94.9Very high136 Ų136100.2 Ų100.252%0.51549%0.493SS..Hα-helixtrans-66.7-36.9-180-74.9118000113.3M85 T86 K91 E92 V93M85-W89 PolarHBondContact O-N 3.5Å; M85-W89 PolarHBondContact SD-NE1 3.09Å; T86-W89 PolarHBondContact O-N 3.45Å; W89-K91 VanDerWaalsContact C-N 3.34Å; W89-K91 PolarHBondContact O-N 3.05Å; W89-E92 HydrophobicContact CE3-CB 4.42Å; W89-E92 HydrophobicContact CE3-CG 4.33Å; W89-E92 HydrophobicContact CZ3-CG 4.33Å; W89-E92 PolarHBondContact O-N 3.04Å; W89-V93 WeakPolarHBondContact O-CG2 3.46Å; W89-V93 PolarHBondContact O-N 2.84Å
90Q94.4Very high94.8Very high114 Ų11498.9 Ų98.953%0.53349%0.489SS..Hα-helixtrans-58.6-47.9174.4179.7178.2-21.700110.5T86 V93 E94T86-Q90 WeakPolarHBondContact O-CB 3.4Å; T86-Q90 PolarHBondContact O-N 3.39Å; Q90-V93 WeakPolarHBondContact O-CB 3.4Å; Q90-V93 PolarHBondContact O-N 3.5Å; Q90-E94 WeakPolarHBondContact CG-OE1 3.47Å; Q90-E94 PolarHBondContact NE2-OE1 2.93Å; Q90-E94 WeakPolarHBondContact O-CG 3.33Å; Q90-E94 PolarHBondContact O-N 3.49Å
91K95.9Very high94.7Very high124 Ų124100.9 Ų100.954%0.53949%0.493SS..Hα-helixtrans-63.5-44.1178.3-170.9-176.2174.1-171.40112.5G87 Y88 W89 V93 E94 D95G87-K91 PolarHBondContact O-N 2.84Å; G87-K91 VanDerWaalsContact O-N 3.14Å; Y88-K91 PolarHBondContact O-N 3.15Å; W89-K91 VanDerWaalsContact C-N 3.34Å; W89-K91 PolarHBondContact O-N 3.05Å; K91-V93 PolarHBondContact O-N 2.99Å; K91-E94 PolarHBondContact O-N 3.21Å; K91-E94 VanDerWaalsContact O-N 3.13Å; K91-D95 WeakPolarHBondContact CE-OD2 3.47Å; K91-D95 WeakPolarHBondContact O-CB 3.16Å; K91-D95 PolarHBondContact O-N 2.95Å
92E95.3Very high94.6Very high54 Ų54101.2 Ų101.225%0.25249%0.492SS..Hα-helixtrans-61.5-27.8176.7179.267-154.700112.2Y88 W89 R96Y88-E92 PolarHBondContact O-N 3.39Å; W89-E92 HydrophobicContact CE3-CB 4.42Å; W89-E92 HydrophobicContact CE3-CG 4.33Å; W89-E92 HydrophobicContact CZ3-CG 4.33Å; W89-E92 PolarHBondContact O-N 3.04Å; E92-R96 WeakPolarHBondContact O-CB 3.37Å; E92-R96 VanDerWaalsContact O-CD 3.23Å; E92-R96 WeakPolarHBondContact O-CD 3.33Å; E92-R96 WeakPolarHBondContact O-CG 3.42Å; E92-R96 PolarHBondContact O-N 3Å; E92-R96 IonicContact OE1-CZ 2.61Å; E92-R96 IonicContact OE1-NE 3.93Å; E92-R96 PolarHBondContact OE1-NE 3.04Å; E92-R96 IonicContact OE1-NH2 3.01Å; E92-R96 PolarHBondContact OE1-NH2 3.29Å
93V94.1Very high94.6Very high74 Ų74102.4 Ų102.445%0.44849%0.493SS..Hα-helixtrans-74.1-48.4170.1169.70000111.4W89 Q90 K91 D95 R96 E97W89-V93 WeakPolarHBondContact O-CG2 3.46Å; W89-V93 PolarHBondContact O-N 2.84Å; Q90-V93 WeakPolarHBondContact O-CB 3.4Å; Q90-V93 PolarHBondContact O-N 3.5Å; K91-V93 PolarHBondContact O-N 2.99Å; V93-D95 PolarHBondContact O-N 2.93Å; V93-R96 WeakPolarHBondContact O-CB 3.41Å; V93-R96 PolarHBondContact O-N 3.22Å; V93-R96 VanDerWaalsContact O-N 3.08Å; V93-E97 HydrophobicContact CG1-CG 4.35Å; V93-E97 PolarHBondContact O-N 3.15Å
94E95.1Very high94.4Very high92 Ų92102 Ų10243%0.4349%0.485SS..Hα-helixtrans-57.7-45.9178.9-71.2170.2-173.700112.1Q90 K91 R96 E97 E98Q90-E94 WeakPolarHBondContact CG-OE1 3.47Å; Q90-E94 PolarHBondContact NE2-OE1 2.93Å; Q90-E94 WeakPolarHBondContact O-CG 3.33Å; Q90-E94 PolarHBondContact O-N 3.49Å; K91-E94 PolarHBondContact O-N 3.21Å; K91-E94 VanDerWaalsContact O-N 3.13Å; E94-R96 VanDerWaalsContact C-N 3.29Å; E94-R96 PolarHBondContact O-N 3.38Å; E94-E97 PolarHBondContact O-N 3.05Å; E94-E98 PolarHBondContact O-N 3.4Å; E94-E98 VanDerWaalsContact O-N 3.08Å
95D95.6Very high94.3Very high83 Ų83101.2 Ų101.244%0.44448%0.48SS..Hα-helixtrans-62-34.1176-74.8-23.7000111.8K91 V93 K99K91-D95 WeakPolarHBondContact CE-OD2 3.47Å; K91-D95 WeakPolarHBondContact O-CB 3.16Å; K91-D95 PolarHBondContact O-N 2.95Å; V93-D95 PolarHBondContact O-N 2.93Å; D95-K99 PolarHBondContact O-N 2.7Å
96R93.7Very high94.2Very high144 Ų144102.2 Ų102.254%0.54348%0.482SS..Hα-helixtrans-75.6-40.6176.3-76.3172.1-172.7-154.84.8112.7E92 V93 E94 E98 K99 I100E92-R96 WeakPolarHBondContact O-CB 3.37Å; E92-R96 VanDerWaalsContact O-CD 3.23Å; E92-R96 WeakPolarHBondContact O-CD 3.33Å; E92-R96 WeakPolarHBondContact O-CG 3.42Å; E92-R96 PolarHBondContact O-N 3Å; E92-R96 IonicContact OE1-CZ 2.61Å; E92-R96 IonicContact OE1-NE 3.93Å; E92-R96 PolarHBondContact OE1-NE 3.04Å; E92-R96 IonicContact OE1-NH2 3.01Å; E92-R96 PolarHBondContact OE1-NH2 3.29Å; V93-R96 WeakPolarHBondContact O-CB 3.41Å; V93-R96 PolarHBondContact O-N 3.22Å; V93-R96 VanDerWaalsContact O-N 3.08Å; E94-R96 VanDerWaalsContact C-N 3.29Å; E94-R96 PolarHBondContact O-N 3.38Å; R96-E98 VanDerWaalsContact C-N 3.33Å; R96-K99 WeakPolarHBondContact O-CB 3.49Å; R96-K99 PolarHBondContact O-N 3.44Å; R96-I100 WeakPolarHBondContact O-CG1 3.47Å; R96-I100 PolarHBondContact O-N 2.87Å
97E93.8Very high94.1Very high99 Ų99103 Ų10346%0.46348%0.482SS..Hα-helixtrans-62.5-41.2175.9-73.2-172.8-177.200111.6V93 E94 K99 I100 R101V93-E97 HydrophobicContact CG1-CG 4.35Å; V93-E97 PolarHBondContact O-N 3.15Å; E94-E97 PolarHBondContact O-N 3.05Å; E97-K99 VanDerWaalsContact C-N 3.31Å; E97-K99 PolarHBondContact O-N 3.3Å; E97-I100 PolarHBondContact O-N 3.19Å; E97-R101 WeakPolarHBondContact O-CG 3.44Å; E97-R101 PolarHBondContact O-N 3.43Å; E97-R101 IonicContact OE2-NH1 3.91Å
98E95.1Very high93.9Very high111 Ų111107.4 Ų107.452%0.51949%0.487SS..Hα-helixtrans-62.2-39.7174.1-176.8145.6-113.800112.2E94 R96 I100 R101 M102E94-E98 PolarHBondContact O-N 3.4Å; E94-E98 VanDerWaalsContact O-N 3.08Å; R96-E98 VanDerWaalsContact C-N 3.33Å; E98-I100 VanDerWaalsContact C-N 3.33Å; E98-I100 PolarHBondContact O-N 3.04Å; E98-R101 PolarHBondContact O-N 3.29Å; E98-M102 PolarHBondContact O-N 3.06Å
99K95.1Very high93.7Very high138 Ų138106.7 Ų106.760%0.649%0.486SS*.Hα-helixtrans-64.1-36.1174.4-167.6174.7-176.5176.60112.6D95 R96 E97 L103D95-K99 PolarHBondContact O-N 2.7Å; R96-K99 WeakPolarHBondContact O-CB 3.49Å; R96-K99 PolarHBondContact O-N 3.44Å; E97-K99 VanDerWaalsContact C-N 3.31Å; E97-K99 PolarHBondContact O-N 3.3Å; K99-L103 WeakPolarHBondContact O-CG 3.46Å; K99-L103 PolarHBondContact O-N 3.5Å
100I92.7Very high93.4Very high93 Ų93106.6 Ų106.648%0.47749%0.491SS..Hα-helixtrans-65.4-50.7173.2-69165000110.1R96 E97 E98 M102 L103 E104R96-I100 WeakPolarHBondContact O-CG1 3.47Å; R96-I100 PolarHBondContact O-N 2.87Å; E97-I100 PolarHBondContact O-N 3.19Å; E98-I100 VanDerWaalsContact C-N 3.33Å; E98-I100 PolarHBondContact O-N 3.04Å; I100-M102 VanDerWaalsContact C-N 3.26Å; I100-M102 PolarHBondContact O-N 3Å; I100-L103 PolarHBondContact O-N 3.13Å; I100-E104 HydrophobicContact CG2-CG 4.41Å; I100-E104 PolarHBondContact O-N 3.13Å
101R94.1Very high93.1Very high126 Ų126106.2 Ų106.248%0.47549%0.49SS..Hα-helixtrans-51.9-45176.3-69.7-174-68.6-100.16.5111.5E97 E98 L103 D105E97-R101 WeakPolarHBondContact O-CG 3.44Å; E97-R101 PolarHBondContact O-N 3.43Å; E97-R101 IonicContact OE2-NH1 3.91Å; E98-R101 PolarHBondContact O-N 3.29Å; R101-L103 VanDerWaalsContact C-N 3.32Å; R101-L103 PolarHBondContact O-N 2.75Å; R101-D105 WeakPolarHBondContact O-CB 3.33Å; R101-D105 PolarHBondContact O-N 3.45Å
102M94.3Very high92.6Very high116 Ų116103 Ų10357%0.57149%0.486SS*.Hα-helixtrans-67.4-22176.8-81.3-149.7-71.400115.6E98 I100 K106E98-M102 PolarHBondContact O-N 3.06Å; I100-M102 VanDerWaalsContact C-N 3.26Å; I100-M102 PolarHBondContact O-N 3Å; M102-K106 WeakPolarHBondContact O-CD 3.42Å; M102-K106 WeakPolarHBondContact O-CG 3.22Å
103L92.4Very high92.2Very high103 Ų103105 Ų10554%0.53950%0.498SS..Hα-helixtrans-86.5-42.5177.4-72.9169.7000111.6K99 I100 R101 D105 K106 L107K99-L103 WeakPolarHBondContact O-CG 3.46Å; K99-L103 PolarHBondContact O-N 3.5Å; I100-L103 PolarHBondContact O-N 3.13Å; R101-L103 VanDerWaalsContact C-N 3.32Å; R101-L103 PolarHBondContact O-N 2.75Å; L103-D105 VanDerWaalsContact C-N 3.26Å; L103-D105 PolarHBondContact O-N 3.5Å; L103-K106 WeakPolarHBondContact O-CB 3.41Å; L103-K106 PolarHBondContact O-N 2.86Å; L103-K106 VanDerWaalsContact O-N 3.08Å; L103-L107 PolarHBondContact O-N 3.44Å
104E90.6Very high91.6Very high88 Ų88104.4 Ų104.441%0.41150%0.501SS..Hα-helixtrans-55.4-44.7172.9-67.6-177.4-176.500111.4I100 K106 L107 R108I100-E104 HydrophobicContact CG2-CG 4.41Å; I100-E104 PolarHBondContact O-N 3.13Å; E104-K106 PolarHBondContact O-N 3.18Å; E104-L107 PolarHBondContact O-N 3.33Å; E104-R108 WeakPolarHBondContact O-CG 3.24Å; E104-R108 PolarHBondContact O-N 3.48Å; E104-R108 IonicContact OE2-CZ 3.2Å; E104-R108 IonicContact OE2-NH1 3.88Å; E104-R108 IonicContact OE2-NH2 2.66Å; E104-R108 PolarHBondContact OE2-NH2 3.36Å
105D92.8Very high90.9Very high69 Ų69105.4 Ų105.437%0.36951%0.508SS..Hα-helixtrans-73.5-10.9-178.4-127.253000113.9R101 L103 R108 K109R101-D105 WeakPolarHBondContact O-CB 3.33Å; R101-D105 PolarHBondContact O-N 3.45Å; L103-D105 VanDerWaalsContact C-N 3.26Å; L103-D105 PolarHBondContact O-N 3.5Å; D105-R108 IonicContact OD1-CZ 3.3Å; D105-R108 IonicContact OD1-NH1 2.84Å; D105-R108 PolarHBondContact OD1-NH1 2.71Å; D105-K109 WeakPolarHBondContact O-CD 3.4Å; D105-K109 VanDerWaalsContact O-CE 3.31Å; D105-K109 WeakPolarHBondContact O-CE 3.43Å; D105-K109 VanDerWaalsContact O-CG 3.31Å; D105-K109 WeakPolarHBondContact O-CG 3.45Å; D105-K109 PolarHBondContact O-NZ 3.33Å; D105-K109 IonicContact OD2-NZ 3.15Å; D105-K109 PolarHBondContact OD2-NZ 3.41Å
106K92.9Very high90.3Very high127 Ų127107.4 Ų107.455%0.55252%0.518SS*.Hα-helixtrans-86.6-42.2167-76.1171.9-178.9176.30111.1M102 L103 E104 K109 Q110M102-K106 WeakPolarHBondContact O-CD 3.42Å; M102-K106 WeakPolarHBondContact O-CG 3.22Å; L103-K106 WeakPolarHBondContact O-CB 3.41Å; L103-K106 PolarHBondContact O-N 2.86Å; L103-K106 VanDerWaalsContact O-N 3.08Å; E104-K106 PolarHBondContact O-N 3.18Å; K106-K109 PolarHBondContact O-N 3.03Å; K106-Q110 PolarHBondContact O-N 3.19Å
107L91.4Very high89.7Confident97 Ų97106.5 Ų106.551%0.50852%0.52SS..Hα-helixtrans-58.4-51.7178.5-176.762.9000111.4L103 E104 K109 Q110 E111L103-L107 PolarHBondContact O-N 3.44Å; E104-L107 PolarHBondContact O-N 3.33Å; L107-K109 PolarHBondContact O-N 3.49Å; L107-Q110 PolarHBondContact O-N 2.97Å; L107-E111 WeakPolarHBondContact O-CG 3.42Å; L107-E111 PolarHBondContact O-N 3.34Å; L107-E111 VanDerWaalsContact O-N 3.09Å
108R91.6Very high89Confident132 Ų132110.3 Ų110.350%0.49853%0.53SS..Hα-helixtrans-51.1-35.4176.1-68.2172.2-173.5133.311.5113.1E104 D105 A112E104-R108 WeakPolarHBondContact O-CG 3.24Å; E104-R108 PolarHBondContact O-N 3.48Å; E104-R108 IonicContact OE2-CZ 3.2Å; E104-R108 IonicContact OE2-NH1 3.88Å; E104-R108 IonicContact OE2-NH2 2.66Å; E104-R108 PolarHBondContact OE2-NH2 3.36Å; D105-R108 IonicContact OD1-CZ 3.3Å; D105-R108 IonicContact OD1-NH1 2.84Å; D105-R108 PolarHBondContact OD1-NH1 2.71Å; R108-A112 PolarHBondContact O-N 3.12Å
109K91.7Very high87.9Confident121 Ų121110.7 Ų110.753%0.52654%0.536SS..Hα-helixtrans-77-30.4-179-68174-173.5118.70112.4D105 K106 L107 I113D105-K109 WeakPolarHBondContact O-CD 3.4Å; D105-K109 VanDerWaalsContact O-CE 3.31Å; D105-K109 WeakPolarHBondContact O-CE 3.43Å; D105-K109 VanDerWaalsContact O-CG 3.31Å; D105-K109 WeakPolarHBondContact O-CG 3.45Å; D105-K109 PolarHBondContact O-NZ 3.33Å; D105-K109 IonicContact OD2-NZ 3.15Å; D105-K109 PolarHBondContact OD2-NZ 3.41Å; K106-K109 PolarHBondContact O-N 3.03Å; L107-K109 PolarHBondContact O-N 3.49Å; K109-I113 WeakPolarHBondContact O-CD1 3Å; K109-I113 WeakPolarHBondContact O-CG1 3.47Å
110Q89.9Confident87Confident133 Ų133112 Ų11262%0.62154%0.542SS*.Hα-helixtrans-75.3-40.8173.8-66.6-171.9-80.700112.1K106 L107 A112 I113 A114K106-Q110 PolarHBondContact O-N 3.19Å; L107-Q110 PolarHBondContact O-N 2.97Å; Q110-A112 VanDerWaalsContact C-N 3.3Å; Q110-A112 PolarHBondContact O-N 2.95Å; Q110-I113 PolarHBondContact O-N 3.32Å; Q110-I113 VanDerWaalsContact O-N 3.08Å; Q110-A114 PolarHBondContact O-N 3.04Å
111E87.6Confident85.9Confident106 Ų106114.9 Ų114.950%0.49555%0.553SS.*Hα-helixtrans-58.3-41.6178.4-67.3171.3149.200112L107 I113 A114 L115L107-E111 WeakPolarHBondContact O-CG 3.42Å; L107-E111 PolarHBondContact O-N 3.34Å; L107-E111 VanDerWaalsContact O-N 3.09Å; E111-I113 VanDerWaalsContact C-N 3.29Å; E111-I113 PolarHBondContact O-N 3.38Å; E111-A114 PolarHBondContact O-N 3.07Å; E111-L115 PolarHBondContact O-N 3.37Å
112A84.3Confident84.5Confident56 Ų56113.7 Ų113.746%0.46356%0.56SS.*Hα-helixtrans-63.2-30.5176.200000113.8R108 Q110R108-A112 PolarHBondContact O-N 3.12Å; Q110-A112 VanDerWaalsContact C-N 3.3Å; Q110-A112 PolarHBondContact O-N 2.95Å
113I86.8Confident82.7Confident98 Ų98110.6 Ų110.650%0.50356%0.557SS.*Hα-helixtrans-75.7-47.7179.2-66.3166.7000110.3K109 Q110 E111 L115 L116 E117K109-I113 WeakPolarHBondContact O-CD1 3Å; K109-I113 WeakPolarHBondContact O-CG1 3.47Å; Q110-I113 PolarHBondContact O-N 3.32Å; Q110-I113 VanDerWaalsContact O-N 3.08Å; E111-I113 VanDerWaalsContact C-N 3.29Å; E111-I113 PolarHBondContact O-N 3.38Å; I113-L115 PolarHBondContact O-N 3.02Å; I113-L116 WeakPolarHBondContact O-CB 3.42Å; I113-L116 PolarHBondContact O-N 3.16Å; I113-E117 PolarHBondContact O-N 2.62Å
114A81.3Confident81.1Confident61 Ų61111.2 Ų111.250%0.50457%0.565SS.*Hα-helixtrans-59.4-33.7-177.800000113.2Q110 E111 E117 R118Q110-A114 PolarHBondContact O-N 3.04Å; E111-A114 PolarHBondContact O-N 3.07Å; A114-E117 PolarHBondContact O-N 3.48Å; A114-R118 PolarHBondContact O-N 3.48Å
115L80.8Confident79.2Confident112 Ų112117.1 Ų117.159%0.58659%0.585SS**Hα-helixtrans-66-33.3175.6-75.3168.4000113.3E111 I113 N119E111-L115 PolarHBondContact O-N 3.37Å; I113-L115 PolarHBondContact O-N 3.02Å; L115-N119 PolarHBondContact O-ND2 3.13Å
116L82.8Confident76.9Confident126 Ų126120.3 Ų120.366%0.6660%0.601SS**Hα-helixtrans-73.6-34178.9-70.1169.2000112.4I113I113-L116 WeakPolarHBondContact O-CB 3.42Å; I113-L116 PolarHBondContact O-N 3.16Å
117E80.7Confident74.5Confident124 Ų124121.4 Ų121.458%0.57961%0.613SS**Hα-helixtrans-71.9-45.1179.3-63.7-17414400111.8I113 A114 N119 K120I113-E117 PolarHBondContact O-N 2.62Å; A114-E117 PolarHBondContact O-N 3.48Å; E117-N119 PolarHBondContact O-N 3.22Å; E117-K120 PolarHBondContact O-N 3.13Å
118R79.3Confident72Confident179 Ų179121.6 Ų121.668%0.67562%0.622SS**Hα-helixtrans-53.3-41.3177.8-174.1-177.7179.998.81.5112.4A114 K120 Q121A114-R118 PolarHBondContact O-N 3.48Å; R118-K120 VanDerWaalsContact C-N 3.29Å; R118-K120 PolarHBondContact O-N 3.45Å; R118-Q121 PolarHBondContact O-N 3.02Å
119N73Confident69.1Low119 Ų119120.7 Ų120.764%0.63664%0.636SS**Hα-helixtrans-70.1-21.6-177.7-71.8-13.2000113.7L115 E117L115-N119 PolarHBondContact O-ND2 3.13Å; E117-N119 PolarHBondContact O-N 3.22Å
120K76.4Confident66.2Low167 Ų167124.3 Ų124.373%0.72666%0.655SS**Hα-helixtrans-75.1-37175.7-74.6-177.8174.9177.80112.9E117 R118 V122E117-K120 PolarHBondContact O-N 3.13Å; R118-K120 VanDerWaalsContact C-N 3.29Å; R118-K120 PolarHBondContact O-N 3.45Å; K120-V122 PolarHBondContact O-N 2.92Å
121Q68.6Low64.6Low153 Ų153122.8 Ų122.872%0.71566%0.656SS**Hα-helixtrans-71.5-30.6-171.8-71.5171.7-23.100113R118 G123R118-Q121 PolarHBondContact O-N 3.02Å; Q121-G123 VanDerWaalsContact C-N 3.31Å; Q121-G123 PolarHBondContact O-N 2.92Å
122V65.9Low62.2Low101 Ų101124.6 Ų124.661%0.61267%0.668SS**Hα-helixtrans-65.5-33179.8-179.70000112.4K120 V124K120-V122 PolarHBondContact O-N 2.92Å; V122-V124 VanDerWaalsContact C-N 3.28Å; V122-V124 PolarHBondContact O-N 3.36Å
123G55.6Low59.9Low51 Ų51129.5 Ų129.553%0.52668%0.682SS.*THydrogen-bonded Turntrans-71.1-15.5-176.200000115.3Q121Q121-G123 VanDerWaalsContact C-N 3.31Å; Q121-G123 PolarHBondContact O-N 2.92Å
124V59.8Low57.7Low116 Ų116130.8 Ų130.870%0.70369%0.694SS**THydrogen-bonded Turntrans-87.8-18.3-173.6-177.20000112.7V122 I126V122-V124 VanDerWaalsContact C-N 3.28Å; V122-V124 PolarHBondContact O-N 3.36Å; V124-I126 PolarHBondContact O-N 2.91Å
125Y50.3Low55.8Low212 Ų212136.9 Ų136.983%0.83171%0.712SS**SBendtrans-89.31.9-166.3-156.7-100.6000114.9
126I44.6Very low54Low136 Ų136136.5 Ų136.570%0.69771%0.711SS**SBendtrans-98.6-23.3-167.5-64.2177.9000113.1V124 S128V124-I126 PolarHBondContact O-N 2.91Å; I126-S128 PolarHBondContact O-N 3.28Å
127D41.4Very low52.7Low150 Ų150135.7 Ų135.780%0.80271%0.711SS**SBendtrans-89.13.2-162.4-71.5-15.2000116.5
128S40Very low51.3Low100 Ų100134.4 Ų134.470%0.69972%0.716SS**  trans-139.792.9-166.865.10000116.9I126I126-S128 PolarHBondContact O-N 3.28Å
129S31.3Very low50.1Low114 Ų114133.8 Ų133.880%0.79772%0.72SS**  trans-166.5131.2154.151.70000114.1
130H29Very low49.3Very low197 Ų197133.3 Ų133.391%0.91271%0.713SS**  trans-171.1149.1158.3-113.5-71.6000111
131P57.4Low48.4Very low101 Ų101128.8 Ų128.866%0.65671%0.707SS**  trans-135.4-170.1-170.635-12.6000117.2
132L36.9Very low48Very low144 Ų144129.7 Ų129.775%0.75471%0.711SS**  trans84.4155.8166.8-45.8175.1000116.4
133E36.4Very low47.9Very low159 Ų159128.7 Ų128.774%0.74370%0.702SS**  cis-144.6-132.61.2-146.2147.9-122.700115.2
134T40.4Very low48.6Very low125 Ų125133 Ų13377%0.76771%0.706SS**  trans-154.4165-15758.60000116.3
135E41.7Very low49.3Very low188 Ų188134 Ų13488%0.87970%0.702SS**  trans-156.3-179.6157.5-109.3175.5174.300108.3
136D42.9Very low50.5Low104 Ų104126.6 Ų126.656%0.55668%0.684SS**  cis-108.7-159.2-11.6168.454.7000109.6S138 K140D136-S138 PolarHBondContact OD2-N 3.33Å; D136-K140 WeakPolarHBondContact O-CE 3.39Å; D136-K140 PolarHBondContact O-NZ 2.75Å
137V54.4Low52Low110 Ų110124.5 Ų124.567%0.66767%0.674SS**  trans-135.5-10.2-176.8-176.50000116.6K140V137-K140 WeakPolarHBondContact O-CB 3.47Å
138S51.3Low53.8Low97 Ų97122.1 Ų122.168%0.67866%0.658SS**SBendtrans-83.2-46.4-167.8-1600000116.7D136 K140 A141D136-S138 PolarHBondContact OD2-N 3.33Å; S138-K140 PolarHBondContact O-N 2.86Å; S138-A141 PolarHBondContact O-N 3.44Å
139E53.8Low55.7Low165 Ų165120.6 Ų120.677%0.77164%0.642SS**THydrogen-bonded Turntrans-61.9-32.1174.3-74.6-178130.200111.4A141 Q142 D143E139-A141 PolarHBondContact O-N 3.01Å; E139-Q142 PolarHBondContact O-N 3.07Å; E139-Q142 VanDerWaalsContact O-N 3.08Å; E139-D143 PolarHBondContact O-N 2.89Å
140K56.5Low58.1Low109 Ų109120.8 Ų120.847%0.47463%0.63SS.*Hα-helixtrans-51.3-17.1178.7-62.9-169.5177.5159.70114.3D136 V137 S138 F144D136-K140 WeakPolarHBondContact O-CE 3.39Å; D136-K140 PolarHBondContact O-NZ 2.75Å; V137-K140 WeakPolarHBondContact O-CB 3.47Å; S138-K140 PolarHBondContact O-N 2.86Å; K140-F144 WeakPolarHBondContact O-CA 3.34Å; K140-F144 WeakPolarHBondContact O-CB 3.29Å; K140-F144 PolarHBondContact O-N 2.7Å
141A57.8Low60.6Low73 Ų73116.3 Ų116.360%0.60361%0.611SS**Hα-helixtrans-81.6-34179.400000114.9S138 E139 F144S138-A141 PolarHBondContact O-N 3.44Å; E139-A141 PolarHBondContact O-N 3.01Å; A141-F144 WeakPolarHBondContact O-CB 3.35Å
142Q61.2Low61.9Low172 Ų172116.8 Ų116.880%0.80460%0.599SS**Hα-helixtrans-83-39.2169.3-83.1-168-16.500110.4E139 F144 K145 A146E139-Q142 PolarHBondContact O-N 3.07Å; E139-Q142 VanDerWaalsContact O-N 3.08Å; Q142-F144 PolarHBondContact O-N 3.29Å; Q142-K145 PolarHBondContact O-N 2.93Å; Q142-A146 PolarHBondContact O-N 3.16Å
143D63.9Low64.2Low80 Ų80115.9 Ų115.943%0.42859%0.589SS.*Hα-helixtrans-56.1-37.4168.7-59-31.8000110.5E139 K145 A146 L147E139-D143 PolarHBondContact O-N 2.89Å; D143-K145 PolarHBondContact O-N 3.27Å; D143-A146 PolarHBondContact O-N 2.9Å; D143-A146 VanDerWaalsContact O-N 3.14Å; D143-L147 HydrophobicContact CB-CD1 4.18Å; D143-L147 WeakPolarHBondContact O-CB 3.45Å; D143-L147 WeakPolarHBondContact O-CG 3.41Å; D143-L147 PolarHBondContact O-N 3.34Å
144F70.5Confident66.5Low140 Ų140114.5 Ų114.561%0.61459%0.585SS**Hα-helixtrans-51.8-35.2176.4-150.4-100.4000112.7K140 A141 Q142 Q148K140-F144 WeakPolarHBondContact O-CA 3.34Å; K140-F144 WeakPolarHBondContact O-CB 3.29Å; K140-F144 PolarHBondContact O-N 2.7Å; A141-F144 WeakPolarHBondContact O-CB 3.35Å; Q142-F144 PolarHBondContact O-N 3.29Å; F144-Q148 WeakPolarHBondContact O-CB 3.48Å; F144-Q148 PolarHBondContact O-N 3.46Å
145K74.5Confident68.5Low139 Ų139113.2 Ų113.260%0.60457%0.57SS**Hα-helixtrans-86.4-34.9-176.5-161.1174.3-176.9-178.50112.3Q142 D143 Q148 D149Q142-K145 PolarHBondContact O-N 2.93Å; D143-K145 PolarHBondContact O-N 3.27Å; K145-Q148 PolarHBondContact O-N 3.12Å; K145-D149 PolarHBondContact O-N 3.48Å; K145-D149 VanDerWaalsContact O-N 3.11Å
146A74.8Confident70.7Confident55 Ų55109.3 Ų109.346%0.45555%0.552SS.*Hα-helixtrans-62.2-50.8167.200000110.1Q142 D143 Q148 D149 E150Q142-A146 PolarHBondContact O-N 3.16Å; D143-A146 PolarHBondContact O-N 2.9Å; D143-A146 VanDerWaalsContact O-N 3.14Å; A146-Q148 PolarHBondContact O-N 3.12Å; A146-D149 PolarHBondContact O-N 3.48Å; A146-D149 VanDerWaalsContact O-N 3.17Å; A146-E150 WeakPolarHBondContact O-CB 3.43Å; A146-E150 WeakPolarHBondContact O-CG 3.27Å; A146-E150 PolarHBondContact O-N 2.97Å
147L76.8Confident72.8Confident93 Ų93108.5 Ų108.549%0.48755%0.547SS..Hα-helixtrans-57.1-28.7170.8-70.6166.5000112.9D143 M151D143-L147 HydrophobicContact CB-CD1 4.18Å; D143-L147 WeakPolarHBondContact O-CB 3.45Å; D143-L147 WeakPolarHBondContact O-CG 3.41Å; D143-L147 PolarHBondContact O-N 3.34Å; L147-M151 WeakPolarHBondContact O-CA 3.38Å; L147-M151 WeakPolarHBondContact O-CB 3.5Å; L147-M151 WeakPolarHBondContact O-CG 3.4Å; L147-M151 PolarHBondContact O-N 3.3Å
148Q78.6Confident74.3Confident99 Ų99108.9 Ų108.946%0.46354%0.542SS..Hα-helixtrans-76.7-36.4176-176.1172.54500112.8F144 K145 A146 R152F144-Q148 WeakPolarHBondContact O-CB 3.48Å; F144-Q148 PolarHBondContact O-N 3.46Å; K145-Q148 PolarHBondContact O-N 3.12Å; A146-Q148 PolarHBondContact O-N 3.12Å; Q148-R152 PolarHBondContact O-N 3.22Å; Q148-R152 VanDerWaalsContact O-N 3.11Å
149D79.6Confident76Confident68 Ų68106.9 Ų106.936%0.36453%0.531SS..Hα-helixtrans-80.4-26.3173.5-76.8-35.1000112.2K145 A146 R152 K153K145-D149 PolarHBondContact O-N 3.48Å; K145-D149 VanDerWaalsContact O-N 3.11Å; A146-D149 PolarHBondContact O-N 3.48Å; A146-D149 VanDerWaalsContact O-N 3.17Å; D149-R152 IonicContact OD1-CZ 2.62Å; D149-R152 IonicContact OD1-NH1 2.8Å; D149-R152 PolarHBondContact OD1-NH1 2.88Å; D149-R152 IonicContact OD1-NH2 2.75Å; D149-R152 PolarHBondContact OD1-NH2 2.98Å; D149-K153 WeakPolarHBondContact O-CG 3.26Å; D149-K153 PolarHBondContact O-N 2.95Å
150E82.3Confident77.7Confident118 Ų118104.1 Ų104.155%0.55152%0.518SS*.Hα-helixtrans-76.8-36167.9-71-168159.100112.3A146 R152 K153 M154A146-E150 WeakPolarHBondContact O-CB 3.43Å; A146-E150 WeakPolarHBondContact O-CG 3.27Å; A146-E150 PolarHBondContact O-N 2.97Å; E150-R152 VanDerWaalsContact C-N 3.33Å; E150-R152 PolarHBondContact O-N 3.42Å; E150-K153 CarbonylContact O-C 3.58Å; E150-K153 PolarHBondContact O-N 3.05Å; E150-M154 WeakPolarHBondContact O-CB 3.4Å; E150-M154 VanDerWaalsContact O-CG 3.28Å; E150-M154 WeakPolarHBondContact O-CG 3.43Å; E150-M154 PolarHBondContact O-N 3.19Å
151M81.8Confident79.4Confident104 Ų104103.7 Ų103.751%0.51252%0.521SS..Hα-helixtrans-56.6-47.8167.3-90.8178.761.500109.9L147 K153 M154 E155L147-M151 WeakPolarHBondContact O-CA 3.38Å; L147-M151 WeakPolarHBondContact O-CB 3.5Å; L147-M151 WeakPolarHBondContact O-CG 3.4Å; L147-M151 PolarHBondContact O-N 3.3Å; M151-K153 VanDerWaalsContact C-N 3.27Å; M151-K153 PolarHBondContact O-N 2.96Å; M151-M154 CarbonylContact O-C 3.59Å; M151-M154 WeakPolarHBondContact O-CA 3.32Å; M151-M154 WeakPolarHBondContact O-CB 3.49Å; M151-M154 PolarHBondContact O-N 3.44Å; M151-E155 WeakPolarHBondContact CE-OE1 3.41Å; M151-E155 WeakPolarHBondContact O-CB 3.38Å; M151-E155 VanDerWaalsContact O-CG 3.24Å; M151-E155 WeakPolarHBondContact O-CG 3.49Å; M151-E155 PolarHBondContact O-N 2.89Å
152R84.3Confident80.9Confident110 Ų110106.4 Ų106.442%0.41552%0.521SS..Hα-helixtrans-60-37.9178.9-162-177.4-50.5109.724.7112.6Q148 D149 E150 E156Q148-R152 PolarHBondContact O-N 3.22Å; Q148-R152 VanDerWaalsContact O-N 3.11Å; D149-R152 IonicContact OD1-CZ 2.62Å; D149-R152 IonicContact OD1-NH1 2.8Å; D149-R152 PolarHBondContact OD1-NH1 2.88Å; D149-R152 IonicContact OD1-NH2 2.75Å; D149-R152 PolarHBondContact OD1-NH2 2.98Å; E150-R152 VanDerWaalsContact C-N 3.33Å; E150-R152 PolarHBondContact O-N 3.42Å; R152-E156 WeakPolarHBondContact O-CB 3.42Å; R152-E156 WeakPolarHBondContact O-CG 3.44Å; R152-E156 PolarHBondContact O-N 2.96Å
153K84.4Confident82.4Confident125 Ų125104.8 Ų104.854%0.54351%0.513SS..Hα-helixtrans-71.5-33.8173.8-68.9170.7-173.8167.90112.7D149 E150 M151 N157D149-K153 WeakPolarHBondContact O-CG 3.26Å; D149-K153 PolarHBondContact O-N 2.95Å; E150-K153 CarbonylContact O-C 3.58Å; E150-K153 PolarHBondContact O-N 3.05Å; M151-K153 VanDerWaalsContact C-N 3.27Å; M151-K153 PolarHBondContact O-N 2.96Å; K153-N157 VanDerWaalsContact O-CB 3.28Å; K153-N157 WeakPolarHBondContact O-CB 3.49Å; K153-N157 PolarHBondContact O-N 2.82Å; K153-N157 PolarHBondContact O-ND2 3.38Å
154M85Confident83.8Confident130 Ų130106.5 Ų106.564%0.6452%0.519SS*.Hα-helixtrans-65-47.8171.5-73.3-107.1-6700110E150 M151 E156 N157 E158E150-M154 WeakPolarHBondContact O-CB 3.4Å; E150-M154 VanDerWaalsContact O-CG 3.28Å; E150-M154 WeakPolarHBondContact O-CG 3.43Å; E150-M154 PolarHBondContact O-N 3.19Å; M151-M154 CarbonylContact O-C 3.59Å; M151-M154 WeakPolarHBondContact O-CA 3.32Å; M151-M154 WeakPolarHBondContact O-CB 3.49Å; M151-M154 PolarHBondContact O-N 3.44Å; M154-E156 PolarHBondContact O-N 3.3Å; M154-N157 CarbonylContact O-C 3.57Å; M154-N157 PolarHBondContact O-N 3.31Å; M154-E158 WeakPolarHBondContact O-CA 3.35Å; M154-E158 WeakPolarHBondContact O-CB 3.39Å; M154-E158 PolarHBondContact O-N 2.9Å
155E83.5Confident84.8Confident98 Ų98103.9 Ų103.946%0.45851%0.511SS..Hα-helixtrans-58.2-43.4174.5-69.1162.2-177.600111.3M151 A159M151-E155 WeakPolarHBondContact CE-OE1 3.41Å; M151-E155 WeakPolarHBondContact O-CB 3.38Å; M151-E155 VanDerWaalsContact O-CG 3.24Å; M151-E155 WeakPolarHBondContact O-CG 3.49Å; M151-E155 PolarHBondContact O-N 2.89Å; E155-A159 VanDerWaalsContact O-CB 3.24Å; E155-A159 WeakPolarHBondContact O-CB 3.01Å; E155-A159 PolarHBondContact O-N 2.9Å
156E86.4Confident85.7Confident106 Ų10698.1 Ų98.150%0.49549%0.49SS..Hα-helixtrans-65.7-38.6175-76.5167-169.500112.8R152 M154 Q160R152-E156 WeakPolarHBondContact O-CB 3.42Å; R152-E156 WeakPolarHBondContact O-CG 3.44Å; R152-E156 PolarHBondContact O-N 2.96Å; M154-E156 PolarHBondContact O-N 3.3Å; E156-Q160 WeakPolarHBondContact O-CG 3.46Å; E156-Q160 PolarHBondContact O-N 3.11Å; E156-Q160 PolarHBondContact O-NE2 3.42Å
157N86.6Confident86.7Confident88 Ų8898.2 Ų98.247%0.47148%0.483SS..Hα-helixtrans-77.8-34176.7-71.6-30.2000112.4K153 M154 Q160 L161K153-N157 VanDerWaalsContact O-CB 3.28Å; K153-N157 WeakPolarHBondContact O-CB 3.49Å; K153-N157 PolarHBondContact O-N 2.82Å; K153-N157 PolarHBondContact O-ND2 3.38Å; M154-N157 CarbonylContact O-C 3.57Å; M154-N157 PolarHBondContact O-N 3.31Å; N157-Q160 PolarHBondContact O-N 3.32Å; N157-L161 WeakPolarHBondContact O-CB 3.3Å; N157-L161 VanDerWaalsContact O-CG 3.29Å; N157-L161 WeakPolarHBondContact O-CG 3.41Å; N157-L161 PolarHBondContact O-N 3.2Å
158E86.1Confident87.5Confident118 Ų11898.1 Ų98.155%0.55148%0.481SS*.Hα-helixtrans-67.3-45.5176-177.7167.2-149.700109.1M154 Q160 L161 E162M154-E158 WeakPolarHBondContact O-CA 3.35Å; M154-E158 WeakPolarHBondContact O-CB 3.39Å; M154-E158 PolarHBondContact O-N 2.9Å; E158-Q160 VanDerWaalsContact C-N 3.34Å; E158-Q160 PolarHBondContact O-N 3.45Å; E158-L161 CarbonylContact O-C 3.59Å; E158-L161 PolarHBondContact O-N 2.92Å; E158-E162 WeakPolarHBondContact O-CB 3.22Å; E158-E162 WeakPolarHBondContact O-CG 3.37Å; E158-E162 PolarHBondContact O-N 3.43Å
159A88.4Confident88.2Confident54 Ų5499.6 Ų99.645%0.44648%0.483SS..Hα-helixtrans-59.1-41.1171.300000112.7E155 E162 E163E155-A159 VanDerWaalsContact O-CB 3.24Å; E155-A159 WeakPolarHBondContact O-CB 3.01Å; E155-A159 PolarHBondContact O-N 2.9Å; A159-E162 PolarHBondContact O-N 2.77Å; A159-E163 WeakPolarHBondContact O-CB 3.26Å; A159-E163 PolarHBondContact O-N 3.41Å
160Q89.8Confident89Confident108 Ų108102.4 Ų102.451%0.50549%0.492SS..Hα-helixtrans-64.1-44.3174-78.4167.170.200112E156 N157 E158 E163 E164E156-Q160 WeakPolarHBondContact O-CG 3.46Å; E156-Q160 PolarHBondContact O-N 3.11Å; E156-Q160 PolarHBondContact O-NE2 3.42Å; N157-Q160 PolarHBondContact O-N 3.32Å; E158-Q160 VanDerWaalsContact C-N 3.34Å; E158-Q160 PolarHBondContact O-N 3.45Å; Q160-E163 PolarHBondContact O-N 3.39Å; Q160-E164 WeakPolarHBondContact O-CG 3.22Å; Q160-E164 PolarHBondContact O-N 3.24Å
161L90.5Very high89.6Confident100 Ų100102.9 Ų102.952%0.52449%0.489SS..Hα-helixtrans-68.6-35.6177.1-72.7169.5000112.1N157 E158 L165N157-L161 WeakPolarHBondContact O-CB 3.3Å; N157-L161 VanDerWaalsContact O-CG 3.29Å; N157-L161 WeakPolarHBondContact O-CG 3.41Å; N157-L161 PolarHBondContact O-N 3.2Å; E158-L161 CarbonylContact O-C 3.59Å; E158-L161 PolarHBondContact O-N 2.92Å; L161-L165 WeakPolarHBondContact O-CB 3.39Å; L161-L165 WeakPolarHBondContact O-CD1 3.35Å; L161-L165 WeakPolarHBondContact O-CG 3.26Å; L161-L165 PolarHBondContact O-N 3.39Å
162E89.4Confident90.2Very high129 Ų129103 Ų10360%0.60349%0.489SS*.Hα-helixtrans-65.8-39.7172.3-77.1-154130.900111.8E158 A159 G166E158-E162 WeakPolarHBondContact O-CB 3.22Å; E158-E162 WeakPolarHBondContact O-CG 3.37Å; E158-E162 PolarHBondContact O-N 3.43Å; A159-E162 PolarHBondContact O-N 2.77Å; E162-G166 WeakPolarHBondContact O-CA 3.24Å; E162-G166 PolarHBondContact O-N 3.47Å
163E93.1Very high90.7Very high138 Ų138101.3 Ų101.365%0.64549%0.488SS*.Hα-helixtrans-64.6-51.3172.6-176.4164.3-144.700110.6A159 Q160 L165 G166 D167A159-E163 WeakPolarHBondContact O-CB 3.26Å; A159-E163 PolarHBondContact O-N 3.41Å; Q160-E163 PolarHBondContact O-N 3.39Å; E163-L165 PolarHBondContact O-N 2.94Å; E163-G166 CarbonylContact O-C 3.58Å; E163-G166 WeakPolarHBondContact O-CA 3.45Å; E163-G166 PolarHBondContact O-N 3.18Å; E163-G166 VanDerWaalsContact O-N 3.09Å; E163-D167 WeakPolarHBondContact O-CB 3.42Å; E163-D167 PolarHBondContact O-N 3.4Å
164E92.9Very high91.2Very high117 Ų117101.1 Ų101.155%0.54749%0.488SS..Hα-helixtrans-59.4-43.2177.3-76.9-164.9168.600112.8Q160 D167 M168Q160-E164 WeakPolarHBondContact O-CG 3.22Å; Q160-E164 PolarHBondContact O-N 3.24Å; E164-D167 PolarHBondContact O-N 2.92Å; E164-M168 HydrophobicContact CB-CE 4.27Å; E164-M168 WeakPolarHBondContact O-CB 3.43Å; E164-M168 WeakPolarHBondContact O-CG 3.07Å; E164-M168 PolarHBondContact O-N 2.95Å
165L92.1Very high91.7Very high85 Ų8598 Ų9845%0.44548%0.476SS..Hα-helixtrans-67.3-37.8174-72.8166.9000111.3L161 E163 D167 M168 R169L161-L165 WeakPolarHBondContact O-CB 3.39Å; L161-L165 WeakPolarHBondContact O-CD1 3.35Å; L161-L165 WeakPolarHBondContact O-CG 3.26Å; L161-L165 PolarHBondContact O-N 3.39Å; E163-L165 PolarHBondContact O-N 2.94Å; L165-D167 VanDerWaalsContact C-N 3.32Å; L165-M168 HydrophobicContact CD2-CE 4.03Å; L165-M168 HydrophobicContact CG-CE 4.44Å; L165-R169 VanDerWaalsContact CB-NH2 3.33Å; L165-R169 WeakPolarHBondContact O-CB 3.3Å; L165-R169 VanDerWaalsContact O-CG 3.26Å; L165-R169 WeakPolarHBondContact O-CG 3.46Å; L165-R169 PolarHBondContact O-N 2.91Å; L165-R169 PolarHBondContact O-NE 3.17Å
166G94.2Very high92.2Very high17 Ų1798 Ų9818%0.17548%0.476CS..Hα-helixtrans-59.5-43.8172.300000111.5E162 E163 R169 K170E162-G166 WeakPolarHBondContact O-CA 3.24Å; E162-G166 PolarHBondContact O-N 3.47Å; E163-G166 CarbonylContact O-C 3.58Å; E163-G166 WeakPolarHBondContact O-CA 3.45Å; E163-G166 PolarHBondContact O-N 3.18Å; E163-G166 VanDerWaalsContact O-N 3.09Å; G166-R169 PolarHBondContact O-N 3.08Å; G166-K170 VanDerWaalsContact O-CG 3.28Å; G166-K170 WeakPolarHBondContact O-CG 3.41Å; G166-K170 PolarHBondContact O-N 3.06Å
167D94.4Very high92.7Very high57 Ų5798.9 Ų98.931%0.30548%0.478SS..Hα-helixtrans-75.5-35.5180-115.344.5000113.1E163 E164 L165 K170 R171E163-D167 WeakPolarHBondContact O-CB 3.42Å; E163-D167 PolarHBondContact O-N 3.4Å; E164-D167 PolarHBondContact O-N 2.92Å; L165-D167 VanDerWaalsContact C-N 3.32Å; D167-K170 PolarHBondContact O-N 3.4Å; D167-K170 WeakPolarHBondContact OD1-CD 3.45Å; D167-K170 WeakPolarHBondContact OD1-CE 3.3Å; D167-K170 IonicContact OD1-NZ 3.87Å; D167-K170 PolarHBondContact OD1-NZ 3.41Å; D167-R171 WeakPolarHBondContact O-CB 3.27Å; D167-R171 WeakPolarHBondContact O-CG 3.32Å; D167-R171 PolarHBondContact O-N 2.75Å; D167-R171 IonicContact OD2-NH1 2.63Å; D167-R171 PolarHBondContact OD2-NH1 2.84Å
168M93.4Very high93.1Very high92 Ų9299.2 Ų99.245%0.45348%0.477SS..Hα-helixtrans-62.6-41.8168.1-78.9-171.6-88.200111.4E164 L165 R171 M172E164-M168 HydrophobicContact CB-CE 4.27Å; E164-M168 WeakPolarHBondContact O-CB 3.43Å; E164-M168 WeakPolarHBondContact O-CG 3.07Å; E164-M168 PolarHBondContact O-N 2.95Å; L165-M168 HydrophobicContact CD2-CE 4.03Å; L165-M168 HydrophobicContact CG-CE 4.44Å; M168-R171 PolarHBondContact O-N 3Å; M168-M172 WeakPolarHBondContact O-CB 3.5Å; M168-M172 PolarHBondContact O-N 3.35Å
169R94.8Very high93.6Very high129 Ų12999.3 Ų99.349%0.48748%0.477SS..Hα-helixtrans-61.8-48.9172.8-76172.3-72.6-137.65.9111.5L165 G166 R171 M172 D173L165-R169 VanDerWaalsContact CB-NH2 3.33Å; L165-R169 WeakPolarHBondContact O-CB 3.3Å; L165-R169 VanDerWaalsContact O-CG 3.26Å; L165-R169 WeakPolarHBondContact O-CG 3.46Å; L165-R169 PolarHBondContact O-N 2.91Å; L165-R169 PolarHBondContact O-NE 3.17Å; G166-R169 PolarHBondContact O-N 3.08Å; R169-R171 VanDerWaalsContact C-N 3.32Å; R169-R171 PolarHBondContact O-N 3.37Å; R169-M172 PolarHBondContact O-N 3.13Å; R169-D173 WeakPolarHBondContact O-CB 3.5Å; R169-D173 PolarHBondContact O-N 3.04Å
170K95.4Very high93.9Very high127 Ų127100.8 Ų100.855%0.55248%0.475SS*.Hα-helixtrans-55.5-43.9174.3-68.7166.9-145.2161.70112.2G166 D167 F174G166-K170 VanDerWaalsContact O-CG 3.28Å; G166-K170 WeakPolarHBondContact O-CG 3.41Å; G166-K170 PolarHBondContact O-N 3.06Å; D167-K170 PolarHBondContact O-N 3.4Å; D167-K170 WeakPolarHBondContact OD1-CD 3.45Å; D167-K170 WeakPolarHBondContact OD1-CE 3.3Å; D167-K170 IonicContact OD1-NZ 3.87Å; D167-K170 PolarHBondContact OD1-NZ 3.41Å; K170-F174 VanDerWaalsContact O-CB 3.31Å; K170-F174 WeakPolarHBondContact O-CB 3.41Å; K170-F174 PolarHBondContact O-N 3.26Å
171R95.1Very high94.3Very high129 Ų129100.2 Ų100.249%0.48747%0.472SS..Hα-helixtrans-65.7-43.4177.5-76.4-174.2-71.1-87.95.6112.3D167 M168 R169 F174 T175D167-R171 WeakPolarHBondContact O-CB 3.27Å; D167-R171 WeakPolarHBondContact O-CG 3.32Å; D167-R171 PolarHBondContact O-N 2.75Å; D167-R171 IonicContact OD2-NH1 2.63Å; D167-R171 PolarHBondContact OD2-NH1 2.84Å; M168-R171 PolarHBondContact O-N 3Å; R169-R171 VanDerWaalsContact C-N 3.32Å; R169-R171 PolarHBondContact O-N 3.37Å; R171-F174 PolarHBondContact O-N 2.99Å; R171-T175 PolarHBondContact O-N 2.91Å; R171-T175 PolarHBondContact O-OG1 2.85Å
172M93.6Very high94.5Very high107 Ų10798.8 Ų98.853%0.52747%0.467SS..Hα-helixtrans-65.2-45.4177.2-175.9-177.871.800111.9M168 R169 F174 T175 Q176M168-M172 WeakPolarHBondContact O-CB 3.5Å; M168-M172 PolarHBondContact O-N 3.35Å; R169-M172 PolarHBondContact O-N 3.13Å; M172-F174 PolarHBondContact O-N 2.87Å; M172-T175 PolarHBondContact O-N 3.33Å; M172-T175 PolarHBondContact O-OG1 3.06Å; M172-Q176 VanDerWaalsContact O-CB 3.26Å; M172-Q176 WeakPolarHBondContact O-CB 3.37Å; M172-Q176 PolarHBondContact O-N 3.33Å
173D95.2Very high94.8Very high73 Ų7398.2 Ų98.239%0.3947%0.468SS..Hα-helixtrans-60.1-35.2174.5-78.97.9000112.1R169 K177R169-D173 WeakPolarHBondContact O-CB 3.5Å; R169-D173 PolarHBondContact O-N 3.04Å; D173-K177 WeakPolarHBondContact O-CB 3.38Å; D173-K177 VanDerWaalsContact O-CD 3.22Å; D173-K177 WeakPolarHBondContact O-CD 3.32Å; D173-K177 WeakPolarHBondContact O-CG 3.34Å; D173-K177 PolarHBondContact O-N 3.3Å
174F95.9Very high95Very high122 Ų12298.7 Ų98.754%0.53546%0.464SS..Hα-helixtrans-71-52.8177.6-179.2-94000111.3K170 R171 M172 Q176 K177 E178K170-F174 VanDerWaalsContact O-CB 3.31Å; K170-F174 WeakPolarHBondContact O-CB 3.41Å; K170-F174 PolarHBondContact O-N 3.26Å; R171-F174 PolarHBondContact O-N 2.99Å; M172-F174 PolarHBondContact O-N 2.87Å; F174-Q176 VanDerWaalsContact C-N 3.31Å; F174-Q176 PolarHBondContact O-N 3.35Å; F174-K177 PolarHBondContact O-N 3.16Å; F174-K177 VanDerWaalsContact O-N 3.1Å; F174-E178 HydrophobicContact CD1-CG 4.38Å; F174-E178 HydrophobicContact CE1-CG 3.97Å; F174-E178 WeakPolarHBondContact CE1-OE1 3.41Å; F174-E178 VanDerWaalsContact CE1-OE2 3.26Å; F174-E178 WeakPolarHBondContact CE1-OE2 3.48Å; F174-E178 HydrophobicContact CZ-CG 4.16Å; F174-E178 WeakPolarHBondContact CZ-OE1 3.26Å; F174-E178 PolarHBondContact O-N 2.98Å
175T94.3Very high95.2Very high63 Ų6398.4 Ų98.439%0.38746%0.461SS..Hα-helixtrans-65-34.5178.656.30000112.2R171 M172 E178 H179R171-T175 PolarHBondContact O-N 2.91Å; R171-T175 PolarHBondContact O-OG1 2.85Å; M172-T175 PolarHBondContact O-N 3.33Å; M172-T175 PolarHBondContact O-OG1 3.06Å; T175-E178 PolarHBondContact O-N 2.82Å; T175-H179 WeakPolarHBondContact O-CB 3.48Å; T175-H179 PolarHBondContact O-CD2 3.47Å; T175-H179 VanDerWaalsContact O-CG 3.25Å; T175-H179 PolarHBondContact O-N 2.96Å
176Q95.2Very high95.3Very high99 Ų9998.2 Ų98.246%0.46346%0.463SS..Hα-helixtrans-60-45.5171-179.6176.3-26.500111.3M172 F174 E178 H179 E180M172-Q176 VanDerWaalsContact O-CB 3.26Å; M172-Q176 WeakPolarHBondContact O-CB 3.37Å; M172-Q176 PolarHBondContact O-N 3.33Å; F174-Q176 VanDerWaalsContact C-N 3.31Å; F174-Q176 PolarHBondContact O-N 3.35Å; Q176-E178 PolarHBondContact O-N 3.34Å; Q176-H179 PolarHBondContact O-N 2.84Å; Q176-E180 HydrophobicContact CG-CG 4.4Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.28Å; Q176-E180 PolarHBondContact NE2-OE1 2.8Å; Q176-E180 WeakPolarHBondContact O-CG 3.4Å; Q176-E180 PolarHBondContact O-N 3.27Å
177K96.1Very high95.4Very high124 Ų124101.5 Ų101.554%0.53947%0.474SS..Hα-helixtrans-64.8-38.7177.7-74162.2-168150.90112.2D173 F174 E180 E181D173-K177 WeakPolarHBondContact O-CB 3.38Å; D173-K177 VanDerWaalsContact O-CD 3.22Å; D173-K177 WeakPolarHBondContact O-CD 3.32Å; D173-K177 WeakPolarHBondContact O-CG 3.34Å; D173-K177 PolarHBondContact O-N 3.3Å; F174-K177 PolarHBondContact O-N 3.16Å; F174-K177 VanDerWaalsContact O-N 3.1Å; K177-E180 PolarHBondContact O-N 3.37Å; K177-E181 WeakPolarHBondContact O-CB 3.47Å; K177-E181 PolarHBondContact O-N 2.65Å
178E95.9Very high95.5Very high96 Ų96102.5 Ų102.545%0.44948%0.479SS..Hα-helixtrans-64-39.8172.5-68.7-171129.600112.2F174 T175 Q176 E181 T182F174-E178 HydrophobicContact CD1-CG 4.38Å; F174-E178 HydrophobicContact CE1-CG 3.97Å; F174-E178 WeakPolarHBondContact CE1-OE1 3.41Å; F174-E178 VanDerWaalsContact CE1-OE2 3.26Å; F174-E178 WeakPolarHBondContact CE1-OE2 3.48Å; F174-E178 HydrophobicContact CZ-CG 4.16Å; F174-E178 WeakPolarHBondContact CZ-OE1 3.26Å; F174-E178 PolarHBondContact O-N 2.98Å; T175-E178 PolarHBondContact O-N 2.82Å; Q176-E178 PolarHBondContact O-N 3.34Å; E178-E181 PolarHBondContact O-N 3.01Å; E178-T182 WeakPolarHBondContact O-CB 3.37Å; E178-T182 WeakPolarHBondContact O-CG2 3.17Å; E178-T182 PolarHBondContact O-N 2.82Å; E178-T182 PolarHBondContact O-OG1 3.32Å
179H95.4Very high95.6Very high119 Ų119100 Ų10055%0.55147%0.471SS*.Hα-helixtrans-66.5-43.2174.1-70-40.3000112.4T175 Q176 E181 T182 L183T175-H179 WeakPolarHBondContact O-CB 3.48Å; T175-H179 PolarHBondContact O-CD2 3.47Å; T175-H179 VanDerWaalsContact O-CG 3.25Å; T175-H179 PolarHBondContact O-N 2.96Å; Q176-H179 PolarHBondContact O-N 2.84Å; H179-E181 PolarHBondContact O-N 3.02Å; H179-T182 WeakPolarHBondContact CA-OG1 3.31Å; H179-T182 PolarHBondContact O-N 2.71Å; H179-T182 PolarHBondContact O-OG1 3.07Å; H179-T182 VanDerWaalsContact O-OG1 3.1Å; H179-L183 VanDerWaalsContact O-CB 3.3Å; H179-L183 WeakPolarHBondContact O-CB 3.32Å; H179-L183 VanDerWaalsContact O-CG 3.23Å; H179-L183 WeakPolarHBondContact O-CG 3.39Å; H179-L183 PolarHBondContact O-N 2.92Å
180E96.3Very high95.7Very high86 Ų8699.4 Ų99.440%0.40247%0.472SS..Hα-helixtrans-63.2-38.5174-74.2176.4-163.100112.5Q176 K177 R184Q176-E180 HydrophobicContact CG-CG 4.4Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.28Å; Q176-E180 PolarHBondContact NE2-OE1 2.8Å; Q176-E180 WeakPolarHBondContact O-CG 3.4Å; Q176-E180 PolarHBondContact O-N 3.27Å; K177-E180 PolarHBondContact O-N 3.37Å; E180-R184 VanDerWaalsContact O-CB 3.31Å; E180-R184 WeakPolarHBondContact O-CB 3.39Å; E180-R184 PolarHBondContact O-N 3.49Å
181E96.4Very high95.7Very high95 Ų9598.2 Ų98.244%0.44447%0.469SS..Hα-helixtrans-73.5-37.9177.9-162.9-173.4148.400112.1K177 E178 H179 R184 K185K177-E181 WeakPolarHBondContact O-CB 3.47Å; K177-E181 PolarHBondContact O-N 2.65Å; E178-E181 PolarHBondContact O-N 3.01Å; H179-E181 PolarHBondContact O-N 3.02Å; E181-R184 PolarHBondContact O-N 2.86Å; E181-K185 HydrophobicContact CG-CD 4.45Å; E181-K185 WeakPolarHBondContact O-CB 3.42Å; E181-K185 VanDerWaalsContact O-CG 3.29Å; E181-K185 WeakPolarHBondContact O-CG 3.35Å; E181-K185 PolarHBondContact O-N 3.38Å; E181-K185 WeakPolarHBondContact OE1-CE 3.45Å; E181-K185 IonicContact OE1-NZ 2.72Å; E181-K185 PolarHBondContact OE1-NZ 3.42Å
182T96.4Very high95.8Very high70 Ų7099.6 Ų99.643%0.42947%0.474SS..Hα-helixtrans-69.3-40.317547.60000112.2E178 H179 R184 K185 T186E178-T182 WeakPolarHBondContact O-CB 3.37Å; E178-T182 WeakPolarHBondContact O-CG2 3.17Å; E178-T182 PolarHBondContact O-N 2.82Å; E178-T182 PolarHBondContact O-OG1 3.32Å; H179-T182 WeakPolarHBondContact CA-OG1 3.31Å; H179-T182 PolarHBondContact O-N 2.71Å; H179-T182 PolarHBondContact O-OG1 3.07Å; H179-T182 VanDerWaalsContact O-OG1 3.1Å; T182-R184 VanDerWaalsContact C-N 3.34Å; T182-R184 PolarHBondContact O-N 3.2Å; T182-K185 PolarHBondContact O-N 2.85Å; T182-T186 WeakPolarHBondContact O-CG2 3.39Å; T182-T186 PolarHBondContact O-N 3.01Å; T182-T186 PolarHBondContact O-OG1 2.97Å; T182-T186 VanDerWaalsContact O-OG1 3.1Å
183L95.8Very high95.9Very high118 Ų11899.6 Ų99.662%0.61848%0.476SS*.Hα-helixtrans-60.7-41.3170.8-74.6169.9000112H179 T186 E187H179-L183 VanDerWaalsContact O-CB 3.3Å; H179-L183 WeakPolarHBondContact O-CB 3.32Å; H179-L183 VanDerWaalsContact O-CG 3.23Å; H179-L183 WeakPolarHBondContact O-CG 3.39Å; H179-L183 PolarHBondContact O-N 2.92Å; L183-T186 WeakPolarHBondContact CA-OG1 3.49Å; L183-T186 PolarHBondContact O-N 2.87Å; L183-T186 PolarHBondContact O-OG1 3.18Å; L183-E187 WeakPolarHBondContact O-CB 3.35Å; L183-E187 PolarHBondContact O-N 2.95Å
184R96.6Very high96Very high147 Ų14799.7 Ų99.756%0.55547%0.474SS*.Hα-helixtrans-63.2-45.9175.6-165.4-176.8-49.9161.610.3111.6E180 E181 T182 T186 E187 D188E180-R184 VanDerWaalsContact O-CB 3.31Å; E180-R184 WeakPolarHBondContact O-CB 3.39Å; E180-R184 PolarHBondContact O-N 3.49Å; E181-R184 PolarHBondContact O-N 2.86Å; T182-R184 VanDerWaalsContact C-N 3.34Å; T182-R184 PolarHBondContact O-N 3.2Å; R184-T186 VanDerWaalsContact C-N 3.35Å; R184-T186 PolarHBondContact O-N 3.23Å; R184-E187 PolarHBondContact O-N 2.97Å; R184-D188 VanDerWaalsContact O-CB 3.29Å; R184-D188 WeakPolarHBondContact O-CB 3.49Å; R184-D188 PolarHBondContact O-N 3.3Å
185K96.7Very high95.9Very high111 Ų11195.4 Ų95.448%0.48346%0.461SS..Hα-helixtrans-61.5-39177.4-74.9166.3-177.61650112.7E181 T182 S189E181-K185 HydrophobicContact CG-CD 4.45Å; E181-K185 WeakPolarHBondContact O-CB 3.42Å; E181-K185 VanDerWaalsContact O-CG 3.29Å; E181-K185 WeakPolarHBondContact O-CG 3.35Å; E181-K185 PolarHBondContact O-N 3.38Å; E181-K185 WeakPolarHBondContact OE1-CE 3.45Å; E181-K185 IonicContact OE1-NZ 2.72Å; E181-K185 PolarHBondContact OE1-NZ 3.42Å; T182-K185 PolarHBondContact O-N 2.85Å; K185-S189 PolarHBondContact O-N 3.07Å; K185-S189 PolarHBondContact O-OG 3.44Å
186T94.3Very high96.1Very high81 Ų8194.6 Ų94.650%0.49746%0.458SS..Hα-helixtrans-73.4-40.5178.6510000112.2T182 L183 R184 S189 F190T182-T186 WeakPolarHBondContact O-CG2 3.39Å; T182-T186 PolarHBondContact O-N 3.01Å; T182-T186 PolarHBondContact O-OG1 2.97Å; T182-T186 VanDerWaalsContact O-OG1 3.1Å; L183-T186 WeakPolarHBondContact CA-OG1 3.49Å; L183-T186 PolarHBondContact O-N 2.87Å; L183-T186 PolarHBondContact O-OG1 3.18Å; R184-T186 VanDerWaalsContact C-N 3.35Å; R184-T186 PolarHBondContact O-N 3.23Å; T186-S189 WeakPolarHBondContact CA-OG 3.41Å; T186-S189 PolarHBondContact O-N 3.29Å; T186-S189 PolarHBondContact O-OG 2.9Å; T186-F190 WeakPolarHBondContact O-CB 3.41Å; T186-F190 PolarHBondContact O-N 3.04Å
187E95.9Very high96.1Very high87 Ų8794.9 Ų94.941%0.40746%0.462SS..Hα-helixtrans-62.8-44.6171.7-179.758-158.400111.3L183 R184 S189 F190 Q191L183-E187 WeakPolarHBondContact O-CB 3.35Å; L183-E187 PolarHBondContact O-N 2.95Å; R184-E187 PolarHBondContact O-N 2.97Å; E187-S189 VanDerWaalsContact C-N 3.27Å; E187-S189 PolarHBondContact O-N 3.13Å; E187-F190 PolarHBondContact O-N 3.47Å; E187-F190 VanDerWaalsContact O-N 3.09Å; E187-Q191 HydrophobicContact CG-CG 4.44Å; E187-Q191 WeakPolarHBondContact O-CG 3.45Å; E187-Q191 PolarHBondContact O-N 3.25Å; E187-Q191 VanDerWaalsContact OE1-CG 3.3Å; E187-Q191 WeakPolarHBondContact OE1-CG 3.29Å; E187-Q191 PolarHBondContact OE1-NE2 2.99Å
188D96.5Very high96.1Very high77 Ų7794.3 Ų94.341%0.41246%0.46SS..Hα-helixtrans-59.9-33.9174.8-76.4-26.9000112.1R184 R192R184-D188 VanDerWaalsContact O-CB 3.29Å; R184-D188 WeakPolarHBondContact O-CB 3.49Å; R184-D188 PolarHBondContact O-N 3.3Å; D188-R192 WeakPolarHBondContact O-CG 3.46Å; D188-R192 PolarHBondContact O-N 3.29Å; D188-R192 PolarHBondContact O-NE 2.66Å
189S95.9Very high96.1Very high41 Ų4197.3 Ų97.329%0.28747%0.467SS..Hα-helixtrans-71.1-47169.444.40000112.4K185 T186 E187 Q191 R192 D193K185-S189 PolarHBondContact O-N 3.07Å; K185-S189 PolarHBondContact O-OG 3.44Å; T186-S189 WeakPolarHBondContact CA-OG 3.41Å; T186-S189 PolarHBondContact O-N 3.29Å; T186-S189 PolarHBondContact O-OG 2.9Å; E187-S189 VanDerWaalsContact C-N 3.27Å; E187-S189 PolarHBondContact O-N 3.13Å; S189-Q191 VanDerWaalsContact C-N 3.31Å; S189-Q191 PolarHBondContact O-N 3.46Å; S189-R192 WeakPolarHBondContact O-CB 3.42Å; S189-R192 PolarHBondContact O-N 3.08Å; S189-D193 VanDerWaalsContact O-CG 3.32Å; S189-D193 PolarHBondContact O-N 3.32Å
190F96.8Very high96.1Very high115 Ų11596.3 Ų96.350%0.50446%0.463SS..Hα-helixtrans-58.9-41.6-179.6177.7-110.5000112T186 E187 D193 Q194T186-F190 WeakPolarHBondContact O-CB 3.41Å; T186-F190 PolarHBondContact O-N 3.04Å; E187-F190 PolarHBondContact O-N 3.47Å; E187-F190 VanDerWaalsContact O-N 3.09Å; F190-D193 PolarHBondContact O-N 2.83Å; F190-Q194 WeakPolarHBondContact O-CB 3.48Å; F190-Q194 PolarHBondContact O-N 2.84Å
191Q96.2Very high96.1Very high102 Ų10298.2 Ų98.248%0.47747%0.473SS..Hα-helixtrans-65.4-38.5174.9-68.4-173.819.600112.7E187 S189 A195E187-Q191 HydrophobicContact CG-CG 4.44Å; E187-Q191 WeakPolarHBondContact O-CG 3.45Å; E187-Q191 PolarHBondContact O-N 3.25Å; E187-Q191 VanDerWaalsContact OE1-CG 3.3Å; E187-Q191 WeakPolarHBondContact OE1-CG 3.29Å; E187-Q191 PolarHBondContact OE1-NE2 2.99Å; S189-Q191 VanDerWaalsContact C-N 3.31Å; S189-Q191 PolarHBondContact O-N 3.46Å; Q191-A195 WeakPolarHBondContact O-CB 3.5Å; Q191-A195 PolarHBondContact O-N 2.87Å
192R96.3Very high96.1Very high158 Ų158102 Ų10260%0.59648%0.483SS*.Hα-helixtrans-65.4-45.7175.2-80.6177.3-72.4151-1.8111.8D188 S189 A195 S196D188-R192 WeakPolarHBondContact O-CG 3.46Å; D188-R192 PolarHBondContact O-N 3.29Å; D188-R192 PolarHBondContact O-NE 2.66Å; S189-R192 WeakPolarHBondContact O-CB 3.42Å; S189-R192 PolarHBondContact O-N 3.08Å; R192-A195 CarbonylContact O-C 3.5Å; R192-A195 WeakPolarHBondContact O-CB 3.39Å; R192-A195 PolarHBondContact O-N 3.46Å; R192-S196 PolarHBondContact O-N 3.3Å
193D95.8Very high96.1Very high108 Ų108103.4 Ų103.458%0.57849%0.487SS*.Hα-helixtrans-68.3-44.7-179.1-64.1-15.9000110.8S189 F190 A195 S196 L197S189-D193 VanDerWaalsContact O-CG 3.32Å; S189-D193 PolarHBondContact O-N 3.32Å; F190-D193 PolarHBondContact O-N 2.83Å; D193-A195 PolarHBondContact O-N 2.61Å; D193-S196 PolarHBondContact O-N 2.91Å; D193-L197 WeakPolarHBondContact O-CB 3.36Å; D193-L197 PolarHBondContact O-N 3.26Å
194Q96.4Very high96.1Very high75 Ų75103.3 Ų103.335%0.3549%0.486SS..Hα-helixtrans-58.6-37.7172.3-167.3-160.8109.100111.4F190 K198F190-Q194 WeakPolarHBondContact O-CB 3.48Å; F190-Q194 PolarHBondContact O-N 2.84Å; Q194-K198 HydrophobicContact CG-CD 4.32Å; Q194-K198 VanDerWaalsContact O-CB 3.27Å; Q194-K198 WeakPolarHBondContact O-CB 3.42Å; Q194-K198 WeakPolarHBondContact O-CD 3.43Å; Q194-K198 WeakPolarHBondContact O-CG 3.39Å; Q194-K198 PolarHBondContact O-N 3.26Å
195A95.8Very high96Very high31 Ų3199.2 Ų99.226%0.25648%0.479SS..Hα-helixtrans-71.9-33.5174.200000112.8Q191 R192 D193 R199Q191-A195 WeakPolarHBondContact O-CB 3.5Å; Q191-A195 PolarHBondContact O-N 2.87Å; R192-A195 CarbonylContact O-C 3.5Å; R192-A195 WeakPolarHBondContact O-CB 3.39Å; R192-A195 PolarHBondContact O-N 3.46Å; D193-A195 PolarHBondContact O-N 2.61Å; A195-R199 VanDerWaalsContact O-CG 3.32Å; A195-R199 WeakPolarHBondContact O-CG 3.29Å; A195-R199 PolarHBondContact O-N 2.91Å; A195-R199 VanDerWaalsContact O-N 3.15Å; A195-R199 PolarHBondContact O-NH1 3.01Å
196S96.8Very high96Very high47 Ų4798.9 Ų98.933%0.32948%0.482SS..Hα-helixtrans-66.7-53174.3-155.30000110.8R192 D193 K198 R199 E200R192-S196 PolarHBondContact O-N 3.3Å; D193-S196 PolarHBondContact O-N 2.91Å; S196-K198 VanDerWaalsContact C-N 3.27Å; S196-K198 PolarHBondContact O-N 3.03Å; S196-R199 CarbonylContact O-C 3.55Å; S196-R199 WeakPolarHBondContact O-CA 3.41Å; S196-R199 WeakPolarHBondContact O-CB 3.39Å; S196-R199 PolarHBondContact O-N 3Å; S196-E200 VanDerWaalsContact C-OE1 3.25Å; S196-E200 VanDerWaalsContact CB-OE1 3.31Å; S196-E200 WeakPolarHBondContact CB-OE1 3.4Å; S196-E200 PolarHBondContact O-N 3.07Å; S196-E200 PolarHBondContact OG-OE1 3.43Å
197L96.6Very high96.1Very high105 Ų105100.1 Ų100.155%0.5548%0.482SS..Hα-helixtrans-55.9-40.8176.6-173.864.7000112D193 R199 E200 M201D193-L197 WeakPolarHBondContact O-CB 3.36Å; D193-L197 PolarHBondContact O-N 3.26Å; L197-R199 VanDerWaalsContact C-N 3.32Å; L197-R199 PolarHBondContact O-N 2.81Å; L197-E200 PolarHBondContact O-N 3.22Å; L197-M201 HydrophobicContact CD1-CG 4.42Å; L197-M201 WeakPolarHBondContact O-CB 3.32Å; L197-M201 VanDerWaalsContact O-CG 3.3Å; L197-M201 WeakPolarHBondContact O-CG 3.25Å; L197-M201 PolarHBondContact O-N 3.31Å
198K95.4Very high96.1Very high112 Ų112102 Ų10249%0.48749%0.491SS..Hα-helixtrans-65-28.1173.3-78.6171.4175.8177.40113.7Q194 S196 R202Q194-K198 HydrophobicContact CG-CD 4.32Å; Q194-K198 VanDerWaalsContact O-CB 3.27Å; Q194-K198 WeakPolarHBondContact O-CB 3.42Å; Q194-K198 WeakPolarHBondContact O-CD 3.43Å; Q194-K198 WeakPolarHBondContact O-CG 3.39Å; Q194-K198 PolarHBondContact O-N 3.26Å; S196-K198 VanDerWaalsContact C-N 3.27Å; S196-K198 PolarHBondContact O-N 3.03Å; K198-R202 WeakPolarHBondContact O-CD 3.39Å; K198-R202 WeakPolarHBondContact O-CG 3.28Å
199R96.2Very high96.1Very high158 Ų158101.5 Ų101.560%0.59649%0.488SS*.Hα-helixtrans-78.9-43.5172.5-70.1175.3-161102.5-6.6111.4A195 S196 L197 R202 L203A195-R199 VanDerWaalsContact O-CG 3.32Å; A195-R199 WeakPolarHBondContact O-CG 3.29Å; A195-R199 PolarHBondContact O-N 2.91Å; A195-R199 VanDerWaalsContact O-N 3.15Å; A195-R199 PolarHBondContact O-NH1 3.01Å; S196-R199 CarbonylContact O-C 3.55Å; S196-R199 WeakPolarHBondContact O-CA 3.41Å; S196-R199 WeakPolarHBondContact O-CB 3.39Å; S196-R199 PolarHBondContact O-N 3Å; L197-R199 VanDerWaalsContact C-N 3.32Å; L197-R199 PolarHBondContact O-N 2.81Å; R199-R202 WeakPolarHBondContact O-CB 3.35Å; R199-R202 PolarHBondContact O-N 2.82Å; R199-L203 WeakPolarHBondContact O-CB 3.36Å; R199-L203 PolarHBondContact O-N 3.33Å
200E96Very high96.1Very high99 Ų99102.3 Ų102.346%0.46350%0.497SS..Hα-helixtrans-62-48.1179.4-71.1156.1-13000111.4S196 L197 R202 L203 M204S196-E200 VanDerWaalsContact C-OE1 3.25Å; S196-E200 VanDerWaalsContact CB-OE1 3.31Å; S196-E200 WeakPolarHBondContact CB-OE1 3.4Å; S196-E200 PolarHBondContact O-N 3.07Å; S196-E200 PolarHBondContact OG-OE1 3.43Å; L197-E200 PolarHBondContact O-N 3.22Å; E200-R202 VanDerWaalsContact C-N 3.28Å; E200-R202 PolarHBondContact O-N 3.04Å; E200-L203 WeakPolarHBondContact O-CB 3.47Å; E200-L203 PolarHBondContact O-N 2.91Å; E200-M204 WeakPolarHBondContact O-CG 3.21Å; E200-M204 PolarHBondContact O-N 2.82Å
201M94.6Very high96.1Very high125 Ų125103.3 Ų103.362%0.61650%0.501SS*.Hα-helixtrans-59.8-36.6174.6-71.4-60.9-62.200112.7L197 C205L197-M201 HydrophobicContact CD1-CG 4.42Å; L197-M201 WeakPolarHBondContact O-CB 3.32Å; L197-M201 VanDerWaalsContact O-CG 3.3Å; L197-M201 WeakPolarHBondContact O-CG 3.25Å; L197-M201 PolarHBondContact O-N 3.31Å; M201-C205 VanDerWaalsContact O-CB 3.24Å; M201-C205 WeakPolarHBondContact O-CB 3.43Å; M201-C205 PolarHBondContact O-N 3.32Å
202R96.5Very high96.1Very high175 Ų175103.7 Ų103.766%0.6650%0.504SS*.Hα-helixtrans-69-38.7173.6-74.5170.9-177.3177.8-0.8112K198 R199 E200 N206K198-R202 WeakPolarHBondContact O-CD 3.39Å; K198-R202 WeakPolarHBondContact O-CG 3.28Å; R199-R202 WeakPolarHBondContact O-CB 3.35Å; R199-R202 PolarHBondContact O-N 2.82Å; E200-R202 VanDerWaalsContact C-N 3.28Å; E200-R202 PolarHBondContact O-N 3.04Å; R202-N206 VanDerWaalsContact O-CB 3.27Å; R202-N206 WeakPolarHBondContact O-CB 3.32Å; R202-N206 PolarHBondContact O-N 2.99Å; R202-N206 PolarHBondContact O-ND2 2.84Å
203L96.8Very high96.1Very high99 Ų99102.1 Ų102.152%0.51850%0.502SS..Hα-helixtrans-65.3-48177.4-178.862.3000110.9R199 E200 N206 Q207R199-L203 WeakPolarHBondContact O-CB 3.36Å; R199-L203 PolarHBondContact O-N 3.33Å; E200-L203 WeakPolarHBondContact O-CB 3.47Å; E200-L203 PolarHBondContact O-N 2.91Å; L203-N206 PolarHBondContact O-N 3.23Å; L203-Q207 HydrophobicContact CD1-CG 4.45Å; L203-Q207 WeakPolarHBondContact O-CB 3.36Å; L203-Q207 VanDerWaalsContact O-CG 3.32Å; L203-Q207 WeakPolarHBondContact O-CG 3.4Å; L203-Q207 PolarHBondContact O-N 3.42Å
204M95.9Very high96.2Very high117 Ų117102.3 Ų102.358%0.57650%0.502SS*.Hα-helixtrans-58.2-50.5175.6-69.9-59.3-60.300111.5E200 N206 Q207 E208E200-M204 WeakPolarHBondContact O-CG 3.21Å; E200-M204 PolarHBondContact O-N 2.82Å; M204-N206 VanDerWaalsContact C-N 3.35Å; M204-N206 PolarHBondContact O-N 3.4Å; M204-Q207 PolarHBondContact O-N 2.88Å; M204-E208 WeakPolarHBondContact O-CB 3.38Å; M204-E208 PolarHBondContact O-N 3.25Å
205C95.1Very high96.1Very high61 Ų61102.2 Ų102.241%0.41250%0.504SS..Hα-helixtrans-60-42.3177.4-177.40000112.1M201 Q207 E208 I209M201-C205 VanDerWaalsContact O-CB 3.24Å; M201-C205 WeakPolarHBondContact O-CB 3.43Å; M201-C205 PolarHBondContact O-N 3.32Å; C205-Q207 PolarHBondContact O-N 3.1Å; C205-E208 PolarHBondContact O-N 2.63Å; C205-I209 WeakPolarHBondContact O-CB 3.41Å; C205-I209 WeakPolarHBondContact O-CD1 3.36Å; C205-I209 WeakPolarHBondContact O-CG1 3.48Å; C205-I209 PolarHBondContact O-N 3.28Å
206N96.2Very high96.2Very high103 Ų103106.4 Ų106.455%0.55152%0.518SS*.Hα-helixtrans-65.2-38.2175.5-75.9-24.2000112.9R202 L203 M204 A210R202-N206 VanDerWaalsContact O-CB 3.27Å; R202-N206 WeakPolarHBondContact O-CB 3.32Å; R202-N206 PolarHBondContact O-N 2.99Å; R202-N206 PolarHBondContact O-ND2 2.84Å; L203-N206 PolarHBondContact O-N 3.23Å; M204-N206 VanDerWaalsContact C-N 3.35Å; M204-N206 PolarHBondContact O-N 3.4Å; N206-A210 VanDerWaalsContact O-CB 3.26Å; N206-A210 WeakPolarHBondContact O-CB 3.42Å; N206-A210 PolarHBondContact O-N 3.06Å
207Q96.4Very high96.2Very high107 Ų107110.3 Ų110.350%0.553%0.531SS..Hα-helixtrans-67.1-42.3175.4-74.7175.60.700111.6L203 M204 C205 A210 K211L203-Q207 HydrophobicContact CD1-CG 4.45Å; L203-Q207 WeakPolarHBondContact O-CB 3.36Å; L203-Q207 VanDerWaalsContact O-CG 3.32Å; L203-Q207 WeakPolarHBondContact O-CG 3.4Å; L203-Q207 PolarHBondContact O-N 3.42Å; M204-Q207 PolarHBondContact O-N 2.88Å; C205-Q207 PolarHBondContact O-N 3.1Å; Q207-A210 PolarHBondContact O-N 3.14Å; Q207-K211 WeakPolarHBondContact O-CB 3.36Å; Q207-K211 PolarHBondContact O-N 2.93Å
208E95.8Very high96.2Very high128 Ų128109.9 Ų109.960%0.59853%0.526SS*.Hα-helixtrans-65.6-44177-168.6171.5-146.900111.4M204 C205 A210 K211 M212M204-E208 WeakPolarHBondContact O-CB 3.38Å; M204-E208 PolarHBondContact O-N 3.25Å; C205-E208 PolarHBondContact O-N 2.63Å; E208-A210 VanDerWaalsContact C-N 3.34Å; E208-A210 PolarHBondContact O-N 2.81Å; E208-K211 PolarHBondContact O-N 3.11Å; E208-M212 HydrophobicContact CG-CE 4.2Å; E208-M212 WeakPolarHBondContact O-CB 3.22Å; E208-M212 WeakPolarHBondContact O-CG 3.49Å; E208-M212 PolarHBondContact O-N 3.29Å
209I96Very high96.3Very high65 Ų65106.8 Ų106.833%0.33352%0.521SS..Hα-helixtrans-60.8-41171.8-70.5167.1000111.4C205 M212 K213C205-I209 WeakPolarHBondContact O-CB 3.41Å; C205-I209 WeakPolarHBondContact O-CD1 3.36Å; C205-I209 WeakPolarHBondContact O-CG1 3.48Å; C205-I209 PolarHBondContact O-N 3.28Å; I209-M212 HydrophobicContact CG1-CE 4.24Å; I209-K213 HydrophobicContact CG2-CD 4.15Å; I209-K213 WeakPolarHBondContact O-CB 3.44Å; I209-K213 VanDerWaalsContact O-CG 3.26Å; I209-K213 WeakPolarHBondContact O-CG 3.17Å; I209-K213 PolarHBondContact O-N 3.33Å
210A96.6Very high96.3Very high59 Ų59101.7 Ų101.749%0.48851%0.508SS..Hα-helixtrans-66.1-41.3177.500000111.8N206 Q207 E208 K213 L214N206-A210 VanDerWaalsContact O-CB 3.26Å; N206-A210 WeakPolarHBondContact O-CB 3.42Å; N206-A210 PolarHBondContact O-N 3.06Å; Q207-A210 PolarHBondContact O-N 3.14Å; E208-A210 VanDerWaalsContact C-N 3.34Å; E208-A210 PolarHBondContact O-N 2.81Å; A210-K213 PolarHBondContact O-N 2.9Å; A210-L214 PolarHBondContact O-N 3.02Å
211K96.7Very high96.4Very high135 Ų13599.5 Ų99.559%0.58751%0.506SS*.Hα-helixtrans-65.4-51.5175.3-171.1-171.1171.2-167.80111.5Q207 E208 K213 L214 D215Q207-K211 WeakPolarHBondContact O-CB 3.36Å; Q207-K211 PolarHBondContact O-N 2.93Å; E208-K211 PolarHBondContact O-N 3.11Å; K211-K213 PolarHBondContact O-N 2.96Å; K211-L214 WeakPolarHBondContact O-CA 3.27Å; K211-L214 PolarHBondContact O-N 2.89Å; K211-D215 WeakPolarHBondContact CE-OD2 3.49Å; K211-D215 VanDerWaalsContact O-CG 3.3Å; K211-D215 PolarHBondContact O-N 3.37Å
212M95.9Very high96.5Very high110 Ų11099.3 Ų99.354%0.54250%0.502SS..Hα-helixtrans-56.4-36.4176.8-73.7-170.5-6700112.2E208 I209 H216E208-M212 HydrophobicContact CG-CE 4.2Å; E208-M212 WeakPolarHBondContact O-CB 3.22Å; E208-M212 WeakPolarHBondContact O-CG 3.49Å; E208-M212 PolarHBondContact O-N 3.29Å; I209-M212 HydrophobicContact CG1-CE 4.24Å; M212-H216 WeakPolarHBondContact O-CB 3.36Å; M212-H216 PolarHBondContact O-N 3.32Å
213K96.4Very high96.6Very high126 Ų12697.5 Ų97.555%0.54850%0.503SS..Hα-helixtrans-64-47172-78.4173.1179.7179.80112I209 A210 K211 H216 H217I209-K213 HydrophobicContact CG2-CD 4.15Å; I209-K213 WeakPolarHBondContact O-CB 3.44Å; I209-K213 VanDerWaalsContact O-CG 3.26Å; I209-K213 WeakPolarHBondContact O-CG 3.17Å; I209-K213 PolarHBondContact O-N 3.33Å; A210-K213 PolarHBondContact O-N 2.9Å; K211-K213 PolarHBondContact O-N 2.96Å; K213-H216 PolarHBondContact O-N 2.92Å; K213-H217 PolarHBondContact O-N 3.1Å; K213-H217 PolarHBondContact O-ND1 3.42Å
214L97.3Very high96.6Very high112 Ų11298.3 Ų98.359%0.58650%0.504SS*.Hα-helixtrans-63.2-49.3179.2-173.1149.3000111.4A210 K211 H216 H217 E218A210-L214 PolarHBondContact O-N 3.02Å; K211-L214 WeakPolarHBondContact O-CA 3.27Å; K211-L214 PolarHBondContact O-N 2.89Å; L214-H216 VanDerWaalsContact C-N 3.26Å; L214-H216 PolarHBondContact O-N 2.62Å; L214-H217 PolarHBondContact O-N 3.47Å; L214-H217 VanDerWaalsContact O-N 3.13Å; L214-E218 PolarHBondContact O-N 2.93Å
215D96.3Very high96.7Very high73 Ų7396.4 Ų96.439%0.3950%0.502SS..Hα-helixtrans-57-40.2177.3-62.9-9.9000110.9K211 A219K211-D215 WeakPolarHBondContact CE-OD2 3.49Å; K211-D215 VanDerWaalsContact O-CG 3.3Å; K211-D215 PolarHBondContact O-N 3.37Å; D215-A219 WeakPolarHBondContact O-CB 3.14Å; D215-A219 PolarHBondContact O-N 2.77Å
216H96.3Very high96.8Very high119 Ų11996.4 Ų96.455%0.55151%0.507SS*.Hα-helixtrans-68-43.7174.9-179.769000113.3M212 K213 L214 E218 A219 V220M212-H216 WeakPolarHBondContact O-CB 3.36Å; M212-H216 PolarHBondContact O-N 3.32Å; K213-H216 PolarHBondContact O-N 2.92Å; L214-H216 VanDerWaalsContact C-N 3.26Å; L214-H216 PolarHBondContact O-N 2.62Å; H216-E218 VanDerWaalsContact C-N 3.32Å; H216-E218 PolarHBondContact O-N 3.07Å; H216-A219 PolarHBondContact O-N 3.48Å; H216-V220 WeakPolarHBondContact O-CG2 3.37Å; H216-V220 PolarHBondContact O-N 3.39Å
217H97.3Very high96.9Very high128 Ų12896.1 Ų96.159%0.59351%0.505SS*.Hα-helixtrans-64.6-37.2176.9-75.969.1000111.4K213 L214 V220 A221K213-H217 PolarHBondContact O-N 3.1Å; K213-H217 PolarHBondContact O-ND1 3.42Å; L214-H217 PolarHBondContact O-N 3.47Å; L214-H217 VanDerWaalsContact O-N 3.13Å; H217-V220 PolarHBondContact O-N 3.24Å; H217-A221 WeakPolarHBondContact O-CB 3.33Å; H217-A221 PolarHBondContact O-N 2.84Å
218E97.2Very high97Very high97 Ų9794.3 Ų94.345%0.45350%0.501SS..Hα-helixtrans-67.3-39.2175.1-157.2-163.9159.600111.7L214 H216 A221 K222L214-E218 PolarHBondContact O-N 2.93Å; H216-E218 VanDerWaalsContact C-N 3.32Å; H216-E218 PolarHBondContact O-N 3.07Å; E218-A221 PolarHBondContact O-N 2.83Å; E218-K222 WeakPolarHBondContact O-CB 3.45Å; E218-K222 WeakPolarHBondContact O-CD 3.32Å; E218-K222 VanDerWaalsContact O-CG 3.26Å; E218-K222 WeakPolarHBondContact O-CG 3.23Å; E218-K222 PolarHBondContact O-N 3.09Å; E218-K222 WeakPolarHBondContact OE1-CE 3.46Å; E218-K222 IonicContact OE1-NZ 2.81Å; E218-K222 PolarHBondContact OE1-NZ 3.04Å; E218-K222 IonicContact OE2-NZ 2.72Å
219A96.9Very high97.1Very high46 Ų4691.5 Ų91.538%0.3850%0.495SS..Hα-helixtrans-63.2-44173.800000112.3D215 H216 K222 M223D215-A219 WeakPolarHBondContact O-CB 3.14Å; D215-A219 PolarHBondContact O-N 2.77Å; H216-A219 PolarHBondContact O-N 3.48Å; A219-K222 PolarHBondContact O-N 3.11Å; A219-M223 WeakPolarHBondContact O-CG 3.41Å; A219-M223 PolarHBondContact O-N 2.91Å
220V96.9Very high97.2Very high52 Ų5291 Ų9132%0.31550%0.501SS..Hα-helixtrans-62.1-48.5175170.80000110.8H216 H217 K222 M223 E224H216-V220 WeakPolarHBondContact O-CG2 3.37Å; H216-V220 PolarHBondContact O-N 3.39Å; H217-V220 PolarHBondContact O-N 3.24Å; V220-K222 VanDerWaalsContact C-N 3.29Å; V220-K222 PolarHBondContact O-N 2.95Å; V220-M223 CarbonylContact O-C 3.53Å; V220-M223 WeakPolarHBondContact O-CA 3.45Å; V220-M223 WeakPolarHBondContact O-CB 3.42Å; V220-M223 PolarHBondContact O-N 3.48Å; V220-E224 HydrophobicContact CG1-CG 4.29Å; V220-E224 WeakPolarHBondContact O-CG 3.27Å; V220-E224 PolarHBondContact O-N 2.69Å
221A97.6Very high97.2Very high52 Ų5292.7 Ų92.743%0.4350%0.497SS..Hα-helixtrans-61.3-35.8178.300000112.8H217 E218 S225H217-A221 WeakPolarHBondContact O-CB 3.33Å; H217-A221 PolarHBondContact O-N 2.84Å; E218-A221 PolarHBondContact O-N 2.83Å; A221-S225 VanDerWaalsContact O-CB 3.29Å; A221-S225 WeakPolarHBondContact O-CB 3.33Å; A221-S225 PolarHBondContact O-N 2.72Å
222K97.5Very high97.3Very high121 Ų12193.5 Ų93.553%0.52650%0.501SS..Hα-helixtrans-64.8-42.5171.8-75.5166.5-176.9165.40111.8E218 A219 V220 S225 A226E218-K222 WeakPolarHBondContact O-CB 3.45Å; E218-K222 WeakPolarHBondContact O-CD 3.32Å; E218-K222 VanDerWaalsContact O-CG 3.26Å; E218-K222 WeakPolarHBondContact O-CG 3.23Å; E218-K222 PolarHBondContact O-N 3.09Å; E218-K222 WeakPolarHBondContact OE1-CE 3.46Å; E218-K222 IonicContact OE1-NZ 2.81Å; E218-K222 PolarHBondContact OE1-NZ 3.04Å; E218-K222 IonicContact OE2-NZ 2.72Å; A219-K222 PolarHBondContact O-N 3.11Å; V220-K222 VanDerWaalsContact C-N 3.29Å; V220-K222 PolarHBondContact O-N 2.95Å; K222-S225 PolarHBondContact O-N 2.96Å; K222-A226 WeakPolarHBondContact O-CB 3.27Å; K222-A226 PolarHBondContact O-N 2.75Å
223M97.2Very high97.4Very high137 Ų13794 Ų9468%0.67550%0.502SS*.Hα-helixtrans-64.6-43.4175.2-73.6174.357.400112.3A219 V220 A226 L227A219-M223 WeakPolarHBondContact O-CG 3.41Å; A219-M223 PolarHBondContact O-N 2.91Å; V220-M223 CarbonylContact O-C 3.53Å; V220-M223 WeakPolarHBondContact O-CA 3.45Å; V220-M223 WeakPolarHBondContact O-CB 3.42Å; V220-M223 PolarHBondContact O-N 3.48Å; M223-A226 PolarHBondContact O-N 3.11Å; M223-L227 WeakPolarHBondContact O-CB 3.38Å; M223-L227 PolarHBondContact O-N 3.23Å
224E98.1Very high97.4Very high116 Ų11693.6 Ų93.654%0.54250%0.497SS..Hα-helixtrans-64.1-40.1176.5-70.6177.8159.800111.9V220 L227 T228V220-E224 HydrophobicContact CG1-CG 4.29Å; V220-E224 WeakPolarHBondContact O-CG 3.27Å; V220-E224 PolarHBondContact O-N 2.69Å; E224-L227 PolarHBondContact O-N 3.47Å; E224-T228 WeakPolarHBondContact O-CB 3.4Å; E224-T228 WeakPolarHBondContact O-CG2 3.25Å; E224-T228 PolarHBondContact O-N 2.94Å; E224-T228 PolarHBondContact O-OG1 3.39Å
225S97.6Very high97.4Very high78 Ų7891.7 Ų91.755%0.54549%0.487SS..Hα-helixtrans-62.1-48.1173.5-174.30000111.8A221 K222 L227 T228 S229A221-S225 VanDerWaalsContact O-CB 3.29Å; A221-S225 WeakPolarHBondContact O-CB 3.33Å; A221-S225 PolarHBondContact O-N 2.72Å; K222-S225 PolarHBondContact O-N 2.96Å; S225-L227 PolarHBondContact O-N 2.98Å; S225-T228 PolarHBondContact O-N 3.41Å; S225-T228 PolarHBondContact O-OG1 3.25Å; S225-S229 WeakPolarHBondContact O-CB 3.43Å; S225-S229 PolarHBondContact O-N 2.89Å
226A97.8Very high97.5Very high61 Ų6191.3 Ų91.350%0.50449%0.49SS..Hα-helixtrans-61.6-44.6175.900000112.4K222 M223 S229 A230K222-A226 WeakPolarHBondContact O-CB 3.27Å; K222-A226 PolarHBondContact O-N 2.75Å; M223-A226 PolarHBondContact O-N 3.11Å; A226-S229 WeakPolarHBondContact O-CB 3.41Å; A226-S229 PolarHBondContact O-N 2.88Å; A226-A230 WeakPolarHBondContact O-CB 3.26Å; A226-A230 PolarHBondContact O-N 2.85Å
227L97.3Very high97.6Very high97 Ų9790.4 Ų90.451%0.50849%0.489SS..Hα-helixtrans-65.7-41.8179.1172.6139.8000112.4M223 E224 S225 S229 A230 F231M223-L227 WeakPolarHBondContact O-CB 3.38Å; M223-L227 PolarHBondContact O-N 3.23Å; E224-L227 PolarHBondContact O-N 3.47Å; S225-L227 PolarHBondContact O-N 2.98Å; L227-S229 VanDerWaalsContact C-N 3.34Å; L227-A230 PolarHBondContact O-N 3.03Å; L227-F231 HydrophobicContact CD1-CE2 4.34Å; L227-F231 HydrophobicContact CD2-CD2 3.92Å; L227-F231 HydrophobicContact CD2-CE2 3.65Å; L227-F231 HydrophobicContact CG-CD2 4.14Å; L227-F231 HydrophobicContact CG-CE2 3.8Å; L227-F231 WeakPolarHBondContact O-CD2 3.49Å; L227-F231 PolarHBondContact O-N 3.1Å
228T98.1Very high97.6Very high68 Ų6888.1 Ų88.142%0.41748%0.481SS..Hα-helixtrans-71.7-27.5175.254.70000112.8E224 S225 K232E224-T228 WeakPolarHBondContact O-CB 3.4Å; E224-T228 WeakPolarHBondContact O-CG2 3.25Å; E224-T228 PolarHBondContact O-N 2.94Å; E224-T228 PolarHBondContact O-OG1 3.39Å; S225-T228 PolarHBondContact O-N 3.41Å; S225-T228 PolarHBondContact O-OG1 3.25Å; T228-K232 WeakPolarHBondContact O-CD 3.46Å; T228-K232 VanDerWaalsContact O-CG 3.31Å; T228-K232 WeakPolarHBondContact O-CG 3.49Å; T228-K232 PolarHBondContact O-N 2.98Å
229S97.9Very high97.6Very high70 Ų7088.2 Ų88.249%0.4948%0.482SS..Hα-helixtrans-68.5-48.3168.7-164.60000111.4S225 A226 L227 F231 K232 E233S225-S229 WeakPolarHBondContact O-CB 3.43Å; S225-S229 PolarHBondContact O-N 2.89Å; A226-S229 WeakPolarHBondContact O-CB 3.41Å; A226-S229 PolarHBondContact O-N 2.88Å; L227-S229 VanDerWaalsContact C-N 3.34Å; S229-F231 VanDerWaalsContact C-N 3.3Å; S229-F231 PolarHBondContact O-N 3.38Å; S229-K232 WeakPolarHBondContact O-CB 3.06Å; S229-K232 PolarHBondContact O-N 2.94Å; S229-K232 VanDerWaalsContact O-N 3.09Å; S229-E233 PolarHBondContact O-N 3.27Å
230A97.7Very high97.7Very high54 Ų5489.7 Ų89.745%0.44649%0.486SS..Hα-helixtrans-61.6-35.217900000112.6A226 L227 E233 R234A226-A230 WeakPolarHBondContact O-CB 3.26Å; A226-A230 PolarHBondContact O-N 2.85Å; L227-A230 PolarHBondContact O-N 3.03Å; A230-E233 PolarHBondContact O-N 2.82Å; A230-R234 WeakPolarHBondContact O-CB 3.44Å; A230-R234 PolarHBondContact O-N 3.31Å
231F97.8Very high97.7Very high95 Ų9591.7 Ų91.742%0.41749%0.494SS..Hα-helixtrans-68.3-38.7172.2-75.1-42.9000113.2L227 S229 E233 R234 D235L227-F231 HydrophobicContact CD1-CE2 4.34Å; L227-F231 HydrophobicContact CD2-CD2 3.92Å; L227-F231 HydrophobicContact CD2-CE2 3.65Å; L227-F231 HydrophobicContact CG-CD2 4.14Å; L227-F231 HydrophobicContact CG-CE2 3.8Å; L227-F231 WeakPolarHBondContact O-CD2 3.49Å; L227-F231 PolarHBondContact O-N 3.1Å; S229-F231 VanDerWaalsContact C-N 3.3Å; S229-F231 PolarHBondContact O-N 3.38Å; F231-E233 VanDerWaalsContact C-N 3.32Å; F231-E233 PolarHBondContact O-N 2.85Å; F231-R234 VanDerWaalsContact CD1-NH1 3.34Å; F231-R234 PolarHBondContact O-N 3.08Å; F231-D235 WeakPolarHBondContact O-CB 3.33Å; F231-D235 PolarHBondContact O-N 3.05Å
232K98.1Very high97.7Very high152 Ų15293.7 Ų93.766%0.66149%0.493SS*.Hα-helixtrans-63.1-39174.2-71.5165.3-175.9169.80112T228 S229 D235 S236T228-K232 WeakPolarHBondContact O-CD 3.46Å; T228-K232 VanDerWaalsContact O-CG 3.31Å; T228-K232 WeakPolarHBondContact O-CG 3.49Å; T228-K232 PolarHBondContact O-N 2.98Å; S229-K232 WeakPolarHBondContact O-CB 3.06Å; S229-K232 PolarHBondContact O-N 2.94Å; S229-K232 VanDerWaalsContact O-N 3.09Å; K232-D235 PolarHBondContact O-N 2.83Å; K232-S236 PolarHBondContact O-N 2.87Å; K232-S236 PolarHBondContact O-OG 2.8Å
233E97.6Very high97.8Very high120 Ų12090.9 Ų90.956%0.56149%0.486SS*.Hα-helixtrans-68.4-45.3175.1-174.4176.5-176.900111.9S229 A230 F231 D235 S236 L237S229-E233 PolarHBondContact O-N 3.27Å; A230-E233 PolarHBondContact O-N 2.82Å; F231-E233 VanDerWaalsContact C-N 3.32Å; F231-E233 PolarHBondContact O-N 2.85Å; E233-D235 PolarHBondContact O-N 3.48Å; E233-S236 PolarHBondContact O-N 2.8Å; E233-S236 PolarHBondContact O-OG 2.61Å; E233-L237 HydrophobicContact CG-CD1 3.99Å; E233-L237 HydrophobicContact CG-CG 4.45Å; E233-L237 WeakPolarHBondContact O-CB 3.39Å; E233-L237 VanDerWaalsContact O-CG 3.25Å; E233-L237 WeakPolarHBondContact O-CG 3.5Å; E233-L237 PolarHBondContact O-N 3.25Å
234R97.6Very high97.8Very high118 Ų11887.7 Ų87.745%0.44548%0.475SS..Hα-helixtrans-53.9-43.1171.8-175.9-156.567.7-168.9-7.8111.4A230 F231 L237 N238A230-R234 WeakPolarHBondContact O-CB 3.44Å; A230-R234 PolarHBondContact O-N 3.31Å; F231-R234 VanDerWaalsContact CD1-NH1 3.34Å; F231-R234 PolarHBondContact O-N 3.08Å; R234-L237 PolarHBondContact O-N 3.44Å; R234-N238 WeakPolarHBondContact O-CB 3.41Å; R234-N238 VanDerWaalsContact O-CG 3.23Å; R234-N238 PolarHBondContact O-N 3.21Å; R234-N238 PolarHBondContact O-ND2 3.24Å; R234-N238 VanDerWaalsContact O-ND2 3.16Å
235D97.8Very high97.7Very high71 Ų7186.4 Ų86.438%0.3847%0.471SS..Hα-helixtrans-77.4-32.5-174.5-67.1-15.1000112.6F231 K232 E233 E239F231-D235 WeakPolarHBondContact O-CB 3.33Å; F231-D235 PolarHBondContact O-N 3.05Å; K232-D235 PolarHBondContact O-N 2.83Å; E233-D235 PolarHBondContact O-N 3.48Å; D235-E239 PolarHBondContact O-N 3.06Å
236S97.9Very high97.8Very high66 Ų6688.5 Ų88.546%0.46247%0.472SS..Hα-helixtrans-69.8-39.3169.368.10000112.3K232 E233 E239 T240K232-S236 PolarHBondContact O-N 2.87Å; K232-S236 PolarHBondContact O-OG 2.8Å; E233-S236 PolarHBondContact O-N 2.8Å; E233-S236 PolarHBondContact O-OG 2.61Å; S236-E239 PolarHBondContact O-N 2.91Å; S236-T240 PolarHBondContact O-N 2.97Å; S236-T240 PolarHBondContact O-OG1 3.43Å
237L97.6Very high97.7Very high99 Ų9991.1 Ų91.152%0.51847%0.474SS..Hα-helixtrans-65-35.5173.4-71.3172.2000112.6E233 R234 T240 L241E233-L237 HydrophobicContact CG-CD1 3.99Å; E233-L237 HydrophobicContact CG-CG 4.45Å; E233-L237 WeakPolarHBondContact O-CB 3.39Å; E233-L237 VanDerWaalsContact O-CG 3.25Å; E233-L237 WeakPolarHBondContact O-CG 3.5Å; E233-L237 PolarHBondContact O-N 3.25Å; R234-L237 PolarHBondContact O-N 3.44Å; L237-T240 PolarHBondContact O-OG1 3.18Å; L237-T240 VanDerWaalsContact O-OG1 3.14Å; L237-L241 VanDerWaalsContact O-CB 3.24Å; L237-L241 WeakPolarHBondContact O-CB 3.22Å; L237-L241 PolarHBondContact O-N 2.81Å
238N97.6Very high97.7Very high80 Ų8089.2 Ų89.243%0.42847%0.472SS..Hα-helixtrans-65.4-41174-80.9-34.6000111.9R234 K242R234-N238 WeakPolarHBondContact O-CB 3.41Å; R234-N238 VanDerWaalsContact O-CG 3.23Å; R234-N238 PolarHBondContact O-N 3.21Å; R234-N238 PolarHBondContact O-ND2 3.24Å; R234-N238 VanDerWaalsContact O-ND2 3.16Å; N238-K242 WeakPolarHBondContact O-CB 3.25Å; N238-K242 PolarHBondContact O-N 3.06Å
239E98Very high97.7Very high100 Ų10090.7 Ų90.747%0.46747%0.474SS..Hα-helixtrans-71.5-35.3177.5-71.6-66.4125.500112.5D235 S236 K242 T243D235-E239 PolarHBondContact O-N 3.06Å; S236-E239 PolarHBondContact O-N 2.91Å; E239-K242 WeakPolarHBondContact O-CB 3.45Å; E239-K242 PolarHBondContact O-N 2.93Å; E239-K242 VanDerWaalsContact OE1-CD 3.25Å; E239-K242 WeakPolarHBondContact OE1-CD 3.45Å; E239-K242 IonicContact OE1-NZ 2.96Å; E239-K242 PolarHBondContact OE1-NZ 3.34Å; E239-K242 WeakPolarHBondContact OE2-CD 3.37Å; E239-K242 IonicContact OE2-NZ 2.82Å; E239-K242 PolarHBondContact OE2-NZ 3.13Å; E239-T243 PolarHBondContact O-N 3.01Å
240T97.8Very high97.7Very high76 Ų7689 Ų8947%0.46647%0.468SS..Hα-helixtrans-72.1-3417358.30000113S236 L237 K242 T243 T244S236-T240 PolarHBondContact O-N 2.97Å; S236-T240 PolarHBondContact O-OG1 3.43Å; L237-T240 PolarHBondContact O-OG1 3.18Å; L237-T240 VanDerWaalsContact O-OG1 3.14Å; T240-K242 VanDerWaalsContact C-N 3.3Å; T240-T243 PolarHBondContact O-N 3.33Å; T240-T243 PolarHBondContact O-OG1 3.3Å; T240-T243 VanDerWaalsContact O-OG1 3.08Å; T240-T244 WeakPolarHBondContact O-CB 3.42Å; T240-T244 WeakPolarHBondContact O-CG2 3.34Å; T240-T244 PolarHBondContact O-N 2.9Å; T240-T244 PolarHBondContact O-OG1 2.99Å
241L97.5Very high97.7Very high94 Ų9491.7 Ų91.749%0.49247%0.474SS..Hα-helixtrans-62.4-40.3169.4178.959.2000111L237 T244 I245L237-L241 VanDerWaalsContact O-CB 3.24Å; L237-L241 WeakPolarHBondContact O-CB 3.22Å; L237-L241 PolarHBondContact O-N 2.81Å; L241-T244 WeakPolarHBondContact CA-OG1 3.47Å; L241-T244 PolarHBondContact O-OG1 3.16Å; L241-T244 VanDerWaalsContact O-OG1 3.06Å; L241-I245 HydrophobicContact CD1-CD1 3.97Å; L241-I245 HydrophobicContact CD1-CG1 4.31Å; L241-I245 HydrophobicContact CG-CD1 3.91Å; L241-I245 WeakPolarHBondContact O-CB 3.35Å; L241-I245 WeakPolarHBondContact O-CD1 3.47Å; L241-I245 WeakPolarHBondContact O-CG1 3.38Å; L241-I245 PolarHBondContact O-N 3.03Å
242K98.4Very high97.7Very high95 Ų9594.9 Ų94.941%0.41349%0.488SS..Hα-helixtrans-67.1-41.3177.3173.7-169.3174.7-1640112.8N238 E239 T240 Q246N238-K242 WeakPolarHBondContact O-CB 3.25Å; N238-K242 PolarHBondContact O-N 3.06Å; E239-K242 WeakPolarHBondContact O-CB 3.45Å; E239-K242 PolarHBondContact O-N 2.93Å; E239-K242 VanDerWaalsContact OE1-CD 3.25Å; E239-K242 WeakPolarHBondContact OE1-CD 3.45Å; E239-K242 IonicContact OE1-NZ 2.96Å; E239-K242 PolarHBondContact OE1-NZ 3.34Å; E239-K242 WeakPolarHBondContact OE2-CD 3.37Å; E239-K242 IonicContact OE2-NZ 2.82Å; E239-K242 PolarHBondContact OE2-NZ 3.13Å; T240-K242 VanDerWaalsContact C-N 3.3Å; K242-Q246 WeakPolarHBondContact O-CG 3.5Å; K242-Q246 PolarHBondContact O-N 3.31Å; K242-Q246 VanDerWaalsContact O-N 3.15Å
243T97.7Very high97.7Very high61 Ų6193.8 Ų93.837%0.37448%0.483SS..Hα-helixtrans-67.4-45.6174.357.30000111.5E239 T240 I245 Q246 E247E239-T243 PolarHBondContact O-N 3.01Å; T240-T243 PolarHBondContact O-N 3.33Å; T240-T243 PolarHBondContact O-OG1 3.3Å; T240-T243 VanDerWaalsContact O-OG1 3.08Å; T243-I245 VanDerWaalsContact C-N 3.31Å; T243-I245 PolarHBondContact O-N 3Å; T243-Q246 WeakPolarHBondContact O-CA 3.48Å; T243-Q246 WeakPolarHBondContact O-CB 3.39Å; T243-Q246 PolarHBondContact O-N 2.97Å; T243-E247 WeakPolarHBondContact O-CG 3.48Å; T243-E247 PolarHBondContact O-N 3.19Å
244T97.1Very high97.7Very high71 Ų7193.3 Ų93.344%0.43648%0.484SS..Hα-helixtrans-64.4-32.5178.751.20000113T240 L241 A248T240-T244 WeakPolarHBondContact O-CB 3.42Å; T240-T244 WeakPolarHBondContact O-CG2 3.34Å; T240-T244 PolarHBondContact O-N 2.9Å; T240-T244 PolarHBondContact O-OG1 2.99Å; L241-T244 WeakPolarHBondContact CA-OG1 3.47Å; L241-T244 PolarHBondContact O-OG1 3.16Å; L241-T244 VanDerWaalsContact O-OG1 3.06Å; T244-A248 VanDerWaalsContact O-CB 3.3Å; T244-A248 WeakPolarHBondContact O-CB 3.42Å; T244-A248 PolarHBondContact O-N 3.49Å
245I97.8Very high97.7Very high89 Ų8992.2 Ų92.246%0.45649%0.49SS..Hα-helixtrans-63.8-43.8169-73.9166.4000111.4L241 T243 A248 E249L241-I245 HydrophobicContact CD1-CD1 3.97Å; L241-I245 HydrophobicContact CD1-CG1 4.31Å; L241-I245 HydrophobicContact CG-CD1 3.91Å; L241-I245 WeakPolarHBondContact O-CB 3.35Å; L241-I245 WeakPolarHBondContact O-CD1 3.47Å; L241-I245 WeakPolarHBondContact O-CG1 3.38Å; L241-I245 PolarHBondContact O-N 3.03Å; T243-I245 VanDerWaalsContact C-N 3.31Å; T243-I245 PolarHBondContact O-N 3Å; I245-A248 PolarHBondContact O-N 3.11Å; I245-E249 PolarHBondContact O-N 2.78Å
246Q97.9Very high97.7Very high121 Ų12195.6 Ų95.657%0.56550%0.504SS*.Hα-helixtrans-65.4-39.1177.8-71.7174.9800112.2K242 T243 E249 G250K242-Q246 WeakPolarHBondContact O-CG 3.5Å; K242-Q246 PolarHBondContact O-N 3.31Å; K242-Q246 VanDerWaalsContact O-N 3.15Å; T243-Q246 WeakPolarHBondContact O-CA 3.48Å; T243-Q246 WeakPolarHBondContact O-CB 3.39Å; T243-Q246 PolarHBondContact O-N 2.97Å; Q246-E249 PolarHBondContact O-N 3.35Å; Q246-G250 PolarHBondContact O-N 3.46Å
247E96.9Very high97.7Very high117 Ų11795.9 Ų95.955%0.54751%0.505SS..Hα-helixtrans-63.4-46.8173-71.5165.9-163.200111.4T243 E249 G250 L251T243-E247 WeakPolarHBondContact O-CG 3.48Å; T243-E247 PolarHBondContact O-N 3.19Å; E247-E249 VanDerWaalsContact C-N 3.32Å; E247-E249 PolarHBondContact O-N 3.3Å; E247-G250 WeakPolarHBondContact O-CA 3.3Å; E247-G250 PolarHBondContact O-N 2.89Å; E247-L251 WeakPolarHBondContact O-CG 3.37Å; E247-L251 PolarHBondContact O-N 3.06Å
248A97.3Very high97.7Very high56 Ų5696 Ų9646%0.46351%0.506SS..Hα-helixtrans-61.6-38.2176.200000112.3T244 I245 K252T244-A248 VanDerWaalsContact O-CB 3.3Å; T244-A248 WeakPolarHBondContact O-CB 3.42Å; T244-A248 PolarHBondContact O-N 3.49Å; I245-A248 PolarHBondContact O-N 3.11Å; A248-K252 VanDerWaalsContact O-CB 3.25Å; A248-K252 WeakPolarHBondContact O-CB 3.28Å; A248-K252 PolarHBondContact O-N 2.92Å
249E97.9Very high97.7Very high99 Ų9994.3 Ų94.346%0.46350%0.503SS..Hα-helixtrans-64.3-41.7170-84.8-157.9-166.800112.9I245 Q246 E247 K252 K253I245-E249 PolarHBondContact O-N 2.78Å; Q246-E249 PolarHBondContact O-N 3.35Å; E247-E249 VanDerWaalsContact C-N 3.32Å; E247-E249 PolarHBondContact O-N 3.3Å; E249-K252 PolarHBondContact O-N 3Å; E249-K253 VanDerWaalsContact O-CD 3.31Å; E249-K253 WeakPolarHBondContact O-CD 3.33Å; E249-K253 WeakPolarHBondContact O-CG 3.48Å; E249-K253 PolarHBondContact O-N 3.41Å; E249-K253 IonicContact OE2-NZ 2.98Å; E249-K253 PolarHBondContact OE2-NZ 3.12Å
250G98.1Very high97.6Very high36 Ų3697.1 Ų97.137%0.37151%0.514SS..Hα-helixtrans-60.6-49.7176.500000111.9Q246 E247 K252 K253 L254Q246-G250 PolarHBondContact O-N 3.46Å; E247-G250 WeakPolarHBondContact O-CA 3.3Å; E247-G250 PolarHBondContact O-N 2.89Å; G250-K252 PolarHBondContact O-N 2.91Å; G250-K253 PolarHBondContact O-N 3.32Å; G250-L254 PolarHBondContact O-N 2.87Å
251L97.6Very high97.6Very high109 Ų10999.3 Ų99.357%0.57152%0.519SS*.Hα-helixtrans-58.8-44.3174-70171.7000111.5E247 K253 L254 T255E247-L251 WeakPolarHBondContact O-CG 3.37Å; E247-L251 PolarHBondContact O-N 3.06Å; L251-K253 VanDerWaalsContact C-N 3.33Å; L251-K253 PolarHBondContact O-N 3.37Å; L251-L254 PolarHBondContact O-N 3.46Å; L251-T255 WeakPolarHBondContact O-CB 3.46Å; L251-T255 PolarHBondContact O-N 3.1Å; L251-T255 PolarHBondContact O-OG1 3.49Å
252K97.8Very high97.6Very high163 Ų163101.4 Ų101.471%0.70952%0.524SS*.Hα-helixtrans-60.7-40176.5-176.6178.7179.6-179.30112.5A248 E249 G250 H256A248-K252 VanDerWaalsContact O-CB 3.25Å; A248-K252 WeakPolarHBondContact O-CB 3.28Å; A248-K252 PolarHBondContact O-N 2.92Å; E249-K252 PolarHBondContact O-N 3Å; G250-K252 PolarHBondContact O-N 2.91Å; K252-H256 WeakPolarHBondContact O-CB 3.44Å; K252-H256 PolarHBondContact O-N 2.9Å; K252-H256 VanDerWaalsContact O-N 3.12Å
253K98.1Very high97.6Very high128 Ų128101.9 Ų101.956%0.55753%0.531SS*.Hα-helixtrans-65.6-44.8175-69.4157-167.1162.90110.9E249 G250 L251 H256 S257E249-K253 VanDerWaalsContact O-CD 3.31Å; E249-K253 WeakPolarHBondContact O-CD 3.33Å; E249-K253 WeakPolarHBondContact O-CG 3.48Å; E249-K253 PolarHBondContact O-N 3.41Å; E249-K253 IonicContact OE2-NZ 2.98Å; E249-K253 PolarHBondContact OE2-NZ 3.12Å; G250-K253 PolarHBondContact O-N 3.32Å; L251-K253 VanDerWaalsContact C-N 3.33Å; L251-K253 PolarHBondContact O-N 3.37Å; K253-H256 PolarHBondContact O-N 2.88Å; K253-S257 PolarHBondContact O-N 3.28Å
254L97.6Very high97.6Very high110 Ų110101.7 Ų101.758%0.57653%0.532SS*.Hα-helixtrans-62-49.7176.8-177.563.7000112.1G250 L251 H256 S257 L258G250-L254 PolarHBondContact O-N 2.87Å; L251-L254 PolarHBondContact O-N 3.46Å; L254-H256 VanDerWaalsContact C-N 3.28Å; L254-H256 PolarHBondContact O-N 2.97Å; L254-S257 WeakPolarHBondContact O-CB 3.31Å; L254-S257 PolarHBondContact O-N 3.45Å; L254-S257 VanDerWaalsContact O-N 3.1Å; L254-L258 WeakPolarHBondContact O-CB 3.23Å; L254-L258 PolarHBondContact O-N 2.88Å
255T97.2Very high97.6Very high95 Ų95102.2 Ų102.258%0.58354%0.535SS*.Hα-helixtrans-58.8-38.6177.4-59.20000111.8L251 A259L251-T255 WeakPolarHBondContact O-CB 3.46Å; L251-T255 PolarHBondContact O-N 3.1Å; L251-T255 PolarHBondContact O-OG1 3.49Å; T255-A259 VanDerWaalsContact O-CB 3.25Å; T255-A259 WeakPolarHBondContact O-CB 3.3Å; T255-A259 PolarHBondContact O-N 2.89Å
256H97.4Very high97.6Very high143 Ų143102.2 Ų102.266%0.66253%0.534SS*.Hα-helixtrans-69-38.5175.9-17057.1000112.6K252 K253 L254 A259 K260K252-H256 WeakPolarHBondContact O-CB 3.44Å; K252-H256 PolarHBondContact O-N 2.9Å; K252-H256 VanDerWaalsContact O-N 3.12Å; K253-H256 PolarHBondContact O-N 2.88Å; L254-H256 VanDerWaalsContact C-N 3.28Å; L254-H256 PolarHBondContact O-N 2.97Å; H256-A259 PolarHBondContact O-N 3.27Å; H256-K260 PolarHBondContact O-N 2.91Å
257S97.7Very high97.5Very high71 Ų71102 Ų10250%0.49754%0.536SS..Hα-helixtrans-63-49173.8-165.40000111.6K253 L254 A259 K260 E261K253-S257 PolarHBondContact O-N 3.28Å; L254-S257 WeakPolarHBondContact O-CB 3.31Å; L254-S257 PolarHBondContact O-N 3.45Å; L254-S257 VanDerWaalsContact O-N 3.1Å; S257-A259 VanDerWaalsContact C-N 3.32Å; S257-A259 PolarHBondContact O-N 3.43Å; S257-K260 WeakPolarHBondContact O-CB 3.41Å; S257-K260 PolarHBondContact O-N 3.42Å; S257-K260 VanDerWaalsContact O-N 3.1Å; S257-E261 PolarHBondContact O-N 2.96Å
258L97.5Very high97.5Very high103 Ų103100.6 Ų100.654%0.53953%0.529SS..Hα-helixtrans-65.3-34179.3-171.6149.3000112L254 E261 K262L254-L258 WeakPolarHBondContact O-CB 3.23Å; L254-L258 PolarHBondContact O-N 2.88Å; L258-E261 PolarHBondContact O-N 3.48Å; L258-K262 VanDerWaalsContact O-CB 3.26Å; L258-K262 WeakPolarHBondContact O-CB 3.47Å; L258-K262 PolarHBondContact O-N 2.9Å
259A97.6Very high97.5Very high44 Ų44103.2 Ų103.236%0.36453%0.53SS..Hα-helixtrans-65.5-38.5171.600000112.5T255 H256 S257 L263T255-A259 VanDerWaalsContact O-CB 3.25Å; T255-A259 WeakPolarHBondContact O-CB 3.3Å; T255-A259 PolarHBondContact O-N 2.89Å; H256-A259 PolarHBondContact O-N 3.27Å; S257-A259 VanDerWaalsContact C-N 3.32Å; S257-A259 PolarHBondContact O-N 3.43Å; A259-L263 WeakPolarHBondContact O-CG 3.43Å; A259-L263 PolarHBondContact O-N 3.46Å
260K97.6Very high97.5Very high159 Ų159102.5 Ų102.569%0.69153%0.53SS*.Hα-helixtrans-67-42.9174.3-176.6-171173.8-1680111.6H256 S257 L263 S264H256-K260 PolarHBondContact O-N 2.91Å; S257-K260 WeakPolarHBondContact O-CB 3.41Å; S257-K260 PolarHBondContact O-N 3.42Å; S257-K260 VanDerWaalsContact O-N 3.1Å; K260-L263 PolarHBondContact O-N 3.24Å; K260-S264 PolarHBondContact O-N 3.27Å
261E97.5Very high97.5Very high121 Ų121106.8 Ų106.857%0.56554%0.542SS*.Hα-helixtrans-62.7-47176.2-173.9175.9-175.700111.5S257 L258 L263 S264 V265S257-E261 PolarHBondContact O-N 2.96Å; L258-E261 PolarHBondContact O-N 3.48Å; E261-L263 PolarHBondContact O-N 2.89Å; E261-S264 WeakPolarHBondContact O-CA 3.43Å; E261-S264 WeakPolarHBondContact O-CB 3.24Å; E261-S264 PolarHBondContact O-N 3.35Å; E261-V265 WeakPolarHBondContact O-CG2 3.34Å; E261-V265 PolarHBondContact O-N 3.43Å
262K97.7Very high97.4Very high139 Ų139106.9 Ų106.960%0.60454%0.542SS*.Hα-helixtrans-55.6-34.9173.5-176.3176.1-179.1177.20112.7L258 M266L258-K262 VanDerWaalsContact O-CB 3.26Å; L258-K262 WeakPolarHBondContact O-CB 3.47Å; L258-K262 PolarHBondContact O-N 2.9Å; K262-M266 VanDerWaalsContact O-CB 3.25Å; K262-M266 WeakPolarHBondContact O-CB 3.46Å; K262-M266 PolarHBondContact O-N 3.39Å
263L97.3Very high97.4Very high105 Ų105102.7 Ų102.755%0.5553%0.525SS..Hα-helixtrans-72.8-36.2174.1-72.5169000112.7A259 K260 E261 L267A259-L263 WeakPolarHBondContact O-CG 3.43Å; A259-L263 PolarHBondContact O-N 3.46Å; K260-L263 PolarHBondContact O-N 3.24Å; E261-L263 PolarHBondContact O-N 2.89Å; L263-L267 WeakPolarHBondContact O-CG 3.36Å; L263-L267 PolarHBondContact O-N 2.85Å; L263-L267 VanDerWaalsContact O-N 3.1Å
264S97.3Very high97.3Very high57 Ų5799.3 Ų99.340%0.39952%0.521SS..Hα-helixtrans-63.6-53173.2-156.20000110.9K260 E261 M266 L267 E268K260-S264 PolarHBondContact O-N 3.27Å; E261-S264 WeakPolarHBondContact O-CA 3.43Å; E261-S264 WeakPolarHBondContact O-CB 3.24Å; E261-S264 PolarHBondContact O-N 3.35Å; S264-M266 PolarHBondContact O-N 3.45Å; S264-L267 PolarHBondContact O-N 3.47Å; S264-E268 WeakPolarHBondContact CB-OE1 3.3Å; S264-E268 WeakPolarHBondContact O-CG 3.16Å; S264-E268 PolarHBondContact O-N 3.19Å; S264-E268 PolarHBondContact OG-OE1 2.99Å
265V97.8Very high97.3Very high82 Ų8297.5 Ų97.550%0.49751%0.514SS..Hα-helixtrans-60-34.5179176.30000111.8E261 K269E261-V265 WeakPolarHBondContact O-CG2 3.34Å; E261-V265 PolarHBondContact O-N 3.43Å; V265-K269 WeakPolarHBondContact O-CB 3.39Å; V265-K269 PolarHBondContact O-N 2.86Å
266M97.4Very high97.3Very high88 Ų8897.2 Ų97.243%0.43351%0.513SS..Hα-helixtrans-65.6-45.5173.3-173.7179.1-62.400112.2K262 S264 K269 D270K262-M266 VanDerWaalsContact O-CB 3.25Å; K262-M266 WeakPolarHBondContact O-CB 3.46Å; K262-M266 PolarHBondContact O-N 3.39Å; S264-M266 PolarHBondContact O-N 3.45Å; M266-K269 PolarHBondContact O-N 2.85Å; M266-D270 WeakPolarHBondContact O-CB 3.33Å; M266-D270 VanDerWaalsContact O-CG 3.31Å; M266-D270 PolarHBondContact O-N 3.33Å
267L97.3Very high97.2Very high116 Ų11696.6 Ų96.661%0.60751%0.508SS*.Hα-helixtrans-65.6-40.6176.5-70.3167.6000112L263 S264 D270 M271L263-L267 WeakPolarHBondContact O-CG 3.36Å; L263-L267 PolarHBondContact O-N 2.85Å; L263-L267 VanDerWaalsContact O-N 3.1Å; S264-L267 PolarHBondContact O-N 3.47Å; L267-D270 PolarHBondContact O-N 3.21Å; L267-M271 WeakPolarHBondContact O-CG 3.44Å; L267-M271 PolarHBondContact O-N 3.41Å
268E96.7Very high97.2Very high89 Ų8999.8 Ų99.842%0.41651%0.513SS..Hα-helixtrans-63.4-43.7175.5-71.1160.7-13100111.3S264 M271 L272S264-E268 WeakPolarHBondContact CB-OE1 3.3Å; S264-E268 WeakPolarHBondContact O-CG 3.16Å; S264-E268 PolarHBondContact O-N 3.19Å; S264-E268 PolarHBondContact OG-OE1 2.99Å; E268-M271 PolarHBondContact O-N 3.1Å; E268-L272 WeakPolarHBondContact O-CB 3.38Å; E268-L272 VanDerWaalsContact O-CG 3.28Å; E268-L272 WeakPolarHBondContact O-CG 3.49Å; E268-L272 PolarHBondContact O-N 2.83Å
269K97.7Very high97.1Very high111 Ų11198.7 Ų98.748%0.48351%0.507SS..Hα-helixtrans-60.7-47.2173.5-174-129.9164.2-141.70111.6V265 M266 M271 L272 E273V265-K269 WeakPolarHBondContact O-CB 3.39Å; V265-K269 PolarHBondContact O-N 2.86Å; M266-K269 PolarHBondContact O-N 2.85Å; K269-M271 VanDerWaalsContact C-N 3.35Å; K269-M271 PolarHBondContact O-N 3.02Å; K269-L272 PolarHBondContact O-N 2.86Å; K269-E273 WeakPolarHBondContact CE-OE2 3.42Å; K269-E273 IonicContact NZ-OE2 2.67Å; K269-E273 PolarHBondContact NZ-OE2 2.84Å; K269-E273 WeakPolarHBondContact O-CB 3.41Å; K269-E273 PolarHBondContact O-N 3.24Å
270D97.2Very high97.1Very high84 Ų84100.1 Ų100.145%0.44951%0.512SS..Hα-helixtrans-65.3-37.3-179.9-72.1-6.4000111.8M266 L267 A274M266-D270 WeakPolarHBondContact O-CB 3.33Å; M266-D270 VanDerWaalsContact O-CG 3.31Å; M266-D270 PolarHBondContact O-N 3.33Å; L267-D270 PolarHBondContact O-N 3.21Å; D270-A274 WeakPolarHBondContact O-CB 3.18Å; D270-A274 PolarHBondContact O-N 2.96Å
271M96.9Very high97Very high126 Ų12694.9 Ų94.962%0.62150%0.498SS*.Hα-helixtrans-64.2-47170.8-74.2-161.9-55.300112.3L267 E268 K269 A274 T275L267-M271 WeakPolarHBondContact O-CG 3.44Å; L267-M271 PolarHBondContact O-N 3.41Å; E268-M271 PolarHBondContact O-N 3.1Å; K269-M271 VanDerWaalsContact C-N 3.35Å; K269-M271 PolarHBondContact O-N 3.02Å; M271-A274 WeakPolarHBondContact O-CB 3.38Å; M271-A274 PolarHBondContact O-N 3.38Å; M271-T275 PolarHBondContact O-N 3.4Å; M271-T275 PolarHBondContact O-OG1 3.48Å
272L96.6Very high96.9Very high111 Ų11194.1 Ų94.158%0.58149%0.493SS*.Hα-helixtrans-62.2-44179.2-75.7169.4000111.2E268 K269 A274 T275 V276E268-L272 WeakPolarHBondContact O-CB 3.38Å; E268-L272 VanDerWaalsContact O-CG 3.28Å; E268-L272 WeakPolarHBondContact O-CG 3.49Å; E268-L272 PolarHBondContact O-N 2.83Å; K269-L272 PolarHBondContact O-N 2.86Å; L272-A274 VanDerWaalsContact C-N 3.3Å; L272-A274 PolarHBondContact O-N 2.96Å; L272-T275 WeakPolarHBondContact CA-OG1 3.43Å; L272-T275 PolarHBondContact O-N 3.49Å; L272-T275 VanDerWaalsContact O-N 3.11Å; L272-T275 PolarHBondContact O-OG1 2.97Å; L272-V276 WeakPolarHBondContact O-CG2 3.49Å; L272-V276 PolarHBondContact O-N 2.93Å
273E97.7Very high96.8Very high74 Ų7493.2 Ų93.235%0.34649%0.493SS..Hα-helixtrans-60.9-39.5176.3-160.2-174.4119.200111.4K269 V276 K277K269-E273 WeakPolarHBondContact CE-OE2 3.42Å; K269-E273 IonicContact NZ-OE2 2.67Å; K269-E273 PolarHBondContact NZ-OE2 2.84Å; K269-E273 WeakPolarHBondContact O-CB 3.41Å; K269-E273 PolarHBondContact O-N 3.24Å; E273-V276 PolarHBondContact O-N 2.95Å; E273-K277 HydrophobicContact CG-CD 4.4Å; E273-K277 WeakPolarHBondContact O-CB 3.42Å; E273-K277 VanDerWaalsContact O-CG 3.29Å; E273-K277 WeakPolarHBondContact O-CG 3.24Å; E273-K277 PolarHBondContact O-N 3.01Å; E273-K277 WeakPolarHBondContact OE1-CE 3.44Å; E273-K277 IonicContact OE1-NZ 2.65Å; E273-K277 PolarHBondContact OE1-NZ 2.97Å
274A96.5Very high96.8Very high58 Ų5892.3 Ų92.348%0.47949%0.486SS..Hα-helixtrans-66.5-38.5172.900000112.9D270 M271 L272 K278D270-A274 WeakPolarHBondContact O-CB 3.18Å; D270-A274 PolarHBondContact O-N 2.96Å; M271-A274 WeakPolarHBondContact O-CB 3.38Å; M271-A274 PolarHBondContact O-N 3.38Å; L272-A274 VanDerWaalsContact C-N 3.3Å; L272-A274 PolarHBondContact O-N 2.96Å; A274-K278 WeakPolarHBondContact O-CB 3.48Å; A274-K278 PolarHBondContact O-N 2.98Å
275T96.6Very high96.7Very high71 Ų7193.3 Ų93.344%0.43649%0.489SS..Hα-helixtrans-68.1-40.217455.90000112.7M271 L272 K278 D279M271-T275 PolarHBondContact O-N 3.4Å; M271-T275 PolarHBondContact O-OG1 3.48Å; L272-T275 WeakPolarHBondContact CA-OG1 3.43Å; L272-T275 PolarHBondContact O-N 3.49Å; L272-T275 VanDerWaalsContact O-N 3.11Å; L272-T275 PolarHBondContact O-OG1 2.97Å; T275-K278 WeakPolarHBondContact O-CB 3.43Å; T275-K278 PolarHBondContact O-N 3.45Å; T275-D279 WeakPolarHBondContact O-CB 3.39Å; T275-D279 PolarHBondContact O-N 2.9Å
276V96.9Very high96.6Very high90 Ų9096.7 Ų96.755%0.54550%0.497SS..Hα-helixtrans-63.1-49.9176.2169.80000110L272 E273 K278 D279 T280L272-V276 WeakPolarHBondContact O-CG2 3.49Å; L272-V276 PolarHBondContact O-N 2.93Å; E273-V276 PolarHBondContact O-N 2.95Å; V276-K278 VanDerWaalsContact C-N 3.29Å; V276-K278 PolarHBondContact O-N 2.87Å; V276-D279 PolarHBondContact O-N 2.81Å; V276-T280 PolarHBondContact O-N 3.33Å; V276-T280 PolarHBondContact O-OG1 3.36Å; V276-T280 VanDerWaalsContact O-OG1 3.09Å
277K96.8Very high96.6Very high130 Ų13098.3 Ų98.357%0.56550%0.503SS*.Hα-helixtrans-55.7-42.4175.9-76.3167.3172170.70112.5E273 D279 A281E273-K277 HydrophobicContact CG-CD 4.4Å; E273-K277 WeakPolarHBondContact O-CB 3.42Å; E273-K277 VanDerWaalsContact O-CG 3.29Å; E273-K277 WeakPolarHBondContact O-CG 3.24Å; E273-K277 PolarHBondContact O-N 3.01Å; E273-K277 WeakPolarHBondContact OE1-CE 3.44Å; E273-K277 IonicContact OE1-NZ 2.65Å; E273-K277 PolarHBondContact OE1-NZ 2.97Å; K277-D279 VanDerWaalsContact C-N 3.35Å; K277-A281 WeakPolarHBondContact O-CB 3.29Å; K277-A281 PolarHBondContact O-N 2.9Å; K277-A281 VanDerWaalsContact O-N 3.14Å
278K96.4Very high96.5Very high137 Ų13798.3 Ų98.360%0.59650%0.498SS*.Hα-helixtrans-63.2-39.2175.5-178178.3-176.4175.70112.3A274 T275 V276 K282A274-K278 WeakPolarHBondContact O-CB 3.48Å; A274-K278 PolarHBondContact O-N 2.98Å; T275-K278 WeakPolarHBondContact O-CB 3.43Å; T275-K278 PolarHBondContact O-N 3.45Å; V276-K278 VanDerWaalsContact C-N 3.29Å; V276-K278 PolarHBondContact O-N 2.87Å; K278-K282 WeakPolarHBondContact O-CG 3.45Å; K278-K282 PolarHBondContact O-N 3.22Å; K278-K282 VanDerWaalsContact O-N 3.11Å
279D96Very high96.5Very high80 Ų80100.2 Ų100.243%0.42851%0.506SS..Hα-helixtrans-84.1-31.8-175.4-74.15.4000112.8T275 V276 K277 K282 M283T275-D279 WeakPolarHBondContact O-CB 3.39Å; T275-D279 PolarHBondContact O-N 2.9Å; V276-D279 PolarHBondContact O-N 2.81Å; K277-D279 VanDerWaalsContact C-N 3.35Å; D279-K282 WeakPolarHBondContact O-CB 3.47Å; D279-K282 PolarHBondContact O-N 3.49Å; D279-K282 WeakPolarHBondContact OD1-CD 3.25Å; D279-K282 WeakPolarHBondContact OD1-CE 3.45Å; D279-K282 IonicContact OD1-NZ 2.75Å; D279-K282 PolarHBondContact OD1-NZ 2.96Å; D279-K282 IonicContact OD2-NZ 3.72Å; D279-M283 VanDerWaalsContact O-CB 3.29Å; D279-M283 WeakPolarHBondContact O-CB 3.38Å; D279-M283 PolarHBondContact O-N 3.32Å
280T96.5Very high96.4Very high74 Ų74100 Ų10045%0.45451%0.509SS..Hα-helixtrans-56.5-49.4163.7-56.80000110.6V276 K282 M283 E284V276-T280 PolarHBondContact O-N 3.33Å; V276-T280 PolarHBondContact O-OG1 3.36Å; V276-T280 VanDerWaalsContact O-OG1 3.09Å; T280-K282 VanDerWaalsContact C-N 3.34Å; T280-K282 PolarHBondContact O-N 3.47Å; T280-M283 WeakPolarHBondContact O-CA 3.22Å; T280-M283 WeakPolarHBondContact O-CB 3.39Å; T280-M283 PolarHBondContact O-N 2.89Å; T280-E284 PolarHBondContact O-N 2.95Å
281A96.1Very high96.3Very high50 Ų5099.3 Ų99.341%0.41351%0.511SS..Hα-helixtrans-62.5-37.1178.100000113K277 M283 V285K277-A281 WeakPolarHBondContact O-CB 3.29Å; K277-A281 PolarHBondContact O-N 2.9Å; K277-A281 VanDerWaalsContact O-N 3.14Å; A281-M283 VanDerWaalsContact C-N 3.31Å; A281-V285 VanDerWaalsContact O-CG2 3.31Å; A281-V285 WeakPolarHBondContact O-CG2 3.4Å; A281-V285 PolarHBondContact O-N 3.02Å
282K95.9Very high96.3Very high104 Ų10498.1 Ų98.145%0.45250%0.504SS..Hα-helixtrans-63.2-38169.7-70.2172.4-169.2164.40112K278 D279 T280 V285 K286K278-K282 WeakPolarHBondContact O-CG 3.45Å; K278-K282 PolarHBondContact O-N 3.22Å; K278-K282 VanDerWaalsContact O-N 3.11Å; D279-K282 WeakPolarHBondContact O-CB 3.47Å; D279-K282 PolarHBondContact O-N 3.49Å; D279-K282 WeakPolarHBondContact OD1-CD 3.25Å; D279-K282 WeakPolarHBondContact OD1-CE 3.45Å; D279-K282 IonicContact OD1-NZ 2.75Å; D279-K282 PolarHBondContact OD1-NZ 2.96Å; D279-K282 IonicContact OD2-NZ 3.72Å; T280-K282 VanDerWaalsContact C-N 3.34Å; T280-K282 PolarHBondContact O-N 3.47Å; K282-V285 PolarHBondContact O-N 3.2Å; K282-K286 WeakPolarHBondContact O-CG 3.17Å; K282-K286 PolarHBondContact O-N 2.93Å
283M96.1Very high96.3Very high121 Ų12197.2 Ų97.260%0.59650%0.503SS*.Hα-helixtrans-69.5-47.1-176.3-162.5-84.9-129.500110.3D279 T280 A281 V285 K286 E287D279-M283 VanDerWaalsContact O-CB 3.29Å; D279-M283 WeakPolarHBondContact O-CB 3.38Å; D279-M283 PolarHBondContact O-N 3.32Å; T280-M283 WeakPolarHBondContact O-CA 3.22Å; T280-M283 WeakPolarHBondContact O-CB 3.39Å; T280-M283 PolarHBondContact O-N 2.89Å; A281-M283 VanDerWaalsContact C-N 3.31Å; M283-V285 VanDerWaalsContact C-N 3.3Å; M283-V285 PolarHBondContact O-N 2.92Å; M283-K286 CarbonylContact O-C 3.54Å; M283-K286 WeakPolarHBondContact O-CA 3.48Å; M283-K286 WeakPolarHBondContact O-CB 3.31Å; M283-K286 PolarHBondContact O-N 2.7Å; M283-E287 WeakPolarHBondContact O-CB 3.47Å; M283-E287 PolarHBondContact O-N 2.92Å
284E96.1Very high96.1Very high86 Ų8699.5 Ų99.540%0.40252%0.515SS..Hα-helixtrans-55-42.4170.1-70.4-179.7-14100113T280 K286 E287 K288T280-E284 PolarHBondContact O-N 2.95Å; E284-K286 VanDerWaalsContact C-N 3.32Å; E284-E287 PolarHBondContact O-N 3.42Å; E284-K288 WeakPolarHBondContact O-CB 3.25Å; E284-K288 WeakPolarHBondContact O-CD 3.49Å; E284-K288 VanDerWaalsContact O-CG 3.28Å; E284-K288 WeakPolarHBondContact O-CG 3.34Å; E284-K288 PolarHBondContact O-N 2.88Å; E284-K288 IonicContact OE2-NZ 2.7Å; E284-K288 PolarHBondContact OE2-NZ 3.38Å
285V96.3Very high96.1Very high77 Ų7799.8 Ų99.847%0.46752%0.517SS..Hα-helixtrans-68.5-31.7178.51690000111.6A281 K282 M283 K289A281-V285 VanDerWaalsContact O-CG2 3.31Å; A281-V285 WeakPolarHBondContact O-CG2 3.4Å; A281-V285 PolarHBondContact O-N 3.02Å; K282-V285 PolarHBondContact O-N 3.2Å; M283-V285 VanDerWaalsContact C-N 3.3Å; M283-V285 PolarHBondContact O-N 2.92Å; V285-K289 VanDerWaalsContact O-CG 3.32Å; V285-K289 WeakPolarHBondContact O-CG 3.47Å; V285-K289 PolarHBondContact O-N 3.14Å
286K95.4Very high96.1Very high153 Ų153101.6 Ų101.667%0.66552%0.519SS*.Hα-helixtrans-71.4-41.8170.8-75.5177.4176.3-1750111.6K282 M283 E284 K289 L290K282-K286 WeakPolarHBondContact O-CG 3.17Å; K282-K286 PolarHBondContact O-N 2.93Å; M283-K286 CarbonylContact O-C 3.54Å; M283-K286 WeakPolarHBondContact O-CA 3.48Å; M283-K286 WeakPolarHBondContact O-CB 3.31Å; M283-K286 PolarHBondContact O-N 2.7Å; E284-K286 VanDerWaalsContact C-N 3.32Å; K286-K289 CarbonylContact O-C 3.59Å; K286-K289 PolarHBondContact O-N 3.45Å; K286-L290 WeakPolarHBondContact O-CB 3.34Å; K286-L290 PolarHBondContact O-N 2.9Å
287E96.6Very high96Very high122 Ų12299.2 Ų99.257%0.5751%0.509SS*.Hα-helixtrans-64.6-44.5-179.7-172.8171.7-151.400111.6M283 E284 K289 L290 S291M283-E287 WeakPolarHBondContact O-CB 3.47Å; M283-E287 PolarHBondContact O-N 2.92Å; E284-E287 PolarHBondContact O-N 3.42Å; E287-K289 VanDerWaalsContact C-N 3.32Å; E287-K289 PolarHBondContact O-N 3.07Å; E287-L290 PolarHBondContact O-N 3.37Å; E287-L290 VanDerWaalsContact O-N 3.1Å; E287-S291 PolarHBondContact O-N 2.92Å; E287-S291 PolarHBondContact O-OG 2.84Å
288K96.2Very high95.9Very high116 Ų11695.1 Ų95.150%0.50450%0.499SS..Hα-helixtrans-58.5-40.6171.7-71.6159.7-175.4157.70112.1E284 S291 E292E284-K288 WeakPolarHBondContact O-CB 3.25Å; E284-K288 WeakPolarHBondContact O-CD 3.49Å; E284-K288 VanDerWaalsContact O-CG 3.28Å; E284-K288 WeakPolarHBondContact O-CG 3.34Å; E284-K288 PolarHBondContact O-N 2.88Å; E284-K288 IonicContact OE2-NZ 2.7Å; E284-K288 PolarHBondContact OE2-NZ 3.38Å; K288-S291 PolarHBondContact O-OG 3.4Å; K288-S291 VanDerWaalsContact O-OG 3.08Å; K288-E292 WeakPolarHBondContact O-CG 3.23Å; K288-E292 PolarHBondContact O-N 2.78Å; K288-E292 VanDerWaalsContact O-N 3.07Å
289K96.3Very high95.9Very high130 Ų13091.9 Ų91.957%0.56549%0.494SS*.Hα-helixtrans-69.5-33.8173.8-74.4178.1179.2-172.10113.1V285 K286 E287 V293V285-K289 VanDerWaalsContact O-CG 3.32Å; V285-K289 WeakPolarHBondContact O-CG 3.47Å; V285-K289 PolarHBondContact O-N 3.14Å; K286-K289 CarbonylContact O-C 3.59Å; K286-K289 PolarHBondContact O-N 3.45Å; E287-K289 VanDerWaalsContact C-N 3.32Å; E287-K289 PolarHBondContact O-N 3.07Å; K289-V293 WeakPolarHBondContact O-CB 3.36Å; K289-V293 VanDerWaalsContact O-CG2 3.27Å; K289-V293 WeakPolarHBondContact O-CG2 3.44Å; K289-V293 PolarHBondContact O-N 3.46Å
290L95.7Very high95.8Very high107 Ų10793.4 Ų93.456%0.5650%0.501SS*.Hα-helixtrans-71.3-41.4179-173146.8000110.7K286 E287 V293 M294K286-L290 WeakPolarHBondContact O-CB 3.34Å; K286-L290 PolarHBondContact O-N 2.9Å; E287-L290 PolarHBondContact O-N 3.37Å; E287-L290 VanDerWaalsContact O-N 3.1Å; L290-V293 PolarHBondContact O-N 3.21Å; L290-M294 HydrophobicContact CD2-CG 4.19Å; L290-M294 HydrophobicContact CD2-SD 3.52Å; L290-M294 VanDerWaalsContact CD2-SD 3.52Å; L290-M294 WeakPolarHBondContact O-CG 3.45Å; L290-M294 PolarHBondContact O-N 3.15Å
291S95.3Very high95.8Very high69 Ų6996.1 Ų96.148%0.48351%0.509SS..Hα-helixtrans-68.1-37.4173.661.60000112.6E287 K288 V293 M294 A295E287-S291 PolarHBondContact O-N 2.92Å; E287-S291 PolarHBondContact O-OG 2.84Å; K288-S291 PolarHBondContact O-OG 3.4Å; K288-S291 VanDerWaalsContact O-OG 3.08Å; S291-V293 VanDerWaalsContact C-N 3.34Å; S291-V293 PolarHBondContact O-N 3.47Å; S291-M294 PolarHBondContact O-N 3.2Å; S291-A295 WeakPolarHBondContact O-CB 3.38Å; S291-A295 PolarHBondContact O-N 3.24Å
292E96.2Very high95.8Very high100 Ų10099.9 Ų99.947%0.46752%0.521SS..Hα-helixtrans-56.9-44.5167.6-86.6-172-127.200112.8K288 K296K288-E292 WeakPolarHBondContact O-CG 3.23Å; K288-E292 PolarHBondContact O-N 2.78Å; K288-E292 VanDerWaalsContact O-N 3.07Å; E292-K296 WeakPolarHBondContact O-CB 3.41Å; E292-K296 WeakPolarHBondContact O-CD 3.41Å; E292-K296 VanDerWaalsContact O-CG 3.26Å; E292-K296 WeakPolarHBondContact O-CG 3.35Å; E292-K296 PolarHBondContact O-N 2.92Å; E292-K296 IonicContact OE2-NZ 3.82Å; E292-K296 PolarHBondContact OE2-NZ 2.87Å
293V95.6Very high95.7Very high93 Ų9397.1 Ų97.156%0.56452%0.518SS*.Hα-helixtrans-70.5-39.7-179.9167.20000111.1K289 L290 S291 K296 A297K289-V293 WeakPolarHBondContact O-CB 3.36Å; K289-V293 VanDerWaalsContact O-CG2 3.27Å; K289-V293 WeakPolarHBondContact O-CG2 3.44Å; K289-V293 PolarHBondContact O-N 3.46Å; L290-V293 PolarHBondContact O-N 3.21Å; S291-V293 VanDerWaalsContact C-N 3.34Å; S291-V293 PolarHBondContact O-N 3.47Å; V293-K296 PolarHBondContact O-N 2.84Å; V293-A297 WeakPolarHBondContact O-CB 3.11Å; V293-A297 PolarHBondContact O-N 2.95Å
294M95.3Very high95.6Very high121 Ų12196.5 Ų96.560%0.59652%0.516SS*.Hα-helixtrans-62.1-43.2173-75178.766.100112L290 S291 K296 A297 A298L290-M294 HydrophobicContact CD2-CG 4.19Å; L290-M294 HydrophobicContact CD2-SD 3.52Å; L290-M294 VanDerWaalsContact CD2-SD 3.52Å; L290-M294 WeakPolarHBondContact O-CG 3.45Å; L290-M294 PolarHBondContact O-N 3.15Å; S291-M294 PolarHBondContact O-N 3.2Å; M294-K296 VanDerWaalsContact C-N 3.34Å; M294-K296 PolarHBondContact O-N 3.49Å; M294-A297 PolarHBondContact O-N 3.28Å; M294-A298 WeakPolarHBondContact O-CB 3.39Å; M294-A298 PolarHBondContact O-N 3.43Å
295A95.8Very high95.5Very high64 Ų6495.3 Ų95.353%0.52952%0.521SS..Hα-helixtrans-63-40.6176.200000111.9S291 S299S291-A295 WeakPolarHBondContact O-CB 3.38Å; S291-A295 PolarHBondContact O-N 3.24Å; A295-S299 WeakPolarHBondContact O-CB 3.41Å; A295-S299 PolarHBondContact O-N 3.14Å
296K95.9Very high95.4Very high110 Ų11095.4 Ų95.448%0.47852%0.516SS..Hα-helixtrans-64-45173.5-72.4161-171.71580111.4E292 V293 M294 S299 L300E292-K296 WeakPolarHBondContact O-CB 3.41Å; E292-K296 WeakPolarHBondContact O-CD 3.41Å; E292-K296 VanDerWaalsContact O-CG 3.26Å; E292-K296 WeakPolarHBondContact O-CG 3.35Å; E292-K296 PolarHBondContact O-N 2.92Å; E292-K296 IonicContact OE2-NZ 3.82Å; E292-K296 PolarHBondContact OE2-NZ 2.87Å; V293-K296 PolarHBondContact O-N 2.84Å; M294-K296 VanDerWaalsContact C-N 3.34Å; M294-K296 PolarHBondContact O-N 3.49Å; K296-S299 PolarHBondContact O-N 2.98Å; K296-S299 PolarHBondContact O-OG 2.99Å; K296-L300 WeakPolarHBondContact O-CG 3.49Å; K296-L300 PolarHBondContact O-N 2.99Å
297A95.1Very high95.4Very high40 Ų4093.2 Ų93.233%0.33151%0.511SS..Hα-helixtrans-58.5-52.4176.400000111.6V293 M294 S299 L300 E301V293-A297 WeakPolarHBondContact O-CB 3.11Å; V293-A297 PolarHBondContact O-N 2.95Å; M294-A297 PolarHBondContact O-N 3.28Å; A297-S299 VanDerWaalsContact C-N 3.27Å; A297-S299 PolarHBondContact O-N 2.96Å; A297-L300 PolarHBondContact O-N 2.88Å; A297-E301 WeakPolarHBondContact O-CG 3.37Å; A297-E301 PolarHBondContact O-N 3.34Å
298A95.4Very high95.2Very high44 Ų4490.5 Ų90.536%0.36451%0.505SS..Hα-helixtrans-58.7-36.617700000112.7M294 L302M294-A298 WeakPolarHBondContact O-CB 3.39Å; M294-A298 PolarHBondContact O-N 3.43Å; A298-L302 WeakPolarHBondContact O-CB 3.31Å; A298-L302 WeakPolarHBondContact O-CG 3.2Å; A298-L302 PolarHBondContact O-N 3Å
299S95.6Very high95.1Very high69 Ų6989.5 Ų89.548%0.48350%0.498SS..Hα-helixtrans-67.8-34.2175.176.40000113.3A295 K296 A297 A303A295-S299 WeakPolarHBondContact O-CB 3.41Å; A295-S299 PolarHBondContact O-N 3.14Å; K296-S299 PolarHBondContact O-N 2.98Å; K296-S299 PolarHBondContact O-OG 2.99Å; A297-S299 VanDerWaalsContact C-N 3.27Å; A297-S299 PolarHBondContact O-N 2.96Å; S299-A303 WeakPolarHBondContact O-CB 3.47Å; S299-A303 PolarHBondContact O-N 3.15Å; S299-A303 VanDerWaalsContact O-N 3.07Å
300L95.3Very high95Very high112 Ų11288.2 Ų88.259%0.58649%0.493SS*.Hα-helixtrans-75.8-38.4175.8-69.6170.3000111.5K296 A297 A303 L304K296-L300 WeakPolarHBondContact O-CG 3.49Å; K296-L300 PolarHBondContact O-N 2.99Å; A297-L300 PolarHBondContact O-N 2.88Å; L300-A303 PolarHBondContact O-N 3.02Å; L300-L304 WeakPolarHBondContact O-CB 3.38Å; L300-L304 VanDerWaalsContact O-CG 3.26Å; L300-L304 WeakPolarHBondContact O-CG 3.31Å; L300-L304 PolarHBondContact O-N 2.87Å
301E95.3Very high94.7Very high131 Ų13186.7 Ų86.761%0.61249%0.491SS*.Hα-helixtrans-60.9-44.5173.1-72.3169.4174.800111.3A297 L304 A305A297-E301 WeakPolarHBondContact O-CG 3.37Å; A297-E301 PolarHBondContact O-N 3.34Å; E301-L304 PolarHBondContact O-N 3.35Å; E301-A305 WeakPolarHBondContact O-CB 3.47Å; E301-A305 PolarHBondContact O-N 3.13Å
302L95.6Very high94.6Very high129 Ų12989.3 Ų89.368%0.67550%0.496SS*.Hα-helixtrans-61.4-43.8172.7-76.5168.4000112.3A298 A305 E306A298-L302 WeakPolarHBondContact O-CB 3.31Å; A298-L302 WeakPolarHBondContact O-CG 3.2Å; A298-L302 PolarHBondContact O-N 3Å; L302-A305 PolarHBondContact O-N 3.18Å; L302-E306 PolarHBondContact O-N 2.87Å
303A94.6Very high94.4Very high45 Ų4589 Ų8937%0.37249%0.494SS..Hα-helixtrans-64.8-42.2177.800000112.3S299 L300 E306 I307S299-A303 WeakPolarHBondContact O-CB 3.47Å; S299-A303 PolarHBondContact O-N 3.15Å; S299-A303 VanDerWaalsContact O-N 3.07Å; L300-A303 PolarHBondContact O-N 3.02Å; A303-E306 PolarHBondContact O-N 3.06Å; A303-I307 VanDerWaalsContact O-CG1 3.26Å; A303-I307 WeakPolarHBondContact O-CG1 3.41Å; A303-I307 PolarHBondContact O-N 2.95Å
304L94.4Very high94.1Very high109 Ų10988.5 Ų88.557%0.57149%0.486SS*.Hα-helixtrans-64.8-44.2175.6-73.7169.7000111.5L300 E301 E306 I307 S308L300-L304 WeakPolarHBondContact O-CB 3.38Å; L300-L304 VanDerWaalsContact O-CG 3.26Å; L300-L304 WeakPolarHBondContact O-CG 3.31Å; L300-L304 PolarHBondContact O-N 2.87Å; E301-L304 PolarHBondContact O-N 3.35Å; L304-E306 VanDerWaalsContact C-N 3.28Å; L304-E306 PolarHBondContact O-N 3.02Å; L304-I307 PolarHBondContact O-N 3.49Å; L304-S308 PolarHBondContact O-N 3.49Å; L304-S308 PolarHBondContact O-OG 2.95Å
305A94.6Very high93.8Very high60 Ų6087.4 Ų87.450%0.49648%0.479SS..Hα-helixtrans-59.7-39.4174.400000111.8E301 L302 R309E301-A305 WeakPolarHBondContact O-CB 3.47Å; E301-A305 PolarHBondContact O-N 3.13Å; L302-A305 PolarHBondContact O-N 3.18Å; A305-R309 VanDerWaalsContact O-CB 3.3Å; A305-R309 WeakPolarHBondContact O-CB 3.44Å; A305-R309 PolarHBondContact O-N 3.08Å
306E94.5Very high93.5Very high80 Ų8088.8 Ų88.837%0.37448%0.475SS..Hα-helixtrans-72.3-32.5176.8-138.4-133.9149.600113.2L302 A303 L304 R309 K310L302-E306 PolarHBondContact O-N 2.87Å; A303-E306 PolarHBondContact O-N 3.06Å; L304-E306 VanDerWaalsContact C-N 3.28Å; L304-E306 PolarHBondContact O-N 3.02Å; E306-R309 IonicContact OE1-CZ 2.71Å; E306-R309 IonicContact OE1-NH2 2.62Å; E306-R309 PolarHBondContact OE1-NH2 3.37Å; E306-K310 VanDerWaalsContact CD-CE 3.48Å; E306-K310 WeakPolarHBondContact O-CB 3.49Å; E306-K310 WeakPolarHBondContact O-CD 3.43Å; E306-K310 VanDerWaalsContact O-CG 3.22Å; E306-K310 WeakPolarHBondContact O-CG 3.37Å; E306-K310 PolarHBondContact O-N 2.88Å; E306-K310 WeakPolarHBondContact OE1-CE 3.43Å; E306-K310 IonicContact OE1-NZ 3.44Å; E306-K310 PolarHBondContact OE1-NZ 3.02Å; E306-K310 IonicContact OE2-NZ 3.95Å; E306-K310 PolarHBondContact OE2-NZ 3.39Å
307I93.8Very high93.2Very high106 Ų10688.7 Ų88.754%0.54447%0.474SS..Hα-helixtrans-66.1-47.5172.3-71.9163.7000110.4A303 L304 R309 K310 S311A303-I307 VanDerWaalsContact O-CG1 3.26Å; A303-I307 WeakPolarHBondContact O-CG1 3.41Å; A303-I307 PolarHBondContact O-N 2.95Å; L304-I307 PolarHBondContact O-N 3.49Å; I307-R309 PolarHBondContact O-N 3Å; I307-K310 WeakPolarHBondContact O-CB 3.49Å; I307-K310 PolarHBondContact O-N 2.69Å; I307-S311 PolarHBondContact O-N 3.3Å
308S93.6Very high92.9Very high66 Ų6691.8 Ų91.846%0.46248%0.482SS..Hα-helixtrans-58-49.2174.8-63.10000111.2L304 K310 S311 E312L304-S308 PolarHBondContact O-N 3.49Å; L304-S308 PolarHBondContact O-OG 2.95Å; S308-K310 VanDerWaalsContact C-N 3.28Å; S308-K310 PolarHBondContact O-N 2.93Å; S308-S311 CarbonylContact O-C 3.6Å; S308-S311 WeakPolarHBondContact O-CA 3.49Å; S308-S311 WeakPolarHBondContact O-CB 3.4Å; S308-S311 PolarHBondContact O-N 3.32Å; S308-E312 WeakPolarHBondContact O-CG 3.5Å; S308-E312 PolarHBondContact O-N 3.44Å
309R94.3Very high92.7Very high94 Ų9495.2 Ų95.236%0.35549%0.489SS..Hα-helixtrans-57.7-37.9175.7-170.8-165.46568.8-1.4112.8A305 E306 I307 Q313A305-R309 VanDerWaalsContact O-CB 3.3Å; A305-R309 WeakPolarHBondContact O-CB 3.44Å; A305-R309 PolarHBondContact O-N 3.08Å; E306-R309 IonicContact OE1-CZ 2.71Å; E306-R309 IonicContact OE1-NH2 2.62Å; E306-R309 PolarHBondContact OE1-NH2 3.37Å; I307-R309 PolarHBondContact O-N 3Å; R309-Q313 WeakPolarHBondContact O-CB 3.43Å; R309-Q313 VanDerWaalsContact O-CG 3.3Å; R309-Q313 WeakPolarHBondContact O-CG 3.43Å; R309-Q313 PolarHBondContact O-N 3.31Å; R309-Q313 VanDerWaalsContact O-N 3.13Å
310K92.6Very high92.3Very high103 Ų10399.1 Ų99.145%0.44849%0.493SS..Hα-helixtrans-69.3-37.9174.4-78.9164174.4159.30111.8E306 I307 S308 Q314E306-K310 VanDerWaalsContact CD-CE 3.48Å; E306-K310 WeakPolarHBondContact O-CB 3.49Å; E306-K310 WeakPolarHBondContact O-CD 3.43Å; E306-K310 VanDerWaalsContact O-CG 3.22Å; E306-K310 WeakPolarHBondContact O-CG 3.37Å; E306-K310 PolarHBondContact O-N 2.88Å; E306-K310 WeakPolarHBondContact OE1-CE 3.43Å; E306-K310 IonicContact OE1-NZ 3.44Å; E306-K310 PolarHBondContact OE1-NZ 3.02Å; E306-K310 IonicContact OE2-NZ 3.95Å; E306-K310 PolarHBondContact OE2-NZ 3.39Å; I307-K310 WeakPolarHBondContact O-CB 3.49Å; I307-K310 PolarHBondContact O-N 2.69Å; S308-K310 VanDerWaalsContact C-N 3.28Å; S308-K310 PolarHBondContact O-N 2.93Å; K310-Q314 WeakPolarHBondContact O-CB 3.33Å; K310-Q314 PolarHBondContact O-N 3.25Å
311S91.3Very high92Very high75 Ų7598 Ų9852%0.52449%0.488SS..Hα-helixtrans-66.2-47.2176-164.10000111.7I307 S308 Q313 Q314 E315I307-S311 PolarHBondContact O-N 3.3Å; S308-S311 CarbonylContact O-C 3.6Å; S308-S311 WeakPolarHBondContact O-CA 3.49Å; S308-S311 WeakPolarHBondContact O-CB 3.4Å; S308-S311 PolarHBondContact O-N 3.32Å; S311-Q313 PolarHBondContact O-N 3.04Å; S311-Q314 WeakPolarHBondContact O-CB 3.29Å; S311-Q314 PolarHBondContact O-N 2.67Å; S311-E315 PolarHBondContact O-N 2.88Å
312E92.7Very high91.8Very high125 Ų12596.4 Ų96.458%0.58448%0.482SS*.Hα-helixtrans-57.6-46.6174.5-69.9166.817600111.3S308 Q314 E315 E316S308-E312 WeakPolarHBondContact O-CG 3.5Å; S308-E312 PolarHBondContact O-N 3.44Å; E312-Q314 PolarHBondContact O-N 3.16Å; E312-E315 PolarHBondContact O-N 3.49Å; E312-E316 WeakPolarHBondContact O-CB 3.4Å; E312-E316 PolarHBondContact O-N 2.95Å
313Q90.6Very high91.6Very high92 Ų9294.6 Ų94.643%0.4348%0.477SS..Hα-helixtrans-65.7-24.9175.7-75.9-175.7-14.300113.7R309 S311 K317R309-Q313 WeakPolarHBondContact O-CB 3.43Å; R309-Q313 VanDerWaalsContact O-CG 3.3Å; R309-Q313 WeakPolarHBondContact O-CG 3.43Å; R309-Q313 PolarHBondContact O-N 3.31Å; R309-Q313 VanDerWaalsContact O-N 3.13Å; S311-Q313 PolarHBondContact O-N 3.04Å; Q313-K317 WeakPolarHBondContact O-CD 3.26Å; Q313-K317 VanDerWaalsContact O-CG 3.22Å; Q313-K317 WeakPolarHBondContact O-CG 3.5Å; Q313-K317 PolarHBondContact O-N 2.67Å
314Q90.1Very high91.2Very high84 Ų8496.6 Ų96.639%0.39349%0.485SS..Hα-helixtrans-80.2-44.8174.6-179.358.821.900111K310 S311 E312 E316 K317 E318K310-Q314 WeakPolarHBondContact O-CB 3.33Å; K310-Q314 PolarHBondContact O-N 3.25Å; S311-Q314 WeakPolarHBondContact O-CB 3.29Å; S311-Q314 PolarHBondContact O-N 2.67Å; E312-Q314 PolarHBondContact O-N 3.16Å; Q314-E316 VanDerWaalsContact C-N 3.27Å; Q314-E316 PolarHBondContact O-N 3.18Å; Q314-K317 WeakPolarHBondContact O-CB 3.2Å; Q314-K317 PolarHBondContact O-N 3.33Å; Q314-K317 VanDerWaalsContact O-N 3.13Å; Q314-E318 WeakPolarHBondContact CG-OE1 3.46Å; Q314-E318 PolarHBondContact NE2-OE1 2.85Å; Q314-E318 WeakPolarHBondContact O-CG 3.38Å; Q314-E318 PolarHBondContact O-N 2.96Å
315E89.4Confident90.9Very high97 Ų9796.4 Ų96.445%0.45348%0.483SS..Hα-helixtrans-60.3-37.5174.6-161.1-162.9154.400111.3S311 E312 E318 K319S311-E315 PolarHBondContact O-N 2.88Å; E312-E315 PolarHBondContact O-N 3.49Å; E315-E318 PolarHBondContact O-N 3.08Å; E315-K319 VanDerWaalsContact O-CG 3.3Å; E315-K319 WeakPolarHBondContact O-CG 3.33Å; E315-K319 PolarHBondContact O-N 2.85Å; E315-K319 WeakPolarHBondContact OE1-CE 3.04Å; E315-K319 IonicContact OE1-NZ 3.57Å; E315-K319 PolarHBondContact OE1-NZ 3.37Å; E315-K319 IonicContact OE2-NZ 2.93Å
316E89.9Confident90.7Very high93 Ų9399 Ų9944%0.43549%0.485SS..Hα-helixtrans-67.1-39.6174.8-149.8-145.8152.500112.4E312 Q314 K319 R320E312-E316 WeakPolarHBondContact O-CB 3.4Å; E312-E316 PolarHBondContact O-N 2.95Å; Q314-E316 VanDerWaalsContact C-N 3.27Å; Q314-E316 PolarHBondContact O-N 3.18Å; E316-K319 PolarHBondContact O-N 3.23Å; E316-R320 VanDerWaalsContact CD-NH2 3.3Å; E316-R320 VanDerWaalsContact O-CG 3.24Å; E316-R320 WeakPolarHBondContact O-CG 3.49Å; E316-R320 PolarHBondContact O-N 3.34Å; E316-R320 IonicContact OE1-CZ 3.69Å; E316-R320 IonicContact OE1-NE 3.6Å; E316-R320 PolarHBondContact OE1-NE 3.44Å; E316-R320 IonicContact OE1-NH2 2.62Å; E316-R320 PolarHBondContact OE1-NH2 3.33Å; E316-R320 IonicContact OE2-CZ 3.11Å; E316-R320 IonicContact OE2-NH2 2.68Å; E316-R320 PolarHBondContact OE2-NH2 2.92Å
317K89.3Confident90.4Very high109 Ų10997.7 Ų97.747%0.47449%0.487SS..Hα-helixtrans-63.8-40.9171.9-73165.6-170169.70111.5Q313 Q314 R320 N321Q313-K317 WeakPolarHBondContact O-CD 3.26Å; Q313-K317 VanDerWaalsContact O-CG 3.22Å; Q313-K317 WeakPolarHBondContact O-CG 3.5Å; Q313-K317 PolarHBondContact O-N 2.67Å; Q314-K317 WeakPolarHBondContact O-CB 3.2Å; Q314-K317 PolarHBondContact O-N 3.33Å; Q314-K317 VanDerWaalsContact O-N 3.13Å; K317-R320 PolarHBondContact O-N 2.93Å; K317-N321 WeakPolarHBondContact O-CB 3.21Å; K317-N321 PolarHBondContact O-N 2.79Å; K317-N321 PolarHBondContact O-ND2 3.08Å; K317-N321 PolarHBondContact O-OD1 3.42Å
318E88.8Confident90.1Very high105 Ų10595.6 Ų95.649%0.49148%0.482SS..Hα-helixtrans-66.1-40178.6-74.7171.1-165.900111.6Q314 E315 N321 L322Q314-E318 WeakPolarHBondContact CG-OE1 3.46Å; Q314-E318 PolarHBondContact NE2-OE1 2.85Å; Q314-E318 WeakPolarHBondContact O-CG 3.38Å; Q314-E318 PolarHBondContact O-N 2.96Å; E315-E318 PolarHBondContact O-N 3.08Å; E318-N321 PolarHBondContact O-N 3.02Å; E318-L322 WeakPolarHBondContact O-CB 3.36Å; E318-L322 PolarHBondContact O-N 3.14Å
319K90.4Very high89.9Confident115 Ų11597.1 Ų97.150%0.548%0.482SS..Hα-helixtrans-60-45.5169.9-72.4164.3-175.31660112E315 E316 L322 V323E315-K319 VanDerWaalsContact O-CG 3.3Å; E315-K319 WeakPolarHBondContact O-CG 3.33Å; E315-K319 PolarHBondContact O-N 2.85Å; E315-K319 WeakPolarHBondContact OE1-CE 3.04Å; E315-K319 IonicContact OE1-NZ 3.57Å; E315-K319 PolarHBondContact OE1-NZ 3.37Å; E315-K319 IonicContact OE2-NZ 2.93Å; E316-K319 PolarHBondContact O-N 3.23Å; K319-L322 PolarHBondContact O-N 2.81Å; K319-V323 WeakPolarHBondContact O-CG2 3.26Å; K319-V323 PolarHBondContact O-N 2.98Å; K319-V323 VanDerWaalsContact O-N 3.16Å
320R88.3Confident89.7Confident152 Ų15296.5 Ų96.557%0.57449%0.488SS*.Hα-helixtrans-62.4-43.1175.6-68.9166.9-177-1529111.7E316 K317 V323 T324E316-R320 VanDerWaalsContact CD-NH2 3.3Å; E316-R320 VanDerWaalsContact O-CG 3.24Å; E316-R320 WeakPolarHBondContact O-CG 3.49Å; E316-R320 PolarHBondContact O-N 3.34Å; E316-R320 IonicContact OE1-CZ 3.69Å; E316-R320 IonicContact OE1-NE 3.6Å; E316-R320 PolarHBondContact OE1-NE 3.44Å; E316-R320 IonicContact OE1-NH2 2.62Å; E316-R320 PolarHBondContact OE1-NH2 3.33Å; E316-R320 IonicContact OE2-CZ 3.11Å; E316-R320 IonicContact OE2-NH2 2.68Å; E316-R320 PolarHBondContact OE2-NH2 2.92Å; K317-R320 PolarHBondContact O-N 2.93Å; R320-V323 PolarHBondContact O-N 3.46Å; R320-T324 PolarHBondContact O-N 2.94Å; R320-T324 VanDerWaalsContact O-N 3.08Å
321N88.5Confident89.5Confident89 Ų8997.2 Ų97.248%0.47649%0.493SS..Hα-helixtrans-64.4-39.9176.7-69.2-13.1000111.9K317 E318 V323 T324 I325K317-N321 WeakPolarHBondContact O-CB 3.21Å; K317-N321 PolarHBondContact O-N 2.79Å; K317-N321 PolarHBondContact O-ND2 3.08Å; K317-N321 PolarHBondContact O-OD1 3.42Å; E318-N321 PolarHBondContact O-N 3.02Å; N321-V323 VanDerWaalsContact C-N 3.3Å; N321-V323 PolarHBondContact O-N 3.2Å; N321-T324 WeakPolarHBondContact CA-OG1 3.38Å; N321-T324 PolarHBondContact O-N 3.33Å; N321-T324 PolarHBondContact O-OG1 3.22Å; N321-I325 VanDerWaalsContact O-CG1 3.27Å; N321-I325 WeakPolarHBondContact O-CG1 3.49Å; N321-I325 PolarHBondContact O-N 2.87Å
322L91.9Very high89.5Confident96 Ų9697.3 Ų97.350%0.50349%0.488SS..Hα-helixtrans-61.7-40.1175.8-178.261.7000111.5E318 K319 I325 Q326E318-L322 WeakPolarHBondContact O-CB 3.36Å; E318-L322 PolarHBondContact O-N 3.14Å; K319-L322 PolarHBondContact O-N 2.81Å; L322-I325 PolarHBondContact O-N 3.28Å; L322-Q326 VanDerWaalsContact O-CG 3.32Å; L322-Q326 WeakPolarHBondContact O-CG 3.45Å; L322-Q326 PolarHBondContact O-N 2.93Å
323V90.4Very high89.4Confident92 Ų9294.2 Ų94.256%0.55848%0.475SS*.Hα-helixtrans-64.9-41.2174.8172.80000111.6K319 R320 N321 Q326 A327K319-V323 WeakPolarHBondContact O-CG2 3.26Å; K319-V323 PolarHBondContact O-N 2.98Å; K319-V323 VanDerWaalsContact O-N 3.16Å; R320-V323 PolarHBondContact O-N 3.46Å; N321-V323 VanDerWaalsContact C-N 3.3Å; N321-V323 PolarHBondContact O-N 3.2Å; V323-Q326 PolarHBondContact O-N 3.44Å; V323-A327 WeakPolarHBondContact O-CB 3.36Å; V323-A327 PolarHBondContact O-N 3.28Å
324T87.1Confident89.4Confident87 Ų8795.3 Ų95.353%0.53448%0.478SS..Hα-helixtrans-68.5-35.617658.90000112.5R320 N321 A327 S328R320-T324 PolarHBondContact O-N 2.94Å; R320-T324 VanDerWaalsContact O-N 3.08Å; N321-T324 WeakPolarHBondContact CA-OG1 3.38Å; N321-T324 PolarHBondContact O-N 3.33Å; N321-T324 PolarHBondContact O-OG1 3.22Å; T324-A327 PolarHBondContact O-N 3.47Å; T324-S328 WeakPolarHBondContact O-CB 3.48Å; T324-S328 PolarHBondContact O-N 3.26Å; T324-S328 PolarHBondContact O-OG 3.5Å
325I87.6Confident89.4Confident105 Ų10596.9 Ų96.954%0.53849%0.489SS..Hα-helixtrans-62.3-48.1172.5-69164.6000110.2N321 L322 A327 S328 Q329N321-I325 VanDerWaalsContact O-CG1 3.27Å; N321-I325 WeakPolarHBondContact O-CG1 3.49Å; N321-I325 PolarHBondContact O-N 2.87Å; L322-I325 PolarHBondContact O-N 3.28Å; I325-A327 VanDerWaalsContact C-N 3.34Å; I325-A327 PolarHBondContact O-N 3.39Å; I325-S328 PolarHBondContact O-N 2.72Å; I325-S328 PolarHBondContact O-OG 3.37Å; I325-Q329 PolarHBondContact O-N 3.4Å
326Q89.9Confident89.4Confident115 Ų11598 Ų9854%0.53749%0.494SS..Hα-helixtrans-59.4-42.3176.5-73.6174.84.700112.2L322 V323 Q329 V330L322-Q326 VanDerWaalsContact O-CG 3.32Å; L322-Q326 WeakPolarHBondContact O-CG 3.45Å; L322-Q326 PolarHBondContact O-N 2.93Å; V323-Q326 PolarHBondContact O-N 3.44Å; Q326-Q329 PolarHBondContact O-N 2.89Å; Q326-V330 WeakPolarHBondContact O-CG2 3.24Å; Q326-V330 PolarHBondContact O-N 2.93Å
327A88.3Confident89.4Confident51 Ų51100 Ų10042%0.42150%0.501SS..Hα-helixtrans-60.6-47.317400000111.8V323 T324 I325 Q329 V330 E331V323-A327 WeakPolarHBondContact O-CB 3.36Å; V323-A327 PolarHBondContact O-N 3.28Å; T324-A327 PolarHBondContact O-N 3.47Å; I325-A327 VanDerWaalsContact C-N 3.34Å; I325-A327 PolarHBondContact O-N 3.39Å; A327-Q329 VanDerWaalsContact C-N 3.33Å; A327-Q329 PolarHBondContact O-N 3.5Å; A327-V330 PolarHBondContact O-N 3.42Å; A327-V330 VanDerWaalsContact O-N 3.17Å; A327-E331 PolarHBondContact O-N 3.07Å
328S86.7Confident89.4Confident62 Ų6299.4 Ų99.443%0.43450%0.503SS..Hα-helixtrans-64.6-34.4179.474.40000113.1T324 I325 E331 L332T324-S328 WeakPolarHBondContact O-CB 3.48Å; T324-S328 PolarHBondContact O-N 3.26Å; T324-S328 PolarHBondContact O-OG 3.5Å; I325-S328 PolarHBondContact O-N 2.72Å; I325-S328 PolarHBondContact O-OG 3.37Å; S328-E331 PolarHBondContact O-N 3.01Å; S328-L332 WeakPolarHBondContact O-CB 3.17Å; S328-L332 PolarHBondContact O-N 3.35Å
329Q89.6Confident89.5Confident99 Ų9999.5 Ų99.546%0.46351%0.506SS..Hα-helixtrans-65.4-43.4173-175.461.655.400111.1I325 Q326 A327 E331 L332 D333I325-Q329 PolarHBondContact O-N 3.4Å; Q326-Q329 PolarHBondContact O-N 2.89Å; A327-Q329 VanDerWaalsContact C-N 3.33Å; A327-Q329 PolarHBondContact O-N 3.5Å; Q329-E331 PolarHBondContact O-N 2.91Å; Q329-L332 PolarHBondContact O-N 3.03Å; Q329-D333 PolarHBondContact NE2-OD1 3.41Å; Q329-D333 WeakPolarHBondContact O-CB 3.21Å; Q329-D333 PolarHBondContact O-N 3.02Å
330V91.3Very high89.4Confident80 Ų8096.3 Ų96.349%0.48550%0.501SS..Hα-helixtrans-63.9-28.9176.3168.50000112.1Q326 A327 K334Q326-V330 WeakPolarHBondContact O-CG2 3.24Å; Q326-V330 PolarHBondContact O-N 2.93Å; A327-V330 PolarHBondContact O-N 3.42Å; A327-V330 VanDerWaalsContact O-N 3.17Å; V330-K334 WeakPolarHBondContact O-CD 3.48Å; V330-K334 VanDerWaalsContact O-CG 3.26Å; V330-K334 WeakPolarHBondContact O-CG 3.32Å; V330-K334 PolarHBondContact O-N 3.24Å
331E87.8Confident89.4Confident119 Ų11994.3 Ų94.356%0.55650%0.5SS*.Hα-helixtrans-75.6-42.6171.5-69.8-177.6169.200112.6A327 S328 Q329 D333 K334 L335A327-E331 PolarHBondContact O-N 3.07Å; S328-E331 PolarHBondContact O-N 3.01Å; Q329-E331 PolarHBondContact O-N 2.91Å; E331-D333 VanDerWaalsContact C-N 3.34Å; E331-D333 PolarHBondContact O-N 2.91Å; E331-K334 WeakPolarHBondContact O-CB 3.47Å; E331-K334 PolarHBondContact O-N 3.17Å; E331-K334 VanDerWaalsContact O-N 3.11Å; E331-L335 WeakPolarHBondContact O-CG 3.3Å; E331-L335 PolarHBondContact O-N 3.06Å
332L90.6Very high89.5Confident77 Ų7798.1 Ų98.140%0.40351%0.507SS..Hα-helixtrans-60.2-42.7175.9-167.9152.3000111.5S328 Q329 K334 L335 Q336S328-L332 WeakPolarHBondContact O-CB 3.17Å; S328-L332 PolarHBondContact O-N 3.35Å; Q329-L332 PolarHBondContact O-N 3.03Å; L332-K334 VanDerWaalsContact C-N 3.34Å; L332-K334 PolarHBondContact O-N 3.35Å; L332-L335 PolarHBondContact O-N 3.18Å; L332-Q336 HydrophobicContact CD2-CG 4.11Å; L332-Q336 WeakPolarHBondContact O-CG 3.39Å; L332-Q336 PolarHBondContact O-N 3.27Å
333D90.6Very high89.3Confident60 Ų6098 Ų9832%0.32150%0.504SS..Hα-helixtrans-58.4-39.6172.5-87.839.7000113.1Q329 E331 K337Q329-D333 PolarHBondContact NE2-OD1 3.41Å; Q329-D333 WeakPolarHBondContact O-CB 3.21Å; Q329-D333 PolarHBondContact O-N 3.02Å; E331-D333 VanDerWaalsContact C-N 3.34Å; E331-D333 PolarHBondContact O-N 2.91Å; D333-K337 WeakPolarHBondContact O-CD 3.27Å; D333-K337 VanDerWaalsContact O-CG 3.29Å; D333-K337 WeakPolarHBondContact O-CG 3.26Å; D333-K337 PolarHBondContact O-N 3.08Å
334K91.2Very high89.2Confident115 Ų115100.6 Ų100.650%0.551%0.508SS..Hα-helixtrans-67.9-43175.6-69.5163.3-167.31660110.8V330 E331 L332 K337 L338V330-K334 WeakPolarHBondContact O-CD 3.48Å; V330-K334 VanDerWaalsContact O-CG 3.26Å; V330-K334 WeakPolarHBondContact O-CG 3.32Å; V330-K334 PolarHBondContact O-N 3.24Å; E331-K334 WeakPolarHBondContact O-CB 3.47Å; E331-K334 PolarHBondContact O-N 3.17Å; E331-K334 VanDerWaalsContact O-N 3.11Å; L332-K334 VanDerWaalsContact C-N 3.34Å; L332-K334 PolarHBondContact O-N 3.35Å; K334-K337 PolarHBondContact O-N 2.68Å; K334-L338 PolarHBondContact O-N 3.37Å
335L90.1Very high89.3Confident116 Ų116100.8 Ų100.861%0.60750%0.503SS*.Hα-helixtrans-64.7-41.9178.6-69.8172000111.8E331 L332 K337 L338 L339E331-L335 WeakPolarHBondContact O-CG 3.3Å; E331-L335 PolarHBondContact O-N 3.06Å; L332-L335 PolarHBondContact O-N 3.18Å; L335-K337 PolarHBondContact O-N 3.23Å; L335-L338 PolarHBondContact O-N 3.03Å; L335-L339 WeakPolarHBondContact O-CB 3.43Å; L335-L339 PolarHBondContact O-N 2.85Å
336Q89.3Confident89.3Confident122 Ų122100.8 Ų100.857%0.5750%0.502SS*.Hα-helixtrans-59.9-43.4173.2-74.8-174.4-4.300112.1L332 L339 A340L332-Q336 HydrophobicContact CD2-CG 4.11Å; L332-Q336 WeakPolarHBondContact O-CG 3.39Å; L332-Q336 PolarHBondContact O-N 3.27Å; Q336-L339 PolarHBondContact O-N 2.94Å; Q336-A340 WeakPolarHBondContact O-CB 3.17Å; Q336-A340 PolarHBondContact O-N 3.31Å
337K89.3Confident89.3Confident134 Ų134101.2 Ų101.258%0.58350%0.502SS*.Hα-helixtrans-62.5-42.4176.3-72.7162.1-172.6156.80111.9D333 K334 L335 A340 M341D333-K337 WeakPolarHBondContact O-CD 3.27Å; D333-K337 VanDerWaalsContact O-CG 3.29Å; D333-K337 WeakPolarHBondContact O-CG 3.26Å; D333-K337 PolarHBondContact O-N 3.08Å; K334-K337 PolarHBondContact O-N 2.68Å; L335-K337 PolarHBondContact O-N 3.23Å; K337-A340 PolarHBondContact O-N 3.48Å; K337-M341 WeakPolarHBondContact O-CG 3.27Å; K337-M341 PolarHBondContact O-N 2.98Å; K337-M341 VanDerWaalsContact O-N 3.12Å
338L90.8Very high89.3Confident97 Ų97105.6 Ų105.651%0.50851%0.513SS..Hα-helixtrans-62.8-45174.5-77.8167.4000112.3K334 L335 A340 M341 R342K334-L338 PolarHBondContact O-N 3.37Å; L335-L338 PolarHBondContact O-N 3.03Å; L338-A340 PolarHBondContact O-N 2.87Å; L338-M341 PolarHBondContact O-N 3.4Å; L338-M341 VanDerWaalsContact O-N 3.12Å; L338-R342 PolarHBondContact O-N 3.48Å
339L89.8Confident89.4Confident107 Ų107107 Ų10756%0.5652%0.519SS*.Hα-helixtrans-61.3-44.7178.4-158.5164.9000110.7L335 Q336 M341 R342 E343L335-L339 WeakPolarHBondContact O-CB 3.43Å; L335-L339 PolarHBondContact O-N 2.85Å; Q336-L339 PolarHBondContact O-N 2.94Å; L339-M341 VanDerWaalsContact C-N 3.27Å; L339-M341 PolarHBondContact O-N 3.5Å; L339-R342 PolarHBondContact O-N 3Å; L339-R342 VanDerWaalsContact O-N 3.16Å; L339-E343 HydrophobicContact CD2-CG 4.28Å; L339-E343 PolarHBondContact O-N 3.34Å
340A89.1Confident89.2Confident47 Ų47109 Ų10939%0.38853%0.526SS..Hα-helixtrans-63.5-26.517500000114Q336 K337 L338 K344Q336-A340 WeakPolarHBondContact O-CB 3.17Å; Q336-A340 PolarHBondContact O-N 3.31Å; K337-A340 PolarHBondContact O-N 3.48Å; L338-A340 PolarHBondContact O-N 2.87Å; A340-K344 WeakPolarHBondContact O-CG 3.46Å
341M87.4Confident89Confident111 Ų111111.2 Ų111.255%0.54753%0.531SS..Hα-helixtrans-74.9-46169.7-62.8-139.4-58.900111.7K337 L338 L339 E343 K344 E345K337-M341 WeakPolarHBondContact O-CG 3.27Å; K337-M341 PolarHBondContact O-N 2.98Å; K337-M341 VanDerWaalsContact O-N 3.12Å; L338-M341 PolarHBondContact O-N 3.4Å; L338-M341 VanDerWaalsContact O-N 3.12Å; L339-M341 VanDerWaalsContact C-N 3.27Å; L339-M341 PolarHBondContact O-N 3.5Å; M341-E343 PolarHBondContact O-N 2.86Å; M341-K344 WeakPolarHBondContact O-CB 3.42Å; M341-K344 PolarHBondContact O-N 3.48Å; M341-E345 PolarHBondContact O-N 3.37Å
342R90.3Very high89.1Confident168 Ų168110.7 Ų110.763%0.63453%0.532SS*.Hα-helixtrans-59.1-34.2176.5-68.4-52.3-161.1178.82.3112.7L338 L339 E345 M346L338-R342 PolarHBondContact O-N 3.48Å; L339-R342 PolarHBondContact O-N 3Å; L339-R342 VanDerWaalsContact O-N 3.16Å; R342-E345 WeakPolarHBondContact CD-OE2 3.37Å; R342-E345 IonicContact CZ-OE2 2.8Å; R342-E345 IonicContact NE-OE2 2.7Å; R342-E345 IonicContact NH1-OE1 3.2Å; R342-E345 IonicContact NH1-OE2 2.71Å; R342-E345 PolarHBondContact NH1-OE2 3.29Å; R342-M346 VanDerWaalsContact O-CB 3.24Å; R342-M346 WeakPolarHBondContact O-CB 3.37Å; R342-M346 PolarHBondContact O-N 3.09Å
343E88.7Confident88.9Confident95 Ų95109.4 Ų109.444%0.44453%0.532SS..Hα-helixtrans-62.1-40171-84.5-161-161.700113.7L339 M341 M346 K347L339-E343 HydrophobicContact CD2-CG 4.28Å; L339-E343 PolarHBondContact O-N 3.34Å; M341-E343 PolarHBondContact O-N 2.86Å; E343-M346 PolarHBondContact O-N 3.36Å; E343-K347 WeakPolarHBondContact O-CB 3.12Å; E343-K347 WeakPolarHBondContact O-CD 3.32Å; E343-K347 VanDerWaalsContact O-CG 3.22Å; E343-K347 WeakPolarHBondContact O-CG 3.47Å; E343-K347 PolarHBondContact O-N 3.38Å; E343-K347 IonicContact OE2-NZ 3.5Å; E343-K347 PolarHBondContact OE2-NZ 3.09Å
344K88.6Confident88.7Confident145 Ų145113.6 Ų113.663%0.6355%0.548SS*.Hα-helixtrans-68.2-43.5178.7-69.2172.2-178.21800110.8A340 M341 K347 H348A340-K344 WeakPolarHBondContact O-CG 3.46Å; M341-K344 WeakPolarHBondContact O-CB 3.42Å; M341-K344 PolarHBondContact O-N 3.48Å; K344-K347 PolarHBondContact O-N 3.08Å; K344-H348 PolarHBondContact O-N 2.95Å
345E87.5Confident88.6Confident91 Ų91111.8 Ų111.843%0.42555%0.546SS..Hα-helixtrans-57.3-49.5171.4-66.1173.2176.600111.2M341 R342 K347 H348 V349M341-E345 PolarHBondContact O-N 3.37Å; R342-E345 WeakPolarHBondContact CD-OE2 3.37Å; R342-E345 IonicContact CZ-OE2 2.8Å; R342-E345 IonicContact NE-OE2 2.7Å; R342-E345 IonicContact NH1-OE1 3.2Å; R342-E345 IonicContact NH1-OE2 2.71Å; R342-E345 PolarHBondContact NH1-OE2 3.29Å; E345-K347 VanDerWaalsContact C-N 3.29Å; E345-K347 PolarHBondContact O-N 3.17Å; E345-H348 WeakPolarHBondContact O-CB 3.5Å; E345-H348 PolarHBondContact O-N 2.84Å; E345-H348 VanDerWaalsContact O-N 3.07Å; E345-V349 WeakPolarHBondContact O-CG2 3.3Å; E345-V349 PolarHBondContact O-N 3.4Å
346M88.9Confident88.4Confident105 Ų105111.1 Ų111.152%0.51754%0.542SS..Hα-helixtrans-61.2-35.5178.5-173.860.76400112.6R342 E343 K350R342-M346 VanDerWaalsContact O-CB 3.24Å; R342-M346 WeakPolarHBondContact O-CB 3.37Å; R342-M346 PolarHBondContact O-N 3.09Å; E343-M346 PolarHBondContact O-N 3.36Å; M346-K350 WeakPolarHBondContact O-CB 3.41Å; M346-K350 WeakPolarHBondContact O-CG 3.49Å; M346-K350 PolarHBondContact O-N 3.31Å
347K88.6Confident88.3Confident124 Ų124109.9 Ų109.954%0.53954%0.543SS..Hα-helixtrans-65.4-42.8172.5-75.1158-178.9157.20111.1E343 K344 E345 K350 Q351E343-K347 WeakPolarHBondContact O-CB 3.12Å; E343-K347 WeakPolarHBondContact O-CD 3.32Å; E343-K347 VanDerWaalsContact O-CG 3.22Å; E343-K347 WeakPolarHBondContact O-CG 3.47Å; E343-K347 PolarHBondContact O-N 3.38Å; E343-K347 IonicContact OE2-NZ 3.5Å; E343-K347 PolarHBondContact OE2-NZ 3.09Å; K344-K347 PolarHBondContact O-N 3.08Å; E345-K347 VanDerWaalsContact C-N 3.29Å; E345-K347 PolarHBondContact O-N 3.17Å; K347-K350 PolarHBondContact O-N 3.15Å; K347-Q351 PolarHBondContact O-N 3.48Å
348H88.6Confident88.2Confident143 Ų143106.7 Ų106.766%0.66254%0.535SS*.Hα-helixtrans-64-43.9172.9-91.1-44000113.3K344 E345 K350 Q351 L352K344-H348 PolarHBondContact O-N 2.95Å; E345-H348 WeakPolarHBondContact O-CB 3.5Å; E345-H348 PolarHBondContact O-N 2.84Å; E345-H348 VanDerWaalsContact O-N 3.07Å; H348-K350 VanDerWaalsContact C-N 3.34Å; H348-K350 PolarHBondContact O-N 2.82Å; H348-Q351 WeakPolarHBondContact O-CB 3.38Å; H348-Q351 PolarHBondContact O-N 2.95Å; H348-Q351 VanDerWaalsContact O-N 3.16Å; H348-L352 PolarHBondContact O-N 2.91Å
349V89.4Confident88Confident91 Ų91107.4 Ų107.455%0.55253%0.534SS*.Hα-helixtrans-60.6-43.4177.3172.50000111E345 Q351 L352 A353E345-V349 WeakPolarHBondContact O-CG2 3.3Å; E345-V349 PolarHBondContact O-N 3.4Å; V349-Q351 PolarHBondContact O-N 3.45Å; V349-L352 PolarHBondContact O-N 2.99Å; V349-A353 WeakPolarHBondContact O-CB 3.5Å; V349-A353 PolarHBondContact O-N 3.04Å
350K85.9Confident87.8Confident142 Ų142108.1 Ų108.162%0.61753%0.529SS*.Hα-helixtrans-62.6-39.2174.2-74.9177.3178.4-176.40112.6M346 K347 H348 K354M346-K350 WeakPolarHBondContact O-CB 3.41Å; M346-K350 WeakPolarHBondContact O-CG 3.49Å; M346-K350 PolarHBondContact O-N 3.31Å; K347-K350 PolarHBondContact O-N 3.15Å; H348-K350 VanDerWaalsContact C-N 3.34Å; H348-K350 PolarHBondContact O-N 2.82Å; K350-K354 WeakPolarHBondContact O-CB 3.2Å; K350-K354 PolarHBondContact O-N 3.38Å
351Q86.9Confident87.7Confident126 Ų126113 Ų11359%0.58954%0.537SS*.Hα-helixtrans-63.1-46.7175.9-161.976.9-3.400111.3K347 H348 V349 K354 T355K347-Q351 PolarHBondContact O-N 3.48Å; H348-Q351 WeakPolarHBondContact O-CB 3.38Å; H348-Q351 PolarHBondContact O-N 2.95Å; H348-Q351 VanDerWaalsContact O-N 3.16Å; V349-Q351 PolarHBondContact O-N 3.45Å; Q351-K354 PolarHBondContact O-N 2.97Å; Q351-T355 PolarHBondContact O-N 3.22Å; Q351-T355 VanDerWaalsContact O-N 3.13Å; Q351-T355 PolarHBondContact O-OG1 3.22Å
352L89.8Confident87.6Confident108 Ų108111.8 Ų111.857%0.56553%0.53SS*.Hα-helixtrans-64.5-45.1178.7-179.261.1000112H348 V349 K354 T355 I356H348-L352 PolarHBondContact O-N 2.91Å; V349-L352 PolarHBondContact O-N 2.99Å; L352-K354 VanDerWaalsContact C-N 3.29Å; L352-K354 PolarHBondContact O-N 2.97Å; L352-T355 WeakPolarHBondContact O-CB 3.47Å; L352-T355 PolarHBondContact O-N 3.02Å; L352-T355 VanDerWaalsContact O-N 3.13Å; L352-I356 HydrophobicContact CD1-CD1 4.38Å; L352-I356 HydrophobicContact CG-CD1 4.08Å; L352-I356 WeakPolarHBondContact O-CG1 3.31Å; L352-I356 PolarHBondContact O-N 3.05Å
353A86.5Confident87.4Confident51 Ų51106.7 Ų106.742%0.42152%0.517SS..Hα-helixtrans-58.9-40.517600000112V349 I356 V357V349-A353 WeakPolarHBondContact O-CB 3.5Å; V349-A353 PolarHBondContact O-N 3.04Å; A353-I356 PolarHBondContact O-N 3.27Å; A353-V357 WeakPolarHBondContact O-CG2 3.33Å; A353-V357 PolarHBondContact O-N 3.49Å
354K86.8Confident87.1Confident147 Ų147104.6 Ų104.664%0.63951%0.508SS*.Hα-helixtrans-61-44.1174-173.3179.4178.5-177.70111.8K350 Q351 L352 V357 V358K350-K354 WeakPolarHBondContact O-CB 3.2Å; K350-K354 PolarHBondContact O-N 3.38Å; Q351-K354 PolarHBondContact O-N 2.97Å; L352-K354 VanDerWaalsContact C-N 3.29Å; L352-K354 PolarHBondContact O-N 2.97Å; K354-V357 PolarHBondContact O-N 2.73Å; K354-V358 WeakPolarHBondContact O-CG2 3.42Å; K354-V358 PolarHBondContact O-N 3.48Å
355T87.9Confident87Confident77 Ų77102.5 Ų102.547%0.47250%0.5SS..Hα-helixtrans-61.8-42.8176.3-560000112.1Q351 L352 V357 V358 K359Q351-T355 PolarHBondContact O-N 3.22Å; Q351-T355 VanDerWaalsContact O-N 3.13Å; Q351-T355 PolarHBondContact O-OG1 3.22Å; L352-T355 WeakPolarHBondContact O-CB 3.47Å; L352-T355 PolarHBondContact O-N 3.02Å; L352-T355 VanDerWaalsContact O-N 3.13Å; T355-V357 PolarHBondContact O-N 2.93Å; T355-V358 PolarHBondContact O-N 3.13Å; T355-K359 PolarHBondContact O-N 3.39Å
356I86.6Confident87Confident103 Ų103104.3 Ų104.353%0.52851%0.507SS..Hα-helixtrans-62.2-43177.5-67.4166.5000111L352 A353 K359 R360L352-I356 HydrophobicContact CD1-CD1 4.38Å; L352-I356 HydrophobicContact CG-CD1 4.08Å; L352-I356 WeakPolarHBondContact O-CG1 3.31Å; L352-I356 PolarHBondContact O-N 3.05Å; A353-I356 PolarHBondContact O-N 3.27Å; I356-K359 PolarHBondContact O-N 3.02Å; I356-R360 WeakPolarHBondContact O-CB 3.31Å; I356-R360 PolarHBondContact O-N 3.3Å
357V86.9Confident86.7Confident95 Ų95100.4 Ų100.458%0.57649%0.487SS*.Hα-helixtrans-65.5-38.8177.5171.20000112A353 K354 T355 R360 R361A353-V357 WeakPolarHBondContact O-CG2 3.33Å; A353-V357 PolarHBondContact O-N 3.49Å; K354-V357 PolarHBondContact O-N 2.73Å; T355-V357 PolarHBondContact O-N 2.93Å; V357-R360 PolarHBondContact O-N 3.49Å; V357-R361 PolarHBondContact O-N 3.46Å; V357-R361 VanDerWaalsContact O-N 3.13Å
358V87.1Confident86.5Confident68 Ų68100.2 Ų100.241%0.41249%0.488SS..Hα-helixtrans-63.5-48.5173.9171.70000110.7K354 T355 R360 R361 E362K354-V358 WeakPolarHBondContact O-CG2 3.42Å; K354-V358 PolarHBondContact O-N 3.48Å; T355-V358 PolarHBondContact O-N 3.13Å; V358-R360 VanDerWaalsContact C-N 3.34Å; V358-R360 PolarHBondContact O-N 2.91Å; V358-R361 WeakPolarHBondContact O-CB 3.29Å; V358-R361 PolarHBondContact O-N 2.91Å; V358-E362 PolarHBondContact O-N 3.41Å; V358-E362 VanDerWaalsContact O-N 3.12Å
359K86.5Confident86.3Confident112 Ų112100.4 Ų100.449%0.48749%0.489SS..Hα-helixtrans-64.9-34.3178.3-70.1-45.2-168.4-172.10113.4T355 I356 E362 V363T355-K359 PolarHBondContact O-N 3.39Å; I356-K359 PolarHBondContact O-N 3.02Å; K359-E362 VanDerWaalsContact CD-CD 3.47Å; K359-E362 WeakPolarHBondContact CD-OE1 3.3Å; K359-E362 WeakPolarHBondContact CD-OE2 3.47Å; K359-E362 WeakPolarHBondContact CE-OE2 3.5Å; K359-E362 IonicContact NZ-OE1 3.99Å; K359-E362 PolarHBondContact NZ-OE1 3.43Å; K359-E362 IonicContact NZ-OE2 2.72Å; K359-E362 PolarHBondContact NZ-OE2 3.37Å; K359-E362 PolarHBondContact O-N 3.48Å; K359-V363 WeakPolarHBondContact O-CG2 3.39Å; K359-V363 PolarHBondContact O-N 2.62Å
360R86Confident86Confident122 Ų12297.3 Ų97.346%0.4647%0.473SS..Hα-helixtrans-61.3-44.7172.4-179.7168.5176.6147.63.5111.6I356 V357 V358 V363 E364 N460I356-R360 WeakPolarHBondContact O-CB 3.31Å; I356-R360 PolarHBondContact O-N 3.3Å; V357-R360 PolarHBondContact O-N 3.49Å; V358-R360 VanDerWaalsContact C-N 3.34Å; V358-R360 PolarHBondContact O-N 2.91Å; R360-V363 PolarHBondContact O-N 3.27Å; R360-E364 HydrophobicContact CG-CG 4.33Å; R360-E364 VanDerWaalsContact CG-OE1 3.3Å; R360-E364 WeakPolarHBondContact CG-OE1 3.49Å; R360-E364 IonicContact CZ-OE1 2.85Å; R360-E364 IonicContact NE-OE1 2.67Å; R360-E364 PolarHBondContact NE-OE1 3.45Å; R360-E364 IonicContact NH2-OE1 2.85Å; R360-E364 PolarHBondContact NH2-OE1 2.91Å; R360-E364 WeakPolarHBondContact O-CG 3.37Å; R360-E364 PolarHBondContact O-N 3.02Å; R360-N460 PolarHBondContact NH2-OD1 3.02Å
361R86.5Confident85.9Confident148 Ų14891.3 Ų91.356%0.55845%0.448SS*.Hα-helixtrans-59.8-47.2177.3-172-167.6-61.2-171.1-4.5112.4V357 V358 V363 E364 E365V357-R361 PolarHBondContact O-N 3.46Å; V357-R361 VanDerWaalsContact O-N 3.13Å; V358-R361 WeakPolarHBondContact O-CB 3.29Å; V358-R361 PolarHBondContact O-N 2.91Å; R361-V363 PolarHBondContact O-N 3.45Å; R361-E364 PolarHBondContact O-N 3.27Å; R361-E365 WeakPolarHBondContact CD-OE1 3.23Å; R361-E365 HydrophobicContact CG-CG 4.15Å; R361-E365 VanDerWaalsContact CG-OE1 3.3Å; R361-E365 WeakPolarHBondContact CG-OE1 3.44Å; R361-E365 WeakPolarHBondContact O-CG 3.29Å; R361-E365 PolarHBondContact O-N 3.46Å
362E86.3Confident85.6Confident87 Ų8786.7 Ų86.741%0.40743%0.434SS..Hα-helixtrans-54.1-38.9180-69.8172.5-158.100112.2V358 K359 F366V358-E362 PolarHBondContact O-N 3.41Å; V358-E362 VanDerWaalsContact O-N 3.12Å; K359-E362 VanDerWaalsContact CD-CD 3.47Å; K359-E362 WeakPolarHBondContact CD-OE1 3.3Å; K359-E362 WeakPolarHBondContact CD-OE2 3.47Å; K359-E362 WeakPolarHBondContact CE-OE2 3.5Å; K359-E362 IonicContact NZ-OE1 3.99Å; K359-E362 PolarHBondContact NZ-OE1 3.43Å; K359-E362 IonicContact NZ-OE2 2.72Å; K359-E362 PolarHBondContact NZ-OE2 3.37Å; K359-E362 PolarHBondContact O-N 3.48Å; E362-F366 PolarHBondContact O-N 2.87Å
363V85.4Confident85.3Confident60 Ų6087 Ų8736%0.36443%0.432SS..Hα-helixtrans-80.2-34.1177.5-162.10000111.8K359 R360 R361 E365 F366 F367 M459K359-V363 WeakPolarHBondContact O-CG2 3.39Å; K359-V363 PolarHBondContact O-N 2.62Å; R360-V363 PolarHBondContact O-N 3.27Å; R361-V363 PolarHBondContact O-N 3.45Å; V363-E365 VanDerWaalsContact C-N 3.34Å; V363-E365 PolarHBondContact O-N 3.3Å; V363-F366 PolarHBondContact O-N 3Å; V363-F367 HydrophobicContact CG1-CD2 3.95Å; V363-F367 HydrophobicContact CG1-CE2 3.84Å; V363-F367 WeakPolarHBondContact O-CD2 3.33Å; V363-F367 PolarHBondContact O-N 3.2Å; V363-F367 VanDerWaalsContact O-N 3.13Å; V363-M459 HydrophobicContact CB-CE 3.95Å; V363-M459 HydrophobicContact CG1-CE 3.61Å; V363-M459 HydrophobicContact CG1-SD 3.7Å
364E83.2Confident85.2Confident51 Ų5185.1 Ų85.124%0.23842%0.415CS..Hα-helixtrans-63.7-36.7174.1-74.8171176.300112.8R360 R361 H368 F456 N460R360-E364 HydrophobicContact CG-CG 4.33Å; R360-E364 VanDerWaalsContact CG-OE1 3.3Å; R360-E364 WeakPolarHBondContact CG-OE1 3.49Å; R360-E364 IonicContact CZ-OE1 2.85Å; R360-E364 IonicContact NE-OE1 2.67Å; R360-E364 PolarHBondContact NE-OE1 3.45Å; R360-E364 IonicContact NH2-OE1 2.85Å; R360-E364 PolarHBondContact NH2-OE1 2.91Å; R360-E364 WeakPolarHBondContact O-CG 3.37Å; R360-E364 PolarHBondContact O-N 3.02Å; R361-E364 PolarHBondContact O-N 3.27Å; E364-H368 PolarHBondContact O-N 3.5Å; E364-H368 PolarHBondContact O-ND1 2.86Å; E364-F456 HydrophobicContact CB-CE2 4.23Å; E364-F456 HydrophobicContact CG-CE2 4.11Å; E364-N460 PolarHBondContact OE1-OD1 2.96Å
365E85.7Confident85Confident102 Ų10284.3 Ų84.348%0.47741%0.408SS..Hα-helixtrans-66.2-49.1174-73.4167.6171.300110.7R361 V363 F367 H368 E369R361-E365 WeakPolarHBondContact CD-OE1 3.23Å; R361-E365 HydrophobicContact CG-CG 4.15Å; R361-E365 VanDerWaalsContact CG-OE1 3.3Å; R361-E365 WeakPolarHBondContact CG-OE1 3.44Å; R361-E365 WeakPolarHBondContact O-CG 3.29Å; R361-E365 PolarHBondContact O-N 3.46Å; V363-E365 VanDerWaalsContact C-N 3.34Å; V363-E365 PolarHBondContact O-N 3.3Å; E365-F367 VanDerWaalsContact C-N 3.34Å; E365-F367 PolarHBondContact O-N 2.89Å; E365-H368 WeakPolarHBondContact O-CB 3.33Å; E365-H368 PolarHBondContact O-N 3.4Å; E365-E369 PolarHBondContact O-N 2.84Å; E365-E369 VanDerWaalsContact O-N 3.08Å
366F86.8Confident84.8Confident129 Ų12987.4 Ų87.457%0.56642%0.417SS*.Hα-helixtrans-54.4-43.3176.4172.4-98.9000113.6E362 V363 H368 E369 A370E362-F366 PolarHBondContact O-N 2.87Å; V363-F366 PolarHBondContact O-N 3Å; F366-H368 PolarHBondContact O-N 2.85Å; F366-E369 PolarHBondContact O-N 3.22Å; F366-A370 WeakPolarHBondContact O-CB 3.26Å; F366-A370 PolarHBondContact O-N 2.92Å
367F84.3Confident84.5Confident23 Ų2385.9 Ų85.910%0.10141%0.408CS..Hα-helixtrans-68.6-31.6177.4-87.8-75.9000113.4V363 E365 L371 L452 L455 F456 M459V363-F367 HydrophobicContact CG1-CD2 3.95Å; V363-F367 HydrophobicContact CG1-CE2 3.84Å; V363-F367 WeakPolarHBondContact O-CD2 3.33Å; V363-F367 PolarHBondContact O-N 3.2Å; V363-F367 VanDerWaalsContact O-N 3.13Å; E365-F367 VanDerWaalsContact C-N 3.34Å; E365-F367 PolarHBondContact O-N 2.89Å; F367-L371 WeakPolarHBondContact O-CB 3.37Å; F367-L371 WeakPolarHBondContact O-CG 3.37Å; F367-L371 PolarHBondContact O-N 3.31Å; F367-L452 HydrophobicContact CD1-CD2 4.46Å; F367-L452 HydrophobicContact CE1-CD2 4.27Å; F367-L455 HydrophobicContact CE1-CB 3.8Å; F367-L455 HydrophobicContact CZ-CB 4.22Å; F367-F456 HydrophobicContact CB-CB 4.29Å; F367-F456 HydrophobicContact CB-CD2 3.47Å; F367-F456 VanDerWaalsContact CB-CD2 3.47Å; F367-F456 HydrophobicContact CB-CE2 4.19Å; F367-F456 HydrophobicContact CB-CG 4.21Å; F367-F456 HydrophobicContact CD1-CB 4.27Å; F367-F456 HydrophobicContact CD2-CD2 4.42Å; F367-F456 HydrophobicContact CG-CB 4.32Å; F367-F456 HydrophobicContact CG-CD2 4.01Å; F367-M459 HydrophobicContact CD2-CE 3.91Å; F367-M459 HydrophobicContact CD2-SD 4.12Å; F367-M459 HydrophobicContact CE2-CE 4.03Å; F367-M459 HydrophobicContact CE2-SD 3.6Å; F367-M459 VanDerWaalsContact CE2-SD 3.6Å; F367-M459 HydrophobicContact CZ-SD 4.5Å
368H82.4Confident84.1Confident119 Ų11982 Ų8255%0.55138%0.383SS*.Hα-helixtrans-67.7-42.7174-8384.7000111.8E364 E365 F366 L371 G372 F456E364-H368 PolarHBondContact O-N 3.5Å; E364-H368 PolarHBondContact O-ND1 2.86Å; E365-H368 WeakPolarHBondContact O-CB 3.33Å; E365-H368 PolarHBondContact O-N 3.4Å; F366-H368 PolarHBondContact O-N 2.85Å; H368-L371 PolarHBondContact O-N 3.3Å; H368-G372 PolarHBondContact O-N 3.17Å; H368-F456 AromaticContact CE1-CE2 3.99Å; H368-F456 AromaticContact CE1-CZ 3.45Å; H368-F456 VanDerWaalsContact CE1-CZ 3.45Å; H368-F456 WeakPolarHBondContact CE1-CZ 3.34Å; H368-F456 AromaticContact ND1-CZ 3.97Å
369E85.6Confident83.8Confident147 Ų14783.5 Ų83.569%0.68739%0.393SS*.Hα-helixtrans-63-45.8176.3-67.1-174.3161.400111.5E365 F366 L371 G372 H373E365-E369 PolarHBondContact O-N 2.84Å; E365-E369 VanDerWaalsContact O-N 3.08Å; F366-E369 PolarHBondContact O-N 3.22Å; E369-L371 PolarHBondContact O-N 3.44Å; E369-G372 PolarHBondContact O-N 2.88Å; E369-H373 PolarHBondContact O-N 3.3Å
370A83.7Confident83.5Confident27 Ų2780.5 Ų80.522%0.22339%0.389CS..Hα-helixtrans-60.5-43.3177.200000112.8F366 H373 V374 L452F366-A370 WeakPolarHBondContact O-CB 3.26Å; F366-A370 PolarHBondContact O-N 2.92Å; A370-H373 PolarHBondContact O-N 2.87Å; A370-V374 PolarHBondContact O-N 3.22Å; A370-L452 HydrophobicContact CB-CD1 4.22Å
371L82.3Confident83.1Confident16 Ų1676.1 Ų76.18%0.08438%0.377CS..Hα-helixtrans-66.8-37.5174.8-80.8168000112.5F367 H368 E369 V374 R375 E449 L452 S453F367-L371 WeakPolarHBondContact O-CB 3.37Å; F367-L371 WeakPolarHBondContact O-CG 3.37Å; F367-L371 PolarHBondContact O-N 3.31Å; H368-L371 PolarHBondContact O-N 3.3Å; E369-L371 PolarHBondContact O-N 3.44Å; L371-V374 PolarHBondContact O-N 3.22Å; L371-R375 WeakPolarHBondContact O-CG 3.22Å; L371-R375 PolarHBondContact O-N 3.04Å; L371-R375 VanDerWaalsContact O-N 3.08Å; L371-E449 HydrophobicContact CD2-CG 4.18Å; L371-L452 HydrophobicContact CD2-CB 3.54Å; L371-L452 HydrophobicContact CG-CB 3.98Å; L371-S453 WeakPolarHBondContact CD2-OG 3.41Å
372G82.1Confident82.7Confident28 Ų2872.8 Ų72.829%0.28937%0.367SS..Hα-helixtrans-59.7-47.9174.500000112.2H368 E369 R375 Q376H368-G372 PolarHBondContact O-N 3.17Å; E369-G372 PolarHBondContact O-N 2.88Å; G372-R375 PolarHBondContact O-N 3.4Å; G372-Q376 WeakPolarHBondContact O-CG 3.2Å; G372-Q376 PolarHBondContact O-N 3.41Å; G372-Q376 VanDerWaalsContact O-N 3.11Å
373H83.8Confident82.4Confident116 Ų11672.9 Ų72.954%0.53737%0.369SS..Hα-helixtrans-62.4-44178.7-169-41.5000112.2E369 A370 R375 Q376 E377E369-H373 PolarHBondContact O-N 3.3Å; A370-H373 PolarHBondContact O-N 2.87Å; H373-R375 VanDerWaalsContact C-N 3.35Å; H373-R375 PolarHBondContact O-N 2.92Å; H373-Q376 PolarHBondContact O-N 2.82Å; H373-E377 PolarHBondContact O-N 2.95Å
374V83.5Confident82Confident10 Ų1074.1 Ų74.16%0.06137%0.371CS..Hα-helixtrans-65.1-38.9178.9171.50000111.5A370 L371 E377 I378 W445 K448 E449 L452A370-V374 PolarHBondContact O-N 3.22Å; L371-V374 PolarHBondContact O-N 3.22Å; V374-E377 PolarHBondContact O-N 3.22Å; V374-I378 HydrophobicContact CG1-CD1 4.19Å; V374-I378 WeakPolarHBondContact O-CG1 3.07Å; V374-I378 PolarHBondContact O-N 3.06Å; V374-W445 HydrophobicContact CG1-CE3 4.27Å; V374-W445 VanDerWaalsContact CG1-O 3.28Å; V374-W445 WeakPolarHBondContact CG1-O 3.4Å; V374-W445 HydrophobicContact CG2-CE3 4.23Å; V374-W445 HydrophobicContact CG2-CZ3 4.29Å; V374-K448 HydrophobicContact CG1-CB 4.05Å; V374-K448 HydrophobicContact CG2-CB 4.37Å; V374-E449 HydrophobicContact CG1-CB 3.89Å; V374-L452 HydrophobicContact CG2-CD1 3.76Å
375R83.3Confident81.5Confident130 Ų13074.7 Ų74.749%0.49138%0.376SS..Hα-helixtrans-63.4-40.6176.4-77.8176.9170.6154.99.1113.3L371 G372 H373 E377 I378 V379 E449L371-R375 WeakPolarHBondContact O-CG 3.22Å; L371-R375 PolarHBondContact O-N 3.04Å; L371-R375 VanDerWaalsContact O-N 3.08Å; G372-R375 PolarHBondContact O-N 3.4Å; H373-R375 VanDerWaalsContact C-N 3.35Å; H373-R375 PolarHBondContact O-N 2.92Å; R375-E377 VanDerWaalsContact C-N 3.31Å; R375-E377 PolarHBondContact O-N 3.31Å; R375-I378 PolarHBondContact O-N 3.05Å; R375-V379 WeakPolarHBondContact O-CG2 3.26Å; R375-V379 PolarHBondContact O-N 3.07Å; R375-E449 HydrophobicContact CG-CG 4.39Å; R375-E449 IonicContact CZ-OE1 3.56Å; R375-E449 IonicContact NE-OE1 2.67Å; R375-E449 PolarHBondContact NE-OE1 3.04Å; R375-E449 IonicContact NH2-OE1 3.51Å; R375-E449 PolarHBondContact NH2-OE1 3.15Å
376Q82.6Confident80.9Confident142 Ų14273.8 Ų73.866%0.66437%0.372SS*.Hα-helixtrans-61.8-42175.9-71173.5700111.1G372 H373 V379 A380G372-Q376 WeakPolarHBondContact O-CG 3.2Å; G372-Q376 PolarHBondContact O-N 3.41Å; G372-Q376 VanDerWaalsContact O-N 3.11Å; H373-Q376 PolarHBondContact O-N 2.82Å; Q376-V379 PolarHBondContact O-N 2.85Å; Q376-A380 PolarHBondContact O-N 2.86Å
377E81.6Confident80.4Confident72 Ų7272.7 Ų72.734%0.33637%0.367SS..Hα-helixtrans-68-35.8179.8-160.260.2-15000113H373 V374 R375 V379 A380 S381 W445H373-E377 PolarHBondContact O-N 2.95Å; V374-E377 PolarHBondContact O-N 3.22Å; R375-E377 VanDerWaalsContact C-N 3.31Å; R375-E377 PolarHBondContact O-N 3.31Å; E377-V379 VanDerWaalsContact C-N 3.32Å; E377-V379 PolarHBondContact O-N 3.39Å; E377-A380 PolarHBondContact O-N 2.87Å; E377-S381 VanDerWaalsContact O-CB 3.28Å; E377-S381 WeakPolarHBondContact O-CB 3.5Å; E377-S381 PolarHBondContact O-N 2.75Å; E377-W445 HydrophobicContact CB-CD2 4.09Å; E377-W445 HydrophobicContact CB-CE3 4.29Å; E377-W445 HydrophobicContact CB-CG 4.34Å; E377-W445 HydrophobicContact CG-CD2 3.62Å; E377-W445 HydrophobicContact CG-CE3 4.15Å; E377-W445 HydrophobicContact CG-CG 3.97Å; E377-W445 HydrophobicContact CG-CH2 4.25Å; E377-W445 HydrophobicContact CG-CZ2 3.72Å; E377-W445 HydrophobicContact CG-CZ3 4.44Å
378I76.9Confident79.9Confident12 Ų1276.2 Ų76.26%0.06238%0.383CS..Hα-helixtrans-59.3-43.2171-68.4168.5000111.1V374 R375 K382 W445 E446 E449V374-I378 HydrophobicContact CG1-CD1 4.19Å; V374-I378 WeakPolarHBondContact O-CG1 3.07Å; V374-I378 PolarHBondContact O-N 3.06Å; R375-I378 PolarHBondContact O-N 3.05Å; I378-K382 HydrophobicContact CG2-CD 4.02Å; I378-K382 VanDerWaalsContact CG2-NZ 3.34Å; I378-K382 WeakPolarHBondContact O-CG 3.04Å; I378-K382 PolarHBondContact O-N 3.05Å; I378-K382 VanDerWaalsContact O-N 3.1Å; I378-W445 HydrophobicContact CD1-CB 4.45Å; I378-W445 HydrophobicContact CG1-CB 3.53Å; I378-E446 HydrophobicContact CD1-CG 4.39Å; I378-E446 HydrophobicContact CG1-CG 4.5Å; I378-E446 HydrophobicContact CG2-CG 4.45Å; I378-E449 HydrophobicContact CD1-CB 4Å; I378-E449 VanDerWaalsContact CD1-OE2 3.29Å; I378-E449 WeakPolarHBondContact CD1-OE2 3.17Å
379V80.9Confident79.3Confident101 Ų10172.2 Ų72.261%0.61237%0.371SS*.Hα-helixtrans-69.2-42.6179.5174.70000111R375 Q376 E377 K382 L383R375-V379 WeakPolarHBondContact O-CG2 3.26Å; R375-V379 PolarHBondContact O-N 3.07Å; Q376-V379 PolarHBondContact O-N 2.85Å; E377-V379 VanDerWaalsContact C-N 3.32Å; E377-V379 PolarHBondContact O-N 3.39Å; V379-K382 PolarHBondContact O-N 3.31Å; V379-L383 WeakPolarHBondContact O-CB 3.31Å; V379-L383 PolarHBondContact O-N 2.88Å
380A79.8Confident78.6Confident48 Ų4869.3 Ų69.340%0.39736%0.36SS..Hα-helixtrans-60-46.9175.500000111.9Q376 E377 K382 L383 Q384Q376-A380 PolarHBondContact O-N 2.86Å; E377-A380 PolarHBondContact O-N 2.87Å; A380-K382 PolarHBondContact O-N 2.84Å; A380-L383 PolarHBondContact O-N 3.04Å; A380-Q384 PolarHBondContact O-N 2.88Å
381S79.1Confident78.2Confident31 Ų3174.7 Ų74.722%0.21738%0.38CS..Hα-helixtrans-56.5-49.3176177.50000112.2E377 L383 Q384 N385E377-S381 VanDerWaalsContact O-CB 3.28Å; E377-S381 WeakPolarHBondContact O-CB 3.5Å; E377-S381 PolarHBondContact O-N 2.75Å; S381-L383 PolarHBondContact O-N 3.28Å; S381-Q384 PolarHBondContact O-N 3.26Å; S381-N385 PolarHBondContact O-N 3.38Å; S381-N385 PolarHBondContact O-ND2 2.84Å
382K77.4Confident77.8Confident78 Ų7877.6 Ų77.634%0.33940%0.396SS..Hα-helixtrans-64.4-40.9-179.4-73.9169.7-177.6169.80112.6I378 V379 A380 Q384 N385 E386 Y421 E446I378-K382 HydrophobicContact CG2-CD 4.02Å; I378-K382 VanDerWaalsContact CG2-NZ 3.34Å; I378-K382 WeakPolarHBondContact O-CG 3.04Å; I378-K382 PolarHBondContact O-N 3.05Å; I378-K382 VanDerWaalsContact O-N 3.1Å; V379-K382 PolarHBondContact O-N 3.31Å; A380-K382 PolarHBondContact O-N 2.84Å; K382-Q384 VanDerWaalsContact C-N 3.32Å; K382-Q384 PolarHBondContact O-N 3.47Å; K382-N385 PolarHBondContact O-N 3.09Å; K382-E386 PolarHBondContact O-N 2.88Å; K382-E386 VanDerWaalsContact O-N 3.09Å; K382-Y421 HydrophobicContact CB-CE1 4.28Å; K382-Y421 HydrophobicContact CG-CE1 4.4Å; K382-Y421 PolarHBondContact O-OH 3.37Å; K382-E446 VanDerWaalsContact CE-OE1 3.24Å; K382-E446 WeakPolarHBondContact CE-OE1 3.36Å; K382-E446 IonicContact NZ-OE1 3.87Å
383L79.8Confident77.3Confident88 Ų8879.5 Ų79.546%0.46140%0.395SS..Hα-helixtrans-65.4-33.8175.6-177.265.4000112.7V379 A380 S381 K387V379-L383 WeakPolarHBondContact O-CB 3.31Å; V379-L383 PolarHBondContact O-N 2.88Å; A380-L383 PolarHBondContact O-N 3.04Å; S381-L383 PolarHBondContact O-N 3.28Å; L383-K387 WeakPolarHBondContact O-CG 3.13Å; L383-K387 PolarHBondContact O-N 3Å
384Q77.1Confident76.8Confident87 Ų8781 Ų8141%0.40740%0.396SS..Hα-helixtrans-71.2-44.9176.3-174.761.115.100111.6A380 S381 K382 E386 K387 E388A380-Q384 PolarHBondContact O-N 2.88Å; S381-Q384 PolarHBondContact O-N 3.26Å; K382-Q384 VanDerWaalsContact C-N 3.32Å; K382-Q384 PolarHBondContact O-N 3.47Å; Q384-E386 VanDerWaalsContact C-N 3.29Å; Q384-E386 PolarHBondContact O-N 2.79Å; Q384-K387 PolarHBondContact O-N 3.41Å; Q384-K387 VanDerWaalsContact O-N 3.15Å; Q384-E388 WeakPolarHBondContact CG-OE1 3.39Å; Q384-E388 PolarHBondContact NE2-OE1 2.83Å; Q384-E388 PolarHBondContact O-N 2.72Å
385N72Confident76.4Confident62 Ų6285 Ų8533%0.33241%0.414SS..Hα-helixtrans-59.4-38175.9-80.9-94.7000112.1S381 K382 A389 M424S381-N385 PolarHBondContact O-N 3.38Å; S381-N385 PolarHBondContact O-ND2 2.84Å; K382-N385 PolarHBondContact O-N 3.09Å; N385-A389 VanDerWaalsContact O-CB 3.27Å; N385-A389 WeakPolarHBondContact O-CB 3.17Å; N385-A389 PolarHBondContact O-N 2.59Å; N385-M424 HydrophobicContact CB-SD 4.18Å
386E73Confident75.9Confident84 Ų8483 Ų8339%0.39341%0.409SS..Hα-helixtrans-62.7-44.1174.6-170.2177.4-163.500112.4K382 Q384 L390K382-E386 PolarHBondContact O-N 2.88Å; K382-E386 VanDerWaalsContact O-N 3.09Å; Q384-E386 VanDerWaalsContact C-N 3.29Å; Q384-E386 PolarHBondContact O-N 2.79Å; E386-L390 VanDerWaalsContact O-CB 3.25Å; E386-L390 WeakPolarHBondContact O-CB 3.35Å; E386-L390 PolarHBondContact O-N 3.42Å
387K76.3Confident75.2Confident106 Ų10680.5 Ų80.546%0.46140%0.396SS..Hα-helixtrans-63.7-45.4177.7-70.2168.2-174.4167.70111.9L383 Q384 L390 Q391L383-K387 WeakPolarHBondContact O-CG 3.13Å; L383-K387 PolarHBondContact O-N 3Å; Q384-K387 PolarHBondContact O-N 3.41Å; Q384-K387 VanDerWaalsContact O-N 3.15Å; K387-L390 PolarHBondContact O-N 3.5Å; K387-Q391 WeakPolarHBondContact O-CG 3.33Å; K387-Q391 PolarHBondContact O-N 3.34Å
388E75.8Confident74.6Confident96 Ų9684.4 Ų84.445%0.44941%0.407SS..Hα-helixtrans-65.2-48.5-179.6-72.5175.1-170.100110.8Q384 L390 Q391 D392Q384-E388 WeakPolarHBondContact CG-OE1 3.39Å; Q384-E388 PolarHBondContact NE2-OE1 2.83Å; Q384-E388 PolarHBondContact O-N 2.72Å; E388-L390 VanDerWaalsContact C-N 3.29Å; E388-L390 PolarHBondContact O-N 2.97Å; E388-Q391 PolarHBondContact O-N 2.94Å; E388-Q391 VanDerWaalsContact O-N 3.16Å; E388-D392 VanDerWaalsContact O-CB 3.31Å; E388-D392 WeakPolarHBondContact O-CB 3.41Å; E388-D392 PolarHBondContact O-N 3.43Å
389A68.6Low74.3Confident36 Ų3687 Ų8730%0.29842%0.419SS..Hα-helixtrans-61.5-34.6175.800000112.9N385 Y393 L420N385-A389 VanDerWaalsContact O-CB 3.27Å; N385-A389 WeakPolarHBondContact O-CB 3.17Å; N385-A389 PolarHBondContact O-N 2.59Å; A389-Y393 VanDerWaalsContact O-CB 3.27Å; A389-Y393 WeakPolarHBondContact O-CB 3.38Å; A389-Y393 PolarHBondContact O-N 3.44Å; A389-L420 HydrophobicContact CB-CD2 3.81Å
390L72.3Confident73.4Confident86 Ų8682.4 Ų82.445%0.4539%0.392SS..Hα-helixtrans-71.1-38.1174.9-174.967.9000112.4E386 K387 E388 R394E386-L390 VanDerWaalsContact O-CB 3.25Å; E386-L390 WeakPolarHBondContact O-CB 3.35Å; E386-L390 PolarHBondContact O-N 3.42Å; K387-L390 PolarHBondContact O-N 3.5Å; E388-L390 VanDerWaalsContact C-N 3.29Å; E388-L390 PolarHBondContact O-N 2.97Å; L390-R394 WeakPolarHBondContact O-CB 3.37Å; L390-R394 WeakPolarHBondContact O-CG 3.43Å; L390-R394 PolarHBondContact O-N 3.07Å
391Q74.1Confident72.5Confident139 Ų13984.3 Ų84.365%0.6540%0.399SS*.Hα-helixtrans-64.7-47.5173.3-76.7-174.8-4.700111.2K387 E388 R394 Q395K387-Q391 WeakPolarHBondContact O-CG 3.33Å; K387-Q391 PolarHBondContact O-N 3.34Å; E388-Q391 PolarHBondContact O-N 2.94Å; E388-Q391 VanDerWaalsContact O-N 3.16Å; Q391-R394 PolarHBondContact O-N 2.78Å; Q391-Q395 WeakPolarHBondContact O-CB 3.38Å; Q391-Q395 PolarHBondContact O-N 3.19Å
392D74.8Confident72.1Confident78 Ų7886.3 Ų86.342%0.41742%0.417SS..Hα-helixtrans-63.3-41.9180-175.960.6000111.9E388 Q395 K396E388-D392 VanDerWaalsContact O-CB 3.31Å; E388-D392 WeakPolarHBondContact O-CB 3.41Å; E388-D392 PolarHBondContact O-N 3.43Å; D392-Q395 PolarHBondContact O-N 2.9Å; D392-K396 WeakPolarHBondContact O-CG 3.26Å; D392-K396 PolarHBondContact O-N 3.45Å; D392-K396 WeakPolarHBondContact OD1-CE 3.28Å; D392-K396 IonicContact OD1-NZ 2.67Å; D392-K396 PolarHBondContact OD1-NZ 3.43Å; D392-K396 IonicContact OD2-NZ 2.7Å; D392-K396 PolarHBondContact OD2-NZ 3.02Å
393Y70.7Confident71.2Confident67 Ų6785.8 Ų85.826%0.26343%0.434SS..Hα-helixtrans-62.2-47.8170.7-179.1-96.6000112.3A389 Q395 K396 F397 P408A389-Y393 VanDerWaalsContact O-CB 3.27Å; A389-Y393 WeakPolarHBondContact O-CB 3.38Å; A389-Y393 PolarHBondContact O-N 3.44Å; Y393-Q395 PolarHBondContact O-N 3.1Å; Y393-K396 PolarHBondContact O-N 3.1Å; Y393-F397 HydrophobicContact CE1-CD2 4.13Å; Y393-F397 AromaticContact CZ-CD2 3.97Å; Y393-F397 WeakPolarHBondContact O-CB 3.42Å; Y393-F397 PolarHBondContact O-N 2.89Å; Y393-P408 HydrophobicContact CD2-CB 4.46Å; Y393-P408 HydrophobicContact CD2-CG 4.26Å; Y393-P408 HydrophobicContact CE2-CB 4.15Å; Y393-P408 HydrophobicContact CE2-CG 3.83Å
394R73.8Confident70.3Confident149 Ų14989.5 Ų89.556%0.56245%0.451SS*.Hα-helixtrans-60.9-34.5177.8-77.8172.4176.5-165.5-0112.2L390 Q391 R398L390-R394 WeakPolarHBondContact O-CB 3.37Å; L390-R394 WeakPolarHBondContact O-CG 3.43Å; L390-R394 PolarHBondContact O-N 3.07Å; Q391-R394 PolarHBondContact O-N 2.78Å; R394-R398 WeakPolarHBondContact O-CG 3.45Å; R394-R398 PolarHBondContact O-N 2.86Å
395Q74.2Confident69.7Low94 Ų9489.6 Ų89.644%0.43945%0.454SS..Hα-helixtrans-67.3-53.7175176.2147.6-2000111.4Q391 D392 Y393 F397 R398 E399Q391-Q395 WeakPolarHBondContact O-CB 3.38Å; Q391-Q395 PolarHBondContact O-N 3.19Å; D392-Q395 PolarHBondContact O-N 2.9Å; Y393-Q395 PolarHBondContact O-N 3.1Å; Q395-F397 PolarHBondContact O-N 3.47Å; Q395-R398 WeakPolarHBondContact O-CB 3.43Å; Q395-R398 PolarHBondContact O-N 3.39Å; Q395-E399 HydrophobicContact CG-CG 4.41Å; Q395-E399 WeakPolarHBondContact CG-OE1 3.46Å; Q395-E399 PolarHBondContact NE2-OE1 3.22Å; Q395-E399 WeakPolarHBondContact O-CG 3.38Å; Q395-E399 PolarHBondContact O-N 3.22Å
396K72.5Confident69.3Low86 Ų8696 Ų9637%0.37448%0.479SS..Hα-helixtrans-60.8-29.9179.2-70.7163.4-174.4168.80112.6D392 Y393 A400 P408D392-K396 WeakPolarHBondContact O-CG 3.26Å; D392-K396 PolarHBondContact O-N 3.45Å; D392-K396 WeakPolarHBondContact OD1-CE 3.28Å; D392-K396 IonicContact OD1-NZ 2.67Å; D392-K396 PolarHBondContact OD1-NZ 3.43Å; D392-K396 IonicContact OD2-NZ 2.7Å; D392-K396 PolarHBondContact OD2-NZ 3.02Å; Y393-K396 PolarHBondContact O-N 3.1Å; K396-A400 WeakPolarHBondContact O-CB 3.15Å; K396-A400 PolarHBondContact O-N 2.99Å; K396-P408 HydrophobicContact CB-CB 4.43Å; K396-P408 HydrophobicContact CB-CG 4.13Å
397F69.5Low68.6Low90 Ų9097.6 Ų97.640%0.39548%0.484SS..Hα-helixtrans-68.8-40.9172.6-161.9-80.7000113Y393 Q395 T401 F407Y393-F397 HydrophobicContact CE1-CD2 4.13Å; Y393-F397 AromaticContact CZ-CD2 3.97Å; Y393-F397 WeakPolarHBondContact O-CB 3.42Å; Y393-F397 PolarHBondContact O-N 2.89Å; Q395-F397 PolarHBondContact O-N 3.47Å; F397-T401 WeakPolarHBondContact O-CB 3.46Å; F397-T401 PolarHBondContact O-N 3.48Å; F397-T401 PolarHBondContact O-OG1 3.49Å; F397-F407 HydrophobicContact CD1-CE1 4.25Å; F397-F407 HydrophobicContact CD2-CD1 4.08Å; F397-F407 HydrophobicContact CD2-CE1 4.41Å; F397-F407 HydrophobicContact CE1-CD1 4.45Å; F397-F407 AromaticContact CE1-CE1 3.87Å; F397-F407 HydrophobicContact CE1-CE1 3.87Å; F397-F407 AromaticContact CE2-CD1 3.83Å; F397-F407 HydrophobicContact CE2-CD1 3.83Å; F397-F407 HydrophobicContact CE2-CE1 4.05Å; F397-F407 HydrophobicContact CZ-CD1 4.02Å; F397-F407 AromaticContact CZ-CE1 3.76Å; F397-F407 HydrophobicContact CZ-CE1 3.76Å
398R68.6Low68Low154 Ų15493.9 Ų93.958%0.58147%0.471SS*.Hα-helixtrans-64.1-45.4173.5-71.8-178.6-60.4-127.32.5111.3R394 Q395 A400 T401 A402R394-R398 WeakPolarHBondContact O-CG 3.45Å; R394-R398 PolarHBondContact O-N 2.86Å; Q395-R398 WeakPolarHBondContact O-CB 3.43Å; Q395-R398 PolarHBondContact O-N 3.39Å; R398-A400 VanDerWaalsContact C-N 3.34Å; R398-A400 PolarHBondContact O-N 3.43Å; R398-T401 WeakPolarHBondContact O-CB 3.08Å; R398-T401 PolarHBondContact O-N 3.34Å; R398-T401 VanDerWaalsContact O-N 3.14Å; R398-A402 PolarHBondContact O-N 3.36Å
399E70.4Confident67.4Low66 Ų6694 Ų9431%0.30848%0.48SS..Hα-helixtrans-63-39.4-179.9-66.7163175.400111.8Q395 A402 M404 I405Q395-E399 HydrophobicContact CG-CG 4.41Å; Q395-E399 WeakPolarHBondContact CG-OE1 3.46Å; Q395-E399 PolarHBondContact NE2-OE1 3.22Å; Q395-E399 WeakPolarHBondContact O-CG 3.38Å; Q395-E399 PolarHBondContact O-N 3.22Å; E399-A402 PolarHBondContact O-N 2.97Å; E399-M404 PolarHBondContact O-N 2.82Å; E399-I405 HydrophobicContact CB-CD1 3.63Å; E399-I405 HydrophobicContact CB-CG1 4.06Å
400A61.1Low67.2Low5 Ų598.4 Ų98.44%0.04150%0.497CS..Hα-helixtrans-67-37.717200000113.3K396 R398 A402 G403 I405 F407K396-A400 WeakPolarHBondContact O-CB 3.15Å; K396-A400 PolarHBondContact O-N 2.99Å; R398-A400 VanDerWaalsContact C-N 3.34Å; R398-A400 PolarHBondContact O-N 3.43Å; A400-A402 PolarHBondContact O-N 3.1Å; A400-G403 PolarHBondContact O-N 3.08Å; A400-I405 VanDerWaalsContact CA-O 3.29Å; A400-I405 WeakPolarHBondContact CA-O 3.21Å; A400-I405 WeakPolarHBondContact CB-O 3.28Å; A400-F407 HydrophobicContact CB-CB 4.48Å; A400-F407 HydrophobicContact CB-CD1 3.87Å; A400-F407 HydrophobicContact CB-CE1 4.17Å; A400-F407 HydrophobicContact CB-CG 4.05Å
401T61.3Low66.8Low89 Ų89101 Ų10155%0.54650%0.501SS..Hα-helixtrans-65.2-28.9176.7-52.50000112.1F397 R398 G403 F407F397-T401 WeakPolarHBondContact O-CB 3.46Å; F397-T401 PolarHBondContact O-N 3.48Å; F397-T401 PolarHBondContact O-OG1 3.49Å; R398-T401 WeakPolarHBondContact O-CB 3.08Å; R398-T401 PolarHBondContact O-N 3.34Å; R398-T401 VanDerWaalsContact O-N 3.14Å; T401-G403 PolarHBondContact O-N 2.88Å; T401-F407 WeakPolarHBondContact OG1-CE1 3.46Å
402A70.8Confident66Low73 Ų7396.5 Ų96.560%0.60348%0.483SS*.THydrogen-bonded Turntrans-77.24.7172.100000114.1R398 E399 A400 M404R398-A402 PolarHBondContact O-N 3.36Å; E399-A402 PolarHBondContact O-N 2.97Å; A400-A402 PolarHBondContact O-N 3.1Å; A402-M404 VanDerWaalsContact C-N 3.27Å; A402-M404 PolarHBondContact O-N 3.19Å
403G58Low65.3Low67 Ų6796.7 Ų96.769%0.69149%0.487SS*.THydrogen-bonded Turntrans78.6-0.3178.400000115.4A400 T401A400-G403 PolarHBondContact O-N 3.08Å; T401-G403 PolarHBondContact O-N 2.88Å
404M62.5Low64.8Low165 Ų16599.8 Ų99.881%0.81351%0.508SS*.SBendtrans-74.6-24-177.4-65.9-70.6-17800113.3E399 A402E399-M404 PolarHBondContact O-N 2.82Å; A402-M404 VanDerWaalsContact C-N 3.27Å; A402-M404 PolarHBondContact O-N 3.19Å
405I63.8Low64.2Low90 Ų90101.9 Ų101.946%0.46252%0.516SS..SBendtrans-144.9160-177-13.2175.8000110.8E399 A400E399-I405 HydrophobicContact CB-CD1 3.63Å; E399-I405 HydrophobicContact CB-CG1 4.06Å; A400-I405 VanDerWaalsContact CA-O 3.29Å; A400-I405 WeakPolarHBondContact CA-O 3.21Å; A400-I405 WeakPolarHBondContact CB-O 3.28Å
406K62.7Low63.1Low197 Ų19799.9 Ų99.986%0.85751%0.513SS*.PPolyproline II helixtrans-71.6144.9167.3-66.2-178.3179.5178.90109.8
407F59.6Low62.2Low116 Ų116102.3 Ų102.351%0.50954%0.537SS..PPolyproline II helixtrans-55.2131.7-178.4-81.9-81.9000112.6F397 A400 T401F397-F407 HydrophobicContact CD1-CE1 4.25Å; F397-F407 HydrophobicContact CD2-CD1 4.08Å; F397-F407 HydrophobicContact CD2-CE1 4.41Å; F397-F407 HydrophobicContact CE1-CD1 4.45Å; F397-F407 AromaticContact CE1-CE1 3.87Å; F397-F407 HydrophobicContact CE1-CE1 3.87Å; F397-F407 AromaticContact CE2-CD1 3.83Å; F397-F407 HydrophobicContact CE2-CD1 3.83Å; F397-F407 HydrophobicContact CE2-CE1 4.05Å; F397-F407 HydrophobicContact CZ-CD1 4.02Å; F397-F407 AromaticContact CZ-CE1 3.76Å; F397-F407 HydrophobicContact CZ-CE1 3.76Å; A400-F407 HydrophobicContact CB-CB 4.48Å; A400-F407 HydrophobicContact CB-CD1 3.87Å; A400-F407 HydrophobicContact CB-CE1 4.17Å; A400-F407 HydrophobicContact CB-CG 4.05Å; T401-F407 WeakPolarHBondContact OG1-CE1 3.46Å
408P62.7Low61.6Low28 Ų28102.5 Ų102.518%0.18254%0.542CS..PPolyproline II helixtrans-70.9138.2-17727.7-34.6000111.8Y393 K396Y393-P408 HydrophobicContact CD2-CB 4.46Å; Y393-P408 HydrophobicContact CD2-CG 4.26Å; Y393-P408 HydrophobicContact CE2-CB 4.15Å; Y393-P408 HydrophobicContact CE2-CG 3.83Å; K396-P408 HydrophobicContact CB-CB 4.43Å; K396-P408 HydrophobicContact CB-CG 4.13Å
409P64.4Low61.6Low100 Ų10097.3 Ų97.365%0.64952%0.523SS*.PPolyproline II helixtrans-56.9140.3173.8-24.834.2000112.5R411P409-R411 PolarHBondContact O-N 2.76Å
410I63.8Low61.1Low127 Ų12796 Ų9665%0.65152%0.518SS*.  trans-72.3113.1175.9-55.6174.2000108.7
411R63.6Low61.1Low141 Ų14197.7 Ų97.753%0.53252%0.523SS..  trans-76.4142.1166.6-71.5-173.3172.6-154.3-4.2109.6P409 N418 L420P409-R411 PolarHBondContact O-N 2.76Å; R411-N418 WeakPolarHBondContact CA-O 3.43Å; R411-L420 HydrophobicContact CB-CD1 4.32Å; R411-L420 HydrophobicContact CB-CG 4.19Å
412T57.6Low61.1Low45 Ų4595.6 Ų95.628%0.27652%0.515SS..BIsolated β-bridgetrans-111.5143.8-177.660.70000112.7N414 S416 N418 L420T412-N414 VanDerWaalsContact C-N 3.31Å; T412-N414 PolarHBondContact OG1-O 3.26Å; T412-S416 VanDerWaalsContact OG1-CB 3.24Å; T412-S416 WeakPolarHBondContact OG1-CB 3.46Å; T412-S416 PolarHBondContact OG1-OG 2.92Å; T412-N418 PolarHBondContact N-O 3.21Å; T412-L420 PolarHBondContact O-N 2.9Å; T412-L420 VanDerWaalsContact O-N 3.13Å
413V60.3Low60.7Low82 Ų8297.5 Ų97.550%0.49752%0.515SS..SBendtrans-74.5-21.8172.1-1750000111.8Y419 L420V413-Y419 VanDerWaalsContact O-CE2 3.26Å; V413-Y419 WeakPolarHBondContact O-CE2 3.38Å; V413-L420 HydrophobicContact CG2-CD1 4.12Å
414N60.6Low60.8Low131 Ų13196.4 Ų96.470%0.70149%0.493SS*.SBendtrans-81.5154.4167.4-74.3-16000111.4T412 S416T412-N414 VanDerWaalsContact C-N 3.31Å; T412-N414 PolarHBondContact OG1-O 3.26Å; N414-S416 VanDerWaalsContact C-N 3.3Å; N414-S416 PolarHBondContact O-N 2.67Å
415R60.3Low60.9Low194 Ų19491.8 Ų91.873%0.73247%0.469SS*.SBendtrans-67.881.2178-84.5-173.9170.6179.8-4.9112.4Y419 E425R415-Y419 HydrophobicContact CG-CD2 4.36Å; R415-Y419 HydrophobicContact CG-CE2 4.42Å; R415-Y419 HydrophobicContact CG-CG 4.42Å; R415-E425 IonicContact CZ-OE2 2.82Å; R415-E425 IonicContact NE-OE2 2.69Å; R415-E425 IonicContact NH2-OE1 3.68Å; R415-E425 IonicContact NH2-OE2 3.71Å; R415-E425 PolarHBondContact NH2-OE2 2.6Å
416S50.1Low60.7Low52 Ų5290.3 Ų90.336%0.36447%0.471SS..SBendtrans-105.3168.3164.3-38.60000108.6T412 N414 N418 Y419T412-S416 VanDerWaalsContact OG1-CB 3.24Å; T412-S416 WeakPolarHBondContact OG1-CB 3.46Å; T412-S416 PolarHBondContact OG1-OG 2.92Å; N414-S416 VanDerWaalsContact C-N 3.3Å; N414-S416 PolarHBondContact O-N 2.67Å; S416-N418 PolarHBondContact O-N 2.92Å; S416-Y419 WeakPolarHBondContact O-CB 3.29Å; S416-Y419 PolarHBondContact O-N 2.88Å
417P54.4Low60.6Low137 Ų13783.2 Ų83.289%0.8945%0.449SS*.THydrogen-bonded Turntrans-59.9-13.417821-33.1000115.6
418N56.6Low60.5Low93 Ų9378.6 Ų78.650%0.49743%0.432SS..THydrogen-bonded Turntrans-113.460.5169.8-72.5-36.6000111.1R411 T412 S416R411-N418 WeakPolarHBondContact CA-O 3.43Å; T412-N418 PolarHBondContact N-O 3.21Å; S416-N418 PolarHBondContact O-N 2.92Å
419Y68.3Low60.3Low45 Ų4584 Ų8418%0.17646%0.455CS..BIsolated β-bridgetrans-77.5140.1-179.5173.6-124.3000112.6V413 R415 S416 Y421 A422 E425V413-Y419 VanDerWaalsContact O-CE2 3.26Å; V413-Y419 WeakPolarHBondContact O-CE2 3.38Å; R415-Y419 HydrophobicContact CG-CD2 4.36Å; R415-Y419 HydrophobicContact CG-CE2 4.42Å; R415-Y419 HydrophobicContact CG-CG 4.42Å; S416-Y419 WeakPolarHBondContact O-CB 3.29Å; S416-Y419 PolarHBondContact O-N 2.88Å; Y419-Y421 HydrophobicContact CE2-CD2 4.34Å; Y419-A422 HydrophobicContact CD1-CB 4.11Å; Y419-E425 WeakPolarHBondContact CE1-OE1 3.42Å; Y419-E425 PolarHBondContact OH-OE1 3.34Å; Y419-E425 VanDerWaalsContact OH-OE1 3.11Å
420L60Low60Low40 Ų4086.1 Ų86.121%0.20945%0.45CS..THydrogen-bonded Turntrans-73-33.4-168.8-136.5154.8000114.4A389 R411 T412 V413A389-L420 HydrophobicContact CB-CD2 3.81Å; R411-L420 HydrophobicContact CB-CD1 4.32Å; R411-L420 HydrophobicContact CB-CG 4.19Å; T412-L420 PolarHBondContact O-N 2.9Å; T412-L420 VanDerWaalsContact O-N 3.13Å; V413-L420 HydrophobicContact CG2-CD1 4.12Å
421Y62.2Low59.3Low39 Ų3984.5 Ų84.515%0.15345%0.45CS..THydrogen-bonded Turntrans-101.415.7-179.4-63.5-80.4000114.1K382 Y419 D423 M424 E425K382-Y421 HydrophobicContact CB-CE1 4.28Å; K382-Y421 HydrophobicContact CG-CE1 4.4Å; K382-Y421 PolarHBondContact O-OH 3.37Å; Y419-Y421 HydrophobicContact CE2-CD2 4.34Å; Y421-D423 VanDerWaalsContact C-N 3.28Å; Y421-D423 PolarHBondContact O-N 3.42Å; Y421-M424 HydrophobicContact CD1-SD 3.85Å; Y421-M424 HydrophobicContact CE1-SD 4.33Å; Y421-M424 PolarHBondContact O-N 2.85Å; Y421-M424 VanDerWaalsContact O-N 3.1Å; Y421-E425 PolarHBondContact O-N 3.32Å
422A61.6Low58.4Low45 Ų4585.6 Ų85.637%0.37246%0.46SS..Hα-helixtrans-55-42.7-176.900000112.7Y419 M424 E425 A426Y419-A422 HydrophobicContact CD1-CB 4.11Å; A422-M424 VanDerWaalsContact C-N 3.34Å; A422-M424 PolarHBondContact O-N 3.41Å; A422-E425 PolarHBondContact O-N 3Å; A422-A426 WeakPolarHBondContact O-CB 3.48Å; A422-A426 PolarHBondContact O-N 2.9Å
423D60.6Low58.2Low114 Ų11488.9 Ų88.961%0.6148%0.483SS*.Hα-helixtrans-68.1-32.2-179.3-54.6-48.7000112.3Y421 A427Y421-D423 VanDerWaalsContact C-N 3.28Å; Y421-D423 PolarHBondContact O-N 3.42Å; D423-A427 PolarHBondContact O-N 2.91Å; D423-A427 VanDerWaalsContact O-N 3.14Å
424M62.1Low57.4Low44 Ų4489.9 Ų89.922%0.21749%0.491CS..Hα-helixtrans-78.7-38.8175.9-62.3-171.798.700112.4N385 Y421 A422 A426 A427 A428N385-M424 HydrophobicContact CB-SD 4.18Å; Y421-M424 HydrophobicContact CD1-SD 3.85Å; Y421-M424 HydrophobicContact CE1-SD 4.33Å; Y421-M424 PolarHBondContact O-N 2.85Å; Y421-M424 VanDerWaalsContact O-N 3.1Å; A422-M424 VanDerWaalsContact C-N 3.34Å; A422-M424 PolarHBondContact O-N 3.41Å; M424-A426 VanDerWaalsContact C-N 3.31Å; M424-A427 PolarHBondContact O-N 2.96Å; M424-A428 WeakPolarHBondContact O-CB 3.38Å; M424-A428 PolarHBondContact O-N 3.04Å
425E64Low56.7Low67 Ų6790.4 Ų90.431%0.31351%0.505SS..Hα-helixtrans-65-36.4172.8-78.9-172.5-160.800111.5R415 Y419 Y421 A422 A428 Q429R415-E425 IonicContact CZ-OE2 2.82Å; R415-E425 IonicContact NE-OE2 2.69Å; R415-E425 IonicContact NH2-OE1 3.68Å; R415-E425 IonicContact NH2-OE2 3.71Å; R415-E425 PolarHBondContact NH2-OE2 2.6Å; Y419-E425 WeakPolarHBondContact CE1-OE1 3.42Å; Y419-E425 PolarHBondContact OH-OE1 3.34Å; Y419-E425 VanDerWaalsContact OH-OE1 3.11Å; Y421-E425 PolarHBondContact O-N 3.32Å; A422-E425 PolarHBondContact O-N 3Å; E425-A428 PolarHBondContact O-N 3.42Å; E425-Q429 PolarHBondContact O-N 2.83Å; E425-Q429 VanDerWaalsContact O-N 3.14Å
426A60Low56.4Low60 Ų6083.7 Ų83.750%0.49650%0.496SS..Hα-helixtrans-62.5-4517200000112A422 M424 A428 Q429A422-A426 WeakPolarHBondContact O-CB 3.48Å; A422-A426 PolarHBondContact O-N 2.9Å; M424-A426 VanDerWaalsContact C-N 3.31Å; A426-A428 PolarHBondContact O-N 2.78Å; A426-Q429 PolarHBondContact O-N 2.77Å; A426-Q429 VanDerWaalsContact O-N 3.15Å
427A59.6Low56.7Low48 Ų4890.4 Ų90.440%0.39752%0.522SS..Hα-helixtrans-65.2-24.4174.700000113.8D423 M424 Q447D423-A427 PolarHBondContact O-N 2.91Å; D423-A427 VanDerWaalsContact O-N 3.14Å; M424-A427 PolarHBondContact O-N 2.96Å; A427-Q447 PolarHBondContact O-NE2 2.78Å
428A56.7Low57Low19 Ų1987.6 Ų87.616%0.15750%0.502CS..Hα-helixtrans-83.4-13.617500000113.9M424 E425 A426 E446 K450M424-A428 WeakPolarHBondContact O-CB 3.38Å; M424-A428 PolarHBondContact O-N 3.04Å; E425-A428 PolarHBondContact O-N 3.42Å; A426-A428 PolarHBondContact O-N 2.78Å; A428-E446 HydrophobicContact CB-CB 4.26Å; A428-E446 HydrophobicContact CB-CG 4.42Å; A428-K450 PolarHBondContact O-NZ 2.81Å
429Q59.3Low57.5Low141 Ų14188.3 Ų88.366%0.65951%0.506SS*.SBendtrans-91.696.7170.4-71.5-172.54.500110.4E425 A426 S431E425-Q429 PolarHBondContact O-N 2.83Å; E425-Q429 VanDerWaalsContact O-N 3.14Å; A426-Q429 PolarHBondContact O-N 2.77Å; A426-Q429 VanDerWaalsContact O-N 3.15Å; Q429-S431 PolarHBondContact O-N 3.35Å
430W57.4Low57.3Low144 Ų14490.4 Ų90.455%0.54552%0.518SS..  trans-69.295.2169-93.9-6.1000110.6L443 Q447W430-L443 HydrophobicContact CH2-CD2 4.1Å; W430-L443 HydrophobicContact CZ2-CD2 3.55Å; W430-Q447 HydrophobicContact CZ2-CB 4.46Å; W430-Q447 HydrophobicContact CZ2-CG 4.41Å; W430-Q447 VanDerWaalsContact NE1-CD 3.31Å
431S49Very low57.7Low93 Ų9392.8 Ų92.865%0.6554%0.538SS*.  trans-72.6-38.2178.4-55.40000113.3Q429Q429-S431 PolarHBondContact O-N 3.35Å
432H46.6Very low57.9Low164 Ų16498.1 Ų98.176%0.75956%0.564SS**SBendtrans-146.6133.7178.9-53.8-61000111.9
433P52.3Low58.3Low114 Ų11496.6 Ų96.674%0.7455%0.55SS*.  trans-84.5134.5175.332.3-32.7000112.3
434P44.2Very low58.8Low103 Ų10393.4 Ų93.467%0.66953%0.534SS*.  trans-70.6146.1169.7-17.832.2000112.5G436P434-G436 PolarHBondContact O-N 3.09Å
435S44.9Very low59.5Low143 Ų14395.4 Ų95.4100%154%0.539SS*.SBendtrans-81.650.5-178.6-175.20000113.7
436G54.8Low60.1Low52 Ų5293.5 Ų93.554%0.53653%0.53SS..SBendtrans-155.7167.6-179.800000113.3P434 V438P434-G436 PolarHBondContact O-N 3.09Å; G436-V438 PolarHBondContact O-N 2.67Å; G436-V438 VanDerWaalsContact O-N 3.15Å
437E56Low60.7Low194 Ų19491.6 Ų91.691%0.90751%0.511SS*.  trans-66110.5-177.6-66.1-172.8133.600112N439E437-N439 PolarHBondContact O-N 3.3Å
438V61Low61.6Low78 Ų7890.4 Ų90.447%0.47350%0.497SS..  trans-86.398.4178.5-173.70000109.9G436 L443G436-V438 PolarHBondContact O-N 2.67Å; G436-V438 VanDerWaalsContact O-N 3.15Å; V438-L443 HydrophobicContact CG1-CD2 3.57Å; V438-L443 HydrophobicContact CG1-CG 4.26Å
439N66.6Low62.7Low108 Ų10891.8 Ų91.858%0.57850%0.5SS*.  trans-63137.6175.6-101.9-56.2000111.8E437 S441 H442E437-N439 PolarHBondContact O-N 3.3Å; N439-S441 PolarHBondContact O-N 3.08Å; N439-H442 PolarHBondContact O-N 3.45Å
440M63.7Low63.5Low88 Ų8890.8 Ų90.843%0.43349%0.494SS..G310 helixtrans-62.2-21.2-170.6-163.7174.4-171.800113.8H442 L443 K448 L452M440-H442 VanDerWaalsContact C-N 3.27Å; M440-H442 PolarHBondContact O-N 2.81Å; M440-L443 HydrophobicContact CG-CD1 4.26Å; M440-L443 PolarHBondContact O-N 3.21Å; M440-K448 HydrophobicContact CE-CB 4.23Å; M440-K448 HydrophobicContact CE-CG 4.11Å; M440-K448 HydrophobicContact CG-CG 4.31Å; M440-K448 WeakPolarHBondContact O-CE 3.18Å; M440-L452 HydrophobicContact CE-CD1 4.26Å; M440-L452 HydrophobicContact CE-CD2 4.26Å; M440-L452 HydrophobicContact CE-CG 4.1Å
441S69.2Low64.5Low90 Ų9086.2 Ų86.263%0.62948%0.481SS*.G310 helixtrans-59.3-31.7170.944.50000113.9N439N439-S441 PolarHBondContact O-N 3.08Å
442H65.6Low65.9Low151 Ų15182.8 Ų82.870%0.69946%0.456SS*.G310 helixtrans-89-4.5-174.9-58.8-87.5000113.8N439 M440N439-H442 PolarHBondContact O-N 3.45Å; M440-H442 VanDerWaalsContact C-N 3.27Å; M440-H442 PolarHBondContact O-N 2.81Å
443L70.8Confident67.3Low14 Ų1477 Ų777%0.07343%0.433CS..SBendtrans-83.5138.8179.2-62.3-178.9000111.6W430 V438 M440 Q447 K448 V451W430-L443 HydrophobicContact CH2-CD2 4.1Å; W430-L443 HydrophobicContact CZ2-CD2 3.55Å; V438-L443 HydrophobicContact CG1-CD2 3.57Å; V438-L443 HydrophobicContact CG1-CG 4.26Å; M440-L443 HydrophobicContact CG-CD1 4.26Å; M440-L443 PolarHBondContact O-N 3.21Å; L443-Q447 HydrophobicContact CB-CB 4.09Å; L443-Q447 HydrophobicContact CD2-CB 4.21Å; L443-K448 HydrophobicContact CB-CD 4.43Å; L443-K448 HydrophobicContact CB-CG 3.7Å; L443-K448 HydrophobicContact CD1-CG 4.26Å; L443-K448 WeakPolarHBondContact O-CE 3.39Å; L443-K448 PolarHBondContact O-NZ 3.48Å; L443-V451 HydrophobicContact CD1-CG2 4.23Å
444T71Confident68.5Low46 Ų4675.1 Ų75.128%0.28242%0.417SS..  trans-64.3161.7165.679.10000110.2E446 Q447 K448T444-E446 VanDerWaalsContact C-N 3.29Å; T444-E446 PolarHBondContact O-N 3.41Å; T444-E446 PolarHBondContact OG1-OE2 3.2Å; T444-Q447 VanDerWaalsContact N-OE1 3.09Å; T444-Q447 WeakPolarHBondContact O-CB 3.28Å; T444-Q447 PolarHBondContact O-N 3.37Å; T444-Q447 VanDerWaalsContact O-N 3.07Å; T444-Q447 WeakPolarHBondContact OG1-CG 3.24Å; T444-Q447 PolarHBondContact OG1-N 2.86Å; T444-K448 WeakPolarHBondContact O-CG 3.41Å; T444-K448 PolarHBondContact O-N 3.19Å
445W77.3Confident70.2Confident87 Ų8774.4 Ų74.433%0.3341%0.407SS..Hα-helixtrans-63.9-35.4-178.7-65.2114.6000112.3V374 E377 I378 Q447 K448 E449V374-W445 HydrophobicContact CG1-CE3 4.27Å; V374-W445 VanDerWaalsContact CG1-O 3.28Å; V374-W445 WeakPolarHBondContact CG1-O 3.4Å; V374-W445 HydrophobicContact CG2-CE3 4.23Å; V374-W445 HydrophobicContact CG2-CZ3 4.29Å; E377-W445 HydrophobicContact CB-CD2 4.09Å; E377-W445 HydrophobicContact CB-CE3 4.29Å; E377-W445 HydrophobicContact CB-CG 4.34Å; E377-W445 HydrophobicContact CG-CD2 3.62Å; E377-W445 HydrophobicContact CG-CE3 4.15Å; E377-W445 HydrophobicContact CG-CG 3.97Å; E377-W445 HydrophobicContact CG-CH2 4.25Å; E377-W445 HydrophobicContact CG-CZ2 3.72Å; E377-W445 HydrophobicContact CG-CZ3 4.44Å; I378-W445 HydrophobicContact CD1-CB 4.45Å; I378-W445 HydrophobicContact CG1-CB 3.53Å; W445-Q447 VanDerWaalsContact C-N 3.32Å; W445-Q447 PolarHBondContact O-N 3.34Å; W445-K448 HydrophobicContact CD2-CD 4.02Å; W445-K448 HydrophobicContact CE3-CD 3.32Å; W445-K448 HydrophobicContact CH2-CD 4.39Å; W445-K448 HydrophobicContact CZ3-CD 3.55Å; W445-K448 PolarHBondContact O-N 2.68Å; W445-E449 PolarHBondContact O-N 2.89Å
446E75.1Confident71.9Confident27 Ų2769.8 Ų69.813%0.12637%0.369CS..Hα-helixtrans-62.6-34.5171.6-63.277.8-173.100113.1I378 K382 A428 T444 K450I378-E446 HydrophobicContact CD1-CG 4.39Å; I378-E446 HydrophobicContact CG1-CG 4.5Å; I378-E446 HydrophobicContact CG2-CG 4.45Å; K382-E446 VanDerWaalsContact CE-OE1 3.24Å; K382-E446 WeakPolarHBondContact CE-OE1 3.36Å; K382-E446 IonicContact NZ-OE1 3.87Å; A428-E446 HydrophobicContact CB-CB 4.26Å; A428-E446 HydrophobicContact CB-CG 4.42Å; T444-E446 VanDerWaalsContact C-N 3.29Å; T444-E446 PolarHBondContact O-N 3.41Å; T444-E446 PolarHBondContact OG1-OE2 3.2Å; E446-K450 WeakPolarHBondContact O-CG 3.12Å; E446-K450 PolarHBondContact O-N 2.74Å
447Q73.3Confident72.9Confident20 Ų2068.5 Ų68.59%0.09335%0.353CS..Hα-helixtrans-74.5-38.7175.9-65.9163.57.300110.8A427 W430 L443 T444 W445 E449 K450 V451A427-Q447 PolarHBondContact O-NE2 2.78Å; W430-Q447 HydrophobicContact CZ2-CB 4.46Å; W430-Q447 HydrophobicContact CZ2-CG 4.41Å; W430-Q447 VanDerWaalsContact NE1-CD 3.31Å; L443-Q447 HydrophobicContact CB-CB 4.09Å; L443-Q447 HydrophobicContact CD2-CB 4.21Å; T444-Q447 VanDerWaalsContact N-OE1 3.09Å; T444-Q447 WeakPolarHBondContact O-CB 3.28Å; T444-Q447 PolarHBondContact O-N 3.37Å; T444-Q447 VanDerWaalsContact O-N 3.07Å; T444-Q447 WeakPolarHBondContact OG1-CG 3.24Å; T444-Q447 PolarHBondContact OG1-N 2.86Å; W445-Q447 VanDerWaalsContact C-N 3.32Å; W445-Q447 PolarHBondContact O-N 3.34Å; Q447-E449 VanDerWaalsContact C-N 3.35Å; Q447-E449 PolarHBondContact O-N 2.84Å; Q447-K450 PolarHBondContact O-N 3.38Å; Q447-V451 WeakPolarHBondContact O-CG2 3.06Å; Q447-V451 PolarHBondContact O-N 3.04Å; Q447-V451 VanDerWaalsContact O-N 3.09Å
448K78.1Confident74Confident22 Ų2267 Ų6710%0.09634%0.344CS..Hα-helixtrans-61.1-40173.2-70164.6175.7143.90112.1V374 M440 L443 T444 W445 V451 L452V374-K448 HydrophobicContact CG1-CB 4.05Å; V374-K448 HydrophobicContact CG2-CB 4.37Å; M440-K448 HydrophobicContact CE-CB 4.23Å; M440-K448 HydrophobicContact CE-CG 4.11Å; M440-K448 HydrophobicContact CG-CG 4.31Å; M440-K448 WeakPolarHBondContact O-CE 3.18Å; L443-K448 HydrophobicContact CB-CD 4.43Å; L443-K448 HydrophobicContact CB-CG 3.7Å; L443-K448 HydrophobicContact CD1-CG 4.26Å; L443-K448 WeakPolarHBondContact O-CE 3.39Å; L443-K448 PolarHBondContact O-NZ 3.48Å; T444-K448 WeakPolarHBondContact O-CG 3.41Å; T444-K448 PolarHBondContact O-N 3.19Å; W445-K448 HydrophobicContact CD2-CD 4.02Å; W445-K448 HydrophobicContact CE3-CD 3.32Å; W445-K448 HydrophobicContact CH2-CD 4.39Å; W445-K448 HydrophobicContact CZ3-CD 3.55Å; W445-K448 PolarHBondContact O-N 2.68Å; K448-V451 PolarHBondContact O-N 2.9Å; K448-L452 WeakPolarHBondContact O-CG 3.49Å; K448-L452 PolarHBondContact O-N 3.02Å
449E80.6Confident74.6Confident48 Ų4867.2 Ų67.222%0.22434%0.341CS..Hα-helixtrans-61.9-46.2176.9-168-170.6171.700111.4L371 V374 R375 I378 W445 Q447 V451 L452 S453L371-E449 HydrophobicContact CD2-CG 4.18Å; V374-E449 HydrophobicContact CG1-CB 3.89Å; R375-E449 HydrophobicContact CG-CG 4.39Å; R375-E449 IonicContact CZ-OE1 3.56Å; R375-E449 IonicContact NE-OE1 2.67Å; R375-E449 PolarHBondContact NE-OE1 3.04Å; R375-E449 IonicContact NH2-OE1 3.51Å; R375-E449 PolarHBondContact NH2-OE1 3.15Å; I378-E449 HydrophobicContact CD1-CB 4Å; I378-E449 VanDerWaalsContact CD1-OE2 3.29Å; I378-E449 WeakPolarHBondContact CD1-OE2 3.17Å; W445-E449 PolarHBondContact O-N 2.89Å; Q447-E449 VanDerWaalsContact C-N 3.35Å; Q447-E449 PolarHBondContact O-N 2.84Å; E449-V451 PolarHBondContact O-N 3.02Å; E449-L452 PolarHBondContact O-N 2.86Å; E449-S453 VanDerWaalsContact O-CB 3.29Å; E449-S453 WeakPolarHBondContact O-CB 3.37Å; E449-S453 PolarHBondContact O-N 3.14Å; E449-S453 PolarHBondContact O-OG 3.24Å
450K75.8Confident74.9Confident121 Ų12163.8 Ų63.853%0.52632%0.323SS..Hα-helixtrans-59.1-46.9177-70.6174.4-178.8179.30111.6A428 E446 Q447 S453 L454A428-K450 PolarHBondContact O-NZ 2.81Å; E446-K450 WeakPolarHBondContact O-CG 3.12Å; E446-K450 PolarHBondContact O-N 2.74Å; Q447-K450 PolarHBondContact O-N 3.38Å; K450-S453 PolarHBondContact O-N 2.72Å; K450-L454 WeakPolarHBondContact O-CB 3.22Å; K450-L454 PolarHBondContact O-N 3.27Å
451V77.9Confident75.3Confident47 Ų4762.5 Ų62.529%0.28533%0.332SS..Hα-helixtrans-64.3-44.6-179.7171.50000112.2L443 Q447 K448 E449 L454 L455L443-V451 HydrophobicContact CD1-CG2 4.23Å; Q447-V451 WeakPolarHBondContact O-CG2 3.06Å; Q447-V451 PolarHBondContact O-N 3.04Å; Q447-V451 VanDerWaalsContact O-N 3.09Å; K448-V451 PolarHBondContact O-N 2.9Å; E449-V451 PolarHBondContact O-N 3.02Å; V451-L454 PolarHBondContact O-N 2.7Å; V451-L455 HydrophobicContact CG1-CD1 4.25Å; V451-L455 PolarHBondContact O-N 3.11Å
452L79.3Confident75.1Confident21 Ų2164.7 Ų64.711%0.1133%0.332CS..Hα-helixtrans-66.7-38.5176.9-73.5173.3000112.3F367 A370 L371 V374 M440 K448 E449 L455 F456F367-L452 HydrophobicContact CD1-CD2 4.46Å; F367-L452 HydrophobicContact CE1-CD2 4.27Å; A370-L452 HydrophobicContact CB-CD1 4.22Å; L371-L452 HydrophobicContact CD2-CB 3.54Å; L371-L452 HydrophobicContact CG-CB 3.98Å; V374-L452 HydrophobicContact CG2-CD1 3.76Å; M440-L452 HydrophobicContact CE-CD1 4.26Å; M440-L452 HydrophobicContact CE-CD2 4.26Å; M440-L452 HydrophobicContact CE-CG 4.1Å; K448-L452 WeakPolarHBondContact O-CG 3.49Å; K448-L452 PolarHBondContact O-N 3.02Å; E449-L452 PolarHBondContact O-N 2.86Å; L452-L455 PolarHBondContact O-N 3.28Å; L452-F456 PolarHBondContact O-N 3.28Å
453S76.1Confident74.1Confident42 Ų4264 Ų6429%0.29434%0.339SS..Hα-helixtrans-63.8-42.3176.9-58.50000111.2L371 E449 K450 F456 A457L371-S453 WeakPolarHBondContact CD2-OG 3.41Å; E449-S453 VanDerWaalsContact O-CB 3.29Å; E449-S453 WeakPolarHBondContact O-CB 3.37Å; E449-S453 PolarHBondContact O-N 3.14Å; E449-S453 PolarHBondContact O-OG 3.24Å; K450-S453 PolarHBondContact O-N 2.72Å; S453-F456 PolarHBondContact O-N 3.17Å; S453-A457 WeakPolarHBondContact O-CB 3.41Å; S453-A457 PolarHBondContact O-N 3.11Å
454L78.2Confident73Confident75 Ų7570.4 Ų70.439%0.39337%0.368SS..Hα-helixtrans-64.6-43.8176.2-17865.3000112.1K450 V451 A457 K458 E464K450-L454 WeakPolarHBondContact O-CB 3.22Å; K450-L454 PolarHBondContact O-N 3.27Å; V451-L454 PolarHBondContact O-N 2.7Å; L454-A457 PolarHBondContact O-N 2.88Å; L454-K458 VanDerWaalsContact O-CB 3.27Å; L454-K458 WeakPolarHBondContact O-CB 3.46Å; L454-K458 PolarHBondContact O-N 2.94Å; L454-E464 VanDerWaalsContact CD1-CD 3.45Å; L454-E464 HydrophobicContact CD1-CG 3.53Å; L454-E464 WeakPolarHBondContact CD1-OE1 3.35Å
455L78.7Confident71.1Confident88 Ų8883.5 Ų83.546%0.46141%0.412SS..Hα-helixtrans-59.1-47175.1-96.1158000111.6F367 V451 L452 K458 M459F367-L455 HydrophobicContact CE1-CB 3.8Å; F367-L455 HydrophobicContact CZ-CB 4.22Å; V451-L455 HydrophobicContact CG1-CD1 4.25Å; V451-L455 PolarHBondContact O-N 3.11Å; L452-L455 PolarHBondContact O-N 3.28Å; L455-K458 PolarHBondContact O-N 2.91Å; L455-M459 WeakPolarHBondContact O-CB 3.42Å; L455-M459 PolarHBondContact O-N 3.49Å
456F80.3Confident70.8Confident46 Ų4683.4 Ų83.420%0.20242%0.417CS..Hα-helixtrans-63.1-43177.9-177.9-106.5000112.6E364 F367 H368 L452 S453 M459 N460E364-F456 HydrophobicContact CB-CE2 4.23Å; E364-F456 HydrophobicContact CG-CE2 4.11Å; F367-F456 HydrophobicContact CB-CB 4.29Å; F367-F456 HydrophobicContact CB-CD2 3.47Å; F367-F456 VanDerWaalsContact CB-CD2 3.47Å; F367-F456 HydrophobicContact CB-CE2 4.19Å; F367-F456 HydrophobicContact CB-CG 4.21Å; F367-F456 HydrophobicContact CD1-CB 4.27Å; F367-F456 HydrophobicContact CD2-CD2 4.42Å; F367-F456 HydrophobicContact CG-CB 4.32Å; F367-F456 HydrophobicContact CG-CD2 4.01Å; H368-F456 AromaticContact CE1-CE2 3.99Å; H368-F456 AromaticContact CE1-CZ 3.45Å; H368-F456 VanDerWaalsContact CE1-CZ 3.45Å; H368-F456 WeakPolarHBondContact CE1-CZ 3.34Å; H368-F456 AromaticContact ND1-CZ 3.97Å; L452-F456 PolarHBondContact O-N 3.28Å; S453-F456 PolarHBondContact O-N 3.17Å; F456-M459 PolarHBondContact O-N 2.73Å; F456-N460 WeakPolarHBondContact CE2-ND2 3.24Å; F456-N460 WeakPolarHBondContact CZ-ND2 3.4Å; F456-N460 PolarHBondContact O-N 3.02Å; F456-N460 VanDerWaalsContact O-N 3.15Å; F456-N460 PolarHBondContact O-ND2 2.79Å
457A77.2Confident70.6Confident25 Ų2586.3 Ų86.321%0.20743%0.432CS..Hα-helixtrans-60.8-49.4175.300000111.6S453 L454 M459 N460 G461 Q462S453-A457 WeakPolarHBondContact O-CB 3.41Å; S453-A457 PolarHBondContact O-N 3.11Å; L454-A457 PolarHBondContact O-N 2.88Å; A457-M459 VanDerWaalsContact C-N 3.34Å; A457-M459 PolarHBondContact O-N 2.78Å; A457-N460 CarbonylContact O-C 3.59Å; A457-N460 WeakPolarHBondContact O-CA 3.45Å; A457-N460 PolarHBondContact O-N 3.22Å; A457-G461 PolarHBondContact O-N 3.23Å; A457-Q462 CarbonylContact C-O 3.4Å; A457-Q462 HydrophobicContact CB-CB 4.2Å; A457-Q462 PolarHBondContact O-N 2.72Å
458K78.3Confident70.5Confident164 Ų16490 Ų9071%0.71345%0.451SS*.Hα-helixtrans-61.1-40.2-179.8-169.3168.7-172167.50112.4L454 L455 N460 G461L454-K458 VanDerWaalsContact O-CB 3.27Å; L454-K458 WeakPolarHBondContact O-CB 3.46Å; L454-K458 PolarHBondContact O-N 2.94Å; L455-K458 PolarHBondContact O-N 2.91Å; K458-N460 VanDerWaalsContact C-N 3.29Å; K458-N460 PolarHBondContact O-N 3.27Å; K458-G461 PolarHBondContact O-N 3.33Å
459M73.4Confident70Confident81 Ų8194 Ų9440%0.39947%0.472SS..Hα-helixtrans-66.4-31.4176.1-146.5-17868.200112.5V363 F367 L455 F456 A457 G461V363-M459 HydrophobicContact CB-CE 3.95Å; V363-M459 HydrophobicContact CG1-CE 3.61Å; V363-M459 HydrophobicContact CG1-SD 3.7Å; F367-M459 HydrophobicContact CD2-CE 3.91Å; F367-M459 HydrophobicContact CD2-SD 4.12Å; F367-M459 HydrophobicContact CE2-CE 4.03Å; F367-M459 HydrophobicContact CE2-SD 3.6Å; F367-M459 VanDerWaalsContact CE2-SD 3.6Å; F367-M459 HydrophobicContact CZ-SD 4.5Å; L455-M459 WeakPolarHBondContact O-CB 3.42Å; L455-M459 PolarHBondContact O-N 3.49Å; F456-M459 PolarHBondContact O-N 2.73Å; A457-M459 VanDerWaalsContact C-N 3.34Å; A457-M459 PolarHBondContact O-N 2.78Å; M459-G461 VanDerWaalsContact C-N 3.29Å; M459-G461 PolarHBondContact O-N 2.72Å
460N73.8Confident69.4Low37 Ų3796.9 Ų96.920%0.19849%0.487CS..THydrogen-bonded Turntrans-81.8-2.3176-81.2-72.4000114.4R360 E364 F456 A457 K458 Q462R360-N460 PolarHBondContact NH2-OD1 3.02Å; E364-N460 PolarHBondContact OE1-OD1 2.96Å; F456-N460 WeakPolarHBondContact CE2-ND2 3.24Å; F456-N460 WeakPolarHBondContact CZ-ND2 3.4Å; F456-N460 PolarHBondContact O-N 3.02Å; F456-N460 VanDerWaalsContact O-N 3.15Å; F456-N460 PolarHBondContact O-ND2 2.79Å; A457-N460 CarbonylContact O-C 3.59Å; A457-N460 WeakPolarHBondContact O-CA 3.45Å; A457-N460 PolarHBondContact O-N 3.22Å; K458-N460 VanDerWaalsContact C-N 3.29Å; K458-N460 PolarHBondContact O-N 3.27Å; N460-Q462 VanDerWaalsContact C-N 3.33Å
461G71.5Confident68.9Low61 Ų6195.3 Ų95.363%0.62948%0.484SS*.THydrogen-bonded Turntrans78.214.8-175.300000114A457 K458 M459A457-G461 PolarHBondContact O-N 3.23Å; K458-G461 PolarHBondContact O-N 3.33Å; M459-G461 VanDerWaalsContact C-N 3.29Å; M459-G461 PolarHBondContact O-N 2.72Å
462Q64.9Low68.3Low136 Ų13698.7 Ų98.764%0.63650%0.499SS*.  trans-89.2104.8173.2-64-174.6-0.400109.3A457 N460A457-Q462 CarbonylContact C-O 3.4Å; A457-Q462 HydrophobicContact CB-CB 4.2Å; A457-Q462 PolarHBondContact O-N 2.72Å; N460-Q462 VanDerWaalsContact C-N 3.33Å
463T45.2Very low67.4Low136 Ų136104.7 Ų104.783%0.83453%0.529SS*.  trans-79.3152.3173.9-22.40000111
464E47Very low66.7Low149 Ų149109.9 Ų109.970%0.69655%0.548SS*.  trans-63.6157.9-171.4-67.8161.6106.100115.4L454L454-E464 VanDerWaalsContact CD1-CD 3.45Å; L454-E464 HydrophobicContact CD1-CG 3.53Å; L454-E464 WeakPolarHBondContact CD1-OE1 3.35Å
465R32.1Very low65.7Low321 Ų321113.1 Ų113.1100%1.21156%0.562SS**  trans-138.50157.6-95-167.9175.6-175.5-0109

Retrieved 465 of 465 residues in 110.1 ms (Link to these results)