A0A077Z8E1_TRITR Loading...

Paramyosin

Paramyosin is a major structural component of many thick filaments isolated from invertebrate muscles.

AlphaFold DB , UniProt , Accession A0A077Z8E1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 878 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
1M40.4Very low42.4Very low237 Ų237150.9 Ų150.9100%1.16787%0.873SS**  084.20-60.9179.2-173.100106.8
2S37.2Very low42.3Very low123 Ų123147.7 Ų147.786%0.8688%0.878SS**  cis97.584.531.7-51.10000113.3
3A43.8Very low42.2Very low109 Ų109146.8 Ų146.890%0.90187%0.874SS**  trans-171.7134.7145.700000111.3
4S37.7Very low42.1Very low115 Ų115146.7 Ų146.780%0.80486%0.863SS**  trans-146.7156.9160.9690000108.8
5L50.8Low42.1Very low177 Ų177149.5 Ų149.593%0.92786%0.86SS**  trans-151160.7175.2-101169.8000111.4
6Y41.2Very low42.3Very low216 Ų216148.6 Ų148.685%0.84787%0.865SS**  trans-161163.1-154.3-138.2-87.3000113.5
7R41.6Very low42.5Very low232 Ų232145.8 Ų145.888%0.87586%0.863SS**  trans91.2148.4167.4-56.8178.1166.2-156.7-5.4119
8S39.6Very low42.8Very low109 Ų109143.4 Ų143.476%0.76286%0.855SS**  cis111.9161.3-0-164.10000116.5
9P51.9Low43.2Very low117 Ų117145.1 Ų145.176%0.7686%0.856SS**  -148-177.7-50.844.5-27000120.5
10S40.5Very low43.4Very low122 Ų122147.6 Ų147.685%0.85386%0.861SS**  trans1200133.9-1480000129.8
11A41.5Very low43.7Very low103 Ų103146.6 Ų146.685%0.85186%0.862SS**  00000000132.2
12A41.3Very low44.3Very low112 Ų112147 Ų14793%0.92685%0.851SS**  00000000123.7
13V40.9Very low45Very low136 Ų136147.1 Ų147.182%0.82485%0.851SS**  00086.20000127.3
14M41.2Very low45.4Very low146 Ų146146.3 Ų146.372%0.71985%0.854SS**  000-67.9-171.7-161.800129.1
15K42.6Very low46Very low189 Ų189145.2 Ų145.282%0.82286%0.861SS**  000-106.7174.3-179.2165.80120.7
16S44.3Very low45.9Very low134 Ų134146.4 Ų146.494%0.93786%0.859SS**  000630000126.1
17A45.8Very low46.3Very low101 Ų101144.4 Ų144.484%0.83586%0.857SS**  00000000120.2
18S47.3Very low46.8Very low103 Ų103138.8 Ų138.872%0.7285%0.854SS**  000-75.10000116.1
19M50.4Low47.2Very low176 Ų176145.7 Ų145.787%0.86787%0.865SS**  000-75.9175.3-170.300120.5
20M48.7Very low46.8Very low195 Ų195143.9 Ų143.996%0.96187%0.867SS**  000-56.9-145.7177.800125.6
21S49.3Very low47Very low126 Ų126148.9 Ų148.988%0.88187%0.874SS**  00051.10000120.8
22R52.4Low47Very low246 Ų246147.3 Ų147.393%0.92887%0.868SS**  000-170.3-171.5-178.4-155.51.6126.6
23S52.5Low47.2Very low125 Ų125145.9 Ų145.987%0.87486%0.864SS**  000-57.70000128.3
24G51.3Low47.4Very low93 Ų93151.6 Ų151.696%0.95987%0.873SS**  00000000128
25G50.7Low47.8Very low92 Ų92148.6 Ų148.695%0.94888%0.879SS**  00000000129
26F49.7Very low48.5Very low202 Ų202144.9 Ų144.989%0.88688%0.884SS**  000-151.3-113.6000131.1
27E48.5Very low48.8Very low174 Ų174144.6 Ų144.681%0.81388%0.878SS**  000-134.1163.3-84.900134.2
28S52.5Low49Very low114 Ų114146 Ų14680%0.79788%0.882SS**  00068.50000126.6
29Y47Very low49.4Very low254 Ų254149.6 Ų149.6100%0.99689%0.892SS**  000-94.9-61.9000121.3
30G44.8Very low49.1Very low79 Ų79145.9 Ų145.981%0.81488%0.884SS**  00000000122
31F44.1Very low49.2Very low226 Ų226144.4 Ų144.499%0.99188%0.878SS**  000151-81.9000127.9
32G42.7Very low49Very low70 Ų70142.5 Ų142.572%0.72287%0.87SS**  00000000132.2
33G45.5Very low48.9Very low82 Ų82137.6 Ų137.685%0.84586%0.862SS**  00000000133.4
34Y44.7Very low48.7Very low257 Ų257138.6 Ų138.6100%1.00886%0.857SS**  000-67.8-76.9000137.2
35G49.7Very low48.8Very low82 Ų82137.4 Ų137.485%0.84585%0.845SS**  00000000126.5
36A56.5Low49Very low112 Ų112137.1 Ų137.193%0.92683%0.828SS**  00000000127.1
37P50.9Low49.2Very low128 Ų128131.2 Ų131.283%0.83181%0.805SS**  00045.9-25.6000128.4
38S49.7Very low49.7Very low129 Ų129127.1 Ų127.190%0.90279%0.792SS**  00070.70000130.1
39L55.8Low50Low179 Ų179132.2 Ų132.294%0.93779%0.794SS**  0-156.50-147.795.5000119.9
40S44.8Very low50.4Low99 Ų99125.1 Ų125.169%0.69277%0.773SS**  trans-162.6-172.1-175.664.80000115.6
41I49.2Very low51Low163 Ų163125.8 Ų125.884%0.83676%0.755SS**  cis-168.8172.59.2-160.6165.3000115.7
42A46.8Very low51.9Low87 Ų87120.3 Ų120.372%0.71974%0.736SS**  trans82.1156.3162.200000125.1
43D49.6Very low52.8Low142 Ų142124 Ų12476%0.75973%0.732SS**  trans55.296.6177.1-74.1-15.6000121.5G45D43-G45 PolarHBondContact O-N 3.32Å
44L47.9Very low53.4Low146 Ų146124.3 Ų124.376%0.76471%0.713SS**THydrogen-bonded Turntrans-74.6-2.4-173.6-88.176.5000117.5L47L44-L47 HydrophobicContact CG-CD2 4.47Å
45G54.1Low54.5Low69 Ų69119.9 Ų119.971%0.71170%0.695SS**THydrogen-bonded Turntrans-73.4-37.9-167.700000115.7D43D43-G45 PolarHBondContact O-N 3.32Å
46S55.5Low55.3Low86 Ų86121.6 Ų121.660%0.60168%0.684SS**THydrogen-bonded Turntrans-88.8-8-178.847.80000113.7
47L53.4Low55.5Low77 Ų77121.2 Ų121.240%0.40367%0.666SS.*Hα-helixtrans-60.4-50.5-172-145.569.1000111.7L44 R49 L50 E51L44-L47 HydrophobicContact CG-CD2 4.47Å; L47-R49 PolarHBondContact O-N 3.3Å; L47-R49 VanDerWaalsContact O-N 3.16Å; L47-L50 CarbonylContact O-C 3.55Å; L47-L50 WeakPolarHBondContact O-CA 3.45Å; L47-L50 WeakPolarHBondContact O-CB 3.39Å; L47-L50 PolarHBondContact O-N 3.4Å; L47-E51 WeakPolarHBondContact CD2-OE1 3.47Å; L47-E51 HydrophobicContact CG-CG 4.07Å; L47-E51 WeakPolarHBondContact O-CG 3.42Å; L47-E51 PolarHBondContact O-N 2.76Å
48T59Low56.1Low88 Ų88120 Ų12054%0.5465%0.649SS.*Hα-helixtrans-54.9-38.6-171.451.60000115.7E51 D52T48-E51 WeakPolarHBondContact CA-OE2 3.49Å; T48-E51 PolarHBondContact N-OE2 3.14Å; T48-D52 PolarHBondContact O-N 3.44Å
49R57.9Low57Low222 Ų222118.3 Ų118.384%0.83863%0.63SS**Hα-helixtrans-79.7-17.3177-80.9-174.3172.8174.8-1.1114.3L47L47-R49 PolarHBondContact O-N 3.3Å; L47-R49 VanDerWaalsContact O-N 3.16Å
50L56Low57.7Low105 Ų105114.9 Ų114.955%0.5561%0.613SS.*Hα-helixtrans-87.3-37.1170.1-70.5169.3000110.5L47 K53 I54L47-L50 CarbonylContact O-C 3.55Å; L47-L50 WeakPolarHBondContact O-CA 3.45Å; L47-L50 WeakPolarHBondContact O-CB 3.39Å; L47-L50 PolarHBondContact O-N 3.4Å; L50-K53 PolarHBondContact O-N 3.5Å; L50-I54 HydrophobicContact CB-CD1 4.42Å; L50-I54 WeakPolarHBondContact O-CB 3.21Å; L50-I54 VanDerWaalsContact O-CG1 3.23Å; L50-I54 WeakPolarHBondContact O-CG1 3.16Å; L50-I54 PolarHBondContact O-N 2.96Å
51E57.6Low58.5Low93 Ų93113.8 Ų113.844%0.43560%0.599SS.*Hα-helixtrans-55.8-50.6175.7-73.7170.9136.900111.9L47 T48 K53 I54 R55L47-E51 WeakPolarHBondContact CD2-OE1 3.47Å; L47-E51 HydrophobicContact CG-CG 4.07Å; L47-E51 WeakPolarHBondContact O-CG 3.42Å; L47-E51 PolarHBondContact O-N 2.76Å; T48-E51 WeakPolarHBondContact CA-OE2 3.49Å; T48-E51 PolarHBondContact N-OE2 3.14Å; E51-K53 VanDerWaalsContact C-N 3.3Å; E51-K53 PolarHBondContact O-N 3.15Å; E51-I54 PolarHBondContact O-N 3.41Å; E51-R55 WeakPolarHBondContact O-CB 3.44Å; E51-R55 PolarHBondContact O-N 2.77Å
52D63.2Low59.4Low111 Ų111111.8 Ų111.859%0.59459%0.586SS**Hα-helixtrans-59.9-36.7177.6-81.1-23.5000113.2T48 R55 L56T48-D52 PolarHBondContact O-N 3.44Å; D52-R55 PolarHBondContact O-N 3.15Å; D52-L56 PolarHBondContact O-N 2.92Å
53K60.7Low60.6Low146 Ų146111.7 Ų111.764%0.63558%0.577SS**Hα-helixtrans-79.4-32178.9-172.7164.9-177.4173.20112.7L50 E51 R55 L57L50-K53 PolarHBondContact O-N 3.5Å; E51-K53 VanDerWaalsContact C-N 3.3Å; E51-K53 PolarHBondContact O-N 3.15Å; K53-R55 VanDerWaalsContact C-N 3.28Å; K53-L57 HydrophobicContact CG-CD1 4.43Å; K53-L57 WeakPolarHBondContact O-CG 3.23Å; K53-L57 PolarHBondContact O-N 2.95Å
54I58.5Low61.3Low89 Ų89109.2 Ų109.246%0.45656%0.56SS.*Hα-helixtrans-63-39.8168.9-74.5164.8000109.4L50 E51 L57 Q58L50-I54 HydrophobicContact CB-CD1 4.42Å; L50-I54 WeakPolarHBondContact O-CB 3.21Å; L50-I54 VanDerWaalsContact O-CG1 3.23Å; L50-I54 WeakPolarHBondContact O-CG1 3.16Å; L50-I54 PolarHBondContact O-N 2.96Å; E51-I54 PolarHBondContact O-N 3.41Å; I54-L57 CarbonylContact O-C 3.5Å; I54-L57 PolarHBondContact O-N 3.28Å; I54-Q58 HydrophobicContact CG2-CG 4.25Å; I54-Q58 VanDerWaalsContact O-CG 3.28Å; I54-Q58 WeakPolarHBondContact O-CG 3.44Å; I54-Q58 PolarHBondContact O-N 3.03Å
55R67.9Low62.6Low164 Ų164108.8 Ų108.862%0.61955%0.549SS*.Hα-helixtrans-65.1-47.1-177.9-156.7173.2-173.1178.91.8113.3E51 D52 K53 L57 Q58 D59E51-R55 WeakPolarHBondContact O-CB 3.44Å; E51-R55 PolarHBondContact O-N 2.77Å; D52-R55 PolarHBondContact O-N 3.15Å; K53-R55 VanDerWaalsContact C-N 3.28Å; R55-L57 VanDerWaalsContact C-N 3.29Å; R55-L57 PolarHBondContact O-N 2.85Å; R55-Q58 WeakPolarHBondContact O-CB 3.37Å; R55-Q58 PolarHBondContact O-N 3.02Å; R55-D59 PolarHBondContact O-N 2.96Å
56L65.9Low63.6Low119 Ų119111.9 Ų111.962%0.62354%0.544SS*.Hα-helixtrans-61.1-37.5173.1-82.2163.7000112.6D52 Q58 D59 D60D52-L56 PolarHBondContact O-N 2.92Å; L56-Q58 VanDerWaalsContact C-N 3.29Å; L56-Q58 PolarHBondContact O-N 3.18Å; L56-D59 PolarHBondContact O-N 2.78Å; L56-D60 PolarHBondContact O-N 3.08Å; L56-D60 VanDerWaalsContact O-N 3.14Å
57L61.9Low64.5Low103 Ų103113 Ų11354%0.53954%0.543SS..Hα-helixtrans-74.5-17.2174.9-69.9171.2000113.5K53 I54 R55 L61K53-L57 HydrophobicContact CG-CD1 4.43Å; K53-L57 WeakPolarHBondContact O-CG 3.23Å; K53-L57 PolarHBondContact O-N 2.95Å; I54-L57 CarbonylContact O-C 3.5Å; I54-L57 PolarHBondContact O-N 3.28Å; R55-L57 VanDerWaalsContact C-N 3.29Å; R55-L57 PolarHBondContact O-N 2.85Å; L57-L61 WeakPolarHBondContact O-CB 3.31Å; L57-L61 PolarHBondContact O-N 2.83Å
58Q63.8Low65.4Low103 Ų103116.3 Ų116.348%0.48155%0.55SS.*Hα-helixtrans-77.7-46170.5-77.4167.1-3000110.4I54 R55 L56 D60 L61 E62I54-Q58 HydrophobicContact CG2-CG 4.25Å; I54-Q58 VanDerWaalsContact O-CG 3.28Å; I54-Q58 WeakPolarHBondContact O-CG 3.44Å; I54-Q58 PolarHBondContact O-N 3.03Å; R55-Q58 WeakPolarHBondContact O-CB 3.37Å; R55-Q58 PolarHBondContact O-N 3.02Å; L56-Q58 VanDerWaalsContact C-N 3.29Å; L56-Q58 PolarHBondContact O-N 3.18Å; Q58-D60 PolarHBondContact O-N 2.8Å; Q58-L61 PolarHBondContact O-N 2.89Å; Q58-E62 WeakPolarHBondContact O-CG 3.33Å; Q58-E62 PolarHBondContact O-N 3.4Å
59D68.3Low66.1Low94 Ų94115.9 Ų115.950%0.50355%0.545SS..Hα-helixtrans-57.8-49.4175.6-68.8-0000111.1R55 L56 L61 E62 T63R55-D59 PolarHBondContact O-N 2.96Å; L56-D59 PolarHBondContact O-N 2.78Å; D59-L61 VanDerWaalsContact C-N 3.34Å; D59-L61 PolarHBondContact O-N 3.3Å; D59-E62 PolarHBondContact O-N 3.45Å; D59-T63 PolarHBondContact O-N 3.48Å
60D69.2Low67Low107 Ų107112.9 Ų112.957%0.57253%0.533SS*.Hα-helixtrans-56.2-46.1175.1-81.8-21.7000111.7L56 Q58 E62 T63 E64L56-D60 PolarHBondContact O-N 3.08Å; L56-D60 VanDerWaalsContact O-N 3.14Å; Q58-D60 PolarHBondContact O-N 2.8Å; D60-E62 VanDerWaalsContact C-N 3.34Å; D60-E62 PolarHBondContact O-N 3.14Å; D60-T63 PolarHBondContact O-N 3.47Å; D60-T63 PolarHBondContact O-OG1 3.21Å; D60-E64 PolarHBondContact O-N 3.49Å; D60-E64 VanDerWaalsContact O-N 3.17Å
61L62.5Low67.9Low76 Ų76113 Ų11340%0.39853%0.534SS..Hα-helixtrans-65.9-32.7-179.4-179.266.3000112.9L57 Q58 D59 R65L57-L61 WeakPolarHBondContact O-CB 3.31Å; L57-L61 PolarHBondContact O-N 2.83Å; Q58-L61 PolarHBondContact O-N 2.89Å; D59-L61 VanDerWaalsContact C-N 3.34Å; D59-L61 PolarHBondContact O-N 3.3Å; L61-R65 WeakPolarHBondContact O-CD 3.45Å; L61-R65 VanDerWaalsContact O-CG 3.24Å; L61-R65 WeakPolarHBondContact O-CG 3.45Å; L61-R65 PolarHBondContact O-N 2.74Å
62E67.1Low68.6Low120 Ų120114.7 Ų114.756%0.56154%0.541SS*.Hα-helixtrans-70.3-37.2175-72-170.4168.300111.5Q58 D59 D60 R65 E66Q58-E62 WeakPolarHBondContact O-CG 3.33Å; Q58-E62 PolarHBondContact O-N 3.4Å; D59-E62 PolarHBondContact O-N 3.45Å; D60-E62 VanDerWaalsContact C-N 3.34Å; D60-E62 PolarHBondContact O-N 3.14Å; E62-R65 WeakPolarHBondContact O-CB 3.38Å; E62-R65 PolarHBondContact O-N 3.39Å; E62-E66 PolarHBondContact O-N 2.78Å; E62-E66 VanDerWaalsContact O-N 3.1Å
63T71.9Confident69.2Low86 Ų86117.4 Ų117.453%0.52854%0.543SS..Hα-helixtrans-66.1-37.8173.869.90000113.4D59 D60 R65 E66 L67D59-T63 PolarHBondContact O-N 3.48Å; D60-T63 PolarHBondContact O-N 3.47Å; D60-T63 PolarHBondContact O-OG1 3.21Å; T63-R65 VanDerWaalsContact C-N 3.31Å; T63-R65 PolarHBondContact O-N 3.24Å; T63-E66 PolarHBondContact O-N 2.72Å; T63-L67 PolarHBondContact O-N 3.31Å
64E64.6Low69.9Low89 Ų89116.4 Ų116.442%0.41654%0.541SS..Hα-helixtrans-64.8-37.6175.3-157.1-147.214200111.4D60 L67 R68D60-E64 PolarHBondContact O-N 3.49Å; D60-E64 VanDerWaalsContact O-N 3.17Å; E64-L67 PolarHBondContact O-N 3.08Å; E64-R68 PolarHBondContact O-N 3.49Å; E64-R68 VanDerWaalsContact O-N 3.09Å; E64-R68 IonicContact OE1-CZ 3.95Å; E64-R68 IonicContact OE1-NE 2.77Å; E64-R68 PolarHBondContact OE1-NE 3.49Å; E64-R68 IonicContact OE1-NH2 3.25Å; E64-R68 PolarHBondContact OE1-NH2 3.17Å
65R75.7Confident70.8Confident138 Ų138121.4 Ų121.452%0.52155%0.554SS.*Hα-helixtrans-64.7-40.1177-74.8166.5171.3-179.2-2.3112.4L61 E62 T63 L67 N69L61-R65 WeakPolarHBondContact O-CD 3.45Å; L61-R65 VanDerWaalsContact O-CG 3.24Å; L61-R65 WeakPolarHBondContact O-CG 3.45Å; L61-R65 PolarHBondContact O-N 2.74Å; E62-R65 WeakPolarHBondContact O-CB 3.38Å; E62-R65 PolarHBondContact O-N 3.39Å; T63-R65 VanDerWaalsContact C-N 3.31Å; T63-R65 PolarHBondContact O-N 3.24Å; R65-L67 VanDerWaalsContact C-N 3.34Å; R65-N69 WeakPolarHBondContact O-CB 3.5Å; R65-N69 PolarHBondContact O-N 3.43Å; R65-N69 VanDerWaalsContact O-N 3.13Å; R65-N69 PolarHBondContact O-ND2 3.16Å
66E74.7Confident71.2Confident133 Ų133116 Ų11662%0.62155%0.545SS*.Hα-helixtrans-62.8-40.4175.2-70.5-147.7141.100112.5E62 T63 N69 R70E62-E66 PolarHBondContact O-N 2.78Å; E62-E66 VanDerWaalsContact O-N 3.1Å; T63-E66 PolarHBondContact O-N 2.72Å; E66-N69 PolarHBondContact O-N 3.02Å; E66-R70 PolarHBondContact O-N 2.77Å
67L74.1Confident71.7Confident109 Ų109115.3 Ų115.357%0.57154%0.541SS*.Hα-helixtrans-66.8-44.4179.1-72.7171.1000112.2T63 E64 R65 N69 R70 I71T63-L67 PolarHBondContact O-N 3.31Å; E64-L67 PolarHBondContact O-N 3.08Å; R65-L67 VanDerWaalsContact C-N 3.34Å; L67-N69 VanDerWaalsContact C-N 3.32Å; L67-N69 PolarHBondContact O-N 2.99Å; L67-R70 PolarHBondContact O-N 3.14Å; L67-R70 VanDerWaalsContact O-N 3.14Å; L67-I71 PolarHBondContact O-N 3.45Å
68R72.8Confident72.4Confident147 Ų147115.5 Ų115.556%0.55554%0.543SS*.Hα-helixtrans-58-44.4173.8-71.3-173.1-175.1-137.45.1112.1E64 R70 I71 E72E64-R68 PolarHBondContact O-N 3.49Å; E64-R68 VanDerWaalsContact O-N 3.09Å; E64-R68 IonicContact OE1-CZ 3.95Å; E64-R68 IonicContact OE1-NE 2.77Å; E64-R68 PolarHBondContact OE1-NE 3.49Å; E64-R68 IonicContact OE1-NH2 3.25Å; E64-R68 PolarHBondContact OE1-NH2 3.17Å; R68-R70 PolarHBondContact O-N 2.95Å; R68-R70 VanDerWaalsContact O-N 3.15Å; R68-I71 PolarHBondContact O-N 3.22Å; R68-I71 VanDerWaalsContact O-N 3.14Å; R68-E72 PolarHBondContact O-N 3.33Å
69N74.6Confident73.1Confident79 Ų79113.8 Ų113.842%0.42254%0.542SS..Hα-helixtrans-62.9-17.8178.5-80.4-44.7000114.2R65 E66 L67 R73R65-N69 WeakPolarHBondContact O-CB 3.5Å; R65-N69 PolarHBondContact O-N 3.43Å; R65-N69 VanDerWaalsContact O-N 3.13Å; R65-N69 PolarHBondContact O-ND2 3.16Å; E66-N69 PolarHBondContact O-N 3.02Å; L67-N69 VanDerWaalsContact C-N 3.32Å; L67-N69 PolarHBondContact O-N 2.99Å; N69-R73 VanDerWaalsContact O-CD 3.32Å; N69-R73 WeakPolarHBondContact O-CD 3.3Å; N69-R73 WeakPolarHBondContact O-CG 3.3Å; N69-R73 PolarHBondContact O-NE 2.72Å
70R76.5Confident73.5Confident160 Ų160113.2 Ų113.260%0.60454%0.541SS*.Hα-helixtrans-83.4-48.9169-66.3-171.8-172.4-160.94.1111.6E66 L67 R68 E72 R73 E74E66-R70 PolarHBondContact O-N 2.77Å; L67-R70 PolarHBondContact O-N 3.14Å; L67-R70 VanDerWaalsContact O-N 3.14Å; R68-R70 PolarHBondContact O-N 2.95Å; R68-R70 VanDerWaalsContact O-N 3.15Å; R70-E72 VanDerWaalsContact C-N 3.28Å; R70-E72 PolarHBondContact O-N 2.87Å; R70-R73 WeakPolarHBondContact O-CB 3.46Å; R70-R73 PolarHBondContact O-N 3.08Å; R70-E74 PolarHBondContact O-N 3.31Å
71I74Confident73.9Confident108 Ų108113.6 Ų113.655%0.55454%0.54SS*.Hα-helixtrans-59.9-38.2-178.2-64.6169.2000111.4L67 R68 R73 R75L67-I71 PolarHBondContact O-N 3.45Å; R68-I71 PolarHBondContact O-N 3.22Å; R68-I71 VanDerWaalsContact O-N 3.14Å; I71-R73 VanDerWaalsContact C-N 3.32Å; I71-R73 PolarHBondContact O-N 2.71Å; I71-R75 VanDerWaalsContact O-CB 3.27Å; I71-R75 WeakPolarHBondContact O-CB 3.07Å; I71-R75 PolarHBondContact O-N 2.66Å
72E72.2Confident74.5Confident128 Ų128115.6 Ų115.660%0.59855%0.55SS**Hα-helixtrans-67.8-29.2176.6-70.9-175.1169.700113.3R68 R70 A76R68-E72 PolarHBondContact O-N 3.33Å; R70-E72 VanDerWaalsContact C-N 3.28Å; R70-E72 PolarHBondContact O-N 2.87Å; E72-A76 PolarHBondContact O-N 3.3Å; E72-A76 VanDerWaalsContact O-N 3.15Å
73R76.7Confident75Confident167 Ų167114.3 Ų114.363%0.6355%0.546SS*.Hα-helixtrans-74.8-48.6174.6-68.4172.6-174.1150.45.3111.8N69 R70 I71 R75 A76 D77N69-R73 VanDerWaalsContact O-CD 3.32Å; N69-R73 WeakPolarHBondContact O-CD 3.3Å; N69-R73 WeakPolarHBondContact O-CG 3.3Å; N69-R73 PolarHBondContact O-NE 2.72Å; R70-R73 WeakPolarHBondContact O-CB 3.46Å; R70-R73 PolarHBondContact O-N 3.08Å; I71-R73 VanDerWaalsContact C-N 3.32Å; I71-R73 PolarHBondContact O-N 2.71Å; R73-R75 PolarHBondContact O-N 2.96Å; R73-A76 WeakPolarHBondContact O-CA 3.49Å; R73-A76 WeakPolarHBondContact O-CB 3.37Å; R73-A76 PolarHBondContact O-N 3.04Å; R73-D77 PolarHBondContact O-N 3.42Å
74E74.4Confident75.3Confident126 Ų126114.6 Ų114.659%0.58954%0.544SS*.Hα-helixtrans-58.5-38176.5-68.5177173.800111.4R70 L78R70-E74 PolarHBondContact O-N 3.31Å; E74-L78 WeakPolarHBondContact O-CG 3.41Å; E74-L78 PolarHBondContact O-N 3.32Å; E74-L78 VanDerWaalsContact O-N 3.12Å
75R77.4Confident75.9Confident194 Ų194115.8 Ų115.873%0.73255%0.553SS**Hα-helixtrans-67.2-34.2174.1-172.6177.7176-148.2-4.3113.1I71 R73 S79I71-R75 VanDerWaalsContact O-CB 3.27Å; I71-R75 WeakPolarHBondContact O-CB 3.07Å; I71-R75 PolarHBondContact O-N 2.66Å; R73-R75 PolarHBondContact O-N 2.96Å; R75-S79 PolarHBondContact O-N 2.87Å
76A75.8Confident75.9Confident51 Ų51112.7 Ų112.742%0.42155%0.55SS..Hα-helixtrans-68.6-46.8175.200000111.5E72 R73 L78 S79 V80E72-A76 PolarHBondContact O-N 3.3Å; E72-A76 VanDerWaalsContact O-N 3.15Å; R73-A76 WeakPolarHBondContact O-CA 3.49Å; R73-A76 WeakPolarHBondContact O-CB 3.37Å; R73-A76 PolarHBondContact O-N 3.04Å; A76-L78 VanDerWaalsContact C-N 3.35Å; A76-L78 PolarHBondContact O-N 3.26Å; A76-S79 WeakPolarHBondContact O-CB 3.37Å; A76-S79 PolarHBondContact O-N 3.24Å; A76-V80 PolarHBondContact O-N 3.17Å; A76-V80 VanDerWaalsContact O-N 3.09Å
77D76.5Confident76.1Confident103 Ų103110.3 Ų110.355%0.55154%0.541SS*.Hα-helixtrans-60.6-41.6178.5-74.2-23.6000112.1R73 S79 V80 Q81R73-D77 PolarHBondContact O-N 3.42Å; D77-S79 VanDerWaalsContact C-N 3.31Å; D77-S79 PolarHBondContact O-N 2.99Å; D77-V80 PolarHBondContact O-N 2.88Å; D77-Q81 WeakPolarHBondContact O-CG 3.46Å; D77-Q81 PolarHBondContact O-N 3.2Å
78L76.9Confident76.2Confident108 Ų108113.5 Ų113.557%0.56555%0.546SS*.Hα-helixtrans-63.5-34.9174-73.5171.2000112.7E74 A76 V80 Q81 L82E74-L78 WeakPolarHBondContact O-CG 3.41Å; E74-L78 PolarHBondContact O-N 3.32Å; E74-L78 VanDerWaalsContact O-N 3.12Å; A76-L78 VanDerWaalsContact C-N 3.35Å; A76-L78 PolarHBondContact O-N 3.26Å; L78-V80 VanDerWaalsContact C-N 3.35Å; L78-Q81 PolarHBondContact O-N 2.85Å; L78-L82 PolarHBondContact O-N 2.74Å; L78-L82 VanDerWaalsContact O-N 3.15Å
79S78.7Confident76.4Confident67 Ų67111.6 Ų111.647%0.46955%0.546SS..Hα-helixtrans-68.3-33.8176.1-163.20000112.4R75 A76 D77 I83R75-S79 PolarHBondContact O-N 2.87Å; A76-S79 WeakPolarHBondContact O-CB 3.37Å; A76-S79 PolarHBondContact O-N 3.24Å; D77-S79 VanDerWaalsContact C-N 3.31Å; D77-S79 PolarHBondContact O-N 2.99Å; S79-I83 PolarHBondContact O-N 3.25Å
80V77.7Confident76.5Confident81 Ų81114.3 Ų114.349%0.49156%0.556SS.*Hα-helixtrans-71.6-36.6174.9174.50000111.3A76 D77 L78 L82 I83 N84A76-V80 PolarHBondContact O-N 3.17Å; A76-V80 VanDerWaalsContact O-N 3.09Å; D77-V80 PolarHBondContact O-N 2.88Å; L78-V80 VanDerWaalsContact C-N 3.35Å; V80-L82 VanDerWaalsContact C-N 3.34Å; V80-L82 PolarHBondContact O-N 3.32Å; V80-I83 PolarHBondContact O-N 2.97Å; V80-N84 PolarHBondContact O-N 2.85Å; V80-N84 PolarHBondContact O-ND2 2.72Å
81Q77.1Confident76.4Confident116 Ų116113.2 Ų113.254%0.54256%0.558SS.*Hα-helixtrans-65.3-35.8175.2-71176.644.500112.6D77 L78 L85D77-Q81 WeakPolarHBondContact O-CG 3.46Å; D77-Q81 PolarHBondContact O-N 3.2Å; L78-Q81 PolarHBondContact O-N 2.85Å; Q81-L85 WeakPolarHBondContact O-CG 3.13Å; Q81-L85 PolarHBondContact O-N 2.96Å
82L74.9Confident76.4Confident117 Ų117110.4 Ų110.461%0.61355%0.551SS**Hα-helixtrans-62.9-43174.4-97.5165.1000112.6L78 V80 L85 T86L78-L82 PolarHBondContact O-N 2.74Å; L78-L82 VanDerWaalsContact O-N 3.15Å; V80-L82 VanDerWaalsContact C-N 3.34Å; V80-L82 PolarHBondContact O-N 3.32Å; L82-L85 PolarHBondContact O-N 3.28Å; L82-T86 PolarHBondContact O-N 2.7Å; L82-T86 VanDerWaalsContact O-N 3.1Å; L82-T86 PolarHBondContact O-OG1 2.74Å; L82-T86 VanDerWaalsContact O-OG1 3.14Å
83I77.7Confident76.5Confident94 Ų94110.4 Ų110.448%0.48255%0.551SS.*Hα-helixtrans-61.7-50.5177.6-64.6165.7000110.4S79 V80 L85 T86 D87S79-I83 PolarHBondContact O-N 3.25Å; V80-I83 PolarHBondContact O-N 2.97Å; I83-L85 PolarHBondContact O-N 3.39Å; I83-T86 WeakPolarHBondContact O-CB 3.2Å; I83-T86 PolarHBondContact O-N 2.75Å; I83-D87 PolarHBondContact O-N 2.63Å
84N78Confident76.6Confident91 Ų91104.8 Ų104.849%0.48755%0.545SS..Hα-helixtrans-60.3-20.8177.9-73.9-68.8000114.5V80V80-N84 PolarHBondContact O-N 2.85Å; V80-N84 PolarHBondContact O-ND2 2.72Å
85L77.3Confident76.6Confident115 Ų115103.5 Ų103.560%0.60255%0.545SS*.Hα-helixtrans-86.1-29.4173.2-74.4172.4000112.6Q81 L82 I83 L89Q81-L85 WeakPolarHBondContact O-CG 3.13Å; Q81-L85 PolarHBondContact O-N 2.96Å; L82-L85 PolarHBondContact O-N 3.28Å; I83-L85 PolarHBondContact O-N 3.39Å; L85-L89 PolarHBondContact O-N 3.09Å
86T76.6Confident76.6Confident72 Ų7298.2 Ų98.244%0.44254%0.535SS..Hα-helixtrans-72.1-47.8174.6-56.10000111.3L82 I83 R88 L89 E90L82-T86 PolarHBondContact O-N 2.7Å; L82-T86 VanDerWaalsContact O-N 3.1Å; L82-T86 PolarHBondContact O-OG1 2.74Å; L82-T86 VanDerWaalsContact O-OG1 3.14Å; I83-T86 WeakPolarHBondContact O-CB 3.2Å; I83-T86 PolarHBondContact O-N 2.75Å; T86-R88 PolarHBondContact O-N 3.38Å; T86-L89 WeakPolarHBondContact O-CA 3.19Å; T86-L89 VanDerWaalsContact O-CB 3.29Å; T86-L89 WeakPolarHBondContact O-CB 3.45Å; T86-L89 PolarHBondContact O-N 2.75Å; T86-E90 PolarHBondContact O-N 3.05Å
87D79.2Confident76.9Confident83 Ų83101.2 Ų101.244%0.44454%0.544SS..Hα-helixtrans-56-39.2179-58-13.9000111.3I83 L89 E90 E91I83-D87 PolarHBondContact O-N 2.63Å; D87-L89 VanDerWaalsContact C-N 3.29Å; D87-L89 PolarHBondContact O-N 2.74Å; D87-E90 PolarHBondContact O-N 3.39Å; D87-E91 PolarHBondContact O-N 3.37Å; D87-E91 VanDerWaalsContact O-N 3.13Å
88R75.9Confident77.1Confident177 Ų17799.2 Ų99.267%0.66854%0.542SS*.Hα-helixtrans-67.9-21.7175.2-86.3-178154.6-168.9-5.3114.9T86 A92T86-R88 PolarHBondContact O-N 3.38Å; R88-A92 PolarHBondContact O-N 2.71Å
89L76.3Confident77.3Confident106 Ų106100.4 Ų100.456%0.55554%0.544SS*.Hα-helixtrans-77.2-42.9173.7-158.179.9000109.9L85 T86 D87 E91 A92 E93L85-L89 PolarHBondContact O-N 3.09Å; T86-L89 WeakPolarHBondContact O-CA 3.19Å; T86-L89 VanDerWaalsContact O-CB 3.29Å; T86-L89 WeakPolarHBondContact O-CB 3.45Å; T86-L89 PolarHBondContact O-N 2.75Å; D87-L89 VanDerWaalsContact C-N 3.29Å; D87-L89 PolarHBondContact O-N 2.74Å; L89-E91 VanDerWaalsContact C-N 3.35Å; L89-E91 PolarHBondContact O-N 2.77Å; L89-A92 WeakPolarHBondContact O-CB 3.36Å; L89-A92 PolarHBondContact O-N 3.22Å; L89-E93 PolarHBondContact O-N 2.71Å
90E76.5Confident77.4Confident136 Ų136101 Ų10164%0.63654%0.541SS*.Hα-helixtrans-63.2-38.1177-61.8-170.217400112T86 D87 A92 E93 G94T86-E90 PolarHBondContact O-N 3.05Å; D87-E90 PolarHBondContact O-N 3.39Å; E90-A92 VanDerWaalsContact C-N 3.29Å; E90-A92 PolarHBondContact O-N 2.73Å; E90-E93 PolarHBondContact O-N 3.18Å; E90-G94 PolarHBondContact O-N 3.36Å
91E74.7Confident77.5Confident138 Ų138102.4 Ų102.465%0.64554%0.543SS*.Hα-helixtrans-60.3-35.8170.5-72.4-169.1137.500113D87 L89 T95D87-E91 PolarHBondContact O-N 3.37Å; D87-E91 VanDerWaalsContact O-N 3.13Å; L89-E91 VanDerWaalsContact C-N 3.35Å; L89-E91 PolarHBondContact O-N 2.77Å; E91-T95 WeakPolarHBondContact O-CG2 3.01Å; E91-T95 PolarHBondContact O-N 2.78Å; E91-T95 PolarHBondContact O-OG1 3.43Å
92A73.6Confident77.7Confident49 Ų4999.3 Ų99.341%0.40554%0.537SS..Hα-helixtrans-76-35.6179.500000112.7R88 L89 E90 T95 T96R88-A92 PolarHBondContact O-N 2.71Å; L89-A92 WeakPolarHBondContact O-CB 3.36Å; L89-A92 PolarHBondContact O-N 3.22Å; E90-A92 VanDerWaalsContact C-N 3.29Å; E90-A92 PolarHBondContact O-N 2.73Å; A92-T95 WeakPolarHBondContact CA-OG1 3.33Å; A92-T95 PolarHBondContact O-OG1 2.83Å; A92-T95 VanDerWaalsContact O-OG1 3.13Å; A92-T96 PolarHBondContact O-N 2.69Å; A92-T96 PolarHBondContact O-OG1 2.71Å
93E75.2Confident78.1Confident128 Ų12897.7 Ų97.760%0.59853%0.529SS*.Hα-helixtrans-69.2-47.5173.6-67.5-171.7164.200110.9L89 E90 T95 T96 D97L89-E93 PolarHBondContact O-N 2.71Å; E90-E93 PolarHBondContact O-N 3.18Å; E93-T95 VanDerWaalsContact C-N 3.31Å; E93-T95 PolarHBondContact O-N 2.75Å; E93-T96 WeakPolarHBondContact O-CB 3.43Å; E93-T96 PolarHBondContact O-N 3.48Å; E93-D97 PolarHBondContact O-N 2.72Å
94G77.8Confident78.5Confident49 Ų49101.5 Ų101.551%0.50554%0.537SS..Hα-helixtrans-61.5-33.2178.600000114.4E90 T96E90-G94 PolarHBondContact O-N 3.36Å; G94-T96 VanDerWaalsContact C-N 3.34Å
95T75.6Confident78.7Confident98 Ų98102.3 Ų102.360%0.60154%0.536SS*.Hα-helixtrans-73.7-23.5172.944.70000113.3E91 A92 E93E91-T95 WeakPolarHBondContact O-CG2 3.01Å; E91-T95 PolarHBondContact O-N 2.78Å; E91-T95 PolarHBondContact O-OG1 3.43Å; A92-T95 WeakPolarHBondContact CA-OG1 3.33Å; A92-T95 PolarHBondContact O-OG1 2.83Å; A92-T95 VanDerWaalsContact O-OG1 3.13Å; E93-T95 VanDerWaalsContact C-N 3.31Å; E93-T95 PolarHBondContact O-N 2.75Å
96T77.9Confident79Confident83 Ų83104.8 Ų104.851%0.50954%0.538SS..Hα-helixtrans-75.9-43178.2-58.60000111.8A92 E93 G94 A98 Q99 I100A92-T96 PolarHBondContact O-N 2.69Å; A92-T96 PolarHBondContact O-OG1 2.71Å; E93-T96 WeakPolarHBondContact O-CB 3.43Å; E93-T96 PolarHBondContact O-N 3.48Å; G94-T96 VanDerWaalsContact C-N 3.34Å; T96-A98 PolarHBondContact O-N 2.86Å; T96-Q99 VanDerWaalsContact O-CB 3.31Å; T96-Q99 WeakPolarHBondContact O-CB 3.1Å; T96-Q99 PolarHBondContact O-N 3.48Å; T96-I100 PolarHBondContact O-N 2.73Å
97D81.9Confident79.4Confident115 Ų115107.9 Ų107.962%0.61555%0.547SS*.Hα-helixtrans-64.9-38.1178.3-92.7-17.9000112.7E93 Q99 I100 E101E93-D97 PolarHBondContact O-N 2.72Å; D97-Q99 PolarHBondContact O-N 3.35Å; D97-I100 PolarHBondContact O-N 3.12Å; D97-E101 PolarHBondContact O-N 2.74Å; D97-E101 VanDerWaalsContact O-N 3.08Å
98A78.9Confident79.7Confident61 Ų61106.1 Ų106.150%0.50454%0.541SS..Hα-helixtrans-57.5-37.1174.900000112.4T96 A102T96-A98 PolarHBondContact O-N 2.86Å; A98-A102 WeakPolarHBondContact O-CB 3.42Å; A98-A102 PolarHBondContact O-N 3.39Å; A98-A102 VanDerWaalsContact O-N 3.11Å
99Q81.5Confident80.2Confident132 Ų132102.9 Ų102.962%0.61753%0.534SS*.Hα-helixtrans-66.7-35.5176.9-163.478.4-2200112T96 D97 N103T96-Q99 VanDerWaalsContact O-CB 3.31Å; T96-Q99 WeakPolarHBondContact O-CB 3.1Å; T96-Q99 PolarHBondContact O-N 3.48Å; D97-Q99 PolarHBondContact O-N 3.35Å; Q99-N103 PolarHBondContact O-N 2.72Å; Q99-N103 PolarHBondContact O-ND2 3.5Å
100I80.8Confident80.5Confident80 Ų80102.7 Ų102.741%0.4153%0.533SS..Hα-helixtrans-72-43.4179-63.5173.1000110.7T96 D97 A102 N103 R104T96-I100 PolarHBondContact O-N 2.73Å; D97-I100 PolarHBondContact O-N 3.12Å; I100-A102 VanDerWaalsContact C-N 3.34Å; I100-A102 PolarHBondContact O-N 3.23Å; I100-N103 PolarHBondContact O-N 3.37Å; I100-R104 PolarHBondContact O-N 3.47Å
101E80.9Confident81.1Confident110 Ų110103.5 Ų103.551%0.51454%0.536SS..Hα-helixtrans-67.7-34.9178.4-151.6-161.9139.300112.1D97 N103 R104 K105D97-E101 PolarHBondContact O-N 2.74Å; D97-E101 VanDerWaalsContact O-N 3.08Å; E101-N103 PolarHBondContact O-N 2.71Å; E101-R104 PolarHBondContact O-N 3.07Å; E101-K105 PolarHBondContact O-N 2.78Å; E101-K105 WeakPolarHBondContact OE1-CE 3.18Å; E101-K105 IonicContact OE1-NZ 2.62Å; E101-K105 PolarHBondContact OE1-NZ 3.06Å
102A81.5Confident81.7Confident51 Ų51103.1 Ų103.142%0.42153%0.533SS..Hα-helixtrans-59.8-43.4172.800000112.3A98 I100 K105 R106A98-A102 WeakPolarHBondContact O-CB 3.42Å; A98-A102 PolarHBondContact O-N 3.39Å; A98-A102 VanDerWaalsContact O-N 3.11Å; I100-A102 VanDerWaalsContact C-N 3.34Å; I100-A102 PolarHBondContact O-N 3.23Å; A102-K105 PolarHBondContact O-N 3.33Å; A102-R106 PolarHBondContact O-N 2.7Å
103N82.8Confident82.3Confident83 Ų83106.2 Ų106.244%0.44454%0.542SS..Hα-helixtrans-64.8-43177.8-77.1-37.3000112.6Q99 I100 E101 K105 R106 E107Q99-N103 PolarHBondContact O-N 2.72Å; Q99-N103 PolarHBondContact O-ND2 3.5Å; I100-N103 PolarHBondContact O-N 3.37Å; E101-N103 PolarHBondContact O-N 2.71Å; N103-K105 VanDerWaalsContact C-N 3.33Å; N103-K105 PolarHBondContact O-N 2.78Å; N103-R106 VanDerWaalsContact O-CB 3.29Å; N103-R106 WeakPolarHBondContact O-CB 3.41Å; N103-R106 PolarHBondContact O-N 3.47Å; N103-R106 VanDerWaalsContact O-N 3.16Å; N103-E107 PolarHBondContact O-N 2.79Å; N103-E107 VanDerWaalsContact O-N 3.08Å
104R84.9Confident83Confident175 Ų175109 Ų10966%0.6655%0.547SS*.Hα-helixtrans-60.6-38.3177.4-75.3-179.4173.5156.50.4113.2I100 E101 R106 S108I100-R104 PolarHBondContact O-N 3.47Å; E101-R104 PolarHBondContact O-N 3.07Å; R104-R106 VanDerWaalsContact C-N 3.35Å; R104-S108 PolarHBondContact O-N 3.38Å
105K83.6Confident83.5Confident108 Ų108112.5 Ų112.547%0.4755%0.548SS..Hα-helixtrans-61.2-46175.3-73.3166.9-175.9161.70110.8E101 A102 N103 E107 S108 E109E101-K105 PolarHBondContact O-N 2.78Å; E101-K105 WeakPolarHBondContact OE1-CE 3.18Å; E101-K105 IonicContact OE1-NZ 2.62Å; E101-K105 PolarHBondContact OE1-NZ 3.06Å; A102-K105 PolarHBondContact O-N 3.33Å; N103-K105 VanDerWaalsContact C-N 3.33Å; N103-K105 PolarHBondContact O-N 2.78Å; K105-E107 PolarHBondContact O-N 2.84Å; K105-S108 WeakPolarHBondContact O-CB 3.31Å; K105-S108 PolarHBondContact O-N 2.88Å; K105-S108 VanDerWaalsContact O-N 3.13Å; K105-S108 PolarHBondContact O-OG 2.93Å; K105-E109 WeakPolarHBondContact O-CG 3.29Å; K105-E109 PolarHBondContact O-N 2.81Å; K105-E109 VanDerWaalsContact O-N 3.09Å
106R83.9Confident84.1Confident167 Ų167112.3 Ų112.363%0.6355%0.547SS*.Hα-helixtrans-60-39.7179.4-146.9176.1-165.6171.24.2113.5A102 N103 R104 E109 L110A102-R106 PolarHBondContact O-N 2.7Å; N103-R106 VanDerWaalsContact O-CB 3.29Å; N103-R106 WeakPolarHBondContact O-CB 3.41Å; N103-R106 PolarHBondContact O-N 3.47Å; N103-R106 VanDerWaalsContact O-N 3.16Å; R104-R106 VanDerWaalsContact C-N 3.35Å; R106-E109 PolarHBondContact O-N 2.67Å; R106-L110 WeakPolarHBondContact O-CG 3.47Å; R106-L110 PolarHBondContact O-N 3.28Å
107E84.5Confident84.5Confident137 Ų137113.4 Ų113.464%0.6455%0.549SS*.Hα-helixtrans-65.2-41.4174-69.4-175.4142.600112N103 K105 E109 L110 Q111N103-E107 PolarHBondContact O-N 2.79Å; N103-E107 VanDerWaalsContact O-N 3.08Å; K105-E107 PolarHBondContact O-N 2.84Å; E107-E109 VanDerWaalsContact C-N 3.27Å; E107-E109 PolarHBondContact O-N 2.69Å; E107-L110 PolarHBondContact O-N 3.35Å; E107-Q111 PolarHBondContact O-N 3.3Å
108S85.3Confident84.8Confident46 Ų46113.8 Ų113.832%0.32255%0.547SS..Hα-helixtrans-64.6-32.4176.691.60000112.8R104 K105 K112R104-S108 PolarHBondContact O-N 3.38Å; K105-S108 WeakPolarHBondContact O-CB 3.31Å; K105-S108 PolarHBondContact O-N 2.88Å; K105-S108 VanDerWaalsContact O-N 3.13Å; K105-S108 PolarHBondContact O-OG 2.93Å; S108-K112 WeakPolarHBondContact O-CD 3.24Å; S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.32Å; S108-K112 PolarHBondContact O-N 2.77Å; S108-K112 PolarHBondContact OG-NZ 3.19Å
109E85.9Confident85.3Confident108 Ų108114.7 Ų114.751%0.50554%0.544SS..Hα-helixtrans-72.6-44.9176.8-72.2168.3176.300111.1K105 R106 E107 Q111 K112 L113K105-E109 WeakPolarHBondContact O-CG 3.29Å; K105-E109 PolarHBondContact O-N 2.81Å; K105-E109 VanDerWaalsContact O-N 3.09Å; R106-E109 PolarHBondContact O-N 2.67Å; E107-E109 VanDerWaalsContact C-N 3.27Å; E107-E109 PolarHBondContact O-N 2.69Å; E109-Q111 VanDerWaalsContact C-N 3.27Å; E109-Q111 PolarHBondContact O-N 2.92Å; E109-K112 PolarHBondContact O-N 2.93Å; E109-L113 WeakPolarHBondContact O-CB 2.96Å; E109-L113 VanDerWaalsContact O-CG 3.32Å; E109-L113 WeakPolarHBondContact O-CG 3.41Å; E109-L113 PolarHBondContact O-N 2.81Å
110L84Confident85.5Confident102 Ų102111.6 Ų111.653%0.53454%0.536SS..Hα-helixtrans-56.5-40.3172.9-78.1167.2000112.4R106 E107 L113 R114R106-L110 WeakPolarHBondContact O-CG 3.47Å; R106-L110 PolarHBondContact O-N 3.28Å; E107-L110 PolarHBondContact O-N 3.35Å; L110-L113 PolarHBondContact O-N 3.41Å; L110-R114 WeakPolarHBondContact O-CG 3.21Å; L110-R114 PolarHBondContact O-N 2.71Å; L110-R114 VanDerWaalsContact O-N 3.1Å
111Q87.2Confident85.8Confident153 Ų153113.1 Ų113.172%0.71554%0.542SS*.Hα-helixtrans-69.7-37.7179-160.8174.522.100112.4E107 E109 K115E107-Q111 PolarHBondContact O-N 3.3Å; E109-Q111 VanDerWaalsContact C-N 3.27Å; E109-Q111 PolarHBondContact O-N 2.92Å; Q111-K115 PolarHBondContact O-N 3.34Å
112K88.9Confident86.2Confident130 Ų130112.1 Ų112.157%0.56554%0.543SS*.Hα-helixtrans-64.6-45.1172.7-69.8160.3-171.7156.60111.6S108 E109 R114 K115 V116S108-K112 WeakPolarHBondContact O-CD 3.24Å; S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.32Å; S108-K112 PolarHBondContact O-N 2.77Å; S108-K112 PolarHBondContact OG-NZ 3.19Å; E109-K112 PolarHBondContact O-N 2.93Å; K112-R114 VanDerWaalsContact C-N 3.32Å; K112-R114 PolarHBondContact O-N 2.8Å; K112-K115 PolarHBondContact O-N 2.75Å; K112-V116 WeakPolarHBondContact O-CG2 3.44Å; K112-V116 PolarHBondContact O-N 3.38Å
113L85.7Confident86.6Confident115 Ų115116.3 Ų116.360%0.60255%0.554SS**Hα-helixtrans-61.4-37.6179.5-73.2168.5000112.5E109 L110 V116 L117E109-L113 WeakPolarHBondContact O-CB 2.96Å; E109-L113 VanDerWaalsContact O-CG 3.32Å; E109-L113 WeakPolarHBondContact O-CG 3.41Å; E109-L113 PolarHBondContact O-N 2.81Å; L110-L113 PolarHBondContact O-N 3.41Å; L113-V116 PolarHBondContact O-N 3.23Å; L113-L117 PolarHBondContact O-N 3.07Å
114R88.7Confident86.8Confident185 Ų185115 Ų11570%0.69855%0.551SS**Hα-helixtrans-61.6-45.4173.7-75.5-178.5-177.7-159.81.6112.4L110 K112 L117 E118L110-R114 WeakPolarHBondContact O-CG 3.21Å; L110-R114 PolarHBondContact O-N 2.71Å; L110-R114 VanDerWaalsContact O-N 3.1Å; K112-R114 VanDerWaalsContact C-N 3.32Å; K112-R114 PolarHBondContact O-N 2.8Å; R114-L117 WeakPolarHBondContact O-CB 3.43Å; R114-L117 PolarHBondContact O-N 2.83Å; R114-E118 PolarHBondContact O-N 3.35Å; R114-E118 VanDerWaalsContact O-N 3.07Å
115K89.7Confident86.9Confident124 Ų124112.9 Ų112.954%0.53955%0.549SS..Hα-helixtrans-63.6-43.5177.9-171.6-178174.3-170.70111.8Q111 K112 L117 E118 D119Q111-K115 PolarHBondContact O-N 3.34Å; K112-K115 PolarHBondContact O-N 2.75Å; K115-L117 PolarHBondContact O-N 2.76Å; K115-E118 PolarHBondContact O-N 2.75Å; K115-E118 VanDerWaalsContact O-N 3.11Å; K115-D119 VanDerWaalsContact CE-OD2 3.31Å; K115-D119 WeakPolarHBondContact CE-OD2 3.03Å; K115-D119 PolarHBondContact O-N 2.93Å
116V87.9Confident87.2Confident93 Ų93112.1 Ų112.156%0.56455%0.55SS*.Hα-helixtrans-60.1-32.6176.4173.50000111.8K112 L113 S120K112-V116 WeakPolarHBondContact O-CG2 3.44Å; K112-V116 PolarHBondContact O-N 3.38Å; L113-V116 PolarHBondContact O-N 3.23Å; V116-S120 WeakPolarHBondContact O-CB 3.19Å; V116-S120 PolarHBondContact O-N 2.74Å
117L86.7Confident87.4Confident107 Ų107107.3 Ų107.356%0.5654%0.542SS*.Hα-helixtrans-69.3-42.1173.8-174.966.7000112.5L113 R114 K115 Q121L113-L117 PolarHBondContact O-N 3.07Å; R114-L117 WeakPolarHBondContact O-CB 3.43Å; R114-L117 PolarHBondContact O-N 2.83Å; K115-L117 PolarHBondContact O-N 2.76Å; L117-Q121 WeakPolarHBondContact O-CG 3.09Å; L117-Q121 PolarHBondContact O-N 2.77Å
118E87.9Confident87.6Confident122 Ų122104.6 Ų104.657%0.5753%0.531SS*.Hα-helixtrans-64.7-48.7175.5-70172.3166.400111.4R114 K115 S120 Q121 V122R114-E118 PolarHBondContact O-N 3.35Å; R114-E118 VanDerWaalsContact O-N 3.07Å; K115-E118 PolarHBondContact O-N 2.75Å; K115-E118 VanDerWaalsContact O-N 3.11Å; E118-S120 VanDerWaalsContact C-N 3.31Å; E118-S120 PolarHBondContact O-N 3.37Å; E118-Q121 PolarHBondContact O-N 2.82Å; E118-V122 PolarHBondContact O-N 3.16Å; E118-V122 VanDerWaalsContact O-N 3.17Å
119D88.7Confident87.9Confident81 Ų81106 Ų10643%0.43354%0.535SS..Hα-helixtrans-57.5-44.3176.6-67.5-30.1000110.4K115 Q121 V122 E123K115-D119 VanDerWaalsContact CE-OD2 3.31Å; K115-D119 WeakPolarHBondContact CE-OD2 3.03Å; K115-D119 PolarHBondContact O-N 2.93Å; D119-Q121 PolarHBondContact O-N 2.87Å; D119-V122 PolarHBondContact O-N 3.4Å; D119-E123 PolarHBondContact O-N 3.43Å
120S86.7Confident88.1Confident66 Ų66106.3 Ų106.346%0.46254%0.536SS..Hα-helixtrans-67.7-31.1177.8-177.80000114V116 E118 S124V116-S120 WeakPolarHBondContact O-CB 3.19Å; V116-S120 PolarHBondContact O-N 2.74Å; E118-S120 VanDerWaalsContact C-N 3.31Å; E118-S120 PolarHBondContact O-N 3.37Å; S120-S124 PolarHBondContact O-N 2.84Å
121Q87.5Confident88.4Confident112 Ų112107 Ų10752%0.52354%0.54SS..Hα-helixtrans-66.8-43.8173.9-79.8176.9-10.500111.2L117 E118 D119 E123 S124 E125L117-Q121 WeakPolarHBondContact O-CG 3.09Å; L117-Q121 PolarHBondContact O-N 2.77Å; E118-Q121 PolarHBondContact O-N 2.82Å; D119-Q121 PolarHBondContact O-N 2.87Å; Q121-E123 PolarHBondContact O-N 2.82Å; Q121-S124 WeakPolarHBondContact O-CB 3.48Å; Q121-S124 PolarHBondContact O-N 2.78Å; Q121-S124 VanDerWaalsContact O-N 3.11Å; Q121-S124 PolarHBondContact O-OG 2.85Å; Q121-E125 PolarHBondContact O-N 3.39Å
122V89.2Confident88.6Confident89 Ų89107.5 Ų107.554%0.53954%0.535SS..Hα-helixtrans-61.5-45177.7176.40000111.4E118 D119 S124 E125 D126E118-V122 PolarHBondContact O-N 3.16Å; E118-V122 VanDerWaalsContact O-N 3.17Å; D119-V122 PolarHBondContact O-N 3.4Å; V122-S124 PolarHBondContact O-N 2.82Å; V122-E125 PolarHBondContact O-N 3.21Å; V122-D126 PolarHBondContact O-N 2.81Å
123E89.1Confident88.7Confident139 Ų139107.5 Ų107.565%0.6554%0.535SS*.Hα-helixtrans-57.8-34.7174.6-71-174.915700112.7D119 Q121 S127D119-E123 PolarHBondContact O-N 3.43Å; Q121-E123 PolarHBondContact O-N 2.82Å; E123-S127 VanDerWaalsContact O-CB 3.32Å; E123-S127 WeakPolarHBondContact O-CB 3.38Å; E123-S127 PolarHBondContact O-N 2.84Å; E123-S127 VanDerWaalsContact O-N 3.09Å; E123-S127 PolarHBondContact O-OG 2.87Å
124S86.1Confident88.9Confident56 Ų56108 Ų10839%0.39253%0.533SS..Hα-helixtrans-72-39.4177.583.20000112.8S120 Q121 V122 S127 I128S120-S124 PolarHBondContact O-N 2.84Å; Q121-S124 WeakPolarHBondContact O-CB 3.48Å; Q121-S124 PolarHBondContact O-N 2.78Å; Q121-S124 VanDerWaalsContact O-N 3.11Å; Q121-S124 PolarHBondContact O-OG 2.85Å; V122-S124 PolarHBondContact O-N 2.82Å; S124-S127 PolarHBondContact O-N 3.48Å; S124-I128 VanDerWaalsContact O-CG1 3.3Å; S124-I128 WeakPolarHBondContact O-CG1 3.06Å; S124-I128 PolarHBondContact O-N 3.45Å
125E88Confident89Confident130 Ų130105.1 Ų105.161%0.60753%0.527SS*.Hα-helixtrans-69-42.5177.5-67.5-160.2147.800111.7Q121 V122 S127 I128 N129Q121-E125 PolarHBondContact O-N 3.39Å; V122-E125 PolarHBondContact O-N 3.21Å; E125-S127 VanDerWaalsContact C-N 3.32Å; E125-S127 PolarHBondContact O-N 2.81Å; E125-I128 PolarHBondContact O-N 3.44Å; E125-N129 WeakPolarHBondContact O-CB 3.48Å; E125-N129 VanDerWaalsContact O-CG 3.3Å; E125-N129 PolarHBondContact O-N 2.72Å; E125-N129 PolarHBondContact O-ND2 2.89Å; E125-N129 VanDerWaalsContact O-ND2 3.16Å
126D89.7Confident89.1Confident93 Ų93105.3 Ų105.350%0.49753%0.529SS..Hα-helixtrans-62.4-39.8174.4-97.4-8.1000111.7V122 I128 N129 Q130V122-D126 PolarHBondContact O-N 2.81Å; D126-I128 PolarHBondContact O-N 3.16Å; D126-N129 PolarHBondContact O-N 2.94Å; D126-Q130 WeakPolarHBondContact O-CG 3.27Å; D126-Q130 PolarHBondContact O-N 2.68Å
127S88.9Confident89.2Confident65 Ų65105.7 Ų105.746%0.45553%0.525SS..Hα-helixtrans-61.4-43.3174.3-63.60000112.1E123 S124 E125 Q130 L131E123-S127 VanDerWaalsContact O-CB 3.32Å; E123-S127 WeakPolarHBondContact O-CB 3.38Å; E123-S127 PolarHBondContact O-N 2.84Å; E123-S127 VanDerWaalsContact O-N 3.09Å; E123-S127 PolarHBondContact O-OG 2.87Å; S124-S127 PolarHBondContact O-N 3.48Å; E125-S127 VanDerWaalsContact C-N 3.32Å; E125-S127 PolarHBondContact O-N 2.81Å; S127-Q130 PolarHBondContact O-N 3.17Å; S127-L131 WeakPolarHBondContact O-CG 3.05Å; S127-L131 PolarHBondContact O-N 3.12Å
128I88.7Confident89.4Confident81 Ų81102.6 Ų102.642%0.41552%0.515SS..Hα-helixtrans-64.2-42175.3-71.3165000111.1S124 E125 D126 L131 R132S124-I128 VanDerWaalsContact O-CG1 3.3Å; S124-I128 WeakPolarHBondContact O-CG1 3.06Å; S124-I128 PolarHBondContact O-N 3.45Å; E125-I128 PolarHBondContact O-N 3.44Å; D126-I128 PolarHBondContact O-N 3.16Å; I128-L131 PolarHBondContact O-N 2.81Å; I128-R132 HydrophobicContact CG2-CG 4.49Å; I128-R132 WeakPolarHBondContact O-CG 3.44Å; I128-R132 PolarHBondContact O-N 3.42Å
129N91Very high89.5Confident76 Ų76100.9 Ų100.941%0.40651%0.509SS..Hα-helixtrans-67.9-38179.3-71.7-34.1000112.3E125 D126 R132 K133E125-N129 WeakPolarHBondContact O-CB 3.48Å; E125-N129 VanDerWaalsContact O-CG 3.3Å; E125-N129 PolarHBondContact O-N 2.72Å; E125-N129 PolarHBondContact O-ND2 2.89Å; E125-N129 VanDerWaalsContact O-ND2 3.16Å; D126-N129 PolarHBondContact O-N 2.94Å; N129-R132 PolarHBondContact O-N 3.06Å; N129-K133 WeakPolarHBondContact O-CB 3.48Å; N129-K133 PolarHBondContact O-N 3.5Å
130Q90.4Very high89.6Confident113 Ų113100.8 Ų100.853%0.52851%0.508SS..Hα-helixtrans-62.8-42.1171.4-73.1-176.342.100112.4D126 S127 K133 K134D126-Q130 WeakPolarHBondContact O-CG 3.27Å; D126-Q130 PolarHBondContact O-N 2.68Å; S127-Q130 PolarHBondContact O-N 3.17Å; Q130-K133 PolarHBondContact O-N 2.73Å; Q130-K134 WeakPolarHBondContact O-CG 3.24Å; Q130-K134 PolarHBondContact O-N 3.32Å
131L89.3Confident89.7Confident118 Ų118101.4 Ų101.462%0.61851%0.506SS*.Hα-helixtrans-65.7-42.9176.6-74.1169.8000112.1S127 I128 K133 K134 H135S127-L131 WeakPolarHBondContact O-CG 3.05Å; S127-L131 PolarHBondContact O-N 3.12Å; I128-L131 PolarHBondContact O-N 2.81Å; L131-K133 PolarHBondContact O-N 2.91Å; L131-K134 PolarHBondContact O-N 3.32Å; L131-H135 WeakPolarHBondContact O-CB 3.31Å; L131-H135 PolarHBondContact O-N 2.82Å
132R91Very high89.9Confident162 Ų162102.9 Ų102.961%0.61151%0.508SS*.Hα-helixtrans-57.7-46.9173.5-76.2171.6173169.6-2.5111.7I128 N129 H135 Q136I128-R132 HydrophobicContact CG2-CG 4.49Å; I128-R132 WeakPolarHBondContact O-CG 3.44Å; I128-R132 PolarHBondContact O-N 3.42Å; N129-R132 PolarHBondContact O-N 3.06Å; R132-H135 PolarHBondContact O-N 3.31Å; R132-Q136 PolarHBondContact O-N 2.99Å
133K91.5Very high90Very high130 Ų130104.6 Ų104.657%0.56551%0.51SS*.Hα-helixtrans-60.4-49.6177.7-180173.4170.1177.80111.9N129 Q130 L131 H135 Q136 E137N129-K133 WeakPolarHBondContact O-CB 3.48Å; N129-K133 PolarHBondContact O-N 3.5Å; Q130-K133 PolarHBondContact O-N 2.73Å; L131-K133 PolarHBondContact O-N 2.91Å; K133-H135 VanDerWaalsContact C-N 3.29Å; K133-H135 PolarHBondContact O-N 3.16Å; K133-Q136 PolarHBondContact O-N 2.8Å; K133-Q136 VanDerWaalsContact O-N 3.14Å; K133-E137 WeakPolarHBondContact CE-OE1 3.32Å; K133-E137 HydrophobicContact CG-CG 4.46Å; K133-E137 IonicContact NZ-OE1 2.74Å; K133-E137 WeakPolarHBondContact O-CG 3.3Å; K133-E137 PolarHBondContact O-N 3.35Å
134K91Very high90Very high127 Ų127103 Ų10355%0.55250%0.502SS*.Hα-helixtrans-58.2-39.8176.5-74.1172.7179.5171.90112.5Q130 L131 A138Q130-K134 WeakPolarHBondContact O-CG 3.24Å; Q130-K134 PolarHBondContact O-N 3.32Å; L131-K134 PolarHBondContact O-N 3.32Å; K134-A138 WeakPolarHBondContact O-CB 3.23Å; K134-A138 PolarHBondContact O-N 2.86Å
135H89.8Confident90.3Very high124 Ų124104.2 Ų104.257%0.57450%0.502SS*.Hα-helixtrans-67.1-40.3176.8-171.267.4000112.1L131 R132 K133 A138 L139L131-H135 WeakPolarHBondContact O-CB 3.31Å; L131-H135 PolarHBondContact O-N 2.82Å; R132-H135 PolarHBondContact O-N 3.31Å; K133-H135 VanDerWaalsContact C-N 3.29Å; K133-H135 PolarHBondContact O-N 3.16Å; H135-A138 PolarHBondContact O-N 3.46Å; H135-L139 WeakPolarHBondContact O-CG 3.11Å; H135-L139 PolarHBondContact O-N 3.06Å
136Q92Very high90.3Very high127 Ų127102.5 Ų102.559%0.59350%0.496SS*.Hα-helixtrans-67.3-38.8176.1-168.9171.27.700112.3R132 K133 L139 I140R132-Q136 PolarHBondContact O-N 2.99Å; K133-Q136 PolarHBondContact O-N 2.8Å; K133-Q136 VanDerWaalsContact O-N 3.14Å; Q136-L139 PolarHBondContact O-N 3.3Å; Q136-I140 HydrophobicContact CG-CD1 4.44Å; Q136-I140 WeakPolarHBondContact O-CG1 3.46Å; Q136-I140 PolarHBondContact O-N 3.19Å; Q136-I140 VanDerWaalsContact O-N 3.1Å
137E91Very high90.3Very high101 Ų101102.8 Ų102.847%0.47249%0.494SS..Hα-helixtrans-62-44.1172.9-72.2168.3164.100111.4K133 I140 D141K133-E137 WeakPolarHBondContact CE-OE1 3.32Å; K133-E137 HydrophobicContact CG-CG 4.46Å; K133-E137 IonicContact NZ-OE1 2.74Å; K133-E137 WeakPolarHBondContact O-CG 3.3Å; K133-E137 PolarHBondContact O-N 3.35Å; E137-I140 PolarHBondContact O-N 3.35Å; E137-D141 PolarHBondContact O-N 3.39Å
138A90.4Very high90.3Very high42 Ų42104.7 Ų104.735%0.34750%0.496SS..Hα-helixtrans-65.2-37.8175.700000113.3K134 H135 I140 D141 Y142K134-A138 WeakPolarHBondContact O-CB 3.23Å; K134-A138 PolarHBondContact O-N 2.86Å; H135-A138 PolarHBondContact O-N 3.46Å; A138-I140 VanDerWaalsContact C-N 3.34Å; A138-D141 PolarHBondContact O-N 2.86Å; A138-Y142 WeakPolarHBondContact O-CD2 3.5Å; A138-Y142 PolarHBondContact O-N 3.12Å
139L89.6Confident90.3Very high87 Ų87106.1 Ų106.146%0.45550%0.504SS..Hα-helixtrans-63.5-38.9174.5-75.4170.2000112.1H135 Q136 Q143H135-L139 WeakPolarHBondContact O-CG 3.11Å; H135-L139 PolarHBondContact O-N 3.06Å; Q136-L139 PolarHBondContact O-N 3.3Å; L139-Q143 WeakPolarHBondContact O-CG 3.31Å; L139-Q143 PolarHBondContact O-N 3.36Å
140I91.3Very high90.3Very high79 Ų79108.5 Ų108.541%0.40551%0.513SS..Hα-helixtrans-66.8-42.2176-69.1164.8000110.8Q136 E137 A138 Q143 Q144Q136-I140 HydrophobicContact CG-CD1 4.44Å; Q136-I140 WeakPolarHBondContact O-CG1 3.46Å; Q136-I140 PolarHBondContact O-N 3.19Å; Q136-I140 VanDerWaalsContact O-N 3.1Å; E137-I140 PolarHBondContact O-N 3.35Å; A138-I140 VanDerWaalsContact C-N 3.34Å; I140-Q143 PolarHBondContact O-N 3.08Å; I140-Q144 WeakPolarHBondContact O-CG 3.1Å; I140-Q144 PolarHBondContact O-N 3.35Å
141D88.8Confident90.3Very high79 Ų79109 Ų10942%0.42251%0.513SS..Hα-helixtrans-62-47.4176-175.462.2000111.6E137 A138 Q143 Q144 Q145E137-D141 PolarHBondContact O-N 3.39Å; A138-D141 PolarHBondContact O-N 2.86Å; D141-Q143 VanDerWaalsContact C-N 3.31Å; D141-Q143 PolarHBondContact O-N 3.34Å; D141-Q144 PolarHBondContact O-N 3.15Å; D141-Q144 VanDerWaalsContact O-N 3.09Å; D141-Q145 WeakPolarHBondContact O-CG 3.29Å; D141-Q145 PolarHBondContact O-N 3.18Å; D141-Q145 PolarHBondContact OD2-NE2 3.04Å
142Y90.8Very high90.4Very high143 Ų143109.2 Ų109.256%0.56151%0.509SS*.Hα-helixtrans-61.4-35.8175.3-71-50.6000113.1A138 Q145 I146A138-Y142 WeakPolarHBondContact O-CD2 3.5Å; A138-Y142 PolarHBondContact O-N 3.12Å; Y142-Q145 PolarHBondContact O-N 2.74Å; Y142-I146 WeakPolarHBondContact O-CD1 3.28Å; Y142-I146 VanDerWaalsContact O-CG1 3.25Å; Y142-I146 WeakPolarHBondContact O-CG1 3.37Å; Y142-I146 PolarHBondContact O-N 3.25Å
143Q90.7Very high90.3Very high125 Ų125106 Ų10658%0.58450%0.504SS*.Hα-helixtrans-62.8-43.2172.1-77.3176-19.900112L139 I140 D141 I146 E147L139-Q143 WeakPolarHBondContact O-CG 3.31Å; L139-Q143 PolarHBondContact O-N 3.36Å; I140-Q143 PolarHBondContact O-N 3.08Å; D141-Q143 VanDerWaalsContact C-N 3.31Å; D141-Q143 PolarHBondContact O-N 3.34Å; Q143-I146 PolarHBondContact O-N 3.4Å; Q143-E147 PolarHBondContact O-N 3.08Å
144Q90.2Very high90.2Very high104 Ų104102.1 Ų102.149%0.48649%0.493SS..Hα-helixtrans-65.2-38.9175.3-68.9-178.134.800112.2I140 D141 E147 Q148I140-Q144 WeakPolarHBondContact O-CG 3.1Å; I140-Q144 PolarHBondContact O-N 3.35Å; D141-Q144 PolarHBondContact O-N 3.15Å; D141-Q144 VanDerWaalsContact O-N 3.09Å; Q144-E147 PolarHBondContact O-N 2.91Å; Q144-Q148 WeakPolarHBondContact O-CG 3.07Å; Q144-Q148 PolarHBondContact O-N 2.72Å
145Q91.2Very high90.2Very high83 Ų83101.8 Ų101.839%0.38849%0.492SS..Hα-helixtrans-62-43.4173.5-68.1-17536.100111.6D141 Y142 Q148 L149D141-Q145 WeakPolarHBondContact O-CG 3.29Å; D141-Q145 PolarHBondContact O-N 3.18Å; D141-Q145 PolarHBondContact OD2-NE2 3.04Å; Y142-Q145 PolarHBondContact O-N 2.74Å; Q145-Q148 PolarHBondContact O-N 3.13Å; Q145-L149 WeakPolarHBondContact O-CG 3.44Å; Q145-L149 PolarHBondContact O-N 3.35Å
146I88.7Confident90.1Very high93 Ų93100.5 Ų100.548%0.47749%0.488SS..Hα-helixtrans-61.2-46.8176-71.2163.7000111Y142 Q143 Q148 L149 Q150Y142-I146 WeakPolarHBondContact O-CD1 3.28Å; Y142-I146 VanDerWaalsContact O-CG1 3.25Å; Y142-I146 WeakPolarHBondContact O-CG1 3.37Å; Y142-I146 PolarHBondContact O-N 3.25Å; Q143-I146 PolarHBondContact O-N 3.4Å; I146-Q148 VanDerWaalsContact C-N 3.34Å; I146-Q148 PolarHBondContact O-N 2.83Å; I146-L149 PolarHBondContact O-N 3.21Å; I146-Q150 HydrophobicContact CG2-CG 4.46Å; I146-Q150 WeakPolarHBondContact O-CG 3.21Å; I146-Q150 PolarHBondContact O-N 3.14Å
147E89.2Confident89.8Confident100 Ų10096.8 Ų96.847%0.46747%0.473SS..Hα-helixtrans-59.4-42.5175.3-84.4-163.8-142.900112.7Q143 Q144 L149 Q150 K151Q143-E147 PolarHBondContact O-N 3.08Å; Q144-E147 PolarHBondContact O-N 2.91Å; E147-L149 VanDerWaalsContact C-N 3.34Å; E147-Q150 PolarHBondContact O-N 2.76Å; E147-K151 WeakPolarHBondContact O-CB 3.29Å; E147-K151 WeakPolarHBondContact O-CD 3.26Å; E147-K151 VanDerWaalsContact O-CG 3.23Å; E147-K151 WeakPolarHBondContact O-CG 3.2Å; E147-K151 PolarHBondContact O-N 3.22Å; E147-K151 IonicContact OE2-NZ 3.66Å; E147-K151 PolarHBondContact OE2-NZ 3.45Å
148Q90Very high89.8Confident104 Ų104100.3 Ų100.349%0.48648%0.482SS..Hα-helixtrans-64.3-39.2177.2-74.2-177.742.900111.9Q144 Q145 I146 K152Q144-Q148 WeakPolarHBondContact O-CG 3.07Å; Q144-Q148 PolarHBondContact O-N 2.72Å; Q145-Q148 PolarHBondContact O-N 3.13Å; I146-Q148 VanDerWaalsContact C-N 3.34Å; I146-Q148 PolarHBondContact O-N 2.83Å; Q148-K152 WeakPolarHBondContact O-CB 3.35Å; Q148-K152 VanDerWaalsContact O-CG 3.3Å; Q148-K152 WeakPolarHBondContact O-CG 3.41Å; Q148-K152 PolarHBondContact O-N 3.36Å
149L89.3Confident89.6Confident111 Ų111102.7 Ų102.758%0.58149%0.485SS*.Hα-helixtrans-67.7-42.8175.9-72.3170.5000111.8Q145 I146 E147 K151 K152 N153Q145-L149 WeakPolarHBondContact O-CG 3.44Å; Q145-L149 PolarHBondContact O-N 3.35Å; I146-L149 PolarHBondContact O-N 3.21Å; E147-L149 VanDerWaalsContact C-N 3.34Å; L149-K151 PolarHBondContact O-N 3.44Å; L149-K152 PolarHBondContact O-N 3.45Å; L149-N153 WeakPolarHBondContact O-CB 3.46Å; L149-N153 PolarHBondContact O-N 2.89Å
150Q90.4Very high89.7Confident127 Ų127104 Ų10459%0.59348%0.484SS*.Hα-helixtrans-59.7-46173.6-72.8175.9-4.700111.7I146 E147 N153 S154I146-Q150 HydrophobicContact CG2-CG 4.46Å; I146-Q150 WeakPolarHBondContact O-CG 3.21Å; I146-Q150 PolarHBondContact O-N 3.14Å; E147-Q150 PolarHBondContact O-N 2.76Å; Q150-N153 PolarHBondContact O-N 3.18Å; Q150-S154 WeakPolarHBondContact O-CB 3.12Å; Q150-S154 PolarHBondContact O-N 3.3Å
151K90.8Very high89.6Confident123 Ų123105.9 Ų105.954%0.53549%0.491SS..Hα-helixtrans-60.7-46.2176.5-72.1162.3-169.7165.10111.2E147 L149 S154 K155E147-K151 WeakPolarHBondContact O-CB 3.29Å; E147-K151 WeakPolarHBondContact O-CD 3.26Å; E147-K151 VanDerWaalsContact O-CG 3.23Å; E147-K151 WeakPolarHBondContact O-CG 3.2Å; E147-K151 PolarHBondContact O-N 3.22Å; E147-K151 IonicContact OE2-NZ 3.66Å; E147-K151 PolarHBondContact OE2-NZ 3.45Å; L149-K151 PolarHBondContact O-N 3.44Å; K151-S154 PolarHBondContact O-N 3.42Å; K151-S154 PolarHBondContact O-OG 3.03Å; K151-K155 PolarHBondContact O-N 3.36Å
152K89.6Confident89.7Confident123 Ų123109.6 Ų109.654%0.53550%0.5SS..Hα-helixtrans-59.8-47.4174.2-76.4171-179.6172.30112.3Q148 L149 S154 K155 I156Q148-K152 WeakPolarHBondContact O-CB 3.35Å; Q148-K152 VanDerWaalsContact O-CG 3.3Å; Q148-K152 WeakPolarHBondContact O-CG 3.41Å; Q148-K152 PolarHBondContact O-N 3.36Å; L149-K152 PolarHBondContact O-N 3.45Å; K152-S154 VanDerWaalsContact C-N 3.35Å; K152-S154 PolarHBondContact O-N 3.31Å; K152-K155 WeakPolarHBondContact O-CB 3.45Å; K152-K155 PolarHBondContact O-N 3.41Å; K152-K155 VanDerWaalsContact O-N 3.11Å; K152-I156 WeakPolarHBondContact O-CG1 3.25Å; K152-I156 PolarHBondContact O-N 2.91Å
153N90.8Very high89.5Confident93 Ų93107.4 Ų107.450%0.49750%0.497SS..Hα-helixtrans-61.4-43.8-179.9-16256.5000111.3L149 Q150 K155 I156 D157L149-N153 WeakPolarHBondContact O-CB 3.46Å; L149-N153 PolarHBondContact O-N 2.89Å; Q150-N153 PolarHBondContact O-N 3.18Å; N153-K155 PolarHBondContact O-N 3.37Å; N153-I156 PolarHBondContact O-N 3.17Å; N153-I156 VanDerWaalsContact O-N 3.07Å; N153-D157 PolarHBondContact ND2-OD2 2.78Å; N153-D157 PolarHBondContact O-N 3.03Å
154S88.5Confident89.4Confident50 Ų50106.5 Ų106.535%0.3549%0.493SS..Hα-helixtrans-62.2-23.8176.578.60000114.4Q150 K151 K152 R158Q150-S154 WeakPolarHBondContact O-CB 3.12Å; Q150-S154 PolarHBondContact O-N 3.3Å; K151-S154 PolarHBondContact O-N 3.42Å; K151-S154 PolarHBondContact O-OG 3.03Å; K152-S154 VanDerWaalsContact C-N 3.35Å; K152-S154 PolarHBondContact O-N 3.31Å; S154-R158 WeakPolarHBondContact O-CD 3.23Å; S154-R158 VanDerWaalsContact O-CG 3.28Å; S154-R158 WeakPolarHBondContact O-CG 3.39Å
155K90.4Very high89.4Confident119 Ų119107.2 Ų107.252%0.51750%0.496SS..Hα-helixtrans-78.1-45.1171.7-176176.1179.3-70.40111K151 K152 N153 D157 R158 E159K151-K155 PolarHBondContact O-N 3.36Å; K152-K155 WeakPolarHBondContact O-CB 3.45Å; K152-K155 PolarHBondContact O-N 3.41Å; K152-K155 VanDerWaalsContact O-N 3.11Å; N153-K155 PolarHBondContact O-N 3.37Å; K155-D157 PolarHBondContact O-N 3.15Å; K155-R158 PolarHBondContact O-N 3.33Å; K155-E159 WeakPolarHBondContact CE-OE1 3.27Å; K155-E159 VanDerWaalsContact NZ-CD 3.26Å; K155-E159 IonicContact NZ-OE1 3.16Å; K155-E159 PolarHBondContact NZ-OE1 3.42Å; K155-E159 IonicContact NZ-OE2 2.69Å; K155-E159 PolarHBondContact NZ-OE2 3.32Å; K155-E159 VanDerWaalsContact NZ-OE2 3.17Å; K155-E159 WeakPolarHBondContact O-CG 3.31Å; K155-E159 PolarHBondContact O-N 2.91Å
156I89.1Confident89.2Confident97 Ų97106.5 Ų106.550%0.49749%0.493SS..Hα-helixtrans-62.4-41.2178.4-65.9166000111.3K152 N153 R158 E159 R160K152-I156 WeakPolarHBondContact O-CG1 3.25Å; K152-I156 PolarHBondContact O-N 2.91Å; N153-I156 PolarHBondContact O-N 3.17Å; N153-I156 VanDerWaalsContact O-N 3.07Å; I156-R158 VanDerWaalsContact C-N 3.33Å; I156-R158 PolarHBondContact O-N 2.8Å; I156-E159 PolarHBondContact O-N 3.06Å; I156-R160 WeakPolarHBondContact O-CB 3.31Å; I156-R160 PolarHBondContact O-N 3.01Å
157D85.1Confident89.2Confident50 Ų50106.3 Ų106.327%0.26750%0.495SS..Hα-helixtrans-60.2-40.8175.4-82.7-51000112.4N153 K155 R160 Q161N153-D157 PolarHBondContact ND2-OD2 2.78Å; N153-D157 PolarHBondContact O-N 3.03Å; K155-D157 PolarHBondContact O-N 3.15Å; D157-R160 IonicContact OD1-CZ 3.15Å; D157-R160 IonicContact OD1-NH1 2.71Å; D157-R160 PolarHBondContact OD1-NH1 2.73Å; D157-R160 IonicContact OD1-NH2 2.74Å; D157-R160 PolarHBondContact OD1-NH2 3.33Å; D157-Q161 WeakPolarHBondContact O-CG 3.32Å; D157-Q161 PolarHBondContact O-N 3.36Å
158R90.4Very high89.2Confident175 Ų175106.7 Ų106.766%0.6650%0.5SS*.Hα-helixtrans-69.2-41.3176.4-68.4170.2-170.7178.73.9112.1S154 K155 I156 Q161 R162S154-R158 WeakPolarHBondContact O-CD 3.23Å; S154-R158 VanDerWaalsContact O-CG 3.28Å; S154-R158 WeakPolarHBondContact O-CG 3.39Å; K155-R158 PolarHBondContact O-N 3.33Å; I156-R158 VanDerWaalsContact C-N 3.33Å; I156-R158 PolarHBondContact O-N 2.8Å; R158-Q161 PolarHBondContact O-N 3.46Å; R158-R162 PolarHBondContact O-N 3.26Å
159E86.9Confident89.1Confident91 Ų91107.6 Ų107.643%0.42550%0.504SS..Hα-helixtrans-65.6-40.4176.8-74172.8163.300111.1K155 I156 R162 L163K155-E159 WeakPolarHBondContact CE-OE1 3.27Å; K155-E159 VanDerWaalsContact NZ-CD 3.26Å; K155-E159 IonicContact NZ-OE1 3.16Å; K155-E159 PolarHBondContact NZ-OE1 3.42Å; K155-E159 IonicContact NZ-OE2 2.69Å; K155-E159 PolarHBondContact NZ-OE2 3.32Å; K155-E159 VanDerWaalsContact NZ-OE2 3.17Å; K155-E159 WeakPolarHBondContact O-CG 3.31Å; K155-E159 PolarHBondContact O-N 2.91Å; I156-E159 PolarHBondContact O-N 3.06Å; E159-R162 PolarHBondContact O-N 3.28Å; E159-L163 WeakPolarHBondContact O-CG 3.28Å; E159-L163 PolarHBondContact O-N 3.04Å
160R91Very high89.1Confident114 Ų114107.8 Ų107.843%0.4351%0.505SS..Hα-helixtrans-60.7-46171.2-171.7-173.567.1-116.5-11111.7I156 D157 R162 L163 Q164I156-R160 WeakPolarHBondContact O-CB 3.31Å; I156-R160 PolarHBondContact O-N 3.01Å; D157-R160 IonicContact OD1-CZ 3.15Å; D157-R160 IonicContact OD1-NH1 2.71Å; D157-R160 PolarHBondContact OD1-NH1 2.73Å; D157-R160 IonicContact OD1-NH2 2.74Å; D157-R160 PolarHBondContact OD1-NH2 3.33Å; R160-R162 PolarHBondContact O-N 2.77Å; R160-L163 PolarHBondContact O-N 3.34Å; R160-Q164 HydrophobicContact CG-CG 4.45Å; R160-Q164 WeakPolarHBondContact O-CB 3.22Å; R160-Q164 VanDerWaalsContact O-CG 3.27Å; R160-Q164 WeakPolarHBondContact O-CG 3.29Å; R160-Q164 PolarHBondContact O-N 3.11Å
161Q89.4Confident89.1Confident119 Ų119105.1 Ų105.156%0.55650%0.497SS*.Hα-helixtrans-61.9-40.9177.6-78.1175.5-18.400112.3D157 R158 Q164 H165D157-Q161 WeakPolarHBondContact O-CG 3.32Å; D157-Q161 PolarHBondContact O-N 3.36Å; R158-Q161 PolarHBondContact O-N 3.46Å; Q161-Q164 PolarHBondContact O-N 2.97Å; Q161-H165 PolarHBondContact O-N 3.23Å; Q161-H165 VanDerWaalsContact O-N 3.12Å
162R90.2Very high88.9Confident158 Ų158102.1 Ų102.160%0.59650%0.495SS*.Hα-helixtrans-62.2-50.4175.8-159-159.591.3176.18.3111.2R158 E159 R160 Q164 H165 E166R158-R162 PolarHBondContact O-N 3.26Å; E159-R162 PolarHBondContact O-N 3.28Å; R160-R162 PolarHBondContact O-N 2.77Å; R162-Q164 VanDerWaalsContact C-N 3.28Å; R162-Q164 PolarHBondContact O-N 2.96Å; R162-H165 WeakPolarHBondContact O-CB 3.3Å; R162-H165 PolarHBondContact O-N 3.41Å; R162-E166 IonicContact CZ-OE2 3.5Å; R162-E166 VanDerWaalsContact CZ-OE2 3.24Å; R162-E166 IonicContact NE-OE2 3.43Å; R162-E166 PolarHBondContact NE-OE2 2.95Å; R162-E166 IonicContact NH2-OE1 3.83Å; R162-E166 PolarHBondContact NH2-OE1 2.78Å; R162-E166 IonicContact NH2-OE2 2.71Å; R162-E166 PolarHBondContact NH2-OE2 3.44Å; R162-E166 WeakPolarHBondContact O-CB 3.2Å; R162-E166 PolarHBondContact O-N 3.12Å
163L87.1Confident88.9Confident96 Ų9697.8 Ų97.850%0.50349%0.485SS..Hα-helixtrans-62.5-34178.8-69.1170.5000112.3E159 R160 H165 V167E159-L163 WeakPolarHBondContact O-CG 3.28Å; E159-L163 PolarHBondContact O-N 3.04Å; R160-L163 PolarHBondContact O-N 3.34Å; L163-H165 VanDerWaalsContact C-N 3.35Å; L163-V167 WeakPolarHBondContact O-CB 3.42Å; L163-V167 VanDerWaalsContact O-CG2 3.26Å; L163-V167 WeakPolarHBondContact O-CG2 3.46Å; L163-V167 PolarHBondContact O-N 3.24Å
164Q89.5Confident88.8Confident107 Ų10797.7 Ų97.750%0.548%0.484SS..Hα-helixtrans-65.5-35.5173.1-77.4177.1-46.100112.6R160 Q161 R162 I168R160-Q164 HydrophobicContact CG-CG 4.45Å; R160-Q164 WeakPolarHBondContact O-CB 3.22Å; R160-Q164 VanDerWaalsContact O-CG 3.27Å; R160-Q164 WeakPolarHBondContact O-CG 3.29Å; R160-Q164 PolarHBondContact O-N 3.11Å; Q161-Q164 PolarHBondContact O-N 2.97Å; R162-Q164 VanDerWaalsContact C-N 3.28Å; R162-Q164 PolarHBondContact O-N 2.96Å; Q164-I168 WeakPolarHBondContact O-CD1 3.4Å; Q164-I168 VanDerWaalsContact O-CG1 3.28Å; Q164-I168 WeakPolarHBondContact O-CG1 3.46Å; Q164-I168 PolarHBondContact O-N 3.34Å
165H88.9Confident88.8Confident118 Ų11899.2 Ų99.255%0.54649%0.488SS..Hα-helixtrans-71.9-46.2174.5-143.659.6000111.4Q161 R162 L163 V167 I168 E169Q161-H165 PolarHBondContact O-N 3.23Å; Q161-H165 VanDerWaalsContact O-N 3.12Å; R162-H165 WeakPolarHBondContact O-CB 3.3Å; R162-H165 PolarHBondContact O-N 3.41Å; L163-H165 VanDerWaalsContact C-N 3.35Å; H165-V167 VanDerWaalsContact C-N 3.29Å; H165-V167 PolarHBondContact O-N 2.8Å; H165-I168 WeakPolarHBondContact O-CA 3.4Å; H165-I168 WeakPolarHBondContact O-CB 3.27Å; H165-I168 PolarHBondContact O-N 3.01Å; H165-E169 IonicContact CD2-OE1 2.72Å; H165-E169 PolarHBondContact O-N 3.41Å
166E88.3Confident88.6Confident69 Ų6997.6 Ų97.632%0.32248%0.482SS..Hα-helixtrans-57.4-39.8178.2-162167.5161.100111.5R162 L170R162-E166 IonicContact CZ-OE2 3.5Å; R162-E166 VanDerWaalsContact CZ-OE2 3.24Å; R162-E166 IonicContact NE-OE2 3.43Å; R162-E166 PolarHBondContact NE-OE2 2.95Å; R162-E166 IonicContact NH2-OE1 3.83Å; R162-E166 PolarHBondContact NH2-OE1 2.78Å; R162-E166 IonicContact NH2-OE2 2.71Å; R162-E166 PolarHBondContact NH2-OE2 3.44Å; R162-E166 WeakPolarHBondContact O-CB 3.2Å; R162-E166 PolarHBondContact O-N 3.12Å; E166-L170 WeakPolarHBondContact O-CB 3.34Å; E166-L170 WeakPolarHBondContact O-CD1 3.33Å; E166-L170 VanDerWaalsContact O-CG 3.22Å; E166-L170 WeakPolarHBondContact O-CG 3.29Å; E166-L170 PolarHBondContact O-N 2.85Å
167V88.4Confident88.5Confident89 Ų8998.7 Ų98.754%0.53949%0.489SS..Hα-helixtrans-65.4-39172.1167.20000112.6L163 H165 T171L163-V167 WeakPolarHBondContact O-CB 3.42Å; L163-V167 VanDerWaalsContact O-CG2 3.26Å; L163-V167 WeakPolarHBondContact O-CG2 3.46Å; L163-V167 PolarHBondContact O-N 3.24Å; H165-V167 VanDerWaalsContact C-N 3.29Å; H165-V167 PolarHBondContact O-N 2.8Å; V167-T171 WeakPolarHBondContact O-CB 3.48Å; V167-T171 PolarHBondContact O-N 3.1Å; V167-T171 PolarHBondContact O-OG1 3.41Å
168I89.5Confident88.7Confident108 Ų108102 Ų10255%0.55450%0.503SS*.Hα-helixtrans-68.6-44.1179-69.6164.4000110.6Q164 H165 T171 A172Q164-I168 WeakPolarHBondContact O-CD1 3.4Å; Q164-I168 VanDerWaalsContact O-CG1 3.28Å; Q164-I168 WeakPolarHBondContact O-CG1 3.46Å; Q164-I168 PolarHBondContact O-N 3.34Å; H165-I168 WeakPolarHBondContact O-CA 3.4Å; H165-I168 WeakPolarHBondContact O-CB 3.27Å; H165-I168 PolarHBondContact O-N 3.01Å; I168-T171 PolarHBondContact O-N 2.9Å; I168-A172 PolarHBondContact O-N 3.21Å
169E88.2Confident88.6Confident123 Ų12399.5 Ų99.558%0.57550%0.497SS*.Hα-helixtrans-61.8-47.2176.7-69.4177.5156.800111.6H165 T171 A172 G173H165-E169 IonicContact CD2-OE1 2.72Å; H165-E169 PolarHBondContact O-N 3.41Å; E169-T171 PolarHBondContact O-N 3.46Å; E169-A172 PolarHBondContact O-N 2.98Å; E169-G173 PolarHBondContact O-N 2.85Å
170L88.1Confident88.7Confident115 Ų11599 Ų9960%0.60250%0.497SS*.Hα-helixtrans-63-38.6175.3-71.2169.8000112.5E166 G173 I174E166-L170 WeakPolarHBondContact O-CB 3.34Å; E166-L170 WeakPolarHBondContact O-CD1 3.33Å; E166-L170 VanDerWaalsContact O-CG 3.22Å; E166-L170 WeakPolarHBondContact O-CG 3.29Å; E166-L170 PolarHBondContact O-N 2.85Å; L170-G173 PolarHBondContact O-N 3.45Å; L170-I174 WeakPolarHBondContact O-CG1 3.45Å; L170-I174 PolarHBondContact O-N 2.95Å
171T90.3Very high88.6Confident70 Ų7099.4 Ų99.443%0.42950%0.502SS..Hα-helixtrans-63.8-45.9175.7-54.10000111.1V167 I168 E169 G173 I174 D175V167-T171 WeakPolarHBondContact O-CB 3.48Å; V167-T171 PolarHBondContact O-N 3.1Å; V167-T171 PolarHBondContact O-OG1 3.41Å; I168-T171 PolarHBondContact O-N 2.9Å; E169-T171 PolarHBondContact O-N 3.46Å; T171-G173 VanDerWaalsContact C-N 3.31Å; T171-G173 PolarHBondContact O-N 3.27Å; T171-I174 PolarHBondContact O-N 3.17Å; T171-D175 PolarHBondContact O-N 2.9Å
172A88.3Confident88.5Confident60 Ų6098.2 Ų98.250%0.49650%0.496SS..Hα-helixtrans-63.2-36176.600000112.6I168 E169 D175 Q176I168-A172 PolarHBondContact O-N 3.21Å; E169-A172 PolarHBondContact O-N 2.98Å; A172-D175 PolarHBondContact O-N 2.87Å; A172-Q176 PolarHBondContact O-N 3.21Å
173G89.1Confident88.4Confident32 Ų3293.6 Ų93.633%0.3349%0.492SS..Hα-helixtrans-63.5-42.6172.600000112.9E169 L170 T171 Q176 L177E169-G173 PolarHBondContact O-N 2.85Å; L170-G173 PolarHBondContact O-N 3.45Å; T171-G173 VanDerWaalsContact C-N 3.31Å; T171-G173 PolarHBondContact O-N 3.27Å; G173-Q176 PolarHBondContact O-N 3.36Å; G173-L177 WeakPolarHBondContact O-CB 3.38Å; G173-L177 WeakPolarHBondContact O-CG 3.24Å; G173-L177 PolarHBondContact O-N 2.85Å
174I88.5Confident88.4Confident92 Ų9291.8 Ų91.847%0.47249%0.491SS..Hα-helixtrans-63.2-46.2174.9-70.6163.7000110.9L170 T171 Q176 L177 Q178L170-I174 WeakPolarHBondContact O-CG1 3.45Å; L170-I174 PolarHBondContact O-N 2.95Å; T171-I174 PolarHBondContact O-N 3.17Å; I174-Q176 PolarHBondContact O-N 3.47Å; I174-L177 PolarHBondContact O-N 3.01Å; I174-Q178 HydrophobicContact CG2-CG 4.49Å; I174-Q178 WeakPolarHBondContact O-CG 3.44Å; I174-Q178 PolarHBondContact O-N 3.15Å
175D87.5Confident88.2Confident82 Ų8290.7 Ų90.744%0.43949%0.486SS..Hα-helixtrans-61.9-31177.7-78.5-7.7000112.7T171 A172 K179T171-D175 PolarHBondContact O-N 2.9Å; A172-D175 PolarHBondContact O-N 2.87Å; D175-K179 WeakPolarHBondContact O-CD 3.41Å; D175-K179 VanDerWaalsContact O-CE 3.26Å; D175-K179 WeakPolarHBondContact O-CE 3.29Å; D175-K179 WeakPolarHBondContact O-CG 3.45Å
176Q87.5Confident88.1Confident84 Ų8490.6 Ų90.639%0.39348%0.484SS..Hα-helixtrans-75.3-48.7174.3-174.852.73800111.5A172 G173 I174 Q178 K179 D180A172-Q176 PolarHBondContact O-N 3.21Å; G173-Q176 PolarHBondContact O-N 3.36Å; I174-Q176 PolarHBondContact O-N 3.47Å; Q176-Q178 PolarHBondContact O-N 3.19Å; Q176-K179 WeakPolarHBondContact O-CB 3.4Å; Q176-K179 PolarHBondContact O-N 3.03Å; Q176-D180 PolarHBondContact NE2-OD1 3.41Å; Q176-D180 PolarHBondContact NE2-OD2 3.41Å; Q176-D180 PolarHBondContact O-N 3.4Å
177L87.4Confident88Confident121 Ų12189.4 Ų89.463%0.63449%0.486SS*.Hα-helixtrans-58.1-33.2176.3-73170000112.7G173 I174 K181G173-L177 WeakPolarHBondContact O-CB 3.38Å; G173-L177 WeakPolarHBondContact O-CG 3.24Å; G173-L177 PolarHBondContact O-N 2.85Å; I174-L177 PolarHBondContact O-N 3.01Å; L177-K181 WeakPolarHBondContact O-CB 3.39Å; L177-K181 PolarHBondContact O-N 2.85Å
178Q88.2Confident87.8Confident120 Ų12087.7 Ų87.756%0.56148%0.481SS*.Hα-helixtrans-66.4-38173.6-74.6-176.432.600113I174 Q176 H182I174-Q178 HydrophobicContact CG2-CG 4.49Å; I174-Q178 WeakPolarHBondContact O-CG 3.44Å; I174-Q178 PolarHBondContact O-N 3.15Å; Q176-Q178 PolarHBondContact O-N 3.19Å; Q178-H182 WeakPolarHBondContact O-CB 3.25Å; Q178-H182 PolarHBondContact O-N 3.5Å
179K88.8Confident87.7Confident122 Ų12288.7 Ų88.753%0.5348%0.483SS..Hα-helixtrans-68-45.9175.7-65.1161.1-162.61550111D175 Q176 H182 A183D175-K179 WeakPolarHBondContact O-CD 3.41Å; D175-K179 VanDerWaalsContact O-CE 3.26Å; D175-K179 WeakPolarHBondContact O-CE 3.29Å; D175-K179 WeakPolarHBondContact O-CG 3.45Å; Q176-K179 WeakPolarHBondContact O-CB 3.4Å; Q176-K179 PolarHBondContact O-N 3.03Å; K179-H182 PolarHBondContact O-N 3.25Å; K179-A183 PolarHBondContact O-N 3.29Å
180D88.1Confident87.6Confident81 Ų8190.5 Ų90.543%0.43349%0.489SS..Hα-helixtrans-66.9-39.4-178.6-62.8-31.2000111Q176 A183 A184Q176-D180 PolarHBondContact NE2-OD1 3.41Å; Q176-D180 PolarHBondContact NE2-OD2 3.41Å; Q176-D180 PolarHBondContact O-N 3.4Å; D180-A183 PolarHBondContact O-N 2.87Å; D180-A184 PolarHBondContact O-N 2.87Å
181K89.8Confident87.4Confident121 Ų12191.5 Ų91.553%0.52649%0.49SS..Hα-helixtrans-56.5-50.8168.5-176.1-164.6162.8-159.80111.4L177 A183 A184 E185L177-K181 WeakPolarHBondContact O-CB 3.39Å; L177-K181 PolarHBondContact O-N 2.85Å; K181-A183 VanDerWaalsContact C-N 3.28Å; K181-A183 PolarHBondContact O-N 2.92Å; K181-A184 WeakPolarHBondContact O-CB 3.31Å; K181-A184 PolarHBondContact O-N 3.42Å; K181-A184 VanDerWaalsContact O-N 3.1Å; K181-E185 WeakPolarHBondContact CE-OE1 3.35Å; K181-E185 IonicContact NZ-OE1 2.89Å; K181-E185 PolarHBondContact NZ-OE1 3.47Å; K181-E185 IonicContact NZ-OE2 2.78Å; K181-E185 PolarHBondContact O-N 2.88Å
182H87.6Confident87.2Confident94 Ų9493 Ų9344%0.43549%0.492SS..Hα-helixtrans-65.9-30.4-177.5-174.255.4000113.1Q178 K179 E185 K186Q178-H182 WeakPolarHBondContact O-CB 3.25Å; Q178-H182 PolarHBondContact O-N 3.5Å; K179-H182 PolarHBondContact O-N 3.25Å; H182-E185 IonicContact ND1-OE2 2.58Å; H182-K186 WeakPolarHBondContact NE2-CE 3.38Å; H182-K186 PolarHBondContact NE2-NZ 3.25Å; H182-K186 PolarHBondContact O-N 2.97Å
183A87.5Confident87.1Confident61 Ų6192.2 Ų92.250%0.50449%0.486SS..Hα-helixtrans-68.1-41.5170.500000111.9K179 D180 K181 K186 A187K179-A183 PolarHBondContact O-N 3.29Å; D180-A183 PolarHBondContact O-N 2.87Å; K181-A183 VanDerWaalsContact C-N 3.28Å; K181-A183 PolarHBondContact O-N 2.92Å; A183-K186 PolarHBondContact O-N 3.34Å; A183-A187 PolarHBondContact O-N 2.88Å
184A86.2Confident86.8Confident59 Ų5992.7 Ų92.749%0.48849%0.487SS..Hα-helixtrans-66.3-40.5176.200000112.8D180 K181 A187 A188D180-A184 PolarHBondContact O-N 2.87Å; K181-A184 WeakPolarHBondContact O-CB 3.31Å; K181-A184 PolarHBondContact O-N 3.42Å; K181-A184 VanDerWaalsContact O-N 3.1Å; A184-A187 PolarHBondContact O-N 2.86Å; A184-A188 PolarHBondContact O-N 3.32Å
185E86.2Confident86.6Confident83 Ų8391 Ų9139%0.38849%0.487SS..Hα-helixtrans-58.3-48.8174.2-74.2173145.700111K181 H182 A187 A188 E189K181-E185 WeakPolarHBondContact CE-OE1 3.35Å; K181-E185 IonicContact NZ-OE1 2.89Å; K181-E185 PolarHBondContact NZ-OE1 3.47Å; K181-E185 IonicContact NZ-OE2 2.78Å; K181-E185 PolarHBondContact O-N 2.88Å; H182-E185 IonicContact ND1-OE2 2.58Å; E185-A187 VanDerWaalsContact C-N 3.31Å; E185-A187 PolarHBondContact O-N 2.95Å; E185-A188 WeakPolarHBondContact O-CB 3.26Å; E185-A188 PolarHBondContact O-N 3.08Å; E185-A188 VanDerWaalsContact O-N 3.17Å; E185-E189 WeakPolarHBondContact O-CG 3.36Å; E185-E189 PolarHBondContact O-N 2.87Å
186K87.3Confident86.5Confident117 Ų11794.2 Ų94.251%0.50949%0.493SS..Hα-helixtrans-63.4-32.6175.8-78176.2170.8164.30113.9H182 A183 K190H182-K186 WeakPolarHBondContact NE2-CE 3.38Å; H182-K186 PolarHBondContact NE2-NZ 3.25Å; H182-K186 PolarHBondContact O-N 2.97Å; A183-K186 PolarHBondContact O-N 3.34Å; K186-K190 WeakPolarHBondContact O-CB 3.4Å; K186-K190 PolarHBondContact O-N 3.44Å
187A86.6Confident86.4Confident44 Ų4497 Ų9736%0.36451%0.506SS..Hα-helixtrans-67.9-44.2173.400000111A183 A184 E185 K190 H191A183-A187 PolarHBondContact O-N 2.88Å; A184-A187 PolarHBondContact O-N 2.86Å; E185-A187 VanDerWaalsContact C-N 3.31Å; E185-A187 PolarHBondContact O-N 2.95Å; A187-K190 PolarHBondContact O-N 3.37Å; A187-H191 PolarHBondContact O-CD2 3.28Å; A187-H191 PolarHBondContact O-N 2.92Å
188A83.9Confident86.2Confident53 Ų5396.8 Ų96.844%0.43851%0.505SS..Hα-helixtrans-61-48.4177.100000112A184 E185 K190 H191 E192A184-A188 PolarHBondContact O-N 3.32Å; E185-A188 WeakPolarHBondContact O-CB 3.26Å; E185-A188 PolarHBondContact O-N 3.08Å; E185-A188 VanDerWaalsContact O-N 3.17Å; A188-K190 VanDerWaalsContact C-N 3.28Å; A188-K190 PolarHBondContact O-N 3Å; A188-H191 PolarHBondContact O-N 3.34Å; A188-H191 VanDerWaalsContact O-N 3.09Å; A188-E192 PolarHBondContact O-N 3.37Å
189E86.6Confident86.1Confident129 Ų12996 Ų9660%0.60350%0.501SS*.Hα-helixtrans-53.6-44.2175.1-72.1176.3161.900112.2E185 E192 A193E185-E189 WeakPolarHBondContact O-CG 3.36Å; E185-E189 PolarHBondContact O-N 2.87Å; E189-E192 PolarHBondContact O-N 3.4Å; E189-A193 PolarHBondContact O-N 3.22Å
190K85.4Confident86.1Confident161 Ų16194.9 Ų94.970%0.750%0.501SS*.Hα-helixtrans-66-39.4177.7-173.7-178.3178.4-175.20112.5K186 A187 A188 A193 A194K186-K190 WeakPolarHBondContact O-CB 3.4Å; K186-K190 PolarHBondContact O-N 3.44Å; A187-K190 PolarHBondContact O-N 3.37Å; A188-K190 VanDerWaalsContact C-N 3.28Å; A188-K190 PolarHBondContact O-N 3Å; K190-A193 PolarHBondContact O-N 3.13Å; K190-A194 PolarHBondContact O-N 3.36Å; K190-A194 VanDerWaalsContact O-N 3.11Å
191H84.6Confident86Confident135 Ų13599.9 Ų99.963%0.62551%0.514SS*.Hα-helixtrans-71.2-36.6177.1-74.4-61.5000112.4A187 A188 A194 A195A187-H191 PolarHBondContact O-CD2 3.28Å; A187-H191 PolarHBondContact O-N 2.92Å; A188-H191 PolarHBondContact O-N 3.34Å; A188-H191 VanDerWaalsContact O-N 3.09Å; H191-A194 PolarHBondContact O-N 3.36Å; H191-A195 WeakPolarHBondContact O-CB 3.29Å; H191-A195 PolarHBondContact O-N 2.83Å
192E86.1Confident85.7Confident101 Ų10197.8 Ų97.847%0.47251%0.511SS..Hα-helixtrans-63.4-41.9171.1-72.2-166.4178.300112.4A188 E189 A195 R196A188-E192 PolarHBondContact O-N 3.37Å; E189-E192 PolarHBondContact O-N 3.4Å; E192-A195 PolarHBondContact O-N 2.91Å; E192-R196 WeakPolarHBondContact O-CG 3.23Å; E192-R196 PolarHBondContact O-N 2.96Å; E192-R196 IonicContact OE2-CZ 2.63Å; E192-R196 VanDerWaalsContact OE2-CZ 3.24Å; E192-R196 IonicContact OE2-NH1 3.43Å; E192-R196 PolarHBondContact OE2-NH1 2.89Å; E192-R196 IonicContact OE2-NH2 3.24Å; E192-R196 PolarHBondContact OE2-NH2 2.86Å
193A85.8Confident85.7Confident44 Ų4496.5 Ų96.536%0.36451%0.507SS..Hα-helixtrans-59.9-48.5176.300000111.2E189 K190 A195 R196 E197E189-A193 PolarHBondContact O-N 3.22Å; K190-A193 PolarHBondContact O-N 3.13Å; A193-A195 VanDerWaalsContact C-N 3.32Å; A193-A195 PolarHBondContact O-N 3.41Å; A193-R196 PolarHBondContact O-N 3.46Å; A193-E197 PolarHBondContact O-N 3.13Å
194A83.1Confident85.6Confident42 Ų4297.4 Ų97.435%0.34750%0.504SS..Hα-helixtrans-61.7-37.2176.300000112.8K190 H191 E197 L198K190-A194 PolarHBondContact O-N 3.36Å; K190-A194 VanDerWaalsContact O-N 3.11Å; H191-A194 PolarHBondContact O-N 3.36Å; A194-E197 PolarHBondContact O-N 3.21Å; A194-L198 WeakPolarHBondContact O-CB 3.28Å; A194-L198 WeakPolarHBondContact O-CG 3.46Å; A194-L198 PolarHBondContact O-N 3.48Å
195A83.4Confident85.4Confident58 Ų5899.6 Ų99.648%0.47951%0.507SS..Hα-helixtrans-65.8-40.1175.200000112.3H191 E192 A193 L198 Q199H191-A195 WeakPolarHBondContact O-CB 3.29Å; H191-A195 PolarHBondContact O-N 2.83Å; E192-A195 PolarHBondContact O-N 2.91Å; A193-A195 VanDerWaalsContact C-N 3.32Å; A193-A195 PolarHBondContact O-N 3.41Å; A195-L198 PolarHBondContact O-N 2.93Å; A195-Q199 PolarHBondContact O-N 3.29Å
196R86.5Confident85.3Confident148 Ų14898.9 Ų98.956%0.55851%0.508SS*.Hα-helixtrans-65.1-41.8174.8-70.1169.4-177.4124.311.3111.8E192 A193 Q199 N200E192-R196 WeakPolarHBondContact O-CG 3.23Å; E192-R196 PolarHBondContact O-N 2.96Å; E192-R196 IonicContact OE2-CZ 2.63Å; E192-R196 VanDerWaalsContact OE2-CZ 3.24Å; E192-R196 IonicContact OE2-NH1 3.43Å; E192-R196 PolarHBondContact OE2-NH1 2.89Å; E192-R196 IonicContact OE2-NH2 3.24Å; E192-R196 PolarHBondContact OE2-NH2 2.86Å; A193-R196 PolarHBondContact O-N 3.46Å; R196-Q199 PolarHBondContact O-N 3.42Å; R196-N200 VanDerWaalsContact O-CG 3.25Å; R196-N200 PolarHBondContact O-N 3.07Å; R196-N200 VanDerWaalsContact O-N 3.08Å; R196-N200 PolarHBondContact O-ND2 2.84Å
197E85.2Confident85.2Confident142 Ų14298.8 Ų98.866%0.66451%0.508SS*.Hα-helixtrans-61.8-42.9174.2-73.4-178.2178.700112.4A193 A194 R201A193-E197 PolarHBondContact O-N 3.13Å; A194-E197 PolarHBondContact O-N 3.21Å; E197-R201 WeakPolarHBondContact O-CB 3.04Å; E197-R201 PolarHBondContact O-N 3.38Å; E197-R201 VanDerWaalsContact O-N 3.15Å
198L82.5Confident85.2Confident117 Ų117101 Ų10161%0.61351%0.513SS*.Hα-helixtrans-65.1-42176.4-73.9170000112.2A194 A195 R201 V202A194-L198 WeakPolarHBondContact O-CB 3.28Å; A194-L198 WeakPolarHBondContact O-CG 3.46Å; A194-L198 PolarHBondContact O-N 3.48Å; A195-L198 PolarHBondContact O-N 2.93Å; L198-R201 PolarHBondContact O-N 2.87Å; L198-V202 WeakPolarHBondContact O-CG2 3.48Å; L198-V202 PolarHBondContact O-N 3.45Å
199Q86.9Confident85Confident104 Ų104104.2 Ų104.249%0.48652%0.523SS..Hα-helixtrans-60.2-51.5176.9-178.459.352.100111.5A195 R196 R201 V202 D203A195-Q199 PolarHBondContact O-N 3.29Å; R196-Q199 PolarHBondContact O-N 3.42Å; Q199-R201 PolarHBondContact O-N 3.03Å; Q199-V202 WeakPolarHBondContact O-CB 3.26Å; Q199-V202 PolarHBondContact O-N 2.78Å; Q199-D203 PolarHBondContact NE2-OD1 3.36Å; Q199-D203 PolarHBondContact NE2-OD2 3.19Å; Q199-D203 PolarHBondContact O-N 3.28Å
200N88.3Confident84.9Confident98 Ų98102.4 Ų102.452%0.52452%0.517SS..Hα-helixtrans-54.4-40177.1-67.5-15.8000111.4R196 D203 D204R196-N200 VanDerWaalsContact O-CG 3.25Å; R196-N200 PolarHBondContact O-N 3.07Å; R196-N200 VanDerWaalsContact O-N 3.08Å; R196-N200 PolarHBondContact O-ND2 2.84Å; N200-D203 PolarHBondContact O-N 3.49Å; N200-D204 PolarHBondContact O-N 3.25Å
201R87.7Confident84.9Confident186 Ų18698.6 Ų98.670%0.70251%0.505SS*.Hα-helixtrans-71.5-30.6-179.5-155.1169.2-163.5132.15.8113.2E197 L198 Q199 L205E197-R201 WeakPolarHBondContact O-CB 3.04Å; E197-R201 PolarHBondContact O-N 3.38Å; E197-R201 VanDerWaalsContact O-N 3.15Å; L198-R201 PolarHBondContact O-N 2.87Å; Q199-R201 PolarHBondContact O-N 3.03Å; R201-L205 WeakPolarHBondContact O-CB 3.45Å; R201-L205 WeakPolarHBondContact O-CD1 3.42Å; R201-L205 VanDerWaalsContact O-CG 3.23Å; R201-L205 WeakPolarHBondContact O-CG 3.3Å; R201-L205 PolarHBondContact O-N 2.9Å; R201-L205 VanDerWaalsContact O-N 3.09Å
202V82.6Confident84.8Confident77 Ų7797.2 Ų97.247%0.46750%0.501SS..Hα-helixtrans-68.9-41.8170169.50000110.8L198 Q199 D204 L205 T206L198-V202 WeakPolarHBondContact O-CG2 3.48Å; L198-V202 PolarHBondContact O-N 3.45Å; Q199-V202 WeakPolarHBondContact O-CB 3.26Å; Q199-V202 PolarHBondContact O-N 2.78Å; V202-D204 PolarHBondContact O-N 3.49Å; V202-L205 PolarHBondContact O-N 3.48Å; V202-T206 WeakPolarHBondContact O-CB 3.13Å; V202-T206 PolarHBondContact O-N 2.76Å; V202-T206 PolarHBondContact O-OG1 2.78Å
203D87.1Confident84.5Confident67 Ų6794.3 Ų94.336%0.35849%0.494SS..Hα-helixtrans-64.8-40.6179-62.7-24.8000111.6Q199 N200 T206 K207Q199-D203 PolarHBondContact NE2-OD1 3.36Å; Q199-D203 PolarHBondContact NE2-OD2 3.19Å; Q199-D203 PolarHBondContact O-N 3.28Å; N200-D203 PolarHBondContact O-N 3.49Å; D203-T206 WeakPolarHBondContact O-CB 3.15Å; D203-T206 PolarHBondContact O-N 3.46Å; D203-K207 WeakPolarHBondContact O-CG 3.33Å; D203-K207 PolarHBondContact O-N 3.48Å
204D84.9Confident84.5Confident81 Ų8197 Ų9743%0.43350%0.499SS..Hα-helixtrans-69.3-40175.2-73-22.2000113.1N200 V202 T206 K207 N208N200-D204 PolarHBondContact O-N 3.25Å; V202-D204 PolarHBondContact O-N 3.49Å; D204-T206 PolarHBondContact O-N 3.19Å; D204-K207 PolarHBondContact O-N 2.79Å; D204-K207 IonicContact OD1-NZ 2.76Å; D204-K207 PolarHBondContact OD1-NZ 2.86Å; D204-N208 VanDerWaalsContact O-CG 3.29Å; D204-N208 PolarHBondContact O-N 2.95Å; D204-N208 PolarHBondContact O-ND2 2.89Å
205L83.5Confident84.6Confident104 Ų104100.3 Ų100.355%0.54551%0.508SS..Hα-helixtrans-61.6-34.5171.5-75.8169.7000112R201 V202 N208 L209R201-L205 WeakPolarHBondContact O-CB 3.45Å; R201-L205 WeakPolarHBondContact O-CD1 3.42Å; R201-L205 VanDerWaalsContact O-CG 3.23Å; R201-L205 WeakPolarHBondContact O-CG 3.3Å; R201-L205 PolarHBondContact O-N 2.9Å; R201-L205 VanDerWaalsContact O-N 3.09Å; V202-L205 PolarHBondContact O-N 3.48Å; L205-N208 PolarHBondContact O-N 3.44Å; L205-L209 WeakPolarHBondContact O-CB 3.21Å; L205-L209 PolarHBondContact O-N 2.79Å
206T82.9Confident84.8Confident69 Ų69105.9 Ų105.942%0.42352%0.516SS..Hα-helixtrans-70-38177.6-56.80000111.9V202 D203 D204 N210V202-T206 WeakPolarHBondContact O-CB 3.13Å; V202-T206 PolarHBondContact O-N 2.76Å; V202-T206 PolarHBondContact O-OG1 2.78Å; D203-T206 WeakPolarHBondContact O-CB 3.15Å; D203-T206 PolarHBondContact O-N 3.46Å; D204-T206 PolarHBondContact O-N 3.19Å; T206-N210 PolarHBondContact O-N 2.91Å; T206-N210 PolarHBondContact O-ND2 3.43Å
207K86.5Confident84.7Confident114 Ų114105.3 Ų105.350%0.49652%0.52SS..Hα-helixtrans-61-52.8170.5-65163.9-156.4161.60110.8D203 D204 L209 N210 D211D203-K207 WeakPolarHBondContact O-CG 3.33Å; D203-K207 PolarHBondContact O-N 3.48Å; D204-K207 PolarHBondContact O-N 2.79Å; D204-K207 IonicContact OD1-NZ 2.76Å; D204-K207 PolarHBondContact OD1-NZ 2.86Å; K207-L209 VanDerWaalsContact C-N 3.28Å; K207-L209 PolarHBondContact O-N 3.35Å; K207-N210 WeakPolarHBondContact O-CB 3.25Å; K207-N210 PolarHBondContact O-N 2.85Å; K207-D211 PolarHBondContact O-N 3.48Å
208N85.1Confident84.8Confident91 Ų91106 Ų10649%0.48752%0.516SS..Hα-helixtrans-58-38.2-179.4-68.8-22.8000112.7D204 L205 D211 L212D204-N208 VanDerWaalsContact O-CG 3.29Å; D204-N208 PolarHBondContact O-N 2.95Å; D204-N208 PolarHBondContact O-ND2 2.89Å; L205-N208 PolarHBondContact O-N 3.44Å; N208-D211 PolarHBondContact O-N 3.3Å; N208-L212 WeakPolarHBondContact O-CB 3.22Å; N208-L212 VanDerWaalsContact O-CG 3.26Å; N208-L212 WeakPolarHBondContact O-CG 3.42Å; N208-L212 PolarHBondContact O-N 3.49Å
209L81.3Confident84.8Confident120 Ų120105.6 Ų105.663%0.62851%0.514SS*.Hα-helixtrans-63.6-40.9174.1-90.6167.2000113L205 K207 A213L205-L209 WeakPolarHBondContact O-CB 3.21Å; L205-L209 PolarHBondContact O-N 2.79Å; K207-L209 VanDerWaalsContact C-N 3.28Å; K207-L209 PolarHBondContact O-N 3.35Å; L209-A213 WeakPolarHBondContact O-CB 3.15Å; L209-A213 PolarHBondContact O-N 3.35Å
210N83.9Confident84.7Confident92 Ų92106.3 Ų106.349%0.49252%0.518SS..Hα-helixtrans-68.2-40.8177.2-74-43.2000111.9T206 K207 A213 Q214T206-N210 PolarHBondContact O-N 2.91Å; T206-N210 PolarHBondContact O-ND2 3.43Å; K207-N210 WeakPolarHBondContact O-CB 3.25Å; K207-N210 PolarHBondContact O-N 2.85Å; N210-A213 PolarHBondContact O-N 2.97Å; N210-Q214 WeakPolarHBondContact O-CG 3.24Å; N210-Q214 PolarHBondContact O-N 2.95Å
211D85.1Confident84.6Confident81 Ų81105.4 Ų105.443%0.43352%0.516SS..Hα-helixtrans-66.3-42.9177.3-69.3-24.5000111.6K207 N208 A213 Q214 Q215K207-D211 PolarHBondContact O-N 3.48Å; N208-D211 PolarHBondContact O-N 3.3Å; D211-A213 VanDerWaalsContact C-N 3.33Å; D211-A213 PolarHBondContact O-N 3.21Å; D211-Q214 PolarHBondContact O-N 3.49Å; D211-Q215 WeakPolarHBondContact O-CG 3.31Å; D211-Q215 PolarHBondContact O-N 2.61Å
212L82.8Confident84.5Confident106 Ų106101.4 Ų101.456%0.55551%0.505SS*.Hα-helixtrans-63-37.1172.8-73.8169.8000112.4N208 Q215 R216N208-L212 WeakPolarHBondContact O-CB 3.22Å; N208-L212 VanDerWaalsContact O-CG 3.26Å; N208-L212 WeakPolarHBondContact O-CG 3.42Å; N208-L212 PolarHBondContact O-N 3.49Å; L212-Q215 PolarHBondContact O-N 2.81Å; L212-R216 WeakPolarHBondContact O-CB 3.26Å; L212-R216 PolarHBondContact O-N 3.31Å
213A79.1Confident84.5Confident40 Ų40102.5 Ų102.533%0.33151%0.508SS..Hα-helixtrans-64.8-4217500000112L209 N210 D211 Q217L209-A213 WeakPolarHBondContact O-CB 3.15Å; L209-A213 PolarHBondContact O-N 3.35Å; N210-A213 PolarHBondContact O-N 2.97Å; D211-A213 VanDerWaalsContact C-N 3.33Å; D211-A213 PolarHBondContact O-N 3.21Å; A213-Q217 PolarHBondContact O-N 3.47Å
214Q86.6Confident84.4Confident99 Ų99103.5 Ų103.546%0.46351%0.513SS..Hα-helixtrans-65.3-44.2174-71.8-176.647.300112.2N210 D211 Q217 R218N210-Q214 WeakPolarHBondContact O-CG 3.24Å; N210-Q214 PolarHBondContact O-N 2.95Å; D211-Q214 PolarHBondContact O-N 3.49Å; Q214-Q217 PolarHBondContact O-N 3.36Å; Q214-R218 WeakPolarHBondContact O-CG 3.27Å; Q214-R218 PolarHBondContact O-N 3.03Å
215Q86Confident84.5Confident113 Ų113102.9 Ų102.953%0.52851%0.51SS..Hα-helixtrans-59.8-46.4176.1-73.7176.712.100111.3D211 L212 Q217 R218 L219D211-Q215 WeakPolarHBondContact O-CG 3.31Å; D211-Q215 PolarHBondContact O-N 2.61Å; L212-Q215 PolarHBondContact O-N 2.81Å; Q215-Q217 VanDerWaalsContact C-N 3.29Å; Q215-Q217 PolarHBondContact O-N 2.86Å; Q215-R218 PolarHBondContact O-N 2.73Å; Q215-L219 WeakPolarHBondContact O-CG 3.32Å; Q215-L219 PolarHBondContact O-N 3.08Å
216R86.1Confident84.5Confident174 Ų174103 Ų10366%0.65751%0.511SS*.Hα-helixtrans-58.4-40.7175.4-171.8-174.369-169.7-1.4111.9L212 Q220L212-R216 WeakPolarHBondContact O-CB 3.26Å; L212-R216 PolarHBondContact O-N 3.31Å; R216-Q220 VanDerWaalsContact O-CB 3.29Å; R216-Q220 WeakPolarHBondContact O-CB 3.33Å; R216-Q220 PolarHBondContact O-N 3.45Å
217Q85.8Confident84.6Confident136 Ų136105.3 Ų105.364%0.63652%0.518SS*.Hα-helixtrans-67.2-36.8178.5-171.1172.5-1.900112.5A213 Q214 Q215 V221A213-Q217 PolarHBondContact O-N 3.47Å; Q214-Q217 PolarHBondContact O-N 3.36Å; Q215-Q217 VanDerWaalsContact C-N 3.29Å; Q215-Q217 PolarHBondContact O-N 2.86Å; Q217-V221 WeakPolarHBondContact O-CG2 3.39Å; Q217-V221 PolarHBondContact O-N 3.4Å
218R86.7Confident84.6Confident156 Ų156105.5 Ų105.559%0.58952%0.519SS*.Hα-helixtrans-65.5-52.3173.4-66.6179.3-166.2-175.66.1111.6Q214 Q215 Q220 V221 E222Q214-R218 WeakPolarHBondContact O-CG 3.27Å; Q214-R218 PolarHBondContact O-N 3.03Å; Q215-R218 PolarHBondContact O-N 2.73Å; R218-Q220 PolarHBondContact O-N 3.38Å; R218-V221 WeakPolarHBondContact O-CA 3.46Å; R218-V221 WeakPolarHBondContact O-CB 3.47Å; R218-V221 PolarHBondContact O-N 3.06Å; R218-E222 WeakPolarHBondContact O-CG 3.17Å; R218-E222 PolarHBondContact O-N 2.99Å
219L82.1Confident84.6Confident109 Ų109106.7 Ų106.757%0.57152%0.522SS*.Hα-helixtrans-57.6-33.1177.4-69.4168.4000112.4Q215 N223Q215-L219 WeakPolarHBondContact O-CG 3.32Å; Q215-L219 PolarHBondContact O-N 3.08Å; L219-N223 VanDerWaalsContact O-CB 3.23Å; L219-N223 WeakPolarHBondContact O-CB 3.42Å; L219-N223 PolarHBondContact O-N 3.28Å
220Q84.3Confident84.6Confident119 Ų119105.2 Ų105.256%0.55651%0.514SS*.Hα-helixtrans-72-31175.4-171.71734.200113R216 R218 N224R216-Q220 VanDerWaalsContact O-CB 3.29Å; R216-Q220 WeakPolarHBondContact O-CB 3.33Å; R216-Q220 PolarHBondContact O-N 3.45Å; R218-Q220 PolarHBondContact O-N 3.38Å; Q220-N224 VanDerWaalsContact O-CG 3.26Å; Q220-N224 PolarHBondContact O-N 3.03Å; Q220-N224 PolarHBondContact O-ND2 3.42Å
221V86.3Confident84.7Confident80 Ų80106.5 Ų106.549%0.48552%0.517SS..Hα-helixtrans-71.4-49.2170.9173.40000110Q217 R218 N223 N224 D225Q217-V221 WeakPolarHBondContact O-CG2 3.39Å; Q217-V221 PolarHBondContact O-N 3.4Å; R218-V221 WeakPolarHBondContact O-CA 3.46Å; R218-V221 WeakPolarHBondContact O-CB 3.47Å; R218-V221 PolarHBondContact O-N 3.06Å; V221-N223 VanDerWaalsContact C-N 3.3Å; V221-N223 PolarHBondContact O-N 2.59Å; V221-N224 WeakPolarHBondContact O-CB 3.33Å; V221-N224 PolarHBondContact O-N 2.96Å; V221-D225 PolarHBondContact O-N 3.34Å
222E85.6Confident84.7Confident102 Ų102107 Ų10748%0.47752%0.52SS..Hα-helixtrans-55.9-42.8177.6-69.1163.2-160.700111.9R218 D225 L226R218-E222 WeakPolarHBondContact O-CG 3.17Å; R218-E222 PolarHBondContact O-N 2.99Å; E222-D225 PolarHBondContact O-N 3.22Å; E222-L226 WeakPolarHBondContact O-CB 3.48Å; E222-L226 WeakPolarHBondContact O-CG 3.42Å; E222-L226 PolarHBondContact O-N 2.9Å
223N83.4Confident84.8Confident99 Ų99107 Ų10753%0.52952%0.519SS..Hα-helixtrans-63.2-42.5174.9-170-72.5000112.4L219 V221 D225 M227L219-N223 VanDerWaalsContact O-CB 3.23Å; L219-N223 WeakPolarHBondContact O-CB 3.42Å; L219-N223 PolarHBondContact O-N 3.28Å; V221-N223 VanDerWaalsContact C-N 3.3Å; V221-N223 PolarHBondContact O-N 2.59Å; N223-D225 VanDerWaalsContact C-N 3.28Å; N223-D225 PolarHBondContact O-N 3.4Å; N223-M227 VanDerWaalsContact O-CB 3.32Å; N223-M227 WeakPolarHBondContact O-CB 3.24Å; N223-M227 WeakPolarHBondContact O-CG 3.42Å; N223-M227 PolarHBondContact O-N 3.41Å
224N85.1Confident85.1Confident88 Ų88110.2 Ų110.247%0.47153%0.525SS..Hα-helixtrans-64.9-30.1176.1-76.8-41.1000112.9Q220 V221 K228Q220-N224 VanDerWaalsContact O-CG 3.26Å; Q220-N224 PolarHBondContact O-N 3.03Å; Q220-N224 PolarHBondContact O-ND2 3.42Å; V221-N224 WeakPolarHBondContact O-CB 3.33Å; V221-N224 PolarHBondContact O-N 2.96Å; N224-K228 WeakPolarHBondContact O-CE 3.41Å; N224-K228 WeakPolarHBondContact O-CG 3.47Å; N224-K228 PolarHBondContact O-N 2.96Å
225D86.7Confident85Confident68 Ų68108.2 Ų108.236%0.36452%0.52SS..Hα-helixtrans-80.9-43.4177.6-69.4-32.1000111.5V221 E222 N223 M227 K228 E229V221-D225 PolarHBondContact O-N 3.34Å; E222-D225 PolarHBondContact O-N 3.22Å; N223-D225 VanDerWaalsContact C-N 3.28Å; N223-D225 PolarHBondContact O-N 3.4Å; D225-M227 PolarHBondContact O-N 2.77Å; D225-K228 WeakPolarHBondContact O-CA 3.49Å; D225-K228 WeakPolarHBondContact O-CB 3.37Å; D225-K228 PolarHBondContact O-N 3.5Å; D225-K228 IonicContact OD1-NZ 2.72Å; D225-K228 PolarHBondContact OD1-NZ 2.89Å; D225-E229 PolarHBondContact O-N 3.42Å
226L84Confident85.1Confident106 Ų106108.5 Ų108.556%0.55552%0.521SS*.Hα-helixtrans-58-35.1170.2-71.6168.7000112.5E222 K228 E229 L230E222-L226 WeakPolarHBondContact O-CB 3.48Å; E222-L226 WeakPolarHBondContact O-CG 3.42Å; E222-L226 PolarHBondContact O-N 2.9Å; L226-K228 VanDerWaalsContact C-N 3.29Å; L226-K228 PolarHBondContact O-N 3.32Å; L226-E229 PolarHBondContact O-N 3.39Å; L226-L230 VanDerWaalsContact O-CB 3.27Å; L226-L230 WeakPolarHBondContact O-CB 3.29Å; L226-L230 PolarHBondContact O-N 3.4Å
227M83.4Confident84.9Confident118 Ų118106.1 Ų106.158%0.58152%0.519SS*.Hα-helixtrans-65.7-28.4173.6-79.7-78.4-7500113.2N223 D225 H231N223-M227 VanDerWaalsContact O-CB 3.32Å; N223-M227 WeakPolarHBondContact O-CB 3.24Å; N223-M227 WeakPolarHBondContact O-CG 3.42Å; N223-M227 PolarHBondContact O-N 3.41Å; D225-M227 PolarHBondContact O-N 2.77Å; M227-H231 PolarHBondContact O-N 3.5Å
228K87.4Confident84.8Confident118 Ų118105.8 Ų105.851%0.51352%0.518SS..Hα-helixtrans-76.1-47.7172-62.7162-163.4164.40110.6N224 D225 L226 L230 H231 D232N224-K228 WeakPolarHBondContact O-CE 3.41Å; N224-K228 WeakPolarHBondContact O-CG 3.47Å; N224-K228 PolarHBondContact O-N 2.96Å; D225-K228 WeakPolarHBondContact O-CA 3.49Å; D225-K228 WeakPolarHBondContact O-CB 3.37Å; D225-K228 PolarHBondContact O-N 3.5Å; D225-K228 IonicContact OD1-NZ 2.72Å; D225-K228 PolarHBondContact OD1-NZ 2.89Å; L226-K228 VanDerWaalsContact C-N 3.29Å; L226-K228 PolarHBondContact O-N 3.32Å; K228-L230 PolarHBondContact O-N 2.86Å; K228-H231 CarbonylContact O-C 3.52Å; K228-H231 WeakPolarHBondContact O-CA 3.41Å; K228-H231 WeakPolarHBondContact O-CB 3.45Å; K228-H231 PolarHBondContact O-N 3.37Å; K228-D232 PolarHBondContact O-N 2.95Å
229E84.4Confident84.7Confident116 Ų116103 Ų10354%0.54251%0.514SS..Hα-helixtrans-56.2-41.6176.6-67-175164.400111.3D225 L226 H231 D232 I233D225-E229 PolarHBondContact O-N 3.42Å; L226-E229 PolarHBondContact O-N 3.39Å; E229-H231 VanDerWaalsContact C-N 3.32Å; E229-H231 PolarHBondContact O-N 2.89Å; E229-D232 PolarHBondContact O-N 3.46Å; E229-I233 WeakPolarHBondContact O-CB 3.38Å; E229-I233 WeakPolarHBondContact O-CD1 3.46Å; E229-I233 VanDerWaalsContact O-CG1 3.22Å; E229-I233 WeakPolarHBondContact O-CG1 3.5Å; E229-I233 PolarHBondContact O-N 3.32Å
230L82.6Confident84.8Confident90 Ų90103.7 Ų103.747%0.47152%0.518SS..Hα-helixtrans-67.6-28.4175.5-173.5146000113.3L226 K228 K234L226-L230 VanDerWaalsContact O-CB 3.27Å; L226-L230 WeakPolarHBondContact O-CB 3.29Å; L226-L230 PolarHBondContact O-N 3.4Å; K228-L230 PolarHBondContact O-N 2.86Å; L230-K234 HydrophobicContact CD2-CD 4.05Å; L230-K234 VanDerWaalsContact O-CG 3.29Å; L230-K234 WeakPolarHBondContact O-CG 3.12Å; L230-K234 PolarHBondContact O-N 2.91Å
231H84.9Confident84.7Confident119 Ų119103.1 Ų103.155%0.55152%0.515SS*.Hα-helixtrans-73.5-47171.5-175.465.6000111.3M227 K228 E229 I233 K234 V235M227-H231 PolarHBondContact O-N 3.5Å; K228-H231 CarbonylContact O-C 3.52Å; K228-H231 WeakPolarHBondContact O-CA 3.41Å; K228-H231 WeakPolarHBondContact O-CB 3.45Å; K228-H231 PolarHBondContact O-N 3.37Å; E229-H231 VanDerWaalsContact C-N 3.32Å; E229-H231 PolarHBondContact O-N 2.89Å; H231-I233 VanDerWaalsContact C-N 3.34Å; H231-I233 PolarHBondContact O-N 3.36Å; H231-K234 WeakPolarHBondContact O-CB 3.4Å; H231-K234 PolarHBondContact O-N 3Å; H231-K234 VanDerWaalsContact O-N 3.12Å; H231-V235 WeakPolarHBondContact O-CG2 3.37Å; H231-V235 PolarHBondContact O-N 3.02Å
232D85.1Confident84.7Confident92 Ų92105.4 Ų105.449%0.49252%0.52SS..Hα-helixtrans-62.2-41.1178.2-69.5-19.8000111.5K228 E229 K234 V235 Q236K228-D232 PolarHBondContact O-N 2.95Å; E229-D232 PolarHBondContact O-N 3.46Å; D232-K234 PolarHBondContact O-N 2.87Å; D232-V235 PolarHBondContact O-N 3.48Å; D232-Q236 VanDerWaalsContact O-CG 3.31Å; D232-Q236 WeakPolarHBondContact O-CG 3.46Å; D232-Q236 PolarHBondContact O-N 2.91Å
233I85.7Confident84.7Confident105 Ų105103.7 Ų103.754%0.53852%0.517SS..Hα-helixtrans-63.9-37.9174-71.8163.1000111.5E229 H231 Q236 M237E229-I233 WeakPolarHBondContact O-CB 3.38Å; E229-I233 WeakPolarHBondContact O-CD1 3.46Å; E229-I233 VanDerWaalsContact O-CG1 3.22Å; E229-I233 WeakPolarHBondContact O-CG1 3.5Å; E229-I233 PolarHBondContact O-N 3.32Å; H231-I233 VanDerWaalsContact C-N 3.34Å; H231-I233 PolarHBondContact O-N 3.36Å; I233-Q236 PolarHBondContact O-N 2.74Å; I233-M237 WeakPolarHBondContact O-CB 3.24Å; I233-M237 PolarHBondContact O-N 3.38Å
234K84.3Confident84.9Confident107 Ų107105.1 Ų105.147%0.46552%0.518SS..Hα-helixtrans-63.8-46.4173.7-81.3173.4177.4177.10111.7L230 H231 D232 Q236 M237 E238L230-K234 HydrophobicContact CD2-CD 4.05Å; L230-K234 VanDerWaalsContact O-CG 3.29Å; L230-K234 WeakPolarHBondContact O-CG 3.12Å; L230-K234 PolarHBondContact O-N 2.91Å; H231-K234 WeakPolarHBondContact O-CB 3.4Å; H231-K234 PolarHBondContact O-N 3Å; H231-K234 VanDerWaalsContact O-N 3.12Å; D232-K234 PolarHBondContact O-N 2.87Å; K234-Q236 VanDerWaalsContact C-N 3.31Å; K234-Q236 PolarHBondContact O-N 2.88Å; K234-M237 PolarHBondContact O-N 3.38Å; K234-M237 VanDerWaalsContact O-N 3.12Å; K234-E238 WeakPolarHBondContact O-CG 3.35Å; K234-E238 PolarHBondContact O-N 3.25Å
235V85.7Confident84.8Confident58 Ų58104.6 Ų104.635%0.35252%0.519SS..Hα-helixtrans-61.9-39.4176.3174.20000111H231 D232 N239H231-V235 WeakPolarHBondContact O-CG2 3.37Å; H231-V235 PolarHBondContact O-N 3.02Å; D232-V235 PolarHBondContact O-N 3.48Å; V235-N239 WeakPolarHBondContact O-CB 3.3Å; V235-N239 PolarHBondContact O-N 2.91Å; V235-N239 VanDerWaalsContact O-N 3.08Å; V235-N239 PolarHBondContact O-ND2 2.98Å
236Q87.4Confident84.8Confident119 Ų119105.8 Ų105.856%0.55652%0.522SS*.Hα-helixtrans-64-41.7172.6-72.2175.131.200112.3D232 I233 K234 N239 L240D232-Q236 VanDerWaalsContact O-CG 3.31Å; D232-Q236 WeakPolarHBondContact O-CG 3.46Å; D232-Q236 PolarHBondContact O-N 2.91Å; I233-Q236 PolarHBondContact O-N 2.74Å; K234-Q236 VanDerWaalsContact C-N 3.31Å; K234-Q236 PolarHBondContact O-N 2.88Å; Q236-N239 PolarHBondContact O-N 3.17Å; Q236-L240 WeakPolarHBondContact O-CB 3.34Å; Q236-L240 VanDerWaalsContact O-CG 3.31Å; Q236-L240 WeakPolarHBondContact O-CG 3.3Å; Q236-L240 PolarHBondContact O-N 3.45Å
237M81.6Confident84.8Confident124 Ų124105.4 Ų105.461%0.61152%0.52SS*.Hα-helixtrans-65.7-40.2178.1-171.1-17771.500112.3I233 K234 L240 Q241I233-M237 WeakPolarHBondContact O-CB 3.24Å; I233-M237 PolarHBondContact O-N 3.38Å; K234-M237 PolarHBondContact O-N 3.38Å; K234-M237 VanDerWaalsContact O-N 3.12Å; M237-L240 PolarHBondContact O-N 2.99Å; M237-Q241 WeakPolarHBondContact O-CB 3.3Å; M237-Q241 PolarHBondContact O-N 3.05Å
238E84.1Confident84.8Confident129 Ų129102.3 Ų102.360%0.60351%0.513SS*.Hα-helixtrans-63.6-44.7175.1-73.5172.8-173.400111.4K234 Q241 H242K234-E238 WeakPolarHBondContact O-CG 3.35Å; K234-E238 PolarHBondContact O-N 3.25Å; E238-Q241 PolarHBondContact O-N 3Å; E238-H242 PolarHBondContact O-N 3.45Å
239N85Confident84.7Confident97 Ų97102.9 Ų102.952%0.51952%0.518SS..Hα-helixtrans-61.7-44.8173.7-78-61.4000112.3V235 Q236 Q241 H242 V243V235-N239 WeakPolarHBondContact O-CB 3.3Å; V235-N239 PolarHBondContact O-N 2.91Å; V235-N239 VanDerWaalsContact O-N 3.08Å; V235-N239 PolarHBondContact O-ND2 2.98Å; Q236-N239 PolarHBondContact O-N 3.17Å; N239-Q241 PolarHBondContact O-N 3.22Å; N239-H242 PolarHBondContact O-N 3.21Å; N239-V243 WeakPolarHBondContact O-CG2 3.18Å; N239-V243 PolarHBondContact O-N 3.24Å
240L84.8Confident84.6Confident123 Ų123102.2 Ų102.264%0.64451%0.514SS*.Hα-helixtrans-63.4-39176.5-76.4170.1000112.3Q236 M237 K244Q236-L240 WeakPolarHBondContact O-CB 3.34Å; Q236-L240 VanDerWaalsContact O-CG 3.31Å; Q236-L240 WeakPolarHBondContact O-CG 3.3Å; Q236-L240 PolarHBondContact O-N 3.45Å; M237-L240 PolarHBondContact O-N 2.99Å; L240-K244 VanDerWaalsContact O-CB 3.24Å; L240-K244 WeakPolarHBondContact O-CB 3.3Å; L240-K244 PolarHBondContact O-N 2.99Å
241Q82.3Confident84.6Confident107 Ų107102.7 Ų102.750%0.552%0.517SS..Hα-helixtrans-66.7-39.3175.6-172.185.9-54.200111.1M237 E238 N239 K244 T245M237-Q241 WeakPolarHBondContact O-CB 3.3Å; M237-Q241 PolarHBondContact O-N 3.05Å; E238-Q241 PolarHBondContact O-N 3Å; N239-Q241 PolarHBondContact O-N 3.22Å; Q241-K244 WeakPolarHBondContact O-CB 3.47Å; Q241-K244 PolarHBondContact O-N 3.42Å; Q241-T245 PolarHBondContact O-N 3Å; Q241-T245 PolarHBondContact O-OG1 3.18Å; Q241-T245 VanDerWaalsContact O-OG1 3.07Å
242H85.8Confident84.5Confident128 Ų128101.9 Ų101.959%0.59351%0.513SS*.Hα-helixtrans-63.1-47175-174.173.6000112.2E238 N239 K244 T245 Q246E238-H242 PolarHBondContact O-N 3.45Å; N239-H242 PolarHBondContact O-N 3.21Å; H242-K244 VanDerWaalsContact C-N 3.28Å; H242-K244 PolarHBondContact O-N 3.05Å; H242-T245 PolarHBondContact O-N 2.89Å; H242-T245 PolarHBondContact O-OG1 3.47Å; H242-Q246 PolarHBondContact O-N 3Å
243V85.8Confident84.4Confident67 Ų67102.1 Ų102.141%0.40651%0.512SS..Hα-helixtrans-61.4-38.1174.5171.40000111N239 Q246 L247N239-V243 WeakPolarHBondContact O-CG2 3.18Å; N239-V243 PolarHBondContact O-N 3.24Å; V243-Q246 PolarHBondContact O-N 3.38Å; V243-L247 HydrophobicContact CG1-CD1 3.87Å; V243-L247 HydrophobicContact CG1-CG 4.29Å; V243-L247 WeakPolarHBondContact O-CB 3.23Å; V243-L247 WeakPolarHBondContact O-CG 3.33Å; V243-L247 PolarHBondContact O-N 2.65Å
244K87.4Confident84.1Confident129 Ų12999.7 Ų99.756%0.56151%0.507SS*.Hα-helixtrans-64.4-41.6175.8174.1-178157.2-155.90112.9L240 Q241 H242 A248L240-K244 VanDerWaalsContact O-CB 3.24Å; L240-K244 WeakPolarHBondContact O-CB 3.3Å; L240-K244 PolarHBondContact O-N 2.99Å; Q241-K244 WeakPolarHBondContact O-CB 3.47Å; Q241-K244 PolarHBondContact O-N 3.42Å; H242-K244 VanDerWaalsContact C-N 3.28Å; H242-K244 PolarHBondContact O-N 3.05Å; K244-A248 WeakPolarHBondContact O-CB 3.3Å; K244-A248 PolarHBondContact O-N 3.37Å
245T83.3Confident84.2Confident77 Ų77101.9 Ų101.947%0.47251%0.512SS..Hα-helixtrans-65.5-39.717326.40000111.8Q241 H242 A248 Q249Q241-T245 PolarHBondContact O-N 3Å; Q241-T245 PolarHBondContact O-OG1 3.18Å; Q241-T245 VanDerWaalsContact O-OG1 3.07Å; H242-T245 PolarHBondContact O-N 2.89Å; H242-T245 PolarHBondContact O-OG1 3.47Å; T245-A248 PolarHBondContact O-N 3.37Å; T245-Q249 WeakPolarHBondContact O-CG 3.49Å; T245-Q249 PolarHBondContact O-N 3.4Å
246Q85.8Confident84.1Confident93 Ų93106.1 Ų106.144%0.43552%0.522SS..Hα-helixtrans-62.1-45.1175.9-170-179.122.900112H242 V243 Q249 Q250H242-Q246 PolarHBondContact O-N 3Å; V243-Q246 PolarHBondContact O-N 3.38Å; Q246-Q249 PolarHBondContact O-N 2.84Å; Q246-Q250 WeakPolarHBondContact O-CG 3.25Å; Q246-Q250 PolarHBondContact O-N 3.43Å
247L84.9Confident83.9Confident98 Ų98108.1 Ų108.151%0.51352%0.524SS..Hα-helixtrans-66.5-35.6175.8-72.4171.9000112.4V243 Q250 L251V243-L247 HydrophobicContact CG1-CD1 3.87Å; V243-L247 HydrophobicContact CG1-CG 4.29Å; V243-L247 WeakPolarHBondContact O-CB 3.23Å; V243-L247 WeakPolarHBondContact O-CG 3.33Å; V243-L247 PolarHBondContact O-N 2.65Å; L247-Q250 PolarHBondContact O-N 2.88Å; L247-L251 WeakPolarHBondContact O-CB 3.35Å; L247-L251 PolarHBondContact O-N 2.99Å
248A83.4Confident83.8Confident53 Ų53107.1 Ų107.144%0.43852%0.521SS..Hα-helixtrans-64.9-42.5174.500000111.8K244 T245 L251 E252K244-A248 WeakPolarHBondContact O-CB 3.3Å; K244-A248 PolarHBondContact O-N 3.37Å; T245-A248 PolarHBondContact O-N 3.37Å; A248-L251 PolarHBondContact O-N 3.18Å; A248-E252 PolarHBondContact O-N 2.95Å
249Q84.5Confident83.7Confident130 Ų130105.2 Ų105.261%0.60751%0.512SS*.Hα-helixtrans-62-45.4173.8-72.6171.5-20.300111.6T245 Q246 L251 E252 E253T245-Q249 WeakPolarHBondContact O-CG 3.49Å; T245-Q249 PolarHBondContact O-N 3.4Å; Q246-Q249 PolarHBondContact O-N 2.84Å; Q249-L251 VanDerWaalsContact C-N 3.34Å; Q249-L251 PolarHBondContact O-N 3.03Å; Q249-E252 PolarHBondContact O-N 2.65Å; Q249-E253 PolarHBondContact O-N 3.46Å
250Q82.2Confident83.6Confident102 Ų102104.4 Ų104.448%0.47751%0.508SS..Hα-helixtrans-63-37.7175.8-72.5176.3-4.500112.8Q246 L247 A254Q246-Q250 WeakPolarHBondContact O-CG 3.25Å; Q246-Q250 PolarHBondContact O-N 3.43Å; L247-Q250 PolarHBondContact O-N 2.88Å; Q250-A254 VanDerWaalsContact O-CB 3.32Å; Q250-A254 WeakPolarHBondContact O-CB 3.49Å; Q250-A254 PolarHBondContact O-N 2.88Å
251L82.7Confident83.2Confident99 Ų99100.9 Ų100.952%0.51850%0.496SS..Hα-helixtrans-64.7-40.4174.3-170.799000111.3L247 A248 Q249 A254 R255L247-L251 WeakPolarHBondContact O-CB 3.35Å; L247-L251 PolarHBondContact O-N 2.99Å; A248-L251 PolarHBondContact O-N 3.18Å; Q249-L251 VanDerWaalsContact C-N 3.34Å; Q249-L251 PolarHBondContact O-N 3.03Å; L251-A254 PolarHBondContact O-N 3.15Å; L251-R255 WeakPolarHBondContact O-CG 3.29Å; L251-R255 PolarHBondContact O-N 2.93Å
252E82Confident83.2Confident103 Ų10399.9 Ų99.948%0.48149%0.492SS..Hα-helixtrans-73.8-36.9179.5-158.4175.513400112.4A248 Q249 A254 R255 R256A248-E252 PolarHBondContact O-N 2.95Å; Q249-E252 PolarHBondContact O-N 2.65Å; E252-A254 VanDerWaalsContact C-N 3.33Å; E252-A254 PolarHBondContact O-N 2.88Å; E252-R255 PolarHBondContact O-N 3.3Å; E252-R256 WeakPolarHBondContact O-CG 3.3Å; E252-R256 PolarHBondContact O-N 3.36Å; E252-R256 IonicContact OE1-CZ 2.71Å; E252-R256 IonicContact OE1-NE 3.27Å; E252-R256 IonicContact OE1-NH2 3.47Å; E252-R256 PolarHBondContact OE1-NH2 2.76Å
253E83.6Confident83Confident97 Ų9799.9 Ų99.945%0.45349%0.486SS..Hα-helixtrans-57.9-45.2166.6-78.8-172.7-15400112Q249 R255 R256 R257Q249-E253 PolarHBondContact O-N 3.46Å; E253-R255 VanDerWaalsContact C-N 3.34Å; E253-R255 PolarHBondContact O-N 3.48Å; E253-R256 PolarHBondContact O-N 2.99Å; E253-R257 WeakPolarHBondContact O-CG 3.37Å; E253-R257 PolarHBondContact O-N 3Å; E253-R257 IonicContact OE2-CZ 3.15Å; E253-R257 IonicContact OE2-NH1 2.71Å; E253-R257 PolarHBondContact OE2-NH1 2.9Å; E253-R257 IonicContact OE2-NH2 2.73Å; E253-R257 PolarHBondContact OE2-NH2 3.25Å
254A80.7Confident82.8Confident53 Ų53102.9 Ų102.944%0.43850%0.496SS..Hα-helixtrans-65.2-37.1178.600000112.1Q250 L251 E252 L258Q250-A254 VanDerWaalsContact O-CB 3.32Å; Q250-A254 WeakPolarHBondContact O-CB 3.49Å; Q250-A254 PolarHBondContact O-N 2.88Å; L251-A254 PolarHBondContact O-N 3.15Å; E252-A254 VanDerWaalsContact C-N 3.33Å; E252-A254 PolarHBondContact O-N 2.88Å; A254-L258 WeakPolarHBondContact O-CB 3.42Å; A254-L258 PolarHBondContact O-N 3.01Å
255R85.4Confident82.7Confident154 Ų154103 Ų10358%0.58149%0.493SS*.Hα-helixtrans-64.7-45.6173.2-77.8175.3175.2-162.6-2.5112.2L251 E252 E253 R257 L258 E259L251-R255 WeakPolarHBondContact O-CG 3.29Å; L251-R255 PolarHBondContact O-N 2.93Å; E252-R255 PolarHBondContact O-N 3.3Å; E253-R255 VanDerWaalsContact C-N 3.34Å; E253-R255 PolarHBondContact O-N 3.48Å; R255-R257 PolarHBondContact O-N 3.46Å; R255-L258 WeakPolarHBondContact O-CB 3.19Å; R255-L258 PolarHBondContact O-N 3.16Å; R255-L258 VanDerWaalsContact O-N 3.1Å; R255-E259 WeakPolarHBondContact O-CG 3.39Å; R255-E259 PolarHBondContact O-N 2.96Å
256R83.4Confident82.6Confident147 Ų147102 Ų10256%0.55549%0.489SS*.Hα-helixtrans-60.2-46.3176.4-68.8175.3-168.2-153.44.1111.3E252 E253 L258 E259 D260E252-R256 WeakPolarHBondContact O-CG 3.3Å; E252-R256 PolarHBondContact O-N 3.36Å; E252-R256 IonicContact OE1-CZ 2.71Å; E252-R256 IonicContact OE1-NE 3.27Å; E252-R256 IonicContact OE1-NH2 3.47Å; E252-R256 PolarHBondContact OE1-NH2 2.76Å; E253-R256 PolarHBondContact O-N 2.99Å; R256-L258 VanDerWaalsContact C-N 3.26Å; R256-L258 PolarHBondContact O-N 3.05Å; R256-E259 PolarHBondContact O-N 3.01Å; R256-D260 WeakPolarHBondContact O-CB 3.33Å; R256-D260 VanDerWaalsContact O-CG 3.31Å; R256-D260 PolarHBondContact O-N 2.77Å
257R83.1Confident82.5Confident160 Ų160103.3 Ų103.360%0.60450%0.495SS*.Hα-helixtrans-58.9-34.4173.6-69.7176.1-171.1125.914113.1E253 R255 A261E253-R257 WeakPolarHBondContact O-CG 3.37Å; E253-R257 PolarHBondContact O-N 3Å; E253-R257 IonicContact OE2-CZ 3.15Å; E253-R257 IonicContact OE2-NH1 2.71Å; E253-R257 PolarHBondContact OE2-NH1 2.9Å; E253-R257 IonicContact OE2-NH2 2.73Å; E253-R257 PolarHBondContact OE2-NH2 3.25Å; R255-R257 PolarHBondContact O-N 3.46Å; R257-A261 WeakPolarHBondContact O-CB 3.44Å; R257-A261 PolarHBondContact O-N 3.09Å
258L80.4Confident82.2Confident103 Ų103104.7 Ų104.754%0.53950%0.501SS..Hα-helixtrans-71.4-48.9174.4-179.163.6000111.5A254 R255 R256 D260 A261 E262A254-L258 WeakPolarHBondContact O-CB 3.42Å; A254-L258 PolarHBondContact O-N 3.01Å; R255-L258 WeakPolarHBondContact O-CB 3.19Å; R255-L258 PolarHBondContact O-N 3.16Å; R255-L258 VanDerWaalsContact O-N 3.1Å; R256-L258 VanDerWaalsContact C-N 3.26Å; R256-L258 PolarHBondContact O-N 3.05Å; L258-D260 VanDerWaalsContact C-N 3.31Å; L258-D260 PolarHBondContact O-N 2.82Å; L258-A261 PolarHBondContact O-N 2.97Å; L258-E262 HydrophobicContact CD1-CG 4.28Å; L258-E262 HydrophobicContact CG-CG 4.48Å; L258-E262 WeakPolarHBondContact O-CG 3.48Å; L258-E262 PolarHBondContact O-N 3.02Å
259E81.9Confident82.1Confident89 Ų89107.1 Ų107.142%0.41650%0.503SS..Hα-helixtrans-57.9-42.3177.4-71.9177.5-150.800112.2R255 R256 E262 R263R255-E259 WeakPolarHBondContact O-CG 3.39Å; R255-E259 PolarHBondContact O-N 2.96Å; R256-E259 PolarHBondContact O-N 3.01Å; E259-E262 PolarHBondContact O-N 3.33Å; E259-R263 VanDerWaalsContact O-CG 3.25Å; E259-R263 WeakPolarHBondContact O-CG 3.44Å; E259-R263 PolarHBondContact O-N 3.31Å; E259-R263 IonicContact OE2-CZ 2.69Å; E259-R263 IonicContact OE2-NH1 3.24Å; E259-R263 PolarHBondContact OE2-NH1 3.08Å; E259-R263 IonicContact OE2-NH2 2.76Å; E259-R263 PolarHBondContact OE2-NH2 3.35Å
260D81.9Confident81.9Confident80 Ų80106 Ų10643%0.42850%0.501SS..Hα-helixtrans-66.5-42.4177.8-66.7-30.4000111.3R256 L258 E262 R263 E264R256-D260 WeakPolarHBondContact O-CB 3.33Å; R256-D260 VanDerWaalsContact O-CG 3.31Å; R256-D260 PolarHBondContact O-N 2.77Å; L258-D260 VanDerWaalsContact C-N 3.31Å; L258-D260 PolarHBondContact O-N 2.82Å; D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact O-N 2.76Å; D260-R263 WeakPolarHBondContact O-CB 3.49Å; D260-R263 PolarHBondContact O-N 2.65Å; D260-R263 IonicContact OD1-CZ 3.2Å; D260-R263 IonicContact OD1-NH1 2.61Å; D260-R263 PolarHBondContact OD1-NH1 3.36Å; D260-E264 WeakPolarHBondContact O-CG 3.41Å; D260-E264 PolarHBondContact O-N 2.82Å
261A77.6Confident81.9Confident49 Ų49106.2 Ų106.241%0.40550%0.502SS..Hα-helixtrans-64.6-31.5172.700000113.1R257 L258 R265R257-A261 WeakPolarHBondContact O-CB 3.44Å; R257-A261 PolarHBondContact O-N 3.09Å; L258-A261 PolarHBondContact O-N 2.97Å; A261-R265 VanDerWaalsContact O-CB 3.27Å; A261-R265 WeakPolarHBondContact O-CB 3.28Å; A261-R265 PolarHBondContact O-N 2.88Å
262E80.8Confident81.8Confident86 Ų86106.4 Ų106.440%0.40250%0.503SS..Hα-helixtrans-75.7-33.5174.1-68.1-152.8119.300112.8L258 E259 D260 R265 S266L258-E262 HydrophobicContact CD1-CG 4.28Å; L258-E262 HydrophobicContact CG-CG 4.48Å; L258-E262 WeakPolarHBondContact O-CG 3.48Å; L258-E262 PolarHBondContact O-N 3.02Å; E259-E262 PolarHBondContact O-N 3.33Å; D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact O-N 2.76Å; E262-R265 PolarHBondContact O-N 3.5Å; E262-R265 IonicContact OE1-CZ 2.93Å; E262-R265 IonicContact OE1-NH1 2.74Å; E262-R265 PolarHBondContact OE1-NH1 2.82Å; E262-R265 IonicContact OE1-NH2 3.89Å; E262-R265 PolarHBondContact OE1-NH2 3.44Å; E262-S266 WeakPolarHBondContact O-CB 3.4Å; E262-S266 PolarHBondContact O-N 2.81Å
263R82.7Confident81.9Confident128 Ų128106.5 Ų106.548%0.48350%0.503SS..Hα-helixtrans-62.2-49.6169.2-71.6164.5-175125.515110.7E259 D260 S266 Q267E259-R263 VanDerWaalsContact O-CG 3.25Å; E259-R263 WeakPolarHBondContact O-CG 3.44Å; E259-R263 PolarHBondContact O-N 3.31Å; E259-R263 IonicContact OE2-CZ 2.69Å; E259-R263 IonicContact OE2-NH1 3.24Å; E259-R263 PolarHBondContact OE2-NH1 3.08Å; E259-R263 IonicContact OE2-NH2 2.76Å; E259-R263 PolarHBondContact OE2-NH2 3.35Å; D260-R263 WeakPolarHBondContact O-CB 3.49Å; D260-R263 PolarHBondContact O-N 2.65Å; D260-R263 IonicContact OD1-CZ 3.2Å; D260-R263 IonicContact OD1-NH1 2.61Å; D260-R263 PolarHBondContact OD1-NH1 3.36Å; R263-S266 PolarHBondContact O-N 3.15Å; R263-Q267 WeakPolarHBondContact O-CG 3.42Å; R263-Q267 PolarHBondContact O-N 2.88Å
264E82.2Confident81.7Confident130 Ų130107.4 Ų107.461%0.60751%0.507SS*.Hα-helixtrans-59.6-46.8175-73.1-178.2172.300111.5D260 S266 Q267 M268D260-E264 WeakPolarHBondContact O-CG 3.41Å; D260-E264 PolarHBondContact O-N 2.82Å; E264-S266 VanDerWaalsContact C-N 3.34Å; E264-S266 PolarHBondContact O-N 2.74Å; E264-Q267 PolarHBondContact O-N 2.93Å; E264-M268 WeakPolarHBondContact O-CB 3.47Å; E264-M268 VanDerWaalsContact O-CG 3.26Å; E264-M268 WeakPolarHBondContact O-CG 3.33Å; E264-M268 PolarHBondContact O-N 3.43Å
265R84.8Confident81.6Confident133 Ų133110 Ų11050%0.50251%0.513SS..Hα-helixtrans-59.3-43.5176.2-165.7-171.176.7-136.9-4111.6A261 E262 M268 Q269A261-R265 VanDerWaalsContact O-CB 3.27Å; A261-R265 WeakPolarHBondContact O-CB 3.28Å; A261-R265 PolarHBondContact O-N 2.88Å; E262-R265 PolarHBondContact O-N 3.5Å; E262-R265 IonicContact OE1-CZ 2.93Å; E262-R265 IonicContact OE1-NH1 2.74Å; E262-R265 PolarHBondContact OE1-NH1 2.82Å; E262-R265 IonicContact OE1-NH2 3.89Å; E262-R265 PolarHBondContact OE1-NH2 3.44Å; R265-M268 PolarHBondContact O-N 3.29Å; R265-Q269 HydrophobicContact CG-CG 4.42Å; R265-Q269 VanDerWaalsContact NE-OE1 3.16Å; R265-Q269 WeakPolarHBondContact O-CB 3.35Å; R265-Q269 VanDerWaalsContact O-CG 3.26Å; R265-Q269 WeakPolarHBondContact O-CG 3.47Å; R265-Q269 PolarHBondContact O-N 2.93Å
266S81.1Confident81.4Confident55 Ų55107 Ų10739%0.38551%0.505SS..Hα-helixtrans-64.7-42178.4179.80000112.2E262 R263 E264 Q269 N270E262-S266 WeakPolarHBondContact O-CB 3.4Å; E262-S266 PolarHBondContact O-N 2.81Å; R263-S266 PolarHBondContact O-N 3.15Å; E264-S266 VanDerWaalsContact C-N 3.34Å; E264-S266 PolarHBondContact O-N 2.74Å; S266-Q269 PolarHBondContact O-N 3.31Å; S266-N270 WeakPolarHBondContact O-CB 3.48Å; S266-N270 PolarHBondContact O-N 2.92Å; S266-N270 PolarHBondContact O-ND2 2.96Å; S266-N270 PolarHBondContact O-OD1 3.44Å
267Q82.9Confident81.3Confident121 Ų121104.6 Ų104.657%0.56550%0.503SS*.Hα-helixtrans-61.2-45.9173.9-72.2179.30.100111.6R263 E264 Q269 N270 Q271R263-Q267 WeakPolarHBondContact O-CG 3.42Å; R263-Q267 PolarHBondContact O-N 2.88Å; E264-Q267 PolarHBondContact O-N 2.93Å; Q267-Q269 PolarHBondContact O-N 3.24Å; Q267-N270 PolarHBondContact O-N 3.48Å; Q267-Q271 WeakPolarHBondContact O-CG 3.48Å; Q267-Q271 PolarHBondContact O-N 2.83Å
268M78.2Confident81.2Confident127 Ų127102 Ų10263%0.62650%0.498SS*.Hα-helixtrans-64.4-38177.2-67.9-71.8170.400112.4E264 R265 L272E264-M268 WeakPolarHBondContact O-CB 3.47Å; E264-M268 VanDerWaalsContact O-CG 3.26Å; E264-M268 WeakPolarHBondContact O-CG 3.33Å; E264-M268 PolarHBondContact O-N 3.43Å; R265-M268 PolarHBondContact O-N 3.29Å; M268-L272 VanDerWaalsContact O-CB 3.3Å; M268-L272 WeakPolarHBondContact O-CB 3.49Å; M268-L272 PolarHBondContact O-N 3.1Å
269Q82.6Confident81Confident103 Ų103101.6 Ų101.648%0.48150%0.495SS..Hα-helixtrans-67.1-39.7175.1-74.2-179-80.800111.9R265 S266 Q267 L272 H273R265-Q269 HydrophobicContact CG-CG 4.42Å; R265-Q269 VanDerWaalsContact NE-OE1 3.16Å; R265-Q269 WeakPolarHBondContact O-CB 3.35Å; R265-Q269 VanDerWaalsContact O-CG 3.26Å; R265-Q269 WeakPolarHBondContact O-CG 3.47Å; R265-Q269 PolarHBondContact O-N 2.93Å; S266-Q269 PolarHBondContact O-N 3.31Å; Q267-Q269 PolarHBondContact O-N 3.24Å; Q269-L272 PolarHBondContact O-N 3.47Å; Q269-H273 WeakPolarHBondContact O-CB 3.42Å; Q269-H273 PolarHBondContact O-N 3.17Å
270N80.1Confident80.8Confident106 Ų106101.8 Ų101.857%0.56750%0.499SS*.Hα-helixtrans-67.5-42.8176.1-67.7-11.4000111.6S266 Q267 H273 Q274S266-N270 WeakPolarHBondContact O-CB 3.48Å; S266-N270 PolarHBondContact O-N 2.92Å; S266-N270 PolarHBondContact O-ND2 2.96Å; S266-N270 PolarHBondContact O-OD1 3.44Å; Q267-N270 PolarHBondContact O-N 3.48Å; N270-H273 PolarHBondContact O-N 2.95Å; N270-Q274 WeakPolarHBondContact O-CB 3.25Å; N270-Q274 PolarHBondContact O-N 3.4Å
271Q82.6Confident80.7Confident107 Ų107101.7 Ų101.750%0.551%0.505SS..Hα-helixtrans-62.1-43.8174.3-73.7175.4-0.900111.9Q267 H273 Q274 I275Q267-Q271 WeakPolarHBondContact O-CG 3.48Å; Q267-Q271 PolarHBondContact O-N 2.83Å; Q271-H273 PolarHBondContact O-N 3.11Å; Q271-Q274 PolarHBondContact O-N 3.39Å; Q271-I275 VanDerWaalsContact O-CG1 3.31Å; Q271-I275 WeakPolarHBondContact O-CG1 3.39Å; Q271-I275 PolarHBondContact O-N 3.45Å
272L80.6Confident80.6Confident103 Ų103104.1 Ų104.154%0.53951%0.514SS..Hα-helixtrans-59.6-45.9175.1-17771.9000111.5M268 Q269 I275 Q276M268-L272 VanDerWaalsContact O-CB 3.3Å; M268-L272 WeakPolarHBondContact O-CB 3.49Å; M268-L272 PolarHBondContact O-N 3.1Å; Q269-L272 PolarHBondContact O-N 3.47Å; L272-I275 PolarHBondContact O-N 2.93Å; L272-Q276 VanDerWaalsContact O-CG 3.29Å; L272-Q276 WeakPolarHBondContact O-CG 3.29Å; L272-Q276 PolarHBondContact O-N 2.84Å
273H82.5Confident80.4Confident105 Ų105104.8 Ų104.849%0.48652%0.518SS..Hα-helixtrans-66.7-38.3-179.9-173.444.2000112.4Q269 N270 Q271 Q276 L277Q269-H273 WeakPolarHBondContact O-CB 3.42Å; Q269-H273 PolarHBondContact O-N 3.17Å; N270-H273 PolarHBondContact O-N 2.95Å; Q271-H273 PolarHBondContact O-N 3.11Å; H273-Q276 WeakPolarHBondContact O-CB 3.41Å; H273-Q276 PolarHBondContact O-N 3.49Å; H273-L277 WeakPolarHBondContact O-CG 3.36Å; H273-L277 PolarHBondContact O-N 2.81Å
274Q80Confident80.1Confident117 Ų117101.9 Ų101.955%0.54752%0.517SS..Hα-helixtrans-64.5-44.3174.7-175.2173.5-19.800111.7N270 Q271 Q276 L277 E278N270-Q274 WeakPolarHBondContact O-CB 3.25Å; N270-Q274 PolarHBondContact O-N 3.4Å; Q271-Q274 PolarHBondContact O-N 3.39Å; Q274-Q276 VanDerWaalsContact C-N 3.27Å; Q274-Q276 PolarHBondContact O-N 2.96Å; Q274-L277 PolarHBondContact O-N 2.84Å; Q274-E278 WeakPolarHBondContact CG-OE1 3.26Å; Q274-E278 PolarHBondContact NE2-OE1 3.23Å; Q274-E278 WeakPolarHBondContact O-CG 3.26Å; Q274-E278 PolarHBondContact O-N 2.8Å
275I78.9Confident79.7Confident108 Ų10898.3 Ų98.355%0.55451%0.51SS*.Hα-helixtrans-63.6-33175.1-68.4166.6000111.5Q271 L272 L279Q271-I275 VanDerWaalsContact O-CG1 3.31Å; Q271-I275 WeakPolarHBondContact O-CG1 3.39Å; Q271-I275 PolarHBondContact O-N 3.45Å; L272-I275 PolarHBondContact O-N 2.93Å; I275-L279 VanDerWaalsContact O-CB 3.3Å; I275-L279 WeakPolarHBondContact O-CB 3.44Å; I275-L279 PolarHBondContact O-N 3.36Å
276Q81.1Confident79.1Confident90 Ų9097.6 Ų97.642%0.42152%0.515SS..Hα-helixtrans-66.3-46.3172.4-75.2169.8-25.500111.9L272 H273 Q274 E278 L279 D280L272-Q276 VanDerWaalsContact O-CG 3.29Å; L272-Q276 WeakPolarHBondContact O-CG 3.29Å; L272-Q276 PolarHBondContact O-N 2.84Å; H273-Q276 WeakPolarHBondContact O-CB 3.41Å; H273-Q276 PolarHBondContact O-N 3.49Å; Q274-Q276 VanDerWaalsContact C-N 3.27Å; Q274-Q276 PolarHBondContact O-N 2.96Å; Q276-E278 VanDerWaalsContact C-N 3.33Å; Q276-E278 PolarHBondContact O-N 3.05Å; Q276-L279 WeakPolarHBondContact O-CB 3.33Å; Q276-L279 PolarHBondContact O-N 3.42Å; Q276-D280 WeakPolarHBondContact O-CB 3.32Å; Q276-D280 VanDerWaalsContact O-CG 3.29Å; Q276-D280 PolarHBondContact O-N 2.81Å
277L81.9Confident78.8Confident97 Ų97101.8 Ų101.851%0.50853%0.529SS..Hα-helixtrans-62.7-38.7176.2-70169.9000112.3H273 Q274 S281H273-L277 WeakPolarHBondContact O-CG 3.36Å; H273-L277 PolarHBondContact O-N 2.81Å; Q274-L277 PolarHBondContact O-N 2.84Å; L277-S281 WeakPolarHBondContact O-CB 3.44Å; L277-S281 PolarHBondContact O-N 3.5Å
278E80.6Confident78.3Confident105 Ų105101.9 Ų101.949%0.49153%0.529SS..Hα-helixtrans-65-39.7173.7-72.2170.5-164.800111.6Q274 Q276 V282Q274-E278 WeakPolarHBondContact CG-OE1 3.26Å; Q274-E278 PolarHBondContact NE2-OE1 3.23Å; Q274-E278 WeakPolarHBondContact O-CG 3.26Å; Q274-E278 PolarHBondContact O-N 2.8Å; Q276-E278 VanDerWaalsContact C-N 3.33Å; Q276-E278 PolarHBondContact O-N 3.05Å; E278-V282 VanDerWaalsContact O-CG2 3.31Å; E278-V282 WeakPolarHBondContact O-CG2 3.47Å; E278-V282 PolarHBondContact O-N 3.27Å; E278-V282 VanDerWaalsContact O-N 3.12Å
279L76.7Confident77.9Confident94 Ų94102.7 Ų102.749%0.49253%0.531SS..Hα-helixtrans-66.4-48.8175.8-179.165.7000112.4I275 Q276 S281 V282 Q283I275-L279 VanDerWaalsContact O-CB 3.3Å; I275-L279 WeakPolarHBondContact O-CB 3.44Å; I275-L279 PolarHBondContact O-N 3.36Å; Q276-L279 WeakPolarHBondContact O-CB 3.33Å; Q276-L279 PolarHBondContact O-N 3.42Å; L279-S281 VanDerWaalsContact C-N 3.32Å; L279-S281 PolarHBondContact O-N 3.45Å; L279-V282 PolarHBondContact O-N 2.83Å; L279-Q283 WeakPolarHBondContact O-CG 3.31Å; L279-Q283 PolarHBondContact O-N 2.81Å
280D77.3Confident77.5Confident93 Ų93100.8 Ų100.850%0.49753%0.529SS..Hα-helixtrans-64-39.3179.9-67.5-12.8000110.7Q276 V282 Q283 S284Q276-D280 WeakPolarHBondContact O-CB 3.32Å; Q276-D280 VanDerWaalsContact O-CG 3.29Å; Q276-D280 PolarHBondContact O-N 2.81Å; D280-V282 PolarHBondContact O-N 3.39Å; D280-Q283 PolarHBondContact O-N 3.32Å; D280-S284 WeakPolarHBondContact O-CB 3.4Å; D280-S284 PolarHBondContact O-N 3.14Å
281S79.1Confident77.3Confident78 Ų7898.7 Ų98.755%0.54552%0.523SS..Hα-helixtrans-59.2-45.2173-179.60000112.3L277 L279 A285L277-S281 WeakPolarHBondContact O-CB 3.44Å; L277-S281 PolarHBondContact O-N 3.5Å; L279-S281 VanDerWaalsContact C-N 3.32Å; L279-S281 PolarHBondContact O-N 3.45Å; S281-A285 WeakPolarHBondContact O-CB 3.24Å; S281-A285 PolarHBondContact O-N 3.06Å; S281-A285 VanDerWaalsContact O-N 3.11Å
282V75.5Confident76.9Confident100 Ų10099 Ų9961%0.60653%0.527SS*.Hα-helixtrans-70.5-34.7179.3169.50000111.5E278 L279 D280 L286E278-V282 VanDerWaalsContact O-CG2 3.31Å; E278-V282 WeakPolarHBondContact O-CG2 3.47Å; E278-V282 PolarHBondContact O-N 3.27Å; E278-V282 VanDerWaalsContact O-N 3.12Å; L279-V282 PolarHBondContact O-N 2.83Å; D280-V282 PolarHBondContact O-N 3.39Å; V282-L286 WeakPolarHBondContact O-CB 3.4Å; V282-L286 PolarHBondContact O-N 3.38Å; V282-L286 VanDerWaalsContact O-N 3.1Å
283Q77.3Confident76.6Confident100 Ų100101.8 Ų101.847%0.46753%0.531SS..Hα-helixtrans-65.9-47.4173.9-72.5-18026.500111.7L279 D280 A285 L286 E287L279-Q283 WeakPolarHBondContact O-CG 3.31Å; L279-Q283 PolarHBondContact O-N 2.81Å; D280-Q283 PolarHBondContact O-N 3.32Å; Q283-A285 VanDerWaalsContact C-N 3.34Å; Q283-A285 PolarHBondContact O-N 3.33Å; Q283-L286 PolarHBondContact O-N 3.49Å; Q283-E287 PolarHBondContact O-N 3.05Å
284S75.3Confident76.3Confident67 Ų67101.8 Ų101.847%0.46953%0.534SS..Hα-helixtrans-59.2-43.6177.5-168.80000112D280 L286 E287 E288D280-S284 WeakPolarHBondContact O-CB 3.4Å; D280-S284 PolarHBondContact O-N 3.14Å; S284-L286 VanDerWaalsContact C-N 3.34Å; S284-L286 PolarHBondContact O-N 2.84Å; S284-E287 PolarHBondContact O-N 3Å; S284-E288 PolarHBondContact O-N 3.23Å
285A74.1Confident76Confident55 Ų55101.3 Ų101.346%0.45553%0.532SS..Hα-helixtrans-63.8-38177.400000112.6S281 Q283 E289S281-A285 WeakPolarHBondContact O-CB 3.24Å; S281-A285 PolarHBondContact O-N 3.06Å; S281-A285 VanDerWaalsContact O-N 3.11Å; Q283-A285 VanDerWaalsContact C-N 3.34Å; Q283-A285 PolarHBondContact O-N 3.33Å; A285-E289 WeakPolarHBondContact O-CB 3.39Å; A285-E289 PolarHBondContact O-N 3.35Å
286L72.7Confident75.4Confident118 Ų11898.9 Ų98.962%0.61853%0.528SS*.Hα-helixtrans-68.8-39.5177.4-176.865.3000112.2V282 Q283 S284 S290V282-L286 WeakPolarHBondContact O-CB 3.4Å; V282-L286 PolarHBondContact O-N 3.38Å; V282-L286 VanDerWaalsContact O-N 3.1Å; Q283-L286 PolarHBondContact O-N 3.49Å; S284-L286 VanDerWaalsContact C-N 3.34Å; S284-L286 PolarHBondContact O-N 2.84Å; L286-S290 WeakPolarHBondContact O-CB 3.41Å; L286-S290 PolarHBondContact O-N 3.02Å; L286-S290 VanDerWaalsContact O-N 3.08Å
287E75Confident75Confident143 Ų14399.7 Ų99.767%0.66853%0.532SS*.Hα-helixtrans-65.7-46.3174.7-70.6-165.5162.400111.4Q283 S284 S290 S291Q283-E287 PolarHBondContact O-N 3.05Å; S284-E287 PolarHBondContact O-N 3Å; E287-S290 PolarHBondContact O-N 3.39Å; E287-S290 PolarHBondContact O-OG 2.95Å; E287-S291 PolarHBondContact O-N 3.12Å
288E72.6Confident74.6Confident124 Ų124101 Ų10158%0.57954%0.535SS*.Hα-helixtrans-58.2-51.2176-76.3-167.7151.100112S284 S290 S291 L292S284-E288 PolarHBondContact O-N 3.23Å; E288-S290 VanDerWaalsContact C-N 3.29Å; E288-S290 PolarHBondContact O-N 2.92Å; E288-S291 PolarHBondContact O-N 2.68Å; E288-S291 VanDerWaalsContact O-N 3.09Å; E288-S291 PolarHBondContact O-OG 3.47Å; E288-L292 WeakPolarHBondContact O-CG 3.45Å; E288-L292 PolarHBondContact O-N 2.92Å
289E69.5Low74.2Confident143 Ų143101.9 Ų101.967%0.66854%0.538SS*.Hα-helixtrans-61.1-38.4179.9-165.7-177.3-129.400111.7A285 S291 R293A285-E289 WeakPolarHBondContact O-CB 3.39Å; A285-E289 PolarHBondContact O-N 3.35Å; E289-S291 VanDerWaalsContact C-N 3.35Å; E289-S291 PolarHBondContact O-N 2.72Å; E289-R293 VanDerWaalsContact O-CB 3.31Å; E289-R293 WeakPolarHBondContact O-CB 3.23Å; E289-R293 PolarHBondContact O-N 2.93Å
290S75Confident73.7Confident63 Ų63103 Ų10344%0.44154%0.544SS..Hα-helixtrans-63.5-38.8175.1840000112.6L286 E287 E288 N294L286-S290 WeakPolarHBondContact O-CB 3.41Å; L286-S290 PolarHBondContact O-N 3.02Å; L286-S290 VanDerWaalsContact O-N 3.08Å; E287-S290 PolarHBondContact O-N 3.39Å; E287-S290 PolarHBondContact O-OG 2.95Å; E288-S290 VanDerWaalsContact C-N 3.29Å; E288-S290 PolarHBondContact O-N 2.92Å; S290-N294 PolarHBondContact O-N 2.88Å; S290-N294 PolarHBondContact O-ND2 3.44Å
291S75.2Confident73.5Confident62 Ų62102.4 Ų102.443%0.43455%0.546SS..Hα-helixtrans-70.8-45.9-179.476.10000111.9E287 E288 E289 R293 N294 E295E287-S291 PolarHBondContact O-N 3.12Å; E288-S291 PolarHBondContact O-N 2.68Å; E288-S291 VanDerWaalsContact O-N 3.09Å; E288-S291 PolarHBondContact O-OG 3.47Å; E289-S291 VanDerWaalsContact C-N 3.35Å; E289-S291 PolarHBondContact O-N 2.72Å; S291-R293 VanDerWaalsContact C-N 3.32Å; S291-R293 PolarHBondContact O-N 2.97Å; S291-N294 PolarHBondContact O-N 3.5Å; S291-E295 PolarHBondContact O-N 3.23Å
292L74.1Confident73.1Confident113 Ų113103.1 Ų103.159%0.59254%0.544SS*.Hα-helixtrans-63.1-39.3178.8-69.7170.9000111.5E288 E295 A296E288-L292 WeakPolarHBondContact O-CG 3.45Å; E288-L292 PolarHBondContact O-N 2.92Å; L292-E295 PolarHBondContact O-N 3.34Å; L292-A296 WeakPolarHBondContact O-CB 3.21Å; L292-A296 PolarHBondContact O-N 2.86Å
293R75.2Confident72.6Confident162 Ų162100.4 Ų100.461%0.61153%0.532SS*.Hα-helixtrans-61.3-47.4174.1-179.3179167.5-168.2-10.6112.1E289 S291 E295 A296 E297E289-R293 VanDerWaalsContact O-CB 3.31Å; E289-R293 WeakPolarHBondContact O-CB 3.23Å; E289-R293 PolarHBondContact O-N 2.93Å; S291-R293 VanDerWaalsContact C-N 3.32Å; S291-R293 PolarHBondContact O-N 2.97Å; R293-E295 VanDerWaalsContact C-N 3.34Å; R293-E295 PolarHBondContact O-N 3.24Å; R293-A296 PolarHBondContact O-N 3.42Å; R293-E297 IonicContact CZ-OE1 3.24Å; R293-E297 VanDerWaalsContact CZ-OE1 3.25Å; R293-E297 IonicContact NE-OE1 3.68Å; R293-E297 PolarHBondContact NE-OE1 3.24Å; R293-E297 IonicContact NH2-OE1 2.97Å; R293-E297 PolarHBondContact NH2-OE1 3.19Å; R293-E297 PolarHBondContact O-N 2.85Å
294N74.9Confident72.3Confident105 Ų105100.3 Ų100.356%0.56154%0.535SS*.Hα-helixtrans-62.8-39.6179.4-73.6-39.3000112S290 S291 H298S290-N294 PolarHBondContact O-N 2.88Å; S290-N294 PolarHBondContact O-ND2 3.44Å; S291-N294 PolarHBondContact O-N 3.5Å; N294-H298 PolarHBondContact O-N 2.93Å
295E73.7Confident71.9Confident108 Ų108101 Ų10151%0.50554%0.536SS..Hα-helixtrans-64.8-39.6172.6-75-149.9159.600113S291 L292 R293 H298 K299S291-E295 PolarHBondContact O-N 3.23Å; L292-E295 PolarHBondContact O-N 3.34Å; R293-E295 VanDerWaalsContact C-N 3.34Å; R293-E295 PolarHBondContact O-N 3.24Å; E295-H298 PolarHBondContact O-N 2.87Å; E295-K299 WeakPolarHBondContact O-CB 3.26Å; E295-K299 VanDerWaalsContact O-CG 3.28Å; E295-K299 WeakPolarHBondContact O-CG 3.45Å; E295-K299 PolarHBondContact O-N 2.85Å; E295-K299 WeakPolarHBondContact OE2-CE 3.31Å; E295-K299 IonicContact OE2-NZ 2.81Å; E295-K299 PolarHBondContact OE2-NZ 2.88Å
296A67.2Low71.6Confident57 Ų57104 Ų10447%0.47154%0.54SS..Hα-helixtrans-65-45.9-179.900000111.9L292 R293 H298 K299 L300L292-A296 WeakPolarHBondContact O-CB 3.21Å; L292-A296 PolarHBondContact O-N 2.86Å; R293-A296 PolarHBondContact O-N 3.42Å; A296-H298 VanDerWaalsContact C-N 3.31Å; A296-H298 PolarHBondContact O-N 2.76Å; A296-K299 PolarHBondContact O-N 3.23Å; A296-L300 WeakPolarHBondContact O-CB 3.36Å; A296-L300 PolarHBondContact O-N 3.47Å
297E71.7Confident71.1Confident107 Ų107102.7 Ų102.750%0.553%0.533SS..Hα-helixtrans-60.9-38.9176.4-69.8-175.1-160.700111.4R293 S301R293-E297 IonicContact CZ-OE1 3.24Å; R293-E297 VanDerWaalsContact CZ-OE1 3.25Å; R293-E297 IonicContact NE-OE1 3.68Å; R293-E297 PolarHBondContact NE-OE1 3.24Å; R293-E297 IonicContact NH2-OE1 2.97Å; R293-E297 PolarHBondContact NH2-OE1 3.19Å; R293-E297 PolarHBondContact O-N 2.85Å; E297-S301 PolarHBondContact O-N 3.38Å
298H73.5Confident70.4Confident124 Ų12499.1 Ų99.157%0.57453%0.528SS*.Hα-helixtrans-68.1-47.9175.8-176.3-93.6000113.3N294 E295 A296 L300 S301 L302N294-H298 PolarHBondContact O-N 2.93Å; E295-H298 PolarHBondContact O-N 2.87Å; A296-H298 VanDerWaalsContact C-N 3.31Å; A296-H298 PolarHBondContact O-N 2.76Å; H298-L300 VanDerWaalsContact C-N 3.3Å; H298-L300 PolarHBondContact O-N 3.03Å; H298-S301 WeakPolarHBondContact O-CB 3.41Å; H298-S301 PolarHBondContact O-N 3.38Å; H298-L302 PolarHBondContact O-N 3.48Å
299K73.6Confident70.1Confident123 Ų12399.6 Ų99.654%0.53553%0.53SS..Hα-helixtrans-62.5-37.3-179.7-71.6166.5-170.8168.80111.9E295 A296 S301 L302 A303E295-K299 WeakPolarHBondContact O-CB 3.26Å; E295-K299 VanDerWaalsContact O-CG 3.28Å; E295-K299 WeakPolarHBondContact O-CG 3.45Å; E295-K299 PolarHBondContact O-N 2.85Å; E295-K299 WeakPolarHBondContact OE2-CE 3.31Å; E295-K299 IonicContact OE2-NZ 2.81Å; E295-K299 PolarHBondContact OE2-NZ 2.88Å; A296-K299 PolarHBondContact O-N 3.23Å; K299-S301 VanDerWaalsContact C-N 3.34Å; K299-S301 PolarHBondContact O-N 2.94Å; K299-L302 PolarHBondContact O-N 3.16Å; K299-A303 PolarHBondContact O-N 2.67Å
300L65.1Low69.9Low119 Ų11999.9 Ų99.962%0.62353%0.525SS*.Hα-helixtrans-69.2-29.5178.6-167.2136.9000112.7A296 H298 N304A296-L300 WeakPolarHBondContact O-CB 3.36Å; A296-L300 PolarHBondContact O-N 3.47Å; H298-L300 VanDerWaalsContact C-N 3.3Å; H298-L300 PolarHBondContact O-N 3.03Å; L300-N304 PolarHBondContact O-N 3.04Å; L300-N304 PolarHBondContact O-ND2 2.86Å
301S72.3Confident69.2Low79 Ų79103.4 Ų103.455%0.55253%0.533SS*.Hα-helixtrans-63.9-50.4173.6-173.80000112.1E297 H298 K299 N304E297-S301 PolarHBondContact O-N 3.38Å; H298-S301 WeakPolarHBondContact O-CB 3.41Å; H298-S301 PolarHBondContact O-N 3.38Å; K299-S301 VanDerWaalsContact C-N 3.34Å; K299-S301 PolarHBondContact O-N 2.94Å; S301-N304 PolarHBondContact O-N 3.36Å
302L72.7Confident68.4Low93 Ų93105.3 Ų105.349%0.48755%0.546SS..Hα-helixtrans-60.7-51.1-179.4-74.4167.2000112.1H298 K299 N304 T305 E306H298-L302 PolarHBondContact O-N 3.48Å; K299-L302 PolarHBondContact O-N 3.16Å; L302-N304 VanDerWaalsContact C-N 3.25Å; L302-N304 PolarHBondContact O-N 2.97Å; L302-T305 PolarHBondContact O-N 2.85Å; L302-T305 PolarHBondContact O-OG1 3.22Å; L302-E306 PolarHBondContact O-N 3.48Å
303A63.9Low67.7Low43 Ų43106.1 Ų106.136%0.35555%0.545SS..Hα-helixtrans-56.9-37.7-176.300000112.9K299 T305 E306 I307K299-A303 PolarHBondContact O-N 2.67Å; A303-T305 VanDerWaalsContact C-N 3.29Å; A303-T305 PolarHBondContact O-N 2.92Å; A303-E306 PolarHBondContact O-N 3.38Å; A303-I307 WeakPolarHBondContact O-CD1 3.17Å; A303-I307 VanDerWaalsContact O-CG1 3.25Å; A303-I307 WeakPolarHBondContact O-CG1 3.36Å; A303-I307 PolarHBondContact O-N 2.93Å; A303-I307 VanDerWaalsContact O-N 3.13Å
304N70.4Confident66.8Low99 Ų99103.7 Ų103.753%0.52954%0.539SS..Hα-helixtrans-63.7-31.1177.2-83.4-66.1000113.3L300 S301 L302L300-N304 PolarHBondContact O-N 3.04Å; L300-N304 PolarHBondContact O-ND2 2.86Å; S301-N304 PolarHBondContact O-N 3.36Å; L302-N304 VanDerWaalsContact C-N 3.25Å; L302-N304 PolarHBondContact O-N 2.97Å
305T67.6Low66Low80 Ų80105.2 Ų105.249%0.49155%0.547SS..Hα-helixtrans-77.4-32.7177.164.50000113.3L302 A303L302-T305 PolarHBondContact O-N 2.85Å; L302-T305 PolarHBondContact O-OG1 3.22Å; A303-T305 VanDerWaalsContact C-N 3.29Å; A303-T305 PolarHBondContact O-N 2.92Å
306E67.4Low65.2Low118 Ų118103.7 Ų103.755%0.55155%0.553SS**Hα-helixtrans-73.7-41.9178.4-62.9-173.1144.800111.9L302 A303 A308 Q309 W310L302-E306 PolarHBondContact O-N 3.48Å; A303-E306 PolarHBondContact O-N 3.38Å; E306-A308 PolarHBondContact O-N 3.48Å; E306-Q309 PolarHBondContact O-N 2.98Å; E306-W310 VanDerWaalsContact O-CD1 3.32Å; E306-W310 PolarHBondContact O-N 3.38Å
307I62.4Low64.8Low92 Ų92107.6 Ų107.647%0.47256%0.561SS.*Hα-helixtrans-57.6-34.7178.1-70.7166.5000111.7A303 K311A303-I307 WeakPolarHBondContact O-CD1 3.17Å; A303-I307 VanDerWaalsContact O-CG1 3.25Å; A303-I307 WeakPolarHBondContact O-CG1 3.36Å; A303-I307 PolarHBondContact O-N 2.93Å; A303-I307 VanDerWaalsContact O-N 3.13Å; I307-K311 PolarHBondContact O-N 3.28Å
308A61.3Low64Low67 Ų67106.2 Ų106.255%0.55456%0.56SS**Hα-helixtrans-66.8-36.3176.700000113E306E306-A308 PolarHBondContact O-N 3.48Å
309Q66.4Low63.3Low135 Ų135104.7 Ų104.763%0.63157%0.569SS**Hα-helixtrans-76.2-38.1-179-63.2-172.525.100112.7E306E306-Q309 PolarHBondContact O-N 2.98Å
310W64.4Low62.6Low148 Ų148105 Ų10556%0.56158%0.575SS**Hα-helixtrans-72.2-37.4-175.9-77.3110.1000113.7E306 S312 K313 F314E306-W310 VanDerWaalsContact O-CD1 3.32Å; E306-W310 PolarHBondContact O-N 3.38Å; W310-S312 VanDerWaalsContact C-N 3.3Å; W310-S312 PolarHBondContact O-N 3.21Å; W310-K313 PolarHBondContact O-N 3.37Å; W310-K313 VanDerWaalsContact O-N 3.11Å; W310-F314 HydrophobicContact CD2-CE2 4.48Å; W310-F314 HydrophobicContact CE3-CD2 4.18Å; W310-F314 AromaticContact CE3-CE2 3.66Å; W310-F314 HydrophobicContact CE3-CE2 3.66Å; W310-F314 HydrophobicContact CZ3-CE2 4.19Å; W310-F314 PolarHBondContact O-N 3.39Å
311K59.4Low62.3Low138 Ų138104.3 Ų104.360%0.657%0.568SS**Hα-helixtrans-55.2-45.1176.3-76.5-177.2174.7-176.50112.3I307 K313 F314I307-K311 PolarHBondContact O-N 3.28Å; K311-K313 PolarHBondContact O-N 2.92Å; K311-F314 PolarHBondContact O-N 2.95Å
312S58.6Low61.7Low102 Ų102105.7 Ų105.771%0.71357%0.566SS**Hα-helixtrans-63.6-10.3-179.2-1720000115.1W310W310-S312 VanDerWaalsContact C-N 3.3Å; W310-S312 PolarHBondContact O-N 3.21Å
313K59.2Low61Low130 Ų130110 Ų11057%0.56558%0.584SS**Hα-helixtrans-104.8-44177.2-65.9-176.8179.8175.30112.4W310 K311 D315 A316W310-K313 PolarHBondContact O-N 3.37Å; W310-K313 VanDerWaalsContact O-N 3.11Å; K311-K313 PolarHBondContact O-N 2.92Å; K313-D315 PolarHBondContact O-N 2.66Å; K313-A316 PolarHBondContact O-N 3.18Å
314F58.1Low60.8Low110 Ų110114.3 Ų114.348%0.48260%0.597SS.*Hα-helixtrans-66.4-33.4-174.3-87.9-71.5000113.9W310 K311 A316 E317 V318W310-F314 HydrophobicContact CD2-CE2 4.48Å; W310-F314 HydrophobicContact CE3-CD2 4.18Å; W310-F314 AromaticContact CE3-CE2 3.66Å; W310-F314 HydrophobicContact CE3-CE2 3.66Å; W310-F314 HydrophobicContact CZ3-CE2 4.19Å; W310-F314 PolarHBondContact O-N 3.39Å; K311-F314 PolarHBondContact O-N 2.95Å; F314-A316 PolarHBondContact O-N 3.28Å; F314-E317 PolarHBondContact O-N 2.94Å; F314-V318 HydrophobicContact CD1-CG2 4.48Å; F314-V318 WeakPolarHBondContact O-CG2 3.45Å; F314-V318 PolarHBondContact O-N 2.96Å
315D56.6Low60.3Low137 Ų137112.6 Ų112.673%0.73359%0.59SS**Hα-helixtrans-62.2-14.9-179.4-68.1-16.9000113.7K313K313-D315 PolarHBondContact O-N 2.66Å
316A58Low60.2Low76 Ų76112.1 Ų112.163%0.62858%0.584SS**Hα-helixtrans-93.2-28.3-179.200000114.8K313 F314K313-A316 PolarHBondContact O-N 3.18Å; F314-A316 PolarHBondContact O-N 3.28Å
317E57.5Low60.4Low140 Ų140110.9 Ų110.965%0.65458%0.581SS**Hα-helixtrans-100-30.2-172.4-66.6-176.6151.400113.2F314 A319 I320F314-E317 PolarHBondContact O-N 2.94Å; E317-A319 PolarHBondContact O-N 3.25Å; E317-A319 VanDerWaalsContact O-N 3.15Å; E317-I320 PolarHBondContact O-N 2.94Å
318V56.1Low60.9Low78 Ų78112 Ų11247%0.47359%0.587SS.*THydrogen-bonded Turntrans-60.8-28.4-175.5171.20000112.9F314 I320F314-V318 HydrophobicContact CD1-CG2 4.48Å; F314-V318 WeakPolarHBondContact O-CG2 3.45Å; F314-V318 PolarHBondContact O-N 2.96Å; V318-I320 PolarHBondContact O-N 3.49Å; V318-I320 VanDerWaalsContact O-N 3.08Å
319A57.7Low61.6Low92 Ų92115.4 Ų115.476%0.7659%0.586SS**THydrogen-bonded Turntrans-66.3-9.1-176.600000115.5E317E317-A319 PolarHBondContact O-N 3.25Å; E317-A319 VanDerWaalsContact O-N 3.15Å
320I59.7Low62.2Low129 Ų129114.9 Ų114.966%0.66258%0.582SS**THydrogen-bonded Turntrans-108.8-30.1-169.8-57.6179.6000113.4E317 V318E317-I320 PolarHBondContact O-N 2.94Å; V318-I320 PolarHBondContact O-N 3.49Å; V318-I320 VanDerWaalsContact O-N 3.08Å
321H58.7Low62.9Low104 Ų104114.4 Ų114.448%0.48158%0.583SS.*  trans-119.319.6-167-71.1-82.8000115.3E323 E324H321-E323 VanDerWaalsContact C-N 3.3Å; H321-E323 PolarHBondContact O-N 2.93Å; H321-E323 VanDerWaalsContact O-N 3.12Å; H321-E324 IonicContact CE1-OE2 2.94Å; H321-E324 IonicContact CG-OE2 2.61Å; H321-E324 IonicContact ND1-OE2 4Å; H321-E324 PolarHBondContact ND1-OE2 3.17Å; H321-E324 PolarHBondContact O-N 3.4Å; H321-E324 VanDerWaalsContact O-N 3.17Å
322Q59.6Low63.8Low108 Ų108114.8 Ų114.851%0.50559%0.589SS.*Hα-helixtrans-52.4-39.2-169.8-168.868.643.600114.7
323E58.2Low65Low185 Ų185115.3 Ų115.386%0.86458%0.583SS**Hα-helixtrans-78.8-25.3-176.5-64.8-170.1138.800114.2H321H321-E323 VanDerWaalsContact C-N 3.3Å; H321-E323 PolarHBondContact O-N 2.93Å; H321-E323 VanDerWaalsContact O-N 3.12Å
324E58.5Low65.9Low132 Ų132115.6 Ų115.662%0.61759%0.586SS**Hα-helixtrans-78-24.8179.9-64.3-176.5119.600112.5H321H321-E324 IonicContact CE1-OE2 2.94Å; H321-E324 IonicContact CG-OE2 2.61Å; H321-E324 IonicContact ND1-OE2 4Å; H321-E324 PolarHBondContact ND1-OE2 3.17Å; H321-E324 PolarHBondContact O-N 3.4Å; H321-E324 VanDerWaalsContact O-N 3.17Å
325V61.5Low67.1Low64 Ų64115.7 Ų115.739%0.38859%0.587SS.*Hα-helixtrans-71.9-38.9-175.3171.90000112.7D327 L328 R329V325-D327 VanDerWaalsContact C-N 3.35Å; V325-D327 PolarHBondContact O-N 2.92Å; V325-L328 PolarHBondContact O-N 2.75Å; V325-R329 HydrophobicContact CG1-CG 4.44Å; V325-R329 PolarHBondContact O-N 3.15Å; V325-R329 VanDerWaalsContact O-N 3.08Å
326D65.5Low68.3Low70 Ų70114.4 Ų114.437%0.37458%0.576SS.*Hα-helixtrans-74.9-21.1-170.8-79.6-22000114R329 K330D326-R329 WeakPolarHBondContact OD1-CD 3.31Å; D326-R329 IonicContact OD1-CZ 3.79Å; D326-R329 IonicContact OD1-NH1 2.66Å; D326-R329 PolarHBondContact OD1-NH1 2.84Å; D326-K330 WeakPolarHBondContact O-CG 3.42Å
327D70.9Confident69.6Low92 Ų92113.2 Ų113.249%0.49257%0.566SS.*Hα-helixtrans-85.3-24.6173.7-113.730.9000113.3V325 K330V325-D327 VanDerWaalsContact C-N 3.35Å; V325-D327 PolarHBondContact O-N 2.92Å; D327-K330 IonicContact OD1-NZ 3.65Å; D327-K330 PolarHBondContact OD1-NZ 3.04Å
328L73.6Confident70.8Confident114 Ų114111.7 Ų111.760%0.59756%0.559SS**Hα-helixtrans-73-39.3168-77.6171.2000111.7V325 K330 K331 M332V325-L328 PolarHBondContact O-N 2.75Å; L328-K330 PolarHBondContact O-N 3.49Å; L328-K331 PolarHBondContact O-N 3.5Å; L328-M332 PolarHBondContact O-N 2.9Å; L328-M332 VanDerWaalsContact O-N 3.12Å
329R76.3Confident72.2Confident140 Ų140114 Ų11453%0.52856%0.56SS.*Hα-helixtrans-53.6-47.9175.5-83.7172.9160.6171.2-6.6113V325 D326 K331 M332 I333V325-R329 HydrophobicContact CG1-CG 4.44Å; V325-R329 PolarHBondContact O-N 3.15Å; V325-R329 VanDerWaalsContact O-N 3.08Å; D326-R329 WeakPolarHBondContact OD1-CD 3.31Å; D326-R329 IonicContact OD1-CZ 3.79Å; D326-R329 IonicContact OD1-NH1 2.66Å; D326-R329 PolarHBondContact OD1-NH1 2.84Å; R329-K331 VanDerWaalsContact C-N 3.28Å; R329-K331 PolarHBondContact O-N 3.47Å; R329-M332 PolarHBondContact O-N 3.47Å; R329-I333 WeakPolarHBondContact O-CG1 3.45Å; R329-I333 PolarHBondContact O-N 2.98Å
330K77.3Confident73.6Confident124 Ų124114.3 Ų114.354%0.53955%0.546SS..Hα-helixtrans-56.4-41.3179.4-66.6167-162.4159.60112.4D326 D327 L328 Q334D326-K330 WeakPolarHBondContact O-CG 3.42Å; D327-K330 IonicContact OD1-NZ 3.65Å; D327-K330 PolarHBondContact OD1-NZ 3.04Å; L328-K330 PolarHBondContact O-N 3.49Å; K330-Q334 PolarHBondContact O-N 3.21Å
331K79.6Confident74.8Confident137 Ų137114.2 Ų114.260%0.59654%0.543SS*.Hα-helixtrans-71.4-35.6179.8-67.6173.1-176.3165.50112.6L328 R329 K335L328-K331 PolarHBondContact O-N 3.5Å; R329-K331 VanDerWaalsContact C-N 3.28Å; R329-K331 PolarHBondContact O-N 3.47Å; K331-K335 PolarHBondContact O-N 3.42Å
332M79.1Confident76.3Confident146 Ų146114.4 Ų114.472%0.71954%0.544SS*.Hα-helixtrans-67.4-40.8173.9-81.5-174.515400112.3L328 R329 Q334 K335 Q336L328-M332 PolarHBondContact O-N 2.9Å; L328-M332 VanDerWaalsContact O-N 3.12Å; R329-M332 PolarHBondContact O-N 3.47Å; M332-Q334 PolarHBondContact O-N 3.02Å; M332-K335 PolarHBondContact O-N 3Å; M332-K335 VanDerWaalsContact O-N 3.17Å; M332-Q336 PolarHBondContact O-N 3.45Å
333I82.6Confident77.6Confident114 Ų114114.1 Ų114.159%0.58555%0.545SS*.Hα-helixtrans-61.3-43.1179.4-68.1164.1000111.6R329 K335 Q336 A337R329-I333 WeakPolarHBondContact O-CG1 3.45Å; R329-I333 PolarHBondContact O-N 2.98Å; I333-K335 VanDerWaalsContact C-N 3.34Å; I333-K335 PolarHBondContact O-N 3.34Å; I333-Q336 PolarHBondContact O-N 2.92Å; I333-A337 PolarHBondContact O-N 3.47Å
334Q79.8Confident79Confident136 Ų136111.3 Ų111.364%0.63653%0.531SS*.Hα-helixtrans-60.2-44.4174.5-71-172.1-71.100112K330 M332 Q336 A337 E338K330-Q334 PolarHBondContact O-N 3.21Å; M332-Q334 PolarHBondContact O-N 3.02Å; Q334-Q336 VanDerWaalsContact C-N 3.31Å; Q334-Q336 PolarHBondContact O-N 3.44Å; Q334-A337 PolarHBondContact O-N 2.93Å; Q334-E338 PolarHBondContact O-N 2.94Å
335K83.1Confident80.4Confident112 Ų112109.3 Ų109.349%0.48752%0.524SS..Hα-helixtrans-73.1-23.2-177.8-143.3-173.9-175-167.70113.7K331 M332 I333 Y339K331-K335 PolarHBondContact O-N 3.42Å; M332-K335 PolarHBondContact O-N 3Å; M332-K335 VanDerWaalsContact O-N 3.17Å; I333-K335 VanDerWaalsContact C-N 3.34Å; I333-K335 PolarHBondContact O-N 3.34Å; K335-Y339 HydrophobicContact CD-CE2 4.48Å; K335-Y339 HydrophobicContact CG-CE2 4.35Å; K335-Y339 WeakPolarHBondContact O-CD2 3.32Å
336Q81Confident81.7Confident110 Ų110111.9 Ų111.951%0.51453%0.533SS..Hα-helixtrans-67.2-48.7170178.1175.8-18.800110.3M332 I333 Q334 E338 Y339 E340M332-Q336 PolarHBondContact O-N 3.45Å; I333-Q336 PolarHBondContact O-N 2.92Å; Q334-Q336 VanDerWaalsContact C-N 3.31Å; Q334-Q336 PolarHBondContact O-N 3.44Å; Q336-E338 VanDerWaalsContact C-N 3.32Å; Q336-E338 PolarHBondContact O-N 2.92Å; Q336-Y339 PolarHBondContact O-N 3.47Å; Q336-E340 HydrophobicContact CG-CG 4.36Å; Q336-E340 VanDerWaalsContact CG-OE1 3.3Å; Q336-E340 WeakPolarHBondContact CG-OE1 3.25Å; Q336-E340 PolarHBondContact NE2-OE1 2.75Å; Q336-E340 WeakPolarHBondContact O-CG 3.4Å; Q336-E340 PolarHBondContact O-N 3.49Å
337A84.4Confident82.9Confident51 Ų51113.6 Ų113.642%0.42154%0.542SS..Hα-helixtrans-59.1-40177.800000112.8I333 Q334 Y339 E340 E341I333-A337 PolarHBondContact O-N 3.47Å; Q334-A337 PolarHBondContact O-N 2.93Å; A337-Y339 PolarHBondContact O-N 3.34Å; A337-E340 PolarHBondContact O-N 3.3Å; A337-E341 PolarHBondContact O-N 2.8Å
338E83.1Confident83.7Confident108 Ų108114.6 Ų114.651%0.50554%0.544SS..Hα-helixtrans-59.4-30.5174.7-72.4178171.200113.8Q334 Q336 Q342Q334-E338 PolarHBondContact O-N 2.94Å; Q336-E338 VanDerWaalsContact C-N 3.32Å; Q336-E338 PolarHBondContact O-N 2.92Å; E338-Q342 WeakPolarHBondContact O-CG 3.28Å; E338-Q342 PolarHBondContact O-NE2 2.87Å
339Y87Confident84.5Confident125 Ų125115.1 Ų115.149%0.4954%0.541SS..Hα-helixtrans-86.5-34.8176-72.4-52.8000112.4K335 Q336 A337 Q342 I343K335-Y339 HydrophobicContact CD-CE2 4.48Å; K335-Y339 HydrophobicContact CG-CE2 4.35Å; K335-Y339 WeakPolarHBondContact O-CD2 3.32Å; Q336-Y339 PolarHBondContact O-N 3.47Å; A337-Y339 PolarHBondContact O-N 3.34Å; Y339-Q342 PolarHBondContact O-N 2.79Å; Y339-I343 VanDerWaalsContact O-CG1 3.3Å; Y339-I343 WeakPolarHBondContact O-CG1 3.46Å; Y339-I343 PolarHBondContact O-N 3.45Å
340E85.5Confident85.1Confident100 Ų100112.7 Ų112.747%0.46754%0.538SS..Hα-helixtrans-62-44.8174.6-72168.2168.800110.8Q336 A337 Q342 I343 E344Q336-E340 HydrophobicContact CG-CG 4.36Å; Q336-E340 VanDerWaalsContact CG-OE1 3.3Å; Q336-E340 WeakPolarHBondContact CG-OE1 3.25Å; Q336-E340 PolarHBondContact NE2-OE1 2.75Å; Q336-E340 WeakPolarHBondContact O-CG 3.4Å; Q336-E340 PolarHBondContact O-N 3.49Å; A337-E340 PolarHBondContact O-N 3.3Å; E340-Q342 PolarHBondContact O-N 3.3Å; E340-I343 PolarHBondContact O-N 2.96Å; E340-E344 PolarHBondContact O-N 3.15Å
341E85.6Confident85.7Confident126 Ų126108.6 Ų108.659%0.58953%0.525SS*.Hα-helixtrans-59.7-42.6173.8-174.2178.8-172.500112.3A337 I343 E344 I345A337-E341 PolarHBondContact O-N 2.8Å; E341-I343 VanDerWaalsContact C-N 3.34Å; E341-I343 PolarHBondContact O-N 2.96Å; E341-E344 PolarHBondContact O-N 3.36Å; E341-I345 HydrophobicContact CG-CD1 4.12Å; E341-I345 VanDerWaalsContact O-CG1 3.3Å; E341-I345 WeakPolarHBondContact O-CG1 3.43Å; E341-I345 PolarHBondContact O-N 3.17Å
342Q89.2Confident86.2Confident109 Ų109108.2 Ų108.251%0.50953%0.525SS..Hα-helixtrans-65.6-35.1176.2-77.4174.366.200112.9E338 Y339 E340 M346E338-Q342 WeakPolarHBondContact O-CG 3.28Å; E338-Q342 PolarHBondContact O-NE2 2.87Å; Y339-Q342 PolarHBondContact O-N 2.79Å; E340-Q342 PolarHBondContact O-N 3.3Å; Q342-M346 WeakPolarHBondContact O-CG 3.36Å; Q342-M346 PolarHBondContact O-N 3.37Å; Q342-M346 VanDerWaalsContact O-N 3.12Å
343I88.2Confident86.7Confident101 Ų101106.8 Ų106.852%0.51852%0.52SS..Hα-helixtrans-68.1-44.5175.3-71.9165.6000110.2Y339 E340 E341 I345 M346 L347Y339-I343 VanDerWaalsContact O-CG1 3.3Å; Y339-I343 WeakPolarHBondContact O-CG1 3.46Å; Y339-I343 PolarHBondContact O-N 3.45Å; E340-I343 PolarHBondContact O-N 2.96Å; E341-I343 VanDerWaalsContact C-N 3.34Å; E341-I343 PolarHBondContact O-N 2.96Å; I343-I345 PolarHBondContact O-N 2.99Å; I343-M346 PolarHBondContact O-N 2.87Å; I343-L347 HydrophobicContact CG2-CD1 3.78Å; I343-L347 HydrophobicContact CG2-CG 4.26Å; I343-L347 WeakPolarHBondContact O-CB 3.37Å; I343-L347 WeakPolarHBondContact O-CG 3.28Å; I343-L347 PolarHBondContact O-N 2.63Å
344E87.3Confident87Confident126 Ų126107.2 Ų107.259%0.58952%0.519SS*.Hα-helixtrans-59.1-45174.8-71.8-159.8152.100112.2E340 E341 M346 L347 Q348E340-E344 PolarHBondContact O-N 3.15Å; E341-E344 PolarHBondContact O-N 3.36Å; E344-M346 VanDerWaalsContact C-N 3.3Å; E344-M346 PolarHBondContact O-N 2.93Å; E344-L347 PolarHBondContact O-N 2.82Å; E344-Q348 WeakPolarHBondContact O-CB 3.49Å; E344-Q348 VanDerWaalsContact O-CG 3.3Å; E344-Q348 WeakPolarHBondContact O-CG 3.47Å; E344-Q348 PolarHBondContact O-N 3.24Å
345I88.6Confident87.5Confident91 Ų91106.7 Ų106.747%0.46752%0.515SS..Hα-helixtrans-59.2-41.1176.9-69.9165.6000111.3E341 I343 K349E341-I345 HydrophobicContact CG-CD1 4.12Å; E341-I345 VanDerWaalsContact O-CG1 3.3Å; E341-I345 WeakPolarHBondContact O-CG1 3.43Å; E341-I345 PolarHBondContact O-N 3.17Å; I343-I345 PolarHBondContact O-N 2.99Å; I345-K349 WeakPolarHBondContact O-CB 3.3Å; I345-K349 PolarHBondContact O-N 2.85Å; I345-K349 VanDerWaalsContact O-N 3.1Å
346M88.1Confident87.7Confident118 Ų118103.6 Ų103.658%0.58151%0.51SS*.Hα-helixtrans-71.5-39.8177.6-69.4-64.8179.200112.5Q342 I343 E344 K349 I350Q342-M346 WeakPolarHBondContact O-CG 3.36Å; Q342-M346 PolarHBondContact O-N 3.37Å; Q342-M346 VanDerWaalsContact O-N 3.12Å; I343-M346 PolarHBondContact O-N 2.87Å; E344-M346 VanDerWaalsContact C-N 3.3Å; E344-M346 PolarHBondContact O-N 2.93Å; M346-K349 PolarHBondContact O-N 3.48Å; M346-I350 WeakPolarHBondContact O-CG1 3.48Å; M346-I350 PolarHBondContact O-N 2.76Å
347L90.1Very high88.2Confident106 Ų106104.7 Ų104.756%0.55551%0.513SS*.Hα-helixtrans-64.1-42.3175.1-72171.6000111.8I343 E344 K349 I350 S351I343-L347 HydrophobicContact CG2-CD1 3.78Å; I343-L347 HydrophobicContact CG2-CG 4.26Å; I343-L347 WeakPolarHBondContact O-CB 3.37Å; I343-L347 WeakPolarHBondContact O-CG 3.28Å; I343-L347 PolarHBondContact O-N 2.63Å; E344-L347 PolarHBondContact O-N 2.82Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 3.08Å; L347-I350 PolarHBondContact O-N 2.68Å; L347-S351 PolarHBondContact O-N 2.96Å
348Q88.6Confident88.4Confident113 Ų113105.5 Ų105.553%0.52852%0.516SS..Hα-helixtrans-59-41.9172.3-72.7179.728.800111.3E344 S351 Q352E344-Q348 WeakPolarHBondContact O-CB 3.49Å; E344-Q348 VanDerWaalsContact O-CG 3.3Å; E344-Q348 WeakPolarHBondContact O-CG 3.47Å; E344-Q348 PolarHBondContact O-N 3.24Å; Q348-S351 PolarHBondContact O-N 3.29Å; Q348-Q352 WeakPolarHBondContact O-CG 3.34Å; Q348-Q352 PolarHBondContact O-N 3.16Å
349K90Very high88.7Confident125 Ų125108.7 Ų108.754%0.54352%0.523SS..Hα-helixtrans-68.1-37.7178.6-165.9172.8-174.4176.30113I345 M346 L347 Q352 L353I345-K349 WeakPolarHBondContact O-CB 3.3Å; I345-K349 PolarHBondContact O-N 2.85Å; I345-K349 VanDerWaalsContact O-N 3.1Å; M346-K349 PolarHBondContact O-N 3.48Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 3.08Å; K349-Q352 PolarHBondContact O-N 2.99Å; K349-L353 WeakPolarHBondContact O-CG 3.48Å; K349-L353 PolarHBondContact O-N 3.08Å; K349-L353 VanDerWaalsContact O-N 3.08Å
350I89.6Confident88.8Confident88 Ų88107.8 Ų107.845%0.45153%0.526SS..Hα-helixtrans-62.9-49171.6-69.5166.3000109.8M346 L347 Q352 L353 E354M346-I350 WeakPolarHBondContact O-CG1 3.48Å; M346-I350 PolarHBondContact O-N 2.76Å; L347-I350 PolarHBondContact O-N 2.68Å; I350-Q352 VanDerWaalsContact C-N 3.27Å; I350-Q352 PolarHBondContact O-N 2.99Å; I350-L353 PolarHBondContact O-N 3.08Å; I350-E354 HydrophobicContact CG2-CG 4.33Å; I350-E354 WeakPolarHBondContact O-CG 3.33Å; I350-E354 PolarHBondContact O-N 3.2Å
351S89.6Confident89Confident38 Ų38107.5 Ų107.527%0.26653%0.525SS..Hα-helixtrans-59.4-35.6177.9-168.80000113L347 Q348 K355L347-S351 PolarHBondContact O-N 2.96Å; Q348-S351 PolarHBondContact O-N 3.29Å; S351-K355 WeakPolarHBondContact O-CB 3.32Å; S351-K355 VanDerWaalsContact O-CD 3.32Å; S351-K355 WeakPolarHBondContact O-CD 3.4Å; S351-K355 VanDerWaalsContact O-CG 3.24Å; S351-K355 WeakPolarHBondContact O-CG 3.41Å; S351-K355 PolarHBondContact O-N 3.03Å; S351-K355 VanDerWaalsContact O-N 3.07Å; S351-K355 PolarHBondContact OG-NZ 3.36Å
352Q89.8Confident89.2Confident129 Ų129104.1 Ų104.160%0.60352%0.515SS*.Hα-helixtrans-65.8-41.8172.7-73.6173.317.500112.3Q348 K349 I350 K355 A356Q348-Q352 WeakPolarHBondContact O-CG 3.34Å; Q348-Q352 PolarHBondContact O-N 3.16Å; K349-Q352 PolarHBondContact O-N 2.99Å; I350-Q352 VanDerWaalsContact C-N 3.27Å; I350-Q352 PolarHBondContact O-N 2.99Å; Q352-K355 PolarHBondContact O-N 3.41Å; Q352-A356 WeakPolarHBondContact O-CB 3.26Å; Q352-A356 PolarHBondContact O-N 3.14Å
353L89.4Confident89.3Confident117 Ų117104 Ų10461%0.61352%0.515SS*.Hα-helixtrans-68.8-37177.3-71.6170.2000112.5K349 I350 A356 K357K349-L353 WeakPolarHBondContact O-CG 3.48Å; K349-L353 PolarHBondContact O-N 3.08Å; K349-L353 VanDerWaalsContact O-N 3.08Å; I350-L353 PolarHBondContact O-N 3.08Å; L353-A356 PolarHBondContact O-N 2.87Å; L353-K357 WeakPolarHBondContact O-CB 3.33Å; L353-K357 PolarHBondContact O-N 3.36Å
354E88.3Confident89.4Confident122 Ų122103.2 Ų103.257%0.5751%0.514SS*.Hα-helixtrans-65.7-41.9174.1-70.1177.714500111.8I350 A356 K357 S358I350-E354 HydrophobicContact CG2-CG 4.33Å; I350-E354 WeakPolarHBondContact O-CG 3.33Å; I350-E354 PolarHBondContact O-N 3.2Å; E354-A356 VanDerWaalsContact C-N 3.3Å; E354-A356 PolarHBondContact O-N 3.41Å; E354-K357 PolarHBondContact O-N 3.5Å; E354-S358 PolarHBondContact O-N 3.35Å; E354-S358 PolarHBondContact O-OG 3.41Å
355K90.2Very high89.6Confident126 Ų126102.8 Ų102.855%0.54851%0.512SS..Hα-helixtrans-65.5-30.6173.1-73.1163.3-178.3148.40112.9S351 Q352 S358 R359S351-K355 WeakPolarHBondContact O-CB 3.32Å; S351-K355 VanDerWaalsContact O-CD 3.32Å; S351-K355 WeakPolarHBondContact O-CD 3.4Å; S351-K355 VanDerWaalsContact O-CG 3.24Å; S351-K355 WeakPolarHBondContact O-CG 3.41Å; S351-K355 PolarHBondContact O-N 3.03Å; S351-K355 VanDerWaalsContact O-N 3.07Å; S351-K355 PolarHBondContact OG-NZ 3.36Å; Q352-K355 PolarHBondContact O-N 3.41Å; K355-S358 PolarHBondContact O-OG 3.11Å; K355-R359 VanDerWaalsContact O-CG 3.31Å; K355-R359 WeakPolarHBondContact O-CG 3.41Å; K355-R359 PolarHBondContact O-N 3.29Å
356A87.6Confident89.7Confident46 Ų46102.5 Ų102.538%0.3852%0.515SS..Hα-helixtrans-73.3-41.7171.900000111.6Q352 L353 E354 R359 L360Q352-A356 WeakPolarHBondContact O-CB 3.26Å; Q352-A356 PolarHBondContact O-N 3.14Å; L353-A356 PolarHBondContact O-N 2.87Å; E354-A356 VanDerWaalsContact C-N 3.3Å; E354-A356 PolarHBondContact O-N 3.41Å; A356-R359 PolarHBondContact O-N 2.92Å; A356-L360 WeakPolarHBondContact O-CG 3.25Å; A356-L360 PolarHBondContact O-N 2.84Å
357K91.6Very high89.9Confident133 Ų133102.6 Ų102.658%0.57852%0.517SS*.Hα-helixtrans-61.1-48.2176.3-176.3-167172.9-162.50111.7L353 E354 R359 L360 Q361L353-K357 WeakPolarHBondContact O-CB 3.33Å; L353-K357 PolarHBondContact O-N 3.36Å; E354-K357 PolarHBondContact O-N 3.5Å; K357-R359 VanDerWaalsContact C-N 3.35Å; K357-R359 PolarHBondContact O-N 3.12Å; K357-L360 PolarHBondContact O-N 2.79Å; K357-Q361 VanDerWaalsContact CE-OE1 3.22Å; K357-Q361 WeakPolarHBondContact O-CG 3.37Å; K357-Q361 PolarHBondContact O-N 3.49Å
358S88.5Confident90Very high69 Ų69101.6 Ų101.648%0.48351%0.511SS..Hα-helixtrans-64.8-37.9-179.364.10000112.5E354 K355 Q361 S362E354-S358 PolarHBondContact O-N 3.35Å; E354-S358 PolarHBondContact O-OG 3.41Å; K355-S358 PolarHBondContact O-OG 3.11Å; S358-Q361 PolarHBondContact O-N 3.49Å; S358-S362 PolarHBondContact O-N 2.94Å; S358-S362 PolarHBondContact O-OG 3.43Å
359R89Confident90.1Very high175 Ų17599.4 Ų99.466%0.6651%0.505SS*.Hα-helixtrans-58.8-52.8170.7-76.1175.8177.6-172.6-1.6111.9K355 A356 K357 Q361 S362 E363K355-R359 VanDerWaalsContact O-CG 3.31Å; K355-R359 WeakPolarHBondContact O-CG 3.41Å; K355-R359 PolarHBondContact O-N 3.29Å; A356-R359 PolarHBondContact O-N 2.92Å; K357-R359 VanDerWaalsContact C-N 3.35Å; K357-R359 PolarHBondContact O-N 3.12Å; R359-Q361 VanDerWaalsContact C-N 3.27Å; R359-Q361 PolarHBondContact O-N 2.94Å; R359-S362 PolarHBondContact O-N 3.32Å; R359-S362 VanDerWaalsContact O-N 3.08Å; R359-S362 PolarHBondContact O-OG 3.26Å; R359-E363 WeakPolarHBondContact O-CG 3.16Å; R359-E363 PolarHBondContact O-N 3.19Å
360L89Confident90.1Very high105 Ų10597 Ų9755%0.5550%0.499SS..Hα-helixtrans-61.8-33.2178.9-71.5170.7000112.9A356 K357 V364A356-L360 WeakPolarHBondContact O-CG 3.25Å; A356-L360 PolarHBondContact O-N 2.84Å; K357-L360 PolarHBondContact O-N 2.79Å; L360-V364 VanDerWaalsContact O-CG2 3.31Å; L360-V364 WeakPolarHBondContact O-CG2 3.47Å; L360-V364 PolarHBondContact O-N 2.8Å
361Q91.7Very high90.2Very high94 Ų9497.6 Ų97.644%0.43950%0.502SS..Hα-helixtrans-64.9-48.3171.2-73.4-175.8-109.100111.3K357 S358 R359 E363 V364 E365K357-Q361 VanDerWaalsContact CE-OE1 3.22Å; K357-Q361 WeakPolarHBondContact O-CG 3.37Å; K357-Q361 PolarHBondContact O-N 3.49Å; S358-Q361 PolarHBondContact O-N 3.49Å; R359-Q361 VanDerWaalsContact C-N 3.27Å; R359-Q361 PolarHBondContact O-N 2.94Å; Q361-E363 VanDerWaalsContact C-N 3.32Å; Q361-E363 PolarHBondContact O-N 3.15Å; Q361-V364 PolarHBondContact O-N 3.19Å; Q361-E365 WeakPolarHBondContact O-CG 3.33Å; Q361-E365 PolarHBondContact O-N 2.95Å
362S88.8Confident90.3Very high56 Ų56100.9 Ų100.939%0.39251%0.513SS..Hα-helixtrans-63.7-33.8176.964.40000113.5S358 R359 E365 V366S358-S362 PolarHBondContact O-N 2.94Å; S358-S362 PolarHBondContact O-OG 3.43Å; R359-S362 PolarHBondContact O-N 3.32Å; R359-S362 VanDerWaalsContact O-N 3.08Å; R359-S362 PolarHBondContact O-OG 3.26Å; S362-E365 PolarHBondContact O-N 3.34Å; S362-V366 WeakPolarHBondContact O-CG2 3.42Å; S362-V366 PolarHBondContact O-N 2.99Å
363E90.5Very high90.4Very high107 Ų107100.2 Ų100.250%0.551%0.508SS..Hα-helixtrans-66.6-40.6173.6-73.1170.7-155.200111.5R359 Q361 L367R359-E363 WeakPolarHBondContact O-CG 3.16Å; R359-E363 PolarHBondContact O-N 3.19Å; Q361-E363 VanDerWaalsContact C-N 3.32Å; Q361-E363 PolarHBondContact O-N 3.15Å; E363-L367 WeakPolarHBondContact O-CB 3.26Å; E363-L367 VanDerWaalsContact O-CG 3.26Å; E363-L367 WeakPolarHBondContact O-CG 3.49Å; E363-L367 PolarHBondContact O-N 2.72Å
364V90.5Very high90.3Very high83 Ų8396.8 Ų96.850%0.50350%0.497SS..Hα-helixtrans-67.4-40.6174.8168.70000111.7L360 Q361 L367 I368L360-V364 VanDerWaalsContact O-CG2 3.31Å; L360-V364 WeakPolarHBondContact O-CG2 3.47Å; L360-V364 PolarHBondContact O-N 2.8Å; Q361-V364 PolarHBondContact O-N 3.19Å; V364-L367 PolarHBondContact O-N 2.91Å; V364-I368 HydrophobicContact CG1-CD1 3.88Å; V364-I368 HydrophobicContact CG1-CG1 4.44Å; V364-I368 VanDerWaalsContact O-CG1 3.32Å; V364-I368 WeakPolarHBondContact O-CG1 3.3Å; V364-I368 PolarHBondContact O-N 2.86Å
365E92Very high90.5Very high118 Ų11896.4 Ų96.455%0.55150%0.495SS*.Hα-helixtrans-62.1-43176-73.8164.7-164.200111.6Q361 S362 I368 V369Q361-E365 WeakPolarHBondContact O-CG 3.33Å; Q361-E365 PolarHBondContact O-N 2.95Å; S362-E365 PolarHBondContact O-N 3.34Å; E365-I368 PolarHBondContact O-N 3.27Å; E365-V369 WeakPolarHBondContact O-CG2 3.36Å; E365-V369 PolarHBondContact O-N 2.91Å
366V91.5Very high90.5Very high85 Ų8595.3 Ų95.352%0.51550%0.495SS..Hα-helixtrans-61.9-43.6172.8169.80000111.5S362 I368 V369 D370S362-V366 WeakPolarHBondContact O-CG2 3.42Å; S362-V366 PolarHBondContact O-N 2.99Å; V366-I368 PolarHBondContact O-N 3.45Å; V366-V369 PolarHBondContact O-N 2.72Å; V366-D370 WeakPolarHBondContact O-CB 3.46Å; V366-D370 PolarHBondContact O-N 3.43Å
367L91Very high90.7Very high119 Ų11996.7 Ų96.762%0.62350%0.499SS*.Hα-helixtrans-65.9-33.4178.4-73.8169.6000113.4E363 V364 L371E363-L367 WeakPolarHBondContact O-CB 3.26Å; E363-L367 VanDerWaalsContact O-CG 3.26Å; E363-L367 WeakPolarHBondContact O-CG 3.49Å; E363-L367 PolarHBondContact O-N 2.72Å; V364-L367 PolarHBondContact O-N 2.91Å; L367-L371 WeakPolarHBondContact O-CB 3.46Å; L367-L371 PolarHBondContact O-N 3.38Å
368I92.5Very high90.6Very high85 Ų8594.7 Ų94.744%0.43649%0.494SS..Hα-helixtrans-65.6-49.7172.3-70.4164.6000109.8V364 E365 V366 D370 L371 E372V364-I368 HydrophobicContact CG1-CD1 3.88Å; V364-I368 HydrophobicContact CG1-CG1 4.44Å; V364-I368 VanDerWaalsContact O-CG1 3.32Å; V364-I368 WeakPolarHBondContact O-CG1 3.3Å; V364-I368 PolarHBondContact O-N 2.86Å; E365-I368 PolarHBondContact O-N 3.27Å; V366-I368 PolarHBondContact O-N 3.45Å; I368-D370 VanDerWaalsContact C-N 3.31Å; I368-D370 PolarHBondContact O-N 3.4Å; I368-L371 WeakPolarHBondContact O-CB 3.47Å; I368-L371 PolarHBondContact O-N 2.94Å; I368-L371 VanDerWaalsContact O-N 3.16Å; I368-E372 WeakPolarHBondContact O-CG 3.41Å; I368-E372 PolarHBondContact O-N 3.24Å
369V91.1Very high90.7Very high67 Ų6793 Ų9341%0.40648%0.484SS..Hα-helixtrans-61.2-37.9179166.50000111.9E365 V366 E372 K373E365-V369 WeakPolarHBondContact O-CG2 3.36Å; E365-V369 PolarHBondContact O-N 2.91Å; V366-V369 PolarHBondContact O-N 2.72Å; V369-E372 PolarHBondContact O-N 2.84Å; V369-K373 VanDerWaalsContact O-CG 3.3Å; V369-K373 WeakPolarHBondContact O-CG 3.43Å; V369-K373 PolarHBondContact O-N 3.26Å
370D91Very high90.8Very high76 Ų7689 Ų8941%0.40648%0.475SS..Hα-helixtrans-74.1-31.3176.2-76.2-11.5000113V366 I368 K373 A374V366-D370 WeakPolarHBondContact O-CB 3.46Å; V366-D370 PolarHBondContact O-N 3.43Å; I368-D370 VanDerWaalsContact C-N 3.31Å; I368-D370 PolarHBondContact O-N 3.4Å; D370-K373 WeakPolarHBondContact OD1-CD 3.4Å; D370-K373 IonicContact OD1-NZ 2.66Å; D370-K373 PolarHBondContact OD1-NZ 3.44Å; D370-A374 WeakPolarHBondContact O-CB 3.47Å; D370-A374 PolarHBondContact O-N 2.68Å
371L90.1Very high90.8Very high99 Ų9988.6 Ų88.652%0.51847%0.473SS..Hα-helixtrans-65.5-42.6169.517962.1000111.5L367 I368 A374 Q375L367-L371 WeakPolarHBondContact O-CB 3.46Å; L367-L371 PolarHBondContact O-N 3.38Å; I368-L371 WeakPolarHBondContact O-CB 3.47Å; I368-L371 PolarHBondContact O-N 2.94Å; I368-L371 VanDerWaalsContact O-N 3.16Å; L371-A374 PolarHBondContact O-N 2.89Å; L371-Q375 HydrophobicContact CD1-CG 4.4Å; L371-Q375 WeakPolarHBondContact O-CG 3.47Å; L371-Q375 PolarHBondContact O-N 3.02Å
372E92.2Very high90.7Very high107 Ų10789.8 Ų89.850%0.548%0.478SS..Hα-helixtrans-64.3-40.8175.6-72.2-179.5168.900111.8I368 V369 Q375 N376I368-E372 WeakPolarHBondContact O-CG 3.41Å; I368-E372 PolarHBondContact O-N 3.24Å; V369-E372 PolarHBondContact O-N 2.84Å; E372-Q375 PolarHBondContact O-N 2.9Å; E372-N376 WeakPolarHBondContact O-CB 3.31Å; E372-N376 PolarHBondContact O-N 3.26Å; E372-N376 PolarHBondContact O-ND2 3.22Å
373K91.1Very high90.8Very high116 Ų11695.8 Ų95.850%0.50449%0.492SS..Hα-helixtrans-59.6-44.6171-71.6169.2-161.4156.50111.7V369 D370 N376 T377V369-K373 VanDerWaalsContact O-CG 3.3Å; V369-K373 WeakPolarHBondContact O-CG 3.43Å; V369-K373 PolarHBondContact O-N 3.26Å; D370-K373 WeakPolarHBondContact OD1-CD 3.4Å; D370-K373 IonicContact OD1-NZ 2.66Å; D370-K373 PolarHBondContact OD1-NZ 3.44Å; K373-N376 PolarHBondContact O-N 2.95Å; K373-T377 WeakPolarHBondContact O-CB 3.42Å; K373-T377 PolarHBondContact O-N 3.4Å; K373-T377 PolarHBondContact O-OG1 3.45Å
374A89.2Confident90.8Very high45 Ų4595.5 Ų95.537%0.37249%0.491SS..Hα-helixtrans-63.3-45.1178.300000111.9D370 L371 T377 I378D370-A374 WeakPolarHBondContact O-CB 3.47Å; D370-A374 PolarHBondContact O-N 2.68Å; L371-A374 PolarHBondContact O-N 2.89Å; A374-T377 PolarHBondContact O-N 2.9Å; A374-I378 WeakPolarHBondContact O-CG1 3.13Å; A374-I378 PolarHBondContact O-N 2.94Å
375Q91.7Very high90.8Very high113 Ų11396.9 Ų96.953%0.52849%0.49SS..Hα-helixtrans-62.8-44.5176.6-72177.36.400112.1L371 E372 T377 I378 A379L371-Q375 HydrophobicContact CD1-CG 4.4Å; L371-Q375 WeakPolarHBondContact O-CG 3.47Å; L371-Q375 PolarHBondContact O-N 3.02Å; E372-Q375 PolarHBondContact O-N 2.9Å; Q375-T377 VanDerWaalsContact C-N 3.31Å; Q375-T377 PolarHBondContact O-N 3.23Å; Q375-I378 PolarHBondContact O-N 3.47Å; Q375-A379 PolarHBondContact O-N 2.97Å
376N91.1Very high90.7Very high103 Ų10395.8 Ų95.855%0.55149%0.485SS*.Hα-helixtrans-62.4-38.4174.6-79.6-65.9000112.1E372 K373 A379 I380E372-N376 WeakPolarHBondContact O-CB 3.31Å; E372-N376 PolarHBondContact O-N 3.26Å; E372-N376 PolarHBondContact O-ND2 3.22Å; K373-N376 PolarHBondContact O-N 2.95Å; N376-A379 PolarHBondContact O-N 3.41Å; N376-I380 WeakPolarHBondContact O-CD1 3.41Å; N376-I380 VanDerWaalsContact O-CG1 3.27Å; N376-I380 WeakPolarHBondContact O-CG1 3.24Å; N376-I380 PolarHBondContact O-N 2.83Å
377T90.4Very high90.7Very high76 Ų7697.9 Ų97.947%0.46649%0.489SS..Hα-helixtrans-65.2-42.3176.6-57.80000111.5K373 A374 Q375 I380 L381K373-T377 WeakPolarHBondContact O-CB 3.42Å; K373-T377 PolarHBondContact O-N 3.4Å; K373-T377 PolarHBondContact O-OG1 3.45Å; A374-T377 PolarHBondContact O-N 2.9Å; Q375-T377 VanDerWaalsContact C-N 3.31Å; Q375-T377 PolarHBondContact O-N 3.23Å; T377-I380 PolarHBondContact O-N 3.42Å; T377-L381 HydrophobicContact CG2-CD1 4.04Å; T377-L381 VanDerWaalsContact O-CG 3.31Å; T377-L381 WeakPolarHBondContact O-CG 3.29Å; T377-L381 PolarHBondContact O-N 3.03Å
378I90.8Very high90.5Very high91 Ų9197.6 Ų97.647%0.46749%0.488SS..Hα-helixtrans-60.7-49.6173.9-69.2163.5000110.3A374 Q375 I380 L381 E382A374-I378 WeakPolarHBondContact O-CG1 3.13Å; A374-I378 PolarHBondContact O-N 2.94Å; Q375-I378 PolarHBondContact O-N 3.47Å; I378-I380 PolarHBondContact O-N 2.82Å; I378-L381 PolarHBondContact O-N 2.86Å; I378-E382 HydrophobicContact CG2-CG 4.2Å; I378-E382 WeakPolarHBondContact O-CG 3.41Å; I378-E382 PolarHBondContact O-N 3.39Å
379A90.7Very high90.4Very high33 Ų3398.4 Ų98.427%0.27349%0.489SS..Hα-helixtrans-62.6-28.9-179.900000113.6Q375 N376 R383Q375-A379 PolarHBondContact O-N 2.97Å; N376-A379 PolarHBondContact O-N 3.41Å; A379-R383 WeakPolarHBondContact O-CD 3.48Å; A379-R383 VanDerWaalsContact O-CG 3.26Å; A379-R383 WeakPolarHBondContact O-CG 3.4Å; A379-R383 PolarHBondContact O-N 2.94Å
380I90.1Very high90.4Very high91 Ų91102.2 Ų102.247%0.46750%0.497SS..Hα-helixtrans-71.7-46.6171.4-69.9164.2000110.6N376 T377 I378 E382 R383 Q384N376-I380 WeakPolarHBondContact O-CD1 3.41Å; N376-I380 VanDerWaalsContact O-CG1 3.27Å; N376-I380 WeakPolarHBondContact O-CG1 3.24Å; N376-I380 PolarHBondContact O-N 2.83Å; T377-I380 PolarHBondContact O-N 3.42Å; I378-I380 PolarHBondContact O-N 2.82Å; I380-E382 PolarHBondContact O-N 3.22Å; I380-R383 PolarHBondContact O-N 3.1Å; I380-Q384 WeakPolarHBondContact O-CG 3.3Å; I380-Q384 PolarHBondContact O-N 3.27Å
381L89.6Confident90.3Very high97 Ų97101.5 Ų101.551%0.50850%0.495SS..Hα-helixtrans-65.5-36.3179.8-70.9169.8000112.6T377 I378 Q384 K385T377-L381 HydrophobicContact CG2-CD1 4.04Å; T377-L381 VanDerWaalsContact O-CG 3.31Å; T377-L381 WeakPolarHBondContact O-CG 3.29Å; T377-L381 PolarHBondContact O-N 3.03Å; I378-L381 PolarHBondContact O-N 2.86Å; L381-Q384 PolarHBondContact O-N 2.73Å; L381-K385 WeakPolarHBondContact O-CB 3.34Å; L381-K385 PolarHBondContact O-N 3.35Å
382E89.7Confident90.2Very high118 Ų118100.3 Ų100.355%0.55149%0.492SS*.Hα-helixtrans-64.3-44.5174.3-73.1178.5148.600111.6I378 I380 Q384 K385 E386I378-E382 HydrophobicContact CG2-CG 4.2Å; I378-E382 WeakPolarHBondContact O-CG 3.41Å; I378-E382 PolarHBondContact O-N 3.39Å; I380-E382 PolarHBondContact O-N 3.22Å; E382-Q384 PolarHBondContact O-N 3.28Å; E382-K385 WeakPolarHBondContact O-CB 3.41Å; E382-K385 PolarHBondContact O-N 3.44Å; E382-E386 PolarHBondContact O-N 2.88Å
383R90.3Very high90.1Very high182 Ų18298.5 Ų98.569%0.68749%0.491SS*.Hα-helixtrans-63.2-40.4174.3-70.9170.4-175.1173.14.1112.2A379 I380 E386 Q387A379-R383 WeakPolarHBondContact O-CD 3.48Å; A379-R383 VanDerWaalsContact O-CG 3.26Å; A379-R383 WeakPolarHBondContact O-CG 3.4Å; A379-R383 PolarHBondContact O-N 2.94Å; I380-R383 PolarHBondContact O-N 3.1Å; R383-E386 PolarHBondContact O-N 2.93Å; R383-Q387 WeakPolarHBondContact O-CB 3.36Å; R383-Q387 PolarHBondContact O-N 3.29Å
384Q89.8Confident89.9Confident101 Ų10198.9 Ų98.947%0.47249%0.494SS..Hα-helixtrans-65.2-41174.7-74.1178.5-7.500111.9I380 L381 E382 Q387 L388I380-Q384 WeakPolarHBondContact O-CG 3.3Å; I380-Q384 PolarHBondContact O-N 3.27Å; L381-Q384 PolarHBondContact O-N 2.73Å; E382-Q384 PolarHBondContact O-N 3.28Å; Q384-Q387 PolarHBondContact O-N 3.38Å; Q384-L388 WeakPolarHBondContact O-CB 3.48Å; Q384-L388 VanDerWaalsContact O-CG 3.31Å; Q384-L388 WeakPolarHBondContact O-CG 3.37Å; Q384-L388 PolarHBondContact O-N 2.95Å
385K90.9Very high89.9Confident113 Ų113102.1 Ų102.149%0.49151%0.505SS..Hα-helixtrans-58.8-51.9173.3174.7-174.5172.3-700111.1L381 E382 Q387 L388 E389L381-K385 WeakPolarHBondContact O-CB 3.34Å; L381-K385 PolarHBondContact O-N 3.35Å; E382-K385 WeakPolarHBondContact O-CB 3.41Å; E382-K385 PolarHBondContact O-N 3.44Å; K385-Q387 VanDerWaalsContact C-N 3.3Å; K385-Q387 PolarHBondContact O-N 3.46Å; K385-L388 PolarHBondContact O-N 3.02Å; K385-E389 VanDerWaalsContact CE-OE1 3.27Å; K385-E389 WeakPolarHBondContact CE-OE1 3.34Å; K385-E389 HydrophobicContact CG-CG 4.48Å; K385-E389 IonicContact NZ-OE1 3.98Å; K385-E389 PolarHBondContact NZ-OE1 3Å; K385-E389 IonicContact NZ-OE2 2.68Å; K385-E389 PolarHBondContact NZ-OE2 3.17Å; K385-E389 WeakPolarHBondContact O-CG 3.36Å; K385-E389 PolarHBondContact O-N 2.99Å
386E90.4Very high89.8Confident95 Ų95102.8 Ų102.844%0.44451%0.506SS..Hα-helixtrans-59.9-40.3177.9-76.6-169.8-155.200112.4E382 R383 E389 R390E382-E386 PolarHBondContact O-N 2.88Å; R383-E386 PolarHBondContact O-N 2.93Å; E386-E389 PolarHBondContact O-N 2.84Å; E386-R390 VanDerWaalsContact O-CG 3.26Å; E386-R390 WeakPolarHBondContact O-CG 3.49Å; E386-R390 PolarHBondContact O-N 3.49Å; E386-R390 IonicContact OE2-CZ 3.66Å; E386-R390 IonicContact OE2-NH2 3.96Å; E386-R390 PolarHBondContact OE2-NH2 2.85Å
387Q90.2Very high89.7Confident128 Ų128101 Ų10160%0.59850%0.499SS*.Hα-helixtrans-63.9-42.9177.1-174175.50.300111.5R383 Q384 K385 R390 V391R383-Q387 WeakPolarHBondContact O-CB 3.36Å; R383-Q387 PolarHBondContact O-N 3.29Å; Q384-Q387 PolarHBondContact O-N 3.38Å; K385-Q387 VanDerWaalsContact C-N 3.3Å; K385-Q387 PolarHBondContact O-N 3.46Å; Q387-R390 PolarHBondContact O-N 2.83Å; Q387-V391 WeakPolarHBondContact O-CG2 3.17Å; Q387-V391 PolarHBondContact O-N 3.49Å
388L88.4Confident89.7Confident114 Ų114105.6 Ų105.660%0.59751%0.508SS*.Hα-helixtrans-65.9-39.8175-72.2169.7000112.2Q384 K385 R390 V391 V392Q384-L388 WeakPolarHBondContact O-CB 3.48Å; Q384-L388 VanDerWaalsContact O-CG 3.31Å; Q384-L388 WeakPolarHBondContact O-CG 3.37Å; Q384-L388 PolarHBondContact O-N 2.95Å; K385-L388 PolarHBondContact O-N 3.02Å; L388-R390 VanDerWaalsContact C-N 3.35Å; L388-R390 PolarHBondContact O-N 3.48Å; L388-V391 PolarHBondContact O-N 3.23Å; L388-V392 WeakPolarHBondContact O-CB 3.38Å; L388-V392 VanDerWaalsContact O-CG2 3.29Å; L388-V392 WeakPolarHBondContact O-CG2 3.33Å; L388-V392 PolarHBondContact O-N 3.29Å
389E90.2Very high89.4Confident101 Ų101106.8 Ų106.847%0.47251%0.514SS..Hα-helixtrans-63.9-38.4176.5-75.3173147.700112K385 E386 S393K385-E389 VanDerWaalsContact CE-OE1 3.27Å; K385-E389 WeakPolarHBondContact CE-OE1 3.34Å; K385-E389 HydrophobicContact CG-CG 4.48Å; K385-E389 IonicContact NZ-OE1 3.98Å; K385-E389 PolarHBondContact NZ-OE1 3Å; K385-E389 IonicContact NZ-OE2 2.68Å; K385-E389 PolarHBondContact NZ-OE2 3.17Å; K385-E389 WeakPolarHBondContact O-CG 3.36Å; K385-E389 PolarHBondContact O-N 2.99Å; E386-E389 PolarHBondContact O-N 2.84Å; E389-S393 PolarHBondContact O-N 3.1Å
390R90.9Very high89.3Confident148 Ų148110.9 Ų110.956%0.55853%0.528SS*.Hα-helixtrans-64.7-50.2172.6-67169.1-152.2-177.66.4111.6E386 Q387 L388 V392 S393 E394E386-R390 VanDerWaalsContact O-CG 3.26Å; E386-R390 WeakPolarHBondContact O-CG 3.49Å; E386-R390 PolarHBondContact O-N 3.49Å; E386-R390 IonicContact OE2-CZ 3.66Å; E386-R390 IonicContact OE2-NH2 3.96Å; E386-R390 PolarHBondContact OE2-NH2 2.85Å; Q387-R390 PolarHBondContact O-N 2.83Å; L388-R390 VanDerWaalsContact C-N 3.35Å; L388-R390 PolarHBondContact O-N 3.48Å; R390-V392 VanDerWaalsContact C-N 3.3Å; R390-V392 PolarHBondContact O-N 3.32Å; R390-S393 WeakPolarHBondContact O-CA 3.5Å; R390-S393 WeakPolarHBondContact O-CB 3.36Å; R390-S393 PolarHBondContact O-N 2.94Å; R390-E394 WeakPolarHBondContact O-CG 3.12Å; R390-E394 PolarHBondContact O-N 3.11Å
391V89.3Confident89.1Confident61 Ų61111.5 Ų111.537%0.3753%0.529SS..Hα-helixtrans-59.7-39.3177.5170.30000111.7Q387 L388 S393 E394 L395Q387-V391 WeakPolarHBondContact O-CG2 3.17Å; Q387-V391 PolarHBondContact O-N 3.49Å; L388-V391 PolarHBondContact O-N 3.23Å; V391-S393 VanDerWaalsContact C-N 3.32Å; V391-S393 PolarHBondContact O-N 3.36Å; V391-E394 PolarHBondContact O-N 2.99Å; V391-L395 HydrophobicContact CG1-CD1 3.87Å; V391-L395 HydrophobicContact CG1-CG 4.35Å; V391-L395 WeakPolarHBondContact O-CB 3.42Å; V391-L395 VanDerWaalsContact O-CG 3.25Å; V391-L395 WeakPolarHBondContact O-CG 3.43Å; V391-L395 PolarHBondContact O-N 2.95Å
392V87.6Confident88.9Confident74 Ų74110.5 Ų110.545%0.44853%0.527SS..Hα-helixtrans-66.5-32.5174.3167.20000112L388 R390 K396L388-V392 WeakPolarHBondContact O-CB 3.38Å; L388-V392 VanDerWaalsContact O-CG2 3.29Å; L388-V392 WeakPolarHBondContact O-CG2 3.33Å; L388-V392 PolarHBondContact O-N 3.29Å; R390-V392 VanDerWaalsContact C-N 3.3Å; R390-V392 PolarHBondContact O-N 3.32Å; V392-K396 HydrophobicContact CG1-CD 4.47Å; V392-K396 VanDerWaalsContact O-CG 3.29Å; V392-K396 WeakPolarHBondContact O-CG 3.43Å; V392-K396 PolarHBondContact O-N 3.34Å
393S89.2Confident88.8Confident69 Ų69108.1 Ų108.148%0.48352%0.52SS..Hα-helixtrans-70.1-46.1173.6-163.20000111.8E389 R390 V391 L395 K396 T397E389-S393 PolarHBondContact O-N 3.1Å; R390-S393 WeakPolarHBondContact O-CA 3.5Å; R390-S393 WeakPolarHBondContact O-CB 3.36Å; R390-S393 PolarHBondContact O-N 2.94Å; V391-S393 VanDerWaalsContact C-N 3.32Å; V391-S393 PolarHBondContact O-N 3.36Å; S393-L395 VanDerWaalsContact C-N 3.34Å; S393-L395 PolarHBondContact O-N 3.11Å; S393-K396 WeakPolarHBondContact O-CB 3.47Å; S393-K396 PolarHBondContact O-N 2.93Å; S393-K396 VanDerWaalsContact O-N 3.15Å; S393-T397 PolarHBondContact O-N 3.4Å; S393-T397 PolarHBondContact O-OG1 3.36Å
394E88.3Confident88.7Confident124 Ų124105.8 Ų105.858%0.57952%0.517SS*.Hα-helixtrans-62-39.5177.2-69.7168.4-159.900112.1R390 V391 K396 T397 R398R390-E394 WeakPolarHBondContact O-CG 3.12Å; R390-E394 PolarHBondContact O-N 3.11Å; V391-E394 PolarHBondContact O-N 2.99Å; E394-K396 VanDerWaalsContact C-N 3.32Å; E394-K396 PolarHBondContact O-N 3.04Å; E394-T397 PolarHBondContact O-OG1 2.88Å; E394-T397 VanDerWaalsContact O-OG1 3.11Å; E394-R398 WeakPolarHBondContact O-CB 3.31Å; E394-R398 PolarHBondContact O-N 3.07Å
395L88.8Confident88.5Confident113 Ų113106.9 Ų106.959%0.59252%0.522SS*.Hα-helixtrans-69-28.5175.2-72.1172.1000112.9V391 S393 L399V391-L395 HydrophobicContact CG1-CD1 3.87Å; V391-L395 HydrophobicContact CG1-CG 4.35Å; V391-L395 WeakPolarHBondContact O-CB 3.42Å; V391-L395 VanDerWaalsContact O-CG 3.25Å; V391-L395 WeakPolarHBondContact O-CG 3.43Å; V391-L395 PolarHBondContact O-N 2.95Å; S393-L395 VanDerWaalsContact C-N 3.34Å; S393-L395 PolarHBondContact O-N 3.11Å; L395-L399 VanDerWaalsContact O-CB 3.3Å; L395-L399 WeakPolarHBondContact O-CB 3.31Å; L395-L399 PolarHBondContact O-N 3.01Å; L395-L399 VanDerWaalsContact O-N 3.08Å
396K89.7Confident88.1Confident127 Ų127106.1 Ų106.155%0.55252%0.523SS*.Hα-helixtrans-72.9-50.2174.2-78.6173.1-179.3-179.70111.9V392 S393 E394 R398 L399 E400V392-K396 HydrophobicContact CG1-CD 4.47Å; V392-K396 VanDerWaalsContact O-CG 3.29Å; V392-K396 WeakPolarHBondContact O-CG 3.43Å; V392-K396 PolarHBondContact O-N 3.34Å; S393-K396 WeakPolarHBondContact O-CB 3.47Å; S393-K396 PolarHBondContact O-N 2.93Å; S393-K396 VanDerWaalsContact O-N 3.15Å; E394-K396 VanDerWaalsContact C-N 3.32Å; E394-K396 PolarHBondContact O-N 3.04Å; K396-R398 VanDerWaalsContact C-N 3.26Å; K396-R398 PolarHBondContact O-N 2.9Å; K396-L399 WeakPolarHBondContact O-CB 3.36Å; K396-L399 PolarHBondContact O-N 3.14Å; K396-L399 VanDerWaalsContact O-N 3.14Å; K396-E400 WeakPolarHBondContact O-CG 3.4Å; K396-E400 PolarHBondContact O-N 3.21Å
397T89.2Confident87.9Confident66 Ų66106.2 Ų106.241%0.40552%0.523SS..Hα-helixtrans-59.7-41.6177.355.40000110.5S393 E394 L399 E400 E401S393-T397 PolarHBondContact O-N 3.4Å; S393-T397 PolarHBondContact O-OG1 3.36Å; E394-T397 PolarHBondContact O-OG1 2.88Å; E394-T397 VanDerWaalsContact O-OG1 3.11Å; T397-L399 VanDerWaalsContact C-N 3.34Å; T397-L399 PolarHBondContact O-N 2.82Å; T397-E400 PolarHBondContact O-N 2.93Å; T397-E400 VanDerWaalsContact O-N 3.16Å; T397-E401 VanDerWaalsContact O-CG 3.28Å; T397-E401 WeakPolarHBondContact O-CG 3.44Å; T397-E401 PolarHBondContact O-N 3.5Å
398R89Confident87.6Confident172 Ų172101.9 Ų101.965%0.64951%0.509SS*.Hα-helixtrans-68.5-29178.1-159.6169-167.8152.85.4114.1E394 K396 E401 V402E394-R398 WeakPolarHBondContact O-CB 3.31Å; E394-R398 PolarHBondContact O-N 3.07Å; K396-R398 VanDerWaalsContact C-N 3.26Å; K396-R398 PolarHBondContact O-N 2.9Å; R398-E401 WeakPolarHBondContact CA-OE2 3.17Å; R398-V402 WeakPolarHBondContact O-CB 3.26Å; R398-V402 VanDerWaalsContact O-CG2 3.28Å; R398-V402 WeakPolarHBondContact O-CG2 3.42Å; R398-V402 PolarHBondContact O-N 3.39Å; R398-V402 VanDerWaalsContact O-N 3.08Å
399L85.3Confident87.4Confident115 Ų115100 Ų10060%0.60250%0.503SS*.Hα-helixtrans-70-40.1170.6179.563.5000111.5L395 K396 T397 T403L395-L399 VanDerWaalsContact O-CB 3.3Å; L395-L399 WeakPolarHBondContact O-CB 3.31Å; L395-L399 PolarHBondContact O-N 3.01Å; L395-L399 VanDerWaalsContact O-N 3.08Å; K396-L399 WeakPolarHBondContact O-CB 3.36Å; K396-L399 PolarHBondContact O-N 3.14Å; K396-L399 VanDerWaalsContact O-N 3.14Å; T397-L399 VanDerWaalsContact C-N 3.34Å; T397-L399 PolarHBondContact O-N 2.82Å; L399-T403 VanDerWaalsContact O-CB 3.31Å; L399-T403 WeakPolarHBondContact O-CB 3.48Å; L399-T403 PolarHBondContact O-N 2.84Å; L399-T403 PolarHBondContact O-OG1 3.32Å
400E88Confident87.1Confident120 Ų12099.4 Ų99.456%0.56150%0.5SS*.Hα-helixtrans-67.3-39.9175.9-70.6172.2-164.400111.8K396 T397 T403 Q404K396-E400 WeakPolarHBondContact O-CG 3.4Å; K396-E400 PolarHBondContact O-N 3.21Å; T397-E400 PolarHBondContact O-N 2.93Å; T397-E400 VanDerWaalsContact O-N 3.16Å; E400-T403 PolarHBondContact O-N 2.97Å; E400-Q404 WeakPolarHBondContact O-CG 3.46Å; E400-Q404 PolarHBondContact O-N 3.21Å; E400-Q404 VanDerWaalsContact O-N 3.08Å; E400-Q404 PolarHBondContact O-NE2 3.34Å
401E87.4Confident86.8Confident103 Ų10399.6 Ų99.648%0.48150%0.5SS..Hα-helixtrans-59.2-56.7172.6-72.9161.1-176.500111.2T397 R398 T403 Q404 E405T397-E401 VanDerWaalsContact O-CG 3.28Å; T397-E401 WeakPolarHBondContact O-CG 3.44Å; T397-E401 PolarHBondContact O-N 3.5Å; R398-E401 WeakPolarHBondContact CA-OE2 3.17Å; E401-T403 PolarHBondContact O-N 2.91Å; E401-Q404 WeakPolarHBondContact O-CB 3.27Å; E401-Q404 PolarHBondContact O-N 3.49Å; E401-E405 PolarHBondContact O-N 3.38Å
402V84.2Confident86.6Confident77 Ų77102.5 Ų102.547%0.46751%0.51SS..Hα-helixtrans-63-30.2-179.3170.40000112.1R398 L406R398-V402 WeakPolarHBondContact O-CB 3.26Å; R398-V402 VanDerWaalsContact O-CG2 3.28Å; R398-V402 WeakPolarHBondContact O-CG2 3.42Å; R398-V402 PolarHBondContact O-N 3.39Å; R398-V402 VanDerWaalsContact O-N 3.08Å; V402-L406 VanDerWaalsContact O-CB 3.28Å; V402-L406 WeakPolarHBondContact O-CB 3.27Å; V402-L406 PolarHBondContact O-N 3Å
403T88.3Confident86.3Confident67 Ų67103.6 Ų103.641%0.41151%0.513SS..Hα-helixtrans-69.2-38.9174.4-58.50000111.3L399 E400 E401 L406 E407L399-T403 VanDerWaalsContact O-CB 3.31Å; L399-T403 WeakPolarHBondContact O-CB 3.48Å; L399-T403 PolarHBondContact O-N 2.84Å; L399-T403 PolarHBondContact O-OG1 3.32Å; E400-T403 PolarHBondContact O-N 2.97Å; E401-T403 PolarHBondContact O-N 2.91Å; T403-L406 PolarHBondContact O-N 3.39Å; T403-E407 PolarHBondContact O-N 2.96Å
404Q87.9Confident86.2Confident133 Ų133106.5 Ų106.562%0.62152%0.517SS*.Hα-helixtrans-69.2-39.3175.6-72.6171.669.100112E400 E401 E407 A408E400-Q404 WeakPolarHBondContact O-CG 3.46Å; E400-Q404 PolarHBondContact O-N 3.21Å; E400-Q404 VanDerWaalsContact O-N 3.08Å; E400-Q404 PolarHBondContact O-NE2 3.34Å; E401-Q404 WeakPolarHBondContact O-CB 3.27Å; E401-Q404 PolarHBondContact O-N 3.49Å; Q404-E407 PolarHBondContact O-N 3.46Å; Q404-A408 WeakPolarHBondContact O-CB 3.31Å; Q404-A408 PolarHBondContact O-N 2.89Å
405E84.7Confident86Confident125 Ų125103.3 Ų103.358%0.58451%0.511SS*.Hα-helixtrans-62.9-41.9172.4-68.9179.516400111.9E401 E407 A408 T409E401-E405 PolarHBondContact O-N 3.38Å; E405-E407 PolarHBondContact O-N 3.33Å; E405-A408 PolarHBondContact O-N 2.96Å; E405-T409 WeakPolarHBondContact O-CG2 3.41Å; E405-T409 PolarHBondContact O-N 2.94Å; E405-T409 PolarHBondContact O-OG1 2.87Å
406L83Confident85.6Confident96 Ų96101.7 Ų101.750%0.50351%0.506SS..Hα-helixtrans-64.1-38.6175.3179.260.5000112V402 T403 T409 Q410V402-L406 VanDerWaalsContact O-CB 3.28Å; V402-L406 WeakPolarHBondContact O-CB 3.27Å; V402-L406 PolarHBondContact O-N 3Å; T403-L406 PolarHBondContact O-N 3.39Å; L406-T409 PolarHBondContact O-OG1 3.42Å; L406-Q410 WeakPolarHBondContact O-CB 3.18Å; L406-Q410 VanDerWaalsContact O-CG 3.24Å; L406-Q410 WeakPolarHBondContact O-CG 3.49Å; L406-Q410 PolarHBondContact O-N 3.38Å; L406-Q410 VanDerWaalsContact O-N 3.15Å
407E86.3Confident85.3Confident98 Ų98100.6 Ų100.646%0.45850%0.503SS..Hα-helixtrans-68.6-40.2172.8-80.4-160.1-151.200112.8T403 Q404 E405 Q410 R411T403-E407 PolarHBondContact O-N 2.96Å; Q404-E407 PolarHBondContact O-N 3.46Å; E405-E407 PolarHBondContact O-N 3.33Å; E407-Q410 PolarHBondContact O-N 2.81Å; E407-R411 WeakPolarHBondContact O-CD 3.4Å; E407-R411 WeakPolarHBondContact O-CG 3.47Å; E407-R411 PolarHBondContact O-N 2.71Å; E407-R411 VanDerWaalsContact O-N 3.1Å; E407-R411 PolarHBondContact O-NE 3.29Å; E407-R411 IonicContact OE2-CZ 2.59Å; E407-R411 IonicContact OE2-NE 2.77Å; E407-R411 IonicContact OE2-NH2 3.74Å; E407-R411 PolarHBondContact OE2-NH2 3.37Å
408A83.9Confident85Confident36 Ų36100.5 Ų100.530%0.29851%0.509SS..Hα-helixtrans-61.5-54.217800000111.3Q404 E405 Q410 R411 E412Q404-A408 WeakPolarHBondContact O-CB 3.31Å; Q404-A408 PolarHBondContact O-N 2.89Å; E405-A408 PolarHBondContact O-N 2.96Å; A408-Q410 VanDerWaalsContact C-N 3.27Å; A408-Q410 PolarHBondContact O-N 3.44Å; A408-R411 WeakPolarHBondContact O-CA 3.4Å; A408-R411 WeakPolarHBondContact O-CB 3.48Å; A408-R411 PolarHBondContact O-N 2.88Å; A408-E412 PolarHBondContact O-N 2.9Å
409T85.2Confident84.7Confident75 Ų7597.8 Ų97.846%0.4650%0.504SS..Hα-helixtrans-60.4-33.7177.851.90000112.7E405 L406 E412 L413E405-T409 WeakPolarHBondContact O-CG2 3.41Å; E405-T409 PolarHBondContact O-N 2.94Å; E405-T409 PolarHBondContact O-OG1 2.87Å; L406-T409 PolarHBondContact O-OG1 3.42Å; T409-E412 PolarHBondContact O-N 3.18Å; T409-L413 WeakPolarHBondContact O-CB 3.32Å; T409-L413 PolarHBondContact O-N 3.01Å
410Q82.3Confident84.5Confident89 Ų8996.6 Ų96.642%0.41650%0.498SS..Hα-helixtrans-68.6-29.7171.7-79.7-175.343.700114.2L406 E407 A408 K414L406-Q410 WeakPolarHBondContact O-CB 3.18Å; L406-Q410 VanDerWaalsContact O-CG 3.24Å; L406-Q410 WeakPolarHBondContact O-CG 3.49Å; L406-Q410 PolarHBondContact O-N 3.38Å; L406-Q410 VanDerWaalsContact O-N 3.15Å; E407-Q410 PolarHBondContact O-N 2.81Å; A408-Q410 VanDerWaalsContact C-N 3.27Å; A408-Q410 PolarHBondContact O-N 3.44Å; Q410-K414 WeakPolarHBondContact O-CD 3.39Å; Q410-K414 WeakPolarHBondContact O-CG 3.31Å; Q410-K414 PolarHBondContact O-N 3.31Å
411R86.3Confident84.3Confident151 Ų15196.7 Ų96.757%0.5750%0.498SS*.Hα-helixtrans-73.5-42.4173.8-63.8158.5-161.7173.44.2110E407 A408 K414 A415E407-R411 WeakPolarHBondContact O-CD 3.4Å; E407-R411 WeakPolarHBondContact O-CG 3.47Å; E407-R411 PolarHBondContact O-N 2.71Å; E407-R411 VanDerWaalsContact O-N 3.1Å; E407-R411 PolarHBondContact O-NE 3.29Å; E407-R411 IonicContact OE2-CZ 2.59Å; E407-R411 IonicContact OE2-NE 2.77Å; E407-R411 IonicContact OE2-NH2 3.74Å; E407-R411 PolarHBondContact OE2-NH2 3.37Å; A408-R411 WeakPolarHBondContact O-CA 3.4Å; A408-R411 WeakPolarHBondContact O-CB 3.48Å; A408-R411 PolarHBondContact O-N 2.88Å; R411-K414 PolarHBondContact O-N 3.02Å; R411-A415 PolarHBondContact O-N 2.92Å
412E83.9Confident84.3Confident123 Ų12398.3 Ų98.358%0.57550%0.503SS*.Hα-helixtrans-64.2-40.5175.8-68.6174.8165.900112.5A408 T409 K414 A415 T416A408-E412 PolarHBondContact O-N 2.9Å; T409-E412 PolarHBondContact O-N 3.18Å; E412-K414 VanDerWaalsContact C-N 3.3Å; E412-K414 PolarHBondContact O-N 3.44Å; E412-A415 PolarHBondContact O-N 3.31Å; E412-T416 WeakPolarHBondContact O-CB 3.28Å; E412-T416 WeakPolarHBondContact O-CG2 3.16Å; E412-T416 PolarHBondContact O-N 3.43Å; E412-T416 PolarHBondContact O-OG1 3.45Å
413L82Confident84.2Confident96 Ų9699.7 Ų99.750%0.50351%0.507SS..Hα-helixtrans-59.7-39.7172.9-178.961.3000111.8T409 T416 Q417T409-L413 WeakPolarHBondContact O-CB 3.32Å; T409-L413 PolarHBondContact O-N 3.01Å; L413-T416 WeakPolarHBondContact CA-OG1 3.41Å; L413-T416 PolarHBondContact O-OG1 3.38Å; L413-T416 VanDerWaalsContact O-OG1 3.14Å; L413-Q417 HydrophobicContact CD1-CG 4.44Å; L413-Q417 VanDerWaalsContact O-CB 3.27Å; L413-Q417 WeakPolarHBondContact O-CB 3.29Å; L413-Q417 WeakPolarHBondContact O-CG 3.39Å; L413-Q417 PolarHBondContact O-N 2.71Å
414K87.2Confident84Confident131 Ų131101.1 Ų101.157%0.5751%0.508SS*.Hα-helixtrans-70.6-37.5176.1-71.4165.1-173.5163.20111.9Q410 R411 E412 A418Q410-K414 WeakPolarHBondContact O-CD 3.39Å; Q410-K414 WeakPolarHBondContact O-CG 3.31Å; Q410-K414 PolarHBondContact O-N 3.31Å; R411-K414 PolarHBondContact O-N 3.02Å; E412-K414 VanDerWaalsContact C-N 3.3Å; E412-K414 PolarHBondContact O-N 3.44Å; K414-A418 PolarHBondContact O-N 3.46Å
415A82.7Confident83.9Confident56 Ų56100.2 Ų100.246%0.46350%0.503SS..Hα-helixtrans-65.4-52175.800000111.7R411 E412 Q417 A418 E419R411-A415 PolarHBondContact O-N 2.92Å; E412-A415 PolarHBondContact O-N 3.31Å; A415-Q417 VanDerWaalsContact C-N 3.32Å; A415-Q417 PolarHBondContact O-N 2.98Å; A415-A418 WeakPolarHBondContact O-CA 3.41Å; A415-A418 WeakPolarHBondContact O-CB 3.46Å; A415-A418 PolarHBondContact O-N 3.02Å; A415-E419 PolarHBondContact O-N 3Å
416T82.3Confident83.9Confident79 Ų7999 Ų9949%0.48550%0.501SS..Hα-helixtrans-62.8-35.3177.751.50000112.5E412 L413 E419 L420E412-T416 WeakPolarHBondContact O-CB 3.28Å; E412-T416 WeakPolarHBondContact O-CG2 3.16Å; E412-T416 PolarHBondContact O-N 3.43Å; E412-T416 PolarHBondContact O-OG1 3.45Å; L413-T416 WeakPolarHBondContact CA-OG1 3.41Å; L413-T416 PolarHBondContact O-OG1 3.38Å; L413-T416 VanDerWaalsContact O-OG1 3.14Å; T416-E419 PolarHBondContact O-N 2.93Å; T416-L420 WeakPolarHBondContact O-CB 3.45Å; T416-L420 PolarHBondContact O-N 2.88Å
417Q81.5Confident83.9Confident104 Ų104102.3 Ų102.349%0.48651%0.507SS..Hα-helixtrans-62.8-42169.8-77.9174.18.200112.4L413 A415 L420 Q421L413-Q417 HydrophobicContact CD1-CG 4.44Å; L413-Q417 VanDerWaalsContact O-CB 3.27Å; L413-Q417 WeakPolarHBondContact O-CB 3.29Å; L413-Q417 WeakPolarHBondContact O-CG 3.39Å; L413-Q417 PolarHBondContact O-N 2.71Å; A415-Q417 VanDerWaalsContact C-N 3.32Å; A415-Q417 PolarHBondContact O-N 2.98Å; Q417-L420 PolarHBondContact O-N 3.33Å; Q417-Q421 WeakPolarHBondContact O-CG 3.42Å; Q417-Q421 PolarHBondContact O-N 3.39Å; Q417-Q421 VanDerWaalsContact O-N 3.11Å
418A83.3Confident83.8Confident64 Ų64102.8 Ų102.853%0.52951%0.51SS..Hα-helixtrans-66.2-40.3176.200000112.2K414 A415 Q421 K422K414-A418 PolarHBondContact O-N 3.46Å; A415-A418 WeakPolarHBondContact O-CA 3.41Å; A415-A418 WeakPolarHBondContact O-CB 3.46Å; A415-A418 PolarHBondContact O-N 3.02Å; A418-Q421 PolarHBondContact O-N 3.11Å; A418-K422 WeakPolarHBondContact O-CB 3.29Å; A418-K422 PolarHBondContact O-N 3.31Å
419E83.3Confident83.9Confident115 Ų115106 Ų10654%0.53752%0.517SS..Hα-helixtrans-64.9-40.1173.6-66.7-154.513100112.4A415 T416 Q421 K422 I423A415-E419 PolarHBondContact O-N 3Å; T416-E419 PolarHBondContact O-N 2.93Å; E419-Q421 VanDerWaalsContact C-N 3.34Å; E419-Q421 PolarHBondContact O-N 3.4Å; E419-K422 WeakPolarHBondContact O-CB 3.48Å; E419-K422 PolarHBondContact O-N 3.01Å; E419-I423 WeakPolarHBondContact O-CB 3.37Å; E419-I423 VanDerWaalsContact O-CG1 3.3Å; E419-I423 WeakPolarHBondContact O-CG1 3.39Å; E419-I423 PolarHBondContact O-N 2.94Å
420L81.1Confident83.8Confident91 Ų91104.7 Ų104.748%0.47651%0.514SS..Hα-helixtrans-59.9-42.1174.8178.661.9000112T416 Q417 I423 K424T416-L420 WeakPolarHBondContact O-CB 3.45Å; T416-L420 PolarHBondContact O-N 2.88Å; Q417-L420 PolarHBondContact O-N 3.33Å; L420-I423 PolarHBondContact O-N 3.05Å; L420-K424 WeakPolarHBondContact O-CG 3.26Å; L420-K424 PolarHBondContact O-N 3.46Å
421Q83.5Confident83.8Confident122 Ų122103 Ų10357%0.5751%0.509SS*.Hα-helixtrans-67.6-38.8175.4-60.9-65.714.200111.8Q417 A418 E419 K424 H425Q417-Q421 WeakPolarHBondContact O-CG 3.42Å; Q417-Q421 PolarHBondContact O-N 3.39Å; Q417-Q421 VanDerWaalsContact O-N 3.11Å; A418-Q421 PolarHBondContact O-N 3.11Å; E419-Q421 VanDerWaalsContact C-N 3.34Å; E419-Q421 PolarHBondContact O-N 3.4Å; Q421-K424 PolarHBondContact O-N 2.87Å; Q421-H425 PolarHBondContact O-N 2.85Å
422K86.6Confident83.7Confident136 Ų136102.4 Ų102.459%0.59151%0.513SS*.Hα-helixtrans-62.4-42.5174.3-174.8-176.5177.5-172.30111.8A418 E419 H425 L426A418-K422 WeakPolarHBondContact O-CB 3.29Å; A418-K422 PolarHBondContact O-N 3.31Å; E419-K422 WeakPolarHBondContact O-CB 3.48Å; E419-K422 PolarHBondContact O-N 3.01Å; K422-H425 PolarHBondContact O-N 2.99Å; K422-L426 HydrophobicContact CG-CD1 4.42Å; K422-L426 VanDerWaalsContact O-CG 3.3Å; K422-L426 WeakPolarHBondContact O-CG 3.35Å; K422-L426 PolarHBondContact O-N 3.32Å
423I82.1Confident83.8Confident107 Ų107102 Ų10255%0.54951%0.511SS..Hα-helixtrans-67.1-41.3176.9-70166.5000111E419 L420 L426 Y427E419-I423 WeakPolarHBondContact O-CB 3.37Å; E419-I423 VanDerWaalsContact O-CG1 3.3Å; E419-I423 WeakPolarHBondContact O-CG1 3.39Å; E419-I423 PolarHBondContact O-N 2.94Å; L420-I423 PolarHBondContact O-N 3.05Å; I423-L426 PolarHBondContact O-N 2.93Å; I423-Y427 WeakPolarHBondContact O-CB 3.45Å; I423-Y427 PolarHBondContact O-N 2.96Å
424K84.8Confident83.9Confident96 Ų96104.9 Ų104.942%0.41752%0.52SS..Hα-helixtrans-58.1-48.9173.1-76.9172.7177.2-178.50112L420 Q421 L426 Y427 E428L420-K424 WeakPolarHBondContact O-CG 3.26Å; L420-K424 PolarHBondContact O-N 3.46Å; Q421-K424 PolarHBondContact O-N 2.87Å; K424-L426 VanDerWaalsContact C-N 3.33Å; K424-L426 PolarHBondContact O-N 3.27Å; K424-Y427 WeakPolarHBondContact O-CB 3.3Å; K424-Y427 PolarHBondContact O-N 3.3Å; K424-Y427 VanDerWaalsContact O-N 3.11Å; K424-E428 WeakPolarHBondContact O-CG 3.46Å; K424-E428 PolarHBondContact O-N 3.07Å
425H85.1Confident83.7Confident114 Ų114103.3 Ų103.353%0.52851%0.514SS..Hα-helixtrans-63.4-37.2178.3-176.353.4000112.9Q421 K422 E428 K429Q421-H425 PolarHBondContact O-N 2.85Å; K422-H425 PolarHBondContact O-N 2.99Å; H425-E428 IonicContact ND1-OE2 3.17Å; H425-K429 WeakPolarHBondContact O-CB 3.38Å; H425-K429 PolarHBondContact O-N 3.03Å
426L86Confident83.8Confident101 Ų101103 Ų10353%0.52951%0.512SS..Hα-helixtrans-67.9-35.3173-70.8172.7000112.5K422 I423 K424 A430K422-L426 HydrophobicContact CG-CD1 4.42Å; K422-L426 VanDerWaalsContact O-CG 3.3Å; K422-L426 WeakPolarHBondContact O-CG 3.35Å; K422-L426 PolarHBondContact O-N 3.32Å; I423-L426 PolarHBondContact O-N 2.93Å; K424-L426 VanDerWaalsContact C-N 3.33Å; K424-L426 PolarHBondContact O-N 3.27Å; L426-A430 WeakPolarHBondContact O-CB 3.41Å; L426-A430 PolarHBondContact O-N 2.73Å
427Y82.2Confident83.8Confident164 Ų164104.5 Ų104.564%0.64352%0.516SS*.Hα-helixtrans-67.3-47.2174.8176.3-93.2000111.8I423 K424 K429 A430 V431I423-Y427 WeakPolarHBondContact O-CB 3.45Å; I423-Y427 PolarHBondContact O-N 2.96Å; K424-Y427 WeakPolarHBondContact O-CB 3.3Å; K424-Y427 PolarHBondContact O-N 3.3Å; K424-Y427 VanDerWaalsContact O-N 3.11Å; Y427-K429 VanDerWaalsContact C-N 3.34Å; Y427-K429 PolarHBondContact O-N 2.96Å; Y427-A430 WeakPolarHBondContact O-CB 3.4Å; Y427-A430 PolarHBondContact O-N 2.69Å; Y427-A430 VanDerWaalsContact O-N 3.12Å; Y427-V431 HydrophobicContact CD1-CG2 4.31Å; Y427-V431 HydrophobicContact CE1-CG2 3.89Å; Y427-V431 HydrophobicContact CE2-CG2 4.5Å; Y427-V431 WeakPolarHBondContact O-CG2 3.25Å; Y427-V431 PolarHBondContact O-N 2.96Å
428E84.8Confident83.9Confident109 Ų109102.3 Ų102.351%0.50952%0.516SS..Hα-helixtrans-54.8-50174-71.6162.1178.200110.6K424 H425 A430 V431 E432K424-E428 WeakPolarHBondContact O-CG 3.46Å; K424-E428 PolarHBondContact O-N 3.07Å; H425-E428 IonicContact ND1-OE2 3.17Å; E428-A430 VanDerWaalsContact C-N 3.32Å; E428-A430 PolarHBondContact O-N 3.04Å; E428-V431 WeakPolarHBondContact O-CB 3.24Å; E428-V431 PolarHBondContact O-N 3.28Å; E428-V431 VanDerWaalsContact O-N 3.09Å; E428-E432 PolarHBondContact O-N 3.23Å
429K85.2Confident84Confident102 Ų102107.3 Ų107.344%0.44352%0.522SS..Hα-helixtrans-61.8-35.4176.1-173173.2-176.9173.80113.4H425 Y427 E432 Q433H425-K429 WeakPolarHBondContact O-CB 3.38Å; H425-K429 PolarHBondContact O-N 3.03Å; Y427-K429 VanDerWaalsContact C-N 3.34Å; Y427-K429 PolarHBondContact O-N 2.96Å; K429-E432 PolarHBondContact O-N 2.83Å; K429-Q433 WeakPolarHBondContact O-CB 3.25Å; K429-Q433 VanDerWaalsContact O-CG 3.3Å; K429-Q433 WeakPolarHBondContact O-CG 3.4Å; K429-Q433 PolarHBondContact O-N 3.4Å
430A82.7Confident84.2Confident49 Ų49107.1 Ų107.141%0.40552%0.521SS..Hα-helixtrans-70.4-32.3174.800000112.3L426 Y427 E428 K434L426-A430 WeakPolarHBondContact O-CB 3.41Å; L426-A430 PolarHBondContact O-N 2.73Å; Y427-A430 WeakPolarHBondContact O-CB 3.4Å; Y427-A430 PolarHBondContact O-N 2.69Å; Y427-A430 VanDerWaalsContact O-N 3.12Å; E428-A430 VanDerWaalsContact C-N 3.32Å; E428-A430 PolarHBondContact O-N 3.04Å; A430-K434 WeakPolarHBondContact O-CB 3.29Å; A430-K434 PolarHBondContact O-N 3.12Å
431V83.2Confident84.2Confident52 Ų52107.1 Ų107.132%0.31552%0.521SS..Hα-helixtrans-68.4-44.7171.5172.70000110.7Y427 E428 Q433 K434 E435Y427-V431 HydrophobicContact CD1-CG2 4.31Å; Y427-V431 HydrophobicContact CE1-CG2 3.89Å; Y427-V431 HydrophobicContact CE2-CG2 4.5Å; Y427-V431 WeakPolarHBondContact O-CG2 3.25Å; Y427-V431 PolarHBondContact O-N 2.96Å; E428-V431 WeakPolarHBondContact O-CB 3.24Å; E428-V431 PolarHBondContact O-N 3.28Å; E428-V431 VanDerWaalsContact O-N 3.09Å; V431-Q433 VanDerWaalsContact C-N 3.34Å; V431-Q433 PolarHBondContact O-N 2.87Å; V431-K434 WeakPolarHBondContact O-CB 3.3Å; V431-K434 PolarHBondContact O-N 3.33Å; V431-E435 PolarHBondContact O-N 2.62Å
432E85.1Confident84.5Confident139 Ų139107.4 Ų107.465%0.6552%0.521SS*.Hα-helixtrans-57.8-44.9173.2-69.3-179.6155.200112E428 K429 E435 A436E428-E432 PolarHBondContact O-N 3.23Å; K429-E432 PolarHBondContact O-N 2.83Å; E432-E435 PolarHBondContact O-N 3.48Å; E432-A436 PolarHBondContact O-N 2.87Å
433Q84.3Confident84.5Confident115 Ų115106.5 Ų106.554%0.53752%0.517SS..Hα-helixtrans-64.1-40.8176.1-75.8178.2-22.400112.3K429 V431 E435 A436 L437K429-Q433 WeakPolarHBondContact O-CB 3.25Å; K429-Q433 VanDerWaalsContact O-CG 3.3Å; K429-Q433 WeakPolarHBondContact O-CG 3.4Å; K429-Q433 PolarHBondContact O-N 3.4Å; V431-Q433 VanDerWaalsContact C-N 3.34Å; V431-Q433 PolarHBondContact O-N 2.87Å; Q433-E435 VanDerWaalsContact C-N 3.34Å; Q433-E435 PolarHBondContact O-N 2.87Å; Q433-A436 PolarHBondContact O-N 3.3Å; Q433-L437 WeakPolarHBondContact O-CB 3.37Å; Q433-L437 WeakPolarHBondContact O-CG 3.37Å; Q433-L437 PolarHBondContact O-N 3.06Å
434K84.7Confident84.6Confident156 Ų156106 Ų10668%0.67851%0.514SS*.Hα-helixtrans-61.4-41.3173.8179.5-171172.7-1700111.5A430 V431 A438A430-K434 WeakPolarHBondContact O-CB 3.29Å; A430-K434 PolarHBondContact O-N 3.12Å; V431-K434 WeakPolarHBondContact O-CB 3.3Å; V431-K434 PolarHBondContact O-N 3.33Å; K434-A438 WeakPolarHBondContact O-CB 3.48Å; K434-A438 PolarHBondContact O-N 3.49Å
435E84Confident84.7Confident98 Ų98107 Ų10746%0.45852%0.521SS..Hα-helixtrans-66.9-41.2175.1-77.6-163.4-157.100112.6V431 E432 Q433 A438 R439V431-E435 PolarHBondContact O-N 2.62Å; E432-E435 PolarHBondContact O-N 3.48Å; Q433-E435 VanDerWaalsContact C-N 3.34Å; Q433-E435 PolarHBondContact O-N 2.87Å; E435-A438 PolarHBondContact O-N 2.9Å; E435-R439 VanDerWaalsContact O-CG 3.23Å; E435-R439 WeakPolarHBondContact O-CG 3.35Å; E435-R439 PolarHBondContact O-N 3.46Å; E435-R439 IonicContact OE2-CZ 3.7Å; E435-R439 IonicContact OE2-NE 3.25Å; E435-R439 IonicContact OE2-NH2 2.65Å; E435-R439 PolarHBondContact OE2-NH2 3.26Å
436A83.2Confident84.8Confident51 Ų51105 Ų10542%0.42151%0.514SS..Hα-helixtrans-59.1-49175.100000111.2E432 Q433 A438 R439 E440E432-A436 PolarHBondContact O-N 2.87Å; Q433-A436 PolarHBondContact O-N 3.3Å; A436-A438 VanDerWaalsContact C-N 3.31Å; A436-A438 PolarHBondContact O-N 3.02Å; A436-R439 PolarHBondContact O-N 2.87Å; A436-E440 WeakPolarHBondContact O-CB 3.49Å; A436-E440 PolarHBondContact O-N 3.46Å
437L82.4Confident84.9Confident109 Ų109103 Ų10357%0.57150%0.503SS*.Hα-helixtrans-63.4-33.2175.7-70.6170.1000112.8Q433 N441Q433-L437 WeakPolarHBondContact O-CB 3.37Å; Q433-L437 WeakPolarHBondContact O-CG 3.37Å; Q433-L437 PolarHBondContact O-N 3.06Å; L437-N441 WeakPolarHBondContact O-CB 3.35Å; L437-N441 PolarHBondContact O-N 3.48Å
438A84.5Confident84.9Confident59 Ų5999.5 Ų99.549%0.48850%0.496SS..Hα-helixtrans-68.9-38.7174.600000112.2K434 E435 A436 K442K434-A438 WeakPolarHBondContact O-CB 3.48Å; K434-A438 PolarHBondContact O-N 3.49Å; E435-A438 PolarHBondContact O-N 2.9Å; A436-A438 VanDerWaalsContact C-N 3.31Å; A436-A438 PolarHBondContact O-N 3.02Å; A438-K442 WeakPolarHBondContact O-CB 3.47Å; A438-K442 PolarHBondContact O-N 3.36Å
439R85.6Confident85.1Confident169 Ų16999.6 Ų99.664%0.63850%0.496SS*.Hα-helixtrans-67.6-41.8174.5-64.1164.4-158.9-174.37.5111.1E435 A436 K442 K443E435-R439 VanDerWaalsContact O-CG 3.23Å; E435-R439 WeakPolarHBondContact O-CG 3.35Å; E435-R439 PolarHBondContact O-N 3.46Å; E435-R439 IonicContact OE2-CZ 3.7Å; E435-R439 IonicContact OE2-NE 3.25Å; E435-R439 IonicContact OE2-NH2 2.65Å; E435-R439 PolarHBondContact OE2-NH2 3.26Å; A436-R439 PolarHBondContact O-N 2.87Å; R439-K442 PolarHBondContact O-N 3.12Å; R439-K443 PolarHBondContact O-N 3.44Å
440E86Confident85.2Confident111 Ų111101.3 Ų101.352%0.51951%0.505SS..Hα-helixtrans-65.8-46.6175.8-176.2174.4-159.100112A436 K442 K443 L444A436-E440 WeakPolarHBondContact O-CB 3.49Å; A436-E440 PolarHBondContact O-N 3.46Å; E440-K442 VanDerWaalsContact C-N 3.32Å; E440-K442 PolarHBondContact O-N 2.94Å; E440-K443 WeakPolarHBondContact O-CB 3.35Å; E440-K443 PolarHBondContact O-N 3.09Å; E440-K443 VanDerWaalsContact O-N 3.13Å; E440-L444 HydrophobicContact CG-CD1 4.17Å; E440-L444 WeakPolarHBondContact O-CG 3.44Å; E440-L444 PolarHBondContact O-N 2.77Å
441N82.4Confident85.3Confident90 Ų90101.8 Ų101.848%0.48151%0.509SS..Hα-helixtrans-61.8-39.9176.1-169.5-22000111.2L437 L444 Q445L437-N441 WeakPolarHBondContact O-CB 3.35Å; L437-N441 PolarHBondContact O-N 3.48Å; N441-L444 PolarHBondContact O-N 2.92Å; N441-Q445 WeakPolarHBondContact O-CG 3.35Å; N441-Q445 PolarHBondContact O-N 3.41Å; N441-Q445 PolarHBondContact OD1-NE2 3.25Å
442K88.5Confident85.4Confident129 Ų129105.3 Ų105.356%0.56152%0.52SS*.Hα-helixtrans-60.3-49.6171.1-166.2-161.4167.9-163.20111.3A438 R439 E440 L444 Q445 D446A438-K442 WeakPolarHBondContact O-CB 3.47Å; A438-K442 PolarHBondContact O-N 3.36Å; R439-K442 PolarHBondContact O-N 3.12Å; E440-K442 VanDerWaalsContact C-N 3.32Å; E440-K442 PolarHBondContact O-N 2.94Å; K442-L444 VanDerWaalsContact C-N 3.27Å; K442-L444 PolarHBondContact O-N 2.96Å; K442-Q445 WeakPolarHBondContact O-CA 3.5Å; K442-Q445 WeakPolarHBondContact O-CB 3.08Å; K442-Q445 PolarHBondContact O-N 3.08Å; K442-D446 VanDerWaalsContact CE-OD2 3.31Å; K442-D446 WeakPolarHBondContact CE-OD2 3.31Å; K442-D446 IonicContact NZ-OD2 3.69Å; K442-D446 PolarHBondContact O-N 3.41Å
443K88.2Confident85.5Confident117 Ų117104.3 Ų104.351%0.50952%0.515SS..Hα-helixtrans-55.1-43.9176.8-169.6-157.8177.9-56.20111.4R439 E440 Q445 D446 D447R439-K443 PolarHBondContact O-N 3.44Å; E440-K443 WeakPolarHBondContact O-CB 3.35Å; E440-K443 PolarHBondContact O-N 3.09Å; E440-K443 VanDerWaalsContact O-N 3.13Å; K443-Q445 VanDerWaalsContact C-N 3.31Å; K443-Q445 PolarHBondContact O-N 2.9Å; K443-D446 PolarHBondContact O-N 2.86Å; K443-D447 IonicContact NZ-OD1 2.68Å; K443-D447 PolarHBondContact NZ-OD1 2.88Å; K443-D447 IonicContact NZ-OD2 2.65Å; K443-D447 PolarHBondContact NZ-OD2 3.42Å; K443-D447 WeakPolarHBondContact O-CB 3.4Å; K443-D447 PolarHBondContact O-N 3.01Å
444L83.8Confident85.5Confident96 Ų96101.8 Ų101.850%0.50351%0.514SS..Hα-helixtrans-67.9-27.3177.8-68.9170.7000113.2E440 N441 K442 L448E440-L444 HydrophobicContact CG-CD1 4.17Å; E440-L444 WeakPolarHBondContact O-CG 3.44Å; E440-L444 PolarHBondContact O-N 2.77Å; N441-L444 PolarHBondContact O-N 2.92Å; K442-L444 VanDerWaalsContact C-N 3.27Å; K442-L444 PolarHBondContact O-N 2.96Å; L444-L448 WeakPolarHBondContact O-CB 3.48Å; L444-L448 PolarHBondContact O-N 3.12Å
445Q86.2Confident85.5Confident117 Ų11799.2 Ų99.255%0.54751%0.507SS..Hα-helixtrans-73.4-40.5170.8-71.7172.830.300111.9N441 K442 K443 L448 H449N441-Q445 WeakPolarHBondContact O-CG 3.35Å; N441-Q445 PolarHBondContact O-N 3.41Å; N441-Q445 PolarHBondContact OD1-NE2 3.25Å; K442-Q445 WeakPolarHBondContact O-CA 3.5Å; K442-Q445 WeakPolarHBondContact O-CB 3.08Å; K442-Q445 PolarHBondContact O-N 3.08Å; K443-Q445 VanDerWaalsContact C-N 3.31Å; K443-Q445 PolarHBondContact O-N 2.9Å; Q445-L448 PolarHBondContact O-N 3.35Å; Q445-H449 PolarHBondContact O-N 2.85Å
446D87.2Confident85.5Confident73 Ų7396.5 Ų96.539%0.3950%0.502SS..Hα-helixtrans-64.1-50.9174.4-61.7-29000109.7K442 K443 L448 H449 E450K442-D446 VanDerWaalsContact CE-OD2 3.31Å; K442-D446 WeakPolarHBondContact CE-OD2 3.31Å; K442-D446 IonicContact NZ-OD2 3.69Å; K442-D446 PolarHBondContact O-N 3.41Å; K443-D446 PolarHBondContact O-N 2.86Å; D446-L448 VanDerWaalsContact C-N 3.31Å; D446-L448 PolarHBondContact O-N 3.4Å; D446-H449 WeakPolarHBondContact O-CA 3.48Å; D446-H449 WeakPolarHBondContact O-CB 3.3Å; D446-H449 PolarHBondContact O-N 2.88Å; D446-E450 PolarHBondContact O-N 3.03Å
447D87.9Confident85.7Confident57 Ų5797.2 Ų97.231%0.30550%0.498SS..Hα-helixtrans-55.7-40.8174-64.1-17.7000112K443 H449 A451K443-D447 IonicContact NZ-OD1 2.68Å; K443-D447 PolarHBondContact NZ-OD1 2.88Å; K443-D447 IonicContact NZ-OD2 2.65Å; K443-D447 PolarHBondContact NZ-OD2 3.42Å; K443-D447 WeakPolarHBondContact O-CB 3.4Å; K443-D447 PolarHBondContact O-N 3.01Å; D447-H449 VanDerWaalsContact C-N 3.34Å; D447-A451 WeakPolarHBondContact O-CB 3.21Å; D447-A451 PolarHBondContact O-N 3.45Å
448L83.9Confident85.8Confident92 Ų9294.4 Ų94.448%0.48249%0.491SS..Hα-helixtrans-70.6-28.1176.7177.563.1000112.6L444 Q445 D446 K452L444-L448 WeakPolarHBondContact O-CB 3.48Å; L444-L448 PolarHBondContact O-N 3.12Å; Q445-L448 PolarHBondContact O-N 3.35Å; D446-L448 VanDerWaalsContact C-N 3.31Å; D446-L448 PolarHBondContact O-N 3.4Å; L448-K452 HydrophobicContact CG-CD 4.46Å; L448-K452 WeakPolarHBondContact O-CD 3.31Å; L448-K452 VanDerWaalsContact O-CG 3.27Å; L448-K452 WeakPolarHBondContact O-CG 3.43Å; L448-K452 PolarHBondContact O-N 3.25Å
449H88Confident85.8Confident111 Ų11195.8 Ų95.851%0.51449%0.49SS..Hα-helixtrans-72.6-47.3174.4-167.9-12.7000110.4Q445 D446 D447 A451 K452 E453Q445-H449 PolarHBondContact O-N 2.85Å; D446-H449 WeakPolarHBondContact O-CA 3.48Å; D446-H449 WeakPolarHBondContact O-CB 3.3Å; D446-H449 PolarHBondContact O-N 2.88Å; D447-H449 VanDerWaalsContact C-N 3.34Å; H449-A451 VanDerWaalsContact C-N 3.32Å; H449-A451 PolarHBondContact O-N 3.39Å; H449-K452 WeakPolarHBondContact O-CB 3.49Å; H449-K452 PolarHBondContact O-N 3.23Å; H449-K452 VanDerWaalsContact O-N 3.12Å; H449-E453 IonicContact CE1-OE1 2.66Å; H449-E453 PolarHBondContact CE1-OE1 3.49Å; H449-E453 PolarHBondContact O-N 3.41Å
450E87.7Confident85.7Confident138 Ų13895.2 Ų95.265%0.64549%0.488SS*.Hα-helixtrans-57.4-44.8174.1-68.2-175.1-17500111.2D446 K452 E453 A454D446-E450 PolarHBondContact O-N 3.03Å; E450-K452 VanDerWaalsContact C-N 3.29Å; E450-K452 PolarHBondContact O-N 3.2Å; E450-E453 PolarHBondContact O-N 3.07Å; E450-A454 WeakPolarHBondContact O-CB 3.34Å; E450-A454 PolarHBondContact O-N 3.43Å
451A84.6Confident85.8Confident58 Ų5895.4 Ų95.448%0.47949%0.487SS..Hα-helixtrans-61.8-33.8176.700000113.3D447 H449 L455D447-A451 WeakPolarHBondContact O-CB 3.21Å; D447-A451 PolarHBondContact O-N 3.45Å; H449-A451 VanDerWaalsContact C-N 3.32Å; H449-A451 PolarHBondContact O-N 3.39Å; A451-L455 WeakPolarHBondContact O-CB 3.44Å; A451-L455 PolarHBondContact O-N 3.11Å
452K86Confident85.9Confident126 Ų12695.5 Ų95.555%0.54849%0.487SS..Hα-helixtrans-73-37.1175-77.3168.6-177.4170.90112.6L448 H449 E450 L455 A456L448-K452 HydrophobicContact CG-CD 4.46Å; L448-K452 WeakPolarHBondContact O-CD 3.31Å; L448-K452 VanDerWaalsContact O-CG 3.27Å; L448-K452 WeakPolarHBondContact O-CG 3.43Å; L448-K452 PolarHBondContact O-N 3.25Å; H449-K452 WeakPolarHBondContact O-CB 3.49Å; H449-K452 PolarHBondContact O-N 3.23Å; H449-K452 VanDerWaalsContact O-N 3.12Å; E450-K452 VanDerWaalsContact C-N 3.29Å; E450-K452 PolarHBondContact O-N 3.2Å; K452-L455 PolarHBondContact O-N 2.88Å; K452-A456 WeakPolarHBondContact O-CB 3.28Å; K452-A456 PolarHBondContact O-N 3.04Å
453E86Confident85.8Confident118 Ų11894.9 Ų94.955%0.55149%0.486SS*.Hα-helixtrans-68.5-43.4174.5-66.3-163.114700111.2H449 E450 L455 A456 D457H449-E453 IonicContact CE1-OE1 2.66Å; H449-E453 PolarHBondContact CE1-OE1 3.49Å; H449-E453 PolarHBondContact O-N 3.41Å; E450-E453 PolarHBondContact O-N 3.07Å; E453-L455 VanDerWaalsContact C-N 3.3Å; E453-L455 PolarHBondContact O-N 3.06Å; E453-A456 WeakPolarHBondContact O-CB 3.32Å; E453-A456 PolarHBondContact O-N 3.39Å; E453-A456 VanDerWaalsContact O-N 3.11Å; E453-D457 PolarHBondContact O-N 3.01Å
454A85.7Confident85.7Confident62 Ų6295.3 Ų95.351%0.51249%0.49SS..Hα-helixtrans-58.9-39.9172.800000112.3E450 A458E450-A454 WeakPolarHBondContact O-CB 3.34Å; E450-A454 PolarHBondContact O-N 3.43Å; A454-A458 VanDerWaalsContact O-CB 3.31Å; A454-A458 WeakPolarHBondContact O-CB 3.3Å; A454-A458 PolarHBondContact O-N 2.9Å
455L82.9Confident85.7Confident102 Ų10295.2 Ų95.253%0.53449%0.49SS..Hα-helixtrans-67.4-38.5173.7-17962000112.4A451 K452 E453 A458 N459A451-L455 WeakPolarHBondContact O-CB 3.44Å; A451-L455 PolarHBondContact O-N 3.11Å; K452-L455 PolarHBondContact O-N 2.88Å; E453-L455 VanDerWaalsContact C-N 3.3Å; E453-L455 PolarHBondContact O-N 3.06Å; L455-A458 PolarHBondContact O-N 3.21Å; L455-N459 WeakPolarHBondContact O-CB 3.26Å; L455-N459 VanDerWaalsContact O-CG 3.27Å; L455-N459 PolarHBondContact O-N 3.38Å; L455-N459 PolarHBondContact O-ND2 3.01Å; L455-N459 VanDerWaalsContact O-ND2 3.1Å
456A85.6Confident85.5Confident41 Ų4193.8 Ų93.834%0.33949%0.485SS..Hα-helixtrans-64.2-42.4175.400000111.7K452 E453 N459 R460K452-A456 WeakPolarHBondContact O-CB 3.28Å; K452-A456 PolarHBondContact O-N 3.04Å; E453-A456 WeakPolarHBondContact O-CB 3.32Å; E453-A456 PolarHBondContact O-N 3.39Å; E453-A456 VanDerWaalsContact O-N 3.11Å; A456-N459 PolarHBondContact O-N 2.73Å; A456-R460 WeakPolarHBondContact O-CG 3.4Å; A456-R460 PolarHBondContact O-N 3.09Å
457D86.2Confident85.4Confident66 Ų6695.1 Ų95.135%0.35349%0.492SS..Hα-helixtrans-70-34.3174.9-98.717.9000113.3E453 R460 K461E453-D457 PolarHBondContact O-N 3.01Å; D457-R460 PolarHBondContact O-N 2.68Å; D457-R460 WeakPolarHBondContact OD1-CD 3.26Å; D457-R460 IonicContact OD1-CZ 2.58Å; D457-R460 IonicContact OD1-NE 3.94Å; D457-R460 IonicContact OD1-NH1 2.67Å; D457-R460 PolarHBondContact OD1-NH1 3.29Å; D457-K461 WeakPolarHBondContact O-CD 3.4Å; D457-K461 WeakPolarHBondContact O-CG 3.49Å; D457-K461 PolarHBondContact O-N 3.49Å
458A84Confident85.3Confident50 Ų5097.4 Ų97.441%0.41350%0.501SS..Hα-helixtrans-63.5-42.417100000111.3A454 L455 K461 L462A454-A458 VanDerWaalsContact O-CB 3.31Å; A454-A458 WeakPolarHBondContact O-CB 3.3Å; A454-A458 PolarHBondContact O-N 2.9Å; L455-A458 PolarHBondContact O-N 3.21Å; A458-K461 PolarHBondContact O-N 2.93Å; A458-L462 WeakPolarHBondContact O-CB 3.41Å; A458-L462 PolarHBondContact O-N 2.97Å
459N84.8Confident85.1Confident88 Ų8897.8 Ų97.847%0.47150%0.503SS..Hα-helixtrans-67.5-35.2176.1-73.1-35.2000112.8L455 A456 H463L455-N459 WeakPolarHBondContact O-CB 3.26Å; L455-N459 VanDerWaalsContact O-CG 3.27Å; L455-N459 PolarHBondContact O-N 3.38Å; L455-N459 PolarHBondContact O-ND2 3.01Å; L455-N459 VanDerWaalsContact O-ND2 3.1Å; A456-N459 PolarHBondContact O-N 2.73Å; N459-H463 PolarHBondContact O-N 3.43Å
460R84.4Confident84.9Confident158 Ų15895.4 Ų95.460%0.59650%0.503SS*.Hα-helixtrans-60.3-52170.7-73.6167.9179.4155.6-2.1111A456 D457 L462 H463 E464A456-R460 WeakPolarHBondContact O-CG 3.4Å; A456-R460 PolarHBondContact O-N 3.09Å; D457-R460 PolarHBondContact O-N 2.68Å; D457-R460 WeakPolarHBondContact OD1-CD 3.26Å; D457-R460 IonicContact OD1-CZ 2.58Å; D457-R460 IonicContact OD1-NE 3.94Å; D457-R460 IonicContact OD1-NH1 2.67Å; D457-R460 PolarHBondContact OD1-NH1 3.29Å; R460-L462 VanDerWaalsContact C-N 3.33Å; R460-L462 PolarHBondContact O-N 3.32Å; R460-H463 PolarHBondContact O-N 2.9Å; R460-H463 VanDerWaalsContact O-N 3.12Å; R460-E464 WeakPolarHBondContact O-CG 3.49Å; R460-E464 PolarHBondContact O-N 2.95Å
461K87.2Confident84.8Confident114 Ų11495.4 Ų95.450%0.49650%0.497SS..Hα-helixtrans-62.1-37.6178.5-72162.8-175.5157.40112.5D457 A458 E464 L465D457-K461 WeakPolarHBondContact O-CD 3.4Å; D457-K461 WeakPolarHBondContact O-CG 3.49Å; D457-K461 PolarHBondContact O-N 3.49Å; A458-K461 PolarHBondContact O-N 2.93Å; K461-E464 PolarHBondContact O-N 3.28Å; K461-L465 WeakPolarHBondContact O-CB 3.48Å; K461-L465 VanDerWaalsContact O-CG 3.25Å; K461-L465 WeakPolarHBondContact O-CG 3.36Å; K461-L465 PolarHBondContact O-N 3.33Å
462L85.3Confident84.7Confident93 Ų9395.9 Ų95.949%0.48749%0.492SS..Hα-helixtrans-61.3-45.4173.1-177.464.6000111A458 R460 L465 D466A458-L462 WeakPolarHBondContact O-CB 3.41Å; A458-L462 PolarHBondContact O-N 2.97Å; R460-L462 VanDerWaalsContact C-N 3.33Å; R460-L462 PolarHBondContact O-N 3.32Å; L462-L465 PolarHBondContact O-N 3.49Å; L462-D466 WeakPolarHBondContact O-CB 3.3Å; L462-D466 PolarHBondContact O-N 3.44Å
463H86.6Confident84.4Confident116 Ų11691.5 Ų91.554%0.53748%0.479SS..Hα-helixtrans-66.8-37.1178-168.852.9000113N459 R460 D466 L467N459-H463 PolarHBondContact O-N 3.43Å; R460-H463 PolarHBondContact O-N 2.9Å; R460-H463 VanDerWaalsContact O-N 3.12Å; H463-D466 PolarHBondContact O-N 2.78Å; H463-L467 VanDerWaalsContact O-CG 3.29Å; H463-L467 WeakPolarHBondContact O-CG 3.27Å; H463-L467 PolarHBondContact O-N 2.91Å
464E86.3Confident84.2Confident125 Ų12586.8 Ų86.858%0.58446%0.462SS*.Hα-helixtrans-61.6-44.6171.7-71.1167.5174.800111.4R460 K461 L467 E468R460-E464 WeakPolarHBondContact O-CG 3.49Å; R460-E464 PolarHBondContact O-N 2.95Å; K461-E464 PolarHBondContact O-N 3.28Å; E464-L467 PolarHBondContact O-N 3.12Å; E464-E468 PolarHBondContact O-N 3.23Å
465L83.7Confident84.1Confident95 Ų9587.3 Ų87.350%0.49745%0.454SS..Hα-helixtrans-67.6-34.6175.5-71.4168.5000112.9K461 L462 E468 N469K461-L465 WeakPolarHBondContact O-CB 3.48Å; K461-L465 VanDerWaalsContact O-CG 3.25Å; K461-L465 WeakPolarHBondContact O-CG 3.36Å; K461-L465 PolarHBondContact O-N 3.33Å; L462-L465 PolarHBondContact O-N 3.49Å; L465-E468 PolarHBondContact O-N 3.37Å; L465-N469 VanDerWaalsContact O-CB 3.27Å; L465-N469 WeakPolarHBondContact O-CB 3.24Å; L465-N469 VanDerWaalsContact O-CG 3.32Å; L465-N469 PolarHBondContact O-N 3.43Å; L465-N469 PolarHBondContact O-ND2 2.86Å
466D81.9Confident84Confident86 Ų8687 Ų8746%0.4645%0.451SS..Hα-helixtrans-67.1-39173.7-78.7-26.3000111.6L462 H463 A470L462-D466 WeakPolarHBondContact O-CB 3.3Å; L462-D466 PolarHBondContact O-N 3.44Å; H463-D466 PolarHBondContact O-N 2.78Å; D466-A470 VanDerWaalsContact O-CB 3.32Å; D466-A470 WeakPolarHBondContact O-CB 3.28Å; D466-A470 PolarHBondContact O-N 3.15Å
467L85Confident83.9Confident102 Ų10292.4 Ų92.453%0.53446%0.463SS..Hα-helixtrans-66.3-40.9173.3-71.8167.9000111.6H463 E464 A470 R471H463-L467 VanDerWaalsContact O-CG 3.29Å; H463-L467 WeakPolarHBondContact O-CG 3.27Å; H463-L467 PolarHBondContact O-N 2.91Å; E464-L467 PolarHBondContact O-N 3.12Å; L467-A470 PolarHBondContact O-N 2.93Å; L467-R471 WeakPolarHBondContact O-CB 3.28Å; L467-R471 PolarHBondContact O-N 3.28Å
468E85.3Confident83.7Confident105 Ų10596 Ų9649%0.49148%0.477SS..Hα-helixtrans-66.8-43.3174.3-174.6163.8-145.300111.9E464 L465 A470 R471 L472E464-E468 PolarHBondContact O-N 3.23Å; L465-E468 PolarHBondContact O-N 3.37Å; E468-A470 VanDerWaalsContact C-N 3.32Å; E468-A470 PolarHBondContact O-N 3.23Å; E468-R471 WeakPolarHBondContact O-CB 3.5Å; E468-R471 PolarHBondContact O-N 2.88Å; E468-R471 VanDerWaalsContact O-N 3.12Å; E468-L472 HydrophobicContact CG-CD1 4Å; E468-L472 HydrophobicContact CG-CG 4.34Å; E468-L472 WeakPolarHBondContact O-CB 3.47Å; E468-L472 WeakPolarHBondContact O-CG 3.48Å; E468-L472 PolarHBondContact O-N 2.83Å
469N80.9Confident83.5Confident99 Ų9999.4 Ų99.453%0.52949%0.488SS..Hα-helixtrans-59-41.1172.5-83.3-47.6000111.9L465 R471 L472 A473L465-N469 VanDerWaalsContact O-CB 3.27Å; L465-N469 WeakPolarHBondContact O-CB 3.24Å; L465-N469 VanDerWaalsContact O-CG 3.32Å; L465-N469 PolarHBondContact O-N 3.43Å; L465-N469 PolarHBondContact O-ND2 2.86Å; N469-R471 VanDerWaalsContact C-N 3.34Å; N469-L472 PolarHBondContact O-N 3.01Å; N469-A473 WeakPolarHBondContact O-CB 3.44Å; N469-A473 PolarHBondContact O-N 2.92Å
470A82.6Confident83.3Confident62 Ų62100.1 Ų100.151%0.51249%0.489SS..Hα-helixtrans-64.6-38.4174.900000112.1D466 L467 E468 G474D466-A470 VanDerWaalsContact O-CB 3.32Å; D466-A470 WeakPolarHBondContact O-CB 3.28Å; D466-A470 PolarHBondContact O-N 3.15Å; L467-A470 PolarHBondContact O-N 2.93Å; E468-A470 VanDerWaalsContact C-N 3.32Å; E468-A470 PolarHBondContact O-N 3.23Å; A470-G474 PolarHBondContact O-N 3.22Å
471R86.8Confident83.3Confident138 Ų13896.3 Ų96.352%0.52148%0.483SS..Hα-helixtrans-64.2-50175-155-17185.468.513.4111.4L467 E468 N469 A473 G474 E475L467-R471 WeakPolarHBondContact O-CB 3.28Å; L467-R471 PolarHBondContact O-N 3.28Å; E468-R471 WeakPolarHBondContact O-CB 3.5Å; E468-R471 PolarHBondContact O-N 2.88Å; E468-R471 VanDerWaalsContact O-N 3.12Å; N469-R471 VanDerWaalsContact C-N 3.34Å; R471-A473 PolarHBondContact O-N 3.39Å; R471-G474 WeakPolarHBondContact O-CA 3.25Å; R471-G474 PolarHBondContact O-N 3.48Å; R471-E475 IonicContact CZ-OE1 3.7Å; R471-E475 IonicContact CZ-OE2 2.68Å; R471-E475 IonicContact NH1-OE1 2.72Å; R471-E475 PolarHBondContact NH1-OE1 2.94Å; R471-E475 IonicContact NH1-OE2 2.73Å; R471-E475 IonicContact NH2-OE1 3.98Å; R471-E475 PolarHBondContact NH2-OE1 2.94Å; R471-E475 IonicContact NH2-OE2 2.97Å; R471-E475 PolarHBondContact NH2-OE2 3.24Å; R471-E475 PolarHBondContact O-N 3.36Å
472L80.8Confident83.2Confident68 Ų6893.3 Ų93.336%0.35648%0.479SS..Hα-helixtrans-64.2-38.3177.5-67.8170000111.8E468 N469 G474 E475 I476E468-L472 HydrophobicContact CG-CD1 4Å; E468-L472 HydrophobicContact CG-CG 4.34Å; E468-L472 WeakPolarHBondContact O-CB 3.47Å; E468-L472 WeakPolarHBondContact O-CG 3.48Å; E468-L472 PolarHBondContact O-N 2.83Å; N469-L472 PolarHBondContact O-N 3.01Å; L472-G474 PolarHBondContact O-N 3.05Å; L472-E475 PolarHBondContact O-N 3Å; L472-I476 WeakPolarHBondContact O-CB 3.46Å; L472-I476 VanDerWaalsContact O-CG1 3.23Å; L472-I476 WeakPolarHBondContact O-CG1 3.41Å; L472-I476 PolarHBondContact O-N 3Å
473A81.5Confident82.9Confident34 Ų3493.8 Ų93.828%0.28148%0.482SS..Hα-helixtrans-66.1-25.4172.200000112.7N469 R471 R477N469-A473 WeakPolarHBondContact O-CB 3.44Å; N469-A473 PolarHBondContact O-N 2.92Å; R471-A473 PolarHBondContact O-N 3.39Å; A473-R477 WeakPolarHBondContact O-CG 3.31Å; A473-R477 PolarHBondContact O-N 3.35Å; A473-R477 PolarHBondContact O-NH1 2.99Å
474G80.7Confident82.8Confident19 Ų1994.8 Ų94.820%0.19649%0.485CS..Hα-helixtrans-65.3-59.2165.900000111.6A470 R471 L472 I476 R477 E478A470-G474 PolarHBondContact O-N 3.22Å; R471-G474 WeakPolarHBondContact O-CA 3.25Å; R471-G474 PolarHBondContact O-N 3.48Å; L472-G474 PolarHBondContact O-N 3.05Å; G474-I476 VanDerWaalsContact C-N 3.26Å; G474-I476 PolarHBondContact O-N 2.77Å; G474-R477 WeakPolarHBondContact O-CB 3.36Å; G474-R477 PolarHBondContact O-N 3.23Å; G474-E478 PolarHBondContact O-N 3.2Å
475E83.7Confident82.6Confident73 Ų7395.1 Ų95.134%0.34149%0.486SS..Hα-helixtrans-57-37.5-179.7-67.5-179.5155.400112.3R471 L472 R477 E478 L479R471-E475 IonicContact CZ-OE1 3.7Å; R471-E475 IonicContact CZ-OE2 2.68Å; R471-E475 IonicContact NH1-OE1 2.72Å; R471-E475 PolarHBondContact NH1-OE1 2.94Å; R471-E475 IonicContact NH1-OE2 2.73Å; R471-E475 IonicContact NH2-OE1 3.98Å; R471-E475 PolarHBondContact NH2-OE1 2.94Å; R471-E475 IonicContact NH2-OE2 2.97Å; R471-E475 PolarHBondContact NH2-OE2 3.24Å; R471-E475 PolarHBondContact O-N 3.36Å; L472-E475 PolarHBondContact O-N 3Å; E475-R477 PolarHBondContact O-N 3Å; E475-E478 PolarHBondContact O-N 2.96Å; E475-L479 WeakPolarHBondContact O-CB 3.27Å; E475-L479 VanDerWaalsContact O-CG 3.24Å; E475-L479 WeakPolarHBondContact O-CG 3.41Å; E475-L479 PolarHBondContact O-N 2.93Å
476I81.4Confident82.4Confident94 Ų9493.5 Ų93.548%0.48249%0.487SS..Hα-helixtrans-62.5-39.5174.2-72.1165.4000111.8L472 G474 Q480L472-I476 WeakPolarHBondContact O-CB 3.46Å; L472-I476 VanDerWaalsContact O-CG1 3.23Å; L472-I476 WeakPolarHBondContact O-CG1 3.41Å; L472-I476 PolarHBondContact O-N 3Å; G474-I476 VanDerWaalsContact C-N 3.26Å; G474-I476 PolarHBondContact O-N 2.77Å; I476-Q480 WeakPolarHBondContact O-CB 3.49Å; I476-Q480 VanDerWaalsContact O-CG 3.23Å; I476-Q480 WeakPolarHBondContact O-CG 3.43Å; I476-Q480 PolarHBondContact O-N 3.39Å
477R83.4Confident82.3Confident156 Ų15692.5 Ų92.559%0.58948%0.479SS*.Hα-helixtrans-68.8-41.8176.2-69.9179.7-148.7107.5-0.4111.4A473 G474 E475 Q480 V481A473-R477 WeakPolarHBondContact O-CG 3.31Å; A473-R477 PolarHBondContact O-N 3.35Å; A473-R477 PolarHBondContact O-NH1 2.99Å; G474-R477 WeakPolarHBondContact O-CB 3.36Å; G474-R477 PolarHBondContact O-N 3.23Å; E475-R477 PolarHBondContact O-N 3Å; R477-Q480 PolarHBondContact O-N 2.93Å; R477-V481 WeakPolarHBondContact O-CG2 3.38Å; R477-V481 PolarHBondContact O-N 3.45Å
478E81.4Confident82.2Confident140 Ų14090 Ų9065%0.65447%0.473SS*.Hα-helixtrans-61.9-46.1176.6-68.1177.5-174.900111.2G474 E475 Q480 V481 A482G474-E478 PolarHBondContact O-N 3.2Å; E475-E478 PolarHBondContact O-N 2.96Å; E478-Q480 VanDerWaalsContact C-N 3.32Å; E478-Q480 PolarHBondContact O-N 3.24Å; E478-V481 PolarHBondContact O-N 2.9Å; E478-V481 VanDerWaalsContact O-N 3.16Å; E478-A482 PolarHBondContact O-N 3.39Å
479L80.9Confident82.1Confident123 Ų12387.7 Ų87.764%0.64447%0.472SS*.Hα-helixtrans-63.2-34.9174.3-70.4170.3000112.6E475 L483E475-L479 WeakPolarHBondContact O-CB 3.27Å; E475-L479 VanDerWaalsContact O-CG 3.24Å; E475-L479 WeakPolarHBondContact O-CG 3.41Å; E475-L479 PolarHBondContact O-N 2.93Å; L479-L483 VanDerWaalsContact O-CB 3.22Å; L479-L483 WeakPolarHBondContact O-CB 3.33Å; L479-L483 PolarHBondContact O-N 2.95Å
480Q80Confident82.1Confident103 Ų10389.4 Ų89.448%0.48147%0.471SS..Hα-helixtrans-68.9-32.2173.3-78.417713.300113.3I476 R477 E478 K484I476-Q480 WeakPolarHBondContact O-CB 3.49Å; I476-Q480 VanDerWaalsContact O-CG 3.23Å; I476-Q480 WeakPolarHBondContact O-CG 3.43Å; I476-Q480 PolarHBondContact O-N 3.39Å; R477-Q480 PolarHBondContact O-N 2.93Å; E478-Q480 VanDerWaalsContact C-N 3.32Å; E478-Q480 PolarHBondContact O-N 3.24Å; Q480-K484 VanDerWaalsContact O-CG 3.32Å; Q480-K484 WeakPolarHBondContact O-CG 3.44Å; Q480-K484 PolarHBondContact O-N 2.85Å
481V84.3Confident82.1Confident78 Ų7892.3 Ų92.347%0.47347%0.469SS..Hα-helixtrans-70.5-51.3172.6172.40000109.9R477 E478 L483 K484 E485R477-V481 WeakPolarHBondContact O-CG2 3.38Å; R477-V481 PolarHBondContact O-N 3.45Å; E478-V481 PolarHBondContact O-N 2.9Å; E478-V481 VanDerWaalsContact O-N 3.16Å; V481-L483 VanDerWaalsContact C-N 3.25Å; V481-L483 PolarHBondContact O-N 3.28Å; V481-K484 WeakPolarHBondContact O-CB 3.19Å; V481-K484 PolarHBondContact O-N 3.01Å; V481-E485 PolarHBondContact O-N 3.31Å
482A84.4Confident82Confident50 Ų5090.5 Ų90.541%0.41347%0.469SS..Hα-helixtrans-57.8-36.7177.300000112.6E478 A486E478-A482 PolarHBondContact O-N 3.39Å; A482-A486 VanDerWaalsContact O-CB 3.28Å; A482-A486 WeakPolarHBondContact O-CB 3.32Å; A482-A486 PolarHBondContact O-N 3.5Å
483L78.8Confident82Confident103 Ų10389.6 Ų89.654%0.53947%0.472SS..Hα-helixtrans-63.8-44.6173.4179.962.7000112L479 V481 A486 E487L479-L483 VanDerWaalsContact O-CB 3.22Å; L479-L483 WeakPolarHBondContact O-CB 3.33Å; L479-L483 PolarHBondContact O-N 2.95Å; V481-L483 VanDerWaalsContact C-N 3.25Å; V481-L483 PolarHBondContact O-N 3.28Å; L483-A486 PolarHBondContact O-N 2.94Å; L483-E487 HydrophobicContact CD1-CG 4.49Å; L483-E487 WeakPolarHBondContact O-CG 3.43Å; L483-E487 PolarHBondContact O-N 3.42Å
484K84.2Confident81.9Confident138 Ų13891.6 Ų91.660%0.648%0.476SS*.Hα-helixtrans-64-40.2177.9-74.3169.6-176.9174.80112.1Q480 V481 E487 A488Q480-K484 VanDerWaalsContact O-CG 3.32Å; Q480-K484 WeakPolarHBondContact O-CG 3.44Å; Q480-K484 PolarHBondContact O-N 2.85Å; V481-K484 WeakPolarHBondContact O-CB 3.19Å; V481-K484 PolarHBondContact O-N 3.01Å; K484-E487 PolarHBondContact O-N 3.12Å; K484-A488 WeakPolarHBondContact O-CB 3.38Å; K484-A488 PolarHBondContact O-N 2.9Å
485E82.6Confident82.1Confident131 Ų13193.4 Ų93.461%0.61248%0.483SS*.Hα-helixtrans-65.4-44.3174.9-68.6178.7172.300111.5V481 E487 A488 A489V481-E485 PolarHBondContact O-N 3.31Å; E485-E487 PolarHBondContact O-N 2.92Å; E485-A488 PolarHBondContact O-N 2.91Å; E485-A489 PolarHBondContact O-N 2.61Å
486A80.1Confident82.2Confident62 Ų6297.3 Ų97.351%0.51250%0.495SS..Hα-helixtrans-62.6-40.5174.900000112.4A482 L483 R490A482-A486 VanDerWaalsContact O-CB 3.28Å; A482-A486 WeakPolarHBondContact O-CB 3.32Å; A482-A486 PolarHBondContact O-N 3.5Å; L483-A486 PolarHBondContact O-N 2.94Å; A486-R490 WeakPolarHBondContact O-CB 3.49Å; A486-R490 PolarHBondContact O-N 2.69Å
487E80Confident82.2Confident65 Ų6595.5 Ų95.530%0.30449%0.493SS..Hα-helixtrans-66.6-38.2173.5-71.7-167.5163.900112.8L483 K484 E485 R490 R491L483-E487 HydrophobicContact CD1-CG 4.49Å; L483-E487 WeakPolarHBondContact O-CG 3.43Å; L483-E487 PolarHBondContact O-N 3.42Å; K484-E487 PolarHBondContact O-N 3.12Å; E485-E487 PolarHBondContact O-N 2.92Å; E487-R490 WeakPolarHBondContact O-CB 3.38Å; E487-R490 PolarHBondContact O-N 3.06Å; E487-R491 VanDerWaalsContact CB-NH1 3.25Å; E487-R491 WeakPolarHBondContact O-CG 3.21Å; E487-R491 PolarHBondContact O-N 2.81Å; E487-R491 IonicContact OE2-CZ 2.75Å; E487-R491 VanDerWaalsContact OE2-CZ 3.24Å; E487-R491 IonicContact OE2-NH1 3.58Å; E487-R491 PolarHBondContact OE2-NH1 2.97Å; E487-R491 IonicContact OE2-NH2 3.55Å; E487-R491 PolarHBondContact OE2-NH2 3.25Å
488A82.9Confident82.2Confident48 Ų4894.1 Ų94.140%0.39749%0.493SS..Hα-helixtrans-62.4-48.4175.300000110.6K484 E485 R490 R491 D492K484-A488 WeakPolarHBondContact O-CB 3.38Å; K484-A488 PolarHBondContact O-N 2.9Å; E485-A488 PolarHBondContact O-N 2.91Å; A488-R490 PolarHBondContact O-N 3.49Å; A488-R491 PolarHBondContact O-N 3.23Å; A488-R491 VanDerWaalsContact O-N 3.14Å; A488-D492 PolarHBondContact O-N 3.1Å
489A82.1Confident82.4Confident58 Ų5895.2 Ų95.248%0.47949%0.492SS..Hα-helixtrans-59.1-34.5173.200000112.6E485 A493E485-A489 PolarHBondContact O-N 2.61Å; A489-A493 WeakPolarHBondContact O-CB 3.34Å; A489-A493 PolarHBondContact O-N 3.11Å
490R81.8Confident82.4Confident135 Ų13591.4 Ų91.451%0.50948%0.478SS..Hα-helixtrans-66.2-45.1174-152.6-164.989.8-153.11.8112.1A486 E487 A488 D492 A493 E494A486-R490 WeakPolarHBondContact O-CB 3.49Å; A486-R490 PolarHBondContact O-N 2.69Å; E487-R490 WeakPolarHBondContact O-CB 3.38Å; E487-R490 PolarHBondContact O-N 3.06Å; A488-R490 PolarHBondContact O-N 3.49Å; R490-D492 VanDerWaalsContact C-N 3.33Å; R490-D492 PolarHBondContact O-N 3.4Å; R490-A493 WeakPolarHBondContact O-CB 3.43Å; R490-A493 PolarHBondContact O-N 2.93Å; R490-A493 VanDerWaalsContact O-N 3.13Å; R490-E494 IonicContact CZ-OE1 2.62Å; R490-E494 IonicContact NE-OE1 3.18Å; R490-E494 PolarHBondContact NE-OE1 3.38Å; R490-E494 IonicContact NH2-OE1 3.16Å; R490-E494 PolarHBondContact NH2-OE1 3.14Å; R490-E494 IonicContact NH2-OE2 3.6Å; R490-E494 WeakPolarHBondContact O-CG 3.47Å; R490-E494 PolarHBondContact O-N 3.27Å
491R83.5Confident82.5Confident122 Ų12290.3 Ų90.346%0.4648%0.478SS..Hα-helixtrans-63.2-38.1176.4-69.9168.2-177.6114.58.5111.8E487 A488 A493 E494 T495E487-R491 VanDerWaalsContact CB-NH1 3.25Å; E487-R491 WeakPolarHBondContact O-CG 3.21Å; E487-R491 PolarHBondContact O-N 2.81Å; E487-R491 IonicContact OE2-CZ 2.75Å; E487-R491 VanDerWaalsContact OE2-CZ 3.24Å; E487-R491 IonicContact OE2-NH1 3.58Å; E487-R491 PolarHBondContact OE2-NH1 2.97Å; E487-R491 IonicContact OE2-NH2 3.55Å; E487-R491 PolarHBondContact OE2-NH2 3.25Å; A488-R491 PolarHBondContact O-N 3.23Å; A488-R491 VanDerWaalsContact O-N 3.14Å; R491-A493 VanDerWaalsContact C-N 3.33Å; R491-E494 PolarHBondContact O-N 3.14Å; R491-T495 WeakPolarHBondContact O-CG2 3.41Å; R491-T495 PolarHBondContact O-N 3.15Å; R491-T495 PolarHBondContact O-OG1 3.25Å
492D83.6Confident82.4Confident100 Ų10089.1 Ų89.154%0.53548%0.476SS..Hα-helixtrans-69.6-28.2173.3-835.2000113A488 R490 T495 R496A488-D492 PolarHBondContact O-N 3.1Å; R490-D492 VanDerWaalsContact C-N 3.33Å; R490-D492 PolarHBondContact O-N 3.4Å; D492-T495 PolarHBondContact O-OG1 2.96Å; D492-R496 WeakPolarHBondContact O-CG 3.47Å; D492-R496 PolarHBondContact O-N 3.13Å; D492-R496 PolarHBondContact O-NE 2.66Å; D492-R496 PolarHBondContact O-NH2 2.68Å
493A80.2Confident82.4Confident50 Ų5092.9 Ų92.941%0.41349%0.485SS..Hα-helixtrans-75.5-43.5171.300000111.6A489 R490 R491 R496 A497A489-A493 WeakPolarHBondContact O-CB 3.34Å; A489-A493 PolarHBondContact O-N 3.11Å; R490-A493 WeakPolarHBondContact O-CB 3.43Å; R490-A493 PolarHBondContact O-N 2.93Å; R490-A493 VanDerWaalsContact O-N 3.13Å; R491-A493 VanDerWaalsContact C-N 3.33Å; A493-R496 PolarHBondContact O-N 3.17Å; A493-A497 WeakPolarHBondContact O-CB 3.48Å; A493-A497 PolarHBondContact O-N 3.46Å
494E80.8Confident82.4Confident76 Ų7693.6 Ų93.636%0.35549%0.489SS..Hα-helixtrans-59.7-46.6176.8-75.9169.6177.600112R490 R491 R496 A497 Q498R490-E494 IonicContact CZ-OE1 2.62Å; R490-E494 IonicContact NE-OE1 3.18Å; R490-E494 PolarHBondContact NE-OE1 3.38Å; R490-E494 IonicContact NH2-OE1 3.16Å; R490-E494 PolarHBondContact NH2-OE1 3.14Å; R490-E494 IonicContact NH2-OE2 3.6Å; R490-E494 WeakPolarHBondContact O-CG 3.47Å; R490-E494 PolarHBondContact O-N 3.27Å; R491-E494 PolarHBondContact O-N 3.14Å; E494-R496 PolarHBondContact O-N 3.48Å; E494-A497 PolarHBondContact O-N 2.85Å; E494-Q498 VanDerWaalsContact O-CG 3.31Å; E494-Q498 WeakPolarHBondContact O-CG 3.32Å; E494-Q498 PolarHBondContact O-N 3.26Å
495T83.5Confident82.2Confident56 Ų5692.9 Ų92.934%0.34449%0.488SS..Hα-helixtrans-67.7-32.3177.749.40000113.1R491 D492 R499R491-T495 WeakPolarHBondContact O-CG2 3.41Å; R491-T495 PolarHBondContact O-N 3.15Å; R491-T495 PolarHBondContact O-OG1 3.25Å; D492-T495 PolarHBondContact O-OG1 2.96Å; T495-R499 WeakPolarHBondContact O-CG 3.34Å; T495-R499 PolarHBondContact O-N 3.41Å; T495-R499 VanDerWaalsContact O-N 3.14Å
496R86.3Confident82.2Confident156 Ų15689.7 Ų89.759%0.58948%0.484SS*.Hα-helixtrans-67.7-41.6170.2-81.2178.4-74.2179.3-4112D492 A493 E494 R499 A500D492-R496 WeakPolarHBondContact O-CG 3.47Å; D492-R496 PolarHBondContact O-N 3.13Å; D492-R496 PolarHBondContact O-NE 2.66Å; D492-R496 PolarHBondContact O-NH2 2.68Å; A493-R496 PolarHBondContact O-N 3.17Å; E494-R496 PolarHBondContact O-N 3.48Å; R496-R499 PolarHBondContact O-N 3.41Å; R496-A500 PolarHBondContact O-N 3Å; R496-A500 VanDerWaalsContact O-N 3.11Å
497A80.5Confident82.3Confident55 Ų5591 Ų9146%0.45548%0.482SS..Hα-helixtrans-63.5-41.1174.600000111.8A493 E494 R499 A500 V501A493-A497 WeakPolarHBondContact O-CB 3.48Å; A493-A497 PolarHBondContact O-N 3.46Å; E494-A497 PolarHBondContact O-N 2.85Å; A497-R499 PolarHBondContact O-N 2.84Å; A497-A500 PolarHBondContact O-N 2.89Å; A497-V501 WeakPolarHBondContact O-CG2 3.27Å; A497-V501 PolarHBondContact O-N 2.98Å
498Q84.8Confident82.4Confident127 Ų12795.5 Ų95.559%0.59350%0.496SS*.Hα-helixtrans-60.8-40.3175.1-74.7169.9-2.400112.6E494 V501 A502E494-Q498 VanDerWaalsContact O-CG 3.31Å; E494-Q498 WeakPolarHBondContact O-CG 3.32Å; E494-Q498 PolarHBondContact O-N 3.26Å; Q498-V501 PolarHBondContact O-N 3.28Å; Q498-A502 WeakPolarHBondContact O-CB 3.45Å; Q498-A502 PolarHBondContact O-N 3.03Å
499R84.8Confident82.4Confident164 Ų16497.5 Ų97.562%0.61950%0.503SS*.Hα-helixtrans-62.9-47.9173.7-70.3176.5-164.3165.17.4111.9T495 R496 A497 V501 A502 E503T495-R499 WeakPolarHBondContact O-CG 3.34Å; T495-R499 PolarHBondContact O-N 3.41Å; T495-R499 VanDerWaalsContact O-N 3.14Å; R496-R499 PolarHBondContact O-N 3.41Å; A497-R499 PolarHBondContact O-N 2.84Å; R499-V501 VanDerWaalsContact C-N 3.29Å; R499-V501 PolarHBondContact O-N 2.95Å; R499-A502 PolarHBondContact O-N 2.64Å; R499-A502 VanDerWaalsContact O-N 3.11Å; R499-E503 WeakPolarHBondContact O-CG 3.39Å; R499-E503 PolarHBondContact O-N 3.36Å
500A81.2Confident82.4Confident43 Ų4398.8 Ų98.836%0.35550%0.499SS..Hα-helixtrans-61.3-36.3177.200000112.6R496 A497 L504R496-A500 PolarHBondContact O-N 3Å; R496-A500 VanDerWaalsContact O-N 3.11Å; A497-A500 PolarHBondContact O-N 2.89Å; A500-L504 WeakPolarHBondContact O-CB 3.13Å; A500-L504 VanDerWaalsContact O-CG 3.27Å; A500-L504 WeakPolarHBondContact O-CG 3.26Å; A500-L504 PolarHBondContact O-N 3.22Å
501V81.9Confident82.4Confident80 Ų8097.2 Ų97.249%0.48550%0.499SS..Hα-helixtrans-67.3-41.51731700000111.5A497 Q498 R499 L504 Q505A497-V501 WeakPolarHBondContact O-CG2 3.27Å; A497-V501 PolarHBondContact O-N 2.98Å; Q498-V501 PolarHBondContact O-N 3.28Å; R499-V501 VanDerWaalsContact C-N 3.29Å; R499-V501 PolarHBondContact O-N 2.95Å; V501-L504 PolarHBondContact O-N 3.19Å; V501-Q505 WeakPolarHBondContact O-CB 3.48Å; V501-Q505 WeakPolarHBondContact O-CG 3.43Å; V501-Q505 PolarHBondContact O-N 2.97Å
502A82.8Confident82.1Confident52 Ų5295.4 Ų95.443%0.4350%0.496SS..Hα-helixtrans-66.5-39.5176.500000112.5Q498 R499 Q505 A506Q498-A502 WeakPolarHBondContact O-CB 3.45Å; Q498-A502 PolarHBondContact O-N 3.03Å; R499-A502 PolarHBondContact O-N 2.64Å; R499-A502 VanDerWaalsContact O-N 3.11Å; A502-Q505 PolarHBondContact O-N 3.33Å; A502-A506 PolarHBondContact O-N 2.92Å
503E83.9Confident82Confident130 Ų13096.6 Ų96.661%0.60749%0.493SS*.Hα-helixtrans-62.4-45172.7-73.3166-16100111.2R499 Q505 A506 L507R499-E503 WeakPolarHBondContact O-CG 3.39Å; R499-E503 PolarHBondContact O-N 3.36Å; E503-Q505 VanDerWaalsContact C-N 3.34Å; E503-Q505 PolarHBondContact O-N 3.19Å; E503-A506 PolarHBondContact O-N 2.97Å; E503-L507 WeakPolarHBondContact O-CB 3.5Å; E503-L507 PolarHBondContact O-N 2.94Å
504L78.3Confident81.9Confident118 Ų118100.2 Ų100.262%0.61850%0.496SS*.Hα-helixtrans-64.3-34.8173.7-75.7168.7000112.9A500 V501 R508A500-L504 WeakPolarHBondContact O-CB 3.13Å; A500-L504 VanDerWaalsContact O-CG 3.27Å; A500-L504 WeakPolarHBondContact O-CG 3.26Å; A500-L504 PolarHBondContact O-N 3.22Å; V501-L504 PolarHBondContact O-N 3.19Å; L504-R508 WeakPolarHBondContact O-CB 3.44Å; L504-R508 PolarHBondContact O-N 2.93Å
505Q81.3Confident81.6Confident122 Ų122101.5 Ų101.557%0.5751%0.505SS*.Hα-helixtrans-68.3-41.1173.3-78179.1-49.300111.8V501 A502 E503 R508 V509V501-Q505 WeakPolarHBondContact O-CB 3.48Å; V501-Q505 WeakPolarHBondContact O-CG 3.43Å; V501-Q505 PolarHBondContact O-N 2.97Å; A502-Q505 PolarHBondContact O-N 3.33Å; E503-Q505 VanDerWaalsContact C-N 3.34Å; E503-Q505 PolarHBondContact O-N 3.19Å; Q505-R508 PolarHBondContact O-N 3.32Å; Q505-V509 WeakPolarHBondContact O-CG2 3.34Å; Q505-V509 PolarHBondContact O-N 3Å
506A82.9Confident81.4Confident64 Ų64103.7 Ų103.753%0.52951%0.511SS..Hα-helixtrans-63.5-46.2175.300000111.7A502 E503 R508 V509 E510A502-A506 PolarHBondContact O-N 2.92Å; E503-A506 PolarHBondContact O-N 2.97Å; A506-R508 VanDerWaalsContact C-N 3.33Å; A506-R508 PolarHBondContact O-N 3.46Å; A506-V509 PolarHBondContact O-N 3.39Å; A506-E510 PolarHBondContact O-N 3.46Å
507L81.1Confident81Confident91 Ų91100.2 Ų100.248%0.47650%0.501SS..Hα-helixtrans-61.7-40.4174.5-113164.6000112E503 E510 M511E503-L507 WeakPolarHBondContact O-CB 3.5Å; E503-L507 PolarHBondContact O-N 2.94Å; L507-E510 PolarHBondContact O-N 2.96Å; L507-M511 HydrophobicContact CD2-CE 4.08Å; L507-M511 WeakPolarHBondContact O-CB 3.48Å; L507-M511 VanDerWaalsContact O-CG 3.27Å; L507-M511 WeakPolarHBondContact O-CG 3.28Å; L507-M511 PolarHBondContact O-N 2.86Å
508R82.6Confident80.7Confident158 Ų158103.2 Ų103.260%0.59650%0.504SS*.Hα-helixtrans-61.8-45.9174.5177.2177170.7157.25.7111.3L504 Q505 A506 M511 E512L504-R508 WeakPolarHBondContact O-CB 3.44Å; L504-R508 PolarHBondContact O-N 2.93Å; Q505-R508 PolarHBondContact O-N 3.32Å; A506-R508 VanDerWaalsContact C-N 3.33Å; A506-R508 PolarHBondContact O-N 3.46Å; R508-M511 PolarHBondContact O-N 2.9Å; R508-E512 HydrophobicContact CG-CG 4.22Å; R508-E512 IonicContact CZ-OE1 2.71Å; R508-E512 IonicContact NE-OE1 3.2Å; R508-E512 PolarHBondContact NE-OE1 3.44Å; R508-E512 IonicContact NE-OE2 2.73Å; R508-E512 IonicContact NH2-OE1 3.33Å; R508-E512 PolarHBondContact NH2-OE1 3.21Å; R508-E512 WeakPolarHBondContact O-CB 3.22Å; R508-E512 WeakPolarHBondContact O-CG 3.37Å; R508-E512 PolarHBondContact O-N 3.3Å
509V82.2Confident80.1Confident90 Ų90102.2 Ų102.255%0.54550%0.499SS..Hα-helixtrans-65.3-37.9177.4169.90000111.7Q505 A506 M511 R513Q505-V509 WeakPolarHBondContact O-CG2 3.34Å; Q505-V509 PolarHBondContact O-N 3Å; A506-V509 PolarHBondContact O-N 3.39Å; V509-M511 VanDerWaalsContact C-N 3.35Å; V509-M511 PolarHBondContact O-N 3.21Å; V509-R513 WeakPolarHBondContact O-CB 3.44Å; V509-R513 PolarHBondContact O-N 2.89Å
510E83.1Confident79.4Confident85 Ų8599.4 Ų99.440%0.39749%0.493SS..Hα-helixtrans-63.1-41.3173.8-167.4-167.2147.900111.8A506 L507 R514A506-E510 PolarHBondContact O-N 3.46Å; L507-E510 PolarHBondContact O-N 2.96Å; E510-R514 PolarHBondContact O-N 2.75Å; E510-R514 IonicContact OE1-CZ 2.73Å; E510-R514 VanDerWaalsContact OE1-CZ 3.23Å; E510-R514 IonicContact OE1-NH1 3.1Å; E510-R514 PolarHBondContact OE1-NH1 2.78Å; E510-R514 IonicContact OE1-NH2 3.79Å; E510-R514 PolarHBondContact OE1-NH2 3.32Å
511M81.1Confident78.9Confident102 Ų102102.8 Ų102.850%0.50250%0.502SS..Hα-helixtrans-73.3-40.1178.7-67.2-64.2177.300112.6L507 R508 V509 R513 R514 L515L507-M511 HydrophobicContact CD2-CE 4.08Å; L507-M511 WeakPolarHBondContact O-CB 3.48Å; L507-M511 VanDerWaalsContact O-CG 3.27Å; L507-M511 WeakPolarHBondContact O-CG 3.28Å; L507-M511 PolarHBondContact O-N 2.86Å; R508-M511 PolarHBondContact O-N 2.9Å; V509-M511 VanDerWaalsContact C-N 3.35Å; V509-M511 PolarHBondContact O-N 3.21Å; M511-R513 VanDerWaalsContact C-N 3.32Å; M511-R514 PolarHBondContact O-N 2.97Å; M511-L515 WeakPolarHBondContact O-CB 3.32Å; M511-L515 PolarHBondContact O-N 3.01Å
512E77.8Confident78.2Confident84 Ų84105.7 Ų105.739%0.39351%0.512SS..Hα-helixtrans-61.4-41.3171.8-76.3173.8158.400110.3R508 R514 L515 Q516R508-E512 HydrophobicContact CG-CG 4.22Å; R508-E512 IonicContact CZ-OE1 2.71Å; R508-E512 IonicContact NE-OE1 3.2Å; R508-E512 PolarHBondContact NE-OE1 3.44Å; R508-E512 IonicContact NE-OE2 2.73Å; R508-E512 IonicContact NH2-OE1 3.33Å; R508-E512 PolarHBondContact NH2-OE1 3.21Å; R508-E512 WeakPolarHBondContact O-CB 3.22Å; R508-E512 WeakPolarHBondContact O-CG 3.37Å; R508-E512 PolarHBondContact O-N 3.3Å; E512-R514 PolarHBondContact O-N 3.25Å; E512-L515 PolarHBondContact O-N 2.99Å; E512-Q516 VanDerWaalsContact O-CB 3.23Å; E512-Q516 WeakPolarHBondContact O-CB 3.34Å; E512-Q516 PolarHBondContact O-N 3.29Å
513R80.7Confident77.4Confident126 Ų126107.4 Ų107.448%0.47551%0.511SS..Hα-helixtrans-62.6-41.9174.1-163.1-162.477.175.220.2112.6V509 M511 Q516 E517V509-R513 WeakPolarHBondContact O-CB 3.44Å; V509-R513 PolarHBondContact O-N 2.89Å; M511-R513 VanDerWaalsContact C-N 3.32Å; R513-Q516 PolarHBondContact O-N 2.82Å; R513-E517 IonicContact CZ-OE1 2.63Å; R513-E517 IonicContact CZ-OE2 3.17Å; R513-E517 VanDerWaalsContact NH1-CD 3.34Å; R513-E517 IonicContact NH1-OE1 3.18Å; R513-E517 PolarHBondContact NH1-OE1 3Å; R513-E517 IonicContact NH1-OE2 2.66Å; R513-E517 IonicContact NH2-OE1 2.72Å; R513-E517 PolarHBondContact NH2-OE1 2.94Å; R513-E517 IonicContact NH2-OE2 2.88Å; R513-E517 PolarHBondContact NH2-OE2 3.3Å; R513-E517 WeakPolarHBondContact O-CG 3.34Å; R513-E517 PolarHBondContact O-N 2.91Å
514R77.9Confident76.6Confident125 Ų125103.8 Ų103.847%0.47250%0.503SS..Hα-helixtrans-68.6-35.3174.6-85.7-168.7177.5117.19.1113.2E510 M511 E512 K518E510-R514 PolarHBondContact O-N 2.75Å; E510-R514 IonicContact OE1-CZ 2.73Å; E510-R514 VanDerWaalsContact OE1-CZ 3.23Å; E510-R514 IonicContact OE1-NH1 3.1Å; E510-R514 PolarHBondContact OE1-NH1 2.78Å; E510-R514 IonicContact OE1-NH2 3.79Å; E510-R514 PolarHBondContact OE1-NH2 3.32Å; M511-R514 PolarHBondContact O-N 2.97Å; E512-R514 PolarHBondContact O-N 3.25Å; R514-K518 PolarHBondContact O-N 2.67Å
515L75.4Confident76Confident104 Ų104104.7 Ų104.755%0.54551%0.508SS..Hα-helixtrans-64.9-48.5173.9-159.782.3000108.9M511 E512 E517 K518 E519M511-L515 WeakPolarHBondContact O-CB 3.32Å; M511-L515 PolarHBondContact O-N 3.01Å; E512-L515 PolarHBondContact O-N 2.99Å; L515-E517 PolarHBondContact O-N 3.3Å; L515-K518 CarbonylContact O-C 3.55Å; L515-K518 WeakPolarHBondContact O-CA 3.33Å; L515-K518 PolarHBondContact O-N 3.25Å; L515-E519 WeakPolarHBondContact O-CG 3.27Å; L515-E519 PolarHBondContact O-N 2.9Å
516Q79.1Confident75.2Confident102 Ų102108.1 Ų108.148%0.47752%0.516SS..Hα-helixtrans-60.7-38.9178.3-170.9177.8-15.800112.5E512 R513 K518 E519 E520E512-Q516 VanDerWaalsContact O-CB 3.23Å; E512-Q516 WeakPolarHBondContact O-CB 3.34Å; E512-Q516 PolarHBondContact O-N 3.29Å; R513-Q516 PolarHBondContact O-N 2.82Å; Q516-K518 VanDerWaalsContact C-N 3.26Å; Q516-K518 PolarHBondContact O-N 3.32Å; Q516-E519 PolarHBondContact O-N 3.49Å; Q516-E520 HydrophobicContact CG-CG 4.41Å; Q516-E520 WeakPolarHBondContact CG-OE1 3.44Å; Q516-E520 PolarHBondContact NE2-OE1 3.42Å; Q516-E520 VanDerWaalsContact O-CB 3.28Å; Q516-E520 WeakPolarHBondContact O-CB 3.34Å; Q516-E520 VanDerWaalsContact O-CG 3.26Å; Q516-E520 WeakPolarHBondContact O-CG 3.48Å; Q516-E520 PolarHBondContact O-N 3.24Å
517E77.7Confident74.3Confident83 Ų83109.4 Ų109.439%0.38851%0.509SS..Hα-helixtrans-58.5-35.5171.2-77.9172.4147.300112.8R513 L515 E521R513-E517 IonicContact CZ-OE1 2.63Å; R513-E517 IonicContact CZ-OE2 3.17Å; R513-E517 VanDerWaalsContact NH1-CD 3.34Å; R513-E517 IonicContact NH1-OE1 3.18Å; R513-E517 PolarHBondContact NH1-OE1 3Å; R513-E517 IonicContact NH1-OE2 2.66Å; R513-E517 IonicContact NH2-OE1 2.72Å; R513-E517 PolarHBondContact NH2-OE1 2.94Å; R513-E517 IonicContact NH2-OE2 2.88Å; R513-E517 PolarHBondContact NH2-OE2 3.3Å; R513-E517 WeakPolarHBondContact O-CG 3.34Å; R513-E517 PolarHBondContact O-N 2.91Å; L515-E517 PolarHBondContact O-N 3.3Å; E517-E521 PolarHBondContact O-N 3Å
518K75Confident73.6Confident117 Ų117111.8 Ų111.851%0.50952%0.522SS..Hα-helixtrans-87.4-28.9179-72.5-64.3174.4-155.80114R514 L515 Q516 E521 M522R514-K518 PolarHBondContact O-N 2.67Å; L515-K518 CarbonylContact O-C 3.55Å; L515-K518 WeakPolarHBondContact O-CA 3.33Å; L515-K518 PolarHBondContact O-N 3.25Å; Q516-K518 VanDerWaalsContact C-N 3.26Å; Q516-K518 PolarHBondContact O-N 3.32Å; K518-E521 WeakPolarHBondContact CD-OE2 3.46Å; K518-E521 IonicContact NZ-OE1 3.66Å; K518-E521 PolarHBondContact NZ-OE1 2.82Å; K518-E521 IonicContact NZ-OE2 2.69Å; K518-E521 PolarHBondContact NZ-OE2 3.01Å; K518-M522 WeakPolarHBondContact O-CB 3.35Å; K518-M522 WeakPolarHBondContact O-CG 3.38Å; K518-M522 PolarHBondContact O-N 3.3Å
519E70.6Confident72.6Confident106 Ų106111.6 Ų111.650%0.49553%0.53SS..Hα-helixtrans-64.2-45.5165-70.5178.4152.400109.4L515 Q516 E521 M522 E523L515-E519 WeakPolarHBondContact O-CG 3.27Å; L515-E519 PolarHBondContact O-N 2.9Å; Q516-E519 PolarHBondContact O-N 3.49Å; E519-E521 PolarHBondContact O-N 3.26Å; E519-M522 PolarHBondContact O-N 2.96Å; E519-E523 WeakPolarHBondContact O-CA 3.3Å; E519-E523 WeakPolarHBondContact O-CB 3.46Å; E519-E523 PolarHBondContact O-N 2.98Å
520E70Confident71.7Confident105 Ų105111.9 Ų111.949%0.49153%0.525SS..Hα-helixtrans-60.8-37.5177.2-76.8173.4-166.800113Q516 A524Q516-E520 HydrophobicContact CG-CG 4.41Å; Q516-E520 WeakPolarHBondContact CG-OE1 3.44Å; Q516-E520 PolarHBondContact NE2-OE1 3.42Å; Q516-E520 VanDerWaalsContact O-CB 3.28Å; Q516-E520 WeakPolarHBondContact O-CB 3.34Å; Q516-E520 VanDerWaalsContact O-CG 3.26Å; Q516-E520 WeakPolarHBondContact O-CG 3.48Å; Q516-E520 PolarHBondContact O-N 3.24Å; E520-A524 WeakPolarHBondContact O-CB 3.32Å; E520-A524 PolarHBondContact O-N 3.22Å
521E71Confident70.9Confident114 Ų114114.2 Ų114.253%0.53354%0.535SS..Hα-helixtrans-62.9-52.1171.2-78.6177.3-163.200112.7E517 K518 E519 L525E517-E521 PolarHBondContact O-N 3Å; K518-E521 WeakPolarHBondContact CD-OE2 3.46Å; K518-E521 IonicContact NZ-OE1 3.66Å; K518-E521 PolarHBondContact NZ-OE1 2.82Å; K518-E521 IonicContact NZ-OE2 2.69Å; K518-E521 PolarHBondContact NZ-OE2 3.01Å; E519-E521 PolarHBondContact O-N 3.26Å; E521-L525 PolarHBondContact O-N 3.05Å
522M68.3Low70.1Confident142 Ų142116.3 Ų116.370%0.754%0.543SS*.Hα-helixtrans-67.4-38.1-178.4-74.4-89.5-79.500112.2K518 E519 L525 R526K518-M522 WeakPolarHBondContact O-CB 3.35Å; K518-M522 WeakPolarHBondContact O-CG 3.38Å; K518-M522 PolarHBondContact O-N 3.3Å; E519-M522 PolarHBondContact O-N 2.96Å; M522-L525 PolarHBondContact O-N 2.89Å; M522-R526 PolarHBondContact O-N 3.03Å
523E64.4Low69.4Low88 Ų88117.5 Ų117.541%0.41155%0.551SS.*Hα-helixtrans-83.4-26.5-176.4-154.6-161.4-179.100111.2E519 L525 K527E519-E523 WeakPolarHBondContact O-CA 3.3Å; E519-E523 WeakPolarHBondContact O-CB 3.46Å; E519-E523 PolarHBondContact O-N 2.98Å; E523-L525 VanDerWaalsContact C-N 3.3Å; E523-K527 HydrophobicContact CG-CD 4.01Å; E523-K527 HydrophobicContact CG-CG 4.23Å; E523-K527 WeakPolarHBondContact O-CA 3.38Å; E523-K527 WeakPolarHBondContact O-CB 3.22Å; E523-K527 WeakPolarHBondContact O-CD 3.05Å; E523-K527 WeakPolarHBondContact O-CG 3.3Å; E523-K527 PolarHBondContact O-N 3.46Å; E523-K527 WeakPolarHBondContact OE1-CE 3.44Å; E523-K527 IonicContact OE1-NZ 2.78Å; E523-K527 PolarHBondContact OE1-NZ 3.46Å; E523-K527 VanDerWaalsContact OE1-NZ 3.1Å; E523-K527 WeakPolarHBondContact OE2-CE 3.36Å; E523-K527 IonicContact OE2-NZ 3.54Å; E523-K527 PolarHBondContact OE2-NZ 2.98Å
524A69Low68.5Low54 Ų54115 Ų11545%0.44655%0.547SS..Hα-helixtrans-61.6-41.1165.900000111.2E520 K527 N528E520-A524 WeakPolarHBondContact O-CB 3.32Å; E520-A524 PolarHBondContact O-N 3.22Å; A524-K527 PolarHBondContact O-N 3.09Å; A524-N528 PolarHBondContact O-N 3.03Å
525L64.3Low68.2Low136 Ų136117.4 Ų117.471%0.71256%0.556SS**Hα-helixtrans-72.3-39.8-179.9-148.5154.4000111.6E521 M522 E523E521-L525 PolarHBondContact O-N 3.05Å; M522-L525 PolarHBondContact O-N 2.89Å; E523-L525 VanDerWaalsContact C-N 3.3Å
526R65.1Low67.6Low195 Ų195118.8 Ų118.874%0.73656%0.564SS**Hα-helixtrans-65-45.9168.1-87-177.6165.1173.6-3.2112.7M522 N528 M529 Q530M522-R526 PolarHBondContact O-N 3.03Å; R526-N528 PolarHBondContact O-N 2.97Å; R526-M529 PolarHBondContact O-N 3.49Å; R526-Q530 WeakPolarHBondContact O-CB 3.39Å; R526-Q530 PolarHBondContact O-N 3.29Å
527K63.4Low67Low91 Ų91118.2 Ų118.240%0.39657%0.567SS.*Hα-helixtrans-57.3-49.3179.6-81.3161.8171.8161.30109.9E523 A524 M529 Q530 F531E523-K527 HydrophobicContact CG-CD 4.01Å; E523-K527 HydrophobicContact CG-CG 4.23Å; E523-K527 WeakPolarHBondContact O-CA 3.38Å; E523-K527 WeakPolarHBondContact O-CB 3.22Å; E523-K527 WeakPolarHBondContact O-CD 3.05Å; E523-K527 WeakPolarHBondContact O-CG 3.3Å; E523-K527 PolarHBondContact O-N 3.46Å; E523-K527 WeakPolarHBondContact OE1-CE 3.44Å; E523-K527 IonicContact OE1-NZ 2.78Å; E523-K527 PolarHBondContact OE1-NZ 3.46Å; E523-K527 VanDerWaalsContact OE1-NZ 3.1Å; E523-K527 WeakPolarHBondContact OE2-CE 3.36Å; E523-K527 IonicContact OE2-NZ 3.54Å; E523-K527 PolarHBondContact OE2-NZ 2.98Å; A524-K527 PolarHBondContact O-N 3.09Å; K527-M529 PolarHBondContact O-N 2.98Å; K527-Q530 PolarHBondContact O-N 3.34Å; K527-Q530 VanDerWaalsContact O-N 3.12Å; K527-F531 HydrophobicContact CB-CD2 4.5Å; K527-F531 WeakPolarHBondContact O-CA 3.34Å; K527-F531 WeakPolarHBondContact O-CB 3.42Å; K527-F531 PolarHBondContact O-N 3.3Å
528N67.6Low66.2Low140 Ų140116.7 Ų116.775%0.74957%0.568SS**Hα-helixtrans-52.6-36.2-178.3-96.1-8.7000114.7A524 R526A524-N528 PolarHBondContact O-N 3.03Å; R526-N528 PolarHBondContact O-N 2.97Å
529M62Low66Low154 Ų154114.3 Ų114.376%0.75957%0.571SS**Hα-helixtrans-88-38174.9-70.1-174.316800113.7R526 K527R526-M529 PolarHBondContact O-N 3.49Å; K527-M529 PolarHBondContact O-N 2.98Å
530Q62.2Low65.5Low96 Ų96115.6 Ų115.645%0.44958%0.581SS.*Hα-helixtrans-76.6-37.1-176.3-170.465.425.700112.4R526 K527 E532 I533 D534R526-Q530 WeakPolarHBondContact O-CB 3.39Å; R526-Q530 PolarHBondContact O-N 3.29Å; K527-Q530 PolarHBondContact O-N 3.34Å; K527-Q530 VanDerWaalsContact O-N 3.12Å; Q530-E532 VanDerWaalsContact C-N 3.29Å; Q530-E532 PolarHBondContact O-N 3.05Å; Q530-I533 PolarHBondContact O-N 3.49Å; Q530-D534 VanDerWaalsContact CG-OD2 3.26Å; Q530-D534 WeakPolarHBondContact CG-OD2 3.3Å; Q530-D534 PolarHBondContact NE2-OD1 3.23Å; Q530-D534 PolarHBondContact NE2-OD2 3.36Å; Q530-D534 WeakPolarHBondContact O-CB 3.48Å; Q530-D534 PolarHBondContact O-N 3.04Å
531F66.4Low65.3Low135 Ų135113.4 Ų113.459%0.59258%0.58SS**Hα-helixtrans-65.8-29.5-175.5-154.6-82.5000111.9K527 R535K527-F531 HydrophobicContact CB-CD2 4.5Å; K527-F531 WeakPolarHBondContact O-CA 3.34Å; K527-F531 WeakPolarHBondContact O-CB 3.42Å; K527-F531 PolarHBondContact O-N 3.3Å; F531-R535 WeakPolarHBondContact O-CB 3.37Å; F531-R535 PolarHBondContact O-N 3.02Å
532E65.3Low65.1Low146 Ų146111.3 Ų111.368%0.68257%0.573SS**Hα-helixtrans-75.9-34.2178.1-164143.9-120.900112.2Q530Q530-E532 VanDerWaalsContact C-N 3.29Å; Q530-E532 PolarHBondContact O-N 3.05Å
533I62.4Low65.2Low108 Ų108107.7 Ų107.755%0.55457%0.565SS**Hα-helixtrans-78.2-52.5175.7-61.6175.9000110.4Q530 R535 L536 T537Q530-I533 PolarHBondContact O-N 3.49Å; I533-R535 VanDerWaalsContact C-N 3.34Å; I533-R535 PolarHBondContact O-N 3.44Å; I533-L536 PolarHBondContact O-N 2.84Å; I533-T537 PolarHBondContact O-N 3.11Å; I533-T537 PolarHBondContact O-OG1 2.96Å
534D60.9Low65.4Low75 Ų75109 Ų10940%0.40157%0.571SS.*Hα-helixtrans-66.2-33-178.8-77.4-9.9000112.2Q530 L536 T537 A538Q530-D534 VanDerWaalsContact CG-OD2 3.26Å; Q530-D534 WeakPolarHBondContact CG-OD2 3.3Å; Q530-D534 PolarHBondContact NE2-OD1 3.23Å; Q530-D534 PolarHBondContact NE2-OD2 3.36Å; Q530-D534 WeakPolarHBondContact O-CB 3.48Å; Q530-D534 PolarHBondContact O-N 3.04Å; D534-L536 VanDerWaalsContact C-N 3.26Å; D534-L536 PolarHBondContact O-N 3.31Å; D534-T537 PolarHBondContact O-N 3.43Å; D534-A538 WeakPolarHBondContact O-CA 3.24Å; D534-A538 WeakPolarHBondContact O-CB 3.33Å; D534-A538 PolarHBondContact O-N 3.44Å
535R71.7Confident65.2Low174 Ų174109 Ų10966%0.65757%0.571SS**Hα-helixtrans-59.3-37.7175.2174.2179.7175.4-167.2-1.5112.3F531 I533 A539F531-R535 WeakPolarHBondContact O-CB 3.37Å; F531-R535 PolarHBondContact O-N 3.02Å; I533-R535 VanDerWaalsContact C-N 3.34Å; I533-R535 PolarHBondContact O-N 3.44Å; R535-A539 WeakPolarHBondContact O-CB 3.28Å; R535-A539 PolarHBondContact O-N 3.02Å
536L62.9Low65.7Low134 Ų134110.2 Ų110.270%0.70257%0.566SS**Hα-helixtrans-79.2-43.1178.8-67.1175000111.5I533 D534I533-L536 PolarHBondContact O-N 2.84Å; D534-L536 VanDerWaalsContact C-N 3.26Å; D534-L536 PolarHBondContact O-N 3.31Å
537T67.2Low66Low90 Ų90107.7 Ų107.755%0.55257%0.565SS**Hα-helixtrans-74.7-43.2-177.3-50.70000112.7I533 D534 A541I533-T537 PolarHBondContact O-N 3.11Å; I533-T537 PolarHBondContact O-OG1 2.96Å; D534-T537 PolarHBondContact O-N 3.43Å; T537-A541 PolarHBondContact O-N 3.21Å
538A61.5Low66.6Low50 Ų50109.5 Ų109.541%0.41357%0.573SS.*Hα-helixtrans-70.9-35.5179.100000112.4D534 L540 A541 D542D534-A538 WeakPolarHBondContact O-CA 3.24Å; D534-A538 WeakPolarHBondContact O-CB 3.33Å; D534-A538 PolarHBondContact O-N 3.44Å; A538-L540 PolarHBondContact O-N 2.88Å; A538-A541 PolarHBondContact O-N 3.33Å; A538-D542 WeakPolarHBondContact O-CB 3.34Å; A538-D542 PolarHBondContact O-N 2.98Å
539A68.8Low66.8Low68 Ų68105.8 Ų105.856%0.56256%0.561SS**Hα-helixtrans-59.2-33.8178.400000113R535R535-A539 WeakPolarHBondContact O-CB 3.28Å; R535-A539 PolarHBondContact O-N 3.02Å
540L60.4Low67.6Low133 Ų133104.5 Ų104.570%0.69655%0.553SS**Hα-helixtrans-77.4-45.7174.7-170.667.2000111.8A538A538-L540 PolarHBondContact O-N 2.88Å
541A67.3Low68.2Low59 Ų59105.8 Ų105.849%0.48856%0.562SS.*Hα-helixtrans-68.7-40.4-17700000113.5T537 A538 A543 E544 A545T537-A541 PolarHBondContact O-N 3.21Å; A538-A541 PolarHBondContact O-N 3.33Å; A541-A543 VanDerWaalsContact C-N 3.35Å; A541-A543 PolarHBondContact O-N 3.44Å; A541-E544 PolarHBondContact O-N 3.43Å; A541-A545 WeakPolarHBondContact O-CB 3.3Å; A541-A545 PolarHBondContact O-N 2.93Å
542D67Low68.8Low70 Ų70102.6 Ų102.637%0.37456%0.557SS.*Hα-helixtrans-69.1-32.7-177.5-17024.2000111.5A538 R546A538-D542 WeakPolarHBondContact O-CB 3.34Å; A538-D542 PolarHBondContact O-N 2.98Å; D542-R546 WeakPolarHBondContact O-CB 3.4Å; D542-R546 WeakPolarHBondContact O-CD 3.44Å; D542-R546 WeakPolarHBondContact O-CG 3.43Å; D542-R546 PolarHBondContact O-N 3.01Å; D542-R546 VanDerWaalsContact O-N 3.09Å; D542-R546 IonicContact OD1-CZ 3.1Å; D542-R546 IonicContact OD1-NE 3.23Å; D542-R546 PolarHBondContact OD1-NE 3.12Å; D542-R546 IonicContact OD1-NH2 2.62Å; D542-R546 PolarHBondContact OD1-NH2 2.97Å; D542-R546 IonicContact OD2-CZ 2.66Å; D542-R546 IonicContact OD2-NE 2.67Å; D542-R546 PolarHBondContact OD2-NE 3.19Å; D542-R546 IonicContact OD2-NH2 3.94Å; D542-R546 PolarHBondContact OD2-NH2 3.39Å
543A69.1Low69.6Low65 Ų65105 Ų10554%0.53756%0.559SS.*Hα-helixtrans-62.4-48.2172.700000112.4A541A541-A543 VanDerWaalsContact C-N 3.35Å; A541-A543 PolarHBondContact O-N 3.44Å
544E68.2Low70.5Confident116 Ų116103.5 Ų103.554%0.54255%0.552SS.*Hα-helixtrans-71-38.7176.9-74.8-152.6-174.500113.2A541 K548A541-E544 PolarHBondContact O-N 3.43Å; E544-K548 PolarHBondContact O-N 2.74Å; E544-K548 IonicContact OE2-NZ 3.42Å; E544-K548 PolarHBondContact OE2-NZ 3.07Å
545A66.4Low71.5Confident54 Ų54106.5 Ų106.545%0.44656%0.562SS.*Hα-helixtrans-64.7-43.8-17700000111.7A541 M547 K548 A549A541-A545 WeakPolarHBondContact O-CB 3.3Å; A541-A545 PolarHBondContact O-N 2.93Å; A545-M547 PolarHBondContact O-N 3.32Å; A545-K548 PolarHBondContact O-N 3.37Å; A545-A549 VanDerWaalsContact O-CB 3.26Å; A545-A549 WeakPolarHBondContact O-CB 3.5Å; A545-A549 PolarHBondContact O-N 3.04Å
546R73.2Confident72Confident161 Ų161105.9 Ų105.961%0.60856%0.564SS**Hα-helixtrans-56.7-51.8-179.5-75.4170.9-171.9-151.63.7112.3D542 K548 A549 E550D542-R546 WeakPolarHBondContact O-CB 3.4Å; D542-R546 WeakPolarHBondContact O-CD 3.44Å; D542-R546 WeakPolarHBondContact O-CG 3.43Å; D542-R546 PolarHBondContact O-N 3.01Å; D542-R546 VanDerWaalsContact O-N 3.09Å; D542-R546 IonicContact OD1-CZ 3.1Å; D542-R546 IonicContact OD1-NE 3.23Å; D542-R546 PolarHBondContact OD1-NE 3.12Å; D542-R546 IonicContact OD1-NH2 2.62Å; D542-R546 PolarHBondContact OD1-NH2 2.97Å; D542-R546 IonicContact OD2-CZ 2.66Å; D542-R546 IonicContact OD2-NE 2.67Å; D542-R546 PolarHBondContact OD2-NE 3.19Å; D542-R546 IonicContact OD2-NH2 3.94Å; D542-R546 PolarHBondContact OD2-NH2 3.39Å; R546-K548 PolarHBondContact O-N 3.49Å; R546-A549 PolarHBondContact O-N 3.3Å; R546-E550 WeakPolarHBondContact O-CB 3.45Å; R546-E550 PolarHBondContact O-N 2.96Å
547M71.3Confident72.9Confident143 Ų143104.3 Ų104.370%0.70455%0.551SS**Hα-helixtrans-65.7-39-178.9-72.4-156.2169.300113.2A545 I551A545-M547 PolarHBondContact O-N 3.32Å; M547-I551 WeakPolarHBondContact O-CG1 3.45Å; M547-I551 PolarHBondContact O-N 3.46Å
548K77Confident73.7Confident129 Ų129106.5 Ų106.556%0.56155%0.55SS**Hα-helixtrans-67.1-37176.3-73.1167.4-179.3162.10112.1E544 A545 R546 S552E544-K548 PolarHBondContact O-N 2.74Å; E544-K548 IonicContact OE2-NZ 3.42Å; E544-K548 PolarHBondContact OE2-NZ 3.07Å; A545-K548 PolarHBondContact O-N 3.37Å; R546-K548 PolarHBondContact O-N 3.49Å; K548-S552 WeakPolarHBondContact O-CB 3.37Å; K548-S552 PolarHBondContact O-N 3.09Å; K548-S552 PolarHBondContact O-OG 3.3Å
549A72.1Confident74.9Confident61 Ų61109.8 Ų109.850%0.50456%0.557SS.*Hα-helixtrans-69.4-43.8177.600000112.4A545 R546 S552 R553A545-A549 VanDerWaalsContact O-CB 3.26Å; A545-A549 WeakPolarHBondContact O-CB 3.5Å; A545-A549 PolarHBondContact O-N 3.04Å; R546-A549 PolarHBondContact O-N 3.3Å; A549-S552 PolarHBondContact O-N 3.49Å; A549-R553 WeakPolarHBondContact O-CB 3.29Å; A549-R553 PolarHBondContact O-N 2.99Å
550E78.2Confident75.5Confident127 Ų127109.1 Ų109.159%0.59355%0.552SS**Hα-helixtrans-66-44.5-177.2-171.8150.5-13700112.3R546 S552 R553 L554R546-E550 WeakPolarHBondContact O-CB 3.45Å; R546-E550 PolarHBondContact O-N 2.96Å; E550-S552 VanDerWaalsContact C-N 3.33Å; E550-S552 PolarHBondContact O-N 3.11Å; E550-R553 PolarHBondContact O-N 3.39Å; E550-L554 HydrophobicContact CG-CD1 4.37Å; E550-L554 WeakPolarHBondContact O-CG 3.44Å; E550-L554 PolarHBondContact O-N 3Å
551I75Confident76.5Confident123 Ų123106.2 Ų106.263%0.63154%0.535SS*.Hα-helixtrans-59.4-43.9173.2-66.7170.1000111.1M547 K555M547-I551 WeakPolarHBondContact O-CG1 3.45Å; M547-I551 PolarHBondContact O-N 3.46Å; I551-K555 WeakPolarHBondContact O-CB 3.41Å; I551-K555 PolarHBondContact O-N 2.96Å
552S78.5Confident77.2Confident69 Ų69108 Ų10848%0.48354%0.535SS..Hα-helixtrans-66.1-38.1178.8-63.50000112.7K548 A549 E550 K556K548-S552 WeakPolarHBondContact O-CB 3.37Å; K548-S552 PolarHBondContact O-N 3.09Å; K548-S552 PolarHBondContact O-OG 3.3Å; A549-S552 PolarHBondContact O-N 3.49Å; E550-S552 VanDerWaalsContact C-N 3.33Å; E550-S552 PolarHBondContact O-N 3.11Å; S552-K556 PolarHBondContact O-N 3Å; S552-K556 VanDerWaalsContact O-N 3.09Å
553R83.1Confident78.1Confident195 Ų195106.8 Ų106.874%0.73653%0.534SS*.Hα-helixtrans-66.2-47.1176.6174.5179.1150122.3-1.8111.4A549 E550 K556 K557A549-R553 WeakPolarHBondContact O-CB 3.29Å; A549-R553 PolarHBondContact O-N 2.99Å; E550-R553 PolarHBondContact O-N 3.39Å; R553-K556 PolarHBondContact O-N 3.25Å; R553-K557 PolarHBondContact O-N 3.46Å
554L80.6Confident78.8Confident77 Ų77110.1 Ų110.140%0.40354%0.539SS..Hα-helixtrans-62.4-44.7177.4-72.8170.9000111.6E550 K556 K557 Y558E550-L554 HydrophobicContact CG-CD1 4.37Å; E550-L554 WeakPolarHBondContact O-CG 3.44Å; E550-L554 PolarHBondContact O-N 3Å; L554-K556 PolarHBondContact O-N 3.41Å; L554-K557 PolarHBondContact O-N 3Å; L554-Y558 HydrophobicContact CB-CE2 4.45Å; L554-Y558 HydrophobicContact CD2-CE2 4.43Å; L554-Y558 WeakPolarHBondContact O-CD2 3.31Å; L554-Y558 PolarHBondContact O-N 3.05Å; L554-Y558 VanDerWaalsContact O-N 3.07Å
555K81.8Confident79.7Confident138 Ų138109.9 Ų109.960%0.654%0.541SS*.Hα-helixtrans-58.8-46.9176.3-174.6175.7178.5178.30112.1I551 K557 Q559I551-K555 WeakPolarHBondContact O-CB 3.41Å; I551-K555 PolarHBondContact O-N 2.96Å; K555-K557 PolarHBondContact O-N 3.4Å; K555-Q559 WeakPolarHBondContact O-CG 3.28Å; K555-Q559 PolarHBondContact O-N 3Å; K555-Q559 VanDerWaalsContact O-N 3.1Å
556K82.2Confident80.6Confident161 Ų161113.4 Ų113.470%0.755%0.548SS*.Hα-helixtrans-63.7-38.6176.7-77.4-172.5175.9-174.60112.8S552 R553 L554 Q559 A560S552-K556 PolarHBondContact O-N 3Å; S552-K556 VanDerWaalsContact O-N 3.09Å; R553-K556 PolarHBondContact O-N 3.25Å; L554-K556 PolarHBondContact O-N 3.41Å; K556-Q559 PolarHBondContact O-N 3.15Å; K556-A560 PolarHBondContact O-N 3.3Å; K556-A560 VanDerWaalsContact O-N 3.09Å
557K83.1Confident81.1Confident101 Ų101112 Ų11244%0.43955%0.55SS.*Hα-helixtrans-59.7-53.2176.8-175.9178.5178.3-78.40111.3R553 L554 K555 Q559 A560 E561R553-K557 PolarHBondContact O-N 3.46Å; L554-K557 PolarHBondContact O-N 3Å; K555-K557 PolarHBondContact O-N 3.4Å; K557-Q559 VanDerWaalsContact C-N 3.32Å; K557-Q559 PolarHBondContact O-N 3.08Å; K557-A560 PolarHBondContact O-N 3.06Å; K557-A560 VanDerWaalsContact O-N 3.11Å; K557-E561 WeakPolarHBondContact CE-OE1 3.47Å; K557-E561 HydrophobicContact CG-CG 4.5Å; K557-E561 IonicContact NZ-OE1 3.5Å; K557-E561 PolarHBondContact NZ-OE1 3.43Å; K557-E561 IonicContact NZ-OE2 3.43Å; K557-E561 PolarHBondContact NZ-OE2 2.66Å; K557-E561 WeakPolarHBondContact O-CG 3.38Å; K557-E561 PolarHBondContact O-N 2.98Å
558Y84.1Confident81.8Confident136 Ų136108.7 Ų108.753%0.53354%0.538SS..Hα-helixtrans-66.7-31.5-178.8-66.2-55.9000113.3L554 A560 E561 I562L554-Y558 HydrophobicContact CB-CE2 4.45Å; L554-Y558 HydrophobicContact CD2-CE2 4.43Å; L554-Y558 WeakPolarHBondContact O-CD2 3.31Å; L554-Y558 PolarHBondContact O-N 3.05Å; L554-Y558 VanDerWaalsContact O-N 3.07Å; Y558-A560 VanDerWaalsContact C-N 3.34Å; Y558-E561 WeakPolarHBondContact CD1-OE2 3.47Å; Y558-I562 WeakPolarHBondContact O-CD1 3.5Å; Y558-I562 VanDerWaalsContact O-CG1 3.25Å; Y558-I562 WeakPolarHBondContact O-CG1 3.42Å; Y558-I562 PolarHBondContact O-N 3.19Å
559Q85Confident82.2Confident120 Ų120107.4 Ų107.456%0.56154%0.536SS*.Hα-helixtrans-66.9-33.3172.3-71.6-174-77.200113K555 K556 K557 A563K555-Q559 WeakPolarHBondContact O-CG 3.28Å; K555-Q559 PolarHBondContact O-N 3Å; K555-Q559 VanDerWaalsContact O-N 3.1Å; K556-Q559 PolarHBondContact O-N 3.15Å; K557-Q559 VanDerWaalsContact C-N 3.32Å; K557-Q559 PolarHBondContact O-N 3.08Å; Q559-A563 PolarHBondContact O-N 2.83Å
560A81.3Confident82.8Confident54 Ų54108 Ų10845%0.44653%0.531SS..Hα-helixtrans-72-45.9173.600000111.9K556 K557 Y558 I562 A563 E564K556-A560 PolarHBondContact O-N 3.3Å; K556-A560 VanDerWaalsContact O-N 3.09Å; K557-A560 PolarHBondContact O-N 3.06Å; K557-A560 VanDerWaalsContact O-N 3.11Å; Y558-A560 VanDerWaalsContact C-N 3.34Å; A560-I562 VanDerWaalsContact C-N 3.3Å; A560-I562 PolarHBondContact O-N 3.26Å; A560-A563 PolarHBondContact O-N 3.35Å; A560-A563 VanDerWaalsContact O-N 3.13Å; A560-E564 PolarHBondContact O-N 3.02Å
561E82.7Confident83.2Confident72 Ų72106.5 Ų106.534%0.33653%0.527SS..Hα-helixtrans-61.2-36.5179.1-70.6178139.500112.3K557 Y558 L565K557-E561 WeakPolarHBondContact CE-OE1 3.47Å; K557-E561 HydrophobicContact CG-CG 4.5Å; K557-E561 IonicContact NZ-OE1 3.5Å; K557-E561 PolarHBondContact NZ-OE1 3.43Å; K557-E561 IonicContact NZ-OE2 3.43Å; K557-E561 PolarHBondContact NZ-OE2 2.66Å; K557-E561 WeakPolarHBondContact O-CG 3.38Å; K557-E561 PolarHBondContact O-N 2.98Å; Y558-E561 WeakPolarHBondContact CD1-OE2 3.47Å; E561-L565 WeakPolarHBondContact O-CB 3.49Å; E561-L565 WeakPolarHBondContact O-CD1 3.37Å; E561-L565 VanDerWaalsContact O-CG 3.24Å; E561-L565 WeakPolarHBondContact O-CG 3.37Å; E561-L565 PolarHBondContact O-N 3.37Å; E561-L565 VanDerWaalsContact O-N 3.15Å
562I82Confident83.7Confident95 Ų95106 Ų10649%0.48753%0.525SS..Hα-helixtrans-64.5-46.9173.2-70.5165.8000111.1Y558 A560 E564 L565 E566Y558-I562 WeakPolarHBondContact O-CD1 3.5Å; Y558-I562 VanDerWaalsContact O-CG1 3.25Å; Y558-I562 WeakPolarHBondContact O-CG1 3.42Å; Y558-I562 PolarHBondContact O-N 3.19Å; A560-I562 VanDerWaalsContact C-N 3.3Å; A560-I562 PolarHBondContact O-N 3.26Å; I562-E564 PolarHBondContact O-N 2.75Å; I562-L565 PolarHBondContact O-N 2.93Å; I562-E566 HydrophobicContact CG2-CG 4.37Å; I562-E566 WeakPolarHBondContact O-CG 3.47Å; I562-E566 PolarHBondContact O-N 3.16Å
563A85Confident84Confident45 Ų45107.1 Ų107.137%0.37253%0.525SS..Hα-helixtrans-64.6-37.8-178.600000112.8Q559 A560 M567Q559-A563 PolarHBondContact O-N 2.83Å; A560-A563 PolarHBondContact O-N 3.35Å; A560-A563 VanDerWaalsContact O-N 3.13Å; A563-M567 WeakPolarHBondContact O-CG 3.36Å; A563-M567 PolarHBondContact O-N 3.44Å
564E84.6Confident84.1Confident135 Ų135105.2 Ų105.263%0.63152%0.518SS*.Hα-helixtrans-64.9-40.9173.2-72.5-172.6141.600112A560 I562 T568A560-E564 PolarHBondContact O-N 3.02Å; I562-E564 PolarHBondContact O-N 2.75Å; E564-T568 WeakPolarHBondContact O-CB 3.39Å; E564-T568 PolarHBondContact O-N 3.17Å; E564-T568 PolarHBondContact O-OG1 3.29Å
565L86Confident84.3Confident112 Ų112104.2 Ų104.259%0.58652%0.521SS*.Hα-helixtrans-66.2-41.8176.6-72.3169.7000112.2E561 I562 T568 I569E561-L565 WeakPolarHBondContact O-CB 3.49Å; E561-L565 WeakPolarHBondContact O-CD1 3.37Å; E561-L565 VanDerWaalsContact O-CG 3.24Å; E561-L565 WeakPolarHBondContact O-CG 3.37Å; E561-L565 PolarHBondContact O-N 3.37Å; E561-L565 VanDerWaalsContact O-N 3.15Å; I562-L565 PolarHBondContact O-N 2.93Å; L565-T568 PolarHBondContact O-N 3.36Å; L565-I569 WeakPolarHBondContact O-CG1 3.33Å; L565-I569 PolarHBondContact O-N 2.89Å
566E85.8Confident84.5Confident128 Ų128101.7 Ų101.760%0.59851%0.514SS*.Hα-helixtrans-61.1-47.6175-73178.6153.800111.7I562 T568 I569 D570I562-E566 HydrophobicContact CG2-CG 4.37Å; I562-E566 WeakPolarHBondContact O-CG 3.47Å; I562-E566 PolarHBondContact O-N 3.16Å; E566-T568 VanDerWaalsContact C-N 3.3Å; E566-T568 PolarHBondContact O-N 3.16Å; E566-I569 PolarHBondContact O-N 3.46Å; E566-D570 PolarHBondContact O-N 3.49Å
567M84.1Confident84.7Confident131 Ų13198.7 Ų98.765%0.64551%0.505SS*.Hα-helixtrans-62-36.7174.4-73.6-171.868.300112.6A563 N571A563-M567 WeakPolarHBondContact O-CG 3.36Å; A563-M567 PolarHBondContact O-N 3.44Å; M567-N571 WeakPolarHBondContact O-CB 3.43Å; M567-N571 VanDerWaalsContact O-CG 3.27Å; M567-N571 PolarHBondContact O-N 3.37Å; M567-N571 VanDerWaalsContact O-N 3.08Å; M567-N571 PolarHBondContact O-ND2 3.01Å; M567-N571 VanDerWaalsContact O-ND2 3.1Å
568T86.6Confident84.7Confident73 Ų73100 Ų10045%0.44851%0.513SS..Hα-helixtrans-66.8-42.8178.4-58.90000111.4E564 L565 E566 L572E564-T568 WeakPolarHBondContact O-CB 3.39Å; E564-T568 PolarHBondContact O-N 3.17Å; E564-T568 PolarHBondContact O-OG1 3.29Å; L565-T568 PolarHBondContact O-N 3.36Å; E566-T568 VanDerWaalsContact C-N 3.3Å; E566-T568 PolarHBondContact O-N 3.16Å; T568-L572 HydrophobicContact CG2-CD1 4.1Å; T568-L572 WeakPolarHBondContact O-CB 3.48Å; T568-L572 VanDerWaalsContact O-CG 3.3Å; T568-L572 WeakPolarHBondContact O-CG 3.32Å; T568-L572 PolarHBondContact O-N 2.86Å
569I84.1Confident84.7Confident102 Ų10295.7 Ų95.752%0.52351%0.506SS..Hα-helixtrans-63.5-44.5176.5-70.6165.8000111.1L565 E566 N571 L572 N573L565-I569 WeakPolarHBondContact O-CG1 3.33Å; L565-I569 PolarHBondContact O-N 2.89Å; E566-I569 PolarHBondContact O-N 3.46Å; I569-N571 PolarHBondContact O-N 2.93Å; I569-L572 PolarHBondContact O-N 2.94Å; I569-N573 WeakPolarHBondContact O-CB 3.49Å; I569-N573 PolarHBondContact O-N 3.08Å; I569-N573 PolarHBondContact O-ND2 3.22Å
570D85.8Confident84.9Confident73 Ų7395.3 Ų95.339%0.3950%0.504SS..Hα-helixtrans-67.7-37.3-178.6-156.160.1000112.2E566 N573 R574E566-D570 PolarHBondContact O-N 3.49Å; D570-N573 PolarHBondContact O-N 2.91Å; D570-R574 VanDerWaalsContact O-CG 3.31Å; D570-R574 WeakPolarHBondContact O-CG 3.32Å; D570-R574 PolarHBondContact O-N 2.98Å; D570-R574 VanDerWaalsContact O-N 3.07Å; D570-R574 IonicContact OD2-CZ 3.82Å; D570-R574 IonicContact OD2-NE 3.52Å; D570-R574 PolarHBondContact OD2-NE 3.11Å; D570-R574 IonicContact OD2-NH2 2.72Å; D570-R574 PolarHBondContact OD2-NH2 2.98Å
571N84.9Confident85.2Confident96 Ų9699.1 Ų99.151%0.51351%0.51SS..Hα-helixtrans-62.6-45.2171.7-75.5-32.2000112.5M567 I569 N573 R574 A575M567-N571 WeakPolarHBondContact O-CB 3.43Å; M567-N571 VanDerWaalsContact O-CG 3.27Å; M567-N571 PolarHBondContact O-N 3.37Å; M567-N571 VanDerWaalsContact O-N 3.08Å; M567-N571 PolarHBondContact O-ND2 3.01Å; M567-N571 VanDerWaalsContact O-ND2 3.1Å; I569-N571 PolarHBondContact O-N 2.93Å; N571-N573 PolarHBondContact O-N 3.45Å; N571-R574 PolarHBondContact O-N 3.02Å; N571-A575 PolarHBondContact O-N 3.1Å
572L86.8Confident85.3Confident114 Ų11499.2 Ų99.260%0.59752%0.516SS*.Hα-helixtrans-63.8-39.2177.5-73.4169.9000112.2T568 I569 A575 N576T568-L572 HydrophobicContact CG2-CD1 4.1Å; T568-L572 WeakPolarHBondContact O-CB 3.48Å; T568-L572 VanDerWaalsContact O-CG 3.3Å; T568-L572 WeakPolarHBondContact O-CG 3.32Å; T568-L572 PolarHBondContact O-N 2.86Å; I569-L572 PolarHBondContact O-N 2.94Å; L572-A575 PolarHBondContact O-N 3.48Å; L572-N576 WeakPolarHBondContact O-CB 3.42Å; L572-N576 PolarHBondContact O-N 3.03Å
573N84.8Confident85.4Confident91 Ų9199.9 Ų99.949%0.48752%0.519SS..Hα-helixtrans-64.3-42176-78.3-32.4000112.3I569 D570 N571 N576 L577I569-N573 WeakPolarHBondContact O-CB 3.49Å; I569-N573 PolarHBondContact O-N 3.08Å; I569-N573 PolarHBondContact O-ND2 3.22Å; D570-N573 PolarHBondContact O-N 2.91Å; N571-N573 PolarHBondContact O-N 3.45Å; N573-N576 PolarHBondContact O-N 2.92Å; N573-L577 PolarHBondContact O-N 3.17Å
574R84.7Confident85.5Confident156 Ų156104.6 Ų104.659%0.58953%0.532SS*.Hα-helixtrans-63.1-47175.1-68.4171.7-164.4-154.75.8111.6D570 N571 N576 L577 E578D570-R574 VanDerWaalsContact O-CG 3.31Å; D570-R574 WeakPolarHBondContact O-CG 3.32Å; D570-R574 PolarHBondContact O-N 2.98Å; D570-R574 VanDerWaalsContact O-N 3.07Å; D570-R574 IonicContact OD2-CZ 3.82Å; D570-R574 IonicContact OD2-NE 3.52Å; D570-R574 PolarHBondContact OD2-NE 3.11Å; D570-R574 IonicContact OD2-NH2 2.72Å; D570-R574 PolarHBondContact OD2-NH2 2.98Å; N571-R574 PolarHBondContact O-N 3.02Å; R574-N576 VanDerWaalsContact C-N 3.34Å; R574-N576 PolarHBondContact O-N 2.9Å; R574-L577 WeakPolarHBondContact O-CB 3.27Å; R574-L577 PolarHBondContact O-N 3.37Å; R574-L577 VanDerWaalsContact O-N 3.13Å; R574-E578 PolarHBondContact O-N 2.87Å
575A85Confident85.6Confident56 Ų56104.8 Ų104.846%0.46353%0.53SS..Hα-helixtrans-60.1-41.217800000112.6N571 L572 E578 A579N571-A575 PolarHBondContact O-N 3.1Å; L572-A575 PolarHBondContact O-N 3.48Å; A575-E578 PolarHBondContact O-N 3.46Å; A575-A579 WeakPolarHBondContact O-CB 3.22Å; A575-A579 PolarHBondContact O-N 2.97Å
576N86.6Confident85.5Confident84 Ų84104.6 Ų104.645%0.44953%0.526SS..Hα-helixtrans-62.1-43.1173.9-172.4-0.9000111.7L572 N573 R574 E578 A579 Q580L572-N576 WeakPolarHBondContact O-CB 3.42Å; L572-N576 PolarHBondContact O-N 3.03Å; N573-N576 PolarHBondContact O-N 2.92Å; R574-N576 VanDerWaalsContact C-N 3.34Å; R574-N576 PolarHBondContact O-N 2.9Å; N576-E578 VanDerWaalsContact C-N 3.33Å; N576-E578 PolarHBondContact O-N 3.29Å; N576-A579 PolarHBondContact O-N 3.2Å; N576-Q580 WeakPolarHBondContact O-CG 3.35Å; N576-Q580 PolarHBondContact O-N 3.4Å; N576-Q580 PolarHBondContact OD1-NE2 2.89Å
577L86.4Confident85.6Confident99 Ų99101 Ų10152%0.51852%0.519SS..Hα-helixtrans-64.9-34.8178.3-151.293.7000112.8N573 R574 K581N573-L577 PolarHBondContact O-N 3.17Å; R574-L577 WeakPolarHBondContact O-CB 3.27Å; R574-L577 PolarHBondContact O-N 3.37Å; R574-L577 VanDerWaalsContact O-N 3.13Å; L577-K581 WeakPolarHBondContact O-CG 3.43Å; L577-K581 PolarHBondContact O-N 3.22Å
578E83.6Confident85.6Confident128 Ų12899.4 Ų99.460%0.59851%0.513SS*.Hα-helixtrans-74.1-38.2174.5-69-171.215400112.6R574 A575 N576 K581 T582R574-E578 PolarHBondContact O-N 2.87Å; A575-E578 PolarHBondContact O-N 3.46Å; N576-E578 VanDerWaalsContact C-N 3.33Å; N576-E578 PolarHBondContact O-N 3.29Å; E578-K581 PolarHBondContact O-N 3.17Å; E578-T582 WeakPolarHBondContact O-CB 3.27Å; E578-T582 PolarHBondContact O-N 3.26Å; E578-T582 PolarHBondContact O-OG1 2.97Å
579A83.1Confident85.5Confident46 Ų46101 Ų10138%0.3852%0.515SS..Hα-helixtrans-59.5-46.3171.700000111.3A575 N576 K581 T582 I583A575-A579 WeakPolarHBondContact O-CB 3.22Å; A575-A579 PolarHBondContact O-N 2.97Å; N576-A579 PolarHBondContact O-N 3.2Å; A579-K581 PolarHBondContact O-N 3.02Å; A579-T582 WeakPolarHBondContact O-CB 3.29Å; A579-T582 PolarHBondContact O-N 2.88Å; A579-T582 VanDerWaalsContact O-N 3.14Å; A579-I583 WeakPolarHBondContact O-CG1 3.31Å; A579-I583 PolarHBondContact O-N 3.37Å
580Q88Confident85.5Confident112 Ų112101.1 Ų101.152%0.52352%0.516SS..Hα-helixtrans-62.3-41.2177.3-71.1178.631.900113N576 T582 K584N576-Q580 WeakPolarHBondContact O-CG 3.35Å; N576-Q580 PolarHBondContact O-N 3.4Å; N576-Q580 PolarHBondContact OD1-NE2 2.89Å; Q580-T582 VanDerWaalsContact C-N 3.31Å; Q580-T582 PolarHBondContact O-N 3.36Å; Q580-K584 PolarHBondContact O-N 3.01Å; Q580-K584 VanDerWaalsContact O-N 3.07Å
581K88.6Confident85.6Confident133 Ų133106.8 Ų106.858%0.57853%0.532SS*.Hα-helixtrans-60.9-40.9172.7-73.3169.2-176.1173.80111.8L577 E578 A579 K584 K585L577-K581 WeakPolarHBondContact O-CG 3.43Å; L577-K581 PolarHBondContact O-N 3.22Å; E578-K581 PolarHBondContact O-N 3.17Å; A579-K581 PolarHBondContact O-N 3.02Å; K581-K584 PolarHBondContact O-N 2.92Å; K581-K585 PolarHBondContact O-N 2.94Å
582T84.5Confident85.6Confident75 Ų75107.2 Ų107.246%0.4654%0.538SS..Hα-helixtrans-67.6-47-179.5-56.60000111.5E578 A579 Q580 K584 K585 Q586E578-T582 WeakPolarHBondContact O-CB 3.27Å; E578-T582 PolarHBondContact O-N 3.26Å; E578-T582 PolarHBondContact O-OG1 2.97Å; A579-T582 WeakPolarHBondContact O-CB 3.29Å; A579-T582 PolarHBondContact O-N 2.88Å; A579-T582 VanDerWaalsContact O-N 3.14Å; Q580-T582 VanDerWaalsContact C-N 3.31Å; Q580-T582 PolarHBondContact O-N 3.36Å; T582-K584 VanDerWaalsContact C-N 3.31Å; T582-K584 PolarHBondContact O-N 2.97Å; T582-K585 PolarHBondContact O-N 3.01Å; T582-Q586 WeakPolarHBondContact O-CG 3.37Å; T582-Q586 PolarHBondContact O-N 3.06Å
583I83.4Confident85.4Confident108 Ų108107 Ų10755%0.55454%0.537SS*.Hα-helixtrans-56.5-45.7174.8-69.6163.7000110.6A579 Q586 A587A579-I583 WeakPolarHBondContact O-CG1 3.31Å; A579-I583 PolarHBondContact O-N 3.37Å; I583-Q586 PolarHBondContact O-N 3.02Å; I583-A587 PolarHBondContact O-N 3.4Å
584K88.8Confident85.3Confident145 Ų145108.3 Ų108.363%0.6354%0.54SS*.Hα-helixtrans-63.6-44.8179.9-162.5173.7-175-1800112Q580 K581 T582 Q586 A587 D588Q580-K584 PolarHBondContact O-N 3.01Å; Q580-K584 VanDerWaalsContact O-N 3.07Å; K581-K584 PolarHBondContact O-N 2.92Å; T582-K584 VanDerWaalsContact C-N 3.31Å; T582-K584 PolarHBondContact O-N 2.97Å; K584-Q586 VanDerWaalsContact C-N 3.33Å; K584-Q586 PolarHBondContact O-N 3.25Å; K584-A587 PolarHBondContact O-N 3.42Å; K584-D588 PolarHBondContact O-N 3.28Å
585K86.6Confident85.3Confident139 Ų139103.9 Ų103.960%0.60453%0.533SS*.Hα-helixtrans-59.5-41.6174.6-175.5-179176.7-1760112.2K581 T582 D588 Q589K581-K585 PolarHBondContact O-N 2.94Å; T582-K585 PolarHBondContact O-N 3.01Å; K585-D588 PolarHBondContact O-N 3.5Å; K585-Q589 WeakPolarHBondContact O-CB 3.5Å; K585-Q589 VanDerWaalsContact O-CG 3.31Å; K585-Q589 WeakPolarHBondContact O-CG 3.23Å; K585-Q589 PolarHBondContact O-N 3.27Å
586Q84Confident85.2Confident107 Ų107104.2 Ų104.250%0.553%0.532SS..Hα-helixtrans-66.6-39.2177.1-73.9173.8-21.700112.3T582 I583 K584 Q589 L590T582-Q586 WeakPolarHBondContact O-CG 3.37Å; T582-Q586 PolarHBondContact O-N 3.06Å; I583-Q586 PolarHBondContact O-N 3.02Å; K584-Q586 VanDerWaalsContact C-N 3.33Å; K584-Q586 PolarHBondContact O-N 3.25Å; Q586-Q589 PolarHBondContact O-N 2.93Å; Q586-L590 WeakPolarHBondContact O-CB 3.36Å; Q586-L590 PolarHBondContact O-N 3.03Å
587A86.3Confident85.1Confident54 Ų54107.6 Ų107.645%0.44654%0.54SS..Hα-helixtrans-64.1-43.4175.600000112.3I583 K584 L590 R591I583-A587 PolarHBondContact O-N 3.4Å; K584-A587 PolarHBondContact O-N 3.42Å; A587-L590 PolarHBondContact O-N 3.44Å; A587-R591 PolarHBondContact O-N 2.96Å; A587-R591 VanDerWaalsContact O-N 3.08Å
588D85.1Confident85.2Confident96 Ų96108.3 Ų108.351%0.51354%0.54SS..Hα-helixtrans-64.7-40.7175.7-67.8-33.1000111.4K584 K585 R591 V592K584-D588 PolarHBondContact O-N 3.28Å; K585-D588 PolarHBondContact O-N 3.5Å; D588-R591 PolarHBondContact O-N 2.9Å; D588-V592 WeakPolarHBondContact O-CG2 3.49Å; D588-V592 PolarHBondContact O-N 3.39Å; D588-V592 VanDerWaalsContact O-N 3.17Å
589Q84.8Confident85.1Confident106 Ų106105.3 Ų105.350%0.49553%0.528SS..Hα-helixtrans-63.8-43174.7-75-179.7-60.200112.8K585 Q586 R591 V592 L593K585-Q589 WeakPolarHBondContact O-CB 3.5Å; K585-Q589 VanDerWaalsContact O-CG 3.31Å; K585-Q589 WeakPolarHBondContact O-CG 3.23Å; K585-Q589 PolarHBondContact O-N 3.27Å; Q586-Q589 PolarHBondContact O-N 2.93Å; Q589-R591 VanDerWaalsContact C-N 3.32Å; Q589-R591 PolarHBondContact O-N 2.68Å; Q589-V592 PolarHBondContact O-N 3.41Å; Q589-L593 WeakPolarHBondContact O-CG 3.5Å; Q589-L593 PolarHBondContact O-N 2.88Å
590L82.6Confident85Confident106 Ų106106.9 Ų106.956%0.55554%0.536SS*.Hα-helixtrans-59.3-42175-85.7165.2000111.9Q586 A587 L593 Q594Q586-L590 WeakPolarHBondContact O-CB 3.36Å; Q586-L590 PolarHBondContact O-N 3.03Å; A587-L590 PolarHBondContact O-N 3.44Å; L590-L593 PolarHBondContact O-N 2.93Å; L590-Q594 WeakPolarHBondContact O-CG 3.35Å; L590-Q594 PolarHBondContact O-N 3.47Å
591R88.5Confident84.8Confident191 Ų191106.8 Ų106.872%0.72154%0.535SS*.Hα-helixtrans-65.5-38.7179.4-170.8174.5-176.5152.94.2112.9A587 D588 Q589 S595A587-R591 PolarHBondContact O-N 2.96Å; A587-R591 VanDerWaalsContact O-N 3.08Å; D588-R591 PolarHBondContact O-N 2.9Å; Q589-R591 VanDerWaalsContact C-N 3.32Å; Q589-R591 PolarHBondContact O-N 2.68Å; R591-S595 PolarHBondContact O-N 3.33Å; R591-S595 VanDerWaalsContact O-N 3.16Å
592V86.1Confident84.7Confident105 Ų105106.6 Ų106.664%0.63653%0.531SS*.Hα-helixtrans-66.1-43.4174173.80000110.8D588 Q589 S595 S596D588-V592 WeakPolarHBondContact O-CG2 3.49Å; D588-V592 PolarHBondContact O-N 3.39Å; D588-V592 VanDerWaalsContact O-N 3.17Å; Q589-V592 PolarHBondContact O-N 3.41Å; V592-S595 PolarHBondContact O-N 3.37Å; V592-S596 PolarHBondContact O-N 2.93Å
593L81.2Confident84.7Confident109 Ų109109.1 Ų109.157%0.57154%0.537SS*.Hα-helixtrans-61.5-44.6176.8-74.4167.4000112Q589 L590 S595 S596 Y597Q589-L593 WeakPolarHBondContact O-CG 3.5Å; Q589-L593 PolarHBondContact O-N 2.88Å; L590-L593 PolarHBondContact O-N 2.93Å; L593-S595 PolarHBondContact O-N 3.1Å; L593-S596 PolarHBondContact O-N 2.92Å; L593-S596 PolarHBondContact O-OG 3.33Å; L593-Y597 WeakPolarHBondContact O-CB 3.18Å; L593-Y597 PolarHBondContact O-N 2.93Å
594Q84.2Confident84.7Confident119 Ų119108.7 Ų108.756%0.55654%0.536SS*.Hα-helixtrans-56.6-49.9174.9-76.3174.9-40.100112.1L590 S596 Y597 E598L590-Q594 WeakPolarHBondContact O-CG 3.35Å; L590-Q594 PolarHBondContact O-N 3.47Å; Q594-S596 VanDerWaalsContact C-N 3.32Å; Q594-S596 PolarHBondContact O-N 2.97Å; Q594-Y597 PolarHBondContact O-N 3.36Å; Q594-Y597 VanDerWaalsContact O-N 3.16Å; Q594-E598 PolarHBondContact O-N 3.29Å
595S84.4Confident84.5Confident64 Ų64106.7 Ų106.745%0.44853%0.529SS..Hα-helixtrans-59-42.4177-1660000112.1R591 V592 L593 Y597 E598 D599R591-S595 PolarHBondContact O-N 3.33Å; R591-S595 VanDerWaalsContact O-N 3.16Å; V592-S595 PolarHBondContact O-N 3.37Å; L593-S595 PolarHBondContact O-N 3.1Å; S595-Y597 VanDerWaalsContact C-N 3.32Å; S595-Y597 PolarHBondContact O-N 3.4Å; S595-E598 PolarHBondContact O-N 2.96Å; S595-D599 PolarHBondContact O-N 3.32Å
596S82.8Confident84.4Confident62 Ų62105.4 Ų105.443%0.43453%0.525SS..Hα-helixtrans-66.5-33.6178.4740000113V592 L593 Q594 C600V592-S596 PolarHBondContact O-N 2.93Å; L593-S596 PolarHBondContact O-N 2.92Å; L593-S596 PolarHBondContact O-OG 3.33Å; Q594-S596 VanDerWaalsContact C-N 3.32Å; Q594-S596 PolarHBondContact O-N 2.97Å; S596-C600 WeakPolarHBondContact O-CB 3.36Å; S596-C600 PolarHBondContact O-N 3.2Å
597Y84.8Confident84.3Confident155 Ų155104 Ų10461%0.60852%0.523SS*.Hα-helixtrans-70.2-45.2176178.8-90.4000111.3L593 Q594 S595 D599 C600 Q601L593-Y597 WeakPolarHBondContact O-CB 3.18Å; L593-Y597 PolarHBondContact O-N 2.93Å; Q594-Y597 PolarHBondContact O-N 3.36Å; Q594-Y597 VanDerWaalsContact O-N 3.16Å; S595-Y597 VanDerWaalsContact C-N 3.32Å; S595-Y597 PolarHBondContact O-N 3.4Å; Y597-D599 PolarHBondContact O-N 3.05Å; Y597-C600 PolarHBondContact O-N 3.48Å; Y597-Q601 WeakPolarHBondContact O-CB 3.32Å; Y597-Q601 PolarHBondContact O-N 2.97Å
598E86.7Confident84.3Confident114 Ų114105.3 Ų105.353%0.53352%0.523SS..Hα-helixtrans-62-41.6176.8-72.4176.9-162.500112.5Q594 S595 R602Q594-E598 PolarHBondContact O-N 3.29Å; S595-E598 PolarHBondContact O-N 2.96Å; E598-R602 WeakPolarHBondContact O-CB 3.23Å; E598-R602 PolarHBondContact O-N 2.92Å
599D82.5Confident84.3Confident65 Ų65104.5 Ų104.535%0.34852%0.519SS..Hα-helixtrans-67.3-41.7175.5-74.4-26000111.9S595 Y597 R602 Q603S595-D599 PolarHBondContact O-N 3.32Å; Y597-D599 PolarHBondContact O-N 3.05Å; D599-R602 PolarHBondContact O-N 3.3Å; D599-R602 IonicContact OD1-CZ 3.17Å; D599-R602 IonicContact OD1-NH1 3.78Å; D599-R602 PolarHBondContact OD1-NH1 2.69Å; D599-R602 IonicContact OD1-NH2 2.76Å; D599-R602 PolarHBondContact OD1-NH2 2.8Å; D599-Q603 WeakPolarHBondContact O-CG 3.37Å; D599-Q603 PolarHBondContact O-N 3.2Å
600C80.7Confident84.1Confident80 Ų80105.8 Ų105.854%0.54152%0.524SS..Hα-helixtrans-64.1-41.6176-169.50000111.9S596 Y597 R602 Q603 L604S596-C600 WeakPolarHBondContact O-CB 3.36Å; S596-C600 PolarHBondContact O-N 3.2Å; Y597-C600 PolarHBondContact O-N 3.48Å; C600-R602 VanDerWaalsContact C-N 3.31Å; C600-R602 PolarHBondContact O-N 2.93Å; C600-Q603 PolarHBondContact O-N 3.14Å; C600-L604 WeakPolarHBondContact O-CB 3.48Å; C600-L604 PolarHBondContact O-N 3.47Å
601Q84.4Confident84.1Confident109 Ų109107.4 Ų107.451%0.50952%0.524SS..Hα-helixtrans-63.9-36174.7-169.8176.47.600111.8Y597 L604 Q605Y597-Q601 WeakPolarHBondContact O-CB 3.32Å; Y597-Q601 PolarHBondContact O-N 2.97Å; Q601-L604 PolarHBondContact O-N 3.46Å; Q601-Q605 PolarHBondContact O-N 3.07Å; Q601-Q605 VanDerWaalsContact O-N 3.11Å
602R85.3Confident83.9Confident130 Ų130100.1 Ų100.149%0.49151%0.505SS..Hα-helixtrans-69.1-39175.7-150.7-178-48.711414.6112.3E598 D599 C600 Q606E598-R602 WeakPolarHBondContact O-CB 3.23Å; E598-R602 PolarHBondContact O-N 2.92Å; D599-R602 PolarHBondContact O-N 3.3Å; D599-R602 IonicContact OD1-CZ 3.17Å; D599-R602 IonicContact OD1-NH1 3.78Å; D599-R602 PolarHBondContact OD1-NH1 2.69Å; D599-R602 IonicContact OD1-NH2 2.76Å; D599-R602 PolarHBondContact OD1-NH2 2.8Å; C600-R602 VanDerWaalsContact C-N 3.31Å; C600-R602 PolarHBondContact O-N 2.93Å; R602-Q606 WeakPolarHBondContact O-CG 3.46Å; R602-Q606 PolarHBondContact O-N 2.88Å
603Q84.7Confident83.8Confident127 Ų12799.9 Ų99.959%0.59350%0.499SS*.Hα-helixtrans-65.8-41.2172.5-71.1178.28.500111.9D599 C600 Q605 Q606 T607D599-Q603 WeakPolarHBondContact O-CG 3.37Å; D599-Q603 PolarHBondContact O-N 3.2Å; C600-Q603 PolarHBondContact O-N 3.14Å; Q603-Q605 PolarHBondContact O-N 2.96Å; Q603-Q606 PolarHBondContact O-N 3.47Å; Q603-T607 PolarHBondContact O-N 3.38Å; Q603-T607 PolarHBondContact O-OG1 3.41Å
604L84.3Confident83.9Confident100 Ų10097.3 Ų97.352%0.52449%0.493SS..Hα-helixtrans-59-44.2176.117861.7000111.9C600 Q601 Q606 T607 L608C600-L604 WeakPolarHBondContact O-CB 3.48Å; C600-L604 PolarHBondContact O-N 3.47Å; Q601-L604 PolarHBondContact O-N 3.46Å; L604-Q606 VanDerWaalsContact C-N 3.34Å; L604-Q606 PolarHBondContact O-N 3.37Å; L604-T607 PolarHBondContact O-N 2.93Å; L604-T607 PolarHBondContact O-OG1 3.03Å; L604-L608 HydrophobicContact CD1-CD1 4.24Å; L604-L608 HydrophobicContact CD1-CG 4.26Å; L604-L608 HydrophobicContact CG-CD1 4.07Å; L604-L608 VanDerWaalsContact O-CG 3.29Å; L604-L608 WeakPolarHBondContact O-CG 3.32Å; L604-L608 PolarHBondContact O-N 3.39Å
605Q84.3Confident83.7Confident102 Ų10296.3 Ų96.348%0.47749%0.489SS..Hα-helixtrans-61.8-43.3176.3-172.160.950.600111.6Q601 Q603 T607 L608 D609Q601-Q605 PolarHBondContact O-N 3.07Å; Q601-Q605 VanDerWaalsContact O-N 3.11Å; Q603-Q605 PolarHBondContact O-N 2.96Å; Q605-T607 VanDerWaalsContact C-N 3.33Å; Q605-T607 PolarHBondContact O-N 3.12Å; Q605-L608 PolarHBondContact O-N 2.85Å; Q605-D609 PolarHBondContact NE2-OD1 3.35Å; Q605-D609 PolarHBondContact O-N 3.06Å
606Q84Confident83.7Confident112 Ų112102.3 Ų102.352%0.52350%0.502SS..Hα-helixtrans-62.2-37.3177.9-70.7178.2-700112.8R602 Q603 L604 Q610R602-Q606 WeakPolarHBondContact O-CG 3.46Å; R602-Q606 PolarHBondContact O-N 2.88Å; Q603-Q606 PolarHBondContact O-N 3.47Å; L604-Q606 VanDerWaalsContact C-N 3.34Å; L604-Q606 PolarHBondContact O-N 3.37Å; Q606-Q610 VanDerWaalsContact O-CG 3.28Å; Q606-Q610 WeakPolarHBondContact O-CG 3.28Å; Q606-Q610 PolarHBondContact O-N 2.93Å; Q606-Q610 VanDerWaalsContact O-N 3.11Å
607T82.2Confident83.9Confident77 Ų77106.1 Ų106.147%0.47251%0.51SS..Hα-helixtrans-73.4-33.4175.252.50000112.7Q603 L604 Q605 Y611Q603-T607 PolarHBondContact O-N 3.38Å; Q603-T607 PolarHBondContact O-OG1 3.41Å; L604-T607 PolarHBondContact O-N 2.93Å; L604-T607 PolarHBondContact O-OG1 3.03Å; Q605-T607 VanDerWaalsContact C-N 3.33Å; Q605-T607 PolarHBondContact O-N 3.12Å; T607-Y611 VanDerWaalsContact O-CB 3.26Å; T607-Y611 WeakPolarHBondContact O-CB 3.35Å; T607-Y611 PolarHBondContact O-N 3.36Å
608L86.9Confident83.7Confident83 Ų83104.2 Ų104.244%0.43551%0.51SS..Hα-helixtrans-66.1-41.4172.7-70.9171.4000112.2L604 Q605 Y611 A612L604-L608 HydrophobicContact CD1-CD1 4.24Å; L604-L608 HydrophobicContact CD1-CG 4.26Å; L604-L608 HydrophobicContact CG-CD1 4.07Å; L604-L608 VanDerWaalsContact O-CG 3.29Å; L604-L608 WeakPolarHBondContact O-CG 3.32Å; L604-L608 PolarHBondContact O-N 3.39Å; Q605-L608 PolarHBondContact O-N 2.85Å; L608-Y611 PolarHBondContact O-N 3.48Å; L608-A612 WeakPolarHBondContact O-CB 3.34Å; L608-A612 PolarHBondContact O-N 2.94Å
609D85.6Confident83.4Confident79 Ų79102.5 Ų102.542%0.42251%0.511SS..Hα-helixtrans-65-42.6176.5-64.6-20.4000111.2Q605 A612 I613Q605-D609 PolarHBondContact NE2-OD1 3.35Å; Q605-D609 PolarHBondContact O-N 3.06Å; D609-A612 PolarHBondContact O-N 3.12Å; D609-I613 WeakPolarHBondContact O-CG1 3.5Å; D609-I613 PolarHBondContact O-N 3.39Å; D609-I613 VanDerWaalsContact O-N 3.14Å
610Q80.7Confident83.4Confident132 Ų132101.7 Ų101.762%0.61751%0.513SS*.Hα-helixtrans-64-41.6173.4-73.1177.127.700112.2Q606 I613 A614Q606-Q610 VanDerWaalsContact O-CG 3.28Å; Q606-Q610 WeakPolarHBondContact O-CG 3.28Å; Q606-Q610 PolarHBondContact O-N 2.93Å; Q606-Q610 VanDerWaalsContact O-N 3.11Å; Q610-I613 PolarHBondContact O-N 3.32Å; Q610-A614 PolarHBondContact O-N 3.01Å
611Y81.9Confident83.4Confident141 Ų141102.9 Ų102.955%0.55351%0.514SS*.Hα-helixtrans-61.2-44175.5176.1-96.6000111.5T607 L608 I613 A614 Q615T607-Y611 VanDerWaalsContact O-CB 3.26Å; T607-Y611 WeakPolarHBondContact O-CB 3.35Å; T607-Y611 PolarHBondContact O-N 3.36Å; L608-Y611 PolarHBondContact O-N 3.48Å; Y611-I613 VanDerWaalsContact C-N 3.31Å; Y611-I613 PolarHBondContact O-N 2.95Å; Y611-A614 PolarHBondContact O-N 3.35Å; Y611-Q615 WeakPolarHBondContact O-CB 3.46Å; Y611-Q615 PolarHBondContact O-N 2.68Å
612A83.8Confident83.3Confident38 Ų38100.4 Ų100.431%0.31451%0.508SS..Hα-helixtrans-62-36.7176.400000112.7L608 D609 R616L608-A612 WeakPolarHBondContact O-CB 3.34Å; L608-A612 PolarHBondContact O-N 2.94Å; D609-A612 PolarHBondContact O-N 3.12Å; A612-R616 WeakPolarHBondContact O-CG 3.38Å; A612-R616 PolarHBondContact O-N 2.93Å; A612-R616 VanDerWaalsContact O-N 3.14Å
613I84.3Confident83.1Confident99 Ų9996.8 Ų96.851%0.50851%0.506SS..Hα-helixtrans-67.7-43.4173.5-66.9165.4000111D609 Q610 Y611 R616 K617D609-I613 WeakPolarHBondContact O-CG1 3.5Å; D609-I613 PolarHBondContact O-N 3.39Å; D609-I613 VanDerWaalsContact O-N 3.14Å; Q610-I613 PolarHBondContact O-N 3.32Å; Y611-I613 VanDerWaalsContact C-N 3.31Å; Y611-I613 PolarHBondContact O-N 2.95Å; I613-R616 PolarHBondContact O-N 2.94Å; I613-K617 PolarHBondContact O-N 3.41Å; I613-K617 VanDerWaalsContact O-N 3.15Å
614A82.6Confident82.9Confident55 Ų5596.1 Ų96.146%0.45550%0.503SS..Hα-helixtrans-63.8-41.5176.800000112.1Q610 Y611 K617 L618Q610-A614 PolarHBondContact O-N 3.01Å; Y611-A614 PolarHBondContact O-N 3.35Å; A614-K617 PolarHBondContact O-N 3.37Å; A614-L618 PolarHBondContact O-N 2.93Å
615Q81.2Confident82.6Confident99 Ų9996.1 Ų96.146%0.46350%0.503SS..Hα-helixtrans-64.3-41178.4-164.4175.61600111.6Y611 K617 L618 S619Y611-Q615 WeakPolarHBondContact O-CB 3.46Å; Y611-Q615 PolarHBondContact O-N 2.68Å; Q615-K617 PolarHBondContact O-N 3.41Å; Q615-L618 WeakPolarHBondContact O-CB 3.31Å; Q615-L618 PolarHBondContact O-N 3.31Å; Q615-S619 PolarHBondContact O-N 2.93Å; Q615-S619 PolarHBondContact O-OG 3.01Å
616R84.8Confident82.5Confident190 Ų19096.4 Ų96.472%0.71750%0.504SS*.Hα-helixtrans-62-41.1172.8-72.1175.2-171.1178.95.1112.6A612 I613 S619 A620A612-R616 WeakPolarHBondContact O-CG 3.38Å; A612-R616 PolarHBondContact O-N 2.93Å; A612-R616 VanDerWaalsContact O-N 3.14Å; I613-R616 PolarHBondContact O-N 2.94Å; R616-S619 PolarHBondContact O-N 3.05Å; R616-A620 PolarHBondContact O-N 2.88Å; R616-A620 VanDerWaalsContact O-N 3.1Å
617K85.3Confident82.3Confident142 Ų14296.2 Ų96.262%0.61751%0.507SS*.Hα-helixtrans-63.7-40.9174.1-73.6-176.3175.5-173.90112I613 A614 Q615 A620 L621I613-K617 PolarHBondContact O-N 3.41Å; I613-K617 VanDerWaalsContact O-N 3.15Å; A614-K617 PolarHBondContact O-N 3.37Å; Q615-K617 PolarHBondContact O-N 3.41Å; K617-A620 PolarHBondContact O-N 3.13Å; K617-L621 WeakPolarHBondContact O-CB 3.44Å; K617-L621 WeakPolarHBondContact O-CG 3.38Å; K617-L621 PolarHBondContact O-N 2.95Å
618L80.5Confident82.1Confident114 Ų11496.6 Ų96.660%0.59751%0.512SS*.Hα-helixtrans-62.3-42.3176.5-175.966000111.5A614 Q615 S622A614-L618 PolarHBondContact O-N 2.93Å; Q615-L618 WeakPolarHBondContact O-CB 3.31Å; Q615-L618 PolarHBondContact O-N 3.31Å; L618-S622 WeakPolarHBondContact O-CB 3.16Å; L618-S622 PolarHBondContact O-N 3.35Å; L618-S622 PolarHBondContact O-OG 3.39Å
619S82.3Confident82Confident79 Ų7996.7 Ų96.755%0.55251%0.509SS*.Hα-helixtrans-63-42.4175.6-61.90000112.7Q615 R616 S622 A623Q615-S619 PolarHBondContact O-N 2.93Å; Q615-S619 PolarHBondContact O-OG 3.01Å; R616-S619 PolarHBondContact O-N 3.05Å; S619-S622 PolarHBondContact O-N 3.43Å; S619-A623 PolarHBondContact O-N 2.81Å; S619-A623 VanDerWaalsContact O-N 3.12Å
620A81.2Confident81.8Confident48 Ų4896.1 Ų96.140%0.39751%0.511SS..Hα-helixtrans-63-51.2176.600000111.9R616 K617 S622 A623 E624R616-A620 PolarHBondContact O-N 2.88Å; R616-A620 VanDerWaalsContact O-N 3.1Å; K617-A620 PolarHBondContact O-N 3.13Å; A620-S622 PolarHBondContact O-N 2.98Å; A620-A623 WeakPolarHBondContact O-CB 3.48Å; A620-A623 PolarHBondContact O-N 3.01Å; A620-E624 PolarHBondContact O-N 2.82Å
621L80.8Confident81.8Confident105 Ų10592.7 Ų92.755%0.5551%0.505SS..Hα-helixtrans-61.7-29.2176.9-69.2168.4000112.8K617 L625K617-L621 WeakPolarHBondContact O-CB 3.44Å; K617-L621 WeakPolarHBondContact O-CG 3.38Å; K617-L621 PolarHBondContact O-N 2.95Å; L621-L625 VanDerWaalsContact O-CB 3.27Å; L621-L625 WeakPolarHBondContact O-CB 3.29Å; L621-L625 PolarHBondContact O-N 2.94Å
622S81.6Confident81.6Confident57 Ų5790.9 Ų90.940%0.39951%0.505SS..Hα-helixtrans-72.1-34.7174.8-57.80000112.5L618 S619 A620 E626L618-S622 WeakPolarHBondContact O-CB 3.16Å; L618-S622 PolarHBondContact O-N 3.35Å; L618-S622 PolarHBondContact O-OG 3.39Å; S619-S622 PolarHBondContact O-N 3.43Å; A620-S622 PolarHBondContact O-N 2.98Å; S622-E626 PolarHBondContact O-N 3.27Å
623A82.2Confident81.5Confident54 Ų5493.4 Ų93.445%0.44651%0.512SS..Hα-helixtrans-69.8-48.8173.800000111.1S619 A620 L625 E626 D627S619-A623 PolarHBondContact O-N 2.81Å; S619-A623 VanDerWaalsContact O-N 3.12Å; A620-A623 WeakPolarHBondContact O-CB 3.48Å; A620-A623 PolarHBondContact O-N 3.01Å; A623-L625 PolarHBondContact O-N 2.93Å; A623-E626 PolarHBondContact O-N 3.31Å; A623-D627 PolarHBondContact O-N 3.27Å
624E80.9Confident81.4Confident113 Ų11392.7 Ų92.753%0.52851%0.513SS..Hα-helixtrans-55.1-38.6175.2-69.5171.7-167.600111.8A620 C628A620-E624 PolarHBondContact O-N 2.82Å; E624-C628 WeakPolarHBondContact O-CB 3.43Å; E624-C628 PolarHBondContact O-N 2.85Å; E624-C628 PolarHBondContact O-SG 3.32Å
625L76.8Confident81.2Confident100 Ų10092.8 Ų92.852%0.52451%0.514SS..Hα-helixtrans-65.5-40175.318063.6000113L621 A623 K629L621-L625 VanDerWaalsContact O-CB 3.27Å; L621-L625 WeakPolarHBondContact O-CB 3.29Å; L621-L625 PolarHBondContact O-N 2.94Å; A623-L625 PolarHBondContact O-N 2.93Å; L625-K629 WeakPolarHBondContact O-CG 3.43Å; L625-K629 PolarHBondContact O-N 2.71Å
626E82.2Confident81Confident107 Ų10790.8 Ų90.850%0.551%0.506SS..Hα-helixtrans-73.6-39.2179.9-139.765.8-148.900111.8S622 A623 C628 K629 S630S622-E626 PolarHBondContact O-N 3.27Å; A623-E626 PolarHBondContact O-N 3.31Å; E626-C628 VanDerWaalsContact C-N 3.34Å; E626-C628 PolarHBondContact O-N 2.99Å; E626-K629 PolarHBondContact O-N 2.96Å; E626-K629 VanDerWaalsContact OE1-CD 3.29Å; E626-K629 WeakPolarHBondContact OE1-CD 3.41Å; E626-K629 IonicContact OE1-NZ 2.76Å; E626-K629 PolarHBondContact OE1-NZ 3.23Å; E626-K629 IonicContact OE2-NZ 2.82Å; E626-K629 PolarHBondContact OE2-NZ 3.01Å; E626-S630 PolarHBondContact O-N 3.4Å
627D80.7Confident80.9Confident109 Ų10990.7 Ų90.758%0.58351%0.505SS*.Hα-helixtrans-57.9-47.5170.3-72-22.2000110.4A623 K629 S630 A631A623-D627 PolarHBondContact O-N 3.27Å; D627-K629 VanDerWaalsContact C-N 3.34Å; D627-K629 PolarHBondContact O-N 3.43Å; D627-S630 PolarHBondContact O-N 3.36Å; D627-S630 VanDerWaalsContact O-N 3.15Å; D627-S630 PolarHBondContact O-OG 2.73Å; D627-A631 PolarHBondContact O-N 2.71Å
628C79Confident80.7Confident84 Ų8488.6 Ų88.657%0.56850%0.504SS*.Hα-helixtrans-61.1-38176.4-70.70000113.2E624 E626 L632E624-C628 WeakPolarHBondContact O-CB 3.43Å; E624-C628 PolarHBondContact O-N 2.85Å; E624-C628 PolarHBondContact O-SG 3.32Å; E626-C628 VanDerWaalsContact C-N 3.34Å; E626-C628 PolarHBondContact O-N 2.99Å; C628-L632 WeakPolarHBondContact O-CB 3.26Å; C628-L632 PolarHBondContact O-N 2.66Å
629K83.6Confident80.9Confident86 Ų8689.7 Ų89.737%0.37450%0.5SS..Hα-helixtrans-64.8-44.2172.9-71.9166.9-173.21640111.5L625 E626 D627 A631 L632 D633L625-K629 WeakPolarHBondContact O-CG 3.43Å; L625-K629 PolarHBondContact O-N 2.71Å; E626-K629 PolarHBondContact O-N 2.96Å; E626-K629 VanDerWaalsContact OE1-CD 3.29Å; E626-K629 WeakPolarHBondContact OE1-CD 3.41Å; E626-K629 IonicContact OE1-NZ 2.76Å; E626-K629 PolarHBondContact OE1-NZ 3.23Å; E626-K629 IonicContact OE2-NZ 2.82Å; E626-K629 PolarHBondContact OE2-NZ 3.01Å; D627-K629 VanDerWaalsContact C-N 3.34Å; D627-K629 PolarHBondContact O-N 3.43Å; K629-A631 VanDerWaalsContact C-N 3.28Å; K629-A631 PolarHBondContact O-N 2.89Å; K629-L632 WeakPolarHBondContact O-CB 3.36Å; K629-L632 PolarHBondContact O-N 2.91Å; K629-L632 VanDerWaalsContact O-N 3.11Å; K629-D633 PolarHBondContact O-N 3.49Å
630S80.8Confident80.9Confident66 Ų6692 Ų9246%0.46250%0.5SS..Hα-helixtrans-62.1-38.4-179.380.70000111.9E626 D627 T634E626-S630 PolarHBondContact O-N 3.4Å; D627-S630 PolarHBondContact O-N 3.36Å; D627-S630 VanDerWaalsContact O-N 3.15Å; D627-S630 PolarHBondContact O-OG 2.73Å; S630-T634 WeakPolarHBondContact O-CB 3.41Å; S630-T634 PolarHBondContact O-N 3.45Å; S630-T634 PolarHBondContact O-OG1 3.03Å
631A80.9Confident80.9Confident61 Ų6195.1 Ų95.150%0.50451%0.507SS..Hα-helixtrans-66.3-42.3172.600000111.9D627 K629 T634 A635D627-A631 PolarHBondContact O-N 2.71Å; K629-A631 VanDerWaalsContact C-N 3.28Å; K629-A631 PolarHBondContact O-N 2.89Å; A631-T634 PolarHBondContact O-N 2.98Å; A631-A635 WeakPolarHBondContact O-CB 3.5Å; A631-A635 PolarHBondContact O-N 3.45Å
632L78.1Confident80.8Confident103 Ų10392.7 Ų92.754%0.53950%0.502SS..Hα-helixtrans-63.7-47176.7178.261.4000112.3C628 K629 T634 A635 I636C628-L632 WeakPolarHBondContact O-CB 3.26Å; C628-L632 PolarHBondContact O-N 2.66Å; K629-L632 WeakPolarHBondContact O-CB 3.36Å; K629-L632 PolarHBondContact O-N 2.91Å; K629-L632 VanDerWaalsContact O-N 3.11Å; L632-T634 VanDerWaalsContact C-N 3.29Å; L632-T634 PolarHBondContact O-N 3.07Å; L632-A635 PolarHBondContact O-N 3.35Å; L632-I636 HydrophobicContact CD1-CD1 4.03Å; L632-I636 HydrophobicContact CD1-CG1 4.3Å; L632-I636 HydrophobicContact CG-CD1 3.91Å; L632-I636 VanDerWaalsContact O-CG1 3.28Å; L632-I636 WeakPolarHBondContact O-CG1 3.36Å; L632-I636 PolarHBondContact O-N 3.08Å
633D82.1Confident80.7Confident90 Ų9093.9 Ų93.948%0.48150%0.501SS..Hα-helixtrans-62.4-37.6176.5-84.5-18.2000111.6K629 I636 R637K629-D633 PolarHBondContact O-N 3.49Å; D633-I636 PolarHBondContact O-N 3.3Å; D633-R637 WeakPolarHBondContact O-CG 3.36Å; D633-R637 PolarHBondContact O-N 2.94Å; D633-R637 VanDerWaalsContact O-N 3.07Å
634T81.1Confident80.6Confident84 Ų8493.5 Ų93.552%0.51550%0.498SS..Hα-helixtrans-65.3-45.8174.3-57.20000110.9S630 A631 L632 I636 R637 V638S630-T634 WeakPolarHBondContact O-CB 3.41Å; S630-T634 PolarHBondContact O-N 3.45Å; S630-T634 PolarHBondContact O-OG1 3.03Å; A631-T634 PolarHBondContact O-N 2.98Å; L632-T634 VanDerWaalsContact C-N 3.29Å; L632-T634 PolarHBondContact O-N 3.07Å; T634-I636 VanDerWaalsContact C-N 3.34Å; T634-I636 PolarHBondContact O-N 3.49Å; T634-R637 PolarHBondContact O-N 2.84Å; T634-V638 WeakPolarHBondContact O-CG2 3.48Å; T634-V638 PolarHBondContact O-N 3.47Å
635A79.1Confident80.7Confident57 Ų5792 Ų9247%0.47149%0.494SS..Hα-helixtrans-62.2-38.5175.700000112.4A631 L632 R637 V638 R639A631-A635 WeakPolarHBondContact O-CB 3.5Å; A631-A635 PolarHBondContact O-N 3.45Å; L632-A635 PolarHBondContact O-N 3.35Å; A635-R637 VanDerWaalsContact C-N 3.35Å; A635-R637 PolarHBondContact O-N 2.95Å; A635-V638 PolarHBondContact O-N 3.02Å; A635-R639 WeakPolarHBondContact O-CB 3.29Å; A635-R639 PolarHBondContact O-N 3.4Å
636I78.1Confident80.8Confident58 Ų5892.7 Ų92.730%0.29750%0.498SS..Hα-helixtrans-64.3-37.8175.3-71.5165.7000111.4L632 D633 T634 K640L632-I636 HydrophobicContact CD1-CD1 4.03Å; L632-I636 HydrophobicContact CD1-CG1 4.3Å; L632-I636 HydrophobicContact CG-CD1 3.91Å; L632-I636 VanDerWaalsContact O-CG1 3.28Å; L632-I636 WeakPolarHBondContact O-CG1 3.36Å; L632-I636 PolarHBondContact O-N 3.08Å; D633-I636 PolarHBondContact O-N 3.3Å; T634-I636 VanDerWaalsContact C-N 3.34Å; T634-I636 PolarHBondContact O-N 3.49Å; I636-K640 HydrophobicContact CG2-CD 4.41Å; I636-K640 WeakPolarHBondContact O-CB 3.48Å; I636-K640 WeakPolarHBondContact O-CG 3.35Å; I636-K640 PolarHBondContact O-N 3.31Å
637R81.2Confident80.8Confident187 Ų18795 Ų9571%0.70651%0.508SS*.Hα-helixtrans-65.5-47.4174.4-68.9172.9-161.2-154.86111.7D633 T634 A635 R639 K640 Q641D633-R637 WeakPolarHBondContact O-CG 3.36Å; D633-R637 PolarHBondContact O-N 2.94Å; D633-R637 VanDerWaalsContact O-N 3.07Å; T634-R637 PolarHBondContact O-N 2.84Å; A635-R637 VanDerWaalsContact C-N 3.35Å; A635-R637 PolarHBondContact O-N 2.95Å; R637-R639 VanDerWaalsContact C-N 3.33Å; R637-R639 PolarHBondContact O-N 3.41Å; R637-K640 PolarHBondContact O-N 2.83Å; R637-Q641 PolarHBondContact O-N 3.49Å
638V82.3Confident80.9Confident98 Ų9895.2 Ų95.259%0.59451%0.506SS*.Hα-helixtrans-61.8-42.2177.7174.80000111.1T634 A635 K640 Q641 A642T634-V638 WeakPolarHBondContact O-CG2 3.48Å; T634-V638 PolarHBondContact O-N 3.47Å; A635-V638 PolarHBondContact O-N 3.02Å; V638-K640 PolarHBondContact O-N 3.43Å; V638-Q641 PolarHBondContact O-N 2.97Å; V638-A642 PolarHBondContact O-N 3.12Å
639R84.3Confident81Confident137 Ų13793.2 Ų93.252%0.51750%0.495SS..Hα-helixtrans-60.8-43.4175.9-157.8-159.781.4-156.93.8111.9A635 R637 Q641 A642 E643A635-R639 WeakPolarHBondContact O-CB 3.29Å; A635-R639 PolarHBondContact O-N 3.4Å; R637-R639 VanDerWaalsContact C-N 3.33Å; R637-R639 PolarHBondContact O-N 3.41Å; R639-Q641 VanDerWaalsContact C-N 3.35Å; R639-Q641 PolarHBondContact O-N 2.87Å; R639-A642 PolarHBondContact O-N 2.84Å; R639-E643 IonicContact CZ-OE1 2.91Å; R639-E643 IonicContact CZ-OE2 2.95Å; R639-E643 IonicContact NE-OE1 3.15Å; R639-E643 PolarHBondContact NE-OE1 2.79Å; R639-E643 IonicContact NE-OE2 2.61Å; R639-E643 IonicContact NH2-OE1 2.66Å; R639-E643 PolarHBondContact NH2-OE1 3.33Å; R639-E643 IonicContact NH2-OE2 2.84Å; R639-E643 PolarHBondContact NH2-OE2 2.94Å; R639-E643 VanDerWaalsContact O-CG 3.28Å; R639-E643 WeakPolarHBondContact O-CG 3.26Å; R639-E643 PolarHBondContact O-N 2.61Å
640K82.7Confident80.9Confident128 Ų12892.1 Ų92.156%0.55750%0.498SS*.Hα-helixtrans-65.7-33.2176.5-79.2-179.2173.6-171.60113.8I636 R637 V638 E643 A644I636-K640 HydrophobicContact CG2-CD 4.41Å; I636-K640 WeakPolarHBondContact O-CB 3.48Å; I636-K640 WeakPolarHBondContact O-CG 3.35Å; I636-K640 PolarHBondContact O-N 3.31Å; R637-K640 PolarHBondContact O-N 2.83Å; V638-K640 PolarHBondContact O-N 3.43Å; K640-E643 WeakPolarHBondContact CA-OE2 3.5Å; K640-A644 PolarHBondContact O-N 3.49Å; K640-A644 VanDerWaalsContact O-N 3.12Å
641Q81.4Confident80.9Confident113 Ų11390.6 Ų90.653%0.52849%0.493SS..Hα-helixtrans-66.8-47.8172.4-171.361.152.200110.2R637 V638 R639 E643 A644 D645R637-Q641 PolarHBondContact O-N 3.49Å; V638-Q641 PolarHBondContact O-N 2.97Å; R639-Q641 VanDerWaalsContact C-N 3.35Å; R639-Q641 PolarHBondContact O-N 2.87Å; Q641-E643 VanDerWaalsContact C-N 3.29Å; Q641-E643 PolarHBondContact O-N 3.17Å; Q641-A644 PolarHBondContact O-N 2.95Å; Q641-D645 PolarHBondContact NE2-OD1 3.18Å; Q641-D645 PolarHBondContact O-N 2.96Å
642A78.6Confident81.1Confident55 Ų5592.8 Ų92.846%0.45549%0.491SS..Hα-helixtrans-62.1-33.8176.600000113.3V638 R639 L646V638-A642 PolarHBondContact O-N 3.12Å; R639-A642 PolarHBondContact O-N 2.84Å; A642-L646 WeakPolarHBondContact O-CB 3.43Å; A642-L646 PolarHBondContact O-N 3.11Å
643E78.9Confident81.2Confident82 Ų8292.6 Ų92.638%0.38349%0.49SS..Hα-helixtrans-61.2-45.6170.5-75.1165.517000111.4R639 K640 Q641 L646 E647R639-E643 IonicContact CZ-OE1 2.91Å; R639-E643 IonicContact CZ-OE2 2.95Å; R639-E643 IonicContact NE-OE1 3.15Å; R639-E643 PolarHBondContact NE-OE1 2.79Å; R639-E643 IonicContact NE-OE2 2.61Å; R639-E643 IonicContact NH2-OE1 2.66Å; R639-E643 PolarHBondContact NH2-OE1 3.33Å; R639-E643 IonicContact NH2-OE2 2.84Å; R639-E643 PolarHBondContact NH2-OE2 2.94Å; R639-E643 VanDerWaalsContact O-CG 3.28Å; R639-E643 WeakPolarHBondContact O-CG 3.26Å; R639-E643 PolarHBondContact O-N 2.61Å; K640-E643 WeakPolarHBondContact CA-OE2 3.5Å; Q641-E643 VanDerWaalsContact C-N 3.29Å; Q641-E643 PolarHBondContact O-N 3.17Å; E643-L646 PolarHBondContact O-N 3.26Å; E643-E647 PolarHBondContact O-N 2.58Å
644A79.9Confident81.2Confident46 Ų4691 Ų9138%0.3849%0.489SS..Hα-helixtrans-69.6-41.3177.800000113.1K640 Q641 L646 E647 E648K640-A644 PolarHBondContact O-N 3.49Å; K640-A644 VanDerWaalsContact O-N 3.12Å; Q641-A644 PolarHBondContact O-N 2.95Å; A644-L646 VanDerWaalsContact C-N 3.25Å; A644-L646 PolarHBondContact O-N 3.43Å; A644-E647 PolarHBondContact O-N 3.44Å; A644-E648 PolarHBondContact O-N 2.88Å
645D83.4Confident81.3Confident82 Ų8292.7 Ų92.744%0.43950%0.495SS..Hα-helixtrans-61.9-36.7176.3-60.1-19.1000110.7Q641 A649Q641-D645 PolarHBondContact NE2-OD1 3.18Å; Q641-D645 PolarHBondContact O-N 2.96Å; D645-A649 VanDerWaalsContact O-CB 3.3Å; D645-A649 WeakPolarHBondContact O-CB 3.44Å; D645-A649 PolarHBondContact O-N 3.33Å
646L79.6Confident81.5Confident114 Ų11495.1 Ų95.160%0.59750%0.499SS*.Hα-helixtrans-70-39.4174.9-17965000112.5A642 E643 A644 S650A642-L646 WeakPolarHBondContact O-CB 3.43Å; A642-L646 PolarHBondContact O-N 3.11Å; E643-L646 PolarHBondContact O-N 3.26Å; A644-L646 VanDerWaalsContact C-N 3.25Å; A644-L646 PolarHBondContact O-N 3.43Å; L646-S650 VanDerWaalsContact O-CB 3.27Å; L646-S650 WeakPolarHBondContact O-CB 3.49Å; L646-S650 PolarHBondContact O-N 3.07Å; L646-S650 PolarHBondContact O-OG 3.07Å
647E82Confident81.7Confident154 Ų15496.9 Ų96.972%0.7251%0.509SS*.Hα-helixtrans-63.5-43.3172.2-75.8-174.7175.200111.5E643 A644 S650 G651E643-E647 PolarHBondContact O-N 2.58Å; A644-E647 PolarHBondContact O-N 3.44Å; E647-S650 PolarHBondContact O-N 2.84Å; E647-G651 PolarHBondContact O-N 3.48Å
648E81.4Confident81.7Confident115 Ų11591 Ų9154%0.53750%0.496SS..Hα-helixtrans-66-40.6177.1-157.3-163156.600111.9A644 G651 K652A644-E648 PolarHBondContact O-N 2.88Å; E648-G651 PolarHBondContact O-N 3.1Å; E648-K652 WeakPolarHBondContact O-CG 3.38Å; E648-K652 PolarHBondContact O-N 3.4Å; E648-K652 WeakPolarHBondContact OE1-CE 3.37Å; E648-K652 IonicContact OE1-NZ 2.65Å; E648-K652 PolarHBondContact OE1-NZ 3.35Å; E648-K652 IonicContact OE2-NZ 3.71Å
649A81.4Confident81.8Confident41 Ų4191 Ų9134%0.33949%0.492SS..Hα-helixtrans-62.9-42.2173.100000112D645 K652 I653D645-A649 VanDerWaalsContact O-CB 3.3Å; D645-A649 WeakPolarHBondContact O-CB 3.44Å; D645-A649 PolarHBondContact O-N 3.33Å; A649-K652 PolarHBondContact O-N 3.07Å; A649-I653 VanDerWaalsContact O-CG1 3.28Å; A649-I653 WeakPolarHBondContact O-CG1 3.33Å; A649-I653 PolarHBondContact O-N 2.94Å
650S80.8Confident81.7Confident63 Ų6389.2 Ų89.244%0.44149%0.493SS..Hα-helixtrans-64.3-39.9177.6-60.80000112L646 E647 I653 A654L646-S650 VanDerWaalsContact O-CB 3.27Å; L646-S650 WeakPolarHBondContact O-CB 3.49Å; L646-S650 PolarHBondContact O-N 3.07Å; L646-S650 PolarHBondContact O-OG 3.07Å; E647-S650 PolarHBondContact O-N 2.84Å; S650-I653 PolarHBondContact O-N 2.67Å; S650-A654 PolarHBondContact O-N 3.37Å
651G81.6Confident81.8Confident34 Ų3488 Ų8835%0.35149%0.492SS..Hα-helixtrans-60.3-49.9171.800000112.2E647 E648 I653 A654 D655E647-G651 PolarHBondContact O-N 3.48Å; E648-G651 PolarHBondContact O-N 3.1Å; G651-I653 VanDerWaalsContact C-N 3.29Å; G651-I653 PolarHBondContact O-N 3.25Å; G651-A654 WeakPolarHBondContact O-CB 3.42Å; G651-A654 PolarHBondContact O-N 3.02Å; G651-A654 VanDerWaalsContact O-N 3.11Å; G651-D655 PolarHBondContact O-N 2.92Å
652K85.3Confident81.9Confident108 Ų10887 Ų8747%0.4749%0.491SS..Hα-helixtrans-58.8-38.1175.8-71.1164.5-175.2164.30112.5E648 A649 L656E648-K652 WeakPolarHBondContact O-CG 3.38Å; E648-K652 PolarHBondContact O-N 3.4Å; E648-K652 WeakPolarHBondContact OE1-CE 3.37Å; E648-K652 IonicContact OE1-NZ 2.65Å; E648-K652 PolarHBondContact OE1-NZ 3.35Å; E648-K652 IonicContact OE2-NZ 3.71Å; A649-K652 PolarHBondContact O-N 3.07Å; K652-L656 WeakPolarHBondContact O-CB 3.09Å; K652-L656 WeakPolarHBondContact O-CG 3.47Å; K652-L656 PolarHBondContact O-N 3.49Å
653I80.4Confident82.2Confident99 Ų9989 Ų8951%0.50849%0.493SS..Hα-helixtrans-65.9-42.8175.4-71.7164.6000110.9A649 S650 G651 L656 I657A649-I653 VanDerWaalsContact O-CG1 3.28Å; A649-I653 WeakPolarHBondContact O-CG1 3.33Å; A649-I653 PolarHBondContact O-N 2.94Å; S650-I653 PolarHBondContact O-N 2.67Å; G651-I653 VanDerWaalsContact C-N 3.29Å; G651-I653 PolarHBondContact O-N 3.25Å; I653-L656 PolarHBondContact O-N 2.85Å; I653-I657 HydrophobicContact CG2-CD1 3.75Å; I653-I657 HydrophobicContact CG2-CG1 4.44Å; I653-I657 WeakPolarHBondContact O-CB 3.23Å; I653-I657 VanDerWaalsContact O-CG1 3.26Å; I653-I657 WeakPolarHBondContact O-CG1 3.48Å; I653-I657 PolarHBondContact O-N 3.28Å
654A81Confident82.5Confident57 Ų5789 Ų8947%0.47150%0.499SS..Hα-helixtrans-62.9-43.4176.100000112.3S650 G651 I657 S658S650-A654 PolarHBondContact O-N 3.37Å; G651-A654 WeakPolarHBondContact O-CB 3.42Å; G651-A654 PolarHBondContact O-N 3.02Å; G651-A654 VanDerWaalsContact O-N 3.11Å; A654-I657 PolarHBondContact O-N 3.03Å; A654-S658 WeakPolarHBondContact O-CB 3.41Å; A654-S658 PolarHBondContact O-N 2.98Å
655D84.8Confident82.6Confident118 Ų11890 Ų9063%0.63150%0.503SS*.Hα-helixtrans-62.5-43.2174.6-76.5-24.5000111.8G651 S658 L659G651-D655 PolarHBondContact O-N 2.92Å; D655-S658 WeakPolarHBondContact O-CB 3.33Å; D655-S658 PolarHBondContact O-N 3.3Å; D655-L659 WeakPolarHBondContact O-CB 3.48Å; D655-L659 PolarHBondContact O-N 3.29Å
656L83.4Confident82.7Confident109 Ų10990.5 Ų90.557%0.57151%0.505SS*.Hα-helixtrans-66.1-37.2176.6-75.1169.8000112.6K652 I653 L659 N660K652-L656 WeakPolarHBondContact O-CB 3.09Å; K652-L656 WeakPolarHBondContact O-CG 3.47Å; K652-L656 PolarHBondContact O-N 3.49Å; I653-L656 PolarHBondContact O-N 2.85Å; L656-L659 PolarHBondContact O-N 3.44Å; L656-N660 WeakPolarHBondContact O-CB 3.49Å; L656-N660 PolarHBondContact O-N 3.42Å
657I81.3Confident83.1Confident95 Ų9590.4 Ų90.449%0.48750%0.5SS..Hα-helixtrans-65-44.4173.3-71.3165.7000110.3I653 A654 N660 N661I653-I657 HydrophobicContact CG2-CD1 3.75Å; I653-I657 HydrophobicContact CG2-CG1 4.44Å; I653-I657 WeakPolarHBondContact O-CB 3.23Å; I653-I657 VanDerWaalsContact O-CG1 3.26Å; I653-I657 WeakPolarHBondContact O-CG1 3.48Å; I653-I657 PolarHBondContact O-N 3.28Å; A654-I657 PolarHBondContact O-N 3.03Å; I657-N660 PolarHBondContact O-N 3.04Å; I657-N661 WeakPolarHBondContact O-CB 3.48Å; I657-N661 VanDerWaalsContact O-CG 3.25Å; I657-N661 PolarHBondContact O-N 2.89Å; I657-N661 PolarHBondContact O-ND2 2.93Å
658S81.6Confident83.2Confident64 Ų6484.5 Ų84.545%0.44848%0.48SS..Hα-helixtrans-59.6-48174.9-174.40000111.6A654 D655 N660 N661 N662A654-S658 WeakPolarHBondContact O-CB 3.41Å; A654-S658 PolarHBondContact O-N 2.98Å; D655-S658 WeakPolarHBondContact O-CB 3.33Å; D655-S658 PolarHBondContact O-N 3.3Å; S658-N660 PolarHBondContact O-N 3.42Å; S658-N661 PolarHBondContact O-N 3.23Å; S658-N662 PolarHBondContact O-N 2.93Å; S658-N662 PolarHBondContact O-ND2 2.97Å
659L85.3Confident83.4Confident97 Ų9785.3 Ų85.351%0.50848%0.482SS..Hα-helixtrans-60.1-45.8176.1-170.976.7000111.7D655 L656 N662 L663D655-L659 WeakPolarHBondContact O-CB 3.48Å; D655-L659 PolarHBondContact O-N 3.29Å; L656-L659 PolarHBondContact O-N 3.44Å; L659-N662 PolarHBondContact O-N 2.69Å; L659-L663 HydrophobicContact CD2-CD1 4.36Å; L659-L663 HydrophobicContact CG-CD1 4.04Å; L659-L663 HydrophobicContact CG-CG 4.49Å; L659-L663 WeakPolarHBondContact O-CB 3.42Å; L659-L663 WeakPolarHBondContact O-CG 3.46Å; L659-L663 PolarHBondContact O-N 3.44Å
660N82Confident83.6Confident99 Ų9988.4 Ų88.453%0.52949%0.492SS..Hα-helixtrans-68-37.7-178.1-166.613000112.3L656 I657 S658 L663 T664L656-N660 WeakPolarHBondContact O-CB 3.49Å; L656-N660 PolarHBondContact O-N 3.42Å; I657-N660 PolarHBondContact O-N 3.04Å; S658-N660 PolarHBondContact O-N 3.42Å; N660-L663 PolarHBondContact O-N 2.99Å; N660-T664 VanDerWaalsContact O-CB 3.3Å; N660-T664 WeakPolarHBondContact O-CB 3.46Å; N660-T664 PolarHBondContact O-N 3.05Å; N660-T664 PolarHBondContact O-OG1 3.15Å
661N83.7Confident83.9Confident103 Ų10390.2 Ų90.255%0.55149%0.494SS*.Hα-helixtrans-63.3-42.5172-73.1-27000111.6I657 S658 T664 S665I657-N661 WeakPolarHBondContact O-CB 3.48Å; I657-N661 VanDerWaalsContact O-CG 3.25Å; I657-N661 PolarHBondContact O-N 2.89Å; I657-N661 PolarHBondContact O-ND2 2.93Å; S658-N661 PolarHBondContact O-N 3.23Å; N661-T664 PolarHBondContact O-N 3.13Å; N661-S665 WeakPolarHBondContact O-CB 3.21Å; N661-S665 PolarHBondContact O-N 2.88Å
662N84.4Confident83.9Confident92 Ų9292.7 Ų92.749%0.49250%0.502SS..Hα-helixtrans-65.1-44.4175.1-74.3-45.2000112.1S658 L659 T664 S665 I666S658-N662 PolarHBondContact O-N 2.93Å; S658-N662 PolarHBondContact O-ND2 2.97Å; L659-N662 PolarHBondContact O-N 2.69Å; N662-T664 VanDerWaalsContact C-N 3.34Å; N662-T664 PolarHBondContact O-N 3.36Å; N662-S665 WeakPolarHBondContact O-CB 3.33Å; N662-S665 PolarHBondContact O-N 3.35Å; N662-I666 VanDerWaalsContact O-CG1 3.31Å; N662-I666 WeakPolarHBondContact O-CG1 3.5Å; N662-I666 PolarHBondContact O-N 3.06Å
663L83.3Confident84Confident97 Ų9791.7 Ų91.751%0.50850%0.502SS..Hα-helixtrans-62.7-38.8175-73.6170.9000112L659 N660 I666 K667L659-L663 HydrophobicContact CD2-CD1 4.36Å; L659-L663 HydrophobicContact CG-CD1 4.04Å; L659-L663 HydrophobicContact CG-CG 4.49Å; L659-L663 WeakPolarHBondContact O-CB 3.42Å; L659-L663 WeakPolarHBondContact O-CG 3.46Å; L659-L663 PolarHBondContact O-N 3.44Å; N660-L663 PolarHBondContact O-N 2.99Å; L663-I666 PolarHBondContact O-N 3.24Å; L663-K667 VanDerWaalsContact O-CB 3.27Å; L663-K667 WeakPolarHBondContact O-CB 3.27Å; L663-K667 PolarHBondContact O-N 3.47Å
664T85.8Confident84.2Confident82 Ų8291.7 Ų91.750%0.50350%0.502SS..Hα-helixtrans-65.9-39.9175.3-60.10000111.5N660 N661 N662 K667 G668N660-T664 VanDerWaalsContact O-CB 3.3Å; N660-T664 WeakPolarHBondContact O-CB 3.46Å; N660-T664 PolarHBondContact O-N 3.05Å; N660-T664 PolarHBondContact O-OG1 3.15Å; N661-T664 PolarHBondContact O-N 3.13Å; N662-T664 VanDerWaalsContact C-N 3.34Å; N662-T664 PolarHBondContact O-N 3.36Å; T664-K667 PolarHBondContact O-N 2.91Å; T664-G668 PolarHBondContact O-N 3.2Å
665S83.2Confident84.4Confident67 Ų6792.4 Ų92.447%0.46950%0.504SS..Hα-helixtrans-65.1-42.2174.2-175.50000112.3N661 N662 K669N661-S665 WeakPolarHBondContact O-CB 3.21Å; N661-S665 PolarHBondContact O-N 2.88Å; N662-S665 WeakPolarHBondContact O-CB 3.33Å; N662-S665 PolarHBondContact O-N 3.35Å; S665-K669 WeakPolarHBondContact O-CG 3.46Å; S665-K669 PolarHBondContact O-N 2.94Å
666I85.4Confident84.3Confident92 Ų9290.2 Ų90.247%0.47250%0.495SS..Hα-helixtrans-65.4-43.7174-68164.1000110.7N662 L663 K669 L670N662-I666 VanDerWaalsContact O-CG1 3.31Å; N662-I666 WeakPolarHBondContact O-CG1 3.5Å; N662-I666 PolarHBondContact O-N 3.06Å; L663-I666 PolarHBondContact O-N 3.24Å; I666-K669 WeakPolarHBondContact O-CB 3.35Å; I666-K669 PolarHBondContact O-N 3.27Å; I666-L670 HydrophobicContact CG2-CD1 3.92Å; I666-L670 HydrophobicContact CG2-CG 4.38Å; I666-L670 WeakPolarHBondContact O-CG 3.4Å; I666-L670 PolarHBondContact O-N 2.96Å
667K86.7Confident84.3Confident113 Ų11388.7 Ų88.749%0.49149%0.492SS..Hα-helixtrans-57.8-49.4175.7-175.1-172174.6-91.90111.3L663 T664 K669 L670 E671L663-K667 VanDerWaalsContact O-CB 3.27Å; L663-K667 WeakPolarHBondContact O-CB 3.27Å; L663-K667 PolarHBondContact O-N 3.47Å; T664-K667 PolarHBondContact O-N 2.91Å; K667-K669 VanDerWaalsContact C-N 3.27Å; K667-K669 PolarHBondContact O-N 3.24Å; K667-L670 CarbonylContact O-C 3.51Å; K667-L670 PolarHBondContact O-N 3.44Å; K667-L670 VanDerWaalsContact O-N 3.12Å; K667-E671 WeakPolarHBondContact CE-OE1 3.49Å; K667-E671 HydrophobicContact CG-CG 4.33Å; K667-E671 IonicContact NZ-OE1 2.93Å; K667-E671 PolarHBondContact NZ-OE1 3.09Å; K667-E671 IonicContact NZ-OE2 3.98Å; K667-E671 PolarHBondContact NZ-OE2 2.99Å; K667-E671 WeakPolarHBondContact O-CG 3.46Å; K667-E671 PolarHBondContact O-N 3.31Å
668G84.4Confident84.4Confident30 Ų3089.3 Ų89.331%0.30949%0.493SS..Hα-helixtrans-61.1-34.5179.200000113.3T664 T672T664-G668 PolarHBondContact O-N 3.2Å; G668-T672 PolarHBondContact O-N 3.33Å; G668-T672 VanDerWaalsContact O-N 3.15Å; G668-T672 PolarHBondContact O-OG1 3Å
669K86.4Confident84.6Confident131 Ų13189 Ų8957%0.5749%0.494SS*.Hα-helixtrans-64.9-53.4169.7-70.5178.2-178.3-176.40111.4S665 I666 K667 E671 T672 D673S665-K669 WeakPolarHBondContact O-CG 3.46Å; S665-K669 PolarHBondContact O-N 2.94Å; I666-K669 WeakPolarHBondContact O-CB 3.35Å; I666-K669 PolarHBondContact O-N 3.27Å; K667-K669 VanDerWaalsContact C-N 3.27Å; K667-K669 PolarHBondContact O-N 3.24Å; K669-E671 VanDerWaalsContact C-N 3.26Å; K669-E671 PolarHBondContact O-N 3.1Å; K669-T672 CarbonylContact O-C 3.59Å; K669-T672 WeakPolarHBondContact O-CA 3.4Å; K669-T672 WeakPolarHBondContact O-CB 3.5Å; K669-T672 PolarHBondContact O-N 3.3Å; K669-D673 PolarHBondContact O-N 2.86Å
670L84.7Confident84.6Confident107 Ų10788.4 Ų88.456%0.5649%0.492SS*.Hα-helixtrans-60.2-32.4179.8-68.7173.3000113.3I666 K667 L674I666-L670 HydrophobicContact CG2-CD1 3.92Å; I666-L670 HydrophobicContact CG2-CG 4.38Å; I666-L670 WeakPolarHBondContact O-CG 3.4Å; I666-L670 PolarHBondContact O-N 2.96Å; K667-L670 CarbonylContact O-C 3.51Å; K667-L670 PolarHBondContact O-N 3.44Å; K667-L670 VanDerWaalsContact O-N 3.12Å; L670-L674 WeakPolarHBondContact O-CB 3.48Å; L670-L674 PolarHBondContact O-N 3.37Å
671E86.5Confident84.8Confident100 Ų10089 Ų8947%0.46750%0.495SS..Hα-helixtrans-69.7-35.3172.5-72.6177.2132.500112K667 K669 S675K667-E671 WeakPolarHBondContact CE-OE1 3.49Å; K667-E671 HydrophobicContact CG-CG 4.33Å; K667-E671 IonicContact NZ-OE1 2.93Å; K667-E671 PolarHBondContact NZ-OE1 3.09Å; K667-E671 IonicContact NZ-OE2 3.98Å; K667-E671 PolarHBondContact NZ-OE2 2.99Å; K667-E671 WeakPolarHBondContact O-CG 3.46Å; K667-E671 PolarHBondContact O-N 3.31Å; K669-E671 VanDerWaalsContact C-N 3.26Å; K669-E671 PolarHBondContact O-N 3.1Å; E671-S675 WeakPolarHBondContact O-CB 3.42Å; E671-S675 PolarHBondContact O-N 3.05Å
672T83Confident84.8Confident87 Ų8788.4 Ų88.453%0.53449%0.491SS..Hα-helixtrans-71.5-45174.5-520000111.3G668 K669 S675 T676G668-T672 PolarHBondContact O-N 3.33Å; G668-T672 VanDerWaalsContact O-N 3.15Å; G668-T672 PolarHBondContact O-OG1 3Å; K669-T672 CarbonylContact O-C 3.59Å; K669-T672 WeakPolarHBondContact O-CA 3.4Å; K669-T672 WeakPolarHBondContact O-CB 3.5Å; K669-T672 PolarHBondContact O-N 3.3Å; T672-S675 PolarHBondContact O-N 3Å; T672-T676 PolarHBondContact O-N 3.09Å; T672-T676 PolarHBondContact O-OG1 3.35Å
673D87.2Confident84.8Confident87 Ų8790.1 Ų90.147%0.46550%0.496SS..Hα-helixtrans-63-44.3176.6-60.3-28.8000110.1K669 T676 C677K669-D673 PolarHBondContact O-N 2.86Å; D673-T676 WeakPolarHBondContact O-CB 3.33Å; D673-T676 PolarHBondContact O-N 3.45Å; D673-T676 VanDerWaalsContact O-N 3.17Å; D673-C677 WeakPolarHBondContact O-CB 3.49Å; D673-C677 PolarHBondContact O-N 3.11Å; D673-C677 PolarHBondContact O-SG 3.05Å; D673-C677 VanDerWaalsContact O-SG 3.37Å
674L83.6Confident84.8Confident98 Ų9889.1 Ų89.151%0.51349%0.494SS..Hα-helixtrans-61.5-44174.3179.363.8000111.9L670 T676 C677 Q678L670-L674 WeakPolarHBondContact O-CB 3.48Å; L670-L674 PolarHBondContact O-N 3.37Å; L674-T676 PolarHBondContact O-N 2.97Å; L674-C677 PolarHBondContact O-N 3.38Å; L674-Q678 HydrophobicContact CD1-CG 4.33Å; L674-Q678 HydrophobicContact CG-CG 4.49Å; L674-Q678 VanDerWaalsContact O-CB 3.3Å; L674-Q678 WeakPolarHBondContact O-CB 3.48Å; L674-Q678 VanDerWaalsContact O-CG 3.24Å; L674-Q678 WeakPolarHBondContact O-CG 3.24Å; L674-Q678 PolarHBondContact O-N 2.92Å
675S86.4Confident84.8Confident72 Ų7287.2 Ų87.250%0.50348%0.483SS..Hα-helixtrans-64-29.2175.9-174.20000112.6E671 T672 A679E671-S675 WeakPolarHBondContact O-CB 3.42Å; E671-S675 PolarHBondContact O-N 3.05Å; T672-S675 PolarHBondContact O-N 3Å; S675-A679 PolarHBondContact O-N 3.38Å
676T82.2Confident84.9Confident72 Ų7289.4 Ų89.444%0.44248%0.484SS..Hα-helixtrans-74.9-52.9176.1-520000109.9T672 D673 L674 Q678 A679 D680T672-T676 PolarHBondContact O-N 3.09Å; T672-T676 PolarHBondContact O-OG1 3.35Å; D673-T676 WeakPolarHBondContact O-CB 3.33Å; D673-T676 PolarHBondContact O-N 3.45Å; D673-T676 VanDerWaalsContact O-N 3.17Å; L674-T676 PolarHBondContact O-N 2.97Å; T676-Q678 PolarHBondContact O-N 3.16Å; T676-A679 WeakPolarHBondContact O-CA 3.41Å; T676-A679 WeakPolarHBondContact O-CB 3.48Å; T676-A679 PolarHBondContact O-N 2.91Å; T676-D680 PolarHBondContact O-N 3.01Å
677C82.8Confident84.9Confident77 Ų7791.1 Ų91.152%0.5249%0.49SS..Hα-helixtrans-58.6-30.2174.8-680000113D673 L674 L681D673-C677 WeakPolarHBondContact O-CB 3.49Å; D673-C677 PolarHBondContact O-N 3.11Å; D673-C677 PolarHBondContact O-SG 3.05Å; D673-C677 VanDerWaalsContact O-SG 3.37Å; L674-C677 PolarHBondContact O-N 3.38Å; C677-L681 VanDerWaalsContact O-CB 3.25Å; C677-L681 WeakPolarHBondContact O-CB 3.4Å; C677-L681 PolarHBondContact O-N 3.1Å
678Q84.7Confident84.8Confident109 Ų10990.5 Ų90.551%0.50949%0.491SS..Hα-helixtrans-68.2-42.4171.7-80.4175.4-8.300111.8L674 T676 L681 D682L674-Q678 HydrophobicContact CD1-CG 4.33Å; L674-Q678 HydrophobicContact CG-CG 4.49Å; L674-Q678 VanDerWaalsContact O-CB 3.3Å; L674-Q678 WeakPolarHBondContact O-CB 3.48Å; L674-Q678 VanDerWaalsContact O-CG 3.24Å; L674-Q678 WeakPolarHBondContact O-CG 3.24Å; L674-Q678 PolarHBondContact O-N 2.92Å; T676-Q678 PolarHBondContact O-N 3.16Å; Q678-L681 PolarHBondContact O-N 3.41Å; Q678-D682 VanDerWaalsContact O-CB 3.28Å; Q678-D682 WeakPolarHBondContact O-CB 3.32Å; Q678-D682 PolarHBondContact O-N 3.14Å
679A84.5Confident84.9Confident56 Ų5696.6 Ų96.646%0.46351%0.505SS..Hα-helixtrans-63.1-43.9174.200000111.6S675 T676 L681 D682 E683S675-A679 PolarHBondContact O-N 3.38Å; T676-A679 WeakPolarHBondContact O-CA 3.41Å; T676-A679 WeakPolarHBondContact O-CB 3.48Å; T676-A679 PolarHBondContact O-N 2.91Å; A679-L681 PolarHBondContact O-N 3.24Å; A679-D682 PolarHBondContact O-N 2.96Å; A679-E683 WeakPolarHBondContact O-CB 3.44Å; A679-E683 PolarHBondContact O-N 2.9Å
680D86.6Confident84.8Confident85 Ų8593.2 Ų93.246%0.45550%0.498SS..Hα-helixtrans-62.2-40.9176.1-59.9-23.7000111.9T676 D682 E683 T684T676-D680 PolarHBondContact O-N 3.01Å; D680-D682 VanDerWaalsContact C-N 3.34Å; D680-E683 PolarHBondContact O-N 3.31Å; D680-T684 WeakPolarHBondContact O-CB 3.49Å; D680-T684 WeakPolarHBondContact O-CG2 3.49Å; D680-T684 PolarHBondContact O-N 3.39Å; D680-T684 PolarHBondContact O-OG1 2.89Å
681L84.6Confident84.8Confident113 Ų11390 Ų9059%0.59249%0.486SS*.Hα-helixtrans-63.7-41.4174.3-171.579.6000111.2C677 Q678 A679 T684 T685C677-L681 VanDerWaalsContact O-CB 3.25Å; C677-L681 WeakPolarHBondContact O-CB 3.4Å; C677-L681 PolarHBondContact O-N 3.1Å; Q678-L681 PolarHBondContact O-N 3.41Å; A679-L681 PolarHBondContact O-N 3.24Å; L681-T684 WeakPolarHBondContact CA-OG1 3.48Å; L681-T684 PolarHBondContact O-OG1 3.25Å; L681-T685 WeakPolarHBondContact O-CB 3.46Å; L681-T685 PolarHBondContact O-N 2.98Å; L681-T685 PolarHBondContact O-OG1 2.85Å
682D85.1Confident84.8Confident90 Ų9089.1 Ų89.148%0.48149%0.485SS..Hα-helixtrans-72.1-32.2-178.7-142.547000111.6Q678 A679 D680 K686Q678-D682 VanDerWaalsContact O-CB 3.28Å; Q678-D682 WeakPolarHBondContact O-CB 3.32Å; Q678-D682 PolarHBondContact O-N 3.14Å; A679-D682 PolarHBondContact O-N 2.96Å; D680-D682 VanDerWaalsContact C-N 3.34Å; D682-K686 WeakPolarHBondContact O-CD 3.35Å; D682-K686 WeakPolarHBondContact O-CE 3.37Å; D682-K686 WeakPolarHBondContact O-CG 3.42Å; D682-K686 PolarHBondContact O-N 3.34Å; D682-K686 PolarHBondContact O-NZ 3.09Å; D682-K686 IonicContact OD2-NZ 2.79Å; D682-K686 PolarHBondContact OD2-NZ 3.45Å
683E84.1Confident84.8Confident128 Ų12890 Ų9060%0.59848%0.483SS*.Hα-helixtrans-72.5-52.2171.8-174.2149.3-129.600111.7A679 D680 T685 K686 E687A679-E683 WeakPolarHBondContact O-CB 3.44Å; A679-E683 PolarHBondContact O-N 2.9Å; D680-E683 PolarHBondContact O-N 3.31Å; E683-T685 PolarHBondContact O-N 3.39Å; E683-K686 CarbonylContact O-C 3.52Å; E683-K686 WeakPolarHBondContact O-CA 3.34Å; E683-K686 WeakPolarHBondContact O-CB 3.26Å; E683-K686 PolarHBondContact O-N 2.96Å; E683-E687 PolarHBondContact O-N 3.02Å
684T83.1Confident84.6Confident76 Ų7693.2 Ų93.247%0.46649%0.489SS..Hα-helixtrans-60.4-31.5175.351.40000112.8D680 L681 E687 L688D680-T684 WeakPolarHBondContact O-CB 3.49Å; D680-T684 WeakPolarHBondContact O-CG2 3.49Å; D680-T684 PolarHBondContact O-N 3.39Å; D680-T684 PolarHBondContact O-OG1 2.89Å; L681-T684 WeakPolarHBondContact CA-OG1 3.48Å; L681-T684 PolarHBondContact O-OG1 3.25Å; T684-E687 PolarHBondContact O-N 3.49Å; T684-L688 WeakPolarHBondContact O-CB 3.47Å; T684-L688 PolarHBondContact O-N 3.01Å
685T85.3Confident84.6Confident42 Ų4290.8 Ų90.826%0.25848%0.483SS..Hα-helixtrans-69.2-34.4171.9-61.50000112.3L681 E683 R689L681-T685 WeakPolarHBondContact O-CB 3.46Å; L681-T685 PolarHBondContact O-N 2.98Å; L681-T685 PolarHBondContact O-OG1 2.85Å; E683-T685 PolarHBondContact O-N 3.39Å; T685-R689 VanDerWaalsContact O-CG 3.31Å; T685-R689 WeakPolarHBondContact O-CG 3.47Å; T685-R689 PolarHBondContact O-N 2.97Å
686K85.9Confident84.6Confident113 Ų11391.5 Ų91.549%0.49148%0.481SS..Hα-helixtrans-70-40.7172.2-69.2154.9-161.6141.70110.9D682 E683 R689 S690D682-K686 WeakPolarHBondContact O-CD 3.35Å; D682-K686 WeakPolarHBondContact O-CE 3.37Å; D682-K686 WeakPolarHBondContact O-CG 3.42Å; D682-K686 PolarHBondContact O-N 3.34Å; D682-K686 PolarHBondContact O-NZ 3.09Å; D682-K686 IonicContact OD2-NZ 2.79Å; D682-K686 PolarHBondContact OD2-NZ 3.45Å; E683-K686 CarbonylContact O-C 3.52Å; E683-K686 WeakPolarHBondContact O-CA 3.34Å; E683-K686 WeakPolarHBondContact O-CB 3.26Å; E683-K686 PolarHBondContact O-N 2.96Å; K686-R689 PolarHBondContact O-N 2.73Å; K686-S690 WeakPolarHBondContact O-CB 3.31Å; K686-S690 PolarHBondContact O-N 3.4Å
687E84.3Confident84.8Confident128 Ų12894.7 Ų94.760%0.59849%0.485SS*.Hα-helixtrans-62.7-43.2174-68.3-158.2130.500112.2E683 T684 S690 A691E683-E687 PolarHBondContact O-N 3.02Å; T684-E687 PolarHBondContact O-N 3.49Å; E687-S690 CarbonylContact O-C 3.55Å; E687-S690 WeakPolarHBondContact O-CB 3.48Å; E687-S690 PolarHBondContact O-N 3.07Å; E687-A691 WeakPolarHBondContact O-CB 3.37Å; E687-A691 PolarHBondContact O-N 2.58Å
688L85.3Confident84.8Confident100 Ų10093.9 Ų93.952%0.52448%0.483SS..Hα-helixtrans-61.3-48175.8-18060.9000111.3T684 S690 A691 D692T684-L688 WeakPolarHBondContact O-CB 3.47Å; T684-L688 PolarHBondContact O-N 3.01Å; L688-S690 VanDerWaalsContact C-N 3.29Å; L688-S690 PolarHBondContact O-N 3.23Å; L688-A691 CarbonylContact O-C 3.59Å; L688-A691 WeakPolarHBondContact O-CA 3.46Å; L688-A691 WeakPolarHBondContact O-CB 3.47Å; L688-A691 PolarHBondContact O-N 2.92Å; L688-D692 PolarHBondContact O-N 2.93Å
689R86.7Confident85Confident158 Ų15895.1 Ų95.160%0.59649%0.491SS*.Hα-helixtrans-59.6-39.6174.2-71.4172.3-171.9161.27112.2T685 K686 A691 D692 E693T685-R689 VanDerWaalsContact O-CG 3.31Å; T685-R689 WeakPolarHBondContact O-CG 3.47Å; T685-R689 PolarHBondContact O-N 2.97Å; K686-R689 PolarHBondContact O-N 2.73Å; R689-A691 VanDerWaalsContact C-N 3.33Å; R689-A691 PolarHBondContact O-N 3.35Å; R689-D692 PolarHBondContact O-N 3.25Å; R689-E693 WeakPolarHBondContact O-CB 3.47Å; R689-E693 WeakPolarHBondContact O-CG 3.36Å; R689-E693 PolarHBondContact O-N 3.49Å
690S84Confident85.1Confident59 Ų5997.7 Ų97.741%0.41349%0.494SS..Hα-helixtrans-66.3-32.4174.11740000112.7K686 E687 L688 R694K686-S690 WeakPolarHBondContact O-CB 3.31Å; K686-S690 PolarHBondContact O-N 3.4Å; E687-S690 CarbonylContact O-C 3.55Å; E687-S690 WeakPolarHBondContact O-CB 3.48Å; E687-S690 PolarHBondContact O-N 3.07Å; L688-S690 VanDerWaalsContact C-N 3.29Å; L688-S690 PolarHBondContact O-N 3.23Å; S690-R694 WeakPolarHBondContact O-CG 3.31Å; S690-R694 PolarHBondContact O-N 2.78Å; S690-R694 PolarHBondContact O-NE 2.91Å
691A85.2Confident85.1Confident39 Ų3997.8 Ų97.832%0.32249%0.494SS..Hα-helixtrans-71.6-46.5172.400000111.6E687 L688 R689 E693 R694 A695E687-A691 WeakPolarHBondContact O-CB 3.37Å; E687-A691 PolarHBondContact O-N 2.58Å; L688-A691 CarbonylContact O-C 3.59Å; L688-A691 WeakPolarHBondContact O-CA 3.46Å; L688-A691 WeakPolarHBondContact O-CB 3.47Å; L688-A691 PolarHBondContact O-N 2.92Å; R689-A691 VanDerWaalsContact C-N 3.33Å; R689-A691 PolarHBondContact O-N 3.35Å; A691-E693 PolarHBondContact O-N 2.99Å; A691-R694 CarbonylContact O-C 3.59Å; A691-R694 WeakPolarHBondContact O-CB 3.37Å; A691-R694 PolarHBondContact O-N 2.89Å; A691-R694 VanDerWaalsContact O-N 3.14Å; A691-A695 WeakPolarHBondContact O-CB 3.43Å; A691-A695 PolarHBondContact O-N 3.24Å
692D85.4Confident85Confident83 Ų8394.7 Ų94.744%0.44449%0.485SS..Hα-helixtrans-62.6-40.6176.1-78.8-16000111.9L688 R689 R694 A695 N696L688-D692 PolarHBondContact O-N 2.93Å; R689-D692 PolarHBondContact O-N 3.25Å; D692-R694 VanDerWaalsContact C-N 3.32Å; D692-R694 PolarHBondContact O-N 2.93Å; D692-A695 PolarHBondContact O-N 3.46Å; D692-N696 VanDerWaalsContact O-CB 3.29Å; D692-N696 WeakPolarHBondContact O-CB 3.48Å; D692-N696 PolarHBondContact O-N 2.71Å; D692-N696 PolarHBondContact O-ND2 2.74Å
693E83.3Confident85.1Confident106 Ų10692.8 Ų92.850%0.49548%0.481SS..Hα-helixtrans-62-39.6173.2-82.7-166.9-130.700111.9R689 A691 R697R689-E693 WeakPolarHBondContact O-CB 3.47Å; R689-E693 WeakPolarHBondContact O-CG 3.36Å; R689-E693 PolarHBondContact O-N 3.49Å; A691-E693 PolarHBondContact O-N 2.99Å; E693-R697 WeakPolarHBondContact O-CB 3.15Å; E693-R697 WeakPolarHBondContact O-CD 3.28Å; E693-R697 WeakPolarHBondContact O-CG 3.37Å; E693-R697 PolarHBondContact O-N 2.71Å; E693-R697 IonicContact OE2-CZ 2.86Å; E693-R697 IonicContact OE2-NH2 3.04Å; E693-R697 PolarHBondContact OE2-NH2 2.88Å
694R83.9Confident85.3Confident153 Ų15392.7 Ų92.758%0.57748%0.476SS*.Hα-helixtrans-68.6-40.7175.1-76.6175.9-72.1153.9-2111.9S690 A691 D692 R697 A698S690-R694 WeakPolarHBondContact O-CG 3.31Å; S690-R694 PolarHBondContact O-N 2.78Å; S690-R694 PolarHBondContact O-NE 2.91Å; A691-R694 CarbonylContact O-C 3.59Å; A691-R694 WeakPolarHBondContact O-CB 3.37Å; A691-R694 PolarHBondContact O-N 2.89Å; A691-R694 VanDerWaalsContact O-N 3.14Å; D692-R694 VanDerWaalsContact C-N 3.32Å; D692-R694 PolarHBondContact O-N 2.93Å; R694-R697 PolarHBondContact O-N 3.16Å; R694-A698 WeakPolarHBondContact O-CB 3.37Å; R694-A698 PolarHBondContact O-N 3.48Å
695A83.4Confident85.3Confident47 Ų4791.6 Ų91.639%0.38847%0.474SS..Hα-helixtrans-65.5-44.9177.200000111.7A691 D692 A698 M699A691-A695 WeakPolarHBondContact O-CB 3.43Å; A691-A695 PolarHBondContact O-N 3.24Å; D692-A695 PolarHBondContact O-N 3.46Å; A695-A698 PolarHBondContact O-N 3.45Å; A695-M699 WeakPolarHBondContact O-CB 3.4Å; A695-M699 WeakPolarHBondContact O-CG 3.33Å; A695-M699 PolarHBondContact O-N 3.28Å
696N86.9Confident85.5Confident87 Ų8795.7 Ų95.747%0.46549%0.492SS..Hα-helixtrans-64.6-40.7176.1-80.5-73.2000112.2D692 M699 Q700D692-N696 VanDerWaalsContact O-CB 3.29Å; D692-N696 WeakPolarHBondContact O-CB 3.48Å; D692-N696 PolarHBondContact O-N 2.71Å; D692-N696 PolarHBondContact O-ND2 2.74Å; N696-M699 PolarHBondContact O-N 2.88Å; N696-Q700 WeakPolarHBondContact O-CB 3.32Å; N696-Q700 VanDerWaalsContact O-CG 3.3Å; N696-Q700 WeakPolarHBondContact O-CG 3.48Å; N696-Q700 PolarHBondContact O-N 3.02Å
697R86.4Confident85.4Confident140 Ų14096.5 Ų96.553%0.52850%0.497SS..Hα-helixtrans-61.5-47.4172.3-70.3168.2-156.4-165.78.1111E693 R694 M699 Q700 D701E693-R697 WeakPolarHBondContact O-CB 3.15Å; E693-R697 WeakPolarHBondContact O-CD 3.28Å; E693-R697 WeakPolarHBondContact O-CG 3.37Å; E693-R697 PolarHBondContact O-N 2.71Å; E693-R697 IonicContact OE2-CZ 2.86Å; E693-R697 IonicContact OE2-NH2 3.04Å; E693-R697 PolarHBondContact OE2-NH2 2.88Å; R694-R697 PolarHBondContact O-N 3.16Å; R697-M699 VanDerWaalsContact C-N 3.31Å; R697-M699 PolarHBondContact O-N 2.96Å; R697-Q700 PolarHBondContact O-N 3.39Å; R697-Q700 VanDerWaalsContact O-N 3.15Å; R697-D701 WeakPolarHBondContact O-CB 3.43Å; R697-D701 PolarHBondContact O-N 3.44Å
698A83Confident85.5Confident59 Ų5996.3 Ų96.349%0.48850%0.497SS..Hα-helixtrans-61.3-36.4176.400000113R694 A695 A702R694-A698 WeakPolarHBondContact O-CB 3.37Å; R694-A698 PolarHBondContact O-N 3.48Å; A695-A698 PolarHBondContact O-N 3.45Å; A698-A702 VanDerWaalsContact O-CB 3.24Å; A698-A702 WeakPolarHBondContact O-CB 2.84Å; A698-A702 PolarHBondContact O-N 2.99Å
699M87.6Confident85.4Confident136 Ų13696.3 Ų96.367%0.6750%0.496SS*.Hα-helixtrans-67.6-41.7172.5-78.8-176.4159.900112.5A695 N696 R697 D701 A702 A703A695-M699 WeakPolarHBondContact O-CB 3.4Å; A695-M699 WeakPolarHBondContact O-CG 3.33Å; A695-M699 PolarHBondContact O-N 3.28Å; N696-M699 PolarHBondContact O-N 2.88Å; R697-M699 VanDerWaalsContact C-N 3.31Å; R697-M699 PolarHBondContact O-N 2.96Å; M699-D701 VanDerWaalsContact C-N 3.34Å; M699-A702 PolarHBondContact O-N 3.32Å; M699-A703 VanDerWaalsContact O-CB 3.26Å; M699-A703 WeakPolarHBondContact O-CB 3.38Å; M699-A703 PolarHBondContact O-N 2.91Å
700Q87.2Confident85.5Confident110 Ų11094.6 Ų94.651%0.51450%0.495SS..Hα-helixtrans-66.9-34175.3-72.9173.88.500112.4N696 R697 R704N696-Q700 WeakPolarHBondContact O-CB 3.32Å; N696-Q700 VanDerWaalsContact O-CG 3.3Å; N696-Q700 WeakPolarHBondContact O-CG 3.48Å; N696-Q700 PolarHBondContact O-N 3.02Å; R697-Q700 PolarHBondContact O-N 3.39Å; R697-Q700 VanDerWaalsContact O-N 3.15Å; Q700-R704 WeakPolarHBondContact O-CB 3.41Å; Q700-R704 WeakPolarHBondContact O-CG 3.49Å; Q700-R704 PolarHBondContact O-N 2.91Å; Q700-R704 PolarHBondContact O-NE 3.29Å
701D86.3Confident85.6Confident87 Ų8797.3 Ų97.347%0.46550%0.501SS..Hα-helixtrans-74.2-39.7175.9-66.1-19.6000111R697 M699 R704 A705R697-D701 WeakPolarHBondContact O-CB 3.43Å; R697-D701 PolarHBondContact O-N 3.44Å; M699-D701 VanDerWaalsContact C-N 3.34Å; D701-R704 PolarHBondContact O-N 3.48Å; D701-R704 IonicContact OD1-CZ 2.67Å; D701-R704 IonicContact OD1-NE 3.44Å; D701-R704 IonicContact OD1-NH2 3.13Å; D701-R704 PolarHBondContact OD1-NH2 3.07Å; D701-A705 WeakPolarHBondContact O-CB 3.43Å; D701-A705 PolarHBondContact O-N 3.3Å
702A82.3Confident85.5Confident48 Ų48101.6 Ų101.640%0.39752%0.515SS..Hα-helixtrans-65.7-39.317200000112.5A698 M699 A705 M706A698-A702 VanDerWaalsContact O-CB 3.24Å; A698-A702 WeakPolarHBondContact O-CB 2.84Å; A698-A702 PolarHBondContact O-N 2.99Å; M699-A702 PolarHBondContact O-N 3.32Å; A702-A705 PolarHBondContact O-N 3.42Å; A702-M706 WeakPolarHBondContact O-CG 3.25Å; A702-M706 PolarHBondContact O-N 3.27Å
703A88Confident85.6Confident50 Ų50101.9 Ų101.941%0.41351%0.513SS..Hα-helixtrans-62.4-48.7174.200000111.2M699 A705 M706 E707M699-A703 VanDerWaalsContact O-CB 3.26Å; M699-A703 WeakPolarHBondContact O-CB 3.38Å; M699-A703 PolarHBondContact O-N 2.91Å; A703-A705 VanDerWaalsContact C-N 3.32Å; A703-A705 PolarHBondContact O-N 2.89Å; A703-M706 PolarHBondContact O-N 3.28Å; A703-M706 VanDerWaalsContact O-N 3.15Å; A703-E707 WeakPolarHBondContact O-CB 3.47Å; A703-E707 PolarHBondContact O-N 3.29Å
704R87.5Confident85.6Confident126 Ų126101.7 Ų101.748%0.47551%0.512SS..Hα-helixtrans-61.3-37.3174.8-76.3-179.1-75.6-162.6-2.3112.8Q700 D701 E707 Q708Q700-R704 WeakPolarHBondContact O-CB 3.41Å; Q700-R704 WeakPolarHBondContact O-CG 3.49Å; Q700-R704 PolarHBondContact O-N 2.91Å; Q700-R704 PolarHBondContact O-NE 3.29Å; D701-R704 PolarHBondContact O-N 3.48Å; D701-R704 IonicContact OD1-CZ 2.67Å; D701-R704 IonicContact OD1-NE 3.44Å; D701-R704 IonicContact OD1-NH2 3.13Å; D701-R704 PolarHBondContact OD1-NH2 3.07Å; R704-E707 PolarHBondContact O-N 3.43Å; R704-Q708 WeakPolarHBondContact O-CB 3.49Å; R704-Q708 VanDerWaalsContact O-CG 3.25Å; R704-Q708 WeakPolarHBondContact O-CG 3.22Å; R704-Q708 PolarHBondContact O-N 3Å
705A84.5Confident85.7Confident53 Ų5399.2 Ų99.244%0.43851%0.507SS..Hα-helixtrans-67.8-35.2174.800000112.7D701 A702 A703 L709D701-A705 WeakPolarHBondContact O-CB 3.43Å; D701-A705 PolarHBondContact O-N 3.3Å; A702-A705 PolarHBondContact O-N 3.42Å; A703-A705 VanDerWaalsContact C-N 3.32Å; A703-A705 PolarHBondContact O-N 2.89Å; A705-L709 VanDerWaalsContact O-CB 3.25Å; A705-L709 WeakPolarHBondContact O-CB 3.4Å; A705-L709 PolarHBondContact O-N 2.95Å
706M87.7Confident85.8Confident127 Ų127100.4 Ų100.463%0.62651%0.513SS*.Hα-helixtrans-70.7-39172.9-74.3-174.9-70.600112.2A702 A703 L709 H710A702-M706 WeakPolarHBondContact O-CG 3.25Å; A702-M706 PolarHBondContact O-N 3.27Å; A703-M706 PolarHBondContact O-N 3.28Å; A703-M706 VanDerWaalsContact O-N 3.15Å; M706-L709 PolarHBondContact O-N 2.9Å; M706-H710 PolarHBondContact O-N 2.9Å
707E85.4Confident85.9Confident130 Ų130103.1 Ų103.161%0.60752%0.524SS*.Hα-helixtrans-63.5-49.7175.6-168166.2-137.500110.9A703 R704 L709 H710 E711A703-E707 WeakPolarHBondContact O-CB 3.47Å; A703-E707 PolarHBondContact O-N 3.29Å; R704-E707 PolarHBondContact O-N 3.43Å; E707-L709 VanDerWaalsContact C-N 3.33Å; E707-L709 PolarHBondContact O-N 2.95Å; E707-H710 WeakPolarHBondContact O-CA 3.46Å; E707-H710 PolarHBondContact O-N 2.84Å; E707-E711 PolarHBondContact O-N 3.13Å
708Q85.1Confident86Confident125 Ų125101.9 Ų101.958%0.58452%0.523SS*.Hα-helixtrans-58.9-39.7173.1-74173.9-9.800112.9R704 H710 E711 E712R704-Q708 WeakPolarHBondContact O-CB 3.49Å; R704-Q708 VanDerWaalsContact O-CG 3.25Å; R704-Q708 WeakPolarHBondContact O-CG 3.22Å; R704-Q708 PolarHBondContact O-N 3Å; Q708-H710 VanDerWaalsContact C-N 3.26Å; Q708-H710 PolarHBondContact O-N 3.48Å; Q708-E711 PolarHBondContact O-N 2.97Å; Q708-E712 WeakPolarHBondContact O-CB 3.4Å; Q708-E712 PolarHBondContact O-N 3.45Å
709L83.9Confident86Confident99 Ų99104.5 Ų104.552%0.51853%0.527SS..Hα-helixtrans-63.4-34.7174.4178.262.8000111.6A705 M706 E707 Q713A705-L709 VanDerWaalsContact O-CB 3.25Å; A705-L709 WeakPolarHBondContact O-CB 3.4Å; A705-L709 PolarHBondContact O-N 2.95Å; M706-L709 PolarHBondContact O-N 2.9Å; E707-L709 VanDerWaalsContact C-N 3.33Å; E707-L709 PolarHBondContact O-N 2.95Å; L709-Q713 WeakPolarHBondContact O-CB 3.36Å; L709-Q713 WeakPolarHBondContact O-CG 3.33Å; L709-Q713 PolarHBondContact O-N 3.19Å
710H88.4Confident85.9Confident123 Ų123100.5 Ų100.557%0.56951%0.509SS*.Hα-helixtrans-77.5-38178.7-144.641.3000112.1M706 E707 Q708 E712 Q713 E714M706-H710 PolarHBondContact O-N 2.9Å; E707-H710 WeakPolarHBondContact O-CA 3.46Å; E707-H710 PolarHBondContact O-N 2.84Å; Q708-H710 VanDerWaalsContact C-N 3.26Å; Q708-H710 PolarHBondContact O-N 3.48Å; H710-E712 PolarHBondContact O-N 3.25Å; H710-Q713 PolarHBondContact ND1-OE1 3.28Å; H710-Q713 PolarHBondContact O-N 3.09Å; H710-E714 PolarHBondContact O-N 3.14Å
711E87.4Confident85.9Confident116 Ų11698 Ų9854%0.54251%0.507SS..Hα-helixtrans-58.4-45.6169.3-69.9-173.4132.700111.5E707 Q708 E714 H715E707-E711 PolarHBondContact O-N 3.13Å; Q708-E711 PolarHBondContact O-N 2.97Å; E711-E714 PolarHBondContact O-N 3.01Å; E711-H715 PolarHBondContact O-N 3.23Å; E711-H715 PolarHBondContact O-ND1 3.34Å
712E82.1Confident86Confident129 Ų129100.1 Ų100.160%0.60352%0.516SS*.Hα-helixtrans-69.1-35.3178.2-171.663.8-162.200111.9Q708 H710 H715 S716Q708-E712 WeakPolarHBondContact O-CB 3.4Å; Q708-E712 PolarHBondContact O-N 3.45Å; H710-E712 PolarHBondContact O-N 3.25Å; E712-H715 PolarHBondContact O-N 3.49Å; E712-S716 VanDerWaalsContact O-CB 3.28Å; E712-S716 WeakPolarHBondContact O-CB 3.32Å; E712-S716 PolarHBondContact O-N 2.97Å
713Q86.4Confident86.3Confident89 Ų89103.8 Ų103.842%0.41652%0.519SS..Hα-helixtrans-61.7-46.2170.1-79.31682.300111.5L709 H710 H715 S716 M717L709-Q713 WeakPolarHBondContact O-CB 3.36Å; L709-Q713 WeakPolarHBondContact O-CG 3.33Å; L709-Q713 PolarHBondContact O-N 3.19Å; H710-Q713 PolarHBondContact ND1-OE1 3.28Å; H710-Q713 PolarHBondContact O-N 3.09Å; Q713-H715 PolarHBondContact O-N 3.11Å; Q713-S716 PolarHBondContact O-N 3.3Å; Q713-M717 WeakPolarHBondContact O-CB 3.38Å; Q713-M717 VanDerWaalsContact O-CG 3.3Å; Q713-M717 WeakPolarHBondContact O-CG 3.31Å; Q713-M717 PolarHBondContact O-N 3.42Å
714E85.4Confident86.2Confident101 Ų101107 Ų10747%0.47252%0.524SS..Hα-helixtrans-61.8-42.3174.2-81.1-148.616200112.1H710 E711 M717 K718H710-E714 PolarHBondContact O-N 3.14Å; E711-E714 PolarHBondContact O-N 3.01Å; E714-M717 PolarHBondContact O-N 2.91Å; E714-K718 WeakPolarHBondContact O-CB 3.29Å; E714-K718 WeakPolarHBondContact O-CD 3.27Å; E714-K718 WeakPolarHBondContact O-CG 3.49Å; E714-K718 PolarHBondContact O-N 3.37Å; E714-K718 WeakPolarHBondContact OE2-CE 3.5Å; E714-K718 IonicContact OE2-NZ 2.68Å; E714-K718 PolarHBondContact OE2-NZ 2.69Å
715H85.4Confident86.1Confident102 Ų102103.7 Ų103.747%0.47252%0.523SS..Hα-helixtrans-62.7-45.7177.3-80.673000111.2E711 E712 Q713 M717 K718 I719E711-H715 PolarHBondContact O-N 3.23Å; E711-H715 PolarHBondContact O-ND1 3.34Å; E712-H715 PolarHBondContact O-N 3.49Å; Q713-H715 PolarHBondContact O-N 3.11Å; H715-M717 PolarHBondContact O-N 3.06Å; H715-K718 PolarHBondContact O-N 2.7Å; H715-I719 WeakPolarHBondContact O-CB 3.36Å; H715-I719 VanDerWaalsContact O-CG1 3.23Å; H715-I719 WeakPolarHBondContact O-CG1 3.49Å; H715-I719 PolarHBondContact O-N 3.02Å
716S85.3Confident86.1Confident72 Ų72105.8 Ų105.850%0.50353%0.527SS..Hα-helixtrans-58.7-45.8174.3-175.10000112E712 Q713 I719 D720E712-S716 VanDerWaalsContact O-CB 3.28Å; E712-S716 WeakPolarHBondContact O-CB 3.32Å; E712-S716 PolarHBondContact O-N 2.97Å; Q713-S716 PolarHBondContact O-N 3.3Å; S716-I719 PolarHBondContact O-N 3.46Å; S716-D720 WeakPolarHBondContact O-CB 3.43Å; S716-D720 PolarHBondContact O-N 2.79Å
717M87.9Confident86Confident143 Ų143103.5 Ų103.570%0.70452%0.515SS*.Hα-helixtrans-64.5-40.3176.6-73.1176.264.600112.8Q713 E714 H715 D720 A721Q713-M717 WeakPolarHBondContact O-CB 3.38Å; Q713-M717 VanDerWaalsContact O-CG 3.3Å; Q713-M717 WeakPolarHBondContact O-CG 3.31Å; Q713-M717 PolarHBondContact O-N 3.42Å; E714-M717 PolarHBondContact O-N 2.91Å; H715-M717 PolarHBondContact O-N 3.06Å; M717-D720 PolarHBondContact O-N 3.24Å; M717-A721 VanDerWaalsContact O-CB 3.26Å; M717-A721 WeakPolarHBondContact O-CB 3.38Å; M717-A721 PolarHBondContact O-N 3.46Å
718K88.4Confident85.9Confident115 Ų115103.4 Ų103.450%0.551%0.514SS..Hα-helixtrans-64.8-42.9175-72.1161.3-168.9166.30111.3E714 H715 M722E714-K718 WeakPolarHBondContact O-CB 3.29Å; E714-K718 WeakPolarHBondContact O-CD 3.27Å; E714-K718 WeakPolarHBondContact O-CG 3.49Å; E714-K718 PolarHBondContact O-N 3.37Å; E714-K718 WeakPolarHBondContact OE2-CE 3.5Å; E714-K718 IonicContact OE2-NZ 2.68Å; E714-K718 PolarHBondContact OE2-NZ 2.69Å; H715-K718 PolarHBondContact O-N 2.7Å; K718-M722 VanDerWaalsContact O-CB 3.26Å; K718-M722 WeakPolarHBondContact O-CB 3.33Å; K718-M722 PolarHBondContact O-N 3.48Å
719I84.8Confident85.8Confident114 Ų114103 Ų10359%0.58551%0.512SS*.Hα-helixtrans-62.6-47.7175.8-71.7165.1000110.7H715 S716 A721 M722 R723H715-I719 WeakPolarHBondContact O-CB 3.36Å; H715-I719 VanDerWaalsContact O-CG1 3.23Å; H715-I719 WeakPolarHBondContact O-CG1 3.49Å; H715-I719 PolarHBondContact O-N 3.02Å; S716-I719 PolarHBondContact O-N 3.46Å; I719-A721 PolarHBondContact O-N 3.11Å; I719-M722 PolarHBondContact O-N 3.42Å; I719-R723 WeakPolarHBondContact O-CB 3.26Å; I719-R723 PolarHBondContact O-N 3.4Å
720D84.9Confident85.8Confident52 Ų52101.8 Ų101.828%0.27851%0.509SS..Hα-helixtrans-72.7-28.6-177.1-157.355.4000112.5S716 M717 R723 K724S716-D720 WeakPolarHBondContact O-CB 3.43Å; S716-D720 PolarHBondContact O-N 2.79Å; M717-D720 PolarHBondContact O-N 3.24Å; D720-R723 IonicContact OD1-CZ 3.84Å; D720-R723 IonicContact OD1-NH1 3.69Å; D720-R723 PolarHBondContact OD1-NH1 3.14Å; D720-K724 WeakPolarHBondContact O-CD 3.35Å; D720-K724 VanDerWaalsContact O-CG 3.31Å; D720-K724 WeakPolarHBondContact O-CG 3.28Å; D720-K724 PolarHBondContact O-N 3.34Å; D720-K724 IonicContact OD2-NZ 3.83Å; D720-K724 PolarHBondContact OD2-NZ 3.35Å
721A87.6Confident85.7Confident58 Ų58102.1 Ų102.148%0.47951%0.508SS..Hα-helixtrans-68.8-47.3168.800000112.2M717 I719 R723 K724 A725M717-A721 VanDerWaalsContact O-CB 3.26Å; M717-A721 WeakPolarHBondContact O-CB 3.38Å; M717-A721 PolarHBondContact O-N 3.46Å; I719-A721 PolarHBondContact O-N 3.11Å; A721-R723 VanDerWaalsContact C-N 3.3Å; A721-R723 PolarHBondContact O-N 3.29Å; A721-K724 PolarHBondContact O-N 3.47Å; A721-A725 PolarHBondContact O-N 3.43Å
722M87.2Confident85.5Confident131 Ų131101.2 Ų101.265%0.64550%0.504SS*.Hα-helixtrans-62.8-38176.2-176175.5176.200111.6K718 I719 A725 L726K718-M722 VanDerWaalsContact O-CB 3.26Å; K718-M722 WeakPolarHBondContact O-CB 3.33Å; K718-M722 PolarHBondContact O-N 3.48Å; I719-M722 PolarHBondContact O-N 3.42Å; M722-A725 PolarHBondContact O-N 2.91Å; M722-L726 HydrophobicContact CG-CD1 4.38Å; M722-L726 WeakPolarHBondContact O-CG 3.27Å; M722-L726 PolarHBondContact O-N 3.35Å
723R88.4Confident85.4Confident124 Ų12499.5 Ų99.547%0.46850%0.499SS..Hα-helixtrans-60.7-47.9171.7179.3-168146.8-139.7-8.2111.6I719 D720 A721 A725 L726 E727I719-R723 WeakPolarHBondContact O-CB 3.26Å; I719-R723 PolarHBondContact O-N 3.4Å; D720-R723 IonicContact OD1-CZ 3.84Å; D720-R723 IonicContact OD1-NH1 3.69Å; D720-R723 PolarHBondContact OD1-NH1 3.14Å; A721-R723 VanDerWaalsContact C-N 3.3Å; A721-R723 PolarHBondContact O-N 3.29Å; R723-A725 VanDerWaalsContact C-N 3.34Å; R723-A725 PolarHBondContact O-N 3.45Å; R723-L726 PolarHBondContact O-N 2.93Å; R723-E727 IonicContact CZ-OE1 2.75Å; R723-E727 IonicContact NE-OE1 3.92Å; R723-E727 PolarHBondContact NE-OE1 2.86Å; R723-E727 IonicContact NH2-OE1 2.64Å; R723-E727 PolarHBondContact NH2-OE1 2.99Å; R723-E727 IonicContact NH2-OE2 2.68Å; R723-E727 WeakPolarHBondContact O-CG 3.4Å; R723-E727 PolarHBondContact O-N 3.49Å
724K87.5Confident85.3Confident117 Ų117100.5 Ų100.551%0.50950%0.503SS..Hα-helixtrans-59.9-43.1176.2-78.6162.7177.3139.40112D720 A721 L726 E727 E728D720-K724 WeakPolarHBondContact O-CD 3.35Å; D720-K724 VanDerWaalsContact O-CG 3.31Å; D720-K724 WeakPolarHBondContact O-CG 3.28Å; D720-K724 PolarHBondContact O-N 3.34Å; D720-K724 IonicContact OD2-NZ 3.83Å; D720-K724 PolarHBondContact OD2-NZ 3.35Å; A721-K724 PolarHBondContact O-N 3.47Å; K724-L726 VanDerWaalsContact C-N 3.33Å; K724-L726 PolarHBondContact O-N 3.38Å; K724-E727 PolarHBondContact O-N 3.07Å; K724-E728 WeakPolarHBondContact O-CB 3.48Å; K724-E728 PolarHBondContact O-N 3.24Å
725A85.5Confident85.1Confident57 Ų57100.7 Ų100.747%0.47151%0.505SS..Hα-helixtrans-61-40.8174.700000112.2A721 M722 R723 E728 H729A721-A725 PolarHBondContact O-N 3.43Å; M722-A725 PolarHBondContact O-N 2.91Å; R723-A725 VanDerWaalsContact C-N 3.34Å; R723-A725 PolarHBondContact O-N 3.45Å; A725-E728 PolarHBondContact O-N 3.47Å; A725-H729 WeakPolarHBondContact O-CB 3.34Å; A725-H729 PolarHBondContact O-N 3.19Å
726L83.1Confident84.8Confident98 Ų98101.2 Ų101.251%0.51351%0.508SS..Hα-helixtrans-67.5-41174.2-72.4168.5000112.6M722 R723 K724 E728 H729 V730M722-L726 HydrophobicContact CG-CD1 4.38Å; M722-L726 WeakPolarHBondContact O-CG 3.27Å; M722-L726 PolarHBondContact O-N 3.35Å; R723-L726 PolarHBondContact O-N 2.93Å; K724-L726 VanDerWaalsContact C-N 3.33Å; K724-L726 PolarHBondContact O-N 3.38Å; L726-E728 VanDerWaalsContact C-N 3.27Å; L726-E728 PolarHBondContact O-N 3.17Å; L726-H729 PolarHBondContact O-N 3.17Å; L726-V730 WeakPolarHBondContact O-CB 3.42Å; L726-V730 VanDerWaalsContact O-CG2 3.29Å; L726-V730 WeakPolarHBondContact O-CG2 3.5Å; L726-V730 PolarHBondContact O-N 2.72Å
727E85.9Confident84.5Confident79 Ų79102.3 Ų102.337%0.36951%0.507SS..Hα-helixtrans-61.2-35.5173.5-74.3178.6-170.700111.9R723 K724 K731R723-E727 IonicContact CZ-OE1 2.75Å; R723-E727 IonicContact NE-OE1 3.92Å; R723-E727 PolarHBondContact NE-OE1 2.86Å; R723-E727 IonicContact NH2-OE1 2.64Å; R723-E727 PolarHBondContact NH2-OE1 2.99Å; R723-E727 IonicContact NH2-OE2 2.68Å; R723-E727 WeakPolarHBondContact O-CG 3.4Å; R723-E727 PolarHBondContact O-N 3.49Å; K724-E727 PolarHBondContact O-N 3.07Å; E727-K731 WeakPolarHBondContact O-CG 3.48Å; E727-K731 PolarHBondContact O-N 2.91Å; E727-K731 VanDerWaalsContact O-N 3.13Å
728E83.4Confident84.1Confident127 Ų127101.7 Ų101.759%0.59350%0.503SS*.Hα-helixtrans-75.2-40.2176.3-170154.3-126.600112.6K724 A725 L726 V730 K731 Q732K724-E728 WeakPolarHBondContact O-CB 3.48Å; K724-E728 PolarHBondContact O-N 3.24Å; A725-E728 PolarHBondContact O-N 3.47Å; L726-E728 VanDerWaalsContact C-N 3.27Å; L726-E728 PolarHBondContact O-N 3.17Å; E728-V730 VanDerWaalsContact C-N 3.33Å; E728-V730 PolarHBondContact O-N 2.75Å; E728-K731 WeakPolarHBondContact O-CB 3.19Å; E728-K731 PolarHBondContact O-N 3.5Å; E728-Q732 PolarHBondContact O-N 3.09Å
729H83.7Confident83.6Confident116 Ų116101.6 Ų101.654%0.53750%0.504SS..Hα-helixtrans-63.7-37.4171.2-118.615.5000112.1A725 L726 Q732 L733A725-H729 WeakPolarHBondContact O-CB 3.34Å; A725-H729 PolarHBondContact O-N 3.19Å; L726-H729 PolarHBondContact O-N 3.17Å; H729-Q732 PolarHBondContact ND1-OE1 2.81Å; H729-Q732 PolarHBondContact O-N 2.72Å; H729-L733 WeakPolarHBondContact O-CB 3.38Å; H729-L733 WeakPolarHBondContact O-CG 3.23Å; H729-L733 PolarHBondContact O-N 3.43Å
730V83.4Confident83.2Confident75 Ų7599 Ų9946%0.45550%0.5SS..Hα-helixtrans-63.6-40173.1167.10000111.1L726 E728 L733 Q734L726-V730 WeakPolarHBondContact O-CB 3.42Å; L726-V730 VanDerWaalsContact O-CG2 3.29Å; L726-V730 WeakPolarHBondContact O-CG2 3.5Å; L726-V730 PolarHBondContact O-N 2.72Å; E728-V730 VanDerWaalsContact C-N 3.33Å; E728-V730 PolarHBondContact O-N 2.75Å; V730-L733 PolarHBondContact O-N 3.39Å; V730-Q734 HydrophobicContact CG1-CG 4.49Å; V730-Q734 WeakPolarHBondContact O-CB 3.39Å; V730-Q734 VanDerWaalsContact O-CG 3.26Å; V730-Q734 WeakPolarHBondContact O-CG 3.43Å; V730-Q734 PolarHBondContact O-N 3.37Å
731K86.1Confident82.8Confident129 Ų129102.1 Ų102.156%0.56151%0.513SS*.Hα-helixtrans-63.9-42.6172.6-72.4166.7-173.8165.40112.1E727 E728 Q734 M735E727-K731 WeakPolarHBondContact O-CG 3.48Å; E727-K731 PolarHBondContact O-N 2.91Å; E727-K731 VanDerWaalsContact O-N 3.13Å; E728-K731 WeakPolarHBondContact O-CB 3.19Å; E728-K731 PolarHBondContact O-N 3.5Å; K731-Q734 PolarHBondContact O-N 2.97Å; K731-M735 WeakPolarHBondContact O-CB 3.48Å; K731-M735 PolarHBondContact O-N 3.27Å
732Q84.2Confident82.2Confident98 Ų98101.6 Ų101.646%0.45851%0.509SS..Hα-helixtrans-60.7-45.2174.8-74.6178.5-23.800111.7E728 H729 M735 Q736E728-Q732 PolarHBondContact O-N 3.09Å; H729-Q732 PolarHBondContact ND1-OE1 2.81Å; H729-Q732 PolarHBondContact O-N 2.72Å; Q732-M735 PolarHBondContact O-N 3.11Å; Q732-Q736 WeakPolarHBondContact O-CB 3.45Å; Q732-Q736 WeakPolarHBondContact O-CG 3.32Å; Q732-Q736 PolarHBondContact O-N 3.35Å
733L79.6Confident81.6Confident93 Ų9398.2 Ų98.249%0.48750%0.502SS..Hα-helixtrans-65-39.5176.5-72.2168.8000112.1H729 V730 M735 Q736 I737H729-L733 WeakPolarHBondContact O-CB 3.38Å; H729-L733 WeakPolarHBondContact O-CG 3.23Å; H729-L733 PolarHBondContact O-N 3.43Å; V730-L733 PolarHBondContact O-N 3.39Å; L733-M735 VanDerWaalsContact C-N 3.34Å; L733-M735 PolarHBondContact O-N 2.87Å; L733-Q736 PolarHBondContact O-N 2.89Å; L733-I737 WeakPolarHBondContact O-CB 3.41Å; L733-I737 WeakPolarHBondContact O-CD1 3.43Å; L733-I737 VanDerWaalsContact O-CG1 3.23Å; L733-I737 WeakPolarHBondContact O-CG1 3.42Å; L733-I737 PolarHBondContact O-N 3.29Å
734Q82.7Confident80.7Confident109 Ų10995.5 Ų95.551%0.50951%0.506SS..Hα-helixtrans-61.8-40.9172.7-76.3172.5-8.700112V730 K731 I737 Q738V730-Q734 HydrophobicContact CG1-CG 4.49Å; V730-Q734 WeakPolarHBondContact O-CB 3.39Å; V730-Q734 VanDerWaalsContact O-CG 3.26Å; V730-Q734 WeakPolarHBondContact O-CG 3.43Å; V730-Q734 PolarHBondContact O-N 3.37Å; K731-Q734 PolarHBondContact O-N 2.97Å; Q734-I737 PolarHBondContact O-N 2.85Å; Q734-Q738 WeakPolarHBondContact O-CG 3.43Å; Q734-Q738 PolarHBondContact O-N 3.11Å
735M81.2Confident79.8Confident105 Ų10595.1 Ų95.152%0.51751%0.509SS..Hα-helixtrans-68.3-42.8176.6-160.8179.382.400111.6K731 Q732 L733 I737 Q738 E739K731-M735 WeakPolarHBondContact O-CB 3.48Å; K731-M735 PolarHBondContact O-N 3.27Å; Q732-M735 PolarHBondContact O-N 3.11Å; L733-M735 VanDerWaalsContact C-N 3.34Å; L733-M735 PolarHBondContact O-N 2.87Å; M735-I737 VanDerWaalsContact C-N 3.3Å; M735-I737 PolarHBondContact O-N 2.84Å; M735-Q738 PolarHBondContact O-N 3.1Å; M735-Q738 VanDerWaalsContact O-N 3.15Å; M735-E739 WeakPolarHBondContact O-CG 3.3Å; M735-E739 PolarHBondContact O-N 3.4Å
736Q80.6Confident79Confident113 Ų11398.2 Ų98.253%0.52852%0.516SS..Hα-helixtrans-62.3-35.4173.3-75.4-179.7-7.700112.6Q732 L733 A740Q732-Q736 WeakPolarHBondContact O-CB 3.45Å; Q732-Q736 WeakPolarHBondContact O-CG 3.32Å; Q732-Q736 PolarHBondContact O-N 3.35Å; L733-Q736 PolarHBondContact O-N 2.89Å; Q736-A740 WeakPolarHBondContact O-CB 3.5Å; Q736-A740 PolarHBondContact O-N 3.19Å
737I78.2Confident78.4Confident95 Ų9595.1 Ų95.149%0.48751%0.508SS..Hα-helixtrans-64.8-45.9172-72.8163.8000110.1L733 Q734 M735 E739 A740 E741L733-I737 WeakPolarHBondContact O-CB 3.41Å; L733-I737 WeakPolarHBondContact O-CD1 3.43Å; L733-I737 VanDerWaalsContact O-CG1 3.23Å; L733-I737 WeakPolarHBondContact O-CG1 3.42Å; L733-I737 PolarHBondContact O-N 3.29Å; Q734-I737 PolarHBondContact O-N 2.85Å; M735-I737 VanDerWaalsContact C-N 3.3Å; M735-I737 PolarHBondContact O-N 2.84Å; I737-E739 PolarHBondContact O-N 2.88Å; I737-A740 PolarHBondContact O-N 2.88Å; I737-E741 HydrophobicContact CG2-CG 4.27Å; I737-E741 WeakPolarHBondContact O-CB 3.44Å; I737-E741 VanDerWaalsContact O-CG 3.3Å; I737-E741 WeakPolarHBondContact O-CG 3.23Å; I737-E741 PolarHBondContact O-N 3.45Å
738Q79Confident77.7Confident130 Ų13092.6 Ų92.661%0.60750%0.503SS*.Hα-helixtrans-62.7-39.2176.5-71.4175.14.900112.6Q734 M735 A742Q734-Q738 WeakPolarHBondContact O-CG 3.43Å; Q734-Q738 PolarHBondContact O-N 3.11Å; M735-Q738 PolarHBondContact O-N 3.1Å; M735-Q738 VanDerWaalsContact O-N 3.15Å; Q738-A742 VanDerWaalsContact O-CB 3.28Å; Q738-A742 WeakPolarHBondContact O-CB 3.34Å; Q738-A742 PolarHBondContact O-N 3.05Å
739E79.2Confident77.2Confident113 Ų11393.3 Ų93.353%0.52850%0.504SS..Hα-helixtrans-65.9-42.7173.6-72.5178.3167.600111.8M735 I737 A742 A743M735-E739 WeakPolarHBondContact O-CG 3.3Å; M735-E739 PolarHBondContact O-N 3.4Å; I737-E739 PolarHBondContact O-N 2.88Å; E739-A742 PolarHBondContact O-N 3.2Å; E739-A743 VanDerWaalsContact O-CB 3.29Å; E739-A743 WeakPolarHBondContact O-CB 3.41Å; E739-A743 PolarHBondContact O-N 3.39Å
740A76.3Confident76.8Confident60 Ų6097.3 Ų97.350%0.49652%0.515SS..Hα-helixtrans-67.1-38.5176.300000112.3Q736 I737 A743 A744Q736-A740 WeakPolarHBondContact O-CB 3.5Å; Q736-A740 PolarHBondContact O-N 3.19Å; I737-A740 PolarHBondContact O-N 2.88Å; A740-A743 PolarHBondContact O-N 3.06Å; A740-A744 WeakPolarHBondContact O-CB 3.35Å; A740-A744 PolarHBondContact O-N 2.84Å
741E77.1Confident76.4Confident117 Ų11797.7 Ų97.755%0.54752%0.517SS..Hα-helixtrans-66.9-41.6173.5-75.9179.9163.500111.4I737 A744 L745I737-E741 HydrophobicContact CG2-CG 4.27Å; I737-E741 WeakPolarHBondContact O-CB 3.44Å; I737-E741 VanDerWaalsContact O-CG 3.3Å; I737-E741 WeakPolarHBondContact O-CG 3.23Å; I737-E741 PolarHBondContact O-N 3.45Å; E741-A744 CarbonylContact O-C 3.59Å; E741-A744 PolarHBondContact O-N 3.01Å; E741-L745 WeakPolarHBondContact O-CB 3.35Å; E741-L745 WeakPolarHBondContact O-CG 3.33Å; E741-L745 PolarHBondContact O-N 2.75Å
742A74.7Confident75.9Confident48 Ų4895.9 Ų95.940%0.39751%0.513SS..Hα-helixtrans-64.4-41.9173.900000111.9Q738 E739 L745 L746Q738-A742 VanDerWaalsContact O-CB 3.28Å; Q738-A742 WeakPolarHBondContact O-CB 3.34Å; Q738-A742 PolarHBondContact O-N 3.05Å; E739-A742 PolarHBondContact O-N 3.2Å; A742-L745 PolarHBondContact O-N 2.62Å; A742-L746 PolarHBondContact O-N 3.18Å
743A73.1Confident75.6Confident60 Ų6093.4 Ų93.450%0.49651%0.509SS..Hα-helixtrans-65.2-39.9173.500000111.9E739 A740 L746 G747E739-A743 VanDerWaalsContact O-CB 3.29Å; E739-A743 WeakPolarHBondContact O-CB 3.41Å; E739-A743 PolarHBondContact O-N 3.39Å; A740-A743 PolarHBondContact O-N 3.06Å; A743-L746 PolarHBondContact O-N 3.02Å; A743-G747 PolarHBondContact O-N 2.74Å
744A70.7Confident75.6Confident67 Ų6796.6 Ų96.655%0.55452%0.519SS*.Hα-helixtrans-67.9-33174.500000112.3A740 E741 G748A740-A744 WeakPolarHBondContact O-CB 3.35Å; A740-A744 PolarHBondContact O-N 2.84Å; E741-A744 CarbonylContact O-C 3.59Å; E741-A744 PolarHBondContact O-N 3.01Å; A744-G748 VanDerWaalsContact O-CA 3.3Å; A744-G748 WeakPolarHBondContact O-CA 3.38Å; A744-G748 PolarHBondContact O-N 3.19Å
745L69.2Low75.5Confident109 Ų10996 Ų9657%0.57152%0.519SS*.Hα-helixtrans-68.6-38.7171.4-87.9160.3000112.2E741 A742 K749E741-L745 WeakPolarHBondContact O-CB 3.35Å; E741-L745 WeakPolarHBondContact O-CG 3.33Å; E741-L745 PolarHBondContact O-N 2.75Å; A742-L745 PolarHBondContact O-N 2.62Å; L745-K749 WeakPolarHBondContact O-CB 3.43Å; L745-K749 VanDerWaalsContact O-CG 3.25Å; L745-K749 WeakPolarHBondContact O-CG 3.33Å; L745-K749 PolarHBondContact O-N 3.47Å
746L67.9Low75.5Confident121 Ų12195.4 Ų95.463%0.63452%0.515SS*.Hα-helixtrans-72.2-43.1175.3-79.9160.8000112.3A742 A743 R750A742-L746 PolarHBondContact O-N 3.18Å; A743-L746 PolarHBondContact O-N 3.02Å; L746-R750 PolarHBondContact O-N 3.24Å
747G70.8Confident75.4Confident33 Ų3393.1 Ų93.134%0.3451%0.509SS..Hα-helixtrans-62.7-46.517200000111.6A743 R750 V751A743-G747 PolarHBondContact O-N 2.74Å; G747-R750 CarbonylContact O-C 3.48Å; G747-R750 WeakPolarHBondContact O-CB 3.33Å; G747-R750 PolarHBondContact O-N 3.21Å; G747-R750 VanDerWaalsContact O-N 3.13Å; G747-V751 WeakPolarHBondContact O-CG2 3.24Å; G747-V751 PolarHBondContact O-N 3.23Å
748G71.6Confident75.6Confident26 Ų2696.5 Ų96.527%0.26852%0.515SS..Hα-helixtrans-57.2-48.9174.700000112A744 R750 V751 I752A744-G748 VanDerWaalsContact O-CA 3.3Å; A744-G748 WeakPolarHBondContact O-CA 3.38Å; A744-G748 PolarHBondContact O-N 3.19Å; G748-R750 VanDerWaalsContact C-N 3.32Å; G748-R750 PolarHBondContact O-N 2.94Å; G748-V751 PolarHBondContact O-N 3.29Å; G748-V751 VanDerWaalsContact O-N 3.15Å; G748-I752 WeakPolarHBondContact O-CB 3.39Å; G748-I752 VanDerWaalsContact O-CG1 3.24Å; G748-I752 WeakPolarHBondContact O-CG1 3.3Å; G748-I752 PolarHBondContact O-N 3.01Å
749K72.6Confident75.7Confident142 Ų14294.5 Ų94.562%0.61751%0.508SS*.Hα-helixtrans-59.8-38173.6-77.5172.5179.5177.70112.8L745 A753L745-K749 WeakPolarHBondContact O-CB 3.43Å; L745-K749 VanDerWaalsContact O-CG 3.25Å; L745-K749 WeakPolarHBondContact O-CG 3.33Å; L745-K749 PolarHBondContact O-N 3.47Å; K749-A753 VanDerWaalsContact O-CB 3.29Å; K749-A753 WeakPolarHBondContact O-CB 3.24Å; K749-A753 PolarHBondContact O-N 3.5Å
750R74.6Confident75.8Confident201 Ų20195 Ų9576%0.75851%0.505SS*.Hα-helixtrans-67.9-37.3173.4-85.6-179.3165.7176-2.7113.2L746 G747 G748 K754L746-R750 PolarHBondContact O-N 3.24Å; G747-R750 CarbonylContact O-C 3.48Å; G747-R750 WeakPolarHBondContact O-CB 3.33Å; G747-R750 PolarHBondContact O-N 3.21Å; G747-R750 VanDerWaalsContact O-N 3.13Å; G748-R750 VanDerWaalsContact C-N 3.32Å; G748-R750 PolarHBondContact O-N 2.94Å; R750-K754 WeakPolarHBondContact O-CG 3.36Å; R750-K754 PolarHBondContact O-N 3.26Å; R750-K754 VanDerWaalsContact O-N 3.14Å
751V75.6Confident76Confident83 Ų8396.4 Ų96.450%0.50350%0.504SS..Hα-helixtrans-71.9-43.8176.4171.40000110.5G747 G748 K754 L755G747-V751 WeakPolarHBondContact O-CG2 3.24Å; G747-V751 PolarHBondContact O-N 3.23Å; G748-V751 PolarHBondContact O-N 3.29Å; G748-V751 VanDerWaalsContact O-N 3.15Å; V751-K754 CarbonylContact O-C 3.53Å; V751-K754 WeakPolarHBondContact O-CB 3.48Å; V751-K754 PolarHBondContact O-N 3.4Å; V751-L755 HydrophobicContact CG1-CD1 3.87Å; V751-L755 HydrophobicContact CG1-CG 4.29Å; V751-L755 WeakPolarHBondContact O-CB 3.39Å; V751-L755 WeakPolarHBondContact O-CG 3.35Å; V751-L755 PolarHBondContact O-N 3.37Å
752I75.1Confident76.2Confident90 Ų9095.9 Ų95.946%0.46250%0.504SS..Hα-helixtrans-59.8-49.5174.2-69.3164.9000110.1G748 K754 L755 E756G748-I752 WeakPolarHBondContact O-CB 3.39Å; G748-I752 VanDerWaalsContact O-CG1 3.24Å; G748-I752 WeakPolarHBondContact O-CG1 3.3Å; G748-I752 PolarHBondContact O-N 3.01Å; I752-K754 VanDerWaalsContact C-N 3.27Å; I752-K754 PolarHBondContact O-N 3.47Å; I752-L755 CarbonylContact O-C 3.57Å; I752-L755 WeakPolarHBondContact O-CA 3.46Å; I752-L755 PolarHBondContact O-N 3.36Å; I752-E756 HydrophobicContact CG2-CG 4.19Å; I752-E756 WeakPolarHBondContact CG2-OE1 3.48Å; I752-E756 WeakPolarHBondContact O-CB 3.4Å; I752-E756 WeakPolarHBondContact O-CG 3.25Å; I752-E756 PolarHBondContact O-N 2.91Å
753A78.4Confident76.5Confident46 Ų4698.8 Ų98.838%0.3851%0.51SS..Hα-helixtrans-59.9-35.5176.600000113K749 T757K749-A753 VanDerWaalsContact O-CB 3.29Å; K749-A753 WeakPolarHBondContact O-CB 3.24Å; K749-A753 PolarHBondContact O-N 3.5Å; A753-T757 WeakPolarHBondContact O-CB 3.35Å; A753-T757 PolarHBondContact O-N 3.2Å; A753-T757 PolarHBondContact O-OG1 3.21Å
754K80Confident76.9Confident160 Ų160102.3 Ų102.370%0.69652%0.518SS*.Hα-helixtrans-67.9-40.6171-79.5-177.7175.4-174.50112.4R750 V751 I752 T757 R758R750-K754 WeakPolarHBondContact O-CG 3.36Å; R750-K754 PolarHBondContact O-N 3.26Å; R750-K754 VanDerWaalsContact O-N 3.14Å; V751-K754 CarbonylContact O-C 3.53Å; V751-K754 WeakPolarHBondContact O-CB 3.48Å; V751-K754 PolarHBondContact O-N 3.4Å; I752-K754 VanDerWaalsContact C-N 3.27Å; I752-K754 PolarHBondContact O-N 3.47Å; K754-T757 PolarHBondContact O-N 2.93Å; K754-R758 VanDerWaalsContact O-CB 3.24Å; K754-R758 WeakPolarHBondContact O-CB 3.36Å; K754-R758 PolarHBondContact O-N 3.26Å
755L80.8Confident77.3Confident98 Ų98101.6 Ų101.651%0.51351%0.511SS..Hα-helixtrans-69.8-39.9177.7-72.5172000111.9V751 I752 T757 R758 I759V751-L755 HydrophobicContact CG1-CD1 3.87Å; V751-L755 HydrophobicContact CG1-CG 4.29Å; V751-L755 WeakPolarHBondContact O-CB 3.39Å; V751-L755 WeakPolarHBondContact O-CG 3.35Å; V751-L755 PolarHBondContact O-N 3.37Å; I752-L755 CarbonylContact O-C 3.57Å; I752-L755 WeakPolarHBondContact O-CA 3.46Å; I752-L755 PolarHBondContact O-N 3.36Å; L755-T757 VanDerWaalsContact C-N 3.35Å; L755-R758 CarbonylContact O-C 3.56Å; L755-R758 WeakPolarHBondContact O-CB 3.23Å; L755-R758 PolarHBondContact O-N 3.06Å; L755-I759 WeakPolarHBondContact O-CB 3.36Å; L755-I759 WeakPolarHBondContact O-CD1 3.45Å; L755-I759 WeakPolarHBondContact O-CG1 3.43Å; L755-I759 PolarHBondContact O-N 3.48Å
756E79.7Confident77.7Confident91 Ų91101.8 Ų101.843%0.42551%0.512SS..Hα-helixtrans-61.7-42.1171.6-73.5177.8-16600111.8I752 I759 R760I752-E756 HydrophobicContact CG2-CG 4.19Å; I752-E756 WeakPolarHBondContact CG2-OE1 3.48Å; I752-E756 WeakPolarHBondContact O-CB 3.4Å; I752-E756 WeakPolarHBondContact O-CG 3.25Å; I752-E756 PolarHBondContact O-N 2.91Å; E756-I759 PolarHBondContact O-N 3.33Å; E756-R760 WeakPolarHBondContact O-CG 3.34Å; E756-R760 PolarHBondContact O-N 3.28Å; E756-R760 IonicContact OE2-NH2 3.78Å; E756-R760 PolarHBondContact OE2-NH2 3.5Å
757T79.8Confident78.2Confident66 Ų66101.7 Ų101.741%0.40551%0.513SS..Hα-helixtrans-65.7-45.3175.3-52.50000110A753 K754 L755 I759 R760 D761A753-T757 WeakPolarHBondContact O-CB 3.35Å; A753-T757 PolarHBondContact O-N 3.2Å; A753-T757 PolarHBondContact O-OG1 3.21Å; K754-T757 PolarHBondContact O-N 2.93Å; L755-T757 VanDerWaalsContact C-N 3.35Å; T757-I759 VanDerWaalsContact C-N 3.26Å; T757-I759 PolarHBondContact O-N 2.83Å; T757-R760 PolarHBondContact O-N 2.89Å; T757-R760 VanDerWaalsContact O-N 3.16Å; T757-D761 PolarHBondContact O-N 2.81Å
758R82.7Confident78.6Confident165 Ų165104.4 Ų104.462%0.62352%0.517SS*.Hα-helixtrans-60.1-34173.7-168.271.9166.4-144.3-3112.6K754 L755 L762K754-R758 VanDerWaalsContact O-CB 3.24Å; K754-R758 WeakPolarHBondContact O-CB 3.36Å; K754-R758 PolarHBondContact O-N 3.26Å; L755-R758 CarbonylContact O-C 3.56Å; L755-R758 WeakPolarHBondContact O-CB 3.23Å; L755-R758 PolarHBondContact O-N 3.06Å; R758-L762 HydrophobicContact CG-CD1 4.17Å; R758-L762 VanDerWaalsContact O-CB 3.27Å; R758-L762 WeakPolarHBondContact O-CB 3.25Å; R758-L762 WeakPolarHBondContact O-CD1 3.28Å; R758-L762 WeakPolarHBondContact O-CG 3.5Å; R758-L762 PolarHBondContact O-N 2.77Å
759I79.8Confident78.8Confident88 Ų88107.9 Ų107.945%0.45153%0.526SS..Hα-helixtrans-68.8-49.4174.5-76.5162.4000109.1L755 E756 T757 D761 L762 E763L755-I759 WeakPolarHBondContact O-CB 3.36Å; L755-I759 WeakPolarHBondContact O-CD1 3.45Å; L755-I759 WeakPolarHBondContact O-CG1 3.43Å; L755-I759 PolarHBondContact O-N 3.48Å; E756-I759 PolarHBondContact O-N 3.33Å; T757-I759 VanDerWaalsContact C-N 3.26Å; T757-I759 PolarHBondContact O-N 2.83Å; I759-D761 VanDerWaalsContact C-N 3.31Å; I759-D761 PolarHBondContact O-N 3.29Å; I759-L762 CarbonylContact O-C 3.57Å; I759-L762 PolarHBondContact O-N 3.02Å; I759-E763 HydrophobicContact CG2-CG 4.14Å; I759-E763 WeakPolarHBondContact O-CB 3.22Å; I759-E763 VanDerWaalsContact O-CG 3.26Å; I759-E763 WeakPolarHBondContact O-CG 3.32Å; I759-E763 PolarHBondContact O-N 2.62Å
760R81.2Confident79Confident124 Ų124103.5 Ų103.547%0.46851%0.511SS..Hα-helixtrans-59-40.3173.9-66.3179.5-151.11058.9112.4E756 T757 L762 E763 M764E756-R760 WeakPolarHBondContact O-CG 3.34Å; E756-R760 PolarHBondContact O-N 3.28Å; E756-R760 IonicContact OE2-NH2 3.78Å; E756-R760 PolarHBondContact OE2-NH2 3.5Å; T757-R760 PolarHBondContact O-N 2.89Å; T757-R760 VanDerWaalsContact O-N 3.16Å; R760-L762 VanDerWaalsContact C-N 3.34Å; R760-L762 PolarHBondContact O-N 3.4Å; R760-E763 PolarHBondContact O-N 3.1Å; R760-M764 WeakPolarHBondContact O-CB 3.46Å; R760-M764 VanDerWaalsContact O-CG 3.31Å; R760-M764 WeakPolarHBondContact O-CG 3.4Å; R760-M764 PolarHBondContact O-N 3.34Å
761D81.3Confident79.2Confident90 Ų90101.3 Ų101.348%0.48150%0.503SS..Hα-helixtrans-62.8-39.9174.8-63.5-29.9000111.5T757 I759 A765T757-D761 PolarHBondContact O-N 2.81Å; I759-D761 VanDerWaalsContact C-N 3.31Å; I759-D761 PolarHBondContact O-N 3.29Å; D761-A765 VanDerWaalsContact O-CB 3.24Å; D761-A765 WeakPolarHBondContact O-CB 3.39Å; D761-A765 PolarHBondContact O-N 2.82Å
762L81.3Confident79.3Confident105 Ų105103.2 Ų103.255%0.5550%0.501SS..Hα-helixtrans-76.3-32.4177.6-75168.8000113R758 I759 R760 A765 L766R758-L762 HydrophobicContact CG-CD1 4.17Å; R758-L762 VanDerWaalsContact O-CB 3.27Å; R758-L762 WeakPolarHBondContact O-CB 3.25Å; R758-L762 WeakPolarHBondContact O-CD1 3.28Å; R758-L762 WeakPolarHBondContact O-CG 3.5Å; R758-L762 PolarHBondContact O-N 2.77Å; I759-L762 CarbonylContact O-C 3.57Å; I759-L762 PolarHBondContact O-N 3.02Å; R760-L762 VanDerWaalsContact C-N 3.34Å; R760-L762 PolarHBondContact O-N 3.4Å; L762-A765 PolarHBondContact O-N 2.76Å; L762-L766 VanDerWaalsContact O-CB 3.22Å; L762-L766 WeakPolarHBondContact O-CB 3.48Å; L762-L766 PolarHBondContact O-N 2.97Å
763E80.2Confident79.4Confident109 Ų109103.9 Ų103.951%0.50950%0.502SS..Hα-helixtrans-68.3-45.8172.3-73.5170.2149.900109.9I759 R760 A765 L766 D767I759-E763 HydrophobicContact CG2-CG 4.14Å; I759-E763 WeakPolarHBondContact O-CB 3.22Å; I759-E763 VanDerWaalsContact O-CG 3.26Å; I759-E763 WeakPolarHBondContact O-CG 3.32Å; I759-E763 PolarHBondContact O-N 2.62Å; R760-E763 PolarHBondContact O-N 3.1Å; E763-A765 VanDerWaalsContact C-N 3.34Å; E763-A765 PolarHBondContact O-N 3.01Å; E763-L766 CarbonylContact O-C 3.6Å; E763-L766 PolarHBondContact O-N 3.27Å; E763-L766 VanDerWaalsContact O-N 3.16Å; E763-D767 PolarHBondContact O-N 3.06Å
764M81.9Confident79.3Confident135 Ų135108.1 Ų108.167%0.66551%0.512SS*.Hα-helixtrans-61.5-40.7170.9-75.7-179.159.400111.9R760 L766 D767 E768R760-M764 WeakPolarHBondContact O-CB 3.46Å; R760-M764 VanDerWaalsContact O-CG 3.31Å; R760-M764 WeakPolarHBondContact O-CG 3.4Å; R760-M764 PolarHBondContact O-N 3.34Å; M764-L766 VanDerWaalsContact C-N 3.32Å; M764-D767 PolarHBondContact O-N 3.31Å; M764-E768 VanDerWaalsContact O-CB 3.25Å; M764-E768 WeakPolarHBondContact O-CB 3.15Å; M764-E768 PolarHBondContact O-N 3.21Å
765A79Confident79.2Confident51 Ų51106.1 Ų106.142%0.42151%0.505SS..Hα-helixtrans-67-32.5174.200000112.4D761 L762 E763 E769D761-A765 VanDerWaalsContact O-CB 3.24Å; D761-A765 WeakPolarHBondContact O-CB 3.39Å; D761-A765 PolarHBondContact O-N 2.82Å; L762-A765 PolarHBondContact O-N 2.76Å; E763-A765 VanDerWaalsContact C-N 3.34Å; E763-A765 PolarHBondContact O-N 3.01Å; A765-E769 WeakPolarHBondContact O-CB 3.45Å; A765-E769 PolarHBondContact O-N 3.45Å
766L76.9Confident78.9Confident113 Ų113105.4 Ų105.459%0.59251%0.505SS*.Hα-helixtrans-74.6-36.1175.4-177.563.7000111.8L762 E763 M764 T770L762-L766 VanDerWaalsContact O-CB 3.22Å; L762-L766 WeakPolarHBondContact O-CB 3.48Å; L762-L766 PolarHBondContact O-N 2.97Å; E763-L766 CarbonylContact O-C 3.6Å; E763-L766 PolarHBondContact O-N 3.27Å; E763-L766 VanDerWaalsContact O-N 3.16Å; M764-L766 VanDerWaalsContact C-N 3.32Å; L766-T770 HydrophobicContact CD1-CG2 4.16Å; L766-T770 HydrophobicContact CG-CG2 4.46Å; L766-T770 VanDerWaalsContact O-CB 3.3Å; L766-T770 WeakPolarHBondContact O-CB 3.33Å; L766-T770 WeakPolarHBondContact O-CG2 3.41Å; L766-T770 PolarHBondContact O-N 3Å; L766-T770 PolarHBondContact O-OG1 3.39Å
767D78.3Confident78.7Confident119 Ų119104.9 Ų104.964%0.63650%0.502SS*.Hα-helixtrans-66.9-43.6170.8-98.5-11.3000111.1E763 M764 T770 R771E763-D767 PolarHBondContact O-N 3.06Å; M764-D767 PolarHBondContact O-N 3.31Å; D767-T770 PolarHBondContact O-OG1 3.36Å; D767-R771 WeakPolarHBondContact O-CB 3.44Å; D767-R771 PolarHBondContact O-N 2.73Å
768E79.5Confident78.8Confident91 Ų91105.7 Ų105.743%0.42550%0.504SS..Hα-helixtrans-64.4-41.1175-171.864.6-165.900111.5M764 R771 R772M764-E768 VanDerWaalsContact O-CB 3.25Å; M764-E768 WeakPolarHBondContact O-CB 3.15Å; M764-E768 PolarHBondContact O-N 3.21Å; E768-R771 WeakPolarHBondContact O-CB 3.41Å; E768-R771 PolarHBondContact O-N 3.2Å; E768-R772 WeakPolarHBondContact O-CB 3.4Å; E768-R772 VanDerWaalsContact O-CG 3.26Å; E768-R772 WeakPolarHBondContact O-CG 3.33Å; E768-R772 PolarHBondContact O-N 2.84Å; E768-R772 IonicContact OE1-NE 2.77Å
769E76Confident78.5Confident98 Ų98100.9 Ų100.946%0.45850%0.495SS..Hα-helixtrans-78.6-28.9179.3-159.661.5-150.100112.6A765 R772 H773A765-E769 WeakPolarHBondContact O-CB 3.45Å; A765-E769 PolarHBondContact O-N 3.45Å; E769-R772 CarbonylContact O-C 3.58Å; E769-R772 WeakPolarHBondContact OE2-CD 3.2Å; E769-R772 IonicContact OE2-CZ 3.72Å; E769-R772 IonicContact OE2-NE 2.68Å; E769-R772 IonicContact OE2-NH1 3.72Å; E769-R772 PolarHBondContact OE2-NH1 3.39Å; E769-H773 VanDerWaalsContact O-CB 3.28Å; E769-H773 WeakPolarHBondContact O-CB 3.43Å; E769-H773 PolarHBondContact O-N 3.13Å
770T76.2Confident78.2Confident51 Ų51101.6 Ų101.631%0.31350%0.499SS..Hα-helixtrans-75.8-26.1168.159.20000112.3L766 D767 H773 K774L766-T770 HydrophobicContact CD1-CG2 4.16Å; L766-T770 HydrophobicContact CG-CG2 4.46Å; L766-T770 VanDerWaalsContact O-CB 3.3Å; L766-T770 WeakPolarHBondContact O-CB 3.33Å; L766-T770 WeakPolarHBondContact O-CG2 3.41Å; L766-T770 PolarHBondContact O-N 3Å; L766-T770 PolarHBondContact O-OG1 3.39Å; D767-T770 PolarHBondContact O-OG1 3.36Å; T770-H773 PolarHBondContact O-N 3.3Å; T770-K774 WeakPolarHBondContact O-CG 3.47Å; T770-K774 PolarHBondContact O-N 3.38Å
771R79.4Confident77.9Confident155 Ų155102.4 Ų102.459%0.58550%0.502SS*.Hα-helixtrans-67.4-47.6167.3-173.2179.1-165.9147.93.9110.6D767 E768 H773 K774 E775D767-R771 WeakPolarHBondContact O-CB 3.44Å; D767-R771 PolarHBondContact O-N 2.73Å; E768-R771 WeakPolarHBondContact O-CB 3.41Å; E768-R771 PolarHBondContact O-N 3.2Å; R771-H773 VanDerWaalsContact C-N 3.29Å; R771-H773 PolarHBondContact O-N 3.44Å; R771-K774 CarbonylContact O-C 3.52Å; R771-K774 WeakPolarHBondContact O-CB 2.84Å; R771-K774 PolarHBondContact O-N 3.38Å; R771-K774 VanDerWaalsContact O-N 3.16Å; R771-E775 WeakPolarHBondContact O-CG 3.48Å; R771-E775 PolarHBondContact O-N 3Å
772R78.2Confident77.8Confident123 Ų123105.5 Ų105.546%0.46451%0.511SS..Hα-helixtrans-61.4-33.1169.2-70.5162.6178.6-1751.6112.8E768 E769 E775 T776E768-R772 WeakPolarHBondContact O-CB 3.4Å; E768-R772 VanDerWaalsContact O-CG 3.26Å; E768-R772 WeakPolarHBondContact O-CG 3.33Å; E768-R772 PolarHBondContact O-N 2.84Å; E768-R772 IonicContact OE1-NE 2.77Å; E769-R772 CarbonylContact O-C 3.58Å; E769-R772 WeakPolarHBondContact OE2-CD 3.2Å; E769-R772 IonicContact OE2-CZ 3.72Å; E769-R772 IonicContact OE2-NE 2.68Å; E769-R772 IonicContact OE2-NH1 3.72Å; E769-R772 PolarHBondContact OE2-NH1 3.39Å; R772-E775 PolarHBondContact O-N 2.93Å; R772-T776 WeakPolarHBondContact O-CB 3.46Å; R772-T776 WeakPolarHBondContact O-CG2 3.4Å; R772-T776 PolarHBondContact O-N 3.46Å; R772-T776 PolarHBondContact O-OG1 3.16Å
773H76.4Confident77.5Confident104 Ų104106.7 Ų106.748%0.48151%0.512SS..Hα-helixtrans-69.5-38.9173.6-165.372000111.5E769 T770 R771 T776 Q777E769-H773 VanDerWaalsContact O-CB 3.28Å; E769-H773 WeakPolarHBondContact O-CB 3.43Å; E769-H773 PolarHBondContact O-N 3.13Å; T770-H773 PolarHBondContact O-N 3.3Å; R771-H773 VanDerWaalsContact C-N 3.29Å; R771-H773 PolarHBondContact O-N 3.44Å; H773-T776 WeakPolarHBondContact CA-OG1 3.46Å; H773-T776 PolarHBondContact O-OG1 3.09Å; H773-Q777 PolarHBondContact CD2-NE2 3.22Å; H773-Q777 PolarHBondContact NE2-NE2 3.18Å; H773-Q777 VanDerWaalsContact O-CB 3.29Å; H773-Q777 WeakPolarHBondContact O-CB 3.34Å; H773-Q777 WeakPolarHBondContact O-CG 3.45Å; H773-Q777 PolarHBondContact O-N 3.28Å
774K78Confident77.1Confident134 Ų134106.3 Ų106.358%0.58351%0.51SS*.Hα-helixtrans-65.2-39.7170.3-74.9163.5-177.4161.30111.5T770 R771 N778T770-K774 WeakPolarHBondContact O-CG 3.47Å; T770-K774 PolarHBondContact O-N 3.38Å; R771-K774 CarbonylContact O-C 3.52Å; R771-K774 WeakPolarHBondContact O-CB 2.84Å; R771-K774 PolarHBondContact O-N 3.38Å; R771-K774 VanDerWaalsContact O-N 3.16Å; K774-N778 VanDerWaalsContact O-CB 3.23Å; K774-N778 WeakPolarHBondContact O-CB 3.39Å; K774-N778 PolarHBondContact O-N 3.35Å; K774-N778 PolarHBondContact O-ND2 2.77Å; K774-N778 VanDerWaalsContact O-ND2 3.07Å
775E77.4Confident76.8Confident119 Ų119108.3 Ų108.356%0.55651%0.511SS*.Hα-helixtrans-70.2-39.2177-74179.7-16700112.6R771 R772 N778 C779R771-E775 WeakPolarHBondContact O-CG 3.48Å; R771-E775 PolarHBondContact O-N 3Å; R772-E775 PolarHBondContact O-N 2.93Å; E775-N778 CarbonylContact O-C 3.52Å; E775-N778 PolarHBondContact O-N 3.28Å; E775-C779 VanDerWaalsContact O-CB 3.26Å; E775-C779 WeakPolarHBondContact O-CB 3.38Å; E775-C779 PolarHBondContact O-N 2.69Å
776T74.8Confident76.7Confident83 Ų83113.5 Ų113.551%0.50952%0.519SS..Hα-helixtrans-72.6-35.3173.250.20000112R772 H773 C779 L780R772-T776 WeakPolarHBondContact O-CB 3.46Å; R772-T776 WeakPolarHBondContact O-CG2 3.4Å; R772-T776 PolarHBondContact O-N 3.46Å; R772-T776 PolarHBondContact O-OG1 3.16Å; H773-T776 WeakPolarHBondContact CA-OG1 3.46Å; H773-T776 PolarHBondContact O-OG1 3.09Å; T776-C779 CarbonylContact O-C 3.49Å; T776-C779 PolarHBondContact O-N 3.08Å; T776-L780 VanDerWaalsContact O-CB 3.25Å; T776-L780 WeakPolarHBondContact O-CB 3.5Å; T776-L780 PolarHBondContact O-N 3.4Å
777Q75.2Confident76.5Confident80 Ų80111.9 Ų111.937%0.37451%0.514SS..Hα-helixtrans-65-37.7167.4-79.5-163.520.500112.2H773 L780 R781H773-Q777 PolarHBondContact CD2-NE2 3.22Å; H773-Q777 PolarHBondContact NE2-NE2 3.18Å; H773-Q777 VanDerWaalsContact O-CB 3.29Å; H773-Q777 WeakPolarHBondContact O-CB 3.34Å; H773-Q777 WeakPolarHBondContact O-CG 3.45Å; H773-Q777 PolarHBondContact O-N 3.28Å; Q777-L780 PolarHBondContact O-N 3.32Å; Q777-R781 WeakPolarHBondContact O-CB 3.48Å; Q777-R781 VanDerWaalsContact O-CG 3.29Å; Q777-R781 WeakPolarHBondContact O-CG 3.46Å; Q777-R781 PolarHBondContact O-N 3.43Å
778N80.7Confident76.3Confident83 Ų83113.4 Ų113.444%0.44452%0.515SS..Hα-helixtrans-70.7-33.4174.6-76.3-33.1000111.8K774 E775 K782K774-N778 VanDerWaalsContact O-CB 3.23Å; K774-N778 WeakPolarHBondContact O-CB 3.39Å; K774-N778 PolarHBondContact O-N 3.35Å; K774-N778 PolarHBondContact O-ND2 2.77Å; K774-N778 VanDerWaalsContact O-ND2 3.07Å; E775-N778 CarbonylContact O-C 3.52Å; E775-N778 PolarHBondContact O-N 3.28Å; N778-K782 WeakPolarHBondContact O-CB 3.3Å; N778-K782 VanDerWaalsContact O-CG 3.31Å; N778-K782 WeakPolarHBondContact O-CG 3.47Å; N778-K782 PolarHBondContact O-N 2.85Å
779C76.9Confident76.1Confident64 Ų64114.4 Ų114.443%0.43252%0.52SS..Hα-helixtrans-69.7-40.7171.3-165.40000110.9E775 T776 K782 K783E775-C779 VanDerWaalsContact O-CB 3.26Å; E775-C779 WeakPolarHBondContact O-CB 3.38Å; E775-C779 PolarHBondContact O-N 2.69Å; T776-C779 CarbonylContact O-C 3.49Å; T776-C779 PolarHBondContact O-N 3.08Å; C779-K782 CarbonylContact O-C 3.59Å; C779-K782 WeakPolarHBondContact O-CB 3.39Å; C779-K782 PolarHBondContact O-N 2.7Å; C779-K783 WeakPolarHBondContact O-CB 3.21Å; C779-K783 VanDerWaalsContact O-CG 3.24Å; C779-K783 WeakPolarHBondContact O-CG 3.26Å; C779-K783 PolarHBondContact O-N 3.03Å
780L72.7Confident75.8Confident102 Ų102114.6 Ų114.653%0.53452%0.522SS..Hα-helixtrans-59.8-51172.6-164.478.8000109.2T776 Q777 K782 K783 E784T776-L780 VanDerWaalsContact O-CB 3.25Å; T776-L780 WeakPolarHBondContact O-CB 3.5Å; T776-L780 PolarHBondContact O-N 3.4Å; Q777-L780 PolarHBondContact O-N 3.32Å; L780-K782 VanDerWaalsContact C-N 3.3Å; L780-K782 PolarHBondContact O-N 3Å; L780-K783 CarbonylContact O-C 3.5Å; L780-K783 WeakPolarHBondContact O-CA 3.46Å; L780-K783 WeakPolarHBondContact O-CB 3.48Å; L780-K783 PolarHBondContact O-N 3.49Å; L780-E784 HydrophobicContact CG-CG 4.39Å; L780-E784 WeakPolarHBondContact O-CB 3.45Å; L780-E784 WeakPolarHBondContact O-CG 3.42Å; L780-E784 PolarHBondContact O-N 3.46Å
781R76.5Confident75.5Confident141 Ų141116.9 Ų116.953%0.53253%0.529SS..Hα-helixtrans-59-35.1174-73.8170.3174.4178.6-1.4113.5Q777 E784 R785Q777-R781 WeakPolarHBondContact O-CB 3.48Å; Q777-R781 VanDerWaalsContact O-CG 3.29Å; Q777-R781 WeakPolarHBondContact O-CG 3.46Å; Q777-R781 PolarHBondContact O-N 3.43Å; R781-E784 WeakPolarHBondContact CA-OE2 3.36Å; R781-R785 WeakPolarHBondContact O-CB 3.36Å; R781-R785 VanDerWaalsContact O-CG 3.29Å; R781-R785 WeakPolarHBondContact O-CG 3.36Å; R781-R785 PolarHBondContact O-N 2.73Å
782K78.9Confident75.4Confident155 Ų155115.7 Ų115.767%0.67453%0.531SS*.Hα-helixtrans-68.5-36.5170.6-78.3174177.8179.20112.1N778 C779 L780 R786N778-K782 WeakPolarHBondContact O-CB 3.3Å; N778-K782 VanDerWaalsContact O-CG 3.31Å; N778-K782 WeakPolarHBondContact O-CG 3.47Å; N778-K782 PolarHBondContact O-N 2.85Å; C779-K782 CarbonylContact O-C 3.59Å; C779-K782 WeakPolarHBondContact O-CB 3.39Å; C779-K782 PolarHBondContact O-N 2.7Å; L780-K782 VanDerWaalsContact C-N 3.3Å; L780-K782 PolarHBondContact O-N 3Å; K782-R786 VanDerWaalsContact O-CB 3.3Å; K782-R786 WeakPolarHBondContact O-CB 3.44Å; K782-R786 PolarHBondContact O-N 3.12Å
783K75.4Confident75.4Confident130 Ų130113.1 Ų113.157%0.56553%0.53SS*.Hα-helixtrans-76.9-35177.3-70-76-175.4169.40112.1C779 L780 R786 V787C779-K783 WeakPolarHBondContact O-CB 3.21Å; C779-K783 VanDerWaalsContact O-CG 3.24Å; C779-K783 WeakPolarHBondContact O-CG 3.26Å; C779-K783 PolarHBondContact O-N 3.03Å; L780-K783 CarbonylContact O-C 3.5Å; L780-K783 WeakPolarHBondContact O-CA 3.46Å; L780-K783 WeakPolarHBondContact O-CB 3.48Å; L780-K783 PolarHBondContact O-N 3.49Å; K783-R786 CarbonylContact O-C 3.58Å; K783-R786 PolarHBondContact O-N 3.3Å; K783-V787 VanDerWaalsContact O-CB 3.29Å; K783-V787 WeakPolarHBondContact O-CB 3.43Å; K783-V787 WeakPolarHBondContact O-CG2 3.32Å; K783-V787 PolarHBondContact O-N 3.47Å
784E70.5Confident75.2Confident101 Ų101112 Ų11247%0.47253%0.53SS..Hα-helixtrans-66.6-42.3169.9-71.7175.4139.100110.7L780 R781 V787 K788L780-E784 HydrophobicContact CG-CG 4.39Å; L780-E784 WeakPolarHBondContact O-CB 3.45Å; L780-E784 WeakPolarHBondContact O-CG 3.42Å; L780-E784 PolarHBondContact O-N 3.46Å; R781-E784 WeakPolarHBondContact CA-OE2 3.36Å; E784-V787 PolarHBondContact O-N 2.97Å; E784-K788 WeakPolarHBondContact O-CB 3.42Å; E784-K788 WeakPolarHBondContact O-CG 3.16Å; E784-K788 PolarHBondContact O-N 3.45Å
785R75.9Confident75.1Confident178 Ų178109.2 Ų109.267%0.67252%0.521SS*.Hα-helixtrans-59.6-48.5168-79.8-178.7-175.6-170.71.2110.6R781 V787 K788 E789R781-R785 WeakPolarHBondContact O-CB 3.36Å; R781-R785 VanDerWaalsContact O-CG 3.29Å; R781-R785 WeakPolarHBondContact O-CG 3.36Å; R781-R785 PolarHBondContact O-N 2.73Å; R785-V787 VanDerWaalsContact C-N 3.29Å; R785-V787 PolarHBondContact O-N 2.88Å; R785-K788 CarbonylContact O-C 3.58Å; R785-K788 WeakPolarHBondContact O-CA 3.34Å; R785-K788 PolarHBondContact O-N 3.22Å; R785-E789 WeakPolarHBondContact O-CB 3.4Å; R785-E789 VanDerWaalsContact O-CG 3.27Å; R785-E789 WeakPolarHBondContact O-CG 3.27Å; R785-E789 PolarHBondContact O-N 3.37Å
786R76.3Confident75.1Confident159 Ų159109 Ų10960%0.652%0.52SS*.Hα-helixtrans-67.6-25.8178.2-167.3162.9175.5154.2-1114K782 K783 E789 M790K782-R786 VanDerWaalsContact O-CB 3.3Å; K782-R786 WeakPolarHBondContact O-CB 3.44Å; K782-R786 PolarHBondContact O-N 3.12Å; K783-R786 CarbonylContact O-C 3.58Å; K783-R786 PolarHBondContact O-N 3.3Å; R786-E789 WeakPolarHBondContact CA-OE2 3.31Å; R786-M790 VanDerWaalsContact O-CB 3.31Å; R786-M790 WeakPolarHBondContact O-CB 3.37Å; R786-M790 VanDerWaalsContact O-CG 3.23Å; R786-M790 WeakPolarHBondContact O-CG 3.4Å; R786-M790 PolarHBondContact O-N 2.66Å
787V73Confident74.9Confident80 Ų80111.5 Ų111.549%0.48553%0.526SS..Hα-helixtrans-76.3-34.8170.3163.70000110.2K783 E784 R785 M790 Q791K783-V787 VanDerWaalsContact O-CB 3.29Å; K783-V787 WeakPolarHBondContact O-CB 3.43Å; K783-V787 WeakPolarHBondContact O-CG2 3.32Å; K783-V787 PolarHBondContact O-N 3.47Å; E784-V787 PolarHBondContact O-N 2.97Å; R785-V787 VanDerWaalsContact C-N 3.29Å; R785-V787 PolarHBondContact O-N 2.88Å; V787-M790 HydrophobicContact CG2-CE 4.16Å; V787-M790 CarbonylContact O-C 3.58Å; V787-Q791 WeakPolarHBondContact O-CB 3.31Å; V787-Q791 PolarHBondContact O-N 2.88Å
788K74.6Confident75Confident151 Ų151112.9 Ų112.966%0.65753%0.532SS*.Hα-helixtrans-73-31.3170.1-74.9-177.1177.2-175.60113.1E784 R785 Q791 M792E784-K788 WeakPolarHBondContact O-CB 3.42Å; E784-K788 WeakPolarHBondContact O-CG 3.16Å; E784-K788 PolarHBondContact O-N 3.45Å; R785-K788 CarbonylContact O-C 3.58Å; R785-K788 WeakPolarHBondContact O-CA 3.34Å; R785-K788 PolarHBondContact O-N 3.22Å; K788-Q791 PolarHBondContact O-N 2.66Å; K788-M792 VanDerWaalsContact O-CB 3.28Å; K788-M792 WeakPolarHBondContact O-CB 3.35Å; K788-M792 VanDerWaalsContact O-CG 3.27Å; K788-M792 WeakPolarHBondContact O-CG 3.46Å; K788-M792 PolarHBondContact O-N 3.42Å
789E74.6Confident74.9Confident112 Ų112115.6 Ų115.652%0.52354%0.54SS..Hα-helixtrans-69.7-42.8170.4-70.5156.8-169.700109.9R785 R786 M792 T793R785-E789 WeakPolarHBondContact O-CB 3.4Å; R785-E789 VanDerWaalsContact O-CG 3.27Å; R785-E789 WeakPolarHBondContact O-CG 3.27Å; R785-E789 PolarHBondContact O-N 3.37Å; R786-E789 WeakPolarHBondContact CA-OE2 3.31Å; E789-M792 CarbonylContact O-C 3.58Å; E789-M792 PolarHBondContact O-N 3.2Å; E789-T793 PolarHBondContact O-N 3.5Å; E789-T793 PolarHBondContact O-OG1 3.31Å; E789-T793 VanDerWaalsContact O-OG1 3.07Å
790M71.2Confident74.9Confident101 Ų101117.1 Ų117.150%0.49854%0.544SS..Hα-helixtrans-68.9-31.5171.1-73.7-172.6-41.200112.8R786 V787 T793 V794R786-M790 VanDerWaalsContact O-CB 3.31Å; R786-M790 WeakPolarHBondContact O-CB 3.37Å; R786-M790 VanDerWaalsContact O-CG 3.23Å; R786-M790 WeakPolarHBondContact O-CG 3.4Å; R786-M790 PolarHBondContact O-N 2.66Å; V787-M790 HydrophobicContact CG2-CE 4.16Å; V787-M790 CarbonylContact O-C 3.58Å; M790-T793 WeakPolarHBondContact CA-OG1 3.45Å; M790-T793 PolarHBondContact O-OG1 2.67Å; M790-V794 VanDerWaalsContact O-CB 3.26Å; M790-V794 WeakPolarHBondContact O-CB 3.4Å; M790-V794 WeakPolarHBondContact O-CG2 3.36Å; M790-V794 PolarHBondContact O-N 2.78Å
791Q70Confident75.2Confident100 Ų100117.9 Ų117.947%0.46754%0.543SS..Hα-helixtrans-68.6-42.1171.7-167.168.755.500109.5V787 K788 V794 D795V787-Q791 WeakPolarHBondContact O-CB 3.31Å; V787-Q791 PolarHBondContact O-N 2.88Å; K788-Q791 PolarHBondContact O-N 2.66Å; Q791-V794 CarbonylContact O-C 3.53Å; Q791-V794 PolarHBondContact O-N 3.06Å; Q791-D795 PolarHBondContact NE2-OD1 3.11Å; Q791-D795 VanDerWaalsContact O-CB 3.31Å; Q791-D795 WeakPolarHBondContact O-CB 3.16Å; Q791-D795 PolarHBondContact O-N 3.38Å
792M77.1Confident75.1Confident129 Ų129115.3 Ų115.364%0.63554%0.539SS*.Hα-helixtrans-65.3-38.4173.6-80.1176.8155.800112.4K788 E789 D795 E796K788-M792 VanDerWaalsContact O-CB 3.28Å; K788-M792 WeakPolarHBondContact O-CB 3.35Å; K788-M792 VanDerWaalsContact O-CG 3.27Å; K788-M792 WeakPolarHBondContact O-CG 3.46Å; K788-M792 PolarHBondContact O-N 3.42Å; E789-M792 CarbonylContact O-C 3.58Å; E789-M792 PolarHBondContact O-N 3.2Å; M792-D795 PolarHBondContact O-N 3.49Å; M792-E796 VanDerWaalsContact O-CB 3.29Å; M792-E796 WeakPolarHBondContact O-CB 3.42Å; M792-E796 WeakPolarHBondContact O-CG 3.35Å; M792-E796 PolarHBondContact O-N 3.08Å
793T76.9Confident75.1Confident70 Ų70113.8 Ų113.843%0.42954%0.536SS..Hα-helixtrans-76.3-22.217247.50000113.3E789 M790 E797E789-T793 PolarHBondContact O-N 3.5Å; E789-T793 PolarHBondContact O-OG1 3.31Å; E789-T793 VanDerWaalsContact O-OG1 3.07Å; M790-T793 WeakPolarHBondContact CA-OG1 3.45Å; M790-T793 PolarHBondContact O-OG1 2.67Å; T793-E797 WeakPolarHBondContact O-CA 3.03Å; T793-E797 WeakPolarHBondContact O-CB 3.09Å; T793-E797 VanDerWaalsContact O-CG 3.25Å; T793-E797 WeakPolarHBondContact O-CG 3.49Å; T793-E797 PolarHBondContact O-N 2.63Å
794V73Confident74.8Confident79 Ų79109.9 Ų109.948%0.47953%0.528SS..Hα-helixtrans-74.6-34.1166.2164.40000111.1M790 Q791 H798M790-V794 VanDerWaalsContact O-CB 3.26Å; M790-V794 WeakPolarHBondContact O-CB 3.4Å; M790-V794 WeakPolarHBondContact O-CG2 3.36Å; M790-V794 PolarHBondContact O-N 2.78Å; Q791-V794 CarbonylContact O-C 3.53Å; Q791-V794 PolarHBondContact O-N 3.06Å; V794-H798 WeakPolarHBondContact O-CA 3.17Å; V794-H798 WeakPolarHBondContact O-CB 3.27Å; V794-H798 PolarHBondContact O-N 3.27Å
795D75.4Confident74.9Confident77 Ų77109.4 Ų109.441%0.41253%0.526SS..Hα-helixtrans-76.4-31.8175.7-64.2-17.2000110.9Q791 M792 K799Q791-D795 PolarHBondContact NE2-OD1 3.11Å; Q791-D795 VanDerWaalsContact O-CB 3.31Å; Q791-D795 WeakPolarHBondContact O-CB 3.16Å; Q791-D795 PolarHBondContact O-N 3.38Å; M792-D795 PolarHBondContact O-N 3.49Å; D795-K799 WeakPolarHBondContact O-CB 3.49Å; D795-K799 WeakPolarHBondContact O-CG 3.46Å; D795-K799 PolarHBondContact O-N 3.27Å
796E77Confident74.7Confident113 Ų113104.3 Ų104.353%0.52851%0.512SS..Hα-helixtrans-75.8-39.1168.7-75.2-173.9142.700111.8M792 H798 K799 N800M792-E796 VanDerWaalsContact O-CB 3.29Å; M792-E796 WeakPolarHBondContact O-CB 3.42Å; M792-E796 WeakPolarHBondContact O-CG 3.35Å; M792-E796 PolarHBondContact O-N 3.08Å; E796-H798 VanDerWaalsContact C-N 3.29Å; E796-H798 PolarHBondContact O-N 3.45Å; E796-K799 CarbonylContact O-C 3.41Å; E796-K799 PolarHBondContact O-N 3.22Å; E796-N800 WeakPolarHBondContact O-CB 3.41Å; E796-N800 PolarHBondContact O-N 3.2Å; E796-N800 PolarHBondContact O-ND2 3.2Å; E796-N800 VanDerWaalsContact O-ND2 3.12Å
797E72.1Confident74.4Confident137 Ų137100.3 Ų100.364%0.6451%0.505SS*.Hα-helixtrans-67.4-30.1169.3-80.4-174.9-176.500111.4T793 N800 F801T793-E797 WeakPolarHBondContact O-CA 3.03Å; T793-E797 WeakPolarHBondContact O-CB 3.09Å; T793-E797 VanDerWaalsContact O-CG 3.25Å; T793-E797 WeakPolarHBondContact O-CG 3.49Å; T793-E797 PolarHBondContact O-N 2.63Å; E797-N800 CarbonylContact O-C 3.47Å; E797-N800 PolarHBondContact O-N 2.8Å; E797-F801 WeakPolarHBondContact O-CA 3.23Å; E797-F801 WeakPolarHBondContact O-CB 3.37Å; E797-F801 PolarHBondContact O-N 3.33Å
798H76.3Confident74Confident108 Ų10898.9 Ų98.950%0.550%0.502SS..Hα-helixtrans-75.4-35.2172.8-170.759.8000111.6V794 E796 F801 I802V794-H798 WeakPolarHBondContact O-CA 3.17Å; V794-H798 WeakPolarHBondContact O-CB 3.27Å; V794-H798 PolarHBondContact O-N 3.27Å; E796-H798 VanDerWaalsContact C-N 3.29Å; E796-H798 PolarHBondContact O-N 3.45Å; H798-F801 PolarHBondContact O-N 3.29Å; H798-I802 WeakPolarHBondContact O-CB 3.22Å; H798-I802 VanDerWaalsContact O-CG1 3.29Å; H798-I802 WeakPolarHBondContact O-CG1 3.46Å; H798-I802 PolarHBondContact O-N 2.95Å
799K79Confident73.8Confident141 Ų14195.7 Ų95.761%0.61349%0.492SS*.Hα-helixtrans-65.8-41.7166.5-82.6175.3178.5172.10112.2D795 E796 F801 I802 M803D795-K799 WeakPolarHBondContact O-CB 3.49Å; D795-K799 WeakPolarHBondContact O-CG 3.46Å; D795-K799 PolarHBondContact O-N 3.27Å; E796-K799 CarbonylContact O-C 3.41Å; E796-K799 PolarHBondContact O-N 3.22Å; K799-F801 VanDerWaalsContact C-N 3.29Å; K799-I802 PolarHBondContact O-N 2.97Å; K799-M803 VanDerWaalsContact O-CB 3.31Å; K799-M803 WeakPolarHBondContact O-CB 3.32Å; K799-M803 VanDerWaalsContact O-CG 3.28Å; K799-M803 WeakPolarHBondContact O-CG 3.49Å; K799-M803 PolarHBondContact O-N 3.41Å
800N76.2Confident73.7Confident96 Ų9697.5 Ų97.551%0.51349%0.494SS..Hα-helixtrans-69.1-30.9176.1-69.7-28.2000110.6E796 E797 M803 A804E796-N800 WeakPolarHBondContact O-CB 3.41Å; E796-N800 PolarHBondContact O-N 3.2Å; E796-N800 PolarHBondContact O-ND2 3.2Å; E796-N800 VanDerWaalsContact O-ND2 3.12Å; E797-N800 CarbonylContact O-C 3.47Å; E797-N800 PolarHBondContact O-N 2.8Å; N800-M803 CarbonylContact O-C 3.45Å; N800-A804 WeakPolarHBondContact O-CA 3.46Å; N800-A804 WeakPolarHBondContact O-CB 3.48Å; N800-A804 PolarHBondContact O-N 3.04Å
801F78.5Confident73.5Confident118 Ų11897.9 Ų97.952%0.51850%0.497SS..Hα-helixtrans-72.7-42.9171.8179.3-91.5000111.1E797 H798 K799 M803 A804 Q805E797-F801 WeakPolarHBondContact O-CA 3.23Å; E797-F801 WeakPolarHBondContact O-CB 3.37Å; E797-F801 PolarHBondContact O-N 3.33Å; H798-F801 PolarHBondContact O-N 3.29Å; K799-F801 VanDerWaalsContact C-N 3.29Å; F801-M803 VanDerWaalsContact C-N 3.31Å; F801-M803 PolarHBondContact O-N 3.13Å; F801-A804 CarbonylContact O-C 3.57Å; F801-A804 WeakPolarHBondContact O-CB 3.47Å; F801-A804 PolarHBondContact O-N 3.39Å; F801-Q805 VanDerWaalsContact O-CB 3.23Å; F801-Q805 WeakPolarHBondContact O-CB 3.43Å; F801-Q805 PolarHBondContact O-N 3.45Å
802I75.9Confident73.2Confident87 Ų8795.2 Ų95.245%0.44649%0.493SS..Hα-helixtrans-62.9-39.8171.6-73.7169.3000109.9H798 K799 Q805 D806H798-I802 WeakPolarHBondContact O-CB 3.22Å; H798-I802 VanDerWaalsContact O-CG1 3.29Å; H798-I802 WeakPolarHBondContact O-CG1 3.46Å; H798-I802 PolarHBondContact O-N 2.95Å; K799-I802 PolarHBondContact O-N 2.97Å; I802-Q805 WeakPolarHBondContact O-CB 3.1Å; I802-Q805 PolarHBondContact O-N 2.8Å; I802-D806 VanDerWaalsContact O-CB 3.27Å; I802-D806 WeakPolarHBondContact O-CB 3.26Å; I802-D806 PolarHBondContact O-N 2.97Å
803M78.4Confident72.9Confident123 Ų12396 Ų9661%0.60649%0.494SS*.Hα-helixtrans-72-27.5173-73.3173.955.500113.1K799 N800 F801 T807K799-M803 VanDerWaalsContact O-CB 3.31Å; K799-M803 WeakPolarHBondContact O-CB 3.32Å; K799-M803 VanDerWaalsContact O-CG 3.28Å; K799-M803 WeakPolarHBondContact O-CG 3.49Å; K799-M803 PolarHBondContact O-N 3.41Å; N800-M803 CarbonylContact O-C 3.45Å; F801-M803 VanDerWaalsContact C-N 3.31Å; F801-M803 PolarHBondContact O-N 3.13Å; M803-T807 VanDerWaalsContact O-CB 3.32Å; M803-T807 WeakPolarHBondContact O-CB 3.2Å; M803-T807 VanDerWaalsContact O-CG2 3.3Å; M803-T807 WeakPolarHBondContact O-CG2 3.37Å; M803-T807 PolarHBondContact O-N 2.87Å; M803-T807 PolarHBondContact O-OG1 3.2Å
804A69.1Low72.5Confident48 Ų4899.2 Ų99.240%0.39750%0.503SS..Hα-helixtrans-73.5-35.617100000111.2N800 F801 T807 A808N800-A804 WeakPolarHBondContact O-CA 3.46Å; N800-A804 WeakPolarHBondContact O-CB 3.48Å; N800-A804 PolarHBondContact O-N 3.04Å; F801-A804 CarbonylContact O-C 3.57Å; F801-A804 WeakPolarHBondContact O-CB 3.47Å; F801-A804 PolarHBondContact O-N 3.39Å; A804-T807 VanDerWaalsContact CA-OG1 3.31Å; A804-T807 WeakPolarHBondContact CA-OG1 3.14Å; A804-T807 PolarHBondContact O-OG1 3.49Å; A804-A808 WeakPolarHBondContact O-CA 2.89Å; A804-A808 WeakPolarHBondContact O-CB 3.47Å; A804-A808 PolarHBondContact O-N 3.24Å
805Q73.1Confident72Confident91 Ų9199.5 Ų99.543%0.42550%0.501SS..Hα-helixtrans-67.6-49.4172-175.481.850.800109.2F801 I802 T807 A808 D809F801-Q805 VanDerWaalsContact O-CB 3.23Å; F801-Q805 WeakPolarHBondContact O-CB 3.43Å; F801-Q805 PolarHBondContact O-N 3.45Å; I802-Q805 WeakPolarHBondContact O-CB 3.1Å; I802-Q805 PolarHBondContact O-N 2.8Å; Q805-T807 VanDerWaalsContact C-N 3.32Å; Q805-T807 PolarHBondContact O-N 3.19Å; Q805-A808 CarbonylContact O-C 3.59Å; Q805-A808 WeakPolarHBondContact O-CA 3.27Å; Q805-A808 WeakPolarHBondContact O-CB 3.49Å; Q805-A808 PolarHBondContact O-N 3.13Å; Q805-D809 WeakPolarHBondContact O-CB 3.35Å; Q805-D809 PolarHBondContact O-N 3.32Å
806D72.3Confident71.5Confident70 Ų70100.9 Ų100.937%0.37451%0.508SS..Hα-helixtrans-64.9-34.8177.3-138.580.2000111.5I802 R810I802-D806 VanDerWaalsContact O-CB 3.27Å; I802-D806 WeakPolarHBondContact O-CB 3.26Å; I802-D806 PolarHBondContact O-N 2.97Å; D806-R810 WeakPolarHBondContact O-CB 3.37Å; D806-R810 VanDerWaalsContact O-CD 3.24Å; D806-R810 WeakPolarHBondContact O-CD 3.29Å; D806-R810 WeakPolarHBondContact O-CG 3.39Å; D806-R810 PolarHBondContact O-N 3Å; D806-R810 IonicContact OD2-CZ 3.03Å; D806-R810 IonicContact OD2-NE 2.74Å; D806-R810 PolarHBondContact OD2-NE 3.14Å; D806-R810 IonicContact OD2-NH2 2.63Å; D806-R810 PolarHBondContact OD2-NH2 3.1Å
807T68.8Low71.2Confident76 Ų7699.1 Ų99.147%0.46651%0.505SS..Hα-helixtrans-75.6-31.2169.651.60000112.8M803 A804 Q805 L811M803-T807 VanDerWaalsContact O-CB 3.32Å; M803-T807 WeakPolarHBondContact O-CB 3.2Å; M803-T807 VanDerWaalsContact O-CG2 3.3Å; M803-T807 WeakPolarHBondContact O-CG2 3.37Å; M803-T807 PolarHBondContact O-N 2.87Å; M803-T807 PolarHBondContact O-OG1 3.2Å; A804-T807 VanDerWaalsContact CA-OG1 3.31Å; A804-T807 WeakPolarHBondContact CA-OG1 3.14Å; A804-T807 PolarHBondContact O-OG1 3.49Å; Q805-T807 VanDerWaalsContact C-N 3.32Å; Q805-T807 PolarHBondContact O-N 3.19Å; T807-L811 WeakPolarHBondContact O-CA 3.36Å; T807-L811 WeakPolarHBondContact O-CB 3.48Å; T807-L811 WeakPolarHBondContact O-CD1 2.97Å; T807-L811 WeakPolarHBondContact O-CG 3.37Å; T807-L811 PolarHBondContact O-N 3.24Å
808A65.8Low70.5Confident49 Ų49100.4 Ų100.441%0.40551%0.505SS..Hα-helixtrans-68.6-38.3173.300000112A804 Q805 L811 A812A804-A808 WeakPolarHBondContact O-CA 2.89Å; A804-A808 WeakPolarHBondContact O-CB 3.47Å; A804-A808 PolarHBondContact O-N 3.24Å; Q805-A808 CarbonylContact O-C 3.59Å; Q805-A808 WeakPolarHBondContact O-CA 3.27Å; Q805-A808 WeakPolarHBondContact O-CB 3.49Å; Q805-A808 PolarHBondContact O-N 3.13Å; A808-L811 CarbonylContact O-C 3.51Å; A808-L811 PolarHBondContact O-N 2.93Å; A808-A812 WeakPolarHBondContact O-CB 3.26Å; A808-A812 PolarHBondContact O-N 3.07Å
809D69.9Low69.4Low85 Ų85101 Ų10146%0.45551%0.507SS..Hα-helixtrans-75.3-42.4177.2-69.4-32.9000110.7Q805 L811 A812 E813Q805-D809 WeakPolarHBondContact O-CB 3.35Å; Q805-D809 PolarHBondContact O-N 3.32Å; D809-L811 VanDerWaalsContact C-N 3.27Å; D809-L811 PolarHBondContact O-N 3.39Å; D809-A812 WeakPolarHBondContact O-CB 3.28Å; D809-A812 PolarHBondContact O-N 3.48Å; D809-A812 VanDerWaalsContact O-N 3.09Å; D809-E813 PolarHBondContact O-N 3.2Å
810R72.6Confident68.4Low150 Ų150104 Ų10457%0.56651%0.514SS*.Hα-helixtrans-64-30.9168.2-68.5166.9-163.9-153.86.1112.4D806 K814D806-R810 WeakPolarHBondContact O-CB 3.37Å; D806-R810 VanDerWaalsContact O-CD 3.24Å; D806-R810 WeakPolarHBondContact O-CD 3.29Å; D806-R810 WeakPolarHBondContact O-CG 3.39Å; D806-R810 PolarHBondContact O-N 3Å; D806-R810 IonicContact OD2-CZ 3.03Å; D806-R810 IonicContact OD2-NE 2.74Å; D806-R810 PolarHBondContact OD2-NE 3.14Å; D806-R810 IonicContact OD2-NH2 2.63Å; D806-R810 PolarHBondContact OD2-NH2 3.1Å; R810-K814 WeakPolarHBondContact O-CB 3.34Å; R810-K814 VanDerWaalsContact O-CG 3.24Å; R810-K814 WeakPolarHBondContact O-CG 3.39Å; R810-K814 PolarHBondContact O-N 3.15Å
811L65.4Low67.5Low108 Ų108105 Ų10557%0.56552%0.515SS*.Hα-helixtrans-74-32.9170.9-80.5166.5000110.9T807 A808 D809 K814 L815T807-L811 WeakPolarHBondContact O-CA 3.36Å; T807-L811 WeakPolarHBondContact O-CB 3.48Å; T807-L811 WeakPolarHBondContact O-CD1 2.97Å; T807-L811 WeakPolarHBondContact O-CG 3.37Å; T807-L811 PolarHBondContact O-N 3.24Å; A808-L811 CarbonylContact O-C 3.51Å; A808-L811 PolarHBondContact O-N 2.93Å; D809-L811 VanDerWaalsContact C-N 3.27Å; D809-L811 PolarHBondContact O-N 3.39Å; L811-K814 CarbonylContact O-C 3.59Å; L811-L815 WeakPolarHBondContact O-CA 3.09Å; L811-L815 WeakPolarHBondContact O-CB 2.96Å; L811-L815 PolarHBondContact O-N 3.49Å
812A64.7Low66.5Low45 Ų45103.8 Ų103.837%0.37251%0.514SS..Hα-helixtrans-69.4-45175.400000111.1A808 D809 L815 N816A808-A812 WeakPolarHBondContact O-CB 3.26Å; A808-A812 PolarHBondContact O-N 3.07Å; D809-A812 WeakPolarHBondContact O-CB 3.28Å; D809-A812 PolarHBondContact O-N 3.48Å; D809-A812 VanDerWaalsContact O-N 3.09Å; A812-L815 PolarHBondContact O-N 3.4Å; A812-N816 WeakPolarHBondContact O-CB 3.42Å; A812-N816 VanDerWaalsContact O-CG 3.26Å; A812-N816 PolarHBondContact O-N 3.09Å; A812-N816 PolarHBondContact O-ND2 3.41Å; A812-N816 VanDerWaalsContact O-ND2 3.17Å
813E69.7Low65.7Low144 Ų144104.8 Ų104.867%0.67352%0.52SS*.Hα-helixtrans-60.1-49.5169.9-75.9-161.7128.600111.3D809 L815 N816 V817D809-E813 PolarHBondContact O-N 3.2Å; E813-L815 VanDerWaalsContact C-N 3.26Å; E813-L815 PolarHBondContact O-N 3.07Å; E813-N816 PolarHBondContact O-N 3.26Å; E813-V817 WeakPolarHBondContact O-CG2 3.02Å; E813-V817 PolarHBondContact O-N 3.06Å
814K68.6Low64.7Low139 Ų139105.5 Ų105.560%0.60452%0.522SS*.Hα-helixtrans-65.7-25.7176.5-75.7-180177.2-177.80113.5R810 L811 Y818R810-K814 WeakPolarHBondContact O-CB 3.34Å; R810-K814 VanDerWaalsContact O-CG 3.24Å; R810-K814 WeakPolarHBondContact O-CG 3.39Å; R810-K814 PolarHBondContact O-N 3.15Å; L811-K814 CarbonylContact O-C 3.59Å; K814-Y818 VanDerWaalsContact O-CB 3.31Å; K814-Y818 WeakPolarHBondContact O-CB 3.08Å; K814-Y818 WeakPolarHBondContact O-CD2 3.03Å; K814-Y818 PolarHBondContact O-N 3.44Å
815L62.8Low64Low84 Ų84105.5 Ų105.544%0.4452%0.522SS..Hα-helixtrans-81-29.5175.7-173.2144.4000111.4L811 A812 E813 K819L811-L815 WeakPolarHBondContact O-CA 3.09Å; L811-L815 WeakPolarHBondContact O-CB 2.96Å; L811-L815 PolarHBondContact O-N 3.49Å; A812-L815 PolarHBondContact O-N 3.4Å; E813-L815 VanDerWaalsContact C-N 3.26Å; E813-L815 PolarHBondContact O-N 3.07Å; L815-K819 HydrophobicContact CD2-CD 3.96Å; L815-K819 WeakPolarHBondContact O-CB 3.38Å; L815-K819 VanDerWaalsContact O-CG 3.29Å; L815-K819 WeakPolarHBondContact O-CG 3.44Å; L815-K819 PolarHBondContact O-N 3.22Å
816N65.2Low63.3Low106 Ų106105.6 Ų105.657%0.56752%0.523SS*.Hα-helixtrans-69.8-36.3166.8-72.1-32.6000111.7A812 E813 R820A812-N816 WeakPolarHBondContact O-CB 3.42Å; A812-N816 VanDerWaalsContact O-CG 3.26Å; A812-N816 PolarHBondContact O-N 3.09Å; A812-N816 PolarHBondContact O-ND2 3.41Å; A812-N816 VanDerWaalsContact O-ND2 3.17Å; E813-N816 PolarHBondContact O-N 3.26Å; N816-R820 PolarHBondContact O-N 3.2Å
817V70.7Confident62.6Low77 Ų77106 Ų10647%0.46753%0.531SS..Hα-helixtrans-70.8-46.3171.3174.80000111.5E813 K819 R820 Q821E813-V817 WeakPolarHBondContact O-CG2 3.02Å; E813-V817 PolarHBondContact O-N 3.06Å; V817-K819 VanDerWaalsContact C-N 3.26Å; V817-K819 PolarHBondContact O-N 2.87Å; V817-R820 PolarHBondContact O-N 3.38Å; V817-Q821 HydrophobicContact CG1-CG 4.48Å; V817-Q821 PolarHBondContact O-N 3.15Å
818Y56.8Low62.1Low164 Ų164107.5 Ų107.564%0.64354%0.536SS*.Hα-helixtrans-53.5-45.2171.2-83.8-51.1000109.7K814 R820 Q821 L822K814-Y818 VanDerWaalsContact O-CB 3.31Å; K814-Y818 WeakPolarHBondContact O-CB 3.08Å; K814-Y818 WeakPolarHBondContact O-CD2 3.03Å; K814-Y818 PolarHBondContact O-N 3.44Å; Y818-R820 VanDerWaalsContact C-N 3.3Å; Y818-R820 PolarHBondContact O-N 3.12Å; Y818-Q821 PolarHBondContact O-N 2.99Å; Y818-L822 WeakPolarHBondContact O-CA 3.47Å; Y818-L822 WeakPolarHBondContact O-CB 3.31Å; Y818-L822 PolarHBondContact O-N 3.41Å
819K54Low61.5Low121 Ų121109.1 Ų109.153%0.52654%0.54SS..Hα-helixtrans-63.4-28.4178.3-81.1174.9176.6174.40114.3L815 V817 N823L815-K819 HydrophobicContact CD2-CD 3.96Å; L815-K819 WeakPolarHBondContact O-CB 3.38Å; L815-K819 VanDerWaalsContact O-CG 3.29Å; L815-K819 WeakPolarHBondContact O-CG 3.44Å; L815-K819 PolarHBondContact O-N 3.22Å; V817-K819 VanDerWaalsContact C-N 3.26Å; V817-K819 PolarHBondContact O-N 2.87Å; K819-N823 PolarHBondContact O-ND2 3.29Å
820R58Low61Low202 Ų202111 Ų11176%0.76255%0.548SS*.Hα-helixtrans-75-51.3170.3-86.6-175.4169.9154.4-1.1112N816 V817 Y818 L822 N823 E824N816-R820 PolarHBondContact O-N 3.2Å; V817-R820 PolarHBondContact O-N 3.38Å; Y818-R820 VanDerWaalsContact C-N 3.3Å; Y818-R820 PolarHBondContact O-N 3.12Å; R820-L822 VanDerWaalsContact C-N 3.32Å; R820-L822 PolarHBondContact O-N 3.45Å; R820-N823 PolarHBondContact O-N 3.02Å; R820-E824 PolarHBondContact O-N 3.05Å; R820-E824 VanDerWaalsContact O-N 3.14Å
821Q57.7Low60.4Low117 Ų117109.9 Ų109.955%0.54755%0.549SS..Hα-helixtrans-69.8-29-176.8-69-177.1-29.100113V817 Y818 A825V817-Q821 HydrophobicContact CG1-CG 4.48Å; V817-Q821 PolarHBondContact O-N 3.15Å; Y818-Q821 PolarHBondContact O-N 2.99Å; Q821-A825 WeakPolarHBondContact O-CB 3.29Å; Q821-A825 PolarHBondContact O-N 2.96Å
822L57.7Low59.9Low93 Ų93108.5 Ų108.549%0.48754%0.542SS..Hα-helixtrans-63.3-48171.1-17081.9000110.1Y818 R820 E824 A825 E826Y818-L822 WeakPolarHBondContact O-CA 3.47Å; Y818-L822 WeakPolarHBondContact O-CB 3.31Å; Y818-L822 PolarHBondContact O-N 3.41Å; R820-L822 VanDerWaalsContact C-N 3.32Å; R820-L822 PolarHBondContact O-N 3.45Å; L822-E824 PolarHBondContact O-N 2.99Å; L822-A825 PolarHBondContact O-N 3.31Å; L822-E826 HydrophobicContact CD1-CG 4.48Å; L822-E826 HydrophobicContact CG-CG 4.14Å; L822-E826 WeakPolarHBondContact O-CB 3.42Å; L822-E826 WeakPolarHBondContact O-CG 3.44Å; L822-E826 PolarHBondContact O-N 3.22Å
823N58.3Low59.6Low108 Ų108109.6 Ų109.658%0.57854%0.542SS*.Hα-helixtrans-62.5-42.2177.7-85.5-82.7000112.7K819 R820 S827K819-N823 PolarHBondContact O-ND2 3.29Å; R820-N823 PolarHBondContact O-N 3.02Å; N823-S827 WeakPolarHBondContact O-CB 3.42Å; N823-S827 PolarHBondContact O-N 3.02Å; N823-S827 VanDerWaalsContact O-N 3.08Å
824E56.9Low59Low138 Ų138109.5 Ų109.565%0.64554%0.542SS*.Hα-helixtrans-67.8-40.8176.8-69.3179.4154.100112R820 L822 S827 L828R820-E824 PolarHBondContact O-N 3.05Å; R820-E824 VanDerWaalsContact O-N 3.14Å; L822-E824 PolarHBondContact O-N 2.99Å; E824-S827 WeakPolarHBondContact O-CB 3.37Å; E824-L828 PolarHBondContact O-N 3.32Å
825A54.9Low58.5Low49 Ų49111.3 Ų111.341%0.40555%0.545SS..Hα-helixtrans-74-33.6177.400000113.1Q821 L822 L828 T829Q821-A825 WeakPolarHBondContact O-CB 3.29Å; Q821-A825 PolarHBondContact O-N 2.96Å; L822-A825 PolarHBondContact O-N 3.31Å; A825-L828 PolarHBondContact O-N 2.72Å; A825-T829 WeakPolarHBondContact O-CA 3.46Å; A825-T829 WeakPolarHBondContact O-CB 3.5Å; A825-T829 PolarHBondContact O-N 3.35Å; A825-T829 PolarHBondContact O-OG1 3.14Å
826E58Low58Low93 Ų93111.2 Ų111.244%0.43555%0.547SS..Hα-helixtrans-67-38.3173.5-77.6174.7150.700110.3L822 T829 M830L822-E826 HydrophobicContact CD1-CG 4.48Å; L822-E826 HydrophobicContact CG-CG 4.14Å; L822-E826 WeakPolarHBondContact O-CB 3.42Å; L822-E826 WeakPolarHBondContact O-CG 3.44Å; L822-E826 PolarHBondContact O-N 3.22Å; E826-T829 PolarHBondContact O-N 3.13Å; E826-M830 VanDerWaalsContact O-CB 3.3Å; E826-M830 WeakPolarHBondContact O-CB 3.46Å; E826-M830 VanDerWaalsContact O-CG 3.3Å; E826-M830 WeakPolarHBondContact O-CG 3.27Å; E826-M830 PolarHBondContact O-N 3.15Å
827S58Low57.5Low78 Ų78113.6 Ų113.655%0.54555%0.548SS..Hα-helixtrans-58.5-48.5171.5-167.90000112.2N823 E824 Q831N823-S827 WeakPolarHBondContact O-CB 3.42Å; N823-S827 PolarHBondContact O-N 3.02Å; N823-S827 VanDerWaalsContact O-N 3.08Å; E824-S827 WeakPolarHBondContact O-CB 3.37Å; S827-Q831 PolarHBondContact O-N 3.14Å
828L58.1Low56.7Low107 Ų107119.3 Ų119.356%0.5656%0.561SS**Hα-helixtrans-72.1-31.7177.9-102.1160.1000113.8E824 A825 N832E824-L828 PolarHBondContact O-N 3.32Å; A825-L828 PolarHBondContact O-N 2.72Å; L828-N832 PolarHBondContact O-N 2.77Å; L828-N832 PolarHBondContact O-ND2 3.09Å; L828-N832 VanDerWaalsContact O-ND2 3.16Å
829T52.7Low56.5Low83 Ų83119.2 Ų119.251%0.50956%0.561SS.*Hα-helixtrans-87.9-27-177-48.10000111.5A825 E826 Q831 N832 L833A825-T829 WeakPolarHBondContact O-CA 3.46Å; A825-T829 WeakPolarHBondContact O-CB 3.5Å; A825-T829 PolarHBondContact O-N 3.35Å; A825-T829 PolarHBondContact O-OG1 3.14Å; E826-T829 PolarHBondContact O-N 3.13Å; T829-Q831 VanDerWaalsContact C-N 3.31Å; T829-Q831 PolarHBondContact O-N 3.42Å; T829-N832 PolarHBondContact O-N 3.42Å; T829-L833 WeakPolarHBondContact O-CA 3.41Å; T829-L833 WeakPolarHBondContact O-CB 3.35Å; T829-L833 PolarHBondContact O-N 3.29Å
830M59.6Low56.5Low126 Ų126117.2 Ų117.262%0.62155%0.553SS**Hα-helixtrans-62.5-38.7165.7-76.3-168.495.500111.3E826 L833 Q834E826-M830 VanDerWaalsContact O-CB 3.3Å; E826-M830 WeakPolarHBondContact O-CB 3.46Å; E826-M830 VanDerWaalsContact O-CG 3.3Å; E826-M830 WeakPolarHBondContact O-CG 3.27Å; E826-M830 PolarHBondContact O-N 3.15Å; M830-L833 PolarHBondContact O-N 3.41Å; M830-Q834 WeakPolarHBondContact O-CG 3.32Å; M830-Q834 PolarHBondContact O-N 3.1Å
831Q60.3Low56.3Low125 Ų125114.1 Ų114.158%0.58455%0.547SS*.Hα-helixtrans-60.2-47.8172.1-72.8-174.8-3.800111.8S827 T829 Q834 R835S827-Q831 PolarHBondContact O-N 3.14Å; T829-Q831 VanDerWaalsContact C-N 3.31Å; T829-Q831 PolarHBondContact O-N 3.42Å; Q831-Q834 PolarHBondContact O-N 3.17Å; Q831-R835 WeakPolarHBondContact O-CB 3.38Å; Q831-R835 PolarHBondContact O-N 2.99Å; Q831-R835 VanDerWaalsContact O-N 3.15Å
832N56.2Low55.7Low79 Ų79115 Ų11542%0.42255%0.552SS.*Hα-helixtrans-71.4-31.4178.2-74.1-49.6000113.2L828 T829 R835 V836L828-N832 PolarHBondContact O-N 2.77Å; L828-N832 PolarHBondContact O-ND2 3.09Å; L828-N832 VanDerWaalsContact O-ND2 3.16Å; T829-N832 PolarHBondContact O-N 3.42Å; N832-R835 CarbonylContact O-C 3.56Å; N832-R835 PolarHBondContact O-N 3.22Å; N832-R835 VanDerWaalsContact O-N 3.15Å; N832-V836 WeakPolarHBondContact O-CB 3.5Å; N832-V836 WeakPolarHBondContact O-CG2 3.4Å; N832-V836 PolarHBondContact O-N 3.29Å
833L56.6Low55Low69 Ų69115.6 Ų115.636%0.36156%0.555SS.*Hα-helixtrans-68-38.1175.7-172.668.6000111.2T829 M830 R835 R837T829-L833 WeakPolarHBondContact O-CA 3.41Å; T829-L833 WeakPolarHBondContact O-CB 3.35Å; T829-L833 PolarHBondContact O-N 3.29Å; M830-L833 PolarHBondContact O-N 3.41Å; L833-R835 VanDerWaalsContact C-N 3.31Å; L833-R837 HydrophobicContact CD1-CG 4.29Å; L833-R837 HydrophobicContact CG-CG 4.45Å; L833-R837 WeakPolarHBondContact O-CB 3.47Å; L833-R837 WeakPolarHBondContact O-CG 3.45Å; L833-R837 PolarHBondContact O-N 3.38Å
834Q58.8Low54.5Low142 Ų142115.4 Ų115.466%0.66455%0.55SS**Hα-helixtrans-64.9-34.7169.3-75.2-177.1-1000112.3M830 Q831M830-Q834 WeakPolarHBondContact O-CG 3.32Å; M830-Q834 PolarHBondContact O-N 3.1Å; Q831-Q834 PolarHBondContact O-N 3.17Å
835R57.9Low54.1Low177 Ų177114.8 Ų114.867%0.66855%0.552SS**Hα-helixtrans-77.6-38.1-178.6-157172.4-175.9-178.80112.8Q831 N832 L833 Y839Q831-R835 WeakPolarHBondContact O-CB 3.38Å; Q831-R835 PolarHBondContact O-N 2.99Å; Q831-R835 VanDerWaalsContact O-N 3.15Å; N832-R835 CarbonylContact O-C 3.56Å; N832-R835 PolarHBondContact O-N 3.22Å; N832-R835 VanDerWaalsContact O-N 3.15Å; L833-R835 VanDerWaalsContact C-N 3.31Å; R835-Y839 WeakPolarHBondContact O-CD2 3.22Å
836V50.8Low53.6Low82 Ų82114.1 Ų114.150%0.49755%0.546SS..Hα-helixtrans-80.7-36.7177.6173.50000111.6N832 R838 Y839 Q840N832-V836 WeakPolarHBondContact O-CB 3.5Å; N832-V836 WeakPolarHBondContact O-CG2 3.4Å; N832-V836 PolarHBondContact O-N 3.29Å; V836-R838 PolarHBondContact O-N 3.38Å; V836-Y839 CarbonylContact O-C 3.58Å; V836-Y839 PolarHBondContact O-N 3.45Å; V836-Q840 HydrophobicContact CG1-CG 4.27Å; V836-Q840 PolarHBondContact O-N 2.81Å
837R55.1Low53Low156 Ų156115.4 Ų115.459%0.58955%0.552SS**Hα-helixtrans-62.8-23.1175.4-77.4177.7176.2-179.40.3114L833L833-R837 HydrophobicContact CD1-CG 4.29Å; L833-R837 HydrophobicContact CG-CG 4.45Å; L833-R837 WeakPolarHBondContact O-CB 3.47Å; L833-R837 WeakPolarHBondContact O-CG 3.45Å; L833-R837 PolarHBondContact O-N 3.38Å
838R53.6Low52.6Low197 Ų197113.4 Ų113.474%0.74354%0.544SS*.Hα-helixtrans-68.1-42.2168.4-77.1-174.8174.5-171.2-1.5112.2V836V836-R838 PolarHBondContact O-N 3.38Å
839Y52.9Low52.2Low162 Ų162117 Ų11764%0.63555%0.55SS*.Hα-helixtrans-82.2-18.8177.8-67.4-53.2000114.4R835 V836 E842 L843R835-Y839 WeakPolarHBondContact O-CD2 3.22Å; V836-Y839 CarbonylContact O-C 3.58Å; V836-Y839 PolarHBondContact O-N 3.45Å; Y839-E842 WeakPolarHBondContact CD1-OE2 3.49Å; Y839-L843 WeakPolarHBondContact O-CB 3.24Å; Y839-L843 PolarHBondContact O-N 3.2Å
840Q54.2Low51.8Low78 Ų78114.8 Ų114.836%0.36454%0.539SS..Hα-helixtrans-58.7-55.7168.9-84.6-167.9-108.600110.6V836 E842 L843 E844V836-Q840 HydrophobicContact CG1-CG 4.27Å; V836-Q840 PolarHBondContact O-N 2.81Å; Q840-E842 VanDerWaalsContact C-N 3.3Å; Q840-E842 PolarHBondContact O-N 3.14Å; Q840-L843 PolarHBondContact O-N 3.25Å; Q840-E844 WeakPolarHBondContact CB-OE1 3.39Å; Q840-E844 PolarHBondContact NE2-OE1 3.32Å; Q840-E844 WeakPolarHBondContact O-CB 3.47Å; Q840-E844 VanDerWaalsContact O-CG 3.23Å; Q840-E844 WeakPolarHBondContact O-CG 3.23Å; Q840-E844 PolarHBondContact O-N 3.33Å
841H53.3Low51.2Low137 Ų137116 Ų11663%0.63454%0.544SS*.Hα-helixtrans-65.5-34.6-174.1-135.235.5000112.3L843 E844 D845H841-L843 VanDerWaalsContact C-N 3.28Å; H841-L843 PolarHBondContact O-N 3.43Å; H841-E844 IonicContact ND1-OE2 3.7Å; H841-D845 PolarHBondContact O-N 3.49Å
842E44.9Very low50.7Low136 Ų136117.8 Ų117.864%0.63655%0.552SS**Hα-helixtrans-69.6-19.6175.1-68.3178.1172.600113.8Y839 Q840Y839-E842 WeakPolarHBondContact CD1-OE2 3.49Å; Q840-E842 VanDerWaalsContact C-N 3.3Å; Q840-E842 PolarHBondContact O-N 3.14Å
843L44.9Very low50.1Low105 Ų105116.3 Ų116.355%0.5555%0.551SS.*Hα-helixtrans-99.4-36.9177.4-162.777.5000112.8Y839 Q840 H841 D845 A846 E847Y839-L843 WeakPolarHBondContact O-CB 3.24Å; Y839-L843 PolarHBondContact O-N 3.2Å; Q840-L843 PolarHBondContact O-N 3.25Å; H841-L843 VanDerWaalsContact C-N 3.28Å; H841-L843 PolarHBondContact O-N 3.43Å; L843-D845 VanDerWaalsContact C-N 3.31Å; L843-D845 PolarHBondContact O-N 3.17Å; L843-A846 WeakPolarHBondContact O-CA 3.38Å; L843-A846 WeakPolarHBondContact O-CB 3.36Å; L843-A846 PolarHBondContact O-N 3.23Å; L843-E847 PolarHBondContact O-N 2.92Å
844E46.2Very low49.6Very low105 Ų105119.9 Ų119.949%0.49157%0.566SS.*Hα-helixtrans-60.9-40.3176.2-71.3158.6-174.800110.6Q840 H841 A846 G848Q840-E844 WeakPolarHBondContact CB-OE1 3.39Å; Q840-E844 PolarHBondContact NE2-OE1 3.32Å; Q840-E844 WeakPolarHBondContact O-CB 3.47Å; Q840-E844 VanDerWaalsContact O-CG 3.23Å; Q840-E844 WeakPolarHBondContact O-CG 3.23Å; Q840-E844 PolarHBondContact O-N 3.33Å; H841-E844 IonicContact ND1-OE2 3.7Å; E844-A846 VanDerWaalsContact C-N 3.32Å; E844-G848 PolarHBondContact O-N 3.03Å
845D50.1Low49.1Very low125 Ų125117.7 Ų117.767%0.66857%0.566SS**Hα-helixtrans-73.9-18.8170.9-113.412.6000113.5H841 L843 R849H841-D845 PolarHBondContact O-N 3.49Å; L843-D845 VanDerWaalsContact C-N 3.31Å; L843-D845 PolarHBondContact O-N 3.17Å; D845-R849 PolarHBondContact O-NE 3.26Å; D845-R849 VanDerWaalsContact O-NE 3.14Å; D845-R849 PolarHBondContact O-NH2 2.86Å
846A43.6Very low48.2Very low34 Ų34113.2 Ų113.228%0.28156%0.562SS.*Hα-helixtrans-78.9-51.5179.600000111.9L843 E844 R849L843-A846 WeakPolarHBondContact O-CA 3.38Å; L843-A846 WeakPolarHBondContact O-CB 3.36Å; L843-A846 PolarHBondContact O-N 3.23Å; E844-A846 VanDerWaalsContact C-N 3.32Å; A846-R849 PolarHBondContact O-NE 3.06Å
847E45.5Very low47.3Very low121 Ų121113.2 Ų113.257%0.56556%0.559SS**Hα-helixtrans-109.82.8-165.4-64.4-163.5149.100115.8L843 R849 A850 E851L843-E847 PolarHBondContact O-N 2.92Å; E847-R849 PolarHBondContact O-N 3.38Å; E847-R849 VanDerWaalsContact O-N 3.14Å; E847-A850 HydrophobicContact CB-CB 3.95Å; E847-A850 HydrophobicContact CG-CB 4.27Å; E847-A850 WeakPolarHBondContact O-CA 3.28Å; E847-A850 VanDerWaalsContact O-CB 3.31Å; E847-A850 WeakPolarHBondContact O-CB 3.36Å; E847-A850 PolarHBondContact O-N 3.49Å; E847-E851 PolarHBondContact O-N 3.49Å; E847-E851 VanDerWaalsContact O-N 3.08Å
848G50.5Low47.1Very low36 Ų36111.8 Ų111.837%0.37156%0.559SS.*Hα-helixtrans-56.8-20.5151.900000112.8E844E844-G848 PolarHBondContact O-N 3.03Å
849R49.3Very low46.7Very low182 Ų182109.9 Ų109.969%0.68756%0.562SS**Hα-helixtrans-79.9-16.7168.5-69.6172.5-87.5166.3-11.1113.9D845 A846 E847D845-R849 PolarHBondContact O-NE 3.26Å; D845-R849 VanDerWaalsContact O-NE 3.14Å; D845-R849 PolarHBondContact O-NH2 2.86Å; A846-R849 PolarHBondContact O-NE 3.06Å; E847-R849 PolarHBondContact O-N 3.38Å; E847-R849 VanDerWaalsContact O-N 3.14Å
850A44.5Very low45.8Very low36 Ų36108.6 Ų108.630%0.29857%0.565SS.*Hα-helixtrans-86.2-36.4173.400000111.6E847 Q852 A853 E854E847-A850 HydrophobicContact CB-CB 3.95Å; E847-A850 HydrophobicContact CG-CB 4.27Å; E847-A850 WeakPolarHBondContact O-CA 3.28Å; E847-A850 VanDerWaalsContact O-CB 3.31Å; E847-A850 WeakPolarHBondContact O-CB 3.36Å; E847-A850 PolarHBondContact O-N 3.49Å; A850-Q852 VanDerWaalsContact C-N 3.28Å; A850-Q852 PolarHBondContact O-N 3.29Å; A850-A853 WeakPolarHBondContact O-CA 3.43Å; A850-A853 WeakPolarHBondContact O-CB 3.38Å; A850-A853 PolarHBondContact O-N 3.27Å; A850-E854 PolarHBondContact O-N 3.21Å
851E46.8Very low44.8Very low152 Ų152112 Ų11271%0.7158%0.575SS**Hα-helixtrans-56-40.5174.9-66.3-172134.700112.3E847 A853 S855E847-E851 PolarHBondContact O-N 3.49Å; E847-E851 VanDerWaalsContact O-N 3.08Å; E851-A853 VanDerWaalsContact C-N 3.32Å; E851-A853 PolarHBondContact O-N 3.45Å; E851-S855 WeakPolarHBondContact O-CB 3.49Å; E851-S855 PolarHBondContact O-N 2.8Å
852Q48.7Very low44.2Very low162 Ų162108.9 Ų108.976%0.75757%0.573SS**Hα-helixtrans-72.5-19.7173.5-75.4-171.2-12.800114.2A850A850-Q852 VanDerWaalsContact C-N 3.28Å; A850-Q852 PolarHBondContact O-N 3.29Å
853A44.9Very low44Very low49 Ų49111 Ų11141%0.40558%0.58SS.*Hα-helixtrans-87.3-45.7-179.700000112.7A850 E851 S855 S856A850-A853 WeakPolarHBondContact O-CA 3.43Å; A850-A853 WeakPolarHBondContact O-CB 3.38Å; A850-A853 PolarHBondContact O-N 3.27Å; E851-A853 VanDerWaalsContact C-N 3.32Å; E851-A853 PolarHBondContact O-N 3.45Å; A853-S855 VanDerWaalsContact C-N 3.3Å; A853-S855 PolarHBondContact O-N 2.85Å; A853-S856 PolarHBondContact O-N 3.24Å; A853-S856 VanDerWaalsContact O-N 3.17Å
854E45Very low43.6Very low144 Ų144112.6 Ų112.667%0.67358%0.584SS**Hα-helixtrans-68.6-30.8179.7-66.4-135.1126.200112.5A850 S856 L857A850-E854 PolarHBondContact O-N 3.21Å; E854-S856 PolarHBondContact O-N 2.88Å; E854-L857 PolarHBondContact O-N 3.16Å
855S48.1Very low43Very low95 Ų95117.1 Ų117.166%0.66460%0.597SS**Hα-helixtrans-50.2-23.7169.8-1760000113.9E851 A853E851-S855 WeakPolarHBondContact O-CB 3.49Å; E851-S855 PolarHBondContact O-N 2.8Å; A853-S855 VanDerWaalsContact C-N 3.3Å; A853-S855 PolarHBondContact O-N 2.85Å
856S38.8Very low42.1Very low84 Ų84115.6 Ų115.659%0.58760%0.596SS**Hα-helixtrans-101.2-16178.6-62.40000115.2A853 E854A853-S856 PolarHBondContact O-N 3.24Å; A853-S856 VanDerWaalsContact O-N 3.17Å; E854-S856 PolarHBondContact O-N 2.88Å
857L33.5Very low41.5Very low82 Ų82118.7 Ų118.743%0.42962%0.616SS.*Hα-helixtrans-109.4-35-161.7-92.7165.9000115.9E854 R861E854-L857 PolarHBondContact O-N 3.16Å; L857-R861 WeakPolarHBondContact O-CD 3.2Å; L857-R861 WeakPolarHBondContact O-CG 3.38Å
858H50.2Low40.7Very low125 Ų125119.2 Ų119.258%0.57963%0.627SS**THydrogen-bonded Turntrans-86.8-8.5177.5-118.1-65.1000114.7I860 R861H858-I860 PolarHBondContact O-N 3.23Å; H858-I860 VanDerWaalsContact O-N 3.08Å; H858-R861 PolarHBondContact CE1-O 3.32Å; H858-R861 VanDerWaalsContact CE1-O 3.24Å; H858-R861 PolarHBondContact ND1-O 2.81Å; H858-R861 PolarHBondContact O-N 3.27Å
859L45.1Very low39.7Very low157 Ų157121.9 Ų121.982%0.82264%0.639SS**THydrogen-bonded Turntrans-52-28.4169.3-173.869000113.5
860I33.2Very low38.8Very low136 Ų136121.3 Ų121.370%0.69765%0.649SS**THydrogen-bonded Turntrans-105.4-28.9-178.5-68.2172.5000112.4H858H858-I860 PolarHBondContact O-N 3.23Å; H858-I860 VanDerWaalsContact O-N 3.08Å
861R34.9Very low38.1Very low149 Ų149123.3 Ų123.356%0.56267%0.673SS**  trans-99.8139.1-151.7-71.2-175.9178.1-171.21.3113.2L857 H858L857-R861 WeakPolarHBondContact O-CD 3.2Å; L857-R861 WeakPolarHBondContact O-CG 3.38Å; H858-R861 PolarHBondContact CE1-O 3.32Å; H858-R861 VanDerWaalsContact CE1-O 3.24Å; H858-R861 PolarHBondContact ND1-O 2.81Å; H858-R861 PolarHBondContact O-N 3.27Å
862A39.6Very low37.3Very low72 Ų72127.6 Ų127.660%0.59568%0.683SS**  trans41.378.6168.700000112.8
863K40.5Very low36.9Very low180 Ų180124.7 Ų124.778%0.78368%0.68SS**  37.3131.268.4-44.3176.5-179.81780111.2
864H37.8Very low36.4Very low139 Ų139130.9 Ų130.964%0.64470%0.703SS**  trans82.5108.9-172.8-64.3-142.8000110.2
865R32.5Very low36.1Very low200 Ų200127.9 Ų127.976%0.75570%0.698SS**  69.6131.873.4-73.1-177.8-102.3-148.5-6109.8
866S31.4Very low35.8Very low93 Ų93126.9 Ų126.965%0.6569%0.691SS**  cis177.3178.6-2.944.70000107.7
867S30.3Very low36.4Very low99 Ų99131.9 Ų131.969%0.69270%0.702SS**  trans75.6130.2157.784.90000114.9
868V29.7Very low37.1Very low132 Ų132137.8 Ų137.880%0.874%0.741SS**  87.1124.196.9161.20000111.2
869S29.3Very low36.4Very low91 Ų91138.4 Ų138.464%0.63675%0.749SS**  cis-166.1165.21.643.30000113.2
870L29.7Very low36Very low171 Ų171137.4 Ų137.490%0.89575%0.745SS**  trans21.6123149.3-73.175.5000117.2
871G30.1Very low36.1Very low77 Ų77137.5 Ų137.579%0.79475%0.748SS**  cis114.9174.23800000111.6
872R29.8Very low36.2Very low242 Ų242136.8 Ų136.891%0.91376%0.759SS**  trans8990.8164.9-156.4167.8-162.7-179.85.9120.4
873S40.1Very low36Very low102 Ų102140.9 Ų140.971%0.71377%0.769SS**  trans41.799.1138.866.30000120.9
874M34.7Very low35.7Very low179 Ų179138.3 Ų138.388%0.88277%0.768SS**  trans-170.1158.1155-102-54.3-14200106.2
875S39.2Very low35.5Very low80 Ų80138.2 Ų138.256%0.55978%0.777SS**  cis-157.4168.4-4.6-157.40000111.6
876S41Very low35.8Very low74 Ų74133.5 Ų133.552%0.51778%0.779SS.*  trans-9.9148.9148.860.60000120.8
877K52Low36.1Very low190 Ų190136.8 Ų136.883%0.82679%0.789SS**  179.5147.5104.8-88.8145.9-166.7173.70110.8
878V47.5Very low36.7Very low205 Ų205140.3 Ų140.3100%1.24280%0.798SS**  cis-96.90-5.1174.60000109.6

Retrieved 878 of 878 residues in 453.7 ms (Link to these results)