A0A096NG79_PAPAN Loading...

Neurofilament light polypeptide

Involved with LARP6 in the stabilization of type I collagen mRNAs for CO1A1 and CO1A2. Neurofilaments usually contain three intermediate filament proteins: NEFL, NEFM, and NEFH which are involved in the maintenance of neuronal caliber. May additionally cooperate with the neuronal intermediate filament proteins PRPH and INA to form neuronal filamentous networks. Vimentins are class-III intermediate filaments found in various non-epithelial cells, especially mesenchymal cells. Vimentin is attached to the nucleus, endoplasmic reticulum, and mitochondria, either laterally or terminally. Plays a role in cell directional movement, orientation, cell sheet organization and Golgi complex polarization at the cell migration front. Protects SCRIB from proteasomal degradation and facilitates its localization to intermediate filaments in a cell contact-mediated manner.

AlphaFold DB , UniProt , Accession A0A096NG79, Species PAPAN (Papio anubis, Olive baboon), Gene NEFL, Length 543 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
1M52.3Low44.8Very low244 Ų244162.6 Ų162.6100%1.20283%0.827SS**  0104.70-72.7174.170.100109
2S42.3Very low43.8Very low126 Ų126158.7 Ų158.788%0.88182%0.817SS**  trans-176.8109.6154.632.70000108.3
3S47.3Very low43.1Very low110 Ų110154.3 Ų154.377%0.76981%0.809SS**  trans-78.9137.5174.149.50000110.5
4F51.1Low42.6Very low209 Ų209158.9 Ų158.992%0.91781%0.812SS**  trans-141.4115.5148-109.3-77.7000111.1
5S45.4Very low42.1Very low108 Ų108161.1 Ų161.176%0.75581%0.814SS**  trans-84.9129.617349.60000110.4
6Y41.2Very low41.8Very low214 Ų214163.9 Ų163.984%0.83981%0.812SS**  trans-153.2122.5148.7-156-106.7000111.5P8Y6-P8 HydrophobicContact CD1-CG 4.29Å; Y6-P8 HydrophobicContact CE1-CB 4.3Å; Y6-P8 HydrophobicContact CE1-CG 4.14Å
7E46.5Very low41.3Very low156 Ų156167.5 Ų167.573%0.72981%0.814SS**  trans-108.8137.9169.8178.8-167.2-120.800107.6
8P52.7Low40.9Very low87 Ų87168.4 Ų168.457%0.56581%0.809SS**  trans-132.5107.9149.732.5-17.7000112.3Y6Y6-P8 HydrophobicContact CD1-CG 4.29Å; Y6-P8 HydrophobicContact CE1-CB 4.3Å; Y6-P8 HydrophobicContact CE1-CG 4.14Å
9Y38.6Very low40.5Very low202 Ų202166.7 Ų166.779%0.79281%0.809SS**  trans17.4108.2142.6-77.1-99.7000117.9
10Y40.8Very low40.1Very low222 Ų222166.2 Ų166.287%0.87181%0.805SS**  trans-120.2134.1145.7-87.3-83.6000110.6T12Y10-T12 PolarHBondContact O-N 3.23Å
11S35Very low39.9Very low111 Ų111164 Ų16478%0.77680%0.802SS**  trans-81.5103.9-167.6-172.20000112.5S13S11-S13 PolarHBondContact O-N 3.05Å; S11-S13 VanDerWaalsContact O-N 3.11Å
12T32.8Very low39.6Very low115 Ų115157.4 Ų157.471%0.70678%0.777SS**  trans-76.296.7174.3-59.50000111.1Y10 Y14Y10-T12 PolarHBondContact O-N 3.23Å; T12-Y14 HydrophobicContact CG2-CD2 3.79Å; T12-Y14 HydrophobicContact CG2-CE2 3.78Å; T12-Y14 PolarHBondContact O-N 3.04Å; T12-Y14 VanDerWaalsContact O-N 3.15Å
13S34.5Very low39.3Very low102 Ų102163.3 Ų163.371%0.71378%0.78SS**  trans-77.992.1172.7-660000111.4S11 K15S11-S13 PolarHBondContact O-N 3.05Å; S11-S13 VanDerWaalsContact O-N 3.11Å; S13-K15 VanDerWaalsContact C-N 3.32Å; S13-K15 PolarHBondContact O-N 3.47Å
14Y36.1Very low38.9Very low218 Ų218164.1 Ų164.186%0.85578%0.781SS**  trans-65.883.4171.7-92.7-85.1000112.1T12 R16T12-Y14 HydrophobicContact CG2-CD2 3.79Å; T12-Y14 HydrophobicContact CG2-CE2 3.78Å; T12-Y14 PolarHBondContact O-N 3.04Å; T12-Y14 VanDerWaalsContact O-N 3.15Å; Y14-R16 PolarHBondContact O-N 2.97Å; Y14-R16 VanDerWaalsContact O-N 3.14Å
15K35.5Very low38.1Very low193 Ų193163.2 Ų163.284%0.83978%0.779SS**  trans-81.483164-94.5-170175.3-179.50110.6S13 R17S13-K15 VanDerWaalsContact C-N 3.32Å; S13-K15 PolarHBondContact O-N 3.47Å; K15-R17 PolarHBondContact O-N 3.31Å
16R36.4Very low37.7Very low206 Ų206165.7 Ų165.778%0.77778%0.782SS**  trans-60.296.8165.7-179.1-169.5-80.4-1441.9109.5Y14 Y18Y14-R16 PolarHBondContact O-N 2.97Å; Y14-R16 VanDerWaalsContact O-N 3.14Å; R16-Y18 HydrophobicContact CG-CD2 3.97Å; R16-Y18 HydrophobicContact CG-CE2 4.09Å; R16-Y18 PolarHBondContact O-N 3Å
17R33.1Very low37.4Very low225 Ų225161 Ų16185%0.84978%0.78SS**  trans-82.5101.7166.9-69-163.9-155.6-174.69.3109.1K15K15-R17 PolarHBondContact O-N 3.31Å
18Y35.2Very low36.5Very low184 Ų184159.2 Ų159.272%0.72279%0.785SS**  trans-72.5130.7147.2-87.9-107.1000107.1R16R16-Y18 HydrophobicContact CG-CD2 3.97Å; R16-Y18 HydrophobicContact CG-CE2 4.09Å; R16-Y18 PolarHBondContact O-N 3Å
19V32.3Very low35.8Very low135 Ų135161.3 Ų161.382%0.81880%0.796SS**  trans-103.2114164.4176.80000105.9
20E32.1Very low35.6Very low156 Ų156163.1 Ų163.173%0.72980%0.802SS**  trans-128.4153-179.5-163.1-175.7166.900108.7
21T37.2Very low35.1Very low121 Ų121157.8 Ų157.874%0.74280%0.797SS**  trans76.6157.7172.280.50000116.3
22P45.4Very low35Very low105 Ų105155.3 Ų155.368%0.68279%0.788SS**  cis-126.1143.6336.5-20.2000116
23R35.8Very low35.3Very low250 Ų250161.2 Ų161.294%0.94380%0.799SS**PPolyproline II helixtrans-79.1117.7158-115.4-179.4178.4168.30.1108.5
24V39.3Very low35.4Very low128 Ų128162.1 Ų162.178%0.77681%0.806SS**PPolyproline II helixtrans-82.3131.7174.9-93.40000111.3
25H34.6Very low35.4Very low190 Ų190158 Ų15888%0.8880%0.804SS**PPolyproline II helixtrans-82.5129.8166.3-70.4-93.4000109.6
26I36Very low35.4Very low159 Ų159153.6 Ų153.682%0.81580%0.803SS**  trans-124125.4161.5-61.3179.8000107.9
27S34.7Very low35.4Very low115 Ų115155.3 Ų155.380%0.80481%0.81SS**  trans-91.6137.8172.1450000110.1
28S29.5Very low35.4Very low120 Ų120150.1 Ų150.184%0.83981%0.808SS**  trans-153.8147.2147.6-164.70000111.9
29V37.6Very low35.5Very low131 Ų131145.7 Ų145.779%0.79481%0.81SS**  trans-96138.8-176.4-78.10000111
30R33.5Very low35.6Very low240 Ų240150 Ų15091%0.90681%0.812SS**  -169.2142.9122.5-118.2175.2177.5-113.9-0.4114.9
31S30.3Very low35.6Very low110 Ų110147.4 Ų147.477%0.76981%0.812SS**  trans-12.5140.6149.9-1640000116.7
32G33.6Very low35.6Very low58 Ų58146.7 Ų146.760%0.59881%0.812SS**  cis134.2127.6300000111.3
33Y38.3Very low35.3Very low239 Ų239151.7 Ų151.794%0.93782%0.819SS**  trans-141.7129.2167.9-94-79.6000110.5
34S36.8Very low35.4Very low122 Ų122145.8 Ų145.885%0.85382%0.815SS**  trans-74.7130.9177.4-61.60000111.5
35T36.8Very low35.5Very low132 Ų132143.7 Ų143.781%0.8181%0.811SS**  trans-132.1100.8153.4-630000108.4R37T35-R37 PolarHBondContact O-N 3.39Å
36A35.2Very low36Very low100 Ų100140.1 Ų140.183%0.82681%0.805SS**  trans-70.1114.4175.800000109.9S38A36-S38 PolarHBondContact O-N 3.35Å
37R35.6Very low36.3Very low242 Ų242139.4 Ų139.491%0.91381%0.808SS**  trans-75.3114.2165.6-82.3-175.7162.2-148.4-3.2109T35 A39T35-R37 PolarHBondContact O-N 3.39Å; R37-A39 PolarHBondContact O-N 2.82Å
38S33.5Very low36.4Very low115 Ų115139.3 Ų139.380%0.80481%0.808SS**  trans-73.9112.4170.1-171.60000109.6A36A36-S38 PolarHBondContact O-N 3.35Å
39A38.3Very low36.9Very low92 Ų92138.8 Ų138.876%0.7680%0.804SS**  trans-89.2109.9171.400000109.2R37 S41R37-A39 PolarHBondContact O-N 2.82Å; A39-S41 PolarHBondContact O-N 2.78Å; A39-S41 VanDerWaalsContact O-N 3.11Å
40Y34.2Very low37Very low224 Ų224138.1 Ų138.188%0.87881%0.805SS**  trans-77.496.3176.3-145.1-93.8000109.2
41S32.4Very low37.3Very low103 Ų103134 Ų13472%0.7280%0.8SS**  trans-98.5107.5174.4-172.20000109.8A39 Y43A39-S41 PolarHBondContact O-N 2.78Å; A39-S41 VanDerWaalsContact O-N 3.11Å; S41-Y43 PolarHBondContact O-N 2.92Å
42S35.8Very low37.7Very low106 Ų106134.7 Ų134.774%0.74181%0.805SS**  trans-79.398.517953.70000110.9
43Y39.1Very low38Very low210 Ų210137.3 Ų137.382%0.82481%0.809SS**PPolyproline II helixtrans-87.8122.3167.264.3-86.4000110.2S41S41-Y43 PolarHBondContact O-N 2.92Å
44S38.8Very low38Very low125 Ų125137.3 Ų137.387%0.87481%0.807SS**PPolyproline II helixtrans-74.6127.2173.8-56.40000110.4
45A40.1Very low37.9Very low84 Ų84142.4 Ų142.469%0.69481%0.808SS**PPolyproline II helixtrans-87147.7172.100000111.3
46P45.2Very low37.8Very low116 Ų116141.8 Ų141.875%0.75381%0.809SS**PPolyproline II helixtrans-81.9147.6-168.132-35.9000114.2S48P46-S48 PolarHBondContact O-N 3.18Å
47V42.2Very low38Very low143 Ų143147.4 Ų147.487%0.86781%0.81SS**PPolyproline II helixtrans-66.5118.3172.8-177.30000109.9
48S37.5Very low37.9Very low114 Ų114141 Ų14180%0.79780%0.802SS**  trans-91.5108172.3-70.20000110.4P46 S50P46-S48 PolarHBondContact O-N 3.18Å; S48-S50 PolarHBondContact O-N 2.88Å
49S39.6Very low38Very low109 Ų109141.2 Ų141.276%0.76280%0.804SS**  trans-74.9110.4175.3420000111.6
50S40.9Very low38Very low116 Ų116142.1 Ų142.181%0.81180%0.804SS**  trans-89.2128.9169.856.10000111S48 S52S48-S50 PolarHBondContact O-N 2.88Å; S50-S52 PolarHBondContact O-N 3.32Å
51L39.1Very low38.3Very low155 Ų155136.8 Ų136.881%0.81280%0.8SS**  trans-79.3116.5-168.7-64.7157.8000111.9V53L51-V53 PolarHBondContact O-N 2.77Å
52S38.4Very low38.6Very low123 Ų123135.6 Ų135.686%0.8680%0.804SS**  trans-72.485.1171-63.40000111.7S50 R54S50-S52 PolarHBondContact O-N 3.32Å; S52-R54 PolarHBondContact O-N 3.4Å; S52-R54 VanDerWaalsContact O-N 3.09Å
53V39.6Very low38.6Very low113 Ų113135.7 Ų135.769%0.68581%0.805SS**  trans-70103174.7177.50000110.3L51 R55L51-V53 PolarHBondContact O-N 2.77Å; V53-R55 HydrophobicContact CG1-CG 4.33Å; V53-R55 PolarHBondContact O-N 3.27Å
54R38.4Very low38.7Very low239 Ų239133.7 Ų133.790%0.90281%0.807SS**  trans-64112.3163.2-77.2-179.8170.3-113.31.2109.2S52S52-R54 PolarHBondContact O-N 3.4Å; S52-R54 VanDerWaalsContact O-N 3.09Å
55R35.4Very low38.7Very low230 Ų230135.8 Ų135.887%0.86881%0.805SS**  trans-100.2104.1164.4-93.7-175.8175.7-1210.3110.4V53V53-R55 HydrophobicContact CG1-CG 4.33Å; V53-R55 PolarHBondContact O-N 3.27Å
56S35.1Very low39Very low119 Ų119137.1 Ų137.183%0.83281%0.807SS**  trans-68.1130.6163-47.90000109.2
57Y38.2Very low38.7Very low218 Ų218136.9 Ų136.986%0.85581%0.808SS**  trans-100.3113.5162.955.9-91.3000109.4
58S33.7Very low38.5Very low107 Ų107137.8 Ų137.875%0.74881%0.807SS**  trans-79.1113.5169.8490000109.5S60S58-S60 PolarHBondContact O-N 2.83Å; S58-S60 VanDerWaalsContact O-N 3.16Å
59S36.6Very low38.8Very low120 Ų120140.6 Ų140.684%0.83981%0.807SS**  trans-7991.817354.70000110.7
60S38Very low39.4Very low110 Ų110142.9 Ų142.977%0.76981%0.811SS**  trans-123.289.1172.263.40000111.5S58S58-S60 PolarHBondContact O-N 2.83Å; S58-S60 VanDerWaalsContact O-N 3.16Å
61S39.8Very low39.7Very low113 Ų113144.2 Ų144.279%0.7981%0.809SS**  trans-158.2120.8159.2178.10000105.7
62G39.3Very low40.4Very low77 Ų77141.7 Ų141.779%0.79480%0.796SS**  cis9659.41700000110.9
63S36.6Very low41.2Very low109 Ų109143 Ų14376%0.76279%0.792SS**  trans-137.7102.1167-1590000110.2
64L39.8Very low42.1Very low167 Ų167141.2 Ų141.287%0.87479%0.785SS**  trans-77.6134.9158.3-65.7162000107.3
65M39.3Very low43Very low169 Ų169135.4 Ų135.483%0.83377%0.768SS**  trans-146154.9155.2-88.7-49.9-178.300109.5
66P45.6Very low44.2Very low112 Ų112128.7 Ų128.773%0.72775%0.753SS**  trans-108.9-172.1-142.48.715.8000112.6
67S38.9Very low45.5Very low111 Ų111125.7 Ų125.778%0.77674%0.735SS**  trans-41137.5171.6-165.50000113.3
68L39.3Very low46.7Very low162 Ų162117.8 Ų117.885%0.84872%0.715SS**  trans-60.6141.4160-66.8103.3000109.6
69E42.3Very low48.2Very low173 Ų173117.6 Ų117.681%0.80870%0.704SS**  trans-161.7121.6134.5-111.3166.5-155.700110.1
70N53.9Low49.8Very low158 Ų158114.3 Ų114.385%0.84568%0.681SS**  trans51.689.7161.7-56.1-29.8000118.9
71L46.7Very low51.6Low144 Ų144113.8 Ų113.875%0.75467%0.67SS**  trans-129.5142.2161.7-98.3158.1000110.8
72D53.7Low53.2Low102 Ų102113 Ų11355%0.54566%0.657SS.*  trans-68.1137.5-171.9177.639.4000113.2S74 Q75D72-S74 PolarHBondContact O-N 3.48Å; D72-S74 WeakPolarHBondContact OD2-CB 3.29Å; D72-S74 PolarHBondContact OD2-OG 2.88Å; D72-Q75 PolarHBondContact O-N 3.28Å
73L54.6Low55Low149 Ų149113 Ų11378%0.7864%0.638SS**Hα-helixtrans-66.4-23.1-170.9-151.673.6000112.5A77L73-A77 PolarHBondContact O-N 3.11Å
74S59.6Low57Low76 Ų76113 Ų11353%0.53162%0.624SS.*Hα-helixtrans-68.9-40.5179.877.60000113.1D72 A77 A78D72-S74 PolarHBondContact O-N 3.48Å; D72-S74 WeakPolarHBondContact OD2-CB 3.29Å; D72-S74 PolarHBondContact OD2-OG 2.88Å; S74-A77 PolarHBondContact O-N 3Å; S74-A78 PolarHBondContact O-N 2.87Å
75Q56.8Low58.9Low118 Ų118107.8 Ų107.855%0.55160%0.602SS**Hα-helixtrans-73.1-37.4-176.4-113.7174.510.500112.1D72 A77 A78 I79D72-Q75 PolarHBondContact O-N 3.28Å; Q75-A77 VanDerWaalsContact C-N 3.32Å; Q75-A77 PolarHBondContact O-N 3.35Å; Q75-A78 PolarHBondContact O-N 3.46Å; Q75-I79 WeakPolarHBondContact O-CG1 3.45Å; Q75-I79 PolarHBondContact O-N 2.86Å; Q75-I79 VanDerWaalsContact O-N 3.12Å
76V59.8Low60.9Low89 Ų89103.5 Ų103.554%0.53958%0.582SS.*Hα-helixtrans-65.8-35.9175.4-178.60000111.2S80V76-S80 WeakPolarHBondContact O-CB 3.47Å; V76-S80 PolarHBondContact O-N 2.83Å
77A62.2Low62.7Low55 Ų55105 Ų10546%0.45557%0.573SS.*Hα-helixtrans-67.3-40.517700000112.8L73 S74 Q75 S80 N81L73-A77 PolarHBondContact O-N 3.11Å; S74-A77 PolarHBondContact O-N 3Å; Q75-A77 VanDerWaalsContact C-N 3.32Å; Q75-A77 PolarHBondContact O-N 3.35Å; A77-S80 PolarHBondContact O-N 3.46Å; A77-N81 PolarHBondContact O-N 3.45Å
78A64.4Low64.9Low53 Ų53104.1 Ų104.144%0.43856%0.563SS.*Hα-helixtrans-62.5-53.7174.800000111.4S74 Q75 S80 N81 D82S74-A78 PolarHBondContact O-N 2.87Å; Q75-A78 PolarHBondContact O-N 3.46Å; A78-S80 PolarHBondContact O-N 3.45Å; A78-N81 PolarHBondContact O-N 3.19Å; A78-D82 PolarHBondContact O-N 3.1Å
79I66.1Low67.2Low103 Ų103102.2 Ų102.253%0.52855%0.549SS..Hα-helixtrans-59.5-35.8177.5-63.8165.9000111.1Q75 D82 L83Q75-I79 WeakPolarHBondContact O-CG1 3.45Å; Q75-I79 PolarHBondContact O-N 2.86Å; Q75-I79 VanDerWaalsContact O-N 3.12Å; I79-D82 PolarHBondContact O-N 3.41Å; I79-L83 WeakPolarHBondContact O-CB 3.37Å; I79-L83 PolarHBondContact O-N 3.28Å
80S69.6Low69.3Low51 Ų5198.8 Ų98.836%0.35753%0.533SS..Hα-helixtrans-65.9-35.5175.2-173.30000113V76 A77 A78 K84V76-S80 WeakPolarHBondContact O-CB 3.47Å; V76-S80 PolarHBondContact O-N 2.83Å; A77-S80 PolarHBondContact O-N 3.46Å; A78-S80 PolarHBondContact O-N 3.45Å; S80-K84 WeakPolarHBondContact O-CD 2.94Å; S80-K84 WeakPolarHBondContact O-CG 3.21Å; S80-K84 PolarHBondContact O-N 2.94Å; S80-K84 VanDerWaalsContact O-N 3.11Å; S80-K84 WeakPolarHBondContact OG-CE 3.42Å
81N74.6Confident70.9Confident98 Ų9898.4 Ų98.452%0.52452%0.524SS..Hα-helixtrans-74.7-37.6175.5-84.9-6.9000112.2A77 A78 K84 S85A77-N81 PolarHBondContact O-N 3.45Å; A78-N81 PolarHBondContact O-N 3.19Å; N81-K84 WeakPolarHBondContact O-CB 3.41Å; N81-K84 PolarHBondContact O-N 3.45Å; N81-K84 VanDerWaalsContact O-N 3.1Å; N81-K84 PolarHBondContact OD1-NZ 2.91Å; N81-S85 PolarHBondContact O-N 2.92Å
82D74.9Confident72.8Confident98 Ų9894.1 Ų94.152%0.52451%0.51SS..Hα-helixtrans-66.1-38.2172.7-67.8-29.6000111.7A78 I79 K84 S85 I86A78-D82 PolarHBondContact O-N 3.1Å; I79-D82 PolarHBondContact O-N 3.41Å; D82-K84 PolarHBondContact O-N 2.96Å; D82-S85 WeakPolarHBondContact CA-OG 3.34Å; D82-S85 PolarHBondContact O-N 2.81Å; D82-S85 PolarHBondContact O-OG 3.34Å; D82-I86 WeakPolarHBondContact O-CB 3.44Å; D82-I86 WeakPolarHBondContact O-CD1 3.46Å; D82-I86 VanDerWaalsContact O-CG1 3.24Å; D82-I86 WeakPolarHBondContact O-CG1 3.31Å; D82-I86 PolarHBondContact O-N 3.24Å
83L76.2Confident74.4Confident75 Ų7594.9 Ų94.939%0.39351%0.51SS..Hα-helixtrans-69.5-17.4171.5-103.8170.3000114.1I79 R87I79-L83 WeakPolarHBondContact O-CB 3.37Å; I79-L83 PolarHBondContact O-N 3.28Å; L83-R87 WeakPolarHBondContact O-CB 3.45Å; L83-R87 VanDerWaalsContact O-CG 3.25Å; L83-R87 WeakPolarHBondContact O-CG 3.34Å; L83-R87 PolarHBondContact O-N 3.36Å; L83-R87 PolarHBondContact O-NH1 3.25Å; L83-R87 VanDerWaalsContact O-NH1 3.15Å
84K79.6Confident76.1Confident110 Ų11093.4 Ų93.448%0.47850%0.502SS..Hα-helixtrans-83.3-43.5169.9-73.2164.3-157.41610110.5S80 N81 D82 R87 T88S80-K84 WeakPolarHBondContact O-CD 2.94Å; S80-K84 WeakPolarHBondContact O-CG 3.21Å; S80-K84 PolarHBondContact O-N 2.94Å; S80-K84 VanDerWaalsContact O-N 3.11Å; S80-K84 WeakPolarHBondContact OG-CE 3.42Å; N81-K84 WeakPolarHBondContact O-CB 3.41Å; N81-K84 PolarHBondContact O-N 3.45Å; N81-K84 VanDerWaalsContact O-N 3.1Å; N81-K84 PolarHBondContact OD1-NZ 2.91Å; D82-K84 PolarHBondContact O-N 2.96Å; K84-R87 PolarHBondContact O-N 3.4Å; K84-T88 WeakPolarHBondContact O-CG2 3.3Å; K84-T88 PolarHBondContact O-N 3.45Å; K84-T88 PolarHBondContact O-OG1 3.12Å; K84-T88 VanDerWaalsContact O-OG1 3.1Å
85S79.1Confident77.5Confident57 Ų5795.1 Ų95.140%0.39950%0.502SS..Hα-helixtrans-62.2-46.1178.167.30000111N81 D82 T88 Q89N81-S85 PolarHBondContact O-N 2.92Å; D82-S85 WeakPolarHBondContact CA-OG 3.34Å; D82-S85 PolarHBondContact O-N 2.81Å; D82-S85 PolarHBondContact O-OG 3.34Å; S85-T88 WeakPolarHBondContact CA-OG1 3.34Å; S85-T88 PolarHBondContact O-N 3.3Å; S85-T88 PolarHBondContact O-OG1 3.36Å; S85-Q89 WeakPolarHBondContact O-CB 3.48Å; S85-Q89 PolarHBondContact O-N 3.23Å
86I82.3Confident79.2Confident80 Ų8093 Ų9341%0.4149%0.494SS..Hα-helixtrans-57.7-50.5172.9-67.4164.9000110.7D82 T88 Q89 E90D82-I86 WeakPolarHBondContact O-CB 3.44Å; D82-I86 WeakPolarHBondContact O-CD1 3.46Å; D82-I86 VanDerWaalsContact O-CG1 3.24Å; D82-I86 WeakPolarHBondContact O-CG1 3.31Å; D82-I86 PolarHBondContact O-N 3.24Å; I86-T88 VanDerWaalsContact C-N 3.31Å; I86-T88 PolarHBondContact O-N 3.49Å; I86-Q89 CarbonylContact O-C 3.58Å; I86-Q89 WeakPolarHBondContact O-CB 3.22Å; I86-Q89 PolarHBondContact O-N 3.15Å; I86-Q89 VanDerWaalsContact O-N 3.07Å; I86-E90 HydrophobicContact CG2-CG 4.23Å; I86-E90 WeakPolarHBondContact O-CB 3.41Å; I86-E90 WeakPolarHBondContact O-CG 3.21Å; I86-E90 PolarHBondContact O-N 3.3Å
87R83.3Confident80.7Confident144 Ų14492.9 Ų92.954%0.54349%0.49SS..Hα-helixtrans-62.7-33.9177.5-79.1-173.2-171.899.8-6113.6L83 K84 K91L83-R87 WeakPolarHBondContact O-CB 3.45Å; L83-R87 VanDerWaalsContact O-CG 3.25Å; L83-R87 WeakPolarHBondContact O-CG 3.34Å; L83-R87 PolarHBondContact O-N 3.36Å; L83-R87 PolarHBondContact O-NH1 3.25Å; L83-R87 VanDerWaalsContact O-NH1 3.15Å; K84-R87 PolarHBondContact O-N 3.4Å; R87-K91 WeakPolarHBondContact O-CB 3.47Å; R87-K91 PolarHBondContact O-N 3.06Å
88T84.8Confident82.1Confident92 Ų9295.2 Ų95.256%0.56450%0.495SS*.Hα-helixtrans-70.4-34.2173.749.80000112K84 S85 I86 A92K84-T88 WeakPolarHBondContact O-CG2 3.3Å; K84-T88 PolarHBondContact O-N 3.45Å; K84-T88 PolarHBondContact O-OG1 3.12Å; K84-T88 VanDerWaalsContact O-OG1 3.1Å; S85-T88 WeakPolarHBondContact CA-OG1 3.34Å; S85-T88 PolarHBondContact O-N 3.3Å; S85-T88 PolarHBondContact O-OG1 3.36Å; I86-T88 VanDerWaalsContact C-N 3.31Å; I86-T88 PolarHBondContact O-N 3.49Å; T88-A92 WeakPolarHBondContact O-CB 3.4Å; T88-A92 PolarHBondContact O-N 3.14Å
89Q86.3Confident83.4Confident121 Ų12196.9 Ų96.957%0.56550%0.496SS*.Hα-helixtrans-71.4-45.5175.8-175174.9-1.200111.7S85 I86 K91 A92 Q93S85-Q89 WeakPolarHBondContact O-CB 3.48Å; S85-Q89 PolarHBondContact O-N 3.23Å; I86-Q89 CarbonylContact O-C 3.58Å; I86-Q89 WeakPolarHBondContact O-CB 3.22Å; I86-Q89 PolarHBondContact O-N 3.15Å; I86-Q89 VanDerWaalsContact O-N 3.07Å; Q89-K91 VanDerWaalsContact C-N 3.34Å; Q89-K91 PolarHBondContact O-N 3.4Å; Q89-A92 PolarHBondContact O-N 3.18Å; Q89-Q93 WeakPolarHBondContact O-CG 3.46Å; Q89-Q93 PolarHBondContact O-N 3.32Å
90E86.6Confident84.7Confident102 Ų10299 Ų9948%0.47750%0.498SS..Hα-helixtrans-59.4-43.8171.4-71.9176158.300111.1I86 A92 Q93 L94I86-E90 HydrophobicContact CG2-CG 4.23Å; I86-E90 WeakPolarHBondContact O-CB 3.41Å; I86-E90 WeakPolarHBondContact O-CG 3.21Å; I86-E90 PolarHBondContact O-N 3.3Å; E90-A92 VanDerWaalsContact C-N 3.35Å; E90-A92 PolarHBondContact O-N 3.39Å; E90-Q93 PolarHBondContact O-N 2.88Å; E90-L94 WeakPolarHBondContact O-CB 3.48Å; E90-L94 VanDerWaalsContact O-CG 3.32Å; E90-L94 WeakPolarHBondContact O-CG 3.43Å; E90-L94 PolarHBondContact O-N 3.21Å
91K87.9Confident85.9Confident149 Ų149102.3 Ų102.365%0.64851%0.506SS*.Hα-helixtrans-62.8-40.3175.5-174.3180177.4-173.90111.9R87 Q89 L94 Q95R87-K91 WeakPolarHBondContact O-CB 3.47Å; R87-K91 PolarHBondContact O-N 3.06Å; Q89-K91 VanDerWaalsContact C-N 3.34Å; Q89-K91 PolarHBondContact O-N 3.4Å; K91-L94 PolarHBondContact O-N 3.41Å; K91-Q95 WeakPolarHBondContact O-CB 3.4Å; K91-Q95 PolarHBondContact O-N 2.9Å
92A87.2Confident86.7Confident55 Ų5599.5 Ų99.546%0.45550%0.496SS..Hα-helixtrans-67.4-38175.900000112.3T88 Q89 E90 Q95 D96T88-A92 WeakPolarHBondContact O-CB 3.4Å; T88-A92 PolarHBondContact O-N 3.14Å; Q89-A92 PolarHBondContact O-N 3.18Å; E90-A92 VanDerWaalsContact C-N 3.35Å; E90-A92 PolarHBondContact O-N 3.39Å; A92-Q95 PolarHBondContact O-N 2.89Å; A92-D96 PolarHBondContact O-N 3.46Å
93Q87.7Confident87.6Confident118 Ų11897.9 Ų97.955%0.55149%0.493SS*.Hα-helixtrans-67.8-41173.8-74.1176.5-13.300112.2Q89 E90 Q95 L97Q89-Q93 WeakPolarHBondContact O-CG 3.46Å; Q89-Q93 PolarHBondContact O-N 3.32Å; E90-Q93 PolarHBondContact O-N 2.88Å; Q93-Q95 VanDerWaalsContact C-N 3.27Å; Q93-Q95 PolarHBondContact O-N 3.48Å; Q93-L97 VanDerWaalsContact O-CB 3.27Å; Q93-L97 WeakPolarHBondContact O-CB 3.14Å; Q93-L97 PolarHBondContact O-N 2.88Å
94L89.1Confident88.5Confident117 Ų117100.8 Ų100.861%0.61350%0.502SS*.Hα-helixtrans-65.7-32.2173-73.6172.3000111.8E90 K91 N98E90-L94 WeakPolarHBondContact O-CB 3.48Å; E90-L94 VanDerWaalsContact O-CG 3.32Å; E90-L94 WeakPolarHBondContact O-CG 3.43Å; E90-L94 PolarHBondContact O-N 3.21Å; K91-L94 PolarHBondContact O-N 3.41Å; L94-N98 VanDerWaalsContact O-CB 3.25Å; L94-N98 WeakPolarHBondContact O-CB 3.3Å; L94-N98 PolarHBondContact O-N 3.36Å
95Q89.2Confident89.2Confident113 Ų11399.9 Ų99.953%0.52850%0.502SS..Hα-helixtrans-69.9-51.2173.7-174.6172.1-14.800111.4K91 A92 Q93 L97 N98 D99K91-Q95 WeakPolarHBondContact O-CB 3.4Å; K91-Q95 PolarHBondContact O-N 2.9Å; A92-Q95 PolarHBondContact O-N 2.89Å; Q93-Q95 VanDerWaalsContact C-N 3.27Å; Q93-Q95 PolarHBondContact O-N 3.48Å; Q95-L97 VanDerWaalsContact C-N 3.25Å; Q95-L97 PolarHBondContact O-N 3.39Å; Q95-N98 CarbonylContact O-C 3.56Å; Q95-N98 WeakPolarHBondContact O-CA 3.38Å; Q95-N98 WeakPolarHBondContact O-CB 3.39Å; Q95-N98 PolarHBondContact O-N 2.8Å; Q95-D99 WeakPolarHBondContact O-CB 3.39Å; Q95-D99 VanDerWaalsContact O-CG 3.22Å; Q95-D99 PolarHBondContact O-N 2.9Å
96D91.9Very high89.9Confident72 Ų72103.4 Ų103.439%0.38551%0.512SS..Hα-helixtrans-56.8-38.7173.8171.553.2000112A92 R100A92-D96 PolarHBondContact O-N 3.46Å; D96-R100 VanDerWaalsContact CG-NE 3.31Å; D96-R100 VanDerWaalsContact CG-NH2 3.34Å; D96-R100 WeakPolarHBondContact O-CB 3.41Å; D96-R100 WeakPolarHBondContact O-CD 3.29Å; D96-R100 WeakPolarHBondContact O-CG 3.37Å; D96-R100 PolarHBondContact O-N 2.94Å; D96-R100 IonicContact OD1-CZ 3.45Å; D96-R100 IonicContact OD1-NE 2.69Å; D96-R100 PolarHBondContact OD1-NE 3.34Å; D96-R100 IonicContact OD1-NH2 3.7Å; D96-R100 PolarHBondContact OD1-NH2 3.01Å; D96-R100 VanDerWaalsContact OD1-NH2 3.14Å; D96-R100 IonicContact OD2-CZ 3.24Å; D96-R100 VanDerWaalsContact OD2-CZ 3.24Å; D96-R100 IonicContact OD2-NE 2.95Å; D96-R100 PolarHBondContact OD2-NE 3.13Å; D96-R100 IonicContact OD2-NH2 2.73Å; D96-R100 PolarHBondContact OD2-NH2 3.45Å
97L91.9Very high90.6Very high87 Ų87105.3 Ų105.346%0.45551%0.514SS..Hα-helixtrans-67.4-38.2174-166.571.8000112.3Q93 Q95 F101Q93-L97 VanDerWaalsContact O-CB 3.27Å; Q93-L97 WeakPolarHBondContact O-CB 3.14Å; Q93-L97 PolarHBondContact O-N 2.88Å; Q95-L97 VanDerWaalsContact C-N 3.25Å; Q95-L97 PolarHBondContact O-N 3.39Å; L97-F101 HydrophobicContact CD1-CE2 4.26Å; L97-F101 HydrophobicContact CD2-CE2 3.92Å; L97-F101 HydrophobicContact CG-CD2 4.05Å; L97-F101 HydrophobicContact CG-CE2 3.67Å; L97-F101 WeakPolarHBondContact O-CD2 3.38Å; L97-F101 WeakPolarHBondContact O-CG 3.49Å; L97-F101 PolarHBondContact O-N 3.08Å
98N91.9Very high91.2Very high104 Ų104100.9 Ų100.956%0.55650%0.503SS*.Hα-helixtrans-68.6-44.8176.3-162.1-65.1000111.6L94 Q95 R100 F101 A102L94-N98 VanDerWaalsContact O-CB 3.25Å; L94-N98 WeakPolarHBondContact O-CB 3.3Å; L94-N98 PolarHBondContact O-N 3.36Å; Q95-N98 CarbonylContact O-C 3.56Å; Q95-N98 WeakPolarHBondContact O-CA 3.38Å; Q95-N98 WeakPolarHBondContact O-CB 3.39Å; Q95-N98 PolarHBondContact O-N 2.8Å; N98-R100 VanDerWaalsContact C-N 3.29Å; N98-R100 PolarHBondContact O-N 2.85Å; N98-F101 CarbonylContact O-C 3.51Å; N98-F101 WeakPolarHBondContact O-CA 3.3Å; N98-F101 WeakPolarHBondContact O-CB 3.43Å; N98-F101 PolarHBondContact O-N 3.34Å; N98-A102 PolarHBondContact O-N 3.08Å
99D92Very high91.6Very high88 Ų88101.9 Ų101.947%0.47150%0.501SS..Hα-helixtrans-61.3-39.4176.7-63.8-23.6000110.4Q95 A102 S103Q95-D99 WeakPolarHBondContact O-CB 3.39Å; Q95-D99 VanDerWaalsContact O-CG 3.22Å; Q95-D99 PolarHBondContact O-N 2.9Å; D99-A102 PolarHBondContact O-N 3.45Å; D99-S103 PolarHBondContact O-N 3.1Å
100R93.3Very high92.1Very high149 Ų149100.6 Ų100.656%0.56250%0.495SS*.Hα-helixtrans-64.2-44.2169.7-70.2169.3-163.5-144.812.5112.5D96 N98 A102 S103 F104D96-R100 VanDerWaalsContact CG-NE 3.31Å; D96-R100 VanDerWaalsContact CG-NH2 3.34Å; D96-R100 WeakPolarHBondContact O-CB 3.41Å; D96-R100 WeakPolarHBondContact O-CD 3.29Å; D96-R100 WeakPolarHBondContact O-CG 3.37Å; D96-R100 PolarHBondContact O-N 2.94Å; D96-R100 IonicContact OD1-CZ 3.45Å; D96-R100 IonicContact OD1-NE 2.69Å; D96-R100 PolarHBondContact OD1-NE 3.34Å; D96-R100 IonicContact OD1-NH2 3.7Å; D96-R100 PolarHBondContact OD1-NH2 3.01Å; D96-R100 VanDerWaalsContact OD1-NH2 3.14Å; D96-R100 IonicContact OD2-CZ 3.24Å; D96-R100 VanDerWaalsContact OD2-CZ 3.24Å; D96-R100 IonicContact OD2-NE 2.95Å; D96-R100 PolarHBondContact OD2-NE 3.13Å; D96-R100 IonicContact OD2-NH2 2.73Å; D96-R100 PolarHBondContact OD2-NH2 3.45Å; N98-R100 VanDerWaalsContact C-N 3.29Å; N98-R100 PolarHBondContact O-N 2.85Å; R100-A102 VanDerWaalsContact C-N 3.33Å; R100-A102 PolarHBondContact O-N 3.46Å; R100-S103 PolarHBondContact O-N 3.19Å; R100-S103 PolarHBondContact O-OG 3.36Å; R100-F104 PolarHBondContact O-N 3.44Å
101F93.7Very high92.5Very high119 Ų11999.2 Ų99.252%0.52249%0.491SS..Hα-helixtrans-62-38.9174.5-79.3-54.3000112.6L97 N98 F104 I105L97-F101 HydrophobicContact CD1-CE2 4.26Å; L97-F101 HydrophobicContact CD2-CE2 3.92Å; L97-F101 HydrophobicContact CG-CD2 4.05Å; L97-F101 HydrophobicContact CG-CE2 3.67Å; L97-F101 WeakPolarHBondContact O-CD2 3.38Å; L97-F101 WeakPolarHBondContact O-CG 3.49Å; L97-F101 PolarHBondContact O-N 3.08Å; N98-F101 CarbonylContact O-C 3.51Å; N98-F101 WeakPolarHBondContact O-CA 3.3Å; N98-F101 WeakPolarHBondContact O-CB 3.43Å; N98-F101 PolarHBondContact O-N 3.34Å; F101-F104 PolarHBondContact O-N 3.13Å; F101-I105 WeakPolarHBondContact O-CB 3.42Å; F101-I105 VanDerWaalsContact O-CG1 3.24Å; F101-I105 WeakPolarHBondContact O-CG1 3.49Å; F101-I105 PolarHBondContact O-N 3.23Å
102A91.9Very high92.9Very high39 Ų3996.4 Ų96.432%0.32248%0.479SS..Hα-helixtrans-60.2-49.6174.200000110.7N98 D99 R100 F104 I105 E106N98-A102 PolarHBondContact O-N 3.08Å; D99-A102 PolarHBondContact O-N 3.45Å; R100-A102 VanDerWaalsContact C-N 3.33Å; R100-A102 PolarHBondContact O-N 3.46Å; A102-F104 VanDerWaalsContact C-N 3.28Å; A102-F104 PolarHBondContact O-N 3.47Å; A102-I105 PolarHBondContact O-N 3.25Å; A102-I105 VanDerWaalsContact O-N 3.12Å; A102-E106 WeakPolarHBondContact O-CG 3.43Å; A102-E106 PolarHBondContact O-N 3.42Å
103S93.3Very high93.3Very high64 Ų64100.1 Ų100.145%0.44849%0.488SS..Hα-helixtrans-60.2-34.2175.674.10000113.4D99 R100 R107D99-S103 PolarHBondContact O-N 3.1Å; R100-S103 PolarHBondContact O-N 3.19Å; R100-S103 PolarHBondContact O-OG 3.36Å; S103-R107 VanDerWaalsContact O-CB 3.31Å; S103-R107 WeakPolarHBondContact O-CB 3.11Å; S103-R107 PolarHBondContact O-N 3.28Å
104F96.1Very high93.7Very high136 Ų13699.2 Ų99.260%0.59648%0.483SS*.Hα-helixtrans-71.6-39.9174.4-172.6-95.5000112.2R100 F101 A102 R107 V108R100-F104 PolarHBondContact O-N 3.44Å; F101-F104 PolarHBondContact O-N 3.13Å; A102-F104 VanDerWaalsContact C-N 3.28Å; A102-F104 PolarHBondContact O-N 3.47Å; F104-R107 PolarHBondContact O-N 3Å; F104-V108 HydrophobicContact CD1-CG2 4.06Å; F104-V108 HydrophobicContact CE1-CG2 3.69Å; F104-V108 HydrophobicContact CZ-CG2 4.06Å; F104-V108 VanDerWaalsContact O-CG2 3.31Å; F104-V108 WeakPolarHBondContact O-CG2 3.2Å; F104-V108 PolarHBondContact O-N 2.82Å
105I93.7Very high94Very high91 Ų9198 Ų9847%0.46748%0.477SS..Hα-helixtrans-64.7-44.6175.2-70.1164000110.4F101 A102 R107 V108 H109F101-I105 WeakPolarHBondContact O-CB 3.42Å; F101-I105 VanDerWaalsContact O-CG1 3.24Å; F101-I105 WeakPolarHBondContact O-CG1 3.49Å; F101-I105 PolarHBondContact O-N 3.23Å; A102-I105 PolarHBondContact O-N 3.25Å; A102-I105 VanDerWaalsContact O-N 3.12Å; I105-R107 VanDerWaalsContact C-N 3.35Å; I105-V108 PolarHBondContact O-N 3.34Å; I105-H109 PolarHBondContact O-N 3.02Å; I105-H109 PolarHBondContact O-ND1 3.12Å
106E94.4Very high94.3Very high132 Ų13298.4 Ų98.462%0.61748%0.477SS*.Hα-helixtrans-57.7-47.8172.8-73.7177.4171.500110.6A102 V108 H109 E110A102-E106 WeakPolarHBondContact O-CG 3.43Å; A102-E106 PolarHBondContact O-N 3.42Å; E106-V108 VanDerWaalsContact C-N 3.32Å; E106-V108 PolarHBondContact O-N 3.21Å; E106-H109 WeakPolarHBondContact O-CB 3.47Å; E106-H109 PolarHBondContact O-N 3.19Å; E106-H109 VanDerWaalsContact O-N 3.1Å; E106-E110 WeakPolarHBondContact O-CG 3.42Å; E106-E110 PolarHBondContact O-N 3.3Å
107R95.4Very high94.5Very high120 Ų12099.3 Ų99.345%0.45349%0.486SS..Hα-helixtrans-63.7-34.4178.2-173.255.4-179.9170.65.5113.4S103 F104 I105 E110 L111S103-R107 VanDerWaalsContact O-CB 3.31Å; S103-R107 WeakPolarHBondContact O-CB 3.11Å; S103-R107 PolarHBondContact O-N 3.28Å; F104-R107 PolarHBondContact O-N 3Å; I105-R107 VanDerWaalsContact C-N 3.35Å; R107-E110 WeakPolarHBondContact CD-OE2 3.45Å; R107-E110 IonicContact CZ-OE2 3.14Å; R107-E110 IonicContact NE-OE2 2.88Å; R107-E110 IonicContact NH1-OE2 3.19Å; R107-E110 PolarHBondContact NH1-OE2 3.43Å; R107-L111 HydrophobicContact CG-CD1 4.3Å; R107-L111 WeakPolarHBondContact O-CB 3.21Å; R107-L111 VanDerWaalsContact O-CG 3.25Å; R107-L111 WeakPolarHBondContact O-CG 3.33Å; R107-L111 PolarHBondContact O-N 3.05Å
108V96.3Very high94.7Very high50 Ų50100 Ų10030%0.30349%0.489SS..Hα-helixtrans-67.2-42.2172.2168.90000110.7F104 I105 E106 E110 L111 E112F104-V108 HydrophobicContact CD1-CG2 4.06Å; F104-V108 HydrophobicContact CE1-CG2 3.69Å; F104-V108 HydrophobicContact CZ-CG2 4.06Å; F104-V108 VanDerWaalsContact O-CG2 3.31Å; F104-V108 WeakPolarHBondContact O-CG2 3.2Å; F104-V108 PolarHBondContact O-N 2.82Å; I105-V108 PolarHBondContact O-N 3.34Å; E106-V108 VanDerWaalsContact C-N 3.32Å; E106-V108 PolarHBondContact O-N 3.21Å; V108-E110 PolarHBondContact O-N 2.9Å; V108-L111 PolarHBondContact O-N 3.09Å; V108-E112 HydrophobicContact CG1-CG 4.38Å; V108-E112 WeakPolarHBondContact O-CB 3.15Å; V108-E112 WeakPolarHBondContact O-CG 3.33Å; V108-E112 PolarHBondContact O-N 3.43Å
109H94.4Very high94.8Very high114 Ų114101 Ų10153%0.52849%0.49SS..Hα-helixtrans-63.2-41.1175.5-77.374.8000112.2I105 E106 E112 Q113I105-H109 PolarHBondContact O-N 3.02Å; I105-H109 PolarHBondContact O-ND1 3.12Å; E106-H109 WeakPolarHBondContact O-CB 3.47Å; E106-H109 PolarHBondContact O-N 3.19Å; E106-H109 VanDerWaalsContact O-N 3.1Å; H109-E112 PolarHBondContact O-N 3.34Å; H109-Q113 WeakPolarHBondContact O-CB 3.43Å; H109-Q113 PolarHBondContact O-N 3.46Å
110E96.1Very high94.9Very high93 Ų9399.2 Ų99.244%0.43549%0.488SS..Hα-helixtrans-58.6-47.1172.3-71.6-177.9158.400111.6E106 R107 V108 Q113 Q114E106-E110 WeakPolarHBondContact O-CG 3.42Å; E106-E110 PolarHBondContact O-N 3.3Å; R107-E110 WeakPolarHBondContact CD-OE2 3.45Å; R107-E110 IonicContact CZ-OE2 3.14Å; R107-E110 IonicContact NE-OE2 2.88Å; R107-E110 IonicContact NH1-OE2 3.19Å; R107-E110 PolarHBondContact NH1-OE2 3.43Å; V108-E110 PolarHBondContact O-N 2.9Å; E110-Q113 PolarHBondContact O-N 3.07Å; E110-Q114 WeakPolarHBondContact O-CB 3.46Å; E110-Q114 VanDerWaalsContact O-CG 3.28Å; E110-Q114 WeakPolarHBondContact O-CG 3.46Å; E110-Q114 PolarHBondContact O-N 3.16Å
111L95.8Very high95Very high74 Ų7497.3 Ų97.339%0.38749%0.486SS..Hα-helixtrans-68.2-37.4179.8-72.5170.1000112.3R107 V108 Q114 N115R107-L111 HydrophobicContact CG-CD1 4.3Å; R107-L111 WeakPolarHBondContact O-CB 3.21Å; R107-L111 VanDerWaalsContact O-CG 3.25Å; R107-L111 WeakPolarHBondContact O-CG 3.33Å; R107-L111 PolarHBondContact O-N 3.05Å; V108-L111 PolarHBondContact O-N 3.09Å; L111-Q114 PolarHBondContact O-N 2.86Å; L111-N115 WeakPolarHBondContact O-CB 3.49Å; L111-N115 PolarHBondContact O-N 3.25Å; L111-N115 PolarHBondContact O-ND2 2.77Å
112E95Very high94.8Very high89 Ų8995.6 Ų95.642%0.41648%0.481SS..Hα-helixtrans-64.2-41171.5-78.7-171.8-161.800112V108 H109 N115 K116V108-E112 HydrophobicContact CG1-CG 4.38Å; V108-E112 WeakPolarHBondContact O-CB 3.15Å; V108-E112 WeakPolarHBondContact O-CG 3.33Å; V108-E112 PolarHBondContact O-N 3.43Å; H109-E112 PolarHBondContact O-N 3.34Å; E112-N115 PolarHBondContact O-N 3.5Å; E112-K116 WeakPolarHBondContact O-CB 3.32Å; E112-K116 WeakPolarHBondContact O-CD 3.47Å; E112-K116 VanDerWaalsContact O-CG 3.25Å; E112-K116 WeakPolarHBondContact O-CG 3.21Å; E112-K116 PolarHBondContact O-N 3.38Å; E112-K116 IonicContact OE2-NZ 3.64Å; E112-K116 PolarHBondContact OE2-NZ 3.41Å
113Q96.1Very high94.8Very high134 Ų13499.1 Ų99.163%0.62649%0.494SS*.Hα-helixtrans-66.8-41.6176.7-170.6174.913.500111H109 E110 K116 V117H109-Q113 WeakPolarHBondContact O-CB 3.43Å; H109-Q113 PolarHBondContact O-N 3.46Å; E110-Q113 PolarHBondContact O-N 3.07Å; Q113-K116 PolarHBondContact O-N 3.05Å; Q113-V117 WeakPolarHBondContact O-CG2 3.44Å; Q113-V117 PolarHBondContact O-N 3.34Å
114Q96.1Very high94.5Very high98 Ų9899.4 Ų99.446%0.45849%0.493SS..Hα-helixtrans-62.6-44.4173.7-73.8174.93.900111.8E110 L111 V117 L118E110-Q114 WeakPolarHBondContact O-CB 3.46Å; E110-Q114 VanDerWaalsContact O-CG 3.28Å; E110-Q114 WeakPolarHBondContact O-CG 3.46Å; E110-Q114 PolarHBondContact O-N 3.16Å; L111-Q114 PolarHBondContact O-N 2.86Å; Q114-V117 PolarHBondContact O-N 3.04Å; Q114-L118 WeakPolarHBondContact O-CG 3.45Å; Q114-L118 PolarHBondContact O-N 3.27Å
115N95.5Very high94Very high92 Ų9296.8 Ų96.849%0.49249%0.485SS..Hα-helixtrans-61.1-44.5174.5-79.4-25.5000111.9L111 E112 V117 L118 E119L111-N115 WeakPolarHBondContact O-CB 3.49Å; L111-N115 PolarHBondContact O-N 3.25Å; L111-N115 PolarHBondContact O-ND2 2.77Å; E112-N115 PolarHBondContact O-N 3.5Å; N115-V117 VanDerWaalsContact C-N 3.28Å; N115-V117 PolarHBondContact O-N 3.36Å; N115-L118 PolarHBondContact O-N 2.77Å; N115-E119 WeakPolarHBondContact O-CB 3.49Å; N115-E119 VanDerWaalsContact O-CG 3.31Å; N115-E119 WeakPolarHBondContact O-CG 3.42Å; N115-E119 PolarHBondContact O-N 3.21Å
116K96.4Very high93.6Very high121 Ų121100.6 Ų100.653%0.52649%0.493SS..Hα-helixtrans-59.3-37.3175.6-74160.8-174.7153.40112.4E112 Q113 A120E112-K116 WeakPolarHBondContact O-CB 3.32Å; E112-K116 WeakPolarHBondContact O-CD 3.47Å; E112-K116 VanDerWaalsContact O-CG 3.25Å; E112-K116 WeakPolarHBondContact O-CG 3.21Å; E112-K116 PolarHBondContact O-N 3.38Å; E112-K116 IonicContact OE2-NZ 3.64Å; E112-K116 PolarHBondContact OE2-NZ 3.41Å; Q113-K116 PolarHBondContact O-N 3.05Å; K116-A120 WeakPolarHBondContact O-CB 3.49Å; K116-A120 PolarHBondContact O-N 3.22Å; K116-A120 VanDerWaalsContact O-N 3.14Å
117V96.2Very high92.9Very high92 Ų92100.5 Ų100.556%0.55849%0.493SS*.Hα-helixtrans-68.9-45.3174.6171.80000111.3Q113 Q114 N115 E119 A120 E121Q113-V117 WeakPolarHBondContact O-CG2 3.44Å; Q113-V117 PolarHBondContact O-N 3.34Å; Q114-V117 PolarHBondContact O-N 3.04Å; N115-V117 VanDerWaalsContact C-N 3.28Å; N115-V117 PolarHBondContact O-N 3.36Å; V117-E119 PolarHBondContact O-N 3.35Å; V117-A120 PolarHBondContact O-N 3.13Å; V117-E121 PolarHBondContact O-N 3.12Å
118L95.7Very high92.1Very high101 Ų101101.7 Ų101.753%0.52950%0.501SS..Hα-helixtrans-64.5-37.7177.5-70.6170.2000112.5Q114 N115 E121 L122Q114-L118 WeakPolarHBondContact O-CG 3.45Å; Q114-L118 PolarHBondContact O-N 3.27Å; N115-L118 PolarHBondContact O-N 2.77Å; L118-E121 PolarHBondContact O-N 3.43Å; L118-L122 WeakPolarHBondContact O-CB 3.39Å; L118-L122 PolarHBondContact O-N 3.22Å
119E94.4Very high90.8Very high124 Ų124107 Ų10758%0.57952%0.522SS*.Hα-helixtrans-62.9-43.6173.3-76173.2178.300111.5N115 V117 L122 L123N115-E119 WeakPolarHBondContact O-CB 3.49Å; N115-E119 VanDerWaalsContact O-CG 3.31Å; N115-E119 WeakPolarHBondContact O-CG 3.42Å; N115-E119 PolarHBondContact O-N 3.21Å; V117-E119 PolarHBondContact O-N 3.35Å; E119-L122 PolarHBondContact O-N 3.37Å; E119-L123 WeakPolarHBondContact O-CG 3.39Å; E119-L123 PolarHBondContact O-N 3.3Å
120A93.8Very high89.5Confident51 Ų51105.6 Ų105.642%0.42153%0.525SS..Hα-helixtrans-65.3-43.1175.800000112.2K116 V117 L123 V124K116-A120 WeakPolarHBondContact O-CB 3.49Å; K116-A120 PolarHBondContact O-N 3.22Å; K116-A120 VanDerWaalsContact O-N 3.14Å; V117-A120 PolarHBondContact O-N 3.13Å; A120-L123 PolarHBondContact O-N 3.01Å; A120-V124 WeakPolarHBondContact O-CG2 3.48Å; A120-V124 PolarHBondContact O-N 2.72Å
121E94.3Very high88.1Confident110 Ų110107.7 Ų107.751%0.51454%0.535SS..Hα-helixtrans-62.5-43.8175.2-174.9174.4-170.700111.5V117 L118 L123 V124 L125V117-E121 PolarHBondContact O-N 3.12Å; L118-E121 PolarHBondContact O-N 3.43Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 3.05Å; E121-V124 PolarHBondContact O-N 3.03Å; E121-L125 HydrophobicContact CG-CD1 4.13Å; E121-L125 WeakPolarHBondContact O-CB 3.46Å; E121-L125 WeakPolarHBondContact O-CG 3.29Å; E121-L125 PolarHBondContact O-N 3.01Å
122L90.8Very high86.7Confident82 Ų82109.2 Ų109.243%0.42955%0.549SS..Hα-helixtrans-62.5-39.9176.9-170.9159000111.7L118 E119 L125 R126L118-L122 WeakPolarHBondContact O-CB 3.39Å; L118-L122 PolarHBondContact O-N 3.22Å; E119-L122 PolarHBondContact O-N 3.37Å; L122-L125 PolarHBondContact O-N 3.19Å; L122-R126 HydrophobicContact CD2-CG 4.13Å; L122-R126 WeakPolarHBondContact O-CB 3.48Å; L122-R126 WeakPolarHBondContact O-CG 3.16Å; L122-R126 PolarHBondContact O-N 3.01Å
123L90Very high85.7Confident113 Ų113108 Ų10859%0.59255%0.551SS**Hα-helixtrans-62.6-45.8173.3-77.4170.2000112E119 A120 E121 L125 R126 Q127E119-L123 WeakPolarHBondContact O-CG 3.39Å; E119-L123 PolarHBondContact O-N 3.3Å; A120-L123 PolarHBondContact O-N 3.01Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 3.05Å; L123-L125 PolarHBondContact O-N 3.02Å; L123-R126 PolarHBondContact O-N 3.3Å; L123-Q127 WeakPolarHBondContact O-CB 3.39Å; L123-Q127 PolarHBondContact O-N 3.44Å
124V88.6Confident85Confident70 Ų70111.1 Ų111.142%0.42456%0.557SS.*Hα-helixtrans-63.8-40.7177.3171.10000111.6A120 E121 Q127 K128A120-V124 WeakPolarHBondContact O-CG2 3.48Å; A120-V124 PolarHBondContact O-N 2.72Å; E121-V124 PolarHBondContact O-N 3.03Å; V124-Q127 PolarHBondContact O-N 2.93Å; V124-K128 HydrophobicContact CG1-CD 4.33Å; V124-K128 WeakPolarHBondContact O-CG 3.25Å; V124-K128 PolarHBondContact O-N 3.16Å
125L85.9Confident84.4Confident81 Ų81113.1 Ų113.142%0.42457%0.565SS.*Hα-helixtrans-65.7-43.4175.2-72.5172000111.6E121 L122 L123 Q127 K128 H129E121-L125 HydrophobicContact CG-CD1 4.13Å; E121-L125 WeakPolarHBondContact O-CB 3.46Å; E121-L125 WeakPolarHBondContact O-CG 3.29Å; E121-L125 PolarHBondContact O-N 3.01Å; L122-L125 PolarHBondContact O-N 3.19Å; L123-L125 PolarHBondContact O-N 3.02Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 3.03Å; L125-K128 PolarHBondContact O-N 2.76Å; L125-H129 PolarHBondContact O-CD2 2.87Å; L125-H129 PolarHBondContact O-N 3.09Å
126R83.9Confident84Confident172 Ų172116.1 Ų116.165%0.64957%0.569SS**Hα-helixtrans-60.1-42.9173.7-81.9-174.1174.5162.30.6111.9L122 L123 H129 S130L122-R126 HydrophobicContact CD2-CG 4.13Å; L122-R126 WeakPolarHBondContact O-CB 3.48Å; L122-R126 WeakPolarHBondContact O-CG 3.16Å; L122-R126 PolarHBondContact O-N 3.01Å; L123-R126 PolarHBondContact O-N 3.3Å; R126-H129 CarbonylContact O-C 3.53Å; R126-H129 PolarHBondContact O-N 3.33Å; R126-S130 WeakPolarHBondContact O-CB 3.31Å; R126-S130 PolarHBondContact O-N 3.23Å; R126-S130 PolarHBondContact O-OG 3.28Å
127Q80.3Confident83.6Confident129 Ų129112.9 Ų112.960%0.60357%0.565SS**Hα-helixtrans-61.6-44.9177.5-168.2176.412.500111.6L123 V124 L125 H129 S130 E131L123-Q127 WeakPolarHBondContact O-CB 3.39Å; L123-Q127 PolarHBondContact O-N 3.44Å; V124-Q127 PolarHBondContact O-N 2.93Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 3.03Å; Q127-H129 VanDerWaalsContact C-N 3.28Å; Q127-H129 PolarHBondContact O-N 3.25Å; Q127-S130 WeakPolarHBondContact CA-OG 3.39Å; Q127-S130 PolarHBondContact O-N 3.03Å; Q127-S130 PolarHBondContact O-OG 2.98Å; Q127-E131 PolarHBondContact O-N 2.97Å
128K78.1Confident83.4Confident146 Ų146112.6 Ų112.664%0.63556%0.56SS**Hα-helixtrans-63.2-30.3175.3-73.1175179.51780113.7V124 L125V124-K128 HydrophobicContact CG1-CD 4.33Å; V124-K128 WeakPolarHBondContact O-CG 3.25Å; V124-K128 PolarHBondContact O-N 3.16Å; L125-K128 PolarHBondContact O-N 2.76Å
129H69.3Low83.3Confident160 Ų160115.4 Ų115.474%0.74156%0.564SS**Hα-helixtrans-91-14.3176.9-75.2-64.2000114.2L125 R126 Q127L125-H129 PolarHBondContact O-CD2 2.87Å; L125-H129 PolarHBondContact O-N 3.09Å; R126-H129 CarbonylContact O-C 3.53Å; R126-H129 PolarHBondContact O-N 3.33Å; Q127-H129 VanDerWaalsContact C-N 3.28Å; Q127-H129 PolarHBondContact O-N 3.25Å
130S67.6Low83.3Confident85 Ų85113.8 Ų113.859%0.59456%0.557SS**Hα-helixtrans-83.2-20.9173.358.40000113.4R126 Q127 P132R126-S130 WeakPolarHBondContact O-CB 3.31Å; R126-S130 PolarHBondContact O-N 3.23Å; R126-S130 PolarHBondContact O-OG 3.28Å; Q127-S130 WeakPolarHBondContact CA-OG 3.39Å; Q127-S130 PolarHBondContact O-N 3.03Å; Q127-S130 PolarHBondContact O-OG 2.98Å; S130-P132 VanDerWaalsContact O-CD 3.28Å; S130-P132 WeakPolarHBondContact O-CD 3.28Å
131E66.6Low83.4Confident137 Ų137115.8 Ų115.864%0.6456%0.557SS**SBendtrans-61.4113.9167.6-70.5-79.9131.700109.1Q127 S133Q127-E131 PolarHBondContact O-N 2.97Å; E131-S133 PolarHBondContact O-N 3.16Å; E131-S133 VanDerWaalsContact O-N 3.11Å
132P65.2Low83.5Confident106 Ų106115.7 Ų115.769%0.68856%0.557SS**  trans-63.6118.7176.925.9-32.4000108.9S130 R134S130-P132 VanDerWaalsContact O-CD 3.28Å; S130-P132 WeakPolarHBondContact O-CD 3.28Å; P132-R134 PolarHBondContact O-N 2.88Å; P132-R134 VanDerWaalsContact O-N 3.13Å
133S75.3Confident83.8Confident65 Ų65115.5 Ų115.546%0.45556%0.556SS.*  trans-51.1123-177.4176.50000110.8E131 F135 R136 A137E131-S133 PolarHBondContact O-N 3.16Å; E131-S133 VanDerWaalsContact O-N 3.11Å; S133-F135 PolarHBondContact O-N 3.39Å; S133-R136 WeakPolarHBondContact O-CA 3.46Å; S133-R136 VanDerWaalsContact O-CB 3.24Å; S133-R136 WeakPolarHBondContact O-CB 3.07Å; S133-R136 PolarHBondContact O-N 3.3Å; S133-A137 PolarHBondContact O-N 3.21Å
134R80.7Confident84.1Confident198 Ų198116.5 Ų116.575%0.74755%0.552SS**Hα-helixtrans-50.6-34.3178173.1178.4155.3-170.9-6.5112.6P132 A137 L138P132-R134 PolarHBondContact O-N 2.88Å; P132-R134 VanDerWaalsContact O-N 3.13Å; R134-A137 PolarHBondContact O-N 3.08Å; R134-L138 HydrophobicContact CG-CD1 4.38Å; R134-L138 WeakPolarHBondContact O-CG 3.37Å; R134-L138 PolarHBondContact O-N 2.79Å; R134-L138 VanDerWaalsContact O-N 3.08Å
135F83.7Confident84.6Confident140 Ų140116.3 Ų116.361%0.61455%0.548SS*.Hα-helixtrans-65.6-38.4174.6-66.5-74.4000112.8S133 L138 Y139S133-F135 PolarHBondContact O-N 3.39Å; F135-L138 PolarHBondContact O-N 3.13Å; F135-Y139 HydrophobicContact CB-CE2 4.42Å; F135-Y139 WeakPolarHBondContact O-CD2 3.24Å; F135-Y139 PolarHBondContact O-N 2.8Å
136R87.2Confident85.2Confident156 Ų156117.5 Ų117.559%0.58956%0.555SS**Hα-helixtrans-62-44.2174.4178.5-180171168.51.2110.8S133 L138 Y139 E140S133-R136 WeakPolarHBondContact O-CA 3.46Å; S133-R136 VanDerWaalsContact O-CB 3.24Å; S133-R136 WeakPolarHBondContact O-CB 3.07Å; S133-R136 PolarHBondContact O-N 3.3Å; R136-L138 VanDerWaalsContact C-N 3.34Å; R136-L138 PolarHBondContact O-N 2.75Å; R136-Y139 PolarHBondContact O-N 2.84Å; R136-E140 HydrophobicContact CG-CG 4.28Å; R136-E140 IonicContact CZ-OE1 3.66Å; R136-E140 VanDerWaalsContact CZ-OE1 3.26Å; R136-E140 IonicContact NE-OE1 3.73Å; R136-E140 PolarHBondContact NE-OE1 2.97Å; R136-E140 IonicContact NE-OE2 3.65Å; R136-E140 IonicContact NH2-OE1 2.69Å; R136-E140 PolarHBondContact NH2-OE1 2.85Å; R136-E140 VanDerWaalsContact O-CB 3.32Å; R136-E140 WeakPolarHBondContact O-CB 3.34Å; R136-E140 WeakPolarHBondContact O-CG 3.4Å; R136-E140 PolarHBondContact O-N 3.44Å
137A88Confident85.8Confident53 Ų53116.6 Ų116.644%0.43855%0.551SS.*Hα-helixtrans-62.5-39.1176.700000112.5S133 R134 E140 Q141S133-A137 PolarHBondContact O-N 3.21Å; R134-A137 PolarHBondContact O-N 3.08Å; A137-E140 PolarHBondContact O-N 3.33Å; A137-Q141 PolarHBondContact O-N 3.17Å
138L91.9Very high86.7Confident86 Ų86114.8 Ų114.845%0.4555%0.545SS..Hα-helixtrans-65.1-45.8174.4-70.1169.6000112.1R134 F135 R136 Q141 E142R134-L138 HydrophobicContact CG-CD1 4.38Å; R134-L138 WeakPolarHBondContact O-CG 3.37Å; R134-L138 PolarHBondContact O-N 2.79Å; R134-L138 VanDerWaalsContact O-N 3.08Å; F135-L138 PolarHBondContact O-N 3.13Å; R136-L138 VanDerWaalsContact C-N 3.34Å; R136-L138 PolarHBondContact O-N 2.75Å; L138-Q141 WeakPolarHBondContact O-CB 3.2Å; L138-Q141 PolarHBondContact O-N 2.73Å; L138-Q141 VanDerWaalsContact O-N 3.16Å; L138-E142 PolarHBondContact O-N 2.89Å
139Y93.4Very high87.6Confident159 Ų159110.5 Ų110.562%0.62454%0.537SS*.Hα-helixtrans-66.6-35.6175-70.8-58.8000112.7F135 R136 Q141 E142 I143F135-Y139 HydrophobicContact CB-CE2 4.42Å; F135-Y139 WeakPolarHBondContact O-CD2 3.24Å; F135-Y139 PolarHBondContact O-N 2.8Å; R136-Y139 PolarHBondContact O-N 2.84Å; Y139-Q141 PolarHBondContact O-N 2.98Å; Y139-E142 PolarHBondContact O-N 3.39Å; Y139-I143 VanDerWaalsContact O-CB 3.29Å; Y139-I143 WeakPolarHBondContact O-CB 3.4Å; Y139-I143 WeakPolarHBondContact O-CD1 3.42Å; Y139-I143 WeakPolarHBondContact O-CG1 3.37Å; Y139-I143 PolarHBondContact O-N 3.47Å
140E94.1Very high89Confident90 Ų90105.5 Ų105.542%0.42152%0.523SS..Hα-helixtrans-70.4-19.5173.3-75.2174.9169.300112.7R136 A137 R144R136-E140 HydrophobicContact CG-CG 4.28Å; R136-E140 IonicContact CZ-OE1 3.66Å; R136-E140 VanDerWaalsContact CZ-OE1 3.26Å; R136-E140 IonicContact NE-OE1 3.73Å; R136-E140 PolarHBondContact NE-OE1 2.97Å; R136-E140 IonicContact NE-OE2 3.65Å; R136-E140 IonicContact NH2-OE1 2.69Å; R136-E140 PolarHBondContact NH2-OE1 2.85Å; R136-E140 VanDerWaalsContact O-CB 3.32Å; R136-E140 WeakPolarHBondContact O-CB 3.34Å; R136-E140 WeakPolarHBondContact O-CG 3.4Å; R136-E140 PolarHBondContact O-N 3.44Å; A137-E140 PolarHBondContact O-N 3.33Å; E140-R144 WeakPolarHBondContact O-CG 3.48Å; E140-R144 PolarHBondContact O-NE 3.34Å
141Q95.8Very high90.4Very high93 Ų93106.6 Ų106.644%0.43552%0.519SS..Hα-helixtrans-78.9-54.5166.6178.5172.7-13.300111.1A137 L138 Y139 I143 R144 D145A137-Q141 PolarHBondContact O-N 3.17Å; L138-Q141 WeakPolarHBondContact O-CB 3.2Å; L138-Q141 PolarHBondContact O-N 2.73Å; L138-Q141 VanDerWaalsContact O-N 3.16Å; Y139-Q141 PolarHBondContact O-N 2.98Å; Q141-I143 PolarHBondContact O-N 2.89Å; Q141-R144 WeakPolarHBondContact O-CA 3.4Å; Q141-R144 WeakPolarHBondContact O-CB 3.25Å; Q141-R144 PolarHBondContact O-N 3.39Å; Q141-D145 VanDerWaalsContact CG-OD2 3.26Å; Q141-D145 WeakPolarHBondContact CG-OD2 3.35Å; Q141-D145 PolarHBondContact NE2-OD2 3.41Å; Q141-D145 PolarHBondContact O-N 2.91Å
142E96.9Very high91.9Very high108 Ų108104.3 Ų104.351%0.50551%0.511SS..Hα-helixtrans-52.3-42.3178.2-169.968.8-155.700111.9L138 Y139 R144 D145 L146L138-E142 PolarHBondContact O-N 2.89Å; Y139-E142 PolarHBondContact O-N 3.39Å; E142-R144 VanDerWaalsContact C-N 3.31Å; E142-R144 PolarHBondContact O-N 2.97Å; E142-D145 PolarHBondContact O-N 3.47Å; E142-L146 HydrophobicContact CG-CD1 4Å; E142-L146 HydrophobicContact CG-CG 4.46Å; E142-L146 VanDerWaalsContact O-CB 3.27Å; E142-L146 WeakPolarHBondContact O-CB 3.42Å; E142-L146 VanDerWaalsContact O-CG 3.22Å; E142-L146 WeakPolarHBondContact O-CG 3.31Å; E142-L146 PolarHBondContact O-N 2.79Å
143I97.1Very high93.4Very high79 Ų79101.7 Ų101.741%0.40550%0.498SS..Hα-helixtrans-67.1-27.8176.6-70.2165.9000112.8Y139 Q141 R147Y139-I143 VanDerWaalsContact O-CB 3.29Å; Y139-I143 WeakPolarHBondContact O-CB 3.4Å; Y139-I143 WeakPolarHBondContact O-CD1 3.42Å; Y139-I143 WeakPolarHBondContact O-CG1 3.37Å; Y139-I143 PolarHBondContact O-N 3.47Å; Q141-I143 PolarHBondContact O-N 2.89Å; I143-R147 VanDerWaalsContact CG2-CZ 3.49Å; I143-R147 WeakPolarHBondContact O-CB 3.39Å; I143-R147 WeakPolarHBondContact O-CD 3.41Å; I143-R147 WeakPolarHBondContact O-CG 3.27Å; I143-R147 PolarHBondContact O-N 3.48Å
144R97.6Very high94.5Very high134 Ų134101.9 Ų101.951%0.50650%0.497SS..Hα-helixtrans-76.1-46.3172.5-76.7178.7-66.6122.6-6110.6E140 Q141 E142 L146 R147 L148E140-R144 WeakPolarHBondContact O-CG 3.48Å; E140-R144 PolarHBondContact O-NE 3.34Å; Q141-R144 WeakPolarHBondContact O-CA 3.4Å; Q141-R144 WeakPolarHBondContact O-CB 3.25Å; Q141-R144 PolarHBondContact O-N 3.39Å; E142-R144 VanDerWaalsContact C-N 3.31Å; E142-R144 PolarHBondContact O-N 2.97Å; R144-L146 VanDerWaalsContact C-N 3.34Å; R144-L146 PolarHBondContact O-N 3.28Å; R144-R147 WeakPolarHBondContact O-CA 3.43Å; R144-R147 WeakPolarHBondContact O-CB 3.4Å; R144-R147 PolarHBondContact O-N 3.3Å; R144-L148 WeakPolarHBondContact O-CG 3.3Å; R144-L148 PolarHBondContact O-N 2.78Å
145D97.9Very high95.3Very high66 Ų6695.7 Ų95.735%0.35348%0.478SS..Hα-helixtrans-65.9-39.9-176.5-58.1-8.2000110.1Q141 E142 R147 L148 A149Q141-D145 VanDerWaalsContact CG-OD2 3.26Å; Q141-D145 WeakPolarHBondContact CG-OD2 3.35Å; Q141-D145 PolarHBondContact NE2-OD2 3.41Å; Q141-D145 PolarHBondContact O-N 2.91Å; E142-D145 PolarHBondContact O-N 3.47Å; D145-R147 VanDerWaalsContact C-N 3.33Å; D145-R147 PolarHBondContact O-N 2.94Å; D145-L148 PolarHBondContact O-N 3.05Å; D145-A149 WeakPolarHBondContact O-CB 3.4Å; D145-A149 PolarHBondContact O-N 2.94Å
146L97.8Very high95.9Very high106 Ų10694.9 Ų94.956%0.55548%0.477SS*.Hα-helixtrans-65.7-27.7170.5-71.8172.1000114.3E142 R144 A150E142-L146 HydrophobicContact CG-CD1 4Å; E142-L146 HydrophobicContact CG-CG 4.46Å; E142-L146 VanDerWaalsContact O-CB 3.27Å; E142-L146 WeakPolarHBondContact O-CB 3.42Å; E142-L146 VanDerWaalsContact O-CG 3.22Å; E142-L146 WeakPolarHBondContact O-CG 3.31Å; E142-L146 PolarHBondContact O-N 2.79Å; R144-L146 VanDerWaalsContact C-N 3.34Å; R144-L146 PolarHBondContact O-N 3.28Å; L146-A150 WeakPolarHBondContact O-CB 3.45Å; L146-A150 PolarHBondContact O-N 3.39Å
147R97.9Very high96.3Very high153 Ų15393.6 Ų93.658%0.57748%0.475SS*.Hα-helixtrans-76-43.3174.3-81.2171-174.8158.64.1111.4I143 R144 D145 A150 E151I143-R147 VanDerWaalsContact CG2-CZ 3.49Å; I143-R147 WeakPolarHBondContact O-CB 3.39Å; I143-R147 WeakPolarHBondContact O-CD 3.41Å; I143-R147 WeakPolarHBondContact O-CG 3.27Å; I143-R147 PolarHBondContact O-N 3.48Å; R144-R147 WeakPolarHBondContact O-CA 3.43Å; R144-R147 WeakPolarHBondContact O-CB 3.4Å; R144-R147 PolarHBondContact O-N 3.3Å; D145-R147 VanDerWaalsContact C-N 3.33Å; D145-R147 PolarHBondContact O-N 2.94Å; R147-A150 PolarHBondContact O-N 3.08Å; R147-A150 VanDerWaalsContact O-N 3.16Å; R147-E151 WeakPolarHBondContact O-CB 3.3Å; R147-E151 WeakPolarHBondContact O-CG 3.32Å; R147-E151 PolarHBondContact O-N 3.45Å
148L98.1Very high96.6Very high90 Ų9096.8 Ų96.847%0.47148%0.481SS..Hα-helixtrans-58.8-50.3174.5-68171.7000110.1R144 D145 A150 E151 D152R144-L148 WeakPolarHBondContact O-CG 3.3Å; R144-L148 PolarHBondContact O-N 2.78Å; D145-L148 PolarHBondContact O-N 3.05Å; L148-A150 PolarHBondContact O-N 2.89Å; L148-E151 CarbonylContact O-C 3.6Å; L148-E151 PolarHBondContact O-N 2.79Å; L148-D152 WeakPolarHBondContact O-CB 3.38Å; L148-D152 VanDerWaalsContact O-CG 3.25Å; L148-D152 PolarHBondContact O-N 2.81Å
149A97.6Very high96.7Very high57 Ų5794.7 Ų94.747%0.47148%0.476SS..Hα-helixtrans-58.6-32.5175.700000113.7D145 A153D145-A149 WeakPolarHBondContact O-CB 3.4Å; D145-A149 PolarHBondContact O-N 2.94Å; A149-A153 VanDerWaalsContact O-CB 3.26Å; A149-A153 WeakPolarHBondContact O-CB 3.33Å; A149-A153 PolarHBondContact O-N 3.28Å; A149-A153 VanDerWaalsContact O-N 3.08Å
150A97.8Very high96.6Very high55 Ų5592.2 Ų92.246%0.45547%0.473SS..Hα-helixtrans-74.4-38.817400000112.6L146 R147 L148 T154L146-A150 WeakPolarHBondContact O-CB 3.45Å; L146-A150 PolarHBondContact O-N 3.39Å; R147-A150 PolarHBondContact O-N 3.08Å; R147-A150 VanDerWaalsContact O-N 3.16Å; L148-A150 PolarHBondContact O-N 2.89Å; A150-T154 WeakPolarHBondContact O-CG2 3.25Å; A150-T154 PolarHBondContact O-N 3.4Å; A150-T154 PolarHBondContact O-OG1 3.32Å
151E98.1Very high96.6Very high108 Ų10891.4 Ų91.451%0.50547%0.469SS..Hα-helixtrans-64.3-48.3174.7-74.3168.5-159.800110.3R147 L148 A153 T154 N155R147-E151 WeakPolarHBondContact O-CB 3.3Å; R147-E151 WeakPolarHBondContact O-CG 3.32Å; R147-E151 PolarHBondContact O-N 3.45Å; L148-E151 CarbonylContact O-C 3.6Å; L148-E151 PolarHBondContact O-N 2.79Å; E151-A153 PolarHBondContact O-N 2.82Å; E151-T154 WeakPolarHBondContact CA-OG1 3.36Å; E151-T154 CarbonylContact O-C 3.58Å; E151-T154 WeakPolarHBondContact O-CA 3.31Å; E151-T154 PolarHBondContact O-N 2.88Å; E151-T154 PolarHBondContact O-OG1 2.93Å; E151-N155 PolarHBondContact O-N 2.92Å; E151-N155 PolarHBondContact O-ND2 2.92Å
152D97.8Very high96.3Very high89 Ų8988.9 Ų88.948%0.47647%0.469SS..Hα-helixtrans-57.4-50.9175.4-65.1-29.8000111.4L148 T154 N155 E156L148-D152 WeakPolarHBondContact O-CB 3.38Å; L148-D152 VanDerWaalsContact O-CG 3.25Å; L148-D152 PolarHBondContact O-N 2.81Å; D152-T154 PolarHBondContact O-N 3.12Å; D152-N155 WeakPolarHBondContact O-CA 3.41Å; D152-N155 WeakPolarHBondContact O-CB 3.47Å; D152-N155 PolarHBondContact O-N 3.4Å; D152-E156 PolarHBondContact O-N 3.16Å
153A97Very high96.1Very high50 Ų5089.6 Ų89.641%0.41347%0.472SS..Hα-helixtrans-61.7-28.9175.500000113.3A149 E151 K157A149-A153 VanDerWaalsContact O-CB 3.26Å; A149-A153 WeakPolarHBondContact O-CB 3.33Å; A149-A153 PolarHBondContact O-N 3.28Å; A149-A153 VanDerWaalsContact O-N 3.08Å; E151-A153 PolarHBondContact O-N 2.82Å; A153-K157 VanDerWaalsContact O-CB 3.22Å; A153-K157 WeakPolarHBondContact O-CB 3.42Å; A153-K157 PolarHBondContact O-N 2.84Å; A153-K157 VanDerWaalsContact O-N 3.12Å
154T97.6Very high95.8Very high69 Ų6992 Ų9242%0.42348%0.476SS..Hα-helixtrans-76.2-28171.756.80000113.5A150 E151 D152 Q158A150-T154 WeakPolarHBondContact O-CG2 3.25Å; A150-T154 PolarHBondContact O-N 3.4Å; A150-T154 PolarHBondContact O-OG1 3.32Å; E151-T154 WeakPolarHBondContact CA-OG1 3.36Å; E151-T154 CarbonylContact O-C 3.58Å; E151-T154 WeakPolarHBondContact O-CA 3.31Å; E151-T154 PolarHBondContact O-N 2.88Å; E151-T154 PolarHBondContact O-OG1 2.93Å; D152-T154 PolarHBondContact O-N 3.12Å; T154-Q158 WeakPolarHBondContact O-CB 3.47Å; T154-Q158 VanDerWaalsContact O-CG 3.28Å; T154-Q158 WeakPolarHBondContact O-CG 3.07Å; T154-Q158 PolarHBondContact O-N 2.82Å; T154-Q158 VanDerWaalsContact O-N 3.12Å; T154-Q158 PolarHBondContact O-NE2 3.36Å
155N97.1Very high95.6Very high68 Ų6890.5 Ų90.536%0.36448%0.475SS..Hα-helixtrans-74.1-48.2175.1-63.7-31.4000110.4E151 D152 K157 Q158 A159E151-N155 PolarHBondContact O-N 2.92Å; E151-N155 PolarHBondContact O-ND2 2.92Å; D152-N155 WeakPolarHBondContact O-CA 3.41Å; D152-N155 WeakPolarHBondContact O-CB 3.47Å; D152-N155 PolarHBondContact O-N 3.4Å; N155-K157 VanDerWaalsContact C-N 3.31Å; N155-K157 PolarHBondContact O-N 3.33Å; N155-Q158 WeakPolarHBondContact O-CB 3.34Å; N155-Q158 PolarHBondContact O-N 3.37Å; N155-A159 PolarHBondContact O-N 2.88Å
156E97.3Very high95.2Very high123 Ų12388.9 Ų88.958%0.57547%0.474SS*.Hα-helixtrans-54.8-47172.5-71.2177.5176.800111.3D152 Q158 A159 L160D152-E156 PolarHBondContact O-N 3.16Å; E156-Q158 VanDerWaalsContact C-N 3.32Å; E156-Q158 PolarHBondContact O-N 2.97Å; E156-A159 PolarHBondContact O-N 3.48Å; E156-L160 WeakPolarHBondContact O-CG 3.49Å; E156-L160 PolarHBondContact O-N 3.4Å
157K96.1Very high94.8Very high129 Ų12989.6 Ų89.656%0.56148%0.478SS*.Hα-helixtrans-59.3-41.4175.6-178.7-173.5169.6-171.20112.2A153 N155 Q161A153-K157 VanDerWaalsContact O-CB 3.22Å; A153-K157 WeakPolarHBondContact O-CB 3.42Å; A153-K157 PolarHBondContact O-N 2.84Å; A153-K157 VanDerWaalsContact O-N 3.12Å; N155-K157 VanDerWaalsContact C-N 3.31Å; N155-K157 PolarHBondContact O-N 3.33Å; K157-Q161 WeakPolarHBondContact O-CB 3.21Å; K157-Q161 WeakPolarHBondContact O-CG 3.48Å; K157-Q161 PolarHBondContact O-N 3.48Å
158Q93.9Very high94.2Very high120 Ų12085.4 Ų85.456%0.56146%0.464SS*.Hα-helixtrans-67.3-40.6178.1-79.516868.900111.9T154 N155 E156 Q161 G162T154-Q158 WeakPolarHBondContact O-CB 3.47Å; T154-Q158 VanDerWaalsContact O-CG 3.28Å; T154-Q158 WeakPolarHBondContact O-CG 3.07Å; T154-Q158 PolarHBondContact O-N 2.82Å; T154-Q158 VanDerWaalsContact O-N 3.12Å; T154-Q158 PolarHBondContact O-NE2 3.36Å; N155-Q158 WeakPolarHBondContact O-CB 3.34Å; N155-Q158 PolarHBondContact O-N 3.37Å; E156-Q158 VanDerWaalsContact C-N 3.32Å; E156-Q158 PolarHBondContact O-N 2.97Å; Q158-Q161 PolarHBondContact O-N 3.04Å; Q158-G162 PolarHBondContact O-N 3.27Å
159A93.9Very high93.8Very high42 Ų4286.7 Ų86.735%0.34747%0.468SS..Hα-helixtrans-59.8-51.9174.200000111.3N155 E156 Q161 G162 E163N155-A159 PolarHBondContact O-N 2.88Å; E156-A159 PolarHBondContact O-N 3.48Å; A159-Q161 VanDerWaalsContact C-N 3.26Å; A159-Q161 PolarHBondContact O-N 3.46Å; A159-G162 PolarHBondContact O-N 3.28Å; A159-E163 PolarHBondContact O-N 2.8Å
160L92.1Very high93.5Very high108 Ų10887.6 Ų87.657%0.56547%0.468SS*.Hα-helixtrans-61.8-30.4176.5-68.5172.6000113.1E156 R164E156-L160 WeakPolarHBondContact O-CG 3.49Å; E156-L160 PolarHBondContact O-N 3.4Å; L160-R164 WeakPolarHBondContact O-CB 3.43Å; L160-R164 PolarHBondContact O-N 2.94Å
161Q92.8Very high93.1Very high72 Ų7289.3 Ų89.334%0.33647%0.469SS..Hα-helixtrans-69.3-42.3172.5-76.9-178.1-79.500111.6K157 Q158 A159 R164 E165K157-Q161 WeakPolarHBondContact O-CB 3.21Å; K157-Q161 WeakPolarHBondContact O-CG 3.48Å; K157-Q161 PolarHBondContact O-N 3.48Å; Q158-Q161 PolarHBondContact O-N 3.04Å; A159-Q161 VanDerWaalsContact C-N 3.26Å; A159-Q161 PolarHBondContact O-N 3.46Å; Q161-R164 PolarHBondContact O-N 3.17Å; Q161-E165 WeakPolarHBondContact O-CB 3.45Å; Q161-E165 VanDerWaalsContact O-CG 3.32Å; Q161-E165 WeakPolarHBondContact O-CG 3.4Å; Q161-E165 PolarHBondContact O-N 3.39Å
162G89Confident92.6Very high41 Ų4190.3 Ų90.342%0.42347%0.468SS..Hα-helixtrans-63.6-43.7174.300000112.9Q158 A159 R164 E165 G166Q158-G162 PolarHBondContact O-N 3.27Å; A159-G162 PolarHBondContact O-N 3.28Å; G162-R164 PolarHBondContact O-N 2.91Å; G162-E165 PolarHBondContact O-N 3.18Å; G162-G166 PolarHBondContact O-N 3.26Å
163E93.8Very high92.2Very high122 Ų12290.2 Ų90.257%0.5747%0.468SS*.Hα-helixtrans-59.6-44.9173.3-72.2174.2-166.300111.8A159 G166 L167A159-E163 PolarHBondContact O-N 2.8Å; E163-G166 PolarHBondContact O-N 2.99Å; E163-L167 WeakPolarHBondContact O-CB 3.4Å; E163-L167 WeakPolarHBondContact O-CG 3.48Å; E163-L167 PolarHBondContact O-N 2.62Å
164R90.9Very high91.6Very high129 Ų12993.4 Ų93.449%0.48748%0.477SS..Hα-helixtrans-62.1-44175.9-166-162.476.1-159.8-11.2111.6L160 Q161 G162 L167 E168L160-R164 WeakPolarHBondContact O-CB 3.43Å; L160-R164 PolarHBondContact O-N 2.94Å; Q161-R164 PolarHBondContact O-N 3.17Å; G162-R164 PolarHBondContact O-N 2.91Å; R164-L167 PolarHBondContact O-N 3.31Å; R164-E168 IonicContact CZ-OE1 2.65Å; R164-E168 IonicContact NE-OE1 3.87Å; R164-E168 PolarHBondContact NE-OE1 2.76Å; R164-E168 IonicContact NH2-OE1 3.64Å; R164-E168 WeakPolarHBondContact O-CB 3.37Å; R164-E168 VanDerWaalsContact O-CG 3.3Å; R164-E168 WeakPolarHBondContact O-CG 3.34Å; R164-E168 PolarHBondContact O-N 3.32Å
165E92.4Very high91.2Very high103 Ų10395 Ų9548%0.48148%0.48SS..Hα-helixtrans-63.9-40.4178.9-75.6168.9-165.900111.5Q161 G162 E168 E169Q161-E165 WeakPolarHBondContact O-CB 3.45Å; Q161-E165 VanDerWaalsContact O-CG 3.32Å; Q161-E165 WeakPolarHBondContact O-CG 3.4Å; Q161-E165 PolarHBondContact O-N 3.39Å; G162-E165 PolarHBondContact O-N 3.18Å; E165-E168 PolarHBondContact O-N 2.91Å; E165-E169 PolarHBondContact O-N 2.85Å
166G89.8Confident90.7Very high32 Ų3294.2 Ų94.233%0.3348%0.483SS..Hα-helixtrans-63.8-43.217200000113.4G162 E163 E169 T170G162-G166 PolarHBondContact O-N 3.26Å; E163-G166 PolarHBondContact O-N 2.99Å; G166-E169 PolarHBondContact O-N 2.92Å; G166-T170 WeakPolarHBondContact O-CG2 3.27Å; G166-T170 PolarHBondContact O-N 3.41Å; G166-T170 PolarHBondContact O-OG1 3.47Å
167L89.1Confident90.3Very high122 Ų12297 Ų9764%0.63949%0.488SS*.Hα-helixtrans-65.1-36.9174.3-72.4173.9000112.5E163 R164 E169 T170 L171E163-L167 WeakPolarHBondContact O-CB 3.4Å; E163-L167 WeakPolarHBondContact O-CG 3.48Å; E163-L167 PolarHBondContact O-N 2.62Å; R164-L167 PolarHBondContact O-N 3.31Å; L167-E169 VanDerWaalsContact C-N 3.34Å; L167-T170 PolarHBondContact O-OG1 3.5Å; L167-L171 VanDerWaalsContact O-CB 3.26Å; L167-L171 WeakPolarHBondContact O-CB 3.34Å; L167-L171 PolarHBondContact O-N 2.86Å
168E86.1Confident90Very high64 Ų6498.8 Ų98.830%0.29949%0.492SS..Hα-helixtrans-66.7-35172.9-72.5176.6-145.500111.9R164 E165 R172R164-E168 IonicContact CZ-OE1 2.65Å; R164-E168 IonicContact NE-OE1 3.87Å; R164-E168 PolarHBondContact NE-OE1 2.76Å; R164-E168 IonicContact NH2-OE1 3.64Å; R164-E168 WeakPolarHBondContact O-CB 3.37Å; R164-E168 VanDerWaalsContact O-CG 3.3Å; R164-E168 WeakPolarHBondContact O-CG 3.34Å; R164-E168 PolarHBondContact O-N 3.32Å; E165-E168 PolarHBondContact O-N 2.91Å; E168-R172 VanDerWaalsContact CB-NH1 3.34Å; E168-R172 VanDerWaalsContact O-CG 3.26Å; E168-R172 WeakPolarHBondContact O-CG 3.36Å; E168-R172 PolarHBondContact O-N 2.83Å; E168-R172 PolarHBondContact O-NH1 2.88Å; E168-R172 IonicContact OE2-CZ 3.55Å; E168-R172 IonicContact OE2-NH1 2.65Å; E168-R172 IonicContact OE2-NH2 2.62Å; E168-R172 PolarHBondContact OE2-NH2 2.86Å
169E90.4Very high89.9Confident117 Ų11799 Ų9955%0.54749%0.494SS..Hα-helixtrans-69.3-45.7174.8-175171.7-170.600112.1E165 G166 L167 L171 R172 N173E165-E169 PolarHBondContact O-N 2.85Å; G166-E169 PolarHBondContact O-N 2.92Å; L167-E169 VanDerWaalsContact C-N 3.34Å; E169-L171 VanDerWaalsContact C-N 3.29Å; E169-L171 PolarHBondContact O-N 3.4Å; E169-R172 PolarHBondContact O-N 3.39Å; E169-N173 WeakPolarHBondContact O-CB 3.47Å; E169-N173 VanDerWaalsContact O-CG 3.26Å; E169-N173 PolarHBondContact O-N 3.45Å; E169-N173 PolarHBondContact O-ND2 3.36Å
170T90.3Very high89.6Confident76 Ų76103.8 Ų103.847%0.46651%0.508SS..Hα-helixtrans-61.7-38.9174.959.30000111.7G166 L167 N173 L174G166-T170 WeakPolarHBondContact O-CG2 3.27Å; G166-T170 PolarHBondContact O-N 3.41Å; G166-T170 PolarHBondContact O-OG1 3.47Å; L167-T170 PolarHBondContact O-OG1 3.5Å; T170-N173 PolarHBondContact O-N 3.43Å; T170-L174 WeakPolarHBondContact O-CB 3.35Å; T170-L174 WeakPolarHBondContact O-CG 3.34Å; T170-L174 PolarHBondContact O-N 2.87Å
171L88.9Confident89.5Confident91 Ų91104.7 Ų104.748%0.47651%0.51SS..Hα-helixtrans-62.4-44.2174-177.5149.4000112.2L167 E169 N173 L174 Q175L167-L171 VanDerWaalsContact O-CB 3.26Å; L167-L171 WeakPolarHBondContact O-CB 3.34Å; L167-L171 PolarHBondContact O-N 2.86Å; E169-L171 VanDerWaalsContact C-N 3.29Å; E169-L171 PolarHBondContact O-N 3.4Å; L171-N173 VanDerWaalsContact C-N 3.35Å; L171-N173 PolarHBondContact O-N 3.39Å; L171-L174 PolarHBondContact O-N 3.22Å; L171-Q175 HydrophobicContact CD2-CG 4.26Å; L171-Q175 WeakPolarHBondContact O-CB 3.32Å; L171-Q175 WeakPolarHBondContact O-CG 3.16Å; L171-Q175 PolarHBondContact O-N 2.94Å
172R89.2Confident89.2Confident129 Ų129103 Ų10349%0.48751%0.505SS..Hα-helixtrans-62.9-40.6175-73.2171.7-164.41116.6111.9E168 E169 Q175 A176E168-R172 VanDerWaalsContact CB-NH1 3.34Å; E168-R172 VanDerWaalsContact O-CG 3.26Å; E168-R172 WeakPolarHBondContact O-CG 3.36Å; E168-R172 PolarHBondContact O-N 2.83Å; E168-R172 PolarHBondContact O-NH1 2.88Å; E168-R172 IonicContact OE2-CZ 3.55Å; E168-R172 IonicContact OE2-NH1 2.65Å; E168-R172 IonicContact OE2-NH2 2.62Å; E168-R172 PolarHBondContact OE2-NH2 2.86Å; E169-R172 PolarHBondContact O-N 3.39Å; R172-Q175 PolarHBondContact O-N 3.03Å; R172-A176 WeakPolarHBondContact O-CB 3.34Å; R172-A176 PolarHBondContact O-N 3.5Å
173N88Confident89.2Confident88 Ų88106 Ų10647%0.47151%0.511SS..Hα-helixtrans-66.6-38177.7-69.5-23.4000112E169 T170 L171 R177E169-N173 WeakPolarHBondContact O-CB 3.47Å; E169-N173 VanDerWaalsContact O-CG 3.26Å; E169-N173 PolarHBondContact O-N 3.45Å; E169-N173 PolarHBondContact O-ND2 3.36Å; T170-N173 PolarHBondContact O-N 3.43Å; L171-N173 VanDerWaalsContact C-N 3.35Å; L171-N173 PolarHBondContact O-N 3.39Å; N173-R177 WeakPolarHBondContact O-CG 3.21Å; N173-R177 PolarHBondContact O-N 2.93Å; N173-R177 VanDerWaalsContact O-N 3.11Å
174L85Confident88.7Confident116 Ų116103 Ų10361%0.60750%0.503SS*.Hα-helixtrans-68.1-39.5172.9-72.4171.1000112.2T170 L171 R177 Y178T170-L174 WeakPolarHBondContact O-CB 3.35Å; T170-L174 WeakPolarHBondContact O-CG 3.34Å; T170-L174 PolarHBondContact O-N 2.87Å; L171-L174 PolarHBondContact O-N 3.22Å; L174-R177 PolarHBondContact O-N 3.45Å; L174-Y178 WeakPolarHBondContact O-CB 3.27Å; L174-Y178 PolarHBondContact O-N 3.22Å
175Q90.1Very high88.7Confident103 Ų103101.9 Ų101.948%0.48150%0.499SS..Hα-helixtrans-61.8-46.6173.9-76.6177.7-29.300111.8L171 R172 R177 Y178 E179L171-Q175 HydrophobicContact CD2-CG 4.26Å; L171-Q175 WeakPolarHBondContact O-CB 3.32Å; L171-Q175 WeakPolarHBondContact O-CG 3.16Å; L171-Q175 PolarHBondContact O-N 2.94Å; R172-Q175 PolarHBondContact O-N 3.03Å; Q175-R177 PolarHBondContact O-N 3.2Å; Q175-Y178 WeakPolarHBondContact O-CB 3.46Å; Q175-Y178 PolarHBondContact O-N 2.67Å; Q175-E179 WeakPolarHBondContact O-CG 3.42Å; Q175-E179 PolarHBondContact O-N 2.73Å
176A86.1Confident88.6Confident52 Ų52101.7 Ų101.743%0.4350%0.498SS..Hα-helixtrans-60.9-42.8177.500000112.3R172 E179 E180R172-A176 WeakPolarHBondContact O-CB 3.34Å; R172-A176 PolarHBondContact O-N 3.5Å; A176-E179 PolarHBondContact O-N 2.84Å; A176-E180 WeakPolarHBondContact O-CB 3.42Å; A176-E180 PolarHBondContact O-N 3.42Å
177R88.6Confident88.5Confident181 Ų181105.5 Ų105.568%0.68351%0.51SS*.Hα-helixtrans-63.8-38.7174.1-74.5-179.6179.6-166.60.1112.8N173 L174 Q175 E180 E181N173-R177 WeakPolarHBondContact O-CG 3.21Å; N173-R177 PolarHBondContact O-N 2.93Å; N173-R177 VanDerWaalsContact O-N 3.11Å; L174-R177 PolarHBondContact O-N 3.45Å; Q175-R177 PolarHBondContact O-N 3.2Å; R177-E180 PolarHBondContact O-N 2.93Å; R177-E181 WeakPolarHBondContact O-CB 3.4Å; R177-E181 PolarHBondContact O-N 3.39Å
178Y88.9Confident88.2Confident166 Ų166101.7 Ų101.765%0.65150%0.497SS*.Hα-helixtrans-65.5-41.8175.5173.4-95.7000111.8L174 Q175 E181 V182L174-Y178 WeakPolarHBondContact O-CB 3.27Å; L174-Y178 PolarHBondContact O-N 3.22Å; Q175-Y178 WeakPolarHBondContact O-CB 3.46Å; Q175-Y178 PolarHBondContact O-N 2.67Å; Y178-E181 PolarHBondContact O-N 3.24Å; Y178-V182 HydrophobicContact CD1-CG2 4.29Å; Y178-V182 HydrophobicContact CD2-CG2 4.45Å; Y178-V182 HydrophobicContact CE1-CG2 3.81Å; Y178-V182 HydrophobicContact CE2-CG2 4Å; Y178-V182 WeakPolarHBondContact O-CB 3.27Å; Y178-V182 VanDerWaalsContact O-CG2 3.27Å; Y178-V182 WeakPolarHBondContact O-CG2 3.38Å; Y178-V182 PolarHBondContact O-N 3.32Å
179E92.1Very high88.4Confident126 Ų126103 Ų10359%0.58950%0.503SS*.Hα-helixtrans-63.4-41.6174.9-71.5174.6-179.200111.8Q175 A176 V182 L183Q175-E179 WeakPolarHBondContact O-CG 3.42Å; Q175-E179 PolarHBondContact O-N 2.73Å; A176-E179 PolarHBondContact O-N 2.84Å; E179-V182 PolarHBondContact O-N 3.47Å; E179-L183 WeakPolarHBondContact O-CG 3.34Å; E179-L183 PolarHBondContact O-N 2.85Å; E179-L183 VanDerWaalsContact O-N 3.1Å
180E87.7Confident88.6Confident141 Ų14199 Ų9966%0.65949%0.493SS*.Hα-helixtrans-63-44.3174.1-174.8171.5-156.100112.3A176 R177 L183 S184A176-E180 WeakPolarHBondContact O-CB 3.42Å; A176-E180 PolarHBondContact O-N 3.42Å; R177-E180 PolarHBondContact O-N 2.93Å; E180-L183 PolarHBondContact O-N 2.93Å; E180-S184 WeakPolarHBondContact O-CB 3.23Å; E180-S184 PolarHBondContact O-N 3.41Å
181E90.9Very high88.6Confident127 Ų127102.8 Ų102.859%0.59350%0.499SS*.Hα-helixtrans-66.2-38177.5-167.761.8-135.700112.1R177 Y178 S184 R185R177-E181 WeakPolarHBondContact O-CB 3.4Å; R177-E181 PolarHBondContact O-N 3.39Å; Y178-E181 PolarHBondContact O-N 3.24Å; E181-S184 PolarHBondContact O-N 3.36Å; E181-R185 WeakPolarHBondContact O-CB 3.33Å; E181-R185 PolarHBondContact O-N 3.38Å
182V86.6Confident88.6Confident38 Ų38102.8 Ų102.823%0.2350%0.499CS..Hα-helixtrans-62.1-44.4174.4166.70000111.1Y178 E179 R185 E186Y178-V182 HydrophobicContact CD1-CG2 4.29Å; Y178-V182 HydrophobicContact CD2-CG2 4.45Å; Y178-V182 HydrophobicContact CE1-CG2 3.81Å; Y178-V182 HydrophobicContact CE2-CG2 4Å; Y178-V182 WeakPolarHBondContact O-CB 3.27Å; Y178-V182 VanDerWaalsContact O-CG2 3.27Å; Y178-V182 WeakPolarHBondContact O-CG2 3.38Å; Y178-V182 PolarHBondContact O-N 3.32Å; E179-V182 PolarHBondContact O-N 3.47Å; V182-R185 PolarHBondContact O-N 3.2Å; V182-E186 WeakPolarHBondContact O-CG 3.37Å; V182-E186 PolarHBondContact O-N 2.93Å
183L88.6Confident89Confident104 Ų104102.8 Ų102.855%0.54551%0.506SS..Hα-helixtrans-66.1-43.5176.3-69170.8000111.7E179 E180 R185 E186 D187E179-L183 WeakPolarHBondContact O-CG 3.34Å; E179-L183 PolarHBondContact O-N 2.85Å; E179-L183 VanDerWaalsContact O-N 3.1Å; E180-L183 PolarHBondContact O-N 2.93Å; L183-R185 VanDerWaalsContact C-N 3.32Å; L183-R185 PolarHBondContact O-N 3.39Å; L183-E186 PolarHBondContact O-N 2.71Å; L183-E186 VanDerWaalsContact O-N 3.16Å; L183-D187 PolarHBondContact O-N 3.42Å
184S82.6Confident89.3Confident59 Ų59105.3 Ų105.341%0.41352%0.515SS..Hα-helixtrans-57.3-43.6175179.60000112.1E180 E181 D187 A188E180-S184 WeakPolarHBondContact O-CB 3.23Å; E180-S184 PolarHBondContact O-N 3.41Å; E181-S184 PolarHBondContact O-N 3.36Å; S184-D187 PolarHBondContact O-N 2.97Å; S184-A188 WeakPolarHBondContact O-CB 3.4Å; S184-A188 PolarHBondContact O-N 2.93Å
185R91.1Very high89.7Confident104 Ų104103 Ų10339%0.39251%0.512SS..Hα-helixtrans-64.1-43.7174.3-175.7-16362.982.814.9111.8E181 V182 L183 A188 E189E181-R185 WeakPolarHBondContact O-CB 3.33Å; E181-R185 PolarHBondContact O-N 3.38Å; V182-R185 PolarHBondContact O-N 3.2Å; L183-R185 VanDerWaalsContact C-N 3.32Å; L183-R185 PolarHBondContact O-N 3.39Å; R185-A188 PolarHBondContact O-N 2.99Å; R185-E189 IonicContact CZ-OE1 2.73Å; R185-E189 IonicContact CZ-OE2 2.87Å; R185-E189 IonicContact NH1-OE1 3.26Å; R185-E189 PolarHBondContact NH1-OE1 2.89Å; R185-E189 IonicContact NH1-OE2 2.75Å; R185-E189 PolarHBondContact NH1-OE2 3.43Å; R185-E189 WeakPolarHBondContact O-CB 3.4Å; R185-E189 WeakPolarHBondContact O-CG 3.29Å; R185-E189 PolarHBondContact O-N 3.21Å
186E90.8Very high90Very high99 Ų99105.8 Ų105.846%0.46352%0.519SS..Hα-helixtrans-63-41.5176.6-73.7177.5-177.600111.9V182 L183 A188 E189 G190V182-E186 WeakPolarHBondContact O-CG 3.37Å; V182-E186 PolarHBondContact O-N 2.93Å; L183-E186 PolarHBondContact O-N 2.71Å; L183-E186 VanDerWaalsContact O-N 3.16Å; E186-A188 VanDerWaalsContact C-N 3.34Å; E186-A188 PolarHBondContact O-N 2.73Å; E186-E189 PolarHBondContact O-N 2.89Å; E186-G190 PolarHBondContact O-N 2.71Å
187D87.9Confident90.5Very high112 Ų112109.2 Ų109.260%0.59952%0.524SS*.Hα-helixtrans-66.9-32.4174-80.6-14.9000112.6L183 S184 R191L183-D187 PolarHBondContact O-N 3.42Å; S184-D187 PolarHBondContact O-N 2.97Å; D187-R191 WeakPolarHBondContact O-CG 3.47Å; D187-R191 PolarHBondContact O-N 3.23Å; D187-R191 PolarHBondContact O-NE 3.35Å
188A82.6Confident91Very high43 Ų43102.2 Ų102.236%0.35551%0.508SS..Hα-helixtrans-72.4-43.7173.800000112S184 R185 E186 R191 L192S184-A188 WeakPolarHBondContact O-CB 3.4Å; S184-A188 PolarHBondContact O-N 2.93Å; R185-A188 PolarHBondContact O-N 2.99Å; E186-A188 VanDerWaalsContact C-N 3.34Å; E186-A188 PolarHBondContact O-N 2.73Å; A188-R191 PolarHBondContact O-N 2.92Å; A188-L192 WeakPolarHBondContact O-CB 3.45Å; A188-L192 PolarHBondContact O-N 2.91Å
189E91.1Very high91.4Very high92 Ų9297.1 Ų97.143%0.4350%0.501SS..Hα-helixtrans-64.3-39.7175-76.1175-174.800111.7R185 E186 L192 M193R185-E189 IonicContact CZ-OE1 2.73Å; R185-E189 IonicContact CZ-OE2 2.87Å; R185-E189 IonicContact NH1-OE1 3.26Å; R185-E189 PolarHBondContact NH1-OE1 2.89Å; R185-E189 IonicContact NH1-OE2 2.75Å; R185-E189 PolarHBondContact NH1-OE2 3.43Å; R185-E189 WeakPolarHBondContact O-CB 3.4Å; R185-E189 WeakPolarHBondContact O-CG 3.29Å; R185-E189 PolarHBondContact O-N 3.21Å; E186-E189 PolarHBondContact O-N 2.89Å; E189-L192 PolarHBondContact O-N 3.49Å; E189-M193 WeakPolarHBondContact O-CB 3.32Å; E189-M193 VanDerWaalsContact O-CG 3.27Å; E189-M193 WeakPolarHBondContact O-CG 3.48Å; E189-M193 PolarHBondContact O-N 2.99Å
190G93.2Very high91.7Very high33 Ų3396.1 Ų96.134%0.3450%0.499SS..Hα-helixtrans-57.3-53.1172.200000112.1E186 L192 M193 E194E186-G190 PolarHBondContact O-N 2.71Å; G190-L192 VanDerWaalsContact C-N 3.31Å; G190-L192 PolarHBondContact O-N 3.48Å; G190-M193 PolarHBondContact O-N 2.89Å; G190-M193 VanDerWaalsContact O-N 3.17Å; G190-E194 WeakPolarHBondContact O-CG 3.45Å; G190-E194 PolarHBondContact O-N 3.22Å
191R90.4Very high92.2Very high155 Ų15594.4 Ų94.459%0.58549%0.491SS*.Hα-helixtrans-59.9-37.9176.3-75.1177.1-70.7153.1-5.3113D187 A188 E194 A195D187-R191 WeakPolarHBondContact O-CG 3.47Å; D187-R191 PolarHBondContact O-N 3.23Å; D187-R191 PolarHBondContact O-NE 3.35Å; A188-R191 PolarHBondContact O-N 2.92Å; R191-E194 PolarHBondContact O-N 3.24Å; R191-A195 WeakPolarHBondContact O-CB 3.39Å; R191-A195 PolarHBondContact O-N 2.92Å
192L90.1Very high92.5Very high91 Ų9191.2 Ų91.248%0.47649%0.487SS..Hα-helixtrans-65.9-41176-178.8157.4000111.6A188 E189 G190 A195 R196A188-L192 WeakPolarHBondContact O-CB 3.45Å; A188-L192 PolarHBondContact O-N 2.91Å; E189-L192 PolarHBondContact O-N 3.49Å; G190-L192 VanDerWaalsContact C-N 3.31Å; G190-L192 PolarHBondContact O-N 3.48Å; L192-A195 PolarHBondContact O-N 3.21Å; L192-R196 HydrophobicContact CD2-CG 4.29Å; L192-R196 WeakPolarHBondContact O-CG 3.46Å; L192-R196 PolarHBondContact O-N 3.45Å
193M95.8Very high93Very high129 Ų12992.2 Ų92.264%0.63550%0.499SS*.Hα-helixtrans-67.5-38.9176.1-71.3-69.6-77.200112.1E189 G190 K197E189-M193 WeakPolarHBondContact O-CB 3.32Å; E189-M193 VanDerWaalsContact O-CG 3.27Å; E189-M193 WeakPolarHBondContact O-CG 3.48Å; E189-M193 PolarHBondContact O-N 2.99Å; G190-M193 PolarHBondContact O-N 2.89Å; G190-M193 VanDerWaalsContact O-N 3.17Å; M193-K197 WeakPolarHBondContact O-CB 3.34Å; M193-K197 PolarHBondContact O-N 3.41Å
194E94.3Very high93.5Very high141 Ų14192.7 Ų92.766%0.65950%0.501SS*.Hα-helixtrans-63-44.8171.9-71.9-179.816900111.9G190 R191 K197 G198G190-E194 WeakPolarHBondContact O-CG 3.45Å; G190-E194 PolarHBondContact O-N 3.22Å; R191-E194 PolarHBondContact O-N 3.24Å; E194-K197 PolarHBondContact O-N 2.89Å; E194-G198 PolarHBondContact O-N 3.46Å
195A93.7Very high94.2Very high67 Ų6792.1 Ų92.155%0.55450%0.5SS*.Hα-helixtrans-62.9-42.6176.900000112.4R191 L192 G198 A199R191-A195 WeakPolarHBondContact O-CB 3.39Å; R191-A195 PolarHBondContact O-N 2.92Å; L192-A195 PolarHBondContact O-N 3.21Å; A195-G198 PolarHBondContact O-N 3.4Å; A195-A199 PolarHBondContact O-N 3.16Å
196R96.6Very high94.6Very high161 Ų16195 Ų9561%0.60851%0.511SS*.Hα-helixtrans-59.8-47.7173-77.6-178.5-178.9-106.31111.7L192 G198 A199 D200L192-R196 HydrophobicContact CD2-CG 4.29Å; L192-R196 WeakPolarHBondContact O-CG 3.46Å; L192-R196 PolarHBondContact O-N 3.45Å; R196-G198 VanDerWaalsContact C-N 3.31Å; R196-G198 PolarHBondContact O-N 3.49Å; R196-A199 WeakPolarHBondContact O-CB 3.47Å; R196-A199 PolarHBondContact O-N 2.92Å; R196-A199 VanDerWaalsContact O-N 3.12Å; R196-D200 PolarHBondContact O-N 3.46Å
197K98Very high94.9Very high124 Ų12491.9 Ų91.954%0.53950%0.502SS..Hα-helixtrans-60.2-40.7176.9-179.1175.2177.5-74.50112M193 E194 D200 E201M193-K197 WeakPolarHBondContact O-CB 3.34Å; M193-K197 PolarHBondContact O-N 3.41Å; E194-K197 PolarHBondContact O-N 2.89Å; K197-D200 PolarHBondContact O-N 2.94Å; K197-E201 WeakPolarHBondContact CE-OE1 3.41Å; K197-E201 IonicContact NZ-OE1 3.86Å; K197-E201 PolarHBondContact NZ-OE1 3.33Å; K197-E201 WeakPolarHBondContact O-CB 3.33Å; K197-E201 WeakPolarHBondContact O-CG 3.48Å; K197-E201 PolarHBondContact O-N 3.32Å
198G97.4Very high95.4Very high35 Ų3593.3 Ų93.336%0.36151%0.505SS..Hα-helixtrans-64.1-38.217400000113.1E194 A195 R196 A202E194-G198 PolarHBondContact O-N 3.46Å; A195-G198 PolarHBondContact O-N 3.4Å; R196-G198 VanDerWaalsContact C-N 3.31Å; R196-G198 PolarHBondContact O-N 3.49Å; G198-A202 VanDerWaalsContact O-CB 3.31Å; G198-A202 WeakPolarHBondContact O-CB 3.26Å; G198-A202 PolarHBondContact O-N 2.95Å
199A97.8Very high96.2Very high59 Ų5996.5 Ų96.549%0.48852%0.516SS..Hα-helixtrans-67.1-41.9174.100000112.2A195 R196 A202 A203A195-A199 PolarHBondContact O-N 3.16Å; R196-A199 WeakPolarHBondContact O-CB 3.47Å; R196-A199 PolarHBondContact O-N 2.92Å; R196-A199 VanDerWaalsContact O-N 3.12Å; A199-A202 PolarHBondContact O-N 3.34Å; A199-A203 WeakPolarHBondContact O-CB 3.35Å; A199-A203 PolarHBondContact O-N 2.9Å
200D98.1Very high96.5Very high105 Ų10595.9 Ų95.956%0.56151%0.513SS*.Hα-helixtrans-63.2-44174.7-68.7-28.5000111.4R196 K197 A203 L204R196-D200 PolarHBondContact O-N 3.46Å; K197-D200 PolarHBondContact O-N 2.94Å; D200-A203 PolarHBondContact O-N 3.48Å; D200-L204 WeakPolarHBondContact O-CG 3.36Å; D200-L204 PolarHBondContact O-N 2.92Å
201E98.1Very high96.7Very high104 Ų104101.2 Ų101.249%0.48653%0.527SS..Hα-helixtrans-62.2-41.7175-76.3174.4-170.600111.9K197 L204 A205K197-E201 WeakPolarHBondContact CE-OE1 3.41Å; K197-E201 IonicContact NZ-OE1 3.86Å; K197-E201 PolarHBondContact NZ-OE1 3.33Å; K197-E201 WeakPolarHBondContact O-CB 3.33Å; K197-E201 WeakPolarHBondContact O-CG 3.48Å; K197-E201 PolarHBondContact O-N 3.32Å; E201-L204 PolarHBondContact O-N 3.36Å; E201-A205 WeakPolarHBondContact O-CB 3.49Å; E201-A205 PolarHBondContact O-N 3.49Å
202A97.1Very high97.1Very high61 Ų61102 Ų10250%0.50453%0.53SS..Hα-helixtrans-66.9-39.3175.200000112.6G198 A199 A205 R206G198-A202 VanDerWaalsContact O-CB 3.31Å; G198-A202 WeakPolarHBondContact O-CB 3.26Å; G198-A202 PolarHBondContact O-N 2.95Å; A199-A202 PolarHBondContact O-N 3.34Å; A202-A205 PolarHBondContact O-N 3.41Å; A202-R206 WeakPolarHBondContact O-CB 3.5Å; A202-R206 PolarHBondContact O-N 2.83Å
203A98.1Very high97.5Very high58 Ų58102.2 Ų102.248%0.47953%0.53SS..Hα-helixtrans-65.5-40.117600000111.9A199 D200 R206 A207A199-A203 WeakPolarHBondContact O-CB 3.35Å; A199-A203 PolarHBondContact O-N 2.9Å; D200-A203 PolarHBondContact O-N 3.48Å; A203-R206 PolarHBondContact O-N 3.13Å; A203-A207 WeakPolarHBondContact O-CB 3.45Å; A203-A207 PolarHBondContact O-N 3.45Å
204L98.4Very high97.6Very high115 Ų115100.5 Ų100.560%0.60252%0.524SS*.Hα-helixtrans-63.6-47.4172.5-72.5172.9000111.6D200 E201 R206 A207 E208D200-L204 WeakPolarHBondContact O-CG 3.36Å; D200-L204 PolarHBondContact O-N 2.92Å; E201-L204 PolarHBondContact O-N 3.36Å; L204-R206 VanDerWaalsContact C-N 3.31Å; L204-R206 PolarHBondContact O-N 2.92Å; L204-A207 PolarHBondContact O-N 3.45Å; L204-E208 WeakPolarHBondContact O-CG 3.25Å; L204-E208 PolarHBondContact O-N 2.92Å
205A98Very high97.8Very high47 Ų4796.7 Ų96.739%0.38851%0.513SS..Hα-helixtrans-60.4-39.9177.300000112.2E201 A202 E208 L209E201-A205 WeakPolarHBondContact O-CB 3.49Å; E201-A205 PolarHBondContact O-N 3.49Å; A202-A205 PolarHBondContact O-N 3.41Å; A205-E208 PolarHBondContact O-N 2.94Å; A205-L209 WeakPolarHBondContact O-CG 3.48Å; A205-L209 PolarHBondContact O-N 3.4Å
206R98.3Very high98Very high163 Ų16397.5 Ų97.562%0.61551%0.507SS*.Hα-helixtrans-60.5-49.8172.3179.2-176.9160.9-168-9111.3A202 A203 L204 E208 L209 E210A202-R206 WeakPolarHBondContact O-CB 3.5Å; A202-R206 PolarHBondContact O-N 2.83Å; A203-R206 PolarHBondContact O-N 3.13Å; L204-R206 VanDerWaalsContact C-N 3.31Å; L204-R206 PolarHBondContact O-N 2.92Å; R206-E208 VanDerWaalsContact C-N 3.27Å; R206-E208 PolarHBondContact O-N 3.37Å; R206-L209 WeakPolarHBondContact O-CB 3.47Å; R206-L209 PolarHBondContact O-N 2.93Å; R206-L209 VanDerWaalsContact O-N 3.09Å; R206-E210 HydrophobicContact CG-CG 4.43Å; R206-E210 IonicContact CZ-OE1 2.82Å; R206-E210 IonicContact NE-OE1 2.9Å; R206-E210 PolarHBondContact NE-OE1 2.9Å; R206-E210 IonicContact NH2-OE1 3.87Å; R206-E210 PolarHBondContact NH2-OE1 2.91Å; R206-E210 WeakPolarHBondContact O-CG 3.49Å; R206-E210 PolarHBondContact O-N 3.36Å
207A98.4Very high98.1Very high34 Ų3495.5 Ų95.528%0.28151%0.506SS..Hα-helixtrans-64.9-28.2179.900000113.4A203 L204 K211A203-A207 WeakPolarHBondContact O-CB 3.45Å; A203-A207 PolarHBondContact O-N 3.45Å; L204-A207 PolarHBondContact O-N 3.45Å; A207-K211 WeakPolarHBondContact O-CG 3.43Å; A207-K211 PolarHBondContact O-N 3.18Å
208E98.4Very high98.1Very high142 Ų14295.2 Ų95.266%0.66451%0.511SS*.Hα-helixtrans-71-39.1170.7-73.8-176.8-178.600112.4L204 A205 R206 R212L204-E208 WeakPolarHBondContact O-CG 3.25Å; L204-E208 PolarHBondContact O-N 2.92Å; A205-E208 PolarHBondContact O-N 2.94Å; R206-E208 VanDerWaalsContact C-N 3.27Å; R206-E208 PolarHBondContact O-N 3.37Å; E208-R212 WeakPolarHBondContact O-CB 3.4Å; E208-R212 PolarHBondContact O-N 2.87Å; E208-R212 VanDerWaalsContact O-N 3.13Å
209L98Very high98.1Very high111 Ų11198.8 Ų98.858%0.58152%0.518SS*.Hα-helixtrans-68.1-42.6174.8-71.4171.7000111.9A205 R206 R212 I213A205-L209 WeakPolarHBondContact O-CG 3.48Å; A205-L209 PolarHBondContact O-N 3.4Å; R206-L209 WeakPolarHBondContact O-CB 3.47Å; R206-L209 PolarHBondContact O-N 2.93Å; R206-L209 VanDerWaalsContact O-N 3.09Å; L209-R212 CarbonylContact O-C 3.59Å; L209-R212 WeakPolarHBondContact O-CA 3.44Å; L209-R212 WeakPolarHBondContact O-CB 3.43Å; L209-R212 PolarHBondContact O-N 2.92Å; L209-R212 VanDerWaalsContact O-N 3.08Å; L209-I213 WeakPolarHBondContact O-CG1 3.31Å; L209-I213 PolarHBondContact O-N 3.45Å
210E98.2Very high98.1Very high78 Ų78100.2 Ų100.236%0.36452%0.517SS..Hα-helixtrans-57.9-51.1175.3-73.8171.8165.300111R206 R212 I213 D214R206-E210 HydrophobicContact CG-CG 4.43Å; R206-E210 IonicContact CZ-OE1 2.82Å; R206-E210 IonicContact NE-OE1 2.9Å; R206-E210 PolarHBondContact NE-OE1 2.9Å; R206-E210 IonicContact NH2-OE1 3.87Å; R206-E210 PolarHBondContact NH2-OE1 2.91Å; R206-E210 WeakPolarHBondContact O-CG 3.49Å; R206-E210 PolarHBondContact O-N 3.36Å; E210-R212 PolarHBondContact O-N 2.97Å; E210-R212 VanDerWaalsContact O-N 3.16Å; E210-I213 WeakPolarHBondContact O-CA 3.26Å; E210-I213 WeakPolarHBondContact O-CB 3.34Å; E210-I213 PolarHBondContact O-N 3.35Å; E210-D214 PolarHBondContact O-N 3.33Å
211K98.4Very high98.1Very high146 Ų14698 Ų9864%0.63551%0.513SS*.Hα-helixtrans-57.7-32.2173.8-73.9170.4-175.8166.80113.4A207 S215A207-K211 WeakPolarHBondContact O-CG 3.43Å; A207-K211 PolarHBondContact O-N 3.18Å; K211-S215 WeakPolarHBondContact O-CB 3.44Å; K211-S215 PolarHBondContact O-N 2.87Å; K211-S215 PolarHBondContact O-OG 2.9Å
212R98.3Very high98.1Very high171 Ų17199.5 Ų99.565%0.64552%0.518SS*.Hα-helixtrans-73-39.4177.2-165.1175.5-171.9117.46.3111.2E208 L209 E210 S215 L216E208-R212 WeakPolarHBondContact O-CB 3.4Å; E208-R212 PolarHBondContact O-N 2.87Å; E208-R212 VanDerWaalsContact O-N 3.13Å; L209-R212 CarbonylContact O-C 3.59Å; L209-R212 WeakPolarHBondContact O-CA 3.44Å; L209-R212 WeakPolarHBondContact O-CB 3.43Å; L209-R212 PolarHBondContact O-N 2.92Å; L209-R212 VanDerWaalsContact O-N 3.08Å; E210-R212 PolarHBondContact O-N 2.97Å; E210-R212 VanDerWaalsContact O-N 3.16Å; R212-S215 WeakPolarHBondContact CA-OG 3.35Å; R212-S215 PolarHBondContact O-N 3.12Å; R212-S215 PolarHBondContact O-OG 3.07Å; R212-L216 HydrophobicContact CG-CD1 4.36Å; R212-L216 VanDerWaalsContact O-CG 3.29Å; R212-L216 WeakPolarHBondContact O-CG 3.49Å; R212-L216 PolarHBondContact O-N 2.75Å
213I98.4Very high98.1Very high95 Ų95100.3 Ų100.349%0.48751%0.514SS..Hα-helixtrans-59.6-51.2171.7-68.5164000109.6L209 E210 S215 L216 M217L209-I213 WeakPolarHBondContact O-CG1 3.31Å; L209-I213 PolarHBondContact O-N 3.45Å; E210-I213 WeakPolarHBondContact O-CA 3.26Å; E210-I213 WeakPolarHBondContact O-CB 3.34Å; E210-I213 PolarHBondContact O-N 3.35Å; I213-S215 VanDerWaalsContact C-N 3.33Å; I213-S215 PolarHBondContact O-N 2.67Å; I213-L216 PolarHBondContact O-N 3.04Å; I213-L216 VanDerWaalsContact O-N 3.09Å; I213-M217 HydrophobicContact CG2-CG 4.38Å; I213-M217 HydrophobicContact CG2-SD 3.95Å; I213-M217 WeakPolarHBondContact O-CG 3.32Å; I213-M217 PolarHBondContact O-N 3.35Å
214D98.2Very high98.1Very high93 Ų93104.4 Ų104.450%0.49752%0.52SS..Hα-helixtrans-53.9-49.3176.8-64.5-25000111.3E210 L216 M217 D218E210-D214 PolarHBondContact O-N 3.33Å; D214-L216 VanDerWaalsContact C-N 3.29Å; D214-L216 PolarHBondContact O-N 3.1Å; D214-M217 WeakPolarHBondContact O-CB 3.31Å; D214-M217 PolarHBondContact O-N 3.37Å; D214-M217 VanDerWaalsContact O-N 3.12Å; D214-D218 PolarHBondContact O-N 3.05Å
215S98.3Very high98.1Very high62 Ų62104.6 Ų104.643%0.43452%0.516SS..Hα-helixtrans-62.6-33.1179.971.30000113.8K211 R212 I213 E219K211-S215 WeakPolarHBondContact O-CB 3.44Å; K211-S215 PolarHBondContact O-N 2.87Å; K211-S215 PolarHBondContact O-OG 2.9Å; R212-S215 WeakPolarHBondContact CA-OG 3.35Å; R212-S215 PolarHBondContact O-N 3.12Å; R212-S215 PolarHBondContact O-OG 3.07Å; I213-S215 VanDerWaalsContact C-N 3.33Å; I213-S215 PolarHBondContact O-N 2.67Å; S215-E219 WeakPolarHBondContact O-CB 3.41Å; S215-E219 PolarHBondContact O-N 3.39Å
216L98Very high98.1Very high83 Ų83104.2 Ų104.244%0.43551%0.509SS..Hα-helixtrans-77.1-33.3175.8-71.5169000111.5R212 I213 D214 E219 I220R212-L216 HydrophobicContact CG-CD1 4.36Å; R212-L216 VanDerWaalsContact O-CG 3.29Å; R212-L216 WeakPolarHBondContact O-CG 3.49Å; R212-L216 PolarHBondContact O-N 2.75Å; I213-L216 PolarHBondContact O-N 3.04Å; I213-L216 VanDerWaalsContact O-N 3.09Å; D214-L216 VanDerWaalsContact C-N 3.29Å; D214-L216 PolarHBondContact O-N 3.1Å; L216-E219 PolarHBondContact O-N 2.94Å; L216-I220 WeakPolarHBondContact O-CB 3.42Å; L216-I220 WeakPolarHBondContact O-CD1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 2.88Å
217M98.1Very high98Very high119 Ų119101.5 Ų101.559%0.58650%0.503SS*.Hα-helixtrans-65.6-42.8172.6-72.6-179.361.900111.3I213 D214 I220 A221I213-M217 HydrophobicContact CG2-CG 4.38Å; I213-M217 HydrophobicContact CG2-SD 3.95Å; I213-M217 WeakPolarHBondContact O-CG 3.32Å; I213-M217 PolarHBondContact O-N 3.35Å; D214-M217 WeakPolarHBondContact O-CB 3.31Å; D214-M217 PolarHBondContact O-N 3.37Å; D214-M217 VanDerWaalsContact O-N 3.12Å; M217-I220 PolarHBondContact O-N 3.17Å; M217-A221 WeakPolarHBondContact O-CB 3.3Å; M217-A221 PolarHBondContact O-N 3.33Å
218D98.2Very high97.9Very high118 Ų118106.8 Ų106.863%0.63152%0.522SS*.Hα-helixtrans-61-43.8172.5-81.6-16.9000111.8D214 A221 F222D214-D218 PolarHBondContact O-N 3.05Å; D218-A221 PolarHBondContact O-N 3.29Å; D218-F222 WeakPolarHBondContact O-CB 3.42Å; D218-F222 PolarHBondContact O-N 3.04Å
219E97.9Very high97.7Very high111 Ų111105.4 Ų105.452%0.51952%0.516SS..Hα-helixtrans-64.2-41.8176.4-173.8169.3-161.800111.9S215 L216 F222 L223S215-E219 WeakPolarHBondContact O-CB 3.41Å; S215-E219 PolarHBondContact O-N 3.39Å; L216-E219 PolarHBondContact O-N 2.94Å; E219-F222 PolarHBondContact O-N 3.1Å; E219-L223 HydrophobicContact CG-CD1 4.15Å; E219-L223 WeakPolarHBondContact O-CB 3.43Å; E219-L223 VanDerWaalsContact O-CG 3.3Å; E219-L223 WeakPolarHBondContact O-CG 3.48Å; E219-L223 PolarHBondContact O-N 3.46Å
220I97.4Very high97.6Very high89 Ų89105.2 Ų105.246%0.45651%0.512SS..Hα-helixtrans-63.2-42.5174.1-72164.4000111.2L216 M217 L223 K224L216-I220 WeakPolarHBondContact O-CB 3.42Å; L216-I220 WeakPolarHBondContact O-CD1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 2.88Å; M217-I220 PolarHBondContact O-N 3.17Å; I220-L223 PolarHBondContact O-N 2.9Å; I220-K224 HydrophobicContact CG2-CD 4.13Å; I220-K224 HydrophobicContact CG2-CG 4.49Å; I220-K224 WeakPolarHBondContact O-CB 3.26Å; I220-K224 VanDerWaalsContact O-CG 3.3Å; I220-K224 WeakPolarHBondContact O-CG 3.35Å; I220-K224 PolarHBondContact O-N 3.36Å
221A97.9Very high97.4Very high58 Ų58105.9 Ų105.948%0.47952%0.517SS..Hα-helixtrans-64.6-41.9177.600000111.6M217 D218 K225M217-A221 WeakPolarHBondContact O-CB 3.3Å; M217-A221 PolarHBondContact O-N 3.33Å; D218-A221 PolarHBondContact O-N 3.29Å; A221-K225 WeakPolarHBondContact O-CB 3.48Å; A221-K225 PolarHBondContact O-N 3.36Å; A221-K225 VanDerWaalsContact O-N 3.1Å
222F98.1Very high97.2Very high136 Ų136101.6 Ų101.660%0.59651%0.509SS*.Hα-helixtrans-61.7-50.3173.9176.9-101.4000111.9D218 E219 K224 K225 V226D218-F222 WeakPolarHBondContact O-CB 3.42Å; D218-F222 PolarHBondContact O-N 3.04Å; E219-F222 PolarHBondContact O-N 3.1Å; F222-K224 PolarHBondContact O-N 3.37Å; F222-K225 PolarHBondContact O-N 3.25Å; F222-V226 HydrophobicContact CD1-CG2 4.28Å; F222-V226 HydrophobicContact CD2-CG2 4.4Å; F222-V226 HydrophobicContact CE1-CG2 3.82Å; F222-V226 HydrophobicContact CE2-CG2 3.95Å; F222-V226 HydrophobicContact CZ-CG2 3.64Å; F222-V226 WeakPolarHBondContact O-CG2 3.47Å; F222-V226 PolarHBondContact O-N 3.04Å
223L97.9Very high96.9Very high78 Ų7899.2 Ų99.241%0.40851%0.505SS..Hα-helixtrans-61.7-42179.2-73.3171000112.4E219 I220 K225 V226 H227E219-L223 HydrophobicContact CG-CD1 4.15Å; E219-L223 WeakPolarHBondContact O-CB 3.43Å; E219-L223 VanDerWaalsContact O-CG 3.3Å; E219-L223 WeakPolarHBondContact O-CG 3.48Å; E219-L223 PolarHBondContact O-N 3.46Å; I220-L223 PolarHBondContact O-N 2.9Å; L223-K225 VanDerWaalsContact C-N 3.33Å; L223-K225 PolarHBondContact O-N 3Å; L223-V226 PolarHBondContact O-N 2.92Å; L223-H227 WeakPolarHBondContact O-CB 3.26Å; L223-H227 PolarHBondContact O-N 2.92Å
224K97.4Very high96.6Very high143 Ų14399.3 Ų99.362%0.62251%0.506SS*.Hα-helixtrans-57.3-46.8173.8-79176.4177.4-179.30111.4I220 F222 H227 E228I220-K224 HydrophobicContact CG2-CD 4.13Å; I220-K224 HydrophobicContact CG2-CG 4.49Å; I220-K224 WeakPolarHBondContact O-CB 3.26Å; I220-K224 VanDerWaalsContact O-CG 3.3Å; I220-K224 WeakPolarHBondContact O-CG 3.35Å; I220-K224 PolarHBondContact O-N 3.36Å; F222-K224 PolarHBondContact O-N 3.37Å; K224-H227 PolarHBondContact O-N 3.5Å; K224-E228 WeakPolarHBondContact O-CB 3.25Å; K224-E228 PolarHBondContact O-N 3.39Å
225K97.9Very high96Very high120 Ų120100.1 Ų100.152%0.52251%0.507SS..Hα-helixtrans-64.3-43.7178.8-176.6178171.1-177.10112.3A221 F222 L223 E228 E229A221-K225 WeakPolarHBondContact O-CB 3.48Å; A221-K225 PolarHBondContact O-N 3.36Å; A221-K225 VanDerWaalsContact O-N 3.1Å; F222-K225 PolarHBondContact O-N 3.25Å; L223-K225 VanDerWaalsContact C-N 3.33Å; L223-K225 PolarHBondContact O-N 3Å; K225-E228 PolarHBondContact O-N 2.9Å; K225-E229 WeakPolarHBondContact CE-OE1 3.49Å; K225-E229 IonicContact NZ-OE1 3.83Å; K225-E229 WeakPolarHBondContact O-CG 3.29Å; K225-E229 PolarHBondContact O-N 3.33Å
226V97.7Very high95.4Very high39 Ų3999.7 Ų99.724%0.23651%0.507CS..Hα-helixtrans-61.5-45.4176.1171.80000110.9F222 L223 E228 E229 E230F222-V226 HydrophobicContact CD1-CG2 4.28Å; F222-V226 HydrophobicContact CD2-CG2 4.4Å; F222-V226 HydrophobicContact CE1-CG2 3.82Å; F222-V226 HydrophobicContact CE2-CG2 3.95Å; F222-V226 HydrophobicContact CZ-CG2 3.64Å; F222-V226 WeakPolarHBondContact O-CG2 3.47Å; F222-V226 PolarHBondContact O-N 3.04Å; L223-V226 PolarHBondContact O-N 2.92Å; V226-E228 VanDerWaalsContact C-N 3.31Å; V226-E228 PolarHBondContact O-N 3.33Å; V226-E229 PolarHBondContact O-N 3.11Å; V226-E230 HydrophobicContact CG1-CG 4.35Å; V226-E230 WeakPolarHBondContact O-CB 3.48Å; V226-E230 WeakPolarHBondContact O-CG 3.32Å; V226-E230 PolarHBondContact O-N 3.43Å
227H96.2Very high94.8Very high105 Ų105100.4 Ų100.449%0.48651%0.508SS..Hα-helixtrans-62.7-37.1176.1-70.9-177.3000112.4L223 K224 E230 I231L223-H227 WeakPolarHBondContact O-CB 3.26Å; L223-H227 PolarHBondContact O-N 2.92Å; K224-H227 PolarHBondContact O-N 3.5Å; H227-E230 PolarHBondContact O-N 2.82Å; H227-I231 VanDerWaalsContact O-CB 3.31Å; H227-I231 WeakPolarHBondContact O-CB 3.38Å; H227-I231 WeakPolarHBondContact O-CD1 3.5Å; H227-I231 WeakPolarHBondContact O-CG1 3.5Å; H227-I231 PolarHBondContact O-N 2.96Å
228E96.6Very high93.8Very high145 Ų14599.5 Ų99.568%0.67850%0.504SS*.Hα-helixtrans-67.6-39.5176.7-168.2166.6-149.400111.8K224 K225 V226 A232K224-E228 WeakPolarHBondContact O-CB 3.25Å; K224-E228 PolarHBondContact O-N 3.39Å; K225-E228 PolarHBondContact O-N 2.9Å; V226-E228 VanDerWaalsContact C-N 3.31Å; V226-E228 PolarHBondContact O-N 3.33Å; E228-A232 WeakPolarHBondContact O-CB 3.38Å; E228-A232 PolarHBondContact O-N 3.44Å
229E95.5Very high92.7Very high113 Ų11399.8 Ų99.853%0.52850%0.502SS..Hα-helixtrans-65.2-45171.8-72176.2-176.900112K225 V226 A232 E233K225-E229 WeakPolarHBondContact CE-OE1 3.49Å; K225-E229 IonicContact NZ-OE1 3.83Å; K225-E229 WeakPolarHBondContact O-CG 3.29Å; K225-E229 PolarHBondContact O-N 3.33Å; V226-E229 PolarHBondContact O-N 3.11Å; E229-A232 PolarHBondContact O-N 2.91Å; E229-E233 PolarHBondContact O-N 3.44Å
230E94.9Very high91.2Very high107 Ų107103.5 Ų103.550%0.551%0.513SS..Hα-helixtrans-63.4-41175.5-75.7-177165.500112.3V226 H227 E233 L234V226-E230 HydrophobicContact CG1-CG 4.35Å; V226-E230 WeakPolarHBondContact O-CB 3.48Å; V226-E230 WeakPolarHBondContact O-CG 3.32Å; V226-E230 PolarHBondContact O-N 3.43Å; H227-E230 PolarHBondContact O-N 2.82Å; E230-E233 PolarHBondContact O-N 3.08Å; E230-L234 WeakPolarHBondContact O-CB 3.4Å; E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.37Å; E230-L234 PolarHBondContact O-N 2.82Å
231I94.7Very high89.4Confident92 Ų92102.3 Ų102.347%0.47252%0.516SS..Hα-helixtrans-63.6-42.9175.1-73.6165000110.2H227 L234 Q235H227-I231 VanDerWaalsContact O-CB 3.31Å; H227-I231 WeakPolarHBondContact O-CB 3.38Å; H227-I231 WeakPolarHBondContact O-CD1 3.5Å; H227-I231 WeakPolarHBondContact O-CG1 3.5Å; H227-I231 PolarHBondContact O-N 2.96Å; I231-L234 PolarHBondContact O-N 3.3Å; I231-Q235 HydrophobicContact CG2-CG 4.42Å; I231-Q235 WeakPolarHBondContact O-CB 3.44Å; I231-Q235 WeakPolarHBondContact O-CG 3.36Å; I231-Q235 PolarHBondContact O-N 3.12Å
232A92.9Very high87Confident56 Ų56107.1 Ų107.146%0.46353%0.528SS..Hα-helixtrans-63.8-41.517600000111.9E228 E229 Q235 A236E228-A232 WeakPolarHBondContact O-CB 3.38Å; E228-A232 PolarHBondContact O-N 3.44Å; E229-A232 PolarHBondContact O-N 2.91Å; A232-Q235 PolarHBondContact O-N 2.96Å; A232-A236 WeakPolarHBondContact O-CB 3.36Å; A232-A236 PolarHBondContact O-N 3.19Å
233E92.9Very high84.5Confident121 Ų121107.9 Ų107.957%0.56554%0.537SS*.Hα-helixtrans-66.7-44.5176.3-163.6-175.2169.400111.7E229 E230 Q235 A236 Q237E229-E233 PolarHBondContact O-N 3.44Å; E230-E233 PolarHBondContact O-N 3.08Å; E233-Q235 VanDerWaalsContact C-N 3.35Å; E233-Q235 PolarHBondContact O-N 2.98Å; E233-A236 CarbonylContact O-C 3.59Å; E233-A236 WeakPolarHBondContact O-CB 3.47Å; E233-A236 PolarHBondContact O-N 2.69Å; E233-Q237 WeakPolarHBondContact O-CB 3.39Å; E233-Q237 WeakPolarHBondContact O-CG 3.36Å; E233-Q237 PolarHBondContact O-N 3.04Å; E233-Q237 PolarHBondContact OE1-NE2 3.37Å; E233-Q237 VanDerWaalsContact OE1-NE2 3.11Å
234L90.9Very high81.7Confident97 Ų97107.6 Ų107.651%0.50854%0.542SS..Hα-helixtrans-63.6-38.5175.7-74.2172.8000112.1E230 I231 Q237 I238E230-L234 WeakPolarHBondContact O-CB 3.4Å; E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.37Å; E230-L234 PolarHBondContact O-N 2.82Å; I231-L234 PolarHBondContact O-N 3.3Å; L234-Q237 PolarHBondContact O-N 3.49Å; L234-I238 WeakPolarHBondContact O-CB 3.34Å; L234-I238 VanDerWaalsContact O-CG1 3.22Å; L234-I238 WeakPolarHBondContact O-CG1 3.32Å; L234-I238 PolarHBondContact O-N 3.37Å
235Q86.5Confident78.7Confident111 Ų111107.2 Ų107.252%0.51955%0.551SS.*Hα-helixtrans-62.8-42.5172.5-75.7176.113.100111.5I231 A232 E233 I238 Q239I231-Q235 HydrophobicContact CG2-CG 4.42Å; I231-Q235 WeakPolarHBondContact O-CB 3.44Å; I231-Q235 WeakPolarHBondContact O-CG 3.36Å; I231-Q235 PolarHBondContact O-N 3.12Å; A232-Q235 PolarHBondContact O-N 2.96Å; E233-Q235 VanDerWaalsContact C-N 3.35Å; E233-Q235 PolarHBondContact O-N 2.98Å; Q235-I238 PolarHBondContact O-N 2.89Å; Q235-Q239 VanDerWaalsContact O-CG 3.29Å; Q235-Q239 WeakPolarHBondContact O-CG 3.5Å; Q235-Q239 PolarHBondContact O-N 2.84Å
236A85.5Confident75.8Confident53 Ų53110.8 Ų110.844%0.43857%0.569SS.*Hα-helixtrans-64.3-42.4174.300000111.9A232 E233 Q239 Y240A232-A236 WeakPolarHBondContact O-CB 3.36Å; A232-A236 PolarHBondContact O-N 3.19Å; E233-A236 CarbonylContact O-C 3.59Å; E233-A236 WeakPolarHBondContact O-CB 3.47Å; E233-A236 PolarHBondContact O-N 2.69Å; A236-Q239 PolarHBondContact O-N 3.37Å; A236-Y240 WeakPolarHBondContact O-CB 3.49Å; A236-Y240 PolarHBondContact O-N 2.92Å
237Q85.3Confident72.9Confident98 Ų98116.8 Ų116.846%0.45860%0.597SS.*Hα-helixtrans-64.6-37.6175.4-71.8-178.523.200112.1E233 L234 Y240 A241E233-Q237 WeakPolarHBondContact O-CB 3.39Å; E233-Q237 WeakPolarHBondContact O-CG 3.36Å; E233-Q237 PolarHBondContact O-N 3.04Å; E233-Q237 PolarHBondContact OE1-NE2 3.37Å; E233-Q237 VanDerWaalsContact OE1-NE2 3.11Å; L234-Q237 PolarHBondContact O-N 3.49Å; Q237-Y240 PolarHBondContact O-N 3.32Å; Q237-A241 WeakPolarHBondContact O-CB 3.34Å; Q237-A241 PolarHBondContact O-N 3.21Å
238I78.1Confident70.5Confident99 Ų99119 Ų11951%0.50861%0.612SS.*Hα-helixtrans-65.2-43.2174.1-72.6164.3000110.7L234 Q235 Y240 A241 Q242L234-I238 WeakPolarHBondContact O-CB 3.34Å; L234-I238 VanDerWaalsContact O-CG1 3.22Å; L234-I238 WeakPolarHBondContact O-CG1 3.32Å; L234-I238 PolarHBondContact O-N 3.37Å; Q235-I238 PolarHBondContact O-N 2.89Å; I238-Y240 VanDerWaalsContact C-N 3.27Å; I238-Y240 PolarHBondContact O-N 2.92Å; I238-A241 PolarHBondContact O-N 3.03Å; I238-Q242 WeakPolarHBondContact O-CB 3.45Å; I238-Q242 WeakPolarHBondContact O-CG 3.26Å; I238-Q242 PolarHBondContact O-N 3.33Å
239Q75.3Confident67.5Low125 Ų125117.6 Ų117.658%0.58461%0.613SS**Hα-helixtrans-62.4-34.9174.1-69.517027.800111.9Q235 A236Q235-Q239 VanDerWaalsContact O-CG 3.29Å; Q235-Q239 WeakPolarHBondContact O-CG 3.5Å; Q235-Q239 PolarHBondContact O-N 2.84Å; A236-Q239 PolarHBondContact O-N 3.37Å
240Y64.5Low65.4Low189 Ų189116.8 Ų116.874%0.74162%0.621SS**Hα-helixtrans-73.1-40.4175.3-140.9-91.5000112.5A236 Q237 I238 I243A236-Y240 WeakPolarHBondContact O-CB 3.49Å; A236-Y240 PolarHBondContact O-N 2.92Å; Q237-Y240 PolarHBondContact O-N 3.32Å; I238-Y240 VanDerWaalsContact C-N 3.27Å; I238-Y240 PolarHBondContact O-N 2.92Å; Y240-I243 PolarHBondContact O-N 3.22Å
241A60.1Low63.4Low63 Ų63120.5 Ų120.552%0.52164%0.635SS.*Hα-helixtrans-73.5-28.5179.900000112.8Q237 I238 I243 S244Q237-A241 WeakPolarHBondContact O-CB 3.34Å; Q237-A241 PolarHBondContact O-N 3.21Å; I238-A241 PolarHBondContact O-N 3.03Å; A241-I243 PolarHBondContact O-N 2.96Å; A241-S244 CarbonylContact O-C 3.6Å; A241-S244 PolarHBondContact O-N 3.42Å
242Q47.2Very low61.7Low159 Ų159121.3 Ų121.374%0.74365%0.646SS**THydrogen-bonded Turntrans-60.5-11169.1-82.2-176.3-23.900113.6I238I238-Q242 WeakPolarHBondContact O-CB 3.45Å; I238-Q242 WeakPolarHBondContact O-CG 3.26Å; I238-Q242 PolarHBondContact O-N 3.33Å
243I47.3Very low60.4Low153 Ų153124.8 Ų124.879%0.78566%0.657SS**THydrogen-bonded Turntrans-110.2-6.1177.9-62.4174.7000111.8Y240 A241Y240-I243 PolarHBondContact O-N 3.22Å; A241-I243 PolarHBondContact O-N 2.96Å
244S39.2Very low58.9Low71 Ų71122.8 Ų122.850%0.49765%0.65SS.*  trans-153.8103.7-170.1167.50000113.3A241A241-S244 CarbonylContact O-C 3.6Å; A241-S244 PolarHBondContact O-N 3.42Å
245V33.6Very low57.9Low135 Ų135121.5 Ų121.582%0.81865%0.649SS**  175.596.9125.8154.50000109.2
246E36.7Very low57.2Low195 Ų195119.5 Ų119.591%0.91165%0.651SS**  trans-106.2131.4138.7-75.9-171154.500106.2
247M38.2Very low56.8Low166 Ų166119.4 Ų119.482%0.81865%0.65SS**  169135.8119.9-170.5160.764.500112.2
248D44.7Very low56.6Low150 Ų150119.4 Ų119.480%0.80265%0.653SS**  trans-71.8133.3174.6175.825.4000112.5
249V34.5Very low56.9Low116 Ų116122 Ų12270%0.70366%0.661SS**  trans-140.196.5170.8-173.20000112.1
250S50.6Low57.4Low97 Ų97120.4 Ų120.468%0.67866%0.656SS**  trans26.4126.3146.154.80000121.4P252S250-P252 WeakPolarHBondContact O-CD 3.22Å
251K52.2Low58.5Low184 Ų184115.1 Ų115.180%0.864%0.64SS**  trans-60.2121.4177-65.2171.4-179.4171.30113.9L254K251-L254 HydrophobicContact CB-CD1 3.8Å; K251-L254 HydrophobicContact CD-CD1 4.12Å; K251-L254 HydrophobicContact CG-CD1 3.86Å
252P60.4Low59.9Low109 Ų109120 Ų12071%0.70865%0.645SS**  trans-74.5171.9156.233.6-33.1000110.2S250 L254S250-P252 WeakPolarHBondContact O-CD 3.22Å; P252-L254 WeakPolarHBondContact O-CD1 3.2Å; P252-L254 PolarHBondContact O-N 2.7Å
253D64.2Low61.9Low130 Ų130114.8 Ų114.870%0.69563%0.629SS**  trans-63.693.9-178.7-176.31.9000112.2S255D253-S255 PolarHBondContact O-N 3.36Å; D253-S255 VanDerWaalsContact O-N 3.16Å; D253-S255 WeakPolarHBondContact OD1-CB 3.4Å; D253-S255 PolarHBondContact OD1-N 2.97Å
254L62.8Low63.9Low79 Ų79112.8 Ų112.841%0.41462%0.616SS.*Hα-helixtrans-63.8-16.3-178-83.4112.7000113.3K251 P252 A256 L258K251-L254 HydrophobicContact CB-CD1 3.8Å; K251-L254 HydrophobicContact CD-CD1 4.12Å; K251-L254 HydrophobicContact CG-CD1 3.86Å; P252-L254 WeakPolarHBondContact O-CD1 3.2Å; P252-L254 PolarHBondContact O-N 2.7Å; L254-A256 PolarHBondContact O-N 3.06Å; L254-L258 HydrophobicContact CB-CD1 3.83Å; L254-L258 HydrophobicContact CB-CG 4.11Å; L254-L258 HydrophobicContact CD2-CD1 4.01Å; L254-L258 HydrophobicContact CD2-CD2 4.35Å; L254-L258 HydrophobicContact CD2-CG 4.09Å; L254-L258 WeakPolarHBondContact O-CB 3.46Å; L254-L258 WeakPolarHBondContact O-CG 3.42Å; L254-L258 PolarHBondContact O-N 3.36Å
255S70.1Confident66.5Low70 Ų70117.3 Ų117.349%0.4962%0.623SS.*Hα-helixtrans-67.3-41.3-169.3-168.60000113.2D253 K259D253-S255 PolarHBondContact O-N 3.36Å; D253-S255 VanDerWaalsContact O-N 3.16Å; D253-S255 WeakPolarHBondContact OD1-CB 3.4Å; D253-S255 PolarHBondContact OD1-N 2.97Å; S255-K259 WeakPolarHBondContact O-CG 3.48Å; S255-K259 PolarHBondContact O-N 3.25Å
256A71.1Confident69.2Low68 Ų68116 Ų11656%0.56261%0.608SS**Hα-helixtrans-75.8-44.8176.300000111.6L254 K259 D260L254-A256 PolarHBondContact O-N 3.06Å; A256-K259 PolarHBondContact O-N 3.15Å; A256-D260 PolarHBondContact O-N 2.96Å
257A76.9Confident71.9Confident51 Ų51113.5 Ų113.542%0.42160%0.595SS.*Hα-helixtrans-63.3-42.4178.500000112.2K259 D260 I261A257-K259 VanDerWaalsContact C-N 3.32Å; A257-K259 PolarHBondContact O-N 3.3Å; A257-D260 PolarHBondContact O-N 2.89Å; A257-I261 VanDerWaalsContact O-CB 3.25Å; A257-I261 WeakPolarHBondContact O-CB 3.5Å; A257-I261 WeakPolarHBondContact O-CD1 3.36Å; A257-I261 WeakPolarHBondContact O-CG1 3.5Å; A257-I261 PolarHBondContact O-N 3.04Å
258L80.8Confident74.5Confident98 Ų98110.7 Ų110.751%0.51358%0.582SS.*Hα-helixtrans-65.3-33.3174.8-73.6172.1000112.5L254 R262L254-L258 HydrophobicContact CB-CD1 3.83Å; L254-L258 HydrophobicContact CB-CG 4.11Å; L254-L258 HydrophobicContact CD2-CD1 4.01Å; L254-L258 HydrophobicContact CD2-CD2 4.35Å; L254-L258 HydrophobicContact CD2-CG 4.09Å; L254-L258 WeakPolarHBondContact O-CB 3.46Å; L254-L258 WeakPolarHBondContact O-CG 3.42Å; L254-L258 PolarHBondContact O-N 3.36Å; L258-R262 WeakPolarHBondContact O-CB 3.28Å; L258-R262 PolarHBondContact O-N 3.49Å
259K84.9Confident76.8Confident154 Ų154106.4 Ų106.467%0.6757%0.568SS**Hα-helixtrans-68.3-42.7173.3-81.8179.4-179.6176.80111.9S255 A256 A257 R262 A263S255-K259 WeakPolarHBondContact O-CG 3.48Å; S255-K259 PolarHBondContact O-N 3.25Å; A256-K259 PolarHBondContact O-N 3.15Å; A257-K259 VanDerWaalsContact C-N 3.32Å; A257-K259 PolarHBondContact O-N 3.3Å; K259-R262 PolarHBondContact O-N 3.42Å; K259-A263 WeakPolarHBondContact O-CB 3.34Å; K259-A263 PolarHBondContact O-N 2.89Å
260D85.5Confident79.5Confident91 Ų91103.4 Ų103.449%0.48756%0.555SS.*Hα-helixtrans-69.9-46.3177.9-16956.9000111.5A256 A257 R262 A263 Q264A256-D260 PolarHBondContact O-N 2.96Å; A257-D260 PolarHBondContact O-N 2.89Å; D260-R262 VanDerWaalsContact C-N 3.28Å; D260-R262 PolarHBondContact O-N 3.32Å; D260-A263 CarbonylContact O-C 3.57Å; D260-A263 PolarHBondContact O-N 3.46Å; D260-A263 VanDerWaalsContact O-N 3.08Å; D260-Q264 WeakPolarHBondContact O-CB 3.4Å; D260-Q264 VanDerWaalsContact O-CG 3.31Å; D260-Q264 WeakPolarHBondContact O-CG 3.42Å; D260-Q264 PolarHBondContact O-N 3.3Å; D260-Q264 PolarHBondContact OD2-NE2 3.36Å
261I88.1Confident81.6Confident78 Ų78104.6 Ų104.640%0.455%0.548SS..Hα-helixtrans-54.6-45171.4-70.6165.3000110.4A257 Q264 Y265A257-I261 VanDerWaalsContact O-CB 3.25Å; A257-I261 WeakPolarHBondContact O-CB 3.5Å; A257-I261 WeakPolarHBondContact O-CD1 3.36Å; A257-I261 WeakPolarHBondContact O-CG1 3.5Å; A257-I261 PolarHBondContact O-N 3.04Å; I261-Q264 PolarHBondContact O-N 2.94Å; I261-Y265 HydrophobicContact CG2-CD2 3.64Å; I261-Y265 HydrophobicContact CG2-CE2 3.68Å; I261-Y265 VanDerWaalsContact O-CD2 3.28Å; I261-Y265 WeakPolarHBondContact O-CD2 3.35Å; I261-Y265 PolarHBondContact O-N 3.47Å
262R88.7Confident83.6Confident166 Ų166101.1 Ų101.163%0.62654%0.538SS*.Hα-helixtrans-62.7-43.8175.4-178.7175.8-177.7139.16.4112.3L258 K259 D260 Q264 Y265 E266L258-R262 WeakPolarHBondContact O-CB 3.28Å; L258-R262 PolarHBondContact O-N 3.49Å; K259-R262 PolarHBondContact O-N 3.42Å; D260-R262 VanDerWaalsContact C-N 3.28Å; D260-R262 PolarHBondContact O-N 3.32Å; R262-Q264 VanDerWaalsContact C-N 3.32Å; R262-Q264 PolarHBondContact O-N 3.03Å; R262-Y265 PolarHBondContact O-N 2.84Å; R262-E266 HydrophobicContact CG-CG 4.4Å; R262-E266 WeakPolarHBondContact CG-OE1 3.48Å; R262-E266 IonicContact CZ-OE1 2.76Å; R262-E266 IonicContact NE-OE1 3.18Å; R262-E266 PolarHBondContact NE-OE1 3.46Å; R262-E266 IonicContact NH2-OE1 3.97Å; R262-E266 WeakPolarHBondContact O-CB 3.29Å; R262-E266 WeakPolarHBondContact O-CG 3.46Å; R262-E266 PolarHBondContact O-N 3.36Å
263A88.9Confident85.2Confident49 Ų49101.9 Ų101.941%0.40553%0.534SS..Hα-helixtrans-64.8-35.9176.200000112.1K259 D260 K267K259-A263 WeakPolarHBondContact O-CB 3.34Å; K259-A263 PolarHBondContact O-N 2.89Å; D260-A263 CarbonylContact O-C 3.57Å; D260-A263 PolarHBondContact O-N 3.46Å; D260-A263 VanDerWaalsContact O-N 3.08Å; A263-K267 WeakPolarHBondContact O-CB 3.5Å; A263-K267 PolarHBondContact O-N 2.9Å
264Q90.6Very high86.7Confident112 Ų112100.7 Ų100.752%0.52352%0.524SS..Hα-helixtrans-66.4-43.4172.5-69.2-176.832.300111.4D260 I261 R262 K267 L268D260-Q264 WeakPolarHBondContact O-CB 3.4Å; D260-Q264 VanDerWaalsContact O-CG 3.31Å; D260-Q264 WeakPolarHBondContact O-CG 3.42Å; D260-Q264 PolarHBondContact O-N 3.3Å; D260-Q264 PolarHBondContact OD2-NE2 3.36Å; I261-Q264 PolarHBondContact O-N 2.94Å; R262-Q264 VanDerWaalsContact C-N 3.32Å; R262-Q264 PolarHBondContact O-N 3.03Å; Q264-K267 PolarHBondContact O-N 3.47Å; Q264-L268 VanDerWaalsContact O-CB 3.24Å; Q264-L268 WeakPolarHBondContact O-CB 3.23Å; Q264-L268 PolarHBondContact O-N 3.32Å
265Y92.8Very high88.2Confident165 Ų165101.6 Ų101.665%0.64753%0.53SS*.Hα-helixtrans-65.2-42.5174.1-90.1-71.2000112.7I261 R262 K267 L268 A269I261-Y265 HydrophobicContact CG2-CD2 3.64Å; I261-Y265 HydrophobicContact CG2-CE2 3.68Å; I261-Y265 VanDerWaalsContact O-CD2 3.28Å; I261-Y265 WeakPolarHBondContact O-CD2 3.35Å; I261-Y265 PolarHBondContact O-N 3.47Å; R262-Y265 PolarHBondContact O-N 2.84Å; Y265-K267 VanDerWaalsContact C-N 3.33Å; Y265-K267 PolarHBondContact O-N 2.95Å; Y265-L268 PolarHBondContact O-N 3.02Å; Y265-A269 VanDerWaalsContact O-CB 3.25Å; Y265-A269 WeakPolarHBondContact O-CB 3.3Å; Y265-A269 PolarHBondContact O-N 2.77Å
266E90.9Very high89.4Confident108 Ų108100 Ų10051%0.50552%0.521SS..Hα-helixtrans-63.2-40175.4-74.8171.7-172.900110.6R262 A270R262-E266 HydrophobicContact CG-CG 4.4Å; R262-E266 WeakPolarHBondContact CG-OE1 3.48Å; R262-E266 IonicContact CZ-OE1 2.76Å; R262-E266 IonicContact NE-OE1 3.18Å; R262-E266 PolarHBondContact NE-OE1 3.46Å; R262-E266 IonicContact NH2-OE1 3.97Å; R262-E266 WeakPolarHBondContact O-CB 3.29Å; R262-E266 WeakPolarHBondContact O-CG 3.46Å; R262-E266 PolarHBondContact O-N 3.36Å; E266-A270 VanDerWaalsContact O-CB 3.3Å; E266-A270 WeakPolarHBondContact O-CB 3.22Å; E266-A270 PolarHBondContact O-N 2.73Å
267K93.4Very high90.5Very high143 Ų143101.1 Ų101.162%0.62251%0.514SS*.Hα-helixtrans-68.8-36.7173.8-171.3176.4-174.8177.70113.1A263 Q264 Y265 K271A263-K267 WeakPolarHBondContact O-CB 3.5Å; A263-K267 PolarHBondContact O-N 2.9Å; Q264-K267 PolarHBondContact O-N 3.47Å; Y265-K267 VanDerWaalsContact C-N 3.33Å; Y265-K267 PolarHBondContact O-N 2.95Å; K267-K271 WeakPolarHBondContact O-CB 3.21Å; K267-K271 WeakPolarHBondContact O-CG 3.17Å; K267-K271 PolarHBondContact O-N 3.42Å
268L92.6Very high91.4Very high106 Ų106103.3 Ų103.356%0.55552%0.516SS*.Hα-helixtrans-71.3-40.6176.6-177.262.6000111.2Q264 Y265 K271 N272Q264-L268 VanDerWaalsContact O-CB 3.24Å; Q264-L268 WeakPolarHBondContact O-CB 3.23Å; Q264-L268 PolarHBondContact O-N 3.32Å; Y265-L268 PolarHBondContact O-N 3.02Å; L268-K271 PolarHBondContact O-N 2.94Å; L268-N272 VanDerWaalsContact O-CB 3.27Å; L268-N272 WeakPolarHBondContact O-CB 3.43Å; L268-N272 PolarHBondContact O-N 3.27Å
269A91.9Very high92.1Very high60 Ų60106.4 Ų106.450%0.49652%0.521SS..Hα-helixtrans-64.9-43.817400000111.4Y265 N272 M273Y265-A269 VanDerWaalsContact O-CB 3.25Å; Y265-A269 WeakPolarHBondContact O-CB 3.3Å; Y265-A269 PolarHBondContact O-N 2.77Å; A269-N272 PolarHBondContact O-N 3.27Å; A269-M273 WeakPolarHBondContact O-CB 3.47Å; A269-M273 PolarHBondContact O-N 2.98Å
270A93Very high92.7Very high54 Ų54105.4 Ų105.445%0.44652%0.517SS..Hα-helixtrans-61.4-43.6173.900000112.1E266 M273 Q274E266-A270 VanDerWaalsContact O-CB 3.3Å; E266-A270 WeakPolarHBondContact O-CB 3.22Å; E266-A270 PolarHBondContact O-N 2.73Å; A270-M273 PolarHBondContact O-N 2.91Å; A270-Q274 WeakPolarHBondContact O-CB 3.26Å; A270-Q274 PolarHBondContact O-N 3.28Å
271K94.6Very high93.2Very high121 Ų121106.6 Ų106.653%0.52652%0.518SS..Hα-helixtrans-62.8-42.9172.8-82.9-173.7168-163.40112.8K267 L268 Q274 N275K267-K271 WeakPolarHBondContact O-CB 3.21Å; K267-K271 WeakPolarHBondContact O-CG 3.17Å; K267-K271 PolarHBondContact O-N 3.42Å; L268-K271 PolarHBondContact O-N 2.94Å; K271-Q274 PolarHBondContact O-N 2.9Å; K271-N275 VanDerWaalsContact O-CB 3.3Å; K271-N275 WeakPolarHBondContact O-CB 3.38Å; K271-N275 PolarHBondContact O-N 3.05Å; K271-N275 PolarHBondContact O-OD1 2.83Å
272N94.3Very high93.6Very high111 Ų111106.1 Ų106.159%0.59452%0.521SS*.Hα-helixtrans-62.2-45.5178-172-14000110.2L268 A269 Q274 N275 A276L268-N272 VanDerWaalsContact O-CB 3.27Å; L268-N272 WeakPolarHBondContact O-CB 3.43Å; L268-N272 PolarHBondContact O-N 3.27Å; A269-N272 PolarHBondContact O-N 3.27Å; N272-Q274 PolarHBondContact O-N 3.38Å; N272-N275 PolarHBondContact O-N 2.91Å; N272-A276 WeakPolarHBondContact O-CB 3.22Å; N272-A276 PolarHBondContact O-N 3.28Å
273M94.1Very high94Very high125 Ų125105.2 Ų105.262%0.61652%0.517SS*.Hα-helixtrans-60.9-44.8175.4-167.1171.775.700112.4A269 A270 A276 E277A269-M273 WeakPolarHBondContact O-CB 3.47Å; A269-M273 PolarHBondContact O-N 2.98Å; A270-M273 PolarHBondContact O-N 2.91Å; M273-A276 PolarHBondContact O-N 3.05Å; M273-E277 PolarHBondContact O-N 2.97Å
274Q95.3Very high94.4Very high105 Ų105109.9 Ų109.949%0.49153%0.529SS..Hα-helixtrans-63-46.8175.1-178.1178.4-7.800111.9A270 K271 N272 A276 E277 E278A270-Q274 WeakPolarHBondContact O-CB 3.26Å; A270-Q274 PolarHBondContact O-N 3.28Å; K271-Q274 PolarHBondContact O-N 2.9Å; N272-Q274 PolarHBondContact O-N 3.38Å; Q274-A276 VanDerWaalsContact C-N 3.3Å; Q274-A276 PolarHBondContact O-N 3.16Å; Q274-E277 WeakPolarHBondContact O-CB 3.47Å; Q274-E277 PolarHBondContact O-N 3.18Å; Q274-E278 HydrophobicContact CG-CG 4.45Å; Q274-E278 VanDerWaalsContact CG-OE1 3.31Å; Q274-E278 WeakPolarHBondContact CG-OE1 3.33Å; Q274-E278 PolarHBondContact NE2-OE1 2.95Å; Q274-E278 WeakPolarHBondContact O-CB 3.37Å; Q274-E278 WeakPolarHBondContact O-CG 3.49Å; Q274-E278 PolarHBondContact O-N 3.2Å
275N94.6Very high94.7Very high99 Ų99108 Ų10853%0.52953%0.525SS..Hα-helixtrans-61.3-39.3177.8-71.88.2000111.4K271 N272 E278 W279K271-N275 VanDerWaalsContact O-CB 3.3Å; K271-N275 WeakPolarHBondContact O-CB 3.38Å; K271-N275 PolarHBondContact O-N 3.05Å; K271-N275 PolarHBondContact O-OD1 2.83Å; N272-N275 PolarHBondContact O-N 2.91Å; N275-E278 PolarHBondContact O-N 3.23Å; N275-W279 WeakPolarHBondContact O-CB 3.27Å; N275-W279 PolarHBondContact O-N 3.33Å
276A93.6Very high94.9Very high37 Ų37103.6 Ų103.631%0.30652%0.515SS..Hα-helixtrans-65.3-45.1175.100000111.3N272 M273 Q274 E278 W279 F280N272-A276 WeakPolarHBondContact O-CB 3.22Å; N272-A276 PolarHBondContact O-N 3.28Å; M273-A276 PolarHBondContact O-N 3.05Å; Q274-A276 VanDerWaalsContact C-N 3.3Å; Q274-A276 PolarHBondContact O-N 3.16Å; A276-E278 PolarHBondContact O-N 2.9Å; A276-W279 PolarHBondContact O-N 2.94Å; A276-F280 WeakPolarHBondContact O-CB 3.49Å; A276-F280 WeakPolarHBondContact O-CD2 3.47Å; A276-F280 PolarHBondContact O-N 2.89Å
277E95.3Very high95.1Very high90 Ų90103.4 Ų103.442%0.42152%0.517SS..Hα-helixtrans-59.5-44.9173.7-81.6-170.3-14300112.7M273 Q274 F280 K281M273-E277 PolarHBondContact O-N 2.97Å; Q274-E277 WeakPolarHBondContact O-CB 3.47Å; Q274-E277 PolarHBondContact O-N 3.18Å; E277-F280 PolarHBondContact O-N 3.49Å; E277-K281 WeakPolarHBondContact O-CB 3.43Å; E277-K281 WeakPolarHBondContact O-CD 3.41Å; E277-K281 WeakPolarHBondContact O-CG 3.39Å; E277-K281 PolarHBondContact O-N 2.9Å; E277-K281 IonicContact OE2-NZ 2.73Å; E277-K281 PolarHBondContact OE2-NZ 3.28Å
278E95.2Very high95.3Very high97 Ų97100.2 Ų100.245%0.45351%0.51SS..Hα-helixtrans-66.5-39.3178.2-73.5174.7-168.100111.4Q274 N275 A276 K281 S282Q274-E278 HydrophobicContact CG-CG 4.45Å; Q274-E278 VanDerWaalsContact CG-OE1 3.31Å; Q274-E278 WeakPolarHBondContact CG-OE1 3.33Å; Q274-E278 PolarHBondContact NE2-OE1 2.95Å; Q274-E278 WeakPolarHBondContact O-CB 3.37Å; Q274-E278 WeakPolarHBondContact O-CG 3.49Å; Q274-E278 PolarHBondContact O-N 3.2Å; N275-E278 PolarHBondContact O-N 3.23Å; A276-E278 PolarHBondContact O-N 2.9Å; E278-K281 PolarHBondContact O-N 3.32Å; E278-S282 VanDerWaalsContact O-CB 3.25Å; E278-S282 WeakPolarHBondContact O-CB 3.36Å; E278-S282 PolarHBondContact O-N 3.25Å
279W95.8Very high95.5Very high164 Ų164100.1 Ų100.162%0.62151%0.506SS*.Hα-helixtrans-62.9-46.4172.9-17688.1000112N275 A276 S282 R283N275-W279 WeakPolarHBondContact O-CB 3.27Å; N275-W279 PolarHBondContact O-N 3.33Å; A276-W279 PolarHBondContact O-N 2.94Å; W279-S282 PolarHBondContact O-N 2.91Å; W279-R283 WeakPolarHBondContact O-CB 3.4Å; W279-R283 PolarHBondContact O-N 3.5Å
280F96.6Very high95.7Very high133 Ų133100.7 Ų100.758%0.58351%0.507SS*.Hα-helixtrans-63.1-44175.4-79.6-61.5000111.9A276 E277 R283 F284A276-F280 WeakPolarHBondContact O-CB 3.49Å; A276-F280 WeakPolarHBondContact O-CD2 3.47Å; A276-F280 PolarHBondContact O-N 2.89Å; E277-F280 PolarHBondContact O-N 3.49Å; F280-R283 PolarHBondContact O-N 3.12Å; F280-F284 VanDerWaalsContact O-CB 3.32Å; F280-F284 WeakPolarHBondContact O-CB 3.48Å; F280-F284 PolarHBondContact O-N 3.39Å
281K97.1Very high95.8Very high116 Ų116100.6 Ų100.650%0.50451%0.506SS..Hα-helixtrans-60.2-48.1176.4-72.6161.1-165.8162.10110.9E277 E278 F284 T285E277-K281 WeakPolarHBondContact O-CB 3.43Å; E277-K281 WeakPolarHBondContact O-CD 3.41Å; E277-K281 WeakPolarHBondContact O-CG 3.39Å; E277-K281 PolarHBondContact O-N 2.9Å; E277-K281 IonicContact OE2-NZ 2.73Å; E277-K281 PolarHBondContact OE2-NZ 3.28Å; E278-K281 PolarHBondContact O-N 3.32Å; K281-F284 PolarHBondContact O-N 3.01Å; K281-T285 PolarHBondContact O-N 2.95Å; K281-T285 PolarHBondContact O-OG1 2.87Å
282S96.7Very high95.9Very high67 Ų6796.9 Ų96.947%0.46950%0.498SS..Hα-helixtrans-61.9-43.9176.9-1790000112.4E278 W279 F284 T285 V286E278-S282 VanDerWaalsContact O-CB 3.25Å; E278-S282 WeakPolarHBondContact O-CB 3.36Å; E278-S282 PolarHBondContact O-N 3.25Å; W279-S282 PolarHBondContact O-N 2.91Å; S282-F284 VanDerWaalsContact C-N 3.29Å; S282-F284 PolarHBondContact O-N 2.95Å; S282-T285 PolarHBondContact O-N 2.95Å; S282-T285 PolarHBondContact O-OG1 2.97Å; S282-V286 WeakPolarHBondContact O-CG2 3.14Å; S282-V286 PolarHBondContact O-N 3.08Å
283R96.6Very high96.1Very high147 Ų14798.3 Ų98.356%0.55550%0.499SS*.Hα-helixtrans-63.1-37.7175.3-174.456.7174.6179.3-0.2111.6W279 F280 L287W279-R283 WeakPolarHBondContact O-CB 3.4Å; W279-R283 PolarHBondContact O-N 3.5Å; F280-R283 PolarHBondContact O-N 3.12Å; R283-L287 WeakPolarHBondContact O-CB 3.25Å; R283-L287 PolarHBondContact O-N 2.9Å
284F97.1Very high96.2Very high148 Ų14897.4 Ų97.465%0.64950%0.497SS*.Hα-helixtrans-70.2-40.2178.2-153.8-81.6000112.5F280 K281 S282 L287 T288F280-F284 VanDerWaalsContact O-CB 3.32Å; F280-F284 WeakPolarHBondContact O-CB 3.48Å; F280-F284 PolarHBondContact O-N 3.39Å; K281-F284 PolarHBondContact O-N 3.01Å; S282-F284 VanDerWaalsContact C-N 3.29Å; S282-F284 PolarHBondContact O-N 2.95Å; F284-L287 PolarHBondContact O-N 3.06Å; F284-T288 WeakPolarHBondContact O-CB 3.39Å; F284-T288 PolarHBondContact O-N 3.06Å; F284-T288 PolarHBondContact O-OG1 3.23Å
285T96.9Very high96.3Very high73 Ų7396.1 Ų96.145%0.44850%0.496SS..Hα-helixtrans-64.4-46.9173.754.10000111.2K281 S282 L287 T288 E289K281-T285 PolarHBondContact O-N 2.95Å; K281-T285 PolarHBondContact O-OG1 2.87Å; S282-T285 PolarHBondContact O-N 2.95Å; S282-T285 PolarHBondContact O-OG1 2.97Å; T285-L287 VanDerWaalsContact C-N 3.31Å; T285-L287 PolarHBondContact O-N 3.12Å; T285-T288 PolarHBondContact O-N 2.97Å; T285-T288 VanDerWaalsContact O-N 3.13Å; T285-E289 WeakPolarHBondContact O-CB 3.14Å; T285-E289 WeakPolarHBondContact O-CG 3.5Å; T285-E289 PolarHBondContact O-N 2.88Å
286V96.9Very high96.4Very high71 Ų7195.4 Ų95.443%0.4349%0.492SS..Hα-helixtrans-58.8-41.7175.7171.30000111.6S282 S290S282-V286 WeakPolarHBondContact O-CG2 3.14Å; S282-V286 PolarHBondContact O-N 3.08Å; V286-S290 WeakPolarHBondContact O-CB 3.19Å; V286-S290 PolarHBondContact O-N 2.92Å
287L96.1Very high96.5Very high104 Ų10496.4 Ų96.455%0.54550%0.501SS..Hα-helixtrans-65.8-40.2176.8-159.882.1000111.9R283 F284 T285 S290 A291R283-L287 WeakPolarHBondContact O-CB 3.25Å; R283-L287 PolarHBondContact O-N 2.9Å; F284-L287 PolarHBondContact O-N 3.06Å; T285-L287 VanDerWaalsContact C-N 3.31Å; T285-L287 PolarHBondContact O-N 3.12Å; L287-S290 PolarHBondContact O-N 3.24Å; L287-A291 WeakPolarHBondContact O-CB 3.31Å; L287-A291 PolarHBondContact O-N 2.83Å
288T96.9Very high96.5Very high76 Ų7695.5 Ų95.547%0.46650%0.501SS..Hα-helixtrans-68.8-43.2179.2-56.20000111.6F284 T285 A291 A292F284-T288 WeakPolarHBondContact O-CB 3.39Å; F284-T288 PolarHBondContact O-N 3.06Å; F284-T288 PolarHBondContact O-OG1 3.23Å; T285-T288 PolarHBondContact O-N 2.97Å; T285-T288 VanDerWaalsContact O-N 3.13Å; T288-A291 PolarHBondContact O-N 3.27Å; T288-A292 WeakPolarHBondContact O-CB 3.05Å; T288-A292 PolarHBondContact O-N 3.03Å
289E97.3Very high96.6Very high104 Ų10497.2 Ų97.249%0.48650%0.503SS..Hα-helixtrans-65.1-40.9174.3-72.7174.8-156.100112.1T285 A292 K293T285-E289 WeakPolarHBondContact O-CB 3.14Å; T285-E289 WeakPolarHBondContact O-CG 3.5Å; T285-E289 PolarHBondContact O-N 2.88Å; E289-A292 PolarHBondContact O-N 3.5Å; E289-K293 WeakPolarHBondContact O-CB 3.37Å; E289-K293 VanDerWaalsContact O-CG 3.29Å; E289-K293 WeakPolarHBondContact O-CG 3.39Å; E289-K293 PolarHBondContact O-N 3.48Å
290S95.6Very high96.6Very high72 Ų7292.1 Ų92.150%0.50350%0.496SS..Hα-helixtrans-64.4-41.6175.4-172.90000111.6V286 L287 K293 N294V286-S290 WeakPolarHBondContact O-CB 3.19Å; V286-S290 PolarHBondContact O-N 2.92Å; L287-S290 PolarHBondContact O-N 3.24Å; S290-K293 PolarHBondContact O-N 3.18Å; S290-N294 WeakPolarHBondContact O-CB 3.48Å; S290-N294 PolarHBondContact O-N 3.45Å
291A96.3Very high96.5Very high53 Ų5388.1 Ų88.144%0.43849%0.488SS..Hα-helixtrans-62.8-44173.800000111.9L287 T288 N294 T295L287-A291 WeakPolarHBondContact O-CB 3.31Å; L287-A291 PolarHBondContact O-N 2.83Å; T288-A291 PolarHBondContact O-N 3.27Å; A291-N294 PolarHBondContact O-N 3.06Å; A291-T295 WeakPolarHBondContact O-CG2 3.5Å; A291-T295 PolarHBondContact O-N 3.36Å; A291-T295 PolarHBondContact O-OG1 3.29Å
292A96.8Very high96.5Very high43 Ų4389.4 Ų89.436%0.35549%0.493SS..Hα-helixtrans-60-51176.100000111.6T288 E289 N294 T295 D296T288-A292 WeakPolarHBondContact O-CB 3.05Å; T288-A292 PolarHBondContact O-N 3.03Å; E289-A292 PolarHBondContact O-N 3.5Å; A292-N294 VanDerWaalsContact C-N 3.3Å; A292-N294 PolarHBondContact O-N 2.8Å; A292-T295 WeakPolarHBondContact CA-OG1 3.44Å; A292-T295 PolarHBondContact O-N 3.16Å; A292-T295 PolarHBondContact O-OG1 3.48Å; A292-D296 PolarHBondContact O-N 3Å
293K96.9Very high96.4Very high140 Ų14090.6 Ų90.661%0.60949%0.494SS*.Hα-helixtrans-55.4-43.1175.6-73.3168.5-177.2170.90112.2E289 S290 D296 A297E289-K293 WeakPolarHBondContact O-CB 3.37Å; E289-K293 VanDerWaalsContact O-CG 3.29Å; E289-K293 WeakPolarHBondContact O-CG 3.39Å; E289-K293 PolarHBondContact O-N 3.48Å; S290-K293 PolarHBondContact O-N 3.18Å; K293-D296 PolarHBondContact O-N 2.83Å; K293-A297 WeakPolarHBondContact O-CB 3.46Å; K293-A297 PolarHBondContact O-N 3.24Å
294N96.3Very high96.2Very high106 Ų10690 Ų9057%0.56750%0.498SS*.Hα-helixtrans-64.6-43.3175.9-169.112.6000111.7S290 A291 A292 D296 A297 V298S290-N294 WeakPolarHBondContact O-CB 3.48Å; S290-N294 PolarHBondContact O-N 3.45Å; A291-N294 PolarHBondContact O-N 3.06Å; A292-N294 VanDerWaalsContact C-N 3.3Å; A292-N294 PolarHBondContact O-N 2.8Å; N294-D296 VanDerWaalsContact C-N 3.29Å; N294-D296 PolarHBondContact O-N 2.85Å; N294-A297 PolarHBondContact O-N 2.94Å; N294-V298 WeakPolarHBondContact O-CB 3.37Å; N294-V298 WeakPolarHBondContact O-CG2 3.39Å; N294-V298 PolarHBondContact O-N 3.25Å
295T97.3Very high96.2Very high78 Ų7887.8 Ų87.848%0.47950%0.496SS..Hα-helixtrans-64.7-31.9175.856.50000113.5A291 A292 R299A291-T295 WeakPolarHBondContact O-CG2 3.5Å; A291-T295 PolarHBondContact O-N 3.36Å; A291-T295 PolarHBondContact O-OG1 3.29Å; A292-T295 WeakPolarHBondContact CA-OG1 3.44Å; A292-T295 PolarHBondContact O-N 3.16Å; A292-T295 PolarHBondContact O-OG1 3.48Å; T295-R299 PolarHBondContact O-N 3.31Å; T295-R299 VanDerWaalsContact O-N 3.1Å
296D97Very high96Very high85 Ų8587.2 Ų87.246%0.45550%0.495SS..Hα-helixtrans-75.6-40.3176.6-67.9-21.2000111.6A292 K293 N294 R299 A300A292-D296 PolarHBondContact O-N 3Å; K293-D296 PolarHBondContact O-N 2.83Å; N294-D296 VanDerWaalsContact C-N 3.29Å; N294-D296 PolarHBondContact O-N 2.85Å; D296-R299 WeakPolarHBondContact O-CB 3.39Å; D296-R299 PolarHBondContact O-N 3.35Å; D296-R299 VanDerWaalsContact O-N 3.12Å; D296-R299 IonicContact OD1-CZ 3.21Å; D296-R299 IonicContact OD1-NH1 2.64Å; D296-R299 PolarHBondContact OD1-NH1 3.3Å; D296-R299 IonicContact OD1-NH2 2.85Å; D296-A300 PolarHBondContact O-N 2.89Å
297A95.6Very high95.9Very high58 Ų5888.2 Ų88.248%0.47950%0.495SS..Hα-helixtrans-60.4-43.9171.700000112K293 N294 R299 A300 A301K293-A297 WeakPolarHBondContact O-CB 3.46Å; K293-A297 PolarHBondContact O-N 3.24Å; N294-A297 PolarHBondContact O-N 2.94Å; A297-R299 VanDerWaalsContact C-N 3.26Å; A297-R299 PolarHBondContact O-N 2.93Å; A297-A300 PolarHBondContact O-N 3.16Å; A297-A301 WeakPolarHBondContact O-CB 3.18Å; A297-A301 PolarHBondContact O-N 3.33Å
298V96.4Very high95.8Very high71 Ų7186.4 Ų86.443%0.4349%0.491SS..Hα-helixtrans-64.1-30.2174.3169.80000112.1N294 K302N294-V298 WeakPolarHBondContact O-CB 3.37Å; N294-V298 WeakPolarHBondContact O-CG2 3.39Å; N294-V298 PolarHBondContact O-N 3.25Å; V298-K302 VanDerWaalsContact O-CG 3.31Å; V298-K302 WeakPolarHBondContact O-CG 3.37Å; V298-K302 PolarHBondContact O-N 3.45Å
299R97.1Very high95.6Very high133 Ų13391 Ų9150%0.50250%0.5SS..Hα-helixtrans-72.8-48.9173.7-165.7-177.6-5896.50.9111T295 D296 A297 A301 K302 D303T295-R299 PolarHBondContact O-N 3.31Å; T295-R299 VanDerWaalsContact O-N 3.1Å; D296-R299 WeakPolarHBondContact O-CB 3.39Å; D296-R299 PolarHBondContact O-N 3.35Å; D296-R299 VanDerWaalsContact O-N 3.12Å; D296-R299 IonicContact OD1-CZ 3.21Å; D296-R299 IonicContact OD1-NH1 2.64Å; D296-R299 PolarHBondContact OD1-NH1 3.3Å; D296-R299 IonicContact OD1-NH2 2.85Å; A297-R299 VanDerWaalsContact C-N 3.26Å; A297-R299 PolarHBondContact O-N 2.93Å; R299-A301 VanDerWaalsContact C-N 3.35Å; R299-A301 PolarHBondContact O-N 2.98Å; R299-K302 WeakPolarHBondContact O-CB 3.34Å; R299-K302 PolarHBondContact O-N 2.87Å; R299-D303 VanDerWaalsContact O-CG 3.31Å; R299-D303 PolarHBondContact O-N 3.4Å
300A95.4Very high95.5Very high57 Ų5794 Ų9447%0.47151%0.507SS..Hα-helixtrans-56.1-46.9177.400000112D296 A297 K302 D303 E304D296-A300 PolarHBondContact O-N 2.89Å; A297-A300 PolarHBondContact O-N 3.16Å; A300-K302 VanDerWaalsContact C-N 3.3Å; A300-K302 PolarHBondContact O-N 3.42Å; A300-D303 PolarHBondContact O-N 2.69Å; A300-E304 WeakPolarHBondContact O-CB 3.5Å; A300-E304 PolarHBondContact O-N 2.93Å
301A93.8Very high95.4Very high49 Ų4996 Ų9641%0.40551%0.512SS..Hα-helixtrans-62.6-33.9176.300000113A297 R299 V305A297-A301 WeakPolarHBondContact O-CB 3.18Å; A297-A301 PolarHBondContact O-N 3.33Å; R299-A301 VanDerWaalsContact C-N 3.35Å; R299-A301 PolarHBondContact O-N 2.98Å; A301-V305 WeakPolarHBondContact O-CB 3.49Å; A301-V305 VanDerWaalsContact O-CG2 3.25Å; A301-V305 WeakPolarHBondContact O-CG2 3.42Å; A301-V305 PolarHBondContact O-N 3.2Å
302K96.9Very high95.2Very high143 Ų14398.9 Ų98.962%0.62252%0.519SS*.Hα-helixtrans-69.8-40173.7-80.8176.9177.6179.70112.4V298 R299 A300 S306V298-K302 VanDerWaalsContact O-CG 3.31Å; V298-K302 WeakPolarHBondContact O-CG 3.37Å; V298-K302 PolarHBondContact O-N 3.45Å; R299-K302 WeakPolarHBondContact O-CB 3.34Å; R299-K302 PolarHBondContact O-N 2.87Å; A300-K302 VanDerWaalsContact C-N 3.3Å; A300-K302 PolarHBondContact O-N 3.42Å; K302-S306 WeakPolarHBondContact O-CB 3.5Å; K302-S306 PolarHBondContact O-N 3.02Å
303D95.1Very high95Very high91 Ų91102.9 Ų102.949%0.48753%0.528SS..Hα-helixtrans-67-43.8178.8-64.4-23.4000109.8R299 A300 S306 E307R299-D303 VanDerWaalsContact O-CG 3.31Å; R299-D303 PolarHBondContact O-N 3.4Å; A300-D303 PolarHBondContact O-N 2.69Å; D303-S306 WeakPolarHBondContact O-CA 3.38Å; D303-S306 WeakPolarHBondContact O-CB 3.37Å; D303-S306 PolarHBondContact O-N 3.16Å; D303-S306 VanDerWaalsContact O-N 3.08Å; D303-S306 PolarHBondContact O-OG 2.83Å; D303-E307 PolarHBondContact O-N 2.8Å
304E93.5Very high94.6Very high136 Ų13698.7 Ų98.764%0.63652%0.52SS*.Hα-helixtrans-57.2-51.8172.5-176.5176.1-162.500112A300 S306 E307 S308A300-E304 WeakPolarHBondContact O-CB 3.5Å; A300-E304 PolarHBondContact O-N 2.93Å; E304-S306 PolarHBondContact O-N 3.18Å; E304-E307 PolarHBondContact O-N 3.2Å; E304-E307 VanDerWaalsContact O-N 3.12Å; E304-S308 PolarHBondContact O-N 2.98Å; E304-S308 PolarHBondContact O-OG 2.84Å; E304-S308 VanDerWaalsContact O-OG 3.04Å
305V95.1Very high94.2Very high100 Ų10099.2 Ų99.261%0.60652%0.517SS*.Hα-helixtrans-57.1-34.4174.4166.70000112A301 R309A301-V305 WeakPolarHBondContact O-CB 3.49Å; A301-V305 VanDerWaalsContact O-CG2 3.25Å; A301-V305 WeakPolarHBondContact O-CG2 3.42Å; A301-V305 PolarHBondContact O-N 3.2Å; V305-R309 VanDerWaalsContact O-CB 3.26Å; V305-R309 WeakPolarHBondContact O-CB 3.36Å; V305-R309 PolarHBondContact O-N 3.07Å
306S94.4Very high93.8Very high61 Ų6198.2 Ų98.243%0.42751%0.511SS..Hα-helixtrans-70.8-39.2178.386.20000112.7K302 D303 E304 R309 R310K302-S306 WeakPolarHBondContact O-CB 3.5Å; K302-S306 PolarHBondContact O-N 3.02Å; D303-S306 WeakPolarHBondContact O-CA 3.38Å; D303-S306 WeakPolarHBondContact O-CB 3.37Å; D303-S306 PolarHBondContact O-N 3.16Å; D303-S306 VanDerWaalsContact O-N 3.08Å; D303-S306 PolarHBondContact O-OG 2.83Å; E304-S306 PolarHBondContact O-N 3.18Å; S306-R309 PolarHBondContact O-N 3.27Å; S306-R310 PolarHBondContact O-N 2.92Å
307E94.6Very high93.6Very high93 Ų9399.5 Ų99.544%0.43552%0.517SS..Hα-helixtrans-74.6-40.8176-73.6-59.2148.100111.7D303 E304 R309 R310 L311D303-E307 PolarHBondContact O-N 2.8Å; E304-E307 PolarHBondContact O-N 3.2Å; E304-E307 VanDerWaalsContact O-N 3.12Å; E307-R309 VanDerWaalsContact C-N 3.25Å; E307-R309 PolarHBondContact O-N 2.69Å; E307-R310 CarbonylContact O-C 3.51Å; E307-R310 WeakPolarHBondContact O-CA 3.37Å; E307-R310 VanDerWaalsContact O-CB 3.32Å; E307-R310 WeakPolarHBondContact O-CB 3.4Å; E307-R310 PolarHBondContact O-N 3.47Å; E307-R310 IonicContact OE1-NH1 3.79Å; E307-R310 WeakPolarHBondContact OE2-CD 3.31Å; E307-L311 WeakPolarHBondContact O-CG 3.38Å; E307-L311 PolarHBondContact O-N 3.4Å
308S92.8Very high93.4Very high66 Ų66101.4 Ų101.446%0.46252%0.516SS..Hα-helixtrans-56-41.8169.9-55.10000111.4E304 R310 L311 L312E304-S308 PolarHBondContact O-N 2.98Å; E304-S308 PolarHBondContact O-OG 2.84Å; E304-S308 VanDerWaalsContact O-OG 3.04Å; S308-R310 VanDerWaalsContact C-N 3.3Å; S308-R310 PolarHBondContact O-N 2.93Å; S308-L311 PolarHBondContact O-N 3.29Å; S308-L312 WeakPolarHBondContact O-CB 3.45Å; S308-L312 PolarHBondContact O-N 2.88Å
309R94.1Very high93.1Very high172 Ų172102 Ų10265%0.64952%0.516SS*.Hα-helixtrans-68.2-27.8175.2-170.4174.6-171.6178.24.1113V305 S306 E307 K313V305-R309 VanDerWaalsContact O-CB 3.26Å; V305-R309 WeakPolarHBondContact O-CB 3.36Å; V305-R309 PolarHBondContact O-N 3.07Å; S306-R309 PolarHBondContact O-N 3.27Å; E307-R309 VanDerWaalsContact C-N 3.25Å; E307-R309 PolarHBondContact O-N 2.69Å; R309-K313 WeakPolarHBondContact O-CG 3.33Å; R309-K313 PolarHBondContact O-N 3.39Å
310R93.9Very high92.9Very high168 Ų168100.8 Ų100.863%0.63452%0.516SS*.Hα-helixtrans-74.2-45.6174.1-172.7-174.2-174.8155.2-0.1111.3S306 E307 S308 K313 A314S306-R310 PolarHBondContact O-N 2.92Å; E307-R310 CarbonylContact O-C 3.51Å; E307-R310 WeakPolarHBondContact O-CA 3.37Å; E307-R310 VanDerWaalsContact O-CB 3.32Å; E307-R310 WeakPolarHBondContact O-CB 3.4Å; E307-R310 PolarHBondContact O-N 3.47Å; E307-R310 IonicContact OE1-NH1 3.79Å; E307-R310 WeakPolarHBondContact OE2-CD 3.31Å; S308-R310 VanDerWaalsContact C-N 3.3Å; S308-R310 PolarHBondContact O-N 2.93Å; R310-K313 PolarHBondContact O-N 3.32Å; R310-A314 PolarHBondContact O-N 2.86Å
311L94.1Very high92.5Very high114 Ų114101.1 Ų101.160%0.59752%0.519SS*.Hα-helixtrans-59.8-45.7174.8-71.7169000111.2E307 S308 K313 A314 K315E307-L311 WeakPolarHBondContact O-CG 3.38Å; E307-L311 PolarHBondContact O-N 3.4Å; S308-L311 PolarHBondContact O-N 3.29Å; L311-K313 PolarHBondContact O-N 3.27Å; L311-A314 WeakPolarHBondContact O-CB 3.49Å; L311-A314 PolarHBondContact O-N 3.2Å; L311-A314 VanDerWaalsContact O-N 3.15Å; L311-K315 PolarHBondContact O-N 3.31Å
312L92.4Very high92Very high113 Ų113102.2 Ų102.259%0.59252%0.523SS*.Hα-helixtrans-56.3-49.6175.7-170158.7000110.9S308 A314 K315 T316S308-L312 WeakPolarHBondContact O-CB 3.45Å; S308-L312 PolarHBondContact O-N 2.88Å; L312-A314 PolarHBondContact O-N 3.42Å; L312-K315 PolarHBondContact O-N 2.92Å; L312-T316 PolarHBondContact O-N 3.07Å; L312-T316 PolarHBondContact O-OG1 2.9Å
313K92.9Very high91.7Very high126 Ų126103.1 Ų103.155%0.54852%0.522SS..Hα-helixtrans-60.1-41.5175.9-74.3174.5178.3-177.20113.1R309 R310 L311 K315 T316 L317R309-K313 WeakPolarHBondContact O-CG 3.33Å; R309-K313 PolarHBondContact O-N 3.39Å; R310-K313 PolarHBondContact O-N 3.32Å; L311-K313 PolarHBondContact O-N 3.27Å; K313-K315 VanDerWaalsContact C-N 3.35Å; K313-T316 PolarHBondContact O-N 2.84Å; K313-L317 WeakPolarHBondContact O-CG 3.47Å; K313-L317 PolarHBondContact O-N 2.8Å
314A88.3Confident91.5Very high53 Ų53100.6 Ų100.644%0.43852%0.518SS..Hα-helixtrans-62.2-44.4177.600000111R310 L311 L312 L317 E318R310-A314 PolarHBondContact O-N 2.86Å; L311-A314 WeakPolarHBondContact O-CB 3.49Å; L311-A314 PolarHBondContact O-N 3.2Å; L311-A314 VanDerWaalsContact O-N 3.15Å; L312-A314 PolarHBondContact O-N 3.42Å; A314-L317 PolarHBondContact O-N 2.94Å; A314-E318 PolarHBondContact O-N 3.47Å
315K87.4Confident91.2Very high116 Ų116100.2 Ų100.250%0.50452%0.518SS..Hα-helixtrans-67.8-34.7175.8-72.9-74.1164.9-162.90113L311 L312 K313 E318 I319L311-K315 PolarHBondContact O-N 3.31Å; L312-K315 PolarHBondContact O-N 2.92Å; K313-K315 VanDerWaalsContact C-N 3.35Å; K315-E318 VanDerWaalsContact CD-OE2 3.31Å; K315-E318 WeakPolarHBondContact CD-OE2 3.37Å; K315-E318 VanDerWaalsContact CE-OE2 3.26Å; K315-E318 WeakPolarHBondContact CE-OE2 3.2Å; K315-E318 VanDerWaalsContact NZ-CD 3.25Å; K315-E318 IonicContact NZ-OE1 3.64Å; K315-E318 PolarHBondContact NZ-OE1 3.23Å; K315-E318 IonicContact NZ-OE2 2.82Å; K315-E318 PolarHBondContact NZ-OE2 2.99Å; K315-E318 PolarHBondContact O-N 2.88Å; K315-I319 WeakPolarHBondContact O-CD1 3.47Å; K315-I319 VanDerWaalsContact O-CG1 3.25Å; K315-I319 WeakPolarHBondContact O-CG1 3.44Å; K315-I319 PolarHBondContact O-N 3.3Å
316T89.4Confident90.6Very high57 Ų5799.9 Ų99.935%0.3551%0.513SS..Hα-helixtrans-60.9-45.8170.9-52.10000111.5L312 K313 E318 I319 E320L312-T316 PolarHBondContact O-N 3.07Å; L312-T316 PolarHBondContact O-OG1 2.9Å; K313-T316 PolarHBondContact O-N 2.84Å; T316-E318 VanDerWaalsContact C-N 3.34Å; T316-E318 PolarHBondContact O-N 3Å; T316-I319 PolarHBondContact O-N 2.84Å; T316-E320 WeakPolarHBondContact O-CG 3.18Å; T316-E320 PolarHBondContact O-N 3.08Å
317L92.1Very high90.5Very high113 Ų113101.7 Ų101.759%0.59251%0.514SS*.Hα-helixtrans-65.8-35.1177.5-69.3171.1000112.6K313 A314 E320 A321K313-L317 WeakPolarHBondContact O-CG 3.47Å; K313-L317 PolarHBondContact O-N 2.8Å; A314-L317 PolarHBondContact O-N 2.94Å; L317-E320 PolarHBondContact O-N 2.86Å; L317-A321 WeakPolarHBondContact O-CB 3.07Å; L317-A321 PolarHBondContact O-N 3.26Å
318E91.4Very high90.3Very high97 Ų9799.3 Ų99.345%0.45351%0.511SS..Hα-helixtrans-64.7-45173.5-168.4177164.300111.2A314 K315 T316 E320 A321 C322A314-E318 PolarHBondContact O-N 3.47Å; K315-E318 VanDerWaalsContact CD-OE2 3.31Å; K315-E318 WeakPolarHBondContact CD-OE2 3.37Å; K315-E318 VanDerWaalsContact CE-OE2 3.26Å; K315-E318 WeakPolarHBondContact CE-OE2 3.2Å; K315-E318 VanDerWaalsContact NZ-CD 3.25Å; K315-E318 IonicContact NZ-OE1 3.64Å; K315-E318 PolarHBondContact NZ-OE1 3.23Å; K315-E318 IonicContact NZ-OE2 2.82Å; K315-E318 PolarHBondContact NZ-OE2 2.99Å; K315-E318 PolarHBondContact O-N 2.88Å; T316-E318 VanDerWaalsContact C-N 3.34Å; T316-E318 PolarHBondContact O-N 3Å; E318-E320 PolarHBondContact O-N 3.13Å; E318-A321 PolarHBondContact O-N 3.16Å; E318-C322 WeakPolarHBondContact O-CB 3.37Å; E318-C322 PolarHBondContact O-N 2.87Å; E318-C322 PolarHBondContact O-SG 3.44Å; E318-C322 VanDerWaalsContact O-SG 3.36Å
319I91Very high89.9Confident84 Ų84100.5 Ų100.543%0.43151%0.512SS..Hα-helixtrans-61.6-43.2173.9-69.2163.4000111.4K315 T316 C322 R323K315-I319 WeakPolarHBondContact O-CD1 3.47Å; K315-I319 VanDerWaalsContact O-CG1 3.25Å; K315-I319 WeakPolarHBondContact O-CG1 3.44Å; K315-I319 PolarHBondContact O-N 3.3Å; T316-I319 PolarHBondContact O-N 2.84Å; I319-C322 PolarHBondContact O-N 3.46Å; I319-R323 WeakPolarHBondContact O-CB 3.48Å; I319-R323 VanDerWaalsContact O-CG 3.29Å; I319-R323 WeakPolarHBondContact O-CG 3.43Å; I319-R323 PolarHBondContact O-N 3.07Å
320E92.6Very high89.6Confident107 Ų10798.2 Ų98.250%0.551%0.508SS..Hα-helixtrans-63.5-40.1176.1-74.5172.1-173.100112T316 L317 E318 R323 G324T316-E320 WeakPolarHBondContact O-CG 3.18Å; T316-E320 PolarHBondContact O-N 3.08Å; L317-E320 PolarHBondContact O-N 2.86Å; E318-E320 PolarHBondContact O-N 3.13Å; E320-R323 PolarHBondContact O-N 2.89Å; E320-G324 PolarHBondContact O-N 3.35Å
321A87.8Confident89.6Confident65 Ų6595.9 Ų95.954%0.53750%0.503SS..Hα-helixtrans-66.2-44.7175.400000112.3L317 E318 G324 M325L317-A321 WeakPolarHBondContact O-CB 3.07Å; L317-A321 PolarHBondContact O-N 3.26Å; E318-A321 PolarHBondContact O-N 3.16Å; A321-G324 PolarHBondContact O-N 2.9Å; A321-M325 WeakPolarHBondContact O-CB 3.16Å; A321-M325 PolarHBondContact O-N 3.4Å
322C83.1Confident89.5Confident72 Ų7296 Ų9649%0.48650%0.5SS..Hα-helixtrans-63.2-41.5175.3-70.40000112E318 I319 M325 N326E318-C322 WeakPolarHBondContact O-CB 3.37Å; E318-C322 PolarHBondContact O-N 2.87Å; E318-C322 PolarHBondContact O-SG 3.44Å; E318-C322 VanDerWaalsContact O-SG 3.36Å; I319-C322 PolarHBondContact O-N 3.46Å; C322-M325 PolarHBondContact O-N 2.82Å; C322-N326 PolarHBondContact O-N 3.44Å
323R90.8Very high89.3Confident161 Ų16195.5 Ų95.561%0.60850%0.498SS*.Hα-helixtrans-60.1-47.6172.9-76.7173.1178.3161.30.4111.9I319 E320 M325 N326 E327I319-R323 WeakPolarHBondContact O-CB 3.48Å; I319-R323 VanDerWaalsContact O-CG 3.29Å; I319-R323 WeakPolarHBondContact O-CG 3.43Å; I319-R323 PolarHBondContact O-N 3.07Å; E320-R323 PolarHBondContact O-N 2.89Å; R323-M325 PolarHBondContact O-N 3.17Å; R323-N326 PolarHBondContact O-N 2.94Å; R323-E327 PolarHBondContact O-N 3.16Å
324G89.4Confident89.4Confident39 Ų3994.2 Ų94.240%0.40249%0.493SS..Hα-helixtrans-62.2-30.8176.700000113.6E320 A321 A328E320-G324 PolarHBondContact O-N 3.35Å; A321-G324 PolarHBondContact O-N 2.9Å; G324-A328 WeakPolarHBondContact O-CB 3.38Å; G324-A328 PolarHBondContact O-N 3.44Å
325M87.9Confident89.7Confident127 Ų12796.8 Ų96.863%0.62650%0.496SS*.Hα-helixtrans-74.8-41.3173.9-175.6148.415000112.3A321 C322 R323 A328 L329A321-M325 WeakPolarHBondContact O-CB 3.16Å; A321-M325 PolarHBondContact O-N 3.4Å; C322-M325 PolarHBondContact O-N 2.82Å; R323-M325 PolarHBondContact O-N 3.17Å; M325-A328 PolarHBondContact O-N 2.92Å; M325-L329 HydrophobicContact CG-CD1 4.37Å; M325-L329 WeakPolarHBondContact O-CG 3.29Å; M325-L329 PolarHBondContact O-N 3.46Å
326N81.3Confident89.9Confident94 Ų9496 Ų9650%0.50350%0.497SS..Hα-helixtrans-60.6-49.5172.4-75.63.7000111.1C322 R323 A328 L329 E330C322-N326 PolarHBondContact O-N 3.44Å; R323-N326 PolarHBondContact O-N 2.94Å; N326-A328 PolarHBondContact O-N 3.36Å; N326-A328 VanDerWaalsContact O-N 3.16Å; N326-L329 PolarHBondContact O-N 3.02Å; N326-E330 WeakPolarHBondContact O-CB 3.32Å; N326-E330 WeakPolarHBondContact O-CG 3.32Å; N326-E330 PolarHBondContact O-N 3.43Å
327E93.6Very high90Very high98 Ų9897 Ų9746%0.45850%0.498SS..Hα-helixtrans-56.6-32.7175.1-79.8-171.6-142.300113.1R323 K331R323-E327 PolarHBondContact O-N 3.16Å; E327-K331 WeakPolarHBondContact O-CB 3.33Å; E327-K331 WeakPolarHBondContact O-CD 3.3Å; E327-K331 WeakPolarHBondContact O-CG 3.42Å; E327-K331 PolarHBondContact O-N 3.32Å; E327-K331 VanDerWaalsContact O-N 3.16Å; E327-K331 IonicContact OE2-NZ 3.71Å; E327-K331 PolarHBondContact OE2-NZ 3.25Å
328A90Very high90.1Very high44 Ų4495.9 Ų95.936%0.36449%0.492SS..Hα-helixtrans-74.7-38.6177.200000111.9G324 M325 N326 Q332G324-A328 WeakPolarHBondContact O-CB 3.38Å; G324-A328 PolarHBondContact O-N 3.44Å; M325-A328 PolarHBondContact O-N 2.92Å; N326-A328 PolarHBondContact O-N 3.36Å; N326-A328 VanDerWaalsContact O-N 3.16Å; A328-Q332 WeakPolarHBondContact O-CG 3.34Å; A328-Q332 PolarHBondContact O-N 3.04Å
329L83.7Confident90.3Very high91 Ų9196.1 Ų96.148%0.47649%0.492SS..Hα-helixtrans-68.5-42.3174.8-70170.1000111.6M325 N326 K331 Q332 L333M325-L329 HydrophobicContact CG-CD1 4.37Å; M325-L329 WeakPolarHBondContact O-CG 3.29Å; M325-L329 PolarHBondContact O-N 3.46Å; N326-L329 PolarHBondContact O-N 3.02Å; L329-K331 PolarHBondContact O-N 3.06Å; L329-Q332 WeakPolarHBondContact O-CB 3.49Å; L329-Q332 PolarHBondContact O-N 3.41Å; L329-Q332 VanDerWaalsContact O-N 3.16Å; L329-L333 WeakPolarHBondContact O-CB 3.35Å; L329-L333 PolarHBondContact O-N 2.95Å
330E89.4Confident90.5Very high123 Ų12397.9 Ų97.958%0.57550%0.498SS*.Hα-helixtrans-59-44.7173.4-72.4167.2-17400111.4N326 Q332 L333 Q334N326-E330 WeakPolarHBondContact O-CB 3.32Å; N326-E330 WeakPolarHBondContact O-CG 3.32Å; N326-E330 PolarHBondContact O-N 3.43Å; E330-Q332 VanDerWaalsContact C-N 3.35Å; E330-Q332 PolarHBondContact O-N 3.45Å; E330-L333 PolarHBondContact O-N 3.35Å; E330-Q334 PolarHBondContact O-N 3.01Å
331K93.7Very high90.6Very high119 Ų11997.4 Ų97.452%0.51750%0.5SS..Hα-helixtrans-63-39.5174.1-73.6162.4-165.3145.70112.1E327 L329 E335E327-K331 WeakPolarHBondContact O-CB 3.33Å; E327-K331 WeakPolarHBondContact O-CD 3.3Å; E327-K331 WeakPolarHBondContact O-CG 3.42Å; E327-K331 PolarHBondContact O-N 3.32Å; E327-K331 VanDerWaalsContact O-N 3.16Å; E327-K331 IonicContact OE2-NZ 3.71Å; E327-K331 PolarHBondContact OE2-NZ 3.25Å; L329-K331 PolarHBondContact O-N 3.06Å; K331-E335 VanDerWaalsContact O-CB 3.22Å; K331-E335 WeakPolarHBondContact O-CB 3.08Å; K331-E335 WeakPolarHBondContact O-CG 3.09Å; K331-E335 PolarHBondContact O-N 3.5Å
332Q92.3Very high90.9Very high116 Ų11697.1 Ų97.154%0.54250%0.497SS..Hα-helixtrans-66.7-37.3175.3-77.2179.1-7.300112.7A328 L329 E330 E335 L336A328-Q332 WeakPolarHBondContact O-CG 3.34Å; A328-Q332 PolarHBondContact O-N 3.04Å; L329-Q332 WeakPolarHBondContact O-CB 3.49Å; L329-Q332 PolarHBondContact O-N 3.41Å; L329-Q332 VanDerWaalsContact O-N 3.16Å; E330-Q332 VanDerWaalsContact C-N 3.35Å; E330-Q332 PolarHBondContact O-N 3.45Å; Q332-E335 PolarHBondContact O-N 3.39Å; Q332-L336 VanDerWaalsContact O-CG 3.29Å; Q332-L336 WeakPolarHBondContact O-CG 3.47Å; Q332-L336 PolarHBondContact O-N 3.03Å
333L86.8Confident91.4Very high103 Ų10398.8 Ų98.854%0.53950%0.501SS..Hα-helixtrans-63.9-53.4175-171.4112.7000110.5L329 E330 E335 L336 E337L329-L333 WeakPolarHBondContact O-CB 3.35Å; L329-L333 PolarHBondContact O-N 2.95Å; E330-L333 PolarHBondContact O-N 3.35Å; L333-E335 VanDerWaalsContact C-N 3.28Å; L333-E335 PolarHBondContact O-N 3.44Å; L333-L336 WeakPolarHBondContact O-CA 3.49Å; L333-L336 WeakPolarHBondContact O-CB 3.43Å; L333-L336 PolarHBondContact O-N 2.95Å; L333-E337 WeakPolarHBondContact CD2-OE1 3.34Å; L333-E337 WeakPolarHBondContact O-CG 3.47Å; L333-E337 PolarHBondContact O-N 3.16Å
334Q95.3Very high91.7Very high99 Ų9994.8 Ų94.846%0.46349%0.491SS..Hα-helixtrans-56.1-43.7175.4-173.867.863.800111.6E330 L336 E337 D338E330-Q334 PolarHBondContact O-N 3.01Å; Q334-L336 PolarHBondContact O-N 3.47Å; Q334-E337 PolarHBondContact O-N 2.83Å; Q334-D338 PolarHBondContact NE2-OD1 3.32Å; Q334-D338 WeakPolarHBondContact O-CB 3.47Å; Q334-D338 PolarHBondContact O-N 2.91Å
335E94.8Very high92Very high107 Ų10796 Ų9650%0.549%0.494SS..Hα-helixtrans-62.9-26.5175.6-95.8-162.5-135.900114.1K331 Q332 L333 K339K331-E335 VanDerWaalsContact O-CB 3.22Å; K331-E335 WeakPolarHBondContact O-CB 3.08Å; K331-E335 WeakPolarHBondContact O-CG 3.09Å; K331-E335 PolarHBondContact O-N 3.5Å; Q332-E335 PolarHBondContact O-N 3.39Å; L333-E335 VanDerWaalsContact C-N 3.28Å; L333-E335 PolarHBondContact O-N 3.44Å; E335-K339 WeakPolarHBondContact O-CD 3.28Å; E335-K339 WeakPolarHBondContact O-CE 3.23Å; E335-K339 WeakPolarHBondContact O-CG 3.24Å; E335-K339 PolarHBondContact O-NZ 3.45Å; E335-K339 IonicContact OE2-NZ 3.68Å; E335-K339 PolarHBondContact OE2-NZ 2.94Å
336L91.7Very high92.5Very high99 Ų9992.5 Ų92.552%0.51848%0.484SS..Hα-helixtrans-83.3-42.2175.6-75.7169.4000110.8Q332 L333 Q334 K339 Q340Q332-L336 VanDerWaalsContact O-CG 3.29Å; Q332-L336 WeakPolarHBondContact O-CG 3.47Å; Q332-L336 PolarHBondContact O-N 3.03Å; L333-L336 WeakPolarHBondContact O-CA 3.49Å; L333-L336 WeakPolarHBondContact O-CB 3.43Å; L333-L336 PolarHBondContact O-N 2.95Å; Q334-L336 PolarHBondContact O-N 3.47Å; L336-K339 PolarHBondContact O-N 3.05Å; L336-Q340 WeakPolarHBondContact O-CG 3.35Å; L336-Q340 PolarHBondContact O-N 3.36Å
337E91.2Very high93.1Very high80 Ų8093.2 Ų93.237%0.37449%0.486SS..Hα-helixtrans-58.9-46.3173.2-69.5177.1168.700111.1L333 Q334 K339 Q340 N341L333-E337 WeakPolarHBondContact CD2-OE1 3.34Å; L333-E337 WeakPolarHBondContact O-CG 3.47Å; L333-E337 PolarHBondContact O-N 3.16Å; Q334-E337 PolarHBondContact O-N 2.83Å; E337-K339 VanDerWaalsContact C-N 3.31Å; E337-K339 PolarHBondContact O-N 2.89Å; E337-Q340 PolarHBondContact O-N 3.41Å; E337-N341 VanDerWaalsContact O-CB 3.3Å; E337-N341 WeakPolarHBondContact O-CB 3.36Å; E337-N341 VanDerWaalsContact O-CG 3.23Å; E337-N341 PolarHBondContact O-N 3.14Å; E337-N341 PolarHBondContact O-ND2 3.19Å
338D94.9Very high93.3Very high88 Ų8893.9 Ų93.947%0.47149%0.489SS..Hα-helixtrans-60.3-39176.6-72.9-5.4000112.1Q334 A342Q334-D338 PolarHBondContact NE2-OD1 3.32Å; Q334-D338 WeakPolarHBondContact O-CB 3.47Å; Q334-D338 PolarHBondContact O-N 2.91Å; D338-A342 WeakPolarHBondContact O-CB 3.48Å; D338-A342 PolarHBondContact O-N 2.76Å
339K95.9Very high93.7Very high103 Ų10395.5 Ų95.545%0.44849%0.492SS..Hα-helixtrans-68.2-45.4175.7-72.3163.1-161.4136.60111.3E335 L336 E337 A342 D343E335-K339 WeakPolarHBondContact O-CD 3.28Å; E335-K339 WeakPolarHBondContact O-CE 3.23Å; E335-K339 WeakPolarHBondContact O-CG 3.24Å; E335-K339 PolarHBondContact O-NZ 3.45Å; E335-K339 IonicContact OE2-NZ 3.68Å; E335-K339 PolarHBondContact OE2-NZ 2.94Å; L336-K339 PolarHBondContact O-N 3.05Å; E337-K339 VanDerWaalsContact C-N 3.31Å; E337-K339 PolarHBondContact O-N 2.89Å; K339-A342 WeakPolarHBondContact O-CB 3.41Å; K339-A342 PolarHBondContact O-N 3.31Å; K339-D343 PolarHBondContact O-N 3.36Å
340Q93.6Very high94.3Very high120 Ų12094.7 Ų94.756%0.56149%0.491SS*.Hα-helixtrans-62.8-42.7176.5-73.2176.8-6.300111.6L336 E337 A342 D343 I344L336-Q340 WeakPolarHBondContact O-CG 3.35Å; L336-Q340 PolarHBondContact O-N 3.36Å; E337-Q340 PolarHBondContact O-N 3.41Å; Q340-A342 VanDerWaalsContact C-N 3.32Å; Q340-A342 PolarHBondContact O-N 2.7Å; Q340-D343 PolarHBondContact O-N 2.88Å; Q340-I344 WeakPolarHBondContact O-CB 3.4Å; Q340-I344 VanDerWaalsContact O-CG1 3.23Å; Q340-I344 WeakPolarHBondContact O-CG1 3.42Å; Q340-I344 PolarHBondContact O-N 3.48Å
341N95.3Very high94.7Very high98 Ų9893.1 Ų93.152%0.52449%0.485SS..Hα-helixtrans-61.6-39.4174.5-75.3-38.3000111.9E337 S345E337-N341 VanDerWaalsContact O-CB 3.3Å; E337-N341 WeakPolarHBondContact O-CB 3.36Å; E337-N341 VanDerWaalsContact O-CG 3.23Å; E337-N341 PolarHBondContact O-N 3.14Å; E337-N341 PolarHBondContact O-ND2 3.19Å; N341-S345 VanDerWaalsContact O-CB 3.25Å; N341-S345 WeakPolarHBondContact O-CB 3.4Å; N341-S345 PolarHBondContact O-N 3.05Å
342A95.1Very high94.9Very high59 Ų5991.2 Ų91.249%0.48848%0.481SS..Hα-helixtrans-65.7-41.9173.800000112.6D338 K339 Q340 S345 A346D338-A342 WeakPolarHBondContact O-CB 3.48Å; D338-A342 PolarHBondContact O-N 2.76Å; K339-A342 WeakPolarHBondContact O-CB 3.41Å; K339-A342 PolarHBondContact O-N 3.31Å; Q340-A342 VanDerWaalsContact C-N 3.32Å; Q340-A342 PolarHBondContact O-N 2.7Å; A342-S345 PolarHBondContact O-N 3.17Å; A342-A346 WeakPolarHBondContact O-CB 3.5Å; A342-A346 PolarHBondContact O-N 2.94Å
343D93.8Very high95.2Very high106 Ų10690.8 Ų90.857%0.56748%0.477SS*.Hα-helixtrans-67.9-40.9176.9-75.4-21.5000112K339 Q340 A346 M347K339-D343 PolarHBondContact O-N 3.36Å; Q340-D343 PolarHBondContact O-N 2.88Å; D343-A346 PolarHBondContact O-N 3.18Å; D343-M347 WeakPolarHBondContact O-CG 3.28Å; D343-M347 PolarHBondContact O-N 2.95Å
344I95.4Very high95.7Very high78 Ų7891.2 Ų91.240%0.448%0.479SS..Hα-helixtrans-60.4-47.5172.8-70.6164.4000110.1Q340 A346 M347 Q348Q340-I344 WeakPolarHBondContact O-CB 3.4Å; Q340-I344 VanDerWaalsContact O-CG1 3.23Å; Q340-I344 WeakPolarHBondContact O-CG1 3.42Å; Q340-I344 PolarHBondContact O-N 3.48Å; I344-A346 PolarHBondContact O-N 3.14Å; I344-M347 HydrophobicContact CG1-CE 4.37Å; I344-M347 PolarHBondContact O-N 2.99Å; I344-Q348 HydrophobicContact CG2-CG 4.48Å; I344-Q348 WeakPolarHBondContact O-CG 3.04Å; I344-Q348 PolarHBondContact O-N 3.33Å
345S97.4Very high95.8Very high65 Ų6590.2 Ų90.246%0.45547%0.474SS..Hα-helixtrans-58.6-46.2175.8-176.90000111.2N341 A342 M347 Q348 D349N341-S345 VanDerWaalsContact O-CB 3.25Å; N341-S345 WeakPolarHBondContact O-CB 3.4Å; N341-S345 PolarHBondContact O-N 3.05Å; A342-S345 PolarHBondContact O-N 3.17Å; S345-M347 VanDerWaalsContact C-N 3.34Å; S345-M347 PolarHBondContact O-N 2.7Å; S345-Q348 PolarHBondContact O-N 3.08Å; S345-D349 WeakPolarHBondContact O-CB 3.38Å; S345-D349 PolarHBondContact O-N 3.13Å
346A97.3Very high96Very high52 Ų5289 Ų8943%0.4347%0.472SS..Hα-helixtrans-62-37.517600000113A342 D343 I344 D349 T350A342-A346 WeakPolarHBondContact O-CB 3.5Å; A342-A346 PolarHBondContact O-N 2.94Å; D343-A346 PolarHBondContact O-N 3.18Å; I344-A346 PolarHBondContact O-N 3.14Å; A346-D349 WeakPolarHBondContact O-CB 3.33Å; A346-D349 PolarHBondContact O-N 2.95Å; A346-T350 WeakPolarHBondContact O-CG2 3.42Å; A346-T350 PolarHBondContact O-N 2.91Å
347M94.1Very high96.3Very high110 Ų11090 Ų9054%0.54247%0.474SS..Hα-helixtrans-67.6-45.4173.9-74-172.1-70.700111.9D343 I344 S345 D349 T350 I351D343-M347 WeakPolarHBondContact O-CG 3.28Å; D343-M347 PolarHBondContact O-N 2.95Å; I344-M347 HydrophobicContact CG1-CE 4.37Å; I344-M347 PolarHBondContact O-N 2.99Å; S345-M347 VanDerWaalsContact C-N 3.34Å; S345-M347 PolarHBondContact O-N 2.7Å; M347-D349 PolarHBondContact O-N 3.05Å; M347-T350 PolarHBondContact O-N 2.79Å; M347-T350 PolarHBondContact O-OG1 2.94Å; M347-I351 WeakPolarHBondContact O-CG1 3.22Å; M347-I351 PolarHBondContact O-N 3.45Å
348Q97.6Very high96.6Very high111 Ų11190.6 Ų90.652%0.51948%0.479SS..Hα-helixtrans-56.8-40.5172.5-70.8173.3-3.600111.3I344 S345 T350 I351 N352I344-Q348 HydrophobicContact CG2-CG 4.48Å; I344-Q348 WeakPolarHBondContact O-CG 3.04Å; I344-Q348 PolarHBondContact O-N 3.33Å; S345-Q348 PolarHBondContact O-N 3.08Å; Q348-T350 VanDerWaalsContact C-N 3.34Å; Q348-T350 PolarHBondContact O-N 3.38Å; Q348-I351 PolarHBondContact O-N 3.21Å; Q348-N352 WeakPolarHBondContact O-CB 3.41Å; Q348-N352 VanDerWaalsContact O-CG 3.23Å; Q348-N352 PolarHBondContact O-N 3.18Å; Q348-N352 PolarHBondContact O-ND2 3.01Å; Q348-N352 VanDerWaalsContact O-ND2 3.16Å
349D98.1Very high96.7Very high79 Ų7993 Ų9342%0.42248%0.481SS..Hα-helixtrans-63-36.2175.8-128.338.2000113.1S345 A346 M347 K353S345-D349 WeakPolarHBondContact O-CB 3.38Å; S345-D349 PolarHBondContact O-N 3.13Å; A346-D349 WeakPolarHBondContact O-CB 3.33Å; A346-D349 PolarHBondContact O-N 2.95Å; M347-D349 PolarHBondContact O-N 3.05Å; D349-K353 WeakPolarHBondContact O-CD 3.49Å; D349-K353 WeakPolarHBondContact O-CE 3.37Å; D349-K353 WeakPolarHBondContact O-CG 3.21Å; D349-K353 PolarHBondContact O-N 3.25Å; D349-K353 IonicContact OD2-NZ 2.71Å; D349-K353 PolarHBondContact OD2-NZ 3.14Å
350T97.8Very high96.9Very high73 Ų7391.4 Ų91.445%0.44848%0.48SS..Hα-helixtrans-75-37.3174.358.60000112.3A346 M347 Q348 K353 L354A346-T350 WeakPolarHBondContact O-CG2 3.42Å; A346-T350 PolarHBondContact O-N 2.91Å; M347-T350 PolarHBondContact O-N 2.79Å; M347-T350 PolarHBondContact O-OG1 2.94Å; Q348-T350 VanDerWaalsContact C-N 3.34Å; Q348-T350 PolarHBondContact O-N 3.38Å; T350-K353 PolarHBondContact O-N 3.33Å; T350-L354 WeakPolarHBondContact O-CG 3.49Å; T350-L354 PolarHBondContact O-N 3.46Å
351I96.9Very high97Very high91 Ų9189 Ų8947%0.46747%0.474SS..Hα-helixtrans-58.6-51.7171.4-67.5164.7000109.8M347 Q348 K353 L354 E355M347-I351 WeakPolarHBondContact O-CG1 3.22Å; M347-I351 PolarHBondContact O-N 3.45Å; Q348-I351 PolarHBondContact O-N 3.21Å; I351-K353 VanDerWaalsContact C-N 3.29Å; I351-K353 PolarHBondContact O-N 2.82Å; I351-L354 PolarHBondContact O-N 2.91Å; I351-L354 VanDerWaalsContact O-N 3.13Å; I351-E355 HydrophobicContact CG2-CG 4.28Å; I351-E355 WeakPolarHBondContact O-CG 3.35Å; I351-E355 PolarHBondContact O-N 2.84Å
352N98.1Very high97.2Very high78 Ų7890.5 Ų90.542%0.41748%0.476SS..Hα-helixtrans-56-40.2177.9-74.6-33.1000112.7Q348 N356Q348-N352 WeakPolarHBondContact O-CB 3.41Å; Q348-N352 VanDerWaalsContact O-CG 3.23Å; Q348-N352 PolarHBondContact O-N 3.18Å; Q348-N352 PolarHBondContact O-ND2 3.01Å; Q348-N352 VanDerWaalsContact O-ND2 3.16Å; N352-N356 WeakPolarHBondContact O-CB 3.47Å; N352-N356 PolarHBondContact O-N 3.32Å; N352-N356 VanDerWaalsContact O-N 3.08Å; N352-N356 PolarHBondContact O-ND2 3.39Å
353K98.2Very high97.3Very high108 Ų10891 Ų9147%0.4748%0.476SS..Hα-helixtrans-63.9-50.1175.4-72.4158-163.31500111.3D349 T350 I351 E355 N356 E357D349-K353 WeakPolarHBondContact O-CD 3.49Å; D349-K353 WeakPolarHBondContact O-CE 3.37Å; D349-K353 WeakPolarHBondContact O-CG 3.21Å; D349-K353 PolarHBondContact O-N 3.25Å; D349-K353 IonicContact OD2-NZ 2.71Å; D349-K353 PolarHBondContact OD2-NZ 3.14Å; T350-K353 PolarHBondContact O-N 3.33Å; I351-K353 VanDerWaalsContact C-N 3.29Å; I351-K353 PolarHBondContact O-N 2.82Å; K353-E355 PolarHBondContact O-N 3.11Å; K353-N356 PolarHBondContact O-N 3.11Å; K353-N356 VanDerWaalsContact O-N 3.14Å; K353-E357 WeakPolarHBondContact O-CG 3.45Å; K353-E357 PolarHBondContact O-N 3.33Å
354L97.6Very high97.5Very high111 Ų11190 Ų9058%0.58147%0.468SS*.Hα-helixtrans-63.5-39.3179.2-69.5172.1000112.7T350 I351 N356 E357 L358T350-L354 WeakPolarHBondContact O-CG 3.49Å; T350-L354 PolarHBondContact O-N 3.46Å; I351-L354 PolarHBondContact O-N 2.91Å; I351-L354 VanDerWaalsContact O-N 3.13Å; L354-N356 VanDerWaalsContact C-N 3.32Å; L354-N356 PolarHBondContact O-N 2.9Å; L354-E357 PolarHBondContact O-N 2.91Å; L354-L358 WeakPolarHBondContact O-CB 3.48Å; L354-L358 PolarHBondContact O-N 3.49Å
355E97.8Very high97.6Very high78 Ų7892.2 Ų92.236%0.36448%0.478SS..Hα-helixtrans-63.3-38.7173.4-69.7-165.8164.100112.2I351 K353 L358 R359I351-E355 HydrophobicContact CG2-CG 4.28Å; I351-E355 WeakPolarHBondContact O-CG 3.35Å; I351-E355 PolarHBondContact O-N 2.84Å; K353-E355 PolarHBondContact O-N 3.11Å; E355-L358 WeakPolarHBondContact O-CB 3.41Å; E355-L358 PolarHBondContact O-N 3.32Å; E355-R359 VanDerWaalsContact CB-NH1 3.29Å; E355-R359 WeakPolarHBondContact O-CB 3.47Å; E355-R359 VanDerWaalsContact O-CG 3.31Å; E355-R359 WeakPolarHBondContact O-CG 3.4Å; E355-R359 PolarHBondContact O-N 3.36Å; E355-R359 IonicContact OE2-CZ 2.73Å; E355-R359 VanDerWaalsContact OE2-CZ 3.24Å; E355-R359 IonicContact OE2-NH1 3.64Å; E355-R359 PolarHBondContact OE2-NH1 2.91Å; E355-R359 IonicContact OE2-NH2 2.67Å; E355-R359 PolarHBondContact OE2-NH2 2.96Å
356N97.9Very high97.6Very high83 Ų8392 Ų9244%0.44448%0.48SS..Hα-helixtrans-71.6-36.6179.1-72.4-24.3000112.1N352 K353 L354 L358 R359 T360N352-N356 WeakPolarHBondContact O-CB 3.47Å; N352-N356 PolarHBondContact O-N 3.32Å; N352-N356 VanDerWaalsContact O-N 3.08Å; N352-N356 PolarHBondContact O-ND2 3.39Å; K353-N356 PolarHBondContact O-N 3.11Å; K353-N356 VanDerWaalsContact O-N 3.14Å; L354-N356 VanDerWaalsContact C-N 3.32Å; L354-N356 PolarHBondContact O-N 2.9Å; N356-L358 VanDerWaalsContact C-N 3.35Å; N356-R359 PolarHBondContact O-N 3.27Å; N356-R359 PolarHBondContact OD1-NH1 3.49Å; N356-T360 WeakPolarHBondContact O-CB 3.17Å; N356-T360 PolarHBondContact O-N 3.43Å; N356-T360 PolarHBondContact O-OG1 3.33Å
357E98.1Very high97.6Very high120 Ų12094.9 Ų94.956%0.56148%0.48SS*.Hα-helixtrans-61.4-42.3167.7-71.1175.1-169.600111.3K353 L354 T360 T361K353-E357 WeakPolarHBondContact O-CG 3.45Å; K353-E357 PolarHBondContact O-N 3.33Å; L354-E357 PolarHBondContact O-N 2.91Å; E357-T360 PolarHBondContact O-N 3.22Å; E357-T361 WeakPolarHBondContact O-CB 3.48Å; E357-T361 WeakPolarHBondContact O-CG2 3.35Å; E357-T361 PolarHBondContact O-N 2.86Å; E357-T361 PolarHBondContact O-OG1 3.39Å
358L97.5Very high97.8Very high91 Ų9195.1 Ų95.148%0.47648%0.475SS..Hα-helixtrans-65-41.1175.6-175.965.7000112.5L354 E355 N356 T361 K362L354-L358 WeakPolarHBondContact O-CB 3.48Å; L354-L358 PolarHBondContact O-N 3.49Å; E355-L358 WeakPolarHBondContact O-CB 3.41Å; E355-L358 PolarHBondContact O-N 3.32Å; N356-L358 VanDerWaalsContact C-N 3.35Å; L358-T361 WeakPolarHBondContact CA-OG1 3.5Å; L358-T361 PolarHBondContact O-OG1 2.87Å; L358-K362 HydrophobicContact CG-CD 4.28Å; L358-K362 VanDerWaalsContact O-CB 3.31Å; L358-K362 WeakPolarHBondContact O-CB 3.46Å; L358-K362 WeakPolarHBondContact O-CD 3.4Å; L358-K362 WeakPolarHBondContact O-CG 3.44Å; L358-K362 PolarHBondContact O-N 3.18Å
359R98.1Very high97.8Very high138 Ų13895.4 Ų95.452%0.52148%0.48SS..Hα-helixtrans-63.9-42.5173.5-73.5173.6-173.3107.512111E355 N356 S363E355-R359 VanDerWaalsContact CB-NH1 3.29Å; E355-R359 WeakPolarHBondContact O-CB 3.47Å; E355-R359 VanDerWaalsContact O-CG 3.31Å; E355-R359 WeakPolarHBondContact O-CG 3.4Å; E355-R359 PolarHBondContact O-N 3.36Å; E355-R359 IonicContact OE2-CZ 2.73Å; E355-R359 VanDerWaalsContact OE2-CZ 3.24Å; E355-R359 IonicContact OE2-NH1 3.64Å; E355-R359 PolarHBondContact OE2-NH1 2.91Å; E355-R359 IonicContact OE2-NH2 2.67Å; E355-R359 PolarHBondContact OE2-NH2 2.96Å; N356-R359 PolarHBondContact O-N 3.27Å; N356-R359 PolarHBondContact OD1-NH1 3.49Å; R359-S363 PolarHBondContact O-N 2.86Å
360T98.3Very high97.8Very high70 Ų7098.2 Ų98.243%0.42949%0.488SS..Hα-helixtrans-63.5-54.3179.8-57.30000110.8N356 E357 K362 S363 E364N356-T360 WeakPolarHBondContact O-CB 3.17Å; N356-T360 PolarHBondContact O-N 3.43Å; N356-T360 PolarHBondContact O-OG1 3.33Å; E357-T360 PolarHBondContact O-N 3.22Å; T360-K362 VanDerWaalsContact C-N 3.34Å; T360-K362 PolarHBondContact O-N 2.94Å; T360-S363 WeakPolarHBondContact O-CA 3.47Å; T360-S363 WeakPolarHBondContact O-CB 3.36Å; T360-S363 PolarHBondContact O-N 3.23Å; T360-S363 PolarHBondContact O-OG 3Å; T360-E364 WeakPolarHBondContact O-CG 3.47Å; T360-E364 PolarHBondContact O-N 3.07Å
361T97.3Very high97.7Very high71 Ų7199 Ų9944%0.43649%0.487SS..Hα-helixtrans-61.9-35.917950.80000113.1E357 L358 E364 M365E357-T361 WeakPolarHBondContact O-CB 3.48Å; E357-T361 WeakPolarHBondContact O-CG2 3.35Å; E357-T361 PolarHBondContact O-N 2.86Å; E357-T361 PolarHBondContact O-OG1 3.39Å; L358-T361 WeakPolarHBondContact CA-OG1 3.5Å; L358-T361 PolarHBondContact O-OG1 2.87Å; T361-E364 PolarHBondContact O-N 3.23Å; T361-M365 WeakPolarHBondContact O-CB 3.38Å; T361-M365 PolarHBondContact O-N 3.1Å
362K98.2Very high97.8Very high128 Ų128102.3 Ų102.356%0.55750%0.495SS*.Hα-helixtrans-61.4-42.4168.3-76.9172.7178.71780112.2L358 T360 M365 A366L358-K362 HydrophobicContact CG-CD 4.28Å; L358-K362 VanDerWaalsContact O-CB 3.31Å; L358-K362 WeakPolarHBondContact O-CB 3.46Å; L358-K362 WeakPolarHBondContact O-CD 3.4Å; L358-K362 WeakPolarHBondContact O-CG 3.44Å; L358-K362 PolarHBondContact O-N 3.18Å; T360-K362 VanDerWaalsContact C-N 3.34Å; T360-K362 PolarHBondContact O-N 2.94Å; K362-M365 PolarHBondContact O-N 3.45Å; K362-A366 PolarHBondContact O-N 3.15Å
363S97.9Very high97.8Very high71 Ų71103.1 Ų103.150%0.49750%0.496SS..Hα-helixtrans-67.8-37.4178.181.10000112.4R359 T360 A366 R367R359-S363 PolarHBondContact O-N 2.86Å; T360-S363 WeakPolarHBondContact O-CA 3.47Å; T360-S363 WeakPolarHBondContact O-CB 3.36Å; T360-S363 PolarHBondContact O-N 3.23Å; T360-S363 PolarHBondContact O-OG 3Å; S363-A366 PolarHBondContact O-N 2.64Å; S363-R367 PolarHBondContact O-N 2.9Å
364E98Very high97.7Very high85 Ų85101.8 Ų101.840%0.39749%0.494SS..Hα-helixtrans-65.4-43.7174-68.4175.9158.500111.7T360 T361 A366 R367 Y368T360-E364 WeakPolarHBondContact O-CG 3.47Å; T360-E364 PolarHBondContact O-N 3.07Å; T361-E364 PolarHBondContact O-N 3.23Å; E364-A366 VanDerWaalsContact C-N 3.34Å; E364-A366 PolarHBondContact O-N 3.21Å; E364-R367 WeakPolarHBondContact O-CB 3.18Å; E364-R367 PolarHBondContact O-N 3.38Å; E364-R367 VanDerWaalsContact O-N 3.17Å; E364-Y368 HydrophobicContact CB-CE2 4.29Å; E364-Y368 WeakPolarHBondContact O-CD2 3.28Å; E364-Y368 PolarHBondContact O-N 3.46Å
365M97.5Very high97.7Very high124 Ų124101.9 Ų101.961%0.61149%0.494SS*.Hα-helixtrans-59.7-43.1174.3-172.1-179.2-62.700111.8T361 K362 R367 Y368 L369T361-M365 WeakPolarHBondContact O-CB 3.38Å; T361-M365 PolarHBondContact O-N 3.1Å; K362-M365 PolarHBondContact O-N 3.45Å; M365-R367 VanDerWaalsContact C-N 3.35Å; M365-R367 PolarHBondContact O-N 3.11Å; M365-Y368 PolarHBondContact O-N 2.73Å; M365-L369 WeakPolarHBondContact O-CG 3.43Å; M365-L369 PolarHBondContact O-N 2.87Å
366A97.4Very high97.7Very high59 Ų59102.1 Ų102.149%0.48850%0.498SS..Hα-helixtrans-63.5-38.8174.800000112.3K362 S363 E364 K370K362-A366 PolarHBondContact O-N 3.15Å; S363-A366 PolarHBondContact O-N 2.64Å; E364-A366 VanDerWaalsContact C-N 3.34Å; E364-A366 PolarHBondContact O-N 3.21Å; A366-K370 PolarHBondContact O-N 3.36Å; A366-K370 VanDerWaalsContact O-N 3.14Å
367R97.9Very high97.6Very high113 Ų113101.8 Ų101.843%0.42650%0.496SS..Hα-helixtrans-62.5-48.2173-176-176.665.8844.7111.5S363 E364 M365 L369 K370 E371S363-R367 PolarHBondContact O-N 2.9Å; E364-R367 WeakPolarHBondContact O-CB 3.18Å; E364-R367 PolarHBondContact O-N 3.38Å; E364-R367 VanDerWaalsContact O-N 3.17Å; M365-R367 VanDerWaalsContact C-N 3.35Å; M365-R367 PolarHBondContact O-N 3.11Å; R367-L369 PolarHBondContact O-N 2.94Å; R367-K370 WeakPolarHBondContact O-CB 3.33Å; R367-K370 PolarHBondContact O-N 2.92Å; R367-E371 WeakPolarHBondContact CG-OE1 3.41Å; R367-E371 IonicContact CZ-OE1 3.46Å; R367-E371 IonicContact CZ-OE2 3.24Å; R367-E371 IonicContact NE-OE1 2.67Å; R367-E371 IonicContact NH1-OE1 3.77Å; R367-E371 PolarHBondContact NH1-OE1 3.32Å; R367-E371 IonicContact NH1-OE2 3.85Å; R367-E371 PolarHBondContact NH1-OE2 3.14Å; R367-E371 WeakPolarHBondContact O-CG 3.36Å; R367-E371 PolarHBondContact O-N 2.85Å
368Y97.6Very high97.6Very high116 Ų116100 Ų10046%0.45549%0.493SS..Hα-helixtrans-60.3-43.7177.8-71.5-54.8000112E364 M365 K370 E371 Y372E364-Y368 HydrophobicContact CB-CE2 4.29Å; E364-Y368 WeakPolarHBondContact O-CD2 3.28Å; E364-Y368 PolarHBondContact O-N 3.46Å; M365-Y368 PolarHBondContact O-N 2.73Å; Y368-K370 VanDerWaalsContact C-N 3.29Å; Y368-K370 PolarHBondContact O-N 3.36Å; Y368-E371 PolarHBondContact O-N 2.65Å; Y368-Y372 WeakPolarHBondContact O-CD2 3.31Å; Y368-Y372 PolarHBondContact O-N 3.39Å
369L97.6Very high97.5Very high116 Ų116100.9 Ų100.961%0.60749%0.493SS*.Hα-helixtrans-57.8-41.2175.6-75.3169.7000112.1M365 R367 Q373M365-L369 WeakPolarHBondContact O-CG 3.43Å; M365-L369 PolarHBondContact O-N 2.87Å; R367-L369 PolarHBondContact O-N 2.94Å; L369-Q373 PolarHBondContact O-N 3.48Å
370K97.5Very high97.5Very high138 Ų13899.1 Ų99.160%0.649%0.492SS*.Hα-helixtrans-65-46.4174.4-173.3179.8176.9-177.20112A366 R367 Y368 Y372 Q373 D374A366-K370 PolarHBondContact O-N 3.36Å; A366-K370 VanDerWaalsContact O-N 3.14Å; R367-K370 WeakPolarHBondContact O-CB 3.33Å; R367-K370 PolarHBondContact O-N 2.92Å; Y368-K370 VanDerWaalsContact C-N 3.29Å; Y368-K370 PolarHBondContact O-N 3.36Å; K370-Y372 VanDerWaalsContact C-N 3.31Å; K370-Y372 PolarHBondContact O-N 2.99Å; K370-Q373 PolarHBondContact O-N 3.14Å; K370-Q373 VanDerWaalsContact O-N 3.1Å; K370-D374 PolarHBondContact O-N 3.02Å
371E97.4Very high97.5Very high89 Ų8998 Ų9842%0.41649%0.49SS..Hα-helixtrans-62.1-36.8178.5-73.7169.9-173.100112.3R367 Y368 L375R367-E371 WeakPolarHBondContact CG-OE1 3.41Å; R367-E371 IonicContact CZ-OE1 3.46Å; R367-E371 IonicContact CZ-OE2 3.24Å; R367-E371 IonicContact NE-OE1 2.67Å; R367-E371 IonicContact NH1-OE1 3.77Å; R367-E371 PolarHBondContact NH1-OE1 3.32Å; R367-E371 IonicContact NH1-OE2 3.85Å; R367-E371 PolarHBondContact NH1-OE2 3.14Å; R367-E371 WeakPolarHBondContact O-CG 3.36Å; R367-E371 PolarHBondContact O-N 2.85Å; Y368-E371 PolarHBondContact O-N 2.65Å; E371-L375 WeakPolarHBondContact O-CB 3.45Å; E371-L375 PolarHBondContact O-N 2.86Å
372Y97.7Very high97.4Very high162 Ų16298.7 Ų98.764%0.63549%0.49SS*.Hα-helixtrans-65.7-40.6171.4-78-60.9000112.6Y368 K370 L375 L376Y368-Y372 WeakPolarHBondContact O-CD2 3.31Å; Y368-Y372 PolarHBondContact O-N 3.39Å; K370-Y372 VanDerWaalsContact C-N 3.31Å; K370-Y372 PolarHBondContact O-N 2.99Å; Y372-L375 PolarHBondContact O-N 2.81Å; Y372-L376 WeakPolarHBondContact O-CB 3.25Å; Y372-L376 PolarHBondContact O-N 2.92Å
373Q97.4Very high97.3Very high95 Ų9596 Ų9644%0.44448%0.482SS..Hα-helixtrans-66.2-42.2175.9-175.460.654.800111.7L369 K370 L376 N377L369-Q373 PolarHBondContact O-N 3.48Å; K370-Q373 PolarHBondContact O-N 3.14Å; K370-Q373 VanDerWaalsContact O-N 3.1Å; Q373-L376 WeakPolarHBondContact O-CB 3.18Å; Q373-L376 PolarHBondContact O-N 3.45Å; Q373-N377 PolarHBondContact NE2-OD1 2.87Å; Q373-N377 PolarHBondContact O-N 3.27Å; Q373-N377 PolarHBondContact O-ND2 2.87Å; Q373-N377 PolarHBondContact O-OD1 3.36Å
374D97.1Very high97.2Very high80 Ų8098.2 Ų98.243%0.42849%0.487SS..Hα-helixtrans-64.3-41.1177.2-71.6-25.6000111.1K370 N377 V378K370-D374 PolarHBondContact O-N 3.02Å; D374-N377 WeakPolarHBondContact O-CB 3.49Å; D374-N377 PolarHBondContact O-N 2.81Å; D374-V378 WeakPolarHBondContact O-CG2 3.4Å; D374-V378 PolarHBondContact O-N 3.33Å; D374-V378 VanDerWaalsContact O-N 3.07Å
375L97.4Very high97.1Very high113 Ų11398.7 Ų98.759%0.59249%0.489SS*.Hα-helixtrans-65.3-39173.4-177.661.7000112.6E371 Y372 N377 V378 K379E371-L375 WeakPolarHBondContact O-CB 3.45Å; E371-L375 PolarHBondContact O-N 2.86Å; Y372-L375 PolarHBondContact O-N 2.81Å; L375-N377 VanDerWaalsContact C-N 3.35Å; L375-V378 PolarHBondContact O-N 3.36Å; L375-K379 WeakPolarHBondContact O-CB 3.25Å; L375-K379 PolarHBondContact O-N 2.89Å
376L96.9Very high97Very high82 Ų8296.5 Ų96.543%0.42948%0.479SS..Hα-helixtrans-62.5-42.2174.1177.661.6000111.3Y372 Q373 V378 K379 M380Y372-L376 WeakPolarHBondContact O-CB 3.25Å; Y372-L376 PolarHBondContact O-N 2.92Å; Q373-L376 WeakPolarHBondContact O-CB 3.18Å; Q373-L376 PolarHBondContact O-N 3.45Å; L376-V378 PolarHBondContact O-N 3.18Å; L376-K379 PolarHBondContact O-N 2.98Å; L376-M380 HydrophobicContact CD1-CG 4.47Å; L376-M380 WeakPolarHBondContact O-CG 3.46Å; L376-M380 PolarHBondContact O-N 3.18Å
377N96.7Very high96.9Very high76 Ų7696.4 Ų96.441%0.40648%0.478SS..Hα-helixtrans-60.1-44.8175.9-64-23000111.2Q373 D374 L375 M380 A381Q373-N377 PolarHBondContact NE2-OD1 2.87Å; Q373-N377 PolarHBondContact O-N 3.27Å; Q373-N377 PolarHBondContact O-ND2 2.87Å; Q373-N377 PolarHBondContact O-OD1 3.36Å; D374-N377 WeakPolarHBondContact O-CB 3.49Å; D374-N377 PolarHBondContact O-N 2.81Å; L375-N377 VanDerWaalsContact C-N 3.35Å; N377-M380 PolarHBondContact O-N 2.72Å; N377-A381 PolarHBondContact O-N 3.14Å
378V97.4Very high96.6Very high83 Ų8393.9 Ų93.950%0.50348%0.482SS..Hα-helixtrans-62.2-43.4174.61730000111.3D374 L375 L376 M380 A381 L382D374-V378 WeakPolarHBondContact O-CG2 3.4Å; D374-V378 PolarHBondContact O-N 3.33Å; D374-V378 VanDerWaalsContact O-N 3.07Å; L375-V378 PolarHBondContact O-N 3.36Å; L376-V378 PolarHBondContact O-N 3.18Å; V378-M380 VanDerWaalsContact C-N 3.33Å; V378-M380 PolarHBondContact O-N 3.42Å; V378-A381 PolarHBondContact O-N 2.96Å; V378-L382 HydrophobicContact CG1-CD1 4.16Å; V378-L382 WeakPolarHBondContact O-CG 3.47Å; V378-L382 PolarHBondContact O-N 3.33Å
379K97.2Very high96.5Very high109 Ų10995 Ų9547%0.47449%0.486SS..Hα-helixtrans-60.7-42176.9-172.8-90.8173-175.10111.8L375 L376 L382 D383L375-K379 WeakPolarHBondContact O-CB 3.25Å; L375-K379 PolarHBondContact O-N 2.89Å; L376-K379 PolarHBondContact O-N 2.98Å; K379-L382 PolarHBondContact O-N 3.49Å; K379-D383 WeakPolarHBondContact CD-OD2 3.31Å; K379-D383 WeakPolarHBondContact CE-OD1 3.38Å; K379-D383 VanDerWaalsContact CE-OD2 3.23Å; K379-D383 WeakPolarHBondContact CE-OD2 3.46Å; K379-D383 VanDerWaalsContact NZ-CG 3.32Å; K379-D383 IonicContact NZ-OD1 3.06Å; K379-D383 PolarHBondContact NZ-OD1 3.45Å; K379-D383 IonicContact NZ-OD2 2.7Å; K379-D383 PolarHBondContact NZ-OD2 3.04Å; K379-D383 PolarHBondContact O-N 3.24Å
380M97.4Very high96.4Very high102 Ų10297.4 Ų97.450%0.50249%0.487SS..Hα-helixtrans-65.5-39.1176-73-177.964.300112.4L376 N377 V378 D383 I384L376-M380 HydrophobicContact CD1-CG 4.47Å; L376-M380 WeakPolarHBondContact O-CG 3.46Å; L376-M380 PolarHBondContact O-N 3.18Å; N377-M380 PolarHBondContact O-N 2.72Å; V378-M380 VanDerWaalsContact C-N 3.33Å; V378-M380 PolarHBondContact O-N 3.42Å; M380-D383 PolarHBondContact O-N 2.96Å; M380-I384 VanDerWaalsContact O-CG1 3.3Å; M380-I384 WeakPolarHBondContact O-CG1 3.43Å; M380-I384 PolarHBondContact O-N 3.34Å; M380-I384 VanDerWaalsContact O-N 3.11Å
381A96.9Very high96.1Very high47 Ų4798.3 Ų98.339%0.38849%0.491SS..Hα-helixtrans-61.3-45173.500000111.5N377 V378 D383 I384 E385N377-A381 PolarHBondContact O-N 3.14Å; V378-A381 PolarHBondContact O-N 2.96Å; A381-D383 PolarHBondContact O-N 2.83Å; A381-I384 WeakPolarHBondContact O-CB 3.5Å; A381-I384 PolarHBondContact O-N 2.88Å; A381-E385 PolarHBondContact O-N 3.11Å
382L96.8Very high95.8Very high85 Ų8599.8 Ų99.845%0.44550%0.501SS..Hα-helixtrans-63.8-37.9175.8-68.8172.1000112.9V378 K379 I384 E385 I386V378-L382 HydrophobicContact CG1-CD1 4.16Å; V378-L382 WeakPolarHBondContact O-CG 3.47Å; V378-L382 PolarHBondContact O-N 3.33Å; K379-L382 PolarHBondContact O-N 3.49Å; L382-I384 VanDerWaalsContact C-N 3.3Å; L382-I384 PolarHBondContact O-N 3.32Å; L382-E385 PolarHBondContact O-N 3.4Å; L382-I386 WeakPolarHBondContact O-CB 3.24Å; L382-I386 WeakPolarHBondContact O-CD1 3.16Å; L382-I386 WeakPolarHBondContact O-CG1 3.49Å; L382-I386 PolarHBondContact O-N 3.49Å
383D96.3Very high95.2Very high70 Ų7097.2 Ų97.237%0.37450%0.498SS..Hα-helixtrans-60.8-41.1173.1-69.5-35.3000111.5K379 M380 A381 I386 A387K379-D383 WeakPolarHBondContact CD-OD2 3.31Å; K379-D383 WeakPolarHBondContact CE-OD1 3.38Å; K379-D383 VanDerWaalsContact CE-OD2 3.23Å; K379-D383 WeakPolarHBondContact CE-OD2 3.46Å; K379-D383 VanDerWaalsContact NZ-CG 3.32Å; K379-D383 IonicContact NZ-OD1 3.06Å; K379-D383 PolarHBondContact NZ-OD1 3.45Å; K379-D383 IonicContact NZ-OD2 2.7Å; K379-D383 PolarHBondContact NZ-OD2 3.04Å; K379-D383 PolarHBondContact O-N 3.24Å; M380-D383 PolarHBondContact O-N 2.96Å; A381-D383 PolarHBondContact O-N 2.83Å; D383-I386 PolarHBondContact O-N 3.15Å; D383-A387 WeakPolarHBondContact O-CB 3.45Å; D383-A387 PolarHBondContact O-N 3.02Å
384I95.4Very high94.5Very high118 Ų11898 Ų9861%0.60550%0.501SS*.Hα-helixtrans-66.3-43.7177.7-67.2163.9000110.4M380 A381 L382 A387 A388M380-I384 VanDerWaalsContact O-CG1 3.3Å; M380-I384 WeakPolarHBondContact O-CG1 3.43Å; M380-I384 PolarHBondContact O-N 3.34Å; M380-I384 VanDerWaalsContact O-N 3.11Å; A381-I384 WeakPolarHBondContact O-CB 3.5Å; A381-I384 PolarHBondContact O-N 2.88Å; L382-I384 VanDerWaalsContact C-N 3.3Å; L382-I384 PolarHBondContact O-N 3.32Å; I384-A387 PolarHBondContact O-N 3.41Å; I384-A388 WeakPolarHBondContact O-CB 3.5Å; I384-A388 PolarHBondContact O-N 3.2Å
385E96.4Very high93.5Very high95 Ų9595.9 Ų95.944%0.44450%0.499SS..Hα-helixtrans-60.1-47.9173.7-73.6178.3-166.600111.5A381 L382 A387 A388 Y389A381-E385 PolarHBondContact O-N 3.11Å; L382-E385 PolarHBondContact O-N 3.4Å; E385-A387 VanDerWaalsContact C-N 3.31Å; E385-A387 PolarHBondContact O-N 2.88Å; E385-A388 WeakPolarHBondContact O-CB 3.47Å; E385-A388 PolarHBondContact O-N 3Å; E385-A388 VanDerWaalsContact O-N 3.14Å; E385-Y389 HydrophobicContact CB-CD2 4.33Å; E385-Y389 HydrophobicContact CB-CE2 4.06Å; E385-Y389 WeakPolarHBondContact O-CD2 3.31Å; E385-Y389 PolarHBondContact O-N 3.19Å
386I94.5Very high92.3Very high79 Ų7994.4 Ų94.441%0.40549%0.489SS..Hα-helixtrans-60-41.2176.8-70164.4000111.1L382 D383 Y389 R390L382-I386 WeakPolarHBondContact O-CB 3.24Å; L382-I386 WeakPolarHBondContact O-CD1 3.16Å; L382-I386 WeakPolarHBondContact O-CG1 3.49Å; L382-I386 PolarHBondContact O-N 3.49Å; D383-I386 PolarHBondContact O-N 3.15Å; I386-Y389 PolarHBondContact O-N 2.87Å; I386-R390 WeakPolarHBondContact O-CB 3.1Å; I386-R390 VanDerWaalsContact O-CG 3.28Å; I386-R390 WeakPolarHBondContact O-CG 3.5Å; I386-R390 PolarHBondContact O-N 3.48Å
387A94.6Very high90.9Very high56 Ų5696.3 Ų96.346%0.46350%0.495SS..Hα-helixtrans-65.6-39.3175.400000112.3D383 I384 E385 K391D383-A387 WeakPolarHBondContact O-CB 3.45Å; D383-A387 PolarHBondContact O-N 3.02Å; I384-A387 PolarHBondContact O-N 3.41Å; E385-A387 VanDerWaalsContact C-N 3.31Å; E385-A387 PolarHBondContact O-N 2.88Å; A387-K391 WeakPolarHBondContact O-CB 3.41Å; A387-K391 PolarHBondContact O-N 3.32Å
388A93.1Very high89.2Confident60 Ų6097.6 Ų97.650%0.49651%0.506SS..Hα-helixtrans-66.4-43.7175.200000111.9I384 E385 K391 L392I384-A388 WeakPolarHBondContact O-CB 3.5Å; I384-A388 PolarHBondContact O-N 3.2Å; E385-A388 WeakPolarHBondContact O-CB 3.47Å; E385-A388 PolarHBondContact O-N 3Å; E385-A388 VanDerWaalsContact O-N 3.14Å; A388-K391 PolarHBondContact O-N 3.32Å; A388-L392 PolarHBondContact O-N 3.46Å
389Y95.4Very high87.6Confident141 Ų141101.4 Ų101.455%0.55351%0.512SS*.Hα-helixtrans-62-47174.2-70.7-54.6000111.4E385 I386 K391 L392 L393E385-Y389 HydrophobicContact CB-CD2 4.33Å; E385-Y389 HydrophobicContact CB-CE2 4.06Å; E385-Y389 WeakPolarHBondContact O-CD2 3.31Å; E385-Y389 PolarHBondContact O-N 3.19Å; I386-Y389 PolarHBondContact O-N 2.87Å; Y389-K391 VanDerWaalsContact C-N 3.34Å; Y389-K391 PolarHBondContact O-N 3.19Å; Y389-L392 WeakPolarHBondContact O-CB 3.45Å; Y389-L392 PolarHBondContact O-N 3.39Å; Y389-L392 VanDerWaalsContact O-N 3.11Å; Y389-L393 WeakPolarHBondContact O-CD1 3.46Å; Y389-L393 PolarHBondContact O-N 2.67Å
390R93.8Very high85.7Confident165 Ų165100.9 Ų100.962%0.62351%0.513SS*.Hα-helixtrans-54.6-49174.6-77.4174.5-177.8172.42.8111.8I386 L392 L393 E394I386-R390 WeakPolarHBondContact O-CB 3.1Å; I386-R390 VanDerWaalsContact O-CG 3.28Å; I386-R390 WeakPolarHBondContact O-CG 3.5Å; I386-R390 PolarHBondContact O-N 3.48Å; R390-L392 VanDerWaalsContact C-N 3.28Å; R390-L392 PolarHBondContact O-N 3.26Å; R390-L393 PolarHBondContact O-N 3.08Å; R390-L393 VanDerWaalsContact O-N 3.15Å; R390-E394 WeakPolarHBondContact O-CG 3.44Å; R390-E394 PolarHBondContact O-N 3.31Å
391K92.4Very high83.6Confident158 Ų158100.5 Ų100.569%0.68752%0.521SS*.Hα-helixtrans-61.9-33.4177.9-172.4175.3-178.81780113.2A387 A388 Y389 G395A387-K391 WeakPolarHBondContact O-CB 3.41Å; A387-K391 PolarHBondContact O-N 3.32Å; A388-K391 PolarHBondContact O-N 3.32Å; Y389-K391 VanDerWaalsContact C-N 3.34Å; Y389-K391 PolarHBondContact O-N 3.19Å; K391-G395 PolarHBondContact O-N 2.88Å; K391-G395 VanDerWaalsContact O-N 3.14Å
392L90.7Very high81.3Confident120 Ų120107.3 Ų107.363%0.62854%0.542SS*.Hα-helixtrans-71.6-42174.5-172.566.6000111.6A388 Y389 R390 G395 E396A388-L392 PolarHBondContact O-N 3.46Å; Y389-L392 WeakPolarHBondContact O-CB 3.45Å; Y389-L392 PolarHBondContact O-N 3.39Å; Y389-L392 VanDerWaalsContact O-N 3.11Å; R390-L392 VanDerWaalsContact C-N 3.28Å; R390-L392 PolarHBondContact O-N 3.26Å; L392-G395 PolarHBondContact O-N 3.34Å; L392-E396 PolarHBondContact O-N 3.38Å
393L85.6Confident79.2Confident108 Ų108108.2 Ų108.257%0.56555%0.551SS**Hα-helixtrans-63.2-43.8173.7-89109000112Y389 R390 G395 E396 E397Y389-L393 WeakPolarHBondContact O-CD1 3.46Å; Y389-L393 PolarHBondContact O-N 2.67Å; R390-L393 PolarHBondContact O-N 3.08Å; R390-L393 VanDerWaalsContact O-N 3.15Å; L393-G395 PolarHBondContact O-N 2.79Å; L393-E396 CarbonylContact O-C 3.59Å; L393-E396 PolarHBondContact O-N 2.83Å; L393-E396 VanDerWaalsContact O-N 3.14Å; L393-E397 WeakPolarHBondContact O-CG 3.25Å; L393-E397 PolarHBondContact O-N 2.78Å
394E82.4Confident76.4Confident111 Ų111109.4 Ų109.452%0.51957%0.565SS.*Hα-helixtrans-59.1-36.1173.3-71.9163.7-164.500111.6R390 T398R390-E394 WeakPolarHBondContact O-CG 3.44Å; R390-E394 PolarHBondContact O-N 3.31Å; E394-T398 WeakPolarHBondContact O-CB 3.34Å; E394-T398 PolarHBondContact O-N 2.65Å; E394-T398 PolarHBondContact O-OG1 3.24Å
395G76.7Confident74Confident36 Ų36110.9 Ų110.937%0.37158%0.579SS.*Hα-helixtrans-67.2-41172.900000113.8K391 L392 L393 T398 R399K391-G395 PolarHBondContact O-N 2.88Å; K391-G395 VanDerWaalsContact O-N 3.14Å; L392-G395 PolarHBondContact O-N 3.34Å; L393-G395 PolarHBondContact O-N 2.79Å; G395-T398 PolarHBondContact O-N 2.9Å; G395-R399 PolarHBondContact O-N 3.03Å
396E71.1Confident71.5Confident82 Ų82109.7 Ų109.738%0.38359%0.592SS.*Hα-helixtrans-67.4-43.7172.7-83.9-70.7101.900111.9L392 L393 T398 R399 L400L392-E396 PolarHBondContact O-N 3.38Å; L393-E396 CarbonylContact O-C 3.59Å; L393-E396 PolarHBondContact O-N 2.83Å; L393-E396 VanDerWaalsContact O-N 3.14Å; E396-T398 PolarHBondContact O-N 3.46Å; E396-R399 WeakPolarHBondContact O-CA 3.32Å; E396-R399 WeakPolarHBondContact O-CB 3.27Å; E396-R399 PolarHBondContact O-N 3.45Å; E396-R399 IonicContact OE1-CZ 2.71Å; E396-R399 IonicContact OE1-NH1 2.77Å; E396-R399 PolarHBondContact OE1-NH1 2.95Å; E396-R399 IonicContact OE2-NH1 3.58Å; E396-L400 WeakPolarHBondContact O-CB 3.37Å; E396-L400 WeakPolarHBondContact O-CG 3.16Å; E396-L400 PolarHBondContact O-N 3.45Å
397E67.4Low68.7Low121 Ų121111.3 Ų111.357%0.56561%0.611SS**Hα-helixtrans-58.3-38.3173-76.2-174170.800111.1L393 R399 L400 S401L393-E397 WeakPolarHBondContact O-CG 3.25Å; L393-E397 PolarHBondContact O-N 2.78Å; E397-R399 VanDerWaalsContact C-N 3.33Å; E397-R399 PolarHBondContact O-N 3.35Å; E397-L400 PolarHBondContact O-N 2.88Å; E397-S401 WeakPolarHBondContact O-CB 3.32Å; E397-S401 PolarHBondContact O-N 3.11Å; E397-S401 PolarHBondContact O-OG 3.39Å
398T62Low66.3Low103 Ų103115.7 Ų115.763%0.63263%0.625SS**Hα-helixtrans-64.9-35.9175-55.20000111.9E394 G395 E396E394-T398 WeakPolarHBondContact O-CB 3.34Å; E394-T398 PolarHBondContact O-N 2.65Å; E394-T398 PolarHBondContact O-OG1 3.24Å; G395-T398 PolarHBondContact O-N 2.9Å; E396-T398 PolarHBondContact O-N 3.46Å
399R63.6Low63.9Low164 Ų164118.6 Ų118.662%0.61964%0.637SS**Hα-helixtrans-71.8-42.3173.8-69.4177.767.9-129.5-2112.5G395 E396 E397 F402G395-R399 PolarHBondContact O-N 3.03Å; E396-R399 WeakPolarHBondContact O-CA 3.32Å; E396-R399 WeakPolarHBondContact O-CB 3.27Å; E396-R399 PolarHBondContact O-N 3.45Å; E396-R399 IonicContact OE1-CZ 2.71Å; E396-R399 IonicContact OE1-NH1 2.77Å; E396-R399 PolarHBondContact OE1-NH1 2.95Å; E396-R399 IonicContact OE2-NH1 3.58Å; E397-R399 VanDerWaalsContact C-N 3.33Å; E397-R399 PolarHBondContact O-N 3.35Å; R399-F402 PolarHBondContact O-N 2.92Å
400L56.8Low61.1Low98 Ų98117.6 Ų117.651%0.51365%0.65SS.*Hα-helixtrans-73.1-30.7-179.2-67.6169.2000112.3E396 E397 F402 T403 S404E396-L400 WeakPolarHBondContact O-CB 3.37Å; E396-L400 WeakPolarHBondContact O-CG 3.16Å; E396-L400 PolarHBondContact O-N 3.45Å; E397-L400 PolarHBondContact O-N 2.88Å; L400-F402 PolarHBondContact O-N 3.29Å; L400-T403 PolarHBondContact O-N 2.91Å; L400-T403 VanDerWaalsContact O-N 3.08Å; L400-T403 PolarHBondContact O-OG1 3.33Å; L400-S404 WeakPolarHBondContact O-CB 3.38Å; L400-S404 PolarHBondContact O-N 3.18Å
401S53.2Low58.4Low94 Ų94113 Ų11366%0.65765%0.654SS**THydrogen-bonded Turntrans-65.2-22.2172.7-630000113.1E397E397-S401 WeakPolarHBondContact O-CB 3.32Å; E397-S401 PolarHBondContact O-N 3.11Å; E397-S401 PolarHBondContact O-OG 3.39Å
402F50.1Low55.7Low189 Ų189116.7 Ų116.783%0.82967%0.666SS**THydrogen-bonded Turntrans-81.4-18.1173.4-171.1-103.1000113.1R399 L400R399-F402 PolarHBondContact O-N 2.92Å; L400-F402 PolarHBondContact O-N 3.29Å
403T51.8Low53.3Low105 Ų105115.4 Ų115.464%0.64467%0.666SS**THydrogen-bonded Turntrans-113.8-14-176.749.90000115L400L400-T403 PolarHBondContact O-N 2.91Å; L400-T403 VanDerWaalsContact O-N 3.08Å; L400-T403 PolarHBondContact O-OG1 3.33Å
404S37.6Very low50.9Low94 Ų94118.9 Ų118.966%0.65768%0.68SS**  trans-103.889-180-163.20000113.2L400 G406L400-S404 WeakPolarHBondContact O-CB 3.38Å; L400-S404 PolarHBondContact O-N 3.18Å; S404-G406 PolarHBondContact O-N 3.27Å
405V45.2Very low48.6Very low150 Ų150119 Ų11991%0.90969%0.693SS**  trans-78.6105.9163.2-84.90000110.8
406G43.9Very low46.8Very low70 Ų70122.7 Ų122.772%0.72271%0.713SS**  trans108.1107.2149.800000118.1S404S404-G406 PolarHBondContact O-N 3.27Å
407S35.3Very low45.1Very low113 Ų113128.1 Ų128.179%0.7974%0.738SS**  -164.1107.4115-169.50000112.9
408I44.8Very low44Very low147 Ų147128.1 Ų128.175%0.75475%0.746SS**  trans-12147.9136.138174.6000116.7
409T42.1Very low42.6Very low122 Ų122133.2 Ų133.275%0.74876%0.76SS**  cis-162.5156.412.510.10000113.1
410S37Very low41.1Very low119 Ų119128.8 Ų128.883%0.83277%0.766SS**  trans67148.4156.2-760000120.8
411G37.2Very low39.8Very low69 Ų69136 Ų13671%0.71179%0.786SS**  cis121.7112.2-19.400000118.4
412Y36Very low39.5Very low236 Ų236137.2 Ų137.293%0.92579%0.794SS**  trans-153.1151.4150.4-129.9-89.1000110
413S39.8Very low39Very low92 Ų92131.4 Ų131.464%0.64378%0.781SS**  trans-122.3157.6-169.856.60000113.4
414Q35.8Very low38.3Very low181 Ų181137.6 Ų137.685%0.84679%0.794SS**  trans121.7138170.2-72.6170.458.900111.7
415S33.7Very low38.4Very low114 Ų114137 Ų13780%0.79780%0.803SS**  cis-159.4146.7-1247.60000108.8
416S38.8Very low38.3Very low113 Ų113133 Ų13379%0.7979%0.793SS**  trans-101.9136172.149.60000110.5
417Q35.5Very low38Very low197 Ų197137.8 Ų137.892%0.92180%0.801SS**  trans-149.4168.2149.4-81.8-140.7-36.700110.3
418V45.3Very low38.1Very low120 Ų120140.9 Ų140.973%0.72780%0.803SS**  trans-130.9163.3-146.9-156.50000111.2
419F32.1Very low37.6Very low210 Ų210140.2 Ų140.292%0.92181%0.806SS**  trans73.6128166.9-79.4-84.7000118.9
420G30.9Very low37.2Very low72 Ų72139.8 Ų139.874%0.74281%0.808SS**  trans164.480.7161.900000118.3
421R30.9Very low37.2Very low249 Ų249138.3 Ų138.394%0.9480%0.798SS**  trans57.9133.2152.2-81.6178.6166.2-107-0.9122.3
422S45.2Very low37.4Very low119 Ų119145.7 Ų145.783%0.83281%0.806SS**  trans-54.1136.1154.6169.70000114.1
423A40Very low37.7Very low67 Ų67142 Ų14255%0.55480%0.801SS**  trans-168.3154.4136.900000109.5
424Y37.4Very low37.5Very low235 Ų235145.4 Ų145.492%0.92281%0.809SS**  trans66.2127.6-179-46.4-81.7000114.7
425G39.2Very low37.2Very low81 Ų81141.9 Ų141.984%0.83580%0.804SS**  cis115.2111.34.900000111.2
426G43.4Very low37.4Very low68 Ų68143 Ų14370%0.70181%0.806SS**  trans112.762.5165.800000118
427L36.9Very low37.4Very low170 Ų170147.7 Ų147.789%0.8981%0.807SS**  trans-118.4103.2139.6-93.179.9000105.8
428Q38.3Very low37.7Very low177 Ų177143.9 Ų143.983%0.82780%0.802SS**  55.165.282.7-68.5-72.4-8.500111.9S430Q428-S430 PolarHBondContact O-N 3.14Å
429T34.8Very low37.2Very low134 Ų134146.9 Ų146.982%0.82281%0.805SS**  trans-56.4109.9155.535.50000109.1S431T429-S431 PolarHBondContact O-N 3.49Å
430S33.7Very low37.4Very low113 Ų113142 Ų14279%0.7980%0.795SS**  trans-63.9124.3174.5-170.80000110.1Q428 Y432Q428-S430 PolarHBondContact O-N 3.14Å; S430-Y432 PolarHBondContact O-N 3.04Å
431S36.2Very low37.7Very low88 Ų88143.6 Ų143.662%0.61580%0.795SS**  trans-71.3119.2-17350.40000112.9T429 L433T429-S431 PolarHBondContact O-N 3.49Å; S431-L433 PolarHBondContact O-N 3.33Å
432Y40.9Very low38.2Very low224 Ų224139 Ų13988%0.87878%0.779SS**  trans-70.9103.7150.5-79-92.2000108.3S430 M434S430-Y432 PolarHBondContact O-N 3.04Å; Y432-M434 PolarHBondContact O-N 2.8Å
433L42.1Very low38.2Very low159 Ų159144.3 Ų144.383%0.83278%0.782SS**  trans-85.288.2167.7-68179.9000109.2S431 S435S431-L433 PolarHBondContact O-N 3.33Å; L433-S435 PolarHBondContact O-N 3.24Å
434M35.7Very low37.7Very low163 Ų163147.3 Ų147.380%0.80379%0.794SS**  trans-68.8120.7156.8-82.3-68.8158.900108.1Y432 T436Y432-M434 PolarHBondContact O-N 2.8Å; M434-T436 PolarHBondContact O-N 2.86Å
435S30.8Very low37.9Very low106 Ų106139.7 Ų139.774%0.74177%0.774SS**  trans-74.994.3177.9-175.10000109.7L433 R437L433-S435 PolarHBondContact O-N 3.24Å; S435-R437 VanDerWaalsContact C-N 3.35Å; S435-R437 PolarHBondContact O-N 3.46Å
436T37.3Very low38.3Very low138 Ų138144 Ų14485%0.84777%0.772SS**  trans-68.393.2166.947.90000109.1M434 S438M434-T436 PolarHBondContact O-N 2.86Å; T436-S438 PolarHBondContact O-N 3.24Å
437R39.1Very low38.3Very low212 Ų212145.7 Ų145.780%0.877%0.769SS**  trans-75115.7158.3-85.1-172169.3-160.9-2.6108.2S435 F439S435-R437 VanDerWaalsContact C-N 3.35Å; S435-R437 PolarHBondContact O-N 3.46Å; R437-F439 PolarHBondContact O-N 3.46Å
438S42.1Very low38.3Very low117 Ų117145.6 Ų145.682%0.81876%0.764SS**PPolyproline II helixtrans-60.7123.5159.3400000109T436T436-S438 PolarHBondContact O-N 3.24Å
439F35Very low38.5Very low182 Ų182145.2 Ų145.280%0.79876%0.762SS**PPolyproline II helixtrans-89.4135.6161.2-81.9-92.9000108.1R437 S441R437-F439 PolarHBondContact O-N 3.46Å; F439-S441 PolarHBondContact O-N 2.86Å
440P36.2Very low38.9Very low108 Ų108145.7 Ų145.770%0.70176%0.755SS**PPolyproline II helixtrans-60.6121.7166.3-21.833.9000109.8Y442P440-Y442 HydrophobicContact CB-CD2 4.12Å; P440-Y442 HydrophobicContact CB-CE2 4.45Å; P440-Y442 PolarHBondContact O-N 3.38Å
441S36.7Very low39.2Very low106 Ų106147.2 Ų147.274%0.74175%0.75SS**  trans-83.488.6174.9-178.10000109.8F439F439-S441 PolarHBondContact O-N 2.86Å
442Y42Very low39.6Very low153 Ų153148.9 Ų148.960%0.675%0.75SS**  trans-128.5127.6163.2-68.4-83.9000107.9P440P440-Y442 HydrophobicContact CB-CD2 4.12Å; P440-Y442 HydrophobicContact CB-CE2 4.45Å; P440-Y442 PolarHBondContact O-N 3.38Å
443Y43.6Very low39.8Very low229 Ų229145.3 Ų145.390%0.89874%0.742SS**  trans63.378.3-179-100.5-96.3000117
444T30.1Very low40.1Very low131 Ų131141.2 Ų141.280%0.80472%0.723SS**  trans-140.7100.1140-169.90000109.1
445S41.3Very low40.8Very low74 Ų74140.4 Ų140.452%0.51772%0.718SS.*  trans-92.2124-179.753.70000110.7V447S445-V447 PolarHBondContact O-N 2.88Å
446H48.5Very low41.7Very low171 Ų171142.5 Ų142.579%0.79272%0.716SS**  trans22.191.3137.1-47-66.1000117.4
447V43.2Very low42.5Very low105 Ų105140 Ų14064%0.63670%0.7SS**SBendtrans-138.3-7.4160.8-1750000112.8S445S445-V447 PolarHBondContact O-N 2.88Å
448Q37.9Very low43.2Very low167 Ų167134.7 Ų134.778%0.7869%0.687SS**SBendtrans-135.36.5-163-107.4156.14.900118.9
449E41.8Very low43.6Very low170 Ų170136.5 Ų136.579%0.79468%0.682SS**SBendtrans-112.7-26.8167.5-76.3175.5143.600112.7Q451 I452E449-Q451 VanDerWaalsContact C-N 3.27Å; E449-Q451 PolarHBondContact O-N 2.93Å; E449-I452 PolarHBondContact O-N 2.69Å
450E43.7Very low44.4Very low144 Ų144130.7 Ų130.767%0.67367%0.668SS**Hα-helixtrans-70.3-17.9-178.1-143.1169.3-155.900114V454E450-V454 VanDerWaalsContact O-CG2 3.26Å; E450-V454 WeakPolarHBondContact O-CG2 3.41Å
451Q38.2Very low45.1Very low144 Ų144128.5 Ų128.567%0.67366%0.659SS**Hα-helixtrans-79.6-13179-71.1-173-14.400114.3E449E449-Q451 VanDerWaalsContact C-N 3.27Å; E449-Q451 PolarHBondContact O-N 2.93Å
452I45.4Very low45.8Very low123 Ų123131.4 Ų131.463%0.63166%0.658SS**Hα-helixtrans-97.7-39.8-178.1-60.7175.2000110.8E449 E456E449-I452 PolarHBondContact O-N 2.69Å; I452-E456 PolarHBondContact O-N 3.05Å
453E44.4Very low45.9Very low149 Ų149127.4 Ų127.470%0.69666%0.657SS**Hα-helixtrans-74-28179.8-63.5-171155.500113.1T457E453-T457 WeakPolarHBondContact O-CB 3.34Å; E453-T457 VanDerWaalsContact O-CG2 3.27Å; E453-T457 WeakPolarHBondContact O-CG2 3.46Å; E453-T457 PolarHBondContact O-N 3.24Å; E453-T457 PolarHBondContact O-OG1 2.88Å
454V49.5Very low46.1Very low74 Ų74124.5 Ų124.545%0.44865%0.652SS.*Hα-helixtrans-74.2-33.8177.1175.60000112.2E450 T457 I458E450-V454 VanDerWaalsContact O-CG2 3.26Å; E450-V454 WeakPolarHBondContact O-CG2 3.41Å; V454-T457 WeakPolarHBondContact CA-OG1 3.5Å; V454-T457 PolarHBondContact O-OG1 3.49Å; V454-I458 HydrophobicContact CG1-CD1 3.72Å; V454-I458 HydrophobicContact CG1-CG1 4.48Å; V454-I458 WeakPolarHBondContact O-CD1 3.46Å; V454-I458 VanDerWaalsContact O-CG1 3.23Å; V454-I458 WeakPolarHBondContact O-CG1 3.41Å; V454-I458 PolarHBondContact O-N 3.41Å
455E49.4Very low46.7Very low146 Ų146126.6 Ų126.668%0.68265%0.652SS**Hα-helixtrans-73.5-42.2-179.9-148.2169.5-149.400111.3T457 I458 E459E455-T457 PolarHBondContact O-N 3.31Å; E455-I458 PolarHBondContact O-N 3.43Å; E455-E459 PolarHBondContact O-N 2.81Å
456E50.5Low46.8Very low149 Ų149127 Ų12770%0.69666%0.66SS**Hα-helixtrans-69.5-31.2177.8-165.4170-161.100112.9I452 A460I452-E456 PolarHBondContact O-N 3.05Å; E456-A460 WeakPolarHBondContact O-CB 3.45Å; E456-A460 PolarHBondContact O-N 3.24Å
457T53.5Low46.6Very low86 Ų86127.3 Ų127.353%0.52866%0.659SS.*Hα-helixtrans-77.1-32.3176.649.20000113.7E453 V454 E455 A460 A461E453-T457 WeakPolarHBondContact O-CB 3.34Å; E453-T457 VanDerWaalsContact O-CG2 3.27Å; E453-T457 WeakPolarHBondContact O-CG2 3.46Å; E453-T457 PolarHBondContact O-N 3.24Å; E453-T457 PolarHBondContact O-OG1 2.88Å; V454-T457 WeakPolarHBondContact CA-OG1 3.5Å; V454-T457 PolarHBondContact O-OG1 3.49Å; E455-T457 PolarHBondContact O-N 3.31Å; T457-A460 PolarHBondContact O-N 2.85Å; T457-A461 WeakPolarHBondContact O-CB 3.47Å; T457-A461 PolarHBondContact O-N 3.35Å
458I54.2Low46.2Very low101 Ų101130.3 Ų130.352%0.51867%0.671SS.*Hα-helixtrans-70.6-39.4174.8-68.9168.8000111.2V454 E455 K462V454-I458 HydrophobicContact CG1-CD1 3.72Å; V454-I458 HydrophobicContact CG1-CG1 4.48Å; V454-I458 WeakPolarHBondContact O-CD1 3.46Å; V454-I458 VanDerWaalsContact O-CG1 3.23Å; V454-I458 WeakPolarHBondContact O-CG1 3.41Å; V454-I458 PolarHBondContact O-N 3.41Å; E455-I458 PolarHBondContact O-N 3.43Å; I458-K462 WeakPolarHBondContact O-CB 3.22Å; I458-K462 PolarHBondContact O-N 2.87Å
459E51.3Low45.9Very low155 Ų155131.2 Ų131.272%0.72468%0.676SS**Hα-helixtrans-67.8-34.6174.5-70.9-159.1143.400112.6E455E455-E459 PolarHBondContact O-N 2.81Å
460A50.3Low45.9Very low59 Ų59128.3 Ų128.349%0.48867%0.671SS.*Hα-helixtrans-68.6-45.3175.600000112.9E456 T457 K462 A463E456-A460 WeakPolarHBondContact O-CB 3.45Å; E456-A460 PolarHBondContact O-N 3.24Å; T457-A460 PolarHBondContact O-N 2.85Å; A460-K462 VanDerWaalsContact C-N 3.35Å; A460-K462 PolarHBondContact O-N 3.27Å; A460-A463 PolarHBondContact O-N 3.34Å
461A52.4Low45.9Very low63 Ų63126.5 Ų126.552%0.52167%0.672SS.*Hα-helixtrans-62.1-41.8179.200000112.1T457 A463 E464 E465T457-A461 WeakPolarHBondContact O-CB 3.47Å; T457-A461 PolarHBondContact O-N 3.35Å; A461-A463 PolarHBondContact O-N 2.97Å; A461-E464 PolarHBondContact O-N 3.1Å; A461-E465 PolarHBondContact O-N 2.92Å
462K49.8Very low45.5Very low166 Ų166124.5 Ų124.572%0.72267%0.674SS**Hα-helixtrans-70.7-9.6-179-151.1169.9-167.71690114.2I458 A460I458-K462 WeakPolarHBondContact O-CB 3.22Å; I458-K462 PolarHBondContact O-N 2.87Å; A460-K462 VanDerWaalsContact C-N 3.35Å; A460-K462 PolarHBondContact O-N 3.27Å
463A46Very low44.9Very low69 Ų69128.1 Ų128.157%0.5769%0.688SS**Hα-helixtrans-96.9-20.9176.500000113.8A460 A461A460-A463 PolarHBondContact O-N 3.34Å; A461-A463 PolarHBondContact O-N 2.97Å
464E47.1Very low44.2Very low169 Ų169124.9 Ų124.979%0.7970%0.695SS**Hα-helixtrans-85.2-36.1174.9-82.3-97118.700112.2A461 A466A461-E464 PolarHBondContact O-N 3.1Å; E464-A466 PolarHBondContact O-N 2.8Å
465E42.3Very low43.7Very low175 Ų175130.9 Ų130.982%0.81872%0.718SS**THydrogen-bonded Turntrans-67.9-6.7-176.4-160173.3-160.700114.4A461A461-E465 PolarHBondContact O-N 2.92Å
466A44Very low43.2Very low82 Ų82128.4 Ų128.468%0.67872%0.722SS**THydrogen-bonded Turntrans-98.217.5-173.800000115.1E464E464-A466 PolarHBondContact O-N 2.8Å
467K44.4Very low42.7Very low178 Ų178130.4 Ų130.477%0.77473%0.732SS**SBendtrans-137-16.4-170-88.4-172.7179.6169.50120.8
468D34.6Very low42.1Very low167 Ų167134.6 Ų134.689%0.89375%0.745SS**  trans-127.292.8-177.6-85.5-46.7000113.7
469E31.1Very low41.4Very low186 Ų186136.9 Ų136.987%0.86975%0.754SS**  trans-145.5156.8156.3-106-162-178.700106.7
470P41.6Very low41.1Very low109 Ų109137.4 Ų137.471%0.70876%0.757SS**  cis-134.3-148.84.245.6-26.7000110.3
471P43.7Very low40.6Very low106 Ų106142.4 Ų142.469%0.68877%0.767SS**  cis-136.6173.4-14.140.5-23000117.4
472S30.9Very low40.2Very low103 Ų103145.5 Ų145.572%0.7278%0.775SS**  trans95.4147.113979.20000122.5
473E31.2Very low40Very low198 Ų198143 Ų14393%0.92576%0.764SS**  trans77.5106.8170.6-62.2-171.6-174.800117.6
474G29.7Very low39.9Very low81 Ų81146.8 Ų146.884%0.83577%0.77SS**  trans165.325175.200000117.1
475E40.7Very low39.8Very low201 Ų201146 Ų14694%0.93977%0.766SS**  trans-70141.4168.7-72.8179169.500110.2
476A38.8Very low39.9Very low93 Ų93140.1 Ų140.177%0.76975%0.748SS**SBendtrans95.476.9178.600000117.3
477E39.7Very low40Very low191 Ų191143.2 Ų143.289%0.89375%0.748SS**SBendtrans-161-4.5143.6-116.6167.7-143.400115.2
478E40.3Very low40.3Very low174 Ų174141.9 Ų141.981%0.81375%0.745SS**SBendtrans-96.8-1.3176.9-66-163.8148.400115.4E480E478-E480 PolarHBondContact O-N 3Å
479E40.1Very low41Very low150 Ų150141.3 Ų141.370%0.70174%0.737SS**THydrogen-bonded Turntrans-86.32.2-177.4-118.2-156.7-131.800115.6K483E479-K483 PolarHBondContact O-NZ 3.33Å; E479-K483 IonicContact OE2-NZ 2.84Å; E479-K483 PolarHBondContact OE2-NZ 2.76Å
480E44.4Very low41.9Very low166 Ų166139.5 Ų139.578%0.77673%0.728SS**THydrogen-bonded Turntrans-102.3-18.3175.7-77.1-160.9155.300114.4E478E478-E480 PolarHBondContact O-N 3Å
481K40.7Very low42.3Very low164 Ų164138.3 Ų138.371%0.71372%0.719SS**Hα-helixtrans-81.2-42.3178.5-96.4-168.7165-160.50113.8K483 E484K481-K483 PolarHBondContact O-N 3.12Å; K481-E484 PolarHBondContact O-N 3.33Å
482D42.6Very low42.7Very low128 Ų128135.9 Ų135.968%0.68471%0.708SS**Hα-helixtrans-71.91.6-179.6-63.71.1000113.3
483K45.1Very low43.9Very low113 Ų113138.4 Ų138.449%0.49171%0.709SS.*Hα-helixtrans-102.2-28.1173.7-68.4-177-173.9117.20113.4E479 K481 E487E479-K483 PolarHBondContact O-NZ 3.33Å; E479-K483 IonicContact OE2-NZ 2.84Å; E479-K483 PolarHBondContact OE2-NZ 2.76Å; K481-K483 PolarHBondContact O-N 3.12Å; K483-E487 PolarHBondContact O-N 3.29Å
484E44.2Very low45Very low149 Ų149136.2 Ų136.270%0.69670%0.698SS**Hα-helixtrans-74.2-39174.7-72.9-172.114400111.4K481 A486 E487 E488K481-E484 PolarHBondContact O-N 3.33Å; E484-A486 VanDerWaalsContact C-N 3.28Å; E484-A486 PolarHBondContact O-N 3.48Å; E484-E487 PolarHBondContact O-N 2.86Å; E484-E488 PolarHBondContact O-N 3.41Å
485E45.6Very low46.1Very low151 Ų151139.7 Ų139.771%0.70669%0.693SS**Hα-helixtrans-69-24.5175.7-68.7-171.9172.800112.9E489E485-E489 PolarHBondContact O-N 2.77Å
486A44.8Very low46.9Very low52 Ų52136.2 Ų136.243%0.4368%0.677SS.*Hα-helixtrans-79.3-34.6177.400000113.6E484 E490E484-A486 VanDerWaalsContact C-N 3.28Å; E484-A486 PolarHBondContact O-N 3.48Å; A486-E490 PolarHBondContact O-N 2.93Å
487E46.9Very low47.9Very low147 Ų147134.4 Ų134.469%0.68766%0.662SS**Hα-helixtrans-74.2-26174.8-73.4-169.2170.100112.3K483 E484 T491K483-E487 PolarHBondContact O-N 3.29Å; E484-E487 PolarHBondContact O-N 2.86Å; E487-T491 WeakPolarHBondContact O-CB 3.45Å; E487-T491 WeakPolarHBondContact O-CG2 3.25Å; E487-T491 PolarHBondContact O-N 2.96Å; E487-T491 PolarHBondContact O-OG1 3.26Å
488E50Low48.8Very low151 Ų151128.2 Ų128.271%0.70664%0.643SS**Hα-helixtrans-74.7-31.1172.2-73.8-162.8156.300113.4E484 T491 A492E484-E488 PolarHBondContact O-N 3.41Å; E488-T491 PolarHBondContact O-OG1 3.43Å; E488-A492 PolarHBondContact O-N 3.04Å
489E50Low49.8Very low154 Ų154126.1 Ų126.172%0.7263%0.631SS**Hα-helixtrans-74.1-43.9172.4-79.4-16514900112.7E485 T491 A492 E493E485-E489 PolarHBondContact O-N 2.77Å; E489-T491 VanDerWaalsContact C-N 3.32Å; E489-T491 PolarHBondContact O-N 3Å; E489-A492 PolarHBondContact O-N 2.94Å; E489-E493 PolarHBondContact O-N 3.14Å; E489-E493 VanDerWaalsContact O-N 3.13Å
490E49.9Very low50.7Low148 Ų148126 Ų12669%0.69263%0.631SS**Hα-helixtrans-64.4-34.2178.5-75.7-165.3165.400112.5A486 E494A486-E490 PolarHBondContact O-N 2.93Å; E490-E494 PolarHBondContact O-N 3.39Å; E490-E494 VanDerWaalsContact O-N 3.13Å
491T49.6Very low51.3Low85 Ų85125.3 Ų125.352%0.52163%0.628SS.*Hα-helixtrans-74.1-26.2176.550.10000113.6E487 E488 E489 E495E487-T491 WeakPolarHBondContact O-CB 3.45Å; E487-T491 WeakPolarHBondContact O-CG2 3.25Å; E487-T491 PolarHBondContact O-N 2.96Å; E487-T491 PolarHBondContact O-OG1 3.26Å; E488-T491 PolarHBondContact O-OG1 3.43Å; E489-T491 VanDerWaalsContact C-N 3.32Å; E489-T491 PolarHBondContact O-N 3Å; T491-E495 PolarHBondContact O-N 2.79Å
492A52.3Low52Low55 Ų55120.5 Ų120.546%0.45561%0.614SS.*Hα-helixtrans-73.3-38.8172.500000112.3E488 E489 E495 E496E488-A492 PolarHBondContact O-N 3.04Å; E489-A492 PolarHBondContact O-N 2.94Å; A492-E495 PolarHBondContact O-N 3.46Å; A492-E496 PolarHBondContact O-N 2.71Å; A492-E496 VanDerWaalsContact O-N 3.12Å
493E54.8Low52.7Low156 Ų156121.1 Ų121.173%0.72961%0.613SS**Hα-helixtrans-68-36.2174.4-70.7-161.915400112.3E489 A497E489-E493 PolarHBondContact O-N 3.14Å; E489-E493 VanDerWaalsContact O-N 3.13Å; E493-A497 WeakPolarHBondContact O-CB 3.41Å; E493-A497 PolarHBondContact O-N 3.19Å
494E53.8Low53.1Low152 Ų152122.5 Ų122.571%0.7162%0.621SS**Hα-helixtrans-66.9-36.1172.8-78-161.6151.600113.2E490 A498E490-E494 PolarHBondContact O-N 3.39Å; E490-E494 VanDerWaalsContact O-N 3.13Å; E494-A498 VanDerWaalsContact O-CB 3.29Å; E494-A498 WeakPolarHBondContact O-CB 3.24Å; E494-A498 PolarHBondContact O-N 2.88Å
495E53.6Low53.6Low153 Ų153118.4 Ų118.472%0.71561%0.613SS**Hα-helixtrans-71.8-33.7175.6-86.1-154.1155.600113.7T491 A492 K499T491-E495 PolarHBondContact O-N 2.79Å; A492-E495 PolarHBondContact O-N 3.46Å; E495-K499 PolarHBondContact O-N 2.9Å
496E58.1Low54Low129 Ų129118.2 Ų118.260%0.60361%0.61SS**Hα-helixtrans-70.2-44172.9-73.8-96.1112.900110.9A492 A498 K499 E500A492-E496 PolarHBondContact O-N 2.71Å; A492-E496 VanDerWaalsContact O-N 3.12Å; E496-A498 PolarHBondContact O-N 3.28Å; E496-K499 WeakPolarHBondContact O-CA 3.47Å; E496-K499 WeakPolarHBondContact O-CB 3.42Å; E496-K499 PolarHBondContact O-N 2.89Å; E496-E500 PolarHBondContact O-N 2.93Å
497A58.8Low54.4Low55 Ų55123.4 Ų123.446%0.45563%0.625SS.*Hα-helixtrans-62.7-41.2177.500000112.8E493 K499 E500 E501E493-A497 WeakPolarHBondContact O-CB 3.41Å; E493-A497 PolarHBondContact O-N 3.19Å; A497-K499 PolarHBondContact O-N 3.48Å; A497-E500 PolarHBondContact O-N 2.98Å; A497-E501 PolarHBondContact O-N 2.91Å; A497-E501 VanDerWaalsContact O-N 3.08Å
498A58.5Low54.6Low61 Ų61124 Ų12450%0.50463%0.628SS.*Hα-helixtrans-66.4-21.6174.500000113.2E494 E496 S502E494-A498 VanDerWaalsContact O-CB 3.29Å; E494-A498 WeakPolarHBondContact O-CB 3.24Å; E494-A498 PolarHBondContact O-N 2.88Å; E496-A498 PolarHBondContact O-N 3.28Å; A498-S502 WeakPolarHBondContact O-CB 3.39Å; A498-S502 PolarHBondContact O-N 3.33Å
499K61.6Low54.7Low129 Ų129124.2 Ų124.256%0.56163%0.629SS**Hα-helixtrans-77.4-47.3173-116.4173.9-176.1166.10111.6E495 E496 A497 S502 E503E495-K499 PolarHBondContact O-N 2.9Å; E496-K499 WeakPolarHBondContact O-CA 3.47Å; E496-K499 WeakPolarHBondContact O-CB 3.42Å; E496-K499 PolarHBondContact O-N 2.89Å; A497-K499 PolarHBondContact O-N 3.48Å; K499-S502 CarbonylContact O-C 3.57Å; K499-S502 WeakPolarHBondContact O-CA 3.16Å; K499-S502 WeakPolarHBondContact O-CB 3.36Å; K499-S502 PolarHBondContact O-N 3.2Å; K499-S502 PolarHBondContact O-OG 2.87Å; K499-E503 PolarHBondContact O-N 3.47Å
500E59.6Low54.6Low149 Ų149125.4 Ų125.470%0.69663%0.634SS**Hα-helixtrans-61-45.2177.8-70.1-164.3146.900111.2E496 A497 S502 E503 E504E496-E500 PolarHBondContact O-N 2.93Å; A497-E500 PolarHBondContact O-N 2.98Å; E500-S502 PolarHBondContact O-N 3.3Å; E500-E503 PolarHBondContact O-N 3.23Å; E500-E503 VanDerWaalsContact O-N 3.16Å; E500-E504 PolarHBondContact O-N 2.92Å
501E56.5Low54.3Low151 Ų151120.7 Ų120.771%0.70663%0.625SS**Hα-helixtrans-59.3-29.7172.5-80.2-162.9154.600112.6A497 A505A497-E501 PolarHBondContact O-N 2.91Å; A497-E501 VanDerWaalsContact O-N 3.08Å; E501-A505 WeakPolarHBondContact O-CB 3.38Å; E501-A505 PolarHBondContact O-N 3.09Å; E501-A505 VanDerWaalsContact O-N 3.08Å
502S56.2Low54.1Low62 Ų62119 Ų11943%0.43463%0.625SS.*Hα-helixtrans-81.2-2317983.60000114.6A498 K499 E500A498-S502 WeakPolarHBondContact O-CB 3.39Å; A498-S502 PolarHBondContact O-N 3.33Å; K499-S502 CarbonylContact O-C 3.57Å; K499-S502 WeakPolarHBondContact O-CA 3.16Å; K499-S502 WeakPolarHBondContact O-CB 3.36Å; K499-S502 PolarHBondContact O-N 3.2Å; K499-S502 PolarHBondContact O-OG 2.87Å; E500-S502 PolarHBondContact O-N 3.3Å
503E56.2Low53.7Low141 Ų141125.1 Ų125.166%0.65964%0.644SS**Hα-helixtrans-84.3-40.2171.1-68.7-160.2146.900110.7K499 E500 A505 K506 E507K499-E503 PolarHBondContact O-N 3.47Å; E500-E503 PolarHBondContact O-N 3.23Å; E500-E503 VanDerWaalsContact O-N 3.16Å; E503-A505 PolarHBondContact O-N 3.48Å; E503-K506 WeakPolarHBondContact O-CB 3.38Å; E503-K506 PolarHBondContact O-N 2.91Å; E503-E507 PolarHBondContact O-N 3.1Å
504E55.2Low53.2Low143 Ų143120.2 Ų120.267%0.66864%0.635SS**Hα-helixtrans-63.5-40.8175.7-155.8171.8-143.900111.3E500 K506 E507 E508E500-E504 PolarHBondContact O-N 2.92Å; E504-K506 PolarHBondContact O-N 2.82Å; E504-E507 PolarHBondContact O-N 2.75Å; E504-E508 PolarHBondContact O-N 2.84Å; E504-E508 VanDerWaalsContact O-N 3.1Å
505A54.3Low52.9Low62 Ų62121 Ų12151%0.51264%0.638SS.*Hα-helixtrans-65.2-20.3172.700000114.3E501 E503 E509E501-A505 WeakPolarHBondContact O-CB 3.38Å; E501-A505 PolarHBondContact O-N 3.09Å; E501-A505 VanDerWaalsContact O-N 3.08Å; E503-A505 PolarHBondContact O-N 3.48Å; A505-E509 PolarHBondContact O-N 3.49Å
506K53.6Low52.5Low147 Ų147121.6 Ų121.664%0.63964%0.642SS**Hα-helixtrans-85.6-35.6173.7-92.8179.8174.3174.30112.9E503 E504 E508 E509 E510E503-K506 WeakPolarHBondContact O-CB 3.38Å; E503-K506 PolarHBondContact O-N 2.91Å; E504-K506 PolarHBondContact O-N 2.82Å; K506-E508 VanDerWaalsContact C-N 3.3Å; K506-E509 PolarHBondContact O-N 3.2Å; K506-E510 PolarHBondContact O-N 3.07Å
507E52Low51.8Low161 Ų161117.1 Ų117.175%0.75263%0.63SS**Hα-helixtrans-67.6-31.9173.3-67.6-156.3156.800111.5E503 E504 G511E503-E507 PolarHBondContact O-N 3.1Å; E504-E507 PolarHBondContact O-N 2.75Å; E507-G511 PolarHBondContact O-N 2.87Å
508E52.7Low51.2Low161 Ų161121.7 Ų121.775%0.75264%0.642SS**Hα-helixtrans-68.9-33.8169.5-71.1-153.5151.800113.3E504 K506 G512E504-E508 PolarHBondContact O-N 2.84Å; E504-E508 VanDerWaalsContact O-N 3.1Å; K506-E508 VanDerWaalsContact C-N 3.3Å; E508-G512 PolarHBondContact O-N 3.32Å
509E50.7Low50.7Low155 Ų155126.6 Ų126.672%0.72466%0.655SS**Hα-helixtrans-74.3-39177.9-139.9178.2-15600112.3A505 K506 G511 G512A505-E509 PolarHBondContact O-N 3.49Å; K506-E509 PolarHBondContact O-N 3.2Å; E509-G511 VanDerWaalsContact C-N 3.35Å; E509-G512 PolarHBondContact O-N 2.79Å
510E48.5Very low49.9Very low179 Ų179125 Ų12584%0.83666%0.656SS**Hα-helixtrans-73.5-23.7171.7-72.6-161.3165.200113.2K506K506-E510 PolarHBondContact O-N 3.07Å
511G43.3Very low49.3Very low48 Ų48124.9 Ų124.950%0.49565%0.653SS.*Hα-helixtrans-71.2-31.2171.900000113.9E507 E509 G514E507-G511 PolarHBondContact O-N 2.87Å; E509-G511 VanDerWaalsContact C-N 3.35Å; G511-G514 PolarHBondContact O-N 2.92Å
512G45.3Very low49Very low50 Ų50125.1 Ų125.152%0.51565%0.654SS.*Hα-helixtrans-70.8-31.6-174.300000115.6E508 E509 G514E508-G512 PolarHBondContact O-N 3.32Å; E509-G512 PolarHBondContact O-N 2.79Å; G512-G514 PolarHBondContact O-N 2.87Å
513E44.3Very low48.7Very low184 Ų184125.1 Ų125.186%0.8666%0.658SS**THydrogen-bonded Turntrans-80.1-2.5179.2-63.9-160.3150.200113.6
514G44.5Very low48.2Very low52 Ų52124 Ų12454%0.53665%0.652SS.*THydrogen-bonded Turntrans-81.2-36.5-178.200000115.7G511 G512G511-G514 PolarHBondContact O-N 2.92Å; G512-G514 PolarHBondContact O-N 2.87Å
515E46.8Very low48Very low168 Ų168123.5 Ų123.579%0.78565%0.65SS**THydrogen-bonded Turntrans-93.8-30.4-169.4-75-167138.800115G517 E518E515-G517 PolarHBondContact O-N 3.1Å; E515-G517 VanDerWaalsContact O-N 3.13Å; E515-E518 PolarHBondContact O-N 3.31Å
516E46.2Very low47.9Very low167 Ų167127.6 Ų127.678%0.7866%0.658SS**Hα-helixtrans-68.5-13.4178-65.5-158.715700113.4T520E516-T520 PolarHBondContact O-OG1 3.29Å
517G43.8Very low47.7Very low35 Ų35127.8 Ų127.836%0.36166%0.662SS.*Hα-helixtrans-84-10.8-179.800000116.5E515E515-G517 PolarHBondContact O-N 3.1Å; E515-G517 VanDerWaalsContact O-N 3.13Å
518E45.5Very low47.7Very low151 Ų151126.9 Ų126.971%0.70666%0.655SS**Hα-helixtrans-104.6-41.1178-89.2-168.7149.300113.7E515 T520 K521 E522E515-E518 PolarHBondContact O-N 3.31Å; E518-T520 PolarHBondContact O-N 2.91Å; E518-K521 PolarHBondContact O-N 3.11Å; E518-E522 PolarHBondContact O-N 3.32Å
519E47.9Very low47.5Very low164 Ų164126 Ų12677%0.76665%0.649SS**Hα-helixtrans-59.6-32.9177.6-72.6-157.5144.100112.7K521 A523E519-K521 VanDerWaalsContact C-N 3.27Å; E519-K521 PolarHBondContact O-N 3.15Å; E519-A523 PolarHBondContact O-N 3.42Å
520T45.4Very low47.6Very low95 Ų95123.9 Ų123.958%0.58365%0.647SS**Hα-helixtrans-71-16.9177.950.10000114.1E516 E518E516-T520 PolarHBondContact O-OG1 3.29Å; E518-T520 PolarHBondContact O-N 2.91Å
521K47Very low47.7Very low147 Ų147123.3 Ų123.364%0.63964%0.644SS**Hα-helixtrans-92.8-34.9174.5-76.6174.9-173.6141.30113.3E518 E519 A523 E524 E525E518-K521 PolarHBondContact O-N 3.11Å; E519-K521 VanDerWaalsContact C-N 3.27Å; E519-K521 PolarHBondContact O-N 3.15Å; K521-A523 VanDerWaalsContact C-N 3.32Å; K521-E524 PolarHBondContact O-N 2.9Å; K521-E525 PolarHBondContact O-N 3.16Å
522E49.7Very low48.1Very low156 Ų156124 Ų12473%0.72965%0.651SS**Hα-helixtrans-67.6-35174.9-64.6-150.7140.700111.5E518 E525 E526E518-E522 PolarHBondContact O-N 3.32Å; E522-E525 PolarHBondContact O-N 3.19Å; E522-E526 PolarHBondContact O-N 3Å; E522-E526 VanDerWaalsContact O-N 3.12Å
523A49.2Very low48.4Very low62 Ų62124.5 Ų124.551%0.51265%0.65SS.*Hα-helixtrans-62.9-41.7173.900000113.6E519 K521 E526 E527E519-A523 PolarHBondContact O-N 3.42Å; K521-A523 VanDerWaalsContact C-N 3.32Å; A523-E526 PolarHBondContact O-N 3Å; A523-E527 PolarHBondContact O-N 2.89Å
524E47Very low48.7Very low117 Ų117118.2 Ų118.255%0.54763%0.634SS.*Hα-helixtrans-71.8-26.3176.9-100.8-146.5104.100113.5K521 K528K521-E524 PolarHBondContact O-N 2.9Å; E524-K528 IonicContact OE1-NZ 3.24Å; E524-K528 PolarHBondContact OE1-NZ 3.47Å
525E50.3Low49Very low133 Ų133124 Ų12462%0.62165%0.647SS**Hα-helixtrans-78-29.5173.9-84.9-137.6155.100113.4K521 E522 K529K521-E525 PolarHBondContact O-N 3.16Å; E522-E525 PolarHBondContact O-N 3.19Å; E525-K529 PolarHBondContact O-N 3.38Å; E525-K529 IonicContact OE2-NZ 2.81Å
526E51.7Low49.2Very low147 Ų147124.2 Ų124.269%0.68765%0.648SS**Hα-helixtrans-72.5-45.1173.5-76.8-130.9126.200112.4E522 A523 K528 K529 V530E522-E526 PolarHBondContact O-N 3Å; E522-E526 VanDerWaalsContact O-N 3.12Å; A523-E526 PolarHBondContact O-N 3Å; E526-K528 VanDerWaalsContact C-N 3.34Å; E526-K528 PolarHBondContact O-N 3.41Å; E526-K529 PolarHBondContact O-N 3.05Å; E526-V530 PolarHBondContact O-N 3.24Å
527E50Low49.5Very low152 Ų152124.1 Ų124.171%0.7165%0.648SS**Hα-helixtrans-61.4-40.1178.6-83.6-160.3142.100112.4A523 K529 V530 E531A523-E527 PolarHBondContact O-N 2.89Å; E527-K529 VanDerWaalsContact C-N 3.26Å; E527-K529 PolarHBondContact O-N 3.42Å; E527-V530 PolarHBondContact O-N 3.25Å; E527-V530 VanDerWaalsContact O-N 3.15Å; E527-E531 PolarHBondContact O-N 3.41Å
528K51.2Low49.8Very low141 Ų141126.4 Ų126.461%0.61366%0.664SS**Hα-helixtrans-66.9-21.9175.6-82.8172.3-177.5125.30114E524 E526E524-K528 IonicContact OE1-NZ 3.24Å; E524-K528 PolarHBondContact OE1-NZ 3.47Å; E526-K528 VanDerWaalsContact C-N 3.34Å; E526-K528 PolarHBondContact O-N 3.41Å
529K49.8Very low50.2Low143 Ų143123.7 Ų123.762%0.62267%0.667SS**Hα-helixtrans-80.2-27.1172.2-90.1170.2-175.9142.10113.2E525 E526 E527E525-K529 PolarHBondContact O-N 3.38Å; E525-K529 IonicContact OE2-NZ 2.81Å; E526-K529 PolarHBondContact O-N 3.05Å; E527-K529 VanDerWaalsContact C-N 3.26Å; E527-K529 PolarHBondContact O-N 3.42Å
530V53Low50.6Low111 Ų111124.9 Ų124.967%0.67367%0.67SS**Hα-helixtrans-79.2-42.4179.6177.90000111.6E526 E527 A533E526-V530 PolarHBondContact O-N 3.24Å; E527-V530 PolarHBondContact O-N 3.25Å; E527-V530 VanDerWaalsContact O-N 3.15Å; V530-A533 PolarHBondContact O-N 3.48Å
531E50.3Low50.9Low167 Ų167129.7 Ų129.778%0.7868%0.682SS**Hα-helixtrans-68.1-37177.5-66.7-153.9133.600112.8E527 A533 G534E527-E531 PolarHBondContact O-N 3.41Å; E531-A533 PolarHBondContact O-N 3.12Å; E531-G534 PolarHBondContact O-N 3.34Å; E531-G534 VanDerWaalsContact O-N 3.14Å
532G51.2Low51.1Low62 Ų62132.5 Ų132.564%0.63969%0.694SS**THydrogen-bonded Turntrans-63.7-20.3177.800000115
533A51Low51Low61 Ų61136.8 Ų136.850%0.50472%0.722SS.*THydrogen-bonded Turntrans-90.2-11.6177.800000113.8V530 E531V530-A533 PolarHBondContact O-N 3.48Å; E531-A533 PolarHBondContact O-N 3.12Å
534G51.6Low51.1Low51 Ų51140.5 Ų140.553%0.52673%0.733SS.*THydrogen-bonded Turntrans-76-37.6-175.900000114.5E531E531-G534 PolarHBondContact O-N 3.34Å; E531-G534 VanDerWaalsContact O-N 3.14Å
535E50.3Low51.3Low173 Ų173141.7 Ų141.781%0.80874%0.743SS**Hα-helixtrans-81.1-26.9-173.6-70.5-160.2124.300114.3Q537E535-Q537 VanDerWaalsContact C-N 3.34Å; E535-Q537 PolarHBondContact O-N 2.57Å
536E51.2Low51.3Low173 Ų173142.2 Ų142.281%0.80875%0.749SS**Hα-helixtrans-77.5-15.4-176.4-147.6-177.3173.300113.9
537Q53Low51.3Low165 Ų165141.9 Ų141.977%0.77175%0.753SS**Hα-helixtrans-94.1-15.8176.4-64-162.427.500114.6E535E535-Q537 VanDerWaalsContact C-N 3.34Å; E535-Q537 PolarHBondContact O-N 2.57Å
538A50.3Low51.4Low84 Ų84141.3 Ų141.369%0.69476%0.756SS**Hα-helixtrans-75.4-24.4178.400000113.4K540A538-K540 PolarHBondContact O-N 3.19Å
539A53.6Low51.4Low93 Ų93141.3 Ų141.377%0.76977%0.765SS**THydrogen-bonded Turntrans-86.13.5-173.600000115.5
540K54.8Low51.5Low190 Ų190141.2 Ų141.283%0.82678%0.776SS**THydrogen-bonded Turntrans-125.818.1-171.2-132.9171.2-169.6167.50116.3A538A538-K540 PolarHBondContact O-N 3.19Å
541K51.8Low51.4Low196 Ų196143.5 Ų143.585%0.85278%0.783SS**SBendtrans-136.264.1171.1-91.4-176.4175171.70111.9
542K51.4Low51.5Low205 Ų205141.6 Ų141.689%0.89178%0.784SS**  trans-16168.3161.8-115.7174.6-173.8177.10111.6
543D47.8Very low51.5Low246 Ų246148.8 Ų148.8100%1.31680%0.797SS**  trans-142.90152.2-91.1-36.5000106.9

Retrieved 543 of 543 residues in 1014.9 ms (Link to these results)