A0A087YC59_POEFO Loading...

Basic helix-loop-helix family, member e41

AlphaFold DB , UniProt , Accession A0A087YC59, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 421 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.8Very low40.3Very low235 Ų235184.8 Ų184.8100%1.15889%0.887SS**  0113.50-84.8171.4147.300106.3
2D35.1Very low39.9Very low170 Ų170185.7 Ų185.791%0.90989%0.889SS**  trans-159.697.5169.1-92.6-59.8000106.8
3E44.2Very low39.5Very low204 Ų204185.6 Ų185.695%0.95388%0.883SS**  trans-105.3129.3173.9-72.6-160.9108.300110.1
4R46Very low39.8Very low245 Ų245184.4 Ų184.493%0.92588%0.879SS**  trans-117.4127.4173.5-176.9177.2-72.5-170.6-2.2109.5
5I46.5Very low39.6Very low158 Ų158183.5 Ų183.581%0.8187%0.874SS**PPolyproline II helixtrans-62.4142.9-171.9-61.8164.9000112
6P50.1Low39.5Very low121 Ų121184.4 Ų184.479%0.78688%0.876SS**PPolyproline II helixtrans-84.9157.5-176.634-36.8000114.8
7H32.2Very low39.8Very low181 Ų181178 Ų17884%0.83886%0.862SS**PPolyproline II helixtrans-95.5116.1175.1-178-60.5000110.2
8L39.1Very low40.2Very low169 Ų169177.2 Ų177.289%0.88586%0.862SS**PPolyproline II helixtrans-76.6151.1176.8-99.4164.8000112.1
9Q38.7Very low40.5Very low184 Ų184178.3 Ų178.386%0.8686%0.863SS**  trans-117.6142.2-165.4-152.9162.328.800112
10D36.5Very low40.9Very low158 Ų158177.2 Ų177.285%0.84586%0.86SS**  trans-67.7119.8-177.1176.824.4000112.8
11R34.6Very low41.4Very low208 Ų208172.3 Ų172.379%0.78586%0.856SS**  trans-170.9106.4156.6-154170.7179.5170.7-1.7113.6
12Q34.6Very low41.6Very low195 Ų195167.8 Ų167.891%0.91183%0.834SS**  trans-132.9113.1147.8-75.5-160.5-39.800109.9
13F35.2Very low42.1Very low185 Ų185167.6 Ų167.681%0.81183%0.833SS**  trans-84.4149.6180-125.2-108.2000110.3
14M42.9Very low42.3Very low169 Ų169166 Ų16683%0.83382%0.823SS**  trans-62.3166.7174.7-173.1171.76800112.2
15E37Very low42.8Very low171 Ų171159.4 Ų159.480%0.79981%0.812SS**  trans101.5100162.8-159.7169.3-16700117
16H39.1Very low43.4Very low197 Ų197157.6 Ų157.691%0.91281%0.811SS**  trans-156.4120.5131-101.1-63.9000109
17A43.3Very low43.8Very low76 Ų76158.9 Ų158.963%0.62881%0.81SS**  trans-87.2147.4-176.100000112.7F19A17-F19 PolarHBondContact O-N 2.74Å
18D48.1Very low44.7Very low164 Ų164160.2 Ų160.288%0.87781%0.809SS**  trans42.376.7134.8-51.2-26.7000117.8
19F45.2Very low45.2Very low197 Ų197159.1 Ų159.186%0.86480%0.801SS**  trans-136.378.2158.6-160.2-92.4000111.4A17A17-F19 PolarHBondContact O-N 2.74Å
20L49.1Very low45.4Very low156 Ų156154.5 Ų154.582%0.81779%0.788SS**SBendtrans171.397.2149.7-94.2165.4000108M22L20-M22 PolarHBondContact O-N 2.73Å
21G50.6Low45.8Very low75 Ų75154.7 Ų154.777%0.77378%0.782SS**  trans-66.194.3-17700000113
22M46.4Very low46.7Very low141 Ų141150 Ų15070%0.69578%0.781SS**  trans-123.491.8169.2-70.3-87.789.100108.5L20 F24L20-M22 PolarHBondContact O-N 2.73Å; M22-F24 VanDerWaalsContact C-N 3.33Å; M22-F24 HydrophobicContact CB-CD2 3.98Å; M22-F24 HydrophobicContact CB-CE2 3.89Å; M22-F24 PolarHBondContact O-N 2.79Å
23D44.6Very low47.8Very low166 Ų166150.3 Ų150.389%0.88878%0.779SS**  trans-64.987.4174.1-73.4-70.6000111.2P25D23-P25 WeakPolarHBondContact O-CD 3.28Å
24F48Very low48.7Very low169 Ų169152.7 Ų152.774%0.74178%0.783SS**  trans-88116.1167.2-81.7-83000109.7M22 P26M22-F24 VanDerWaalsContact C-N 3.33Å; M22-F24 HydrophobicContact CB-CD2 3.98Å; M22-F24 HydrophobicContact CB-CE2 3.89Å; M22-F24 PolarHBondContact O-N 2.79Å; F24-P26 WeakPolarHBondContact O-CD 3.31Å
25P56.7Low49.3Very low107 Ų107148.3 Ų148.370%0.69578%0.781SS**  trans-66.3116.8179.8-19.832.3000111.4D23 L27D23-P25 WeakPolarHBondContact O-CD 3.28Å; P25-L27 PolarHBondContact O-N 3.14Å
26P59.5Low50.2Low120 Ų120147.2 Ų147.278%0.77978%0.779SS**  trans-83.649.9179.635.8-34.2000110.8F24F24-P26 WeakPolarHBondContact O-CD 3.31Å
27L57.6Low50.9Low148 Ų148147.7 Ų147.778%0.77578%0.778SS**  trans-111.257-171.4-68.3-178.2000113.2P25P25-L27 PolarHBondContact O-N 3.14Å
28Y52.1Low51.1Low210 Ų210154.1 Ų154.182%0.82479%0.786SS**  trans-157.272.1138.3-133.1-98000113C30Y28-C30 VanDerWaalsContact C-N 3.31Å; Y28-C30 HydrophobicContact CD1-CB 4.24Å; Y28-C30 PolarHBondContact O-N 3.38Å
29M49.8Very low51.3Low146 Ų146154.8 Ų154.872%0.71978%0.784SS**  trans-62.598.5154.1-83.4-145.390.300108.4K31M29-K31 PolarHBondContact O-N 3.25Å
30C41.8Very low51.8Low87 Ų87148.6 Ų148.659%0.58876%0.76SS**  trans-69.483.4171-166.60000109.8Y28 S32Y28-C30 VanDerWaalsContact C-N 3.31Å; Y28-C30 HydrophobicContact CD1-CB 4.24Å; Y28-C30 PolarHBondContact O-N 3.38Å; C30-S32 PolarHBondContact O-N 3.09Å
31K44.9Very low52Low162 Ų162144.4 Ų144.470%0.70474%0.744SS**  trans-69.883.8168.6-66.6-77.4-176.5175.80107.8M29 K33M29-K31 PolarHBondContact O-N 3.25Å; K31-K33 PolarHBondContact O-N 3.21Å
32S53.5Low52.3Low109 Ų109144.2 Ų144.276%0.76274%0.742SS**  trans-66.668.2174.3-67.30000112C30C30-S32 PolarHBondContact O-N 3.09Å
33K58.2Low52.9Low202 Ų202143.4 Ų143.488%0.87874%0.735SS**  trans-109.267.3175.2-159.5-174.9-176.5-175.90110.8K31K31-K33 PolarHBondContact O-N 3.21Å
34R55.3Low53.6Low234 Ų234138.9 Ų138.988%0.88371%0.711SS**SBendtrans-139111.5155.6-168.6168.4-69.4178.9-0.7108I36R34-I36 PolarHBondContact O-N 2.83Å
35G54.9Low54.2Low78 Ų78133.9 Ų133.980%0.80470%0.701SS**  trans-68.9116.5-171.400000112.1K37G35-K37 PolarHBondContact O-N 3.26Å; G35-K37 VanDerWaalsContact O-N 3.12Å
36I56.2Low54.7Low147 Ų147137.4 Ų137.475%0.75470%0.701SS**  trans-81.474.3161.3-164.176.5000108.3R34 R38R34-I36 PolarHBondContact O-N 2.83Å; I36-R38 PolarHBondContact O-N 3.29Å
37K53.2Low55.2Low207 Ų207136.8 Ų136.890%0.969%0.686SS**  trans-75.575.9169.5-169.1-175.3177.8-177.50109.2G35G35-K37 PolarHBondContact O-N 3.26Å; G35-K37 VanDerWaalsContact O-N 3.12Å
38R47Very low56.2Low211 Ų211135 Ų13580%0.79668%0.677SS**  trans-128.1113.6153.6-72.3-157.1-174.9-147.15.3108.7I36 D40I36-R38 PolarHBondContact O-N 3.29Å; R38-D40 PolarHBondContact O-N 3.45Å; R38-D40 VanDerWaalsContact O-N 3.09Å
39E53.8Low57.9Low178 Ų178128 Ų12883%0.83266%0.657SS**THydrogen-bonded Turntrans-79.288.2-176.5-175.8-97.5128.300109.4
40D54.3Low60Low67 Ų67126.6 Ų126.636%0.35865%0.648SS.*THydrogen-bonded Turntrans-153.9-2.5151.3-160.1-137.8000112.1R38 G42 K43R38-D40 PolarHBondContact O-N 3.45Å; R38-D40 VanDerWaalsContact O-N 3.09Å; D40-G42 PolarHBondContact O-N 3.49Å; D40-K43 PolarHBondContact O-N 2.8Å; D40-K43 VanDerWaalsContact O-N 3.12Å; D40-K43 WeakPolarHBondContact OD2-CD 3.37Å; D40-K43 IonicContact OD2-NZ 2.59Å; D40-K43 PolarHBondContact OD2-NZ 3.39Å
41S53.6Low62.4Low68 Ų68131.1 Ų131.148%0.47665%0.653SS.*Hα-helixtrans-62.4-16.6-172.3-550000115.6K43 D44 A45S41-K43 VanDerWaalsContact C-N 3.28Å; S41-K43 PolarHBondContact O-N 3.25Å; S41-D44 PolarHBondContact O-N 2.98Å; S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.49Å
42G57.1Low64.8Low71 Ų71129.1 Ų129.173%0.73265%0.65SS**Hα-helixtrans-64.5-32.2174.900000113.1D40D40-G42 PolarHBondContact O-N 3.49Å
43K59.1Low66.8Low125 Ų125129.6 Ų129.654%0.54364%0.642SS.*Hα-helixtrans-84.2-38.9177.8-56.7174.6-158.8131.70110.7D40 S41 Y46 K47D40-K43 PolarHBondContact O-N 2.8Å; D40-K43 VanDerWaalsContact O-N 3.12Å; D40-K43 WeakPolarHBondContact OD2-CD 3.37Å; D40-K43 IonicContact OD2-NZ 2.59Å; D40-K43 PolarHBondContact OD2-NZ 3.39Å; S41-K43 VanDerWaalsContact C-N 3.28Å; S41-K43 PolarHBondContact O-N 3.25Å; K43-Y46 PolarHBondContact O-N 3.31Å; K43-K47 WeakPolarHBondContact O-CG 3.49Å; K43-K47 PolarHBondContact O-N 3.05Å
44D58.4Low68.6Low71 Ų71122.2 Ų122.238%0.3861%0.611SS.*Hα-helixtrans-73.3-29.3178.7-76.6-24.6000113.8S41 Y46 K47 L48S41-D44 PolarHBondContact O-N 2.98Å; D44-Y46 PolarHBondContact O-N 3.2Å; D44-K47 PolarHBondContact O-N 3.47Å; D44-K47 VanDerWaalsContact O-N 3.14Å; D44-K47 WeakPolarHBondContact OD1-CD 3.44Å; D44-L48 WeakPolarHBondContact O-CG 3.46Å; D44-L48 PolarHBondContact O-N 2.81Å
45A61.3Low70.6Confident64 Ų64116.5 Ų116.553%0.52959%0.592SS.*Hα-helixtrans-61.5-27.3174.700000113.2S41 P49S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.49Å; A45-P49 WeakPolarHBondContact O-CD 3.31Å; A45-P49 WeakPolarHBondContact O-CG 3.38Å
46Y66.3Low72.6Confident180 Ų180120.6 Ų120.671%0.70659%0.588SS**Hα-helixtrans-88.4-33.6171.8-170.3-101.2000112.4K43 D44 L48 P49 H50K43-Y46 PolarHBondContact O-N 3.31Å; D44-Y46 PolarHBondContact O-N 3.2Å; Y46-L48 VanDerWaalsContact C-N 3.34Å; Y46-L48 PolarHBondContact O-N 3.27Å; Y46-P49 WeakPolarHBondContact O-CD 3.44Å; Y46-H50 PolarHBondContact O-N 3.38Å; Y46-H50 VanDerWaalsContact O-N 3.17Å
47K72Confident74.6Confident107 Ų107120.2 Ų120.247%0.46558%0.577SS.*Hα-helixtrans-67.2-30.4176.2-68.9168.9-179.1-174.30113.1K43 D44 H50 R51K43-K47 WeakPolarHBondContact O-CG 3.49Å; K43-K47 PolarHBondContact O-N 3.05Å; D44-K47 PolarHBondContact O-N 3.47Å; D44-K47 VanDerWaalsContact O-N 3.14Å; D44-K47 WeakPolarHBondContact OD1-CD 3.44Å; K47-H50 PolarHBondContact O-N 2.93Å; K47-R51 WeakPolarHBondContact O-CB 3.48Å; K47-R51 VanDerWaalsContact O-CG 3.23Å; K47-R51 WeakPolarHBondContact O-CG 3.5Å; K47-R51 PolarHBondContact O-N 2.94Å
48L77.1Confident76.7Confident111 Ų111116.1 Ų116.158%0.58156%0.556SS**Hα-helixtrans-64.5-52.7177.4-77167.3000112.4D44 Y46 H50 R51 L52D44-L48 WeakPolarHBondContact O-CG 3.46Å; D44-L48 PolarHBondContact O-N 2.81Å; Y46-L48 VanDerWaalsContact C-N 3.34Å; Y46-L48 PolarHBondContact O-N 3.27Å; L48-H50 VanDerWaalsContact C-N 3.34Å; L48-H50 PolarHBondContact O-N 3.41Å; L48-R51 PolarHBondContact O-N 2.99Å; L48-L52 PolarHBondContact O-N 3.37Å
49P88.5Confident79.1Confident63 Ų63109.9 Ų109.941%0.40954%0.538SS..Hα-helixtrans-53.9-45.9167.7-27.834.3000113.2A45 Y46 R51 L52 I53A45-P49 WeakPolarHBondContact O-CD 3.31Å; A45-P49 WeakPolarHBondContact O-CG 3.38Å; Y46-P49 WeakPolarHBondContact O-CD 3.44Å; P49-R51 PolarHBondContact O-N 3.42Å; P49-L52 PolarHBondContact O-N 2.94Å; P49-L52 VanDerWaalsContact O-N 3.12Å; P49-I53 VanDerWaalsContact O-CG1 3.3Å; P49-I53 WeakPolarHBondContact O-CG1 3.4Å; P49-I53 PolarHBondContact O-N 3.38Å
50H93.8Very high81.3Confident116 Ų116109.7 Ų109.754%0.53753%0.53SS..Hα-helixtrans-61.2-44.1180-172.476.5000112.3Y46 K47 L48 L52 I53 E54Y46-H50 PolarHBondContact O-N 3.38Å; Y46-H50 VanDerWaalsContact O-N 3.17Å; K47-H50 PolarHBondContact O-N 2.93Å; L48-H50 VanDerWaalsContact C-N 3.34Å; L48-H50 PolarHBondContact O-N 3.41Å; H50-L52 VanDerWaalsContact C-N 3.3Å; H50-L52 PolarHBondContact O-N 3.46Å; H50-I53 PolarHBondContact O-N 3.23Å; H50-E54 WeakPolarHBondContact O-CB 3.25Å; H50-E54 PolarHBondContact O-N 3.38Å
51R92.1Very high83.3Confident183 Ų183109.7 Ų109.769%0.69153%0.53SS*.Hα-helixtrans-62.1-34.9174.3-73.8174.495179.27.2112.3K47 L48 P49 K55K47-R51 WeakPolarHBondContact O-CB 3.48Å; K47-R51 VanDerWaalsContact O-CG 3.23Å; K47-R51 WeakPolarHBondContact O-CG 3.5Å; K47-R51 PolarHBondContact O-N 2.94Å; L48-R51 PolarHBondContact O-N 2.99Å; P49-R51 PolarHBondContact O-N 3.42Å; R51-K55 VanDerWaalsContact O-CB 3.25Å; R51-K55 WeakPolarHBondContact O-CB 3.48Å; R51-K55 PolarHBondContact O-N 3.44Å
52L94.9Very high85.4Confident120 Ų120109.7 Ų109.763%0.62852%0.524SS*.Hα-helixtrans-73.8-42.7178.2-173.263.8000112.2L48 P49 H50 K55 K56L48-L52 PolarHBondContact O-N 3.37Å; P49-L52 PolarHBondContact O-N 2.94Å; P49-L52 VanDerWaalsContact O-N 3.12Å; H50-L52 VanDerWaalsContact C-N 3.3Å; H50-L52 PolarHBondContact O-N 3.46Å; L52-K55 PolarHBondContact O-N 3.16Å; L52-K56 PolarHBondContact O-N 2.86Å
53I95.1Very high87.4Confident118 Ų118112 Ų11261%0.60552%0.516SS*.Hα-helixtrans-61.5-48.8175.3-67.9163.3000110.2P49 H50 K55 K56 R57P49-I53 VanDerWaalsContact O-CG1 3.3Å; P49-I53 WeakPolarHBondContact O-CG1 3.4Å; P49-I53 PolarHBondContact O-N 3.38Å; H50-I53 PolarHBondContact O-N 3.23Å; I53-K55 VanDerWaalsContact C-N 3.34Å; I53-K55 PolarHBondContact O-N 3.26Å; I53-K56 PolarHBondContact O-N 2.97Å; I53-R57 PolarHBondContact O-N 3.43Å
54E96.9Very high89.3Confident47 Ų47108.5 Ų108.522%0.2251%0.507CS..Hα-helixtrans-68.6-31.3178.6167.852.9-161.500112.1H50 R57 R58H50-E54 WeakPolarHBondContact O-CB 3.25Å; H50-E54 PolarHBondContact O-N 3.38Å; E54-R57 PolarHBondContact O-N 3.4Å; E54-R57 IonicContact OE1-NH1 2.75Å; E54-R57 PolarHBondContact OE1-NH1 2.89Å; E54-R57 WeakPolarHBondContact OE2-CD 3.38Å; E54-R57 IonicContact OE2-CZ 2.81Å; E54-R57 IonicContact OE2-NE 3.23Å; E54-R57 IonicContact OE2-NH1 3.95Å; E54-R57 PolarHBondContact OE2-NH1 3Å; E54-R58 WeakPolarHBondContact O-CG 3.13Å; E54-R58 PolarHBondContact O-N 3.4Å; E54-R58 WeakPolarHBondContact OE1-CD 3.34Å; E54-R58 WeakPolarHBondContact OE1-CG 3.31Å; E54-R58 IonicContact OE1-CZ 3.16Å; E54-R58 IonicContact OE1-NE 3.12Å; E54-R58 IonicContact OE1-NH1 2.78Å; E54-R58 PolarHBondContact OE1-NH1 2.94Å
55K96.4Very high91.1Very high114 Ų114106.5 Ų106.550%0.49650%0.495SS..Hα-helixtrans-60-53.6167.3-177.2-175.1173-1730110.5R51 L52 I53 R57 R58 D59R51-K55 VanDerWaalsContact O-CB 3.25Å; R51-K55 WeakPolarHBondContact O-CB 3.48Å; R51-K55 PolarHBondContact O-N 3.44Å; L52-K55 PolarHBondContact O-N 3.16Å; I53-K55 VanDerWaalsContact C-N 3.34Å; I53-K55 PolarHBondContact O-N 3.26Å; K55-R57 VanDerWaalsContact C-N 3.25Å; K55-R57 PolarHBondContact O-N 2.84Å; K55-R58 PolarHBondContact O-N 3.44Å; K55-D59 WeakPolarHBondContact CE-OD2 3.49Å; K55-D59 WeakPolarHBondContact CG-OD2 3.49Å; K55-D59 PolarHBondContact O-N 2.84Å
56K97.1Very high92.7Very high164 Ų164104.8 Ų104.871%0.71348%0.484SS*.Hα-helixtrans-57.4-37.6179-173.4178.1-179.9-179.90112.3L52 I53 R60L52-K56 PolarHBondContact O-N 2.86Å; I53-K56 PolarHBondContact O-N 2.97Å; K56-R60 PolarHBondContact O-N 3.19Å; K56-R60 VanDerWaalsContact O-N 3.11Å
57R98.2Very high94.2Very high140 Ų140101.1 Ų101.153%0.52847%0.474SS..Hα-helixtrans-62-48.2173.3175.3177.3160.2-82.1-6.8111.8I53 E54 K55 R60 I61I53-R57 PolarHBondContact O-N 3.43Å; E54-R57 PolarHBondContact O-N 3.4Å; E54-R57 IonicContact OE1-NH1 2.75Å; E54-R57 PolarHBondContact OE1-NH1 2.89Å; E54-R57 WeakPolarHBondContact OE2-CD 3.38Å; E54-R57 IonicContact OE2-CZ 2.81Å; E54-R57 IonicContact OE2-NE 3.23Å; E54-R57 IonicContact OE2-NH1 3.95Å; E54-R57 PolarHBondContact OE2-NH1 3Å; K55-R57 VanDerWaalsContact C-N 3.25Å; K55-R57 PolarHBondContact O-N 2.84Å; R57-R60 PolarHBondContact O-N 3.18Å; R57-I61 HydrophobicContact CG-CD1 4Å; R57-I61 WeakPolarHBondContact O-CG1 3.31Å; R57-I61 PolarHBondContact O-N 3.16Å
58R98.3Very high95.3Very high121 Ų12198.8 Ų98.846%0.45747%0.466SS..Hα-helixtrans-64.9-39.7177.5-73.5-170.2-62.1-107.31.2112.8E54 K55 R60 I61 N62E54-R58 WeakPolarHBondContact O-CG 3.13Å; E54-R58 PolarHBondContact O-N 3.4Å; E54-R58 WeakPolarHBondContact OE1-CD 3.34Å; E54-R58 WeakPolarHBondContact OE1-CG 3.31Å; E54-R58 IonicContact OE1-CZ 3.16Å; E54-R58 IonicContact OE1-NE 3.12Å; E54-R58 IonicContact OE1-NH1 2.78Å; E54-R58 PolarHBondContact OE1-NH1 2.94Å; K55-R58 PolarHBondContact O-N 3.44Å; R58-R60 VanDerWaalsContact C-N 3.35Å; R58-R60 PolarHBondContact O-N 3.05Å; R58-I61 PolarHBondContact O-N 2.91Å; R58-N62 PolarHBondContact O-N 2.94Å; R58-N62 PolarHBondContact O-ND2 3.49Å; R58-N62 VanDerWaalsContact O-ND2 3.14Å
59D97.8Very high96.1Very high79 Ų7996.6 Ų96.642%0.42245%0.452SS..Hα-helixtrans-60.6-46.3178.4-63.4-17.9000110K55 I61 N62 E63K55-D59 WeakPolarHBondContact CE-OD2 3.49Å; K55-D59 WeakPolarHBondContact CG-OD2 3.49Å; K55-D59 PolarHBondContact O-N 2.84Å; D59-I61 PolarHBondContact O-N 3.31Å; D59-N62 PolarHBondContact O-N 3.14Å; D59-E63 PolarHBondContact O-N 3.05Å
60R98.4Very high96.4Very high174 Ų17499 Ų9966%0.65746%0.461SS*.Hα-helixtrans-61-40.3172.4-179177.6174.6-108.1-1.3113.6K56 R57 R58 N62 E63 C64K56-R60 PolarHBondContact O-N 3.19Å; K56-R60 VanDerWaalsContact O-N 3.11Å; R57-R60 PolarHBondContact O-N 3.18Å; R58-R60 VanDerWaalsContact C-N 3.35Å; R58-R60 PolarHBondContact O-N 3.05Å; R60-N62 VanDerWaalsContact C-N 3.34Å; R60-E63 PolarHBondContact O-N 3.3Å; R60-C64 PolarHBondContact O-N 2.79Å; R60-C64 PolarHBondContact O-SG 3.49Å; R60-C64 VanDerWaalsContact O-SG 3.36Å
61I97.9Very high96.4Very high68 Ų6899.9 Ų99.935%0.34947%0.469SS..Hα-helixtrans-64.1-41.9176.5-70.7166000110.6R57 R58 D59 E63 C64 I65R57-I61 HydrophobicContact CG-CD1 4Å; R57-I61 WeakPolarHBondContact O-CG1 3.31Å; R57-I61 PolarHBondContact O-N 3.16Å; R58-I61 PolarHBondContact O-N 2.91Å; D59-I61 PolarHBondContact O-N 3.31Å; I61-E63 VanDerWaalsContact C-N 3.35Å; I61-C64 PolarHBondContact O-N 3.33Å; I61-I65 HydrophobicContact CG2-CD1 3.84Å; I61-I65 VanDerWaalsContact O-CG1 3.31Å; I61-I65 WeakPolarHBondContact O-CG1 3.43Å; I61-I65 PolarHBondContact O-N 2.79Å
62N97.7Very high96.5Very high67 Ų6791.4 Ų91.436%0.35844%0.438SS..Hα-helixtrans-65.7-38.1177.8-64.9-32000111.9R58 D59 R60 I65 G66 K86R58-N62 PolarHBondContact O-N 2.94Å; R58-N62 PolarHBondContact O-ND2 3.49Å; R58-N62 VanDerWaalsContact O-ND2 3.14Å; D59-N62 PolarHBondContact O-N 3.14Å; R60-N62 VanDerWaalsContact C-N 3.34Å; N62-I65 PolarHBondContact O-N 3.39Å; N62-G66 PolarHBondContact O-N 2.92Å; N62-K86 PolarHBondContact OD1-NZ 3.08Å
63E98.1Very high96.4Very high121 Ų12187 Ų8757%0.56542%0.416SS*.Hα-helixtrans-60.2-49.4173.4-179.4176.5-145.600111.6D59 R60 I61 I65 G66 Q67D59-E63 PolarHBondContact O-N 3.05Å; R60-E63 PolarHBondContact O-N 3.3Å; I61-E63 VanDerWaalsContact C-N 3.35Å; E63-I65 VanDerWaalsContact C-N 3.33Å; E63-I65 PolarHBondContact O-N 3.48Å; E63-G66 WeakPolarHBondContact O-CA 3.15Å; E63-G66 PolarHBondContact O-N 3.45Å; E63-G66 VanDerWaalsContact O-N 3.09Å; E63-Q67 WeakPolarHBondContact O-CG 3.4Å; E63-Q67 PolarHBondContact O-N 3.14Å
64C98.1Very high96.2Very high51 Ų5186.9 Ų86.935%0.34541%0.413SS..Hα-helixtrans-62.4-37.1175.9-640000112.8R60 I61 G66 Q67 L68R60-C64 PolarHBondContact O-N 2.79Å; R60-C64 PolarHBondContact O-SG 3.49Å; R60-C64 VanDerWaalsContact O-SG 3.36Å; I61-C64 PolarHBondContact O-N 3.33Å; C64-G66 VanDerWaalsContact C-N 3.32Å; C64-Q67 PolarHBondContact O-N 2.99Å; C64-L68 WeakPolarHBondContact O-CG 3.38Å; C64-L68 PolarHBondContact O-N 3.3Å
65I96.8Very high95.7Very high28 Ų2891.1 Ų91.114%0.14443%0.432CS..Hα-helixtrans-67.3-34.4174.3-66.5167.1000111.1I61 N62 E63 L68 K69 K86 V89I61-I65 HydrophobicContact CG2-CD1 3.84Å; I61-I65 VanDerWaalsContact O-CG1 3.31Å; I61-I65 WeakPolarHBondContact O-CG1 3.43Å; I61-I65 PolarHBondContact O-N 2.79Å; N62-I65 PolarHBondContact O-N 3.39Å; E63-I65 VanDerWaalsContact C-N 3.33Å; E63-I65 PolarHBondContact O-N 3.48Å; I65-L68 PolarHBondContact O-N 2.89Å; I65-K69 PolarHBondContact O-N 3.41Å; I65-K86 HydrophobicContact CD1-CD 4.16Å; I65-K86 HydrophobicContact CG2-CB 4.47Å; I65-K86 HydrophobicContact CG2-CG 4.26Å; I65-V89 HydrophobicContact CG2-CB 4.4Å; I65-V89 HydrophobicContact CG2-CG1 4.25Å
66G95.4Very high95.3Very high29 Ų2987.4 Ų87.430%0.29942%0.418SS..Hα-helixtrans-61.3-49.7170.600000112N62 E63 C64 L68 K69 D70N62-G66 PolarHBondContact O-N 2.92Å; E63-G66 WeakPolarHBondContact O-CA 3.15Å; E63-G66 PolarHBondContact O-N 3.45Å; E63-G66 VanDerWaalsContact O-N 3.09Å; C64-G66 VanDerWaalsContact C-N 3.32Å; G66-L68 VanDerWaalsContact C-N 3.33Å; G66-L68 PolarHBondContact O-N 3.45Å; G66-K69 WeakPolarHBondContact O-CA 3.47Å; G66-K69 VanDerWaalsContact O-CB 3.31Å; G66-K69 WeakPolarHBondContact O-CB 3.25Å; G66-K69 PolarHBondContact O-N 2.86Å; G66-D70 PolarHBondContact O-N 3.13Å
67Q96.7Very high94.8Very high103 Ų10380.9 Ų80.948%0.48139%0.39SS..Hα-helixtrans-58.5-42.5176.2-68.6169.9-1200112.3E63 C64 K69 D70 L71E63-Q67 WeakPolarHBondContact O-CG 3.4Å; E63-Q67 PolarHBondContact O-N 3.14Å; C64-Q67 PolarHBondContact O-N 2.99Å; Q67-K69 VanDerWaalsContact C-N 3.35Å; Q67-K69 PolarHBondContact O-N 3.38Å; Q67-D70 PolarHBondContact O-N 2.88Å; Q67-L71 WeakPolarHBondContact O-CB 3.36Å; Q67-L71 VanDerWaalsContact O-CG 3.3Å; Q67-L71 WeakPolarHBondContact O-CG 3.45Å; Q67-L71 PolarHBondContact O-N 2.75Å
68L96.4Very high94.1Very high57 Ų5780.3 Ų80.330%0.29840%0.396SS..Hα-helixtrans-61.3-42.1173.3-72.1-179.6000112C64 I65 G66 D70 L71 L72 V89 L90 T93C64-L68 WeakPolarHBondContact O-CG 3.38Å; C64-L68 PolarHBondContact O-N 3.3Å; I65-L68 PolarHBondContact O-N 2.89Å; G66-L68 VanDerWaalsContact C-N 3.33Å; G66-L68 PolarHBondContact O-N 3.45Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.01Å; L68-L71 PolarHBondContact O-N 2.98Å; L68-L72 WeakPolarHBondContact O-CG 3.35Å; L68-L72 PolarHBondContact O-N 3.46Å; L68-V89 HydrophobicContact CB-CG1 3.95Å; L68-L90 HydrophobicContact CD1-CD2 4.11Å; L68-T93 HydrophobicContact CD1-CG2 4.49Å; L68-T93 HydrophobicContact CD2-CG2 3.99Å
69K94.3Very high93.2Very high66 Ų6679.2 Ų79.229%0.28741%0.407SS..Hα-helixtrans-58.9-44.1174.9-178.6-178.1174.71760111.2I65 G66 Q67 L72 K77 G82 L84 V89I65-K69 PolarHBondContact O-N 3.41Å; G66-K69 WeakPolarHBondContact O-CA 3.47Å; G66-K69 VanDerWaalsContact O-CB 3.31Å; G66-K69 WeakPolarHBondContact O-CB 3.25Å; G66-K69 PolarHBondContact O-N 2.86Å; Q67-K69 VanDerWaalsContact C-N 3.35Å; Q67-K69 PolarHBondContact O-N 3.38Å; K69-L72 WeakPolarHBondContact O-CB 3.2Å; K69-L72 PolarHBondContact O-N 2.94Å; K69-K77 WeakPolarHBondContact O-CE 3.19Å; K69-G82 PolarHBondContact NZ-O 2.86Å; K69-L84 HydrophobicContact CD-CB 4.19Å; K69-L84 HydrophobicContact CD-CD1 4.28Å; K69-L84 HydrophobicContact CG-CB 4.46Å; K69-L84 HydrophobicContact CG-CD1 3.79Å; K69-V89 HydrophobicContact CB-CG1 4.07Å; K69-V89 HydrophobicContact CB-CG2 3.97Å; K69-V89 HydrophobicContact CD-CG2 4.48Å; K69-V89 HydrophobicContact CG-CG2 4.21Å
70D93.7Very high92.2Very high113 Ų11377.7 Ų77.760%0.60440%0.401SS*.Hα-helixtrans-70.8-35.7-176.3-64.3-27000112.2G66 Q67 L68 L72 K77G66-D70 PolarHBondContact O-N 3.13Å; Q67-D70 PolarHBondContact O-N 2.88Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.01Å; D70-L72 VanDerWaalsContact C-N 3.27Å; D70-L72 PolarHBondContact O-N 2.9Å; D70-K77 PolarHBondContact O-NZ 3.49Å
71L94.9Very high91.1Very high135 Ų13577.6 Ų77.671%0.70741%0.412SS*.Hα-helixtrans-69.4-15.5175-71.7170.6000114.4Q67 L68Q67-L71 WeakPolarHBondContact O-CB 3.36Å; Q67-L71 VanDerWaalsContact O-CG 3.3Å; Q67-L71 WeakPolarHBondContact O-CG 3.45Å; Q67-L71 PolarHBondContact O-N 2.75Å; L68-L71 PolarHBondContact O-N 2.98Å
72L94.3Very high89.8Confident5 Ų576.1 Ų76.13%0.02641%0.414CS..SBendtrans-66141178-76.6171000112L68 K69 D70 L76 K77 L84 V89 L92 H96L68-L72 WeakPolarHBondContact O-CG 3.35Å; L68-L72 PolarHBondContact O-N 3.46Å; K69-L72 WeakPolarHBondContact O-CB 3.2Å; K69-L72 PolarHBondContact O-N 2.94Å; D70-L72 VanDerWaalsContact C-N 3.27Å; D70-L72 PolarHBondContact O-N 2.9Å; L72-L76 HydrophobicContact CD2-CD1 4.4Å; L72-K77 HydrophobicContact CB-CD 4.5Å; L72-K77 HydrophobicContact CB-CG 4.06Å; L72-K77 WeakPolarHBondContact O-CD 3.24Å; L72-K77 WeakPolarHBondContact O-CE 3.21Å; L72-K77 PolarHBondContact O-NZ 3.29Å; L72-L84 HydrophobicContact CD1-CD1 4.11Å; L72-V89 HydrophobicContact CD1-CG1 4.43Å; L72-L92 HydrophobicContact CD1-CB 3.77Å; L72-L92 HydrophobicContact CD1-CD1 4.24Å; L72-L92 HydrophobicContact CD2-CB 3.89Å; L72-H96 HydrophobicContact CD2-CB 4.29Å
73P92.6Very high89.2Confident28 Ų2880 Ų8018%0.18243%0.43CS..  trans-56.2140.5169.1-25.832.8000113.3H75 L76 K77P73-H75 VanDerWaalsContact C-N 3.27Å; P73-H75 WeakPolarHBondContact CB-CE1 3.44Å; P73-H75 PolarHBondContact O-N 3.01Å; P73-L76 HydrophobicContact CB-CG 4.45Å; P73-L76 HydrophobicContact CG-CD1 4.33Å; P73-L76 WeakPolarHBondContact O-CB 3.46Å; P73-L76 PolarHBondContact O-N 3.14Å; P73-K77 PolarHBondContact O-N 3.49Å; P73-K77 VanDerWaalsContact O-N 3.15Å
74E90.1Very high88.7Confident115 Ų11575 Ų7554%0.53741%0.407SS..Hα-helixtrans-56.1-37.3-178.9-65.8-53.2132.700113.5L76 K77 L78E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.16Å; E74-K77 PolarHBondContact O-N 3.38Å; E74-K77 VanDerWaalsContact OE1-CD 3.32Å; E74-K77 WeakPolarHBondContact OE1-CD 3.37Å; E74-K77 IonicContact OE1-NZ 3.71Å; E74-K77 PolarHBondContact OE1-NZ 2.89Å; E74-K77 WeakPolarHBondContact OE2-CD 3.47Å; E74-L78 WeakPolarHBondContact O-CB 3.41Å; E74-L78 VanDerWaalsContact O-CG 3.25Å; E74-L78 WeakPolarHBondContact O-CG 3.37Å; E74-L78 PolarHBondContact O-N 3.48Å
75H87.4Confident88.5Confident135 Ų13578.6 Ų78.663%0.62542%0.419SS*.Hα-helixtrans-63.8-29.417762.5-98.3000113.1P73 S79P73-H75 VanDerWaalsContact C-N 3.27Å; P73-H75 WeakPolarHBondContact CB-CE1 3.44Å; P73-H75 PolarHBondContact O-N 3.01Å; H75-S79 PolarHBondContact O-N 2.79Å
76L86.4Confident88.4Confident36 Ų3682.9 Ų82.919%0.18844%0.436CS..Hα-helixtrans-78-38.9173.2-63-174.9000111.5L72 P73 E74 S79 L92 H96L72-L76 HydrophobicContact CD2-CD1 4.4Å; P73-L76 HydrophobicContact CB-CG 4.45Å; P73-L76 HydrophobicContact CG-CD1 4.33Å; P73-L76 WeakPolarHBondContact O-CB 3.46Å; P73-L76 PolarHBondContact O-N 3.14Å; E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.16Å; L76-S79 WeakPolarHBondContact O-CB 3.49Å; L76-S79 PolarHBondContact O-N 3.43Å; L76-L92 HydrophobicContact CB-CD1 4.26Å; L76-L92 HydrophobicContact CB-CD2 4.28Å; L76-L92 HydrophobicContact CD2-CD2 4.47Å; L76-L92 WeakPolarHBondContact O-CD1 3.38Å; L76-H96 HydrophobicContact CD1-CB 4.03Å
77K86.8Confident88.4Confident28 Ų2884.6 Ų84.612%0.12245%0.448CS..Hα-helixtrans-61.7-43.9175.2-69.4162.2167.2154.70112.3K69 D70 L72 P73 E74 S79 T80 G82 L84K69-K77 WeakPolarHBondContact O-CE 3.19Å; D70-K77 PolarHBondContact O-NZ 3.49Å; L72-K77 HydrophobicContact CB-CD 4.5Å; L72-K77 HydrophobicContact CB-CG 4.06Å; L72-K77 WeakPolarHBondContact O-CD 3.24Å; L72-K77 WeakPolarHBondContact O-CE 3.21Å; L72-K77 PolarHBondContact O-NZ 3.29Å; P73-K77 PolarHBondContact O-N 3.49Å; P73-K77 VanDerWaalsContact O-N 3.15Å; E74-K77 PolarHBondContact O-N 3.38Å; E74-K77 VanDerWaalsContact OE1-CD 3.32Å; E74-K77 WeakPolarHBondContact OE1-CD 3.37Å; E74-K77 IonicContact OE1-NZ 3.71Å; E74-K77 PolarHBondContact OE1-NZ 2.89Å; E74-K77 WeakPolarHBondContact OE2-CD 3.47Å; K77-S79 VanDerWaalsContact C-N 3.34Å; K77-S79 PolarHBondContact O-N 2.91Å; K77-T80 PolarHBondContact O-N 3.06Å; K77-T80 PolarHBondContact O-OG1 2.82Å; K77-G82 PolarHBondContact O-N 3.47Å; K77-L84 HydrophobicContact CB-CD1 4.35Å; K77-L84 HydrophobicContact CG-CD1 3.95Å
78L83.6Confident88.3Confident128 Ų12881.5 Ų81.567%0.6744%0.436SS*.Hα-helixtrans-71.1-26.8-177.2-69.7169.7000113.2E74 T80 L81E74-L78 WeakPolarHBondContact O-CB 3.41Å; E74-L78 VanDerWaalsContact O-CG 3.25Å; E74-L78 WeakPolarHBondContact O-CG 3.37Å; E74-L78 PolarHBondContact O-N 3.48Å; L78-T80 PolarHBondContact O-N 3.32Å; L78-L81 PolarHBondContact O-N 3.26Å
79S80.2Confident88.3Confident97 Ų9778.9 Ų78.968%0.67842%0.422SS*.THydrogen-bonded Turntrans-55.7-23.6175.6-170.10000113.5H75 L76 K77H75-S79 PolarHBondContact O-N 2.79Å; L76-S79 WeakPolarHBondContact O-CB 3.49Å; L76-S79 PolarHBondContact O-N 3.43Å; K77-S79 VanDerWaalsContact C-N 3.34Å; K77-S79 PolarHBondContact O-N 2.91Å
80T76.6Confident88.4Confident48 Ų4880 Ų8029%0.29443%0.431SS..THydrogen-bonded Turntrans-125.739.3-17256.60000113.1K77 L78 G82 L84 V88K77-T80 PolarHBondContact O-N 3.06Å; K77-T80 PolarHBondContact O-OG1 2.82Å; L78-T80 PolarHBondContact O-N 3.32Å; T80-G82 PolarHBondContact O-N 3.39Å; T80-L84 WeakPolarHBondContact OG1-CD2 3.5Å; T80-V88 HydrophobicContact CG2-CG1 3.89Å
81L75.1Confident88.5Confident171 Ų17179.4 Ų79.490%0.89542%0.424SS*.THydrogen-bonded Turntrans59.519.6173.1-155.877.3000114.4L78 H83L78-L81 PolarHBondContact O-N 3.26Å; L81-H83 PolarHBondContact O-N 2.99Å
82G71.7Confident88.5Confident38 Ų3873.5 Ų73.539%0.39239%0.393SS..SBendtrans70.1-23.4179.100000116.3K69 K77 T80 L84K69-G82 PolarHBondContact NZ-O 2.86Å; K77-G82 PolarHBondContact O-N 3.47Å; T80-G82 PolarHBondContact O-N 3.39Å; G82-L84 VanDerWaalsContact C-N 3.29Å; G82-L84 PolarHBondContact O-N 2.98Å
83H84Confident88.6Confident148 Ų14874.2 Ų74.269%0.68540%0.398SS*.  trans-8472.2173.1-163.479.3000111.4L81 E85L81-H83 PolarHBondContact O-N 2.99Å; H83-E85 PolarHBondContact O-N 2.78Å
84L88.5Confident88.9Confident15 Ų1577.7 Ų77.78%0.07941%0.414CS..  trans-66.6110.8174.7-74.1169.6000111.9K69 L72 K77 T80 G82 V88 V89 L92K69-L84 HydrophobicContact CD-CB 4.19Å; K69-L84 HydrophobicContact CD-CD1 4.28Å; K69-L84 HydrophobicContact CG-CB 4.46Å; K69-L84 HydrophobicContact CG-CD1 3.79Å; L72-L84 HydrophobicContact CD1-CD1 4.11Å; K77-L84 HydrophobicContact CB-CD1 4.35Å; K77-L84 HydrophobicContact CG-CD1 3.95Å; T80-L84 WeakPolarHBondContact OG1-CD2 3.5Å; G82-L84 VanDerWaalsContact C-N 3.29Å; G82-L84 PolarHBondContact O-N 2.98Å; L84-V88 HydrophobicContact CD2-CB 4.08Å; L84-V88 HydrophobicContact CD2-CG1 3.46Å; L84-V88 VanDerWaalsContact CD2-CG1 3.46Å; L84-V89 HydrophobicContact CB-CG2 3.68Å; L84-V89 HydrophobicContact CD1-CG2 4.43Å; L84-L92 HydrophobicContact CD2-CD1 3.45Å; L84-L92 VanDerWaalsContact CD2-CD1 3.45Å
85E93.7Very high89.1Confident128 Ų12877.4 Ų77.460%0.59841%0.411SS*.  trans-66.1157.8164.6-60.9-168.7168.900111.3H83 A87 V88 V89H83-E85 PolarHBondContact O-N 2.78Å; E85-A87 VanDerWaalsContact C-N 3.29Å; E85-A87 PolarHBondContact O-N 3.42Å; E85-V88 HydrophobicContact CB-CG2 4.14Å; E85-V88 PolarHBondContact O-N 3.36Å; E85-V89 WeakPolarHBondContact O-CG2 3.47Å; E85-V89 PolarHBondContact O-N 2.94Å
86K94.9Very high89.5Confident117 Ų11773.3 Ų73.351%0.50939%0.393SS..Hα-helixtrans-58.6-37.6-176.1-61.1-172.7-175.5-179.30113.6N62 I65 L90N62-K86 PolarHBondContact OD1-NZ 3.08Å; I65-K86 HydrophobicContact CD1-CD 4.16Å; I65-K86 HydrophobicContact CG2-CB 4.47Å; I65-K86 HydrophobicContact CG2-CG 4.26Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 2.86Å
87A95.3Very high90.1Very high66 Ų6676 Ų7655%0.54541%0.407SS..Hα-helixtrans-65.1-44.3175.900000111.2E85 L90 E91E85-A87 VanDerWaalsContact C-N 3.29Å; E85-A87 PolarHBondContact O-N 3.42Å; A87-L90 PolarHBondContact O-N 2.7Å; A87-E91 PolarHBondContact O-N 2.9Å
88V94.8Very high90.6Very high38 Ų3879.2 Ų79.223%0.2343%0.425CS..Hα-helixtrans-66.2-38.3179.4-172.10000111.6T80 L84 E85 L90 E91 L92T80-V88 HydrophobicContact CG2-CG1 3.89Å; L84-V88 HydrophobicContact CD2-CB 4.08Å; L84-V88 HydrophobicContact CD2-CG1 3.46Å; L84-V88 VanDerWaalsContact CD2-CG1 3.46Å; E85-V88 HydrophobicContact CB-CG2 4.14Å; E85-V88 PolarHBondContact O-N 3.36Å; V88-L90 VanDerWaalsContact C-N 3.34Å; V88-L90 PolarHBondContact O-N 2.79Å; V88-E91 PolarHBondContact O-N 3.13Å; V88-L92 HydrophobicContact CG1-CD1 4.04Å; V88-L92 HydrophobicContact CG1-CG 4.2Å; V88-L92 WeakPolarHBondContact O-CB 3.31Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.38Å; V88-L92 PolarHBondContact O-N 2.91Å
89V95.1Very high91.2Very high2 Ų275.7 Ų75.71%0.01242%0.415CS..Hα-helixtrans-56.1-49.1171.3176.70000110.7I65 L68 K69 L72 L84 E85 T93I65-V89 HydrophobicContact CG2-CB 4.4Å; I65-V89 HydrophobicContact CG2-CG1 4.25Å; L68-V89 HydrophobicContact CB-CG1 3.95Å; K69-V89 HydrophobicContact CB-CG1 4.07Å; K69-V89 HydrophobicContact CB-CG2 3.97Å; K69-V89 HydrophobicContact CD-CG2 4.48Å; K69-V89 HydrophobicContact CG-CG2 4.21Å; L72-V89 HydrophobicContact CD1-CG1 4.43Å; L84-V89 HydrophobicContact CB-CG2 3.68Å; L84-V89 HydrophobicContact CD1-CG2 4.43Å; E85-V89 WeakPolarHBondContact O-CG2 3.47Å; E85-V89 PolarHBondContact O-N 2.94Å; V89-T93 VanDerWaalsContact O-CB 3.32Å; V89-T93 WeakPolarHBondContact O-CB 3.48Å; V89-T93 PolarHBondContact O-N 2.78Å; V89-T93 PolarHBondContact O-OG1 2.98Å
90L96.9Very high92Very high90 Ų9075 Ų7547%0.47140%0.403SS..Hα-helixtrans-66.2-40.9-178.5-66.6171.8000112L68 K86 A87 V88 T93 L94L68-L90 HydrophobicContact CD1-CD2 4.11Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 2.86Å; A87-L90 PolarHBondContact O-N 2.7Å; V88-L90 VanDerWaalsContact C-N 3.34Å; V88-L90 PolarHBondContact O-N 2.79Å; L90-T93 PolarHBondContact O-N 3.28Å; L90-L94 PolarHBondContact O-N 3.46Å
91E95.6Very high93Very high99 Ų9976.9 Ų76.946%0.46341%0.414SS..Hα-helixtrans-65.4-45.4177.7-167.9-166.9146.200112.2A87 V88 T93 L94 K95A87-E91 PolarHBondContact O-N 2.9Å; V88-E91 PolarHBondContact O-N 3.13Å; E91-T93 VanDerWaalsContact C-N 3.31Å; E91-T93 PolarHBondContact O-N 2.59Å; E91-L94 PolarHBondContact O-N 2.98Å; E91-K95 WeakPolarHBondContact O-CG 3.3Å; E91-K95 PolarHBondContact O-N 3.05Å; E91-K95 WeakPolarHBondContact OE1-CE 3.4Å; E91-K95 IonicContact OE1-NZ 3.49Å; E91-K95 PolarHBondContact OE1-NZ 2.74Å
92L95.5Very high94Very high11 Ų1170.9 Ų70.96%0.05839%0.389CS..Hα-helixtrans-66.6-34.6175.4-68179.4000111.9L72 L76 L84 V88 K95 H96L72-L92 HydrophobicContact CD1-CB 3.77Å; L72-L92 HydrophobicContact CD1-CD1 4.24Å; L72-L92 HydrophobicContact CD2-CB 3.89Å; L76-L92 HydrophobicContact CB-CD1 4.26Å; L76-L92 HydrophobicContact CB-CD2 4.28Å; L76-L92 HydrophobicContact CD2-CD2 4.47Å; L76-L92 WeakPolarHBondContact O-CD1 3.38Å; L84-L92 HydrophobicContact CD2-CD1 3.45Å; L84-L92 VanDerWaalsContact CD2-CD1 3.45Å; V88-L92 HydrophobicContact CG1-CD1 4.04Å; V88-L92 HydrophobicContact CG1-CG 4.2Å; V88-L92 WeakPolarHBondContact O-CB 3.31Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.38Å; V88-L92 PolarHBondContact O-N 2.91Å; L92-K95 HydrophobicContact CD2-CD 4.37Å; L92-K95 PolarHBondContact O-N 3.16Å; L92-H96 WeakPolarHBondContact O-CB 3.48Å; L92-H96 PolarHBondContact O-N 3.12Å
93T96.8Very high95.2Very high20 Ų2073.2 Ų73.212%0.12340%0.396CS..Hα-helixtrans-63.1-44.8174.3-59.40000110.1L68 V89 L90 E91 H96 L97L68-T93 HydrophobicContact CD1-CG2 4.49Å; L68-T93 HydrophobicContact CD2-CG2 3.99Å; V89-T93 VanDerWaalsContact O-CB 3.32Å; V89-T93 WeakPolarHBondContact O-CB 3.48Å; V89-T93 PolarHBondContact O-N 2.78Å; V89-T93 PolarHBondContact O-OG1 2.98Å; L90-T93 PolarHBondContact O-N 3.28Å; E91-T93 VanDerWaalsContact C-N 3.31Å; E91-T93 PolarHBondContact O-N 2.59Å; T93-H96 PolarHBondContact O-N 3.41Å; T93-L97 HydrophobicContact CG2-CD1 4.02Å; T93-L97 HydrophobicContact CG2-CG 4.38Å; T93-L97 WeakPolarHBondContact O-CB 3.09Å; T93-L97 VanDerWaalsContact O-CG 3.31Å; T93-L97 WeakPolarHBondContact O-CG 3.49Å; T93-L97 PolarHBondContact O-N 2.96Å
94L97.1Very high95.8Very high101 Ų10170.3 Ų70.353%0.52939%0.388SS..Hα-helixtrans-62.1-44.8175.7-178.662000111.9L90 E91 H96 L97 N98L90-L94 PolarHBondContact O-N 3.46Å; E91-L94 PolarHBondContact O-N 2.98Å; L94-H96 VanDerWaalsContact C-N 3.33Å; L94-H96 PolarHBondContact O-N 2.68Å; L94-L97 PolarHBondContact O-N 3.29Å; L94-N98 WeakPolarHBondContact O-CB 3.32Å; L94-N98 VanDerWaalsContact O-CG 3.26Å; L94-N98 PolarHBondContact O-N 2.96Å
95K95.4Very high96.2Very high109 Ų10974.7 Ų74.747%0.47441%0.408SS..Hα-helixtrans-59.4-42.8175-73.4173.1-178.3171.70111.9E91 L92 A99E91-K95 WeakPolarHBondContact O-CG 3.3Å; E91-K95 PolarHBondContact O-N 3.05Å; E91-K95 WeakPolarHBondContact OE1-CE 3.4Å; E91-K95 IonicContact OE1-NZ 3.49Å; E91-K95 PolarHBondContact OE1-NZ 2.74Å; L92-K95 HydrophobicContact CD2-CD 4.37Å; L92-K95 PolarHBondContact O-N 3.16Å; K95-A99 PolarHBondContact O-N 3.01Å; K95-A99 VanDerWaalsContact O-N 3.09Å
96H96.3Very high96.3Very high50 Ų5074.7 Ų74.723%0.23141%0.409CS..Hα-helixtrans-66.8-45.2177.6-175.640.9000112.3L72 L76 L92 T93 L94 N98 A99 L100L72-H96 HydrophobicContact CD2-CB 4.29Å; L76-H96 HydrophobicContact CD1-CB 4.03Å; L92-H96 WeakPolarHBondContact O-CB 3.48Å; L92-H96 PolarHBondContact O-N 3.12Å; T93-H96 PolarHBondContact O-N 3.41Å; L94-H96 VanDerWaalsContact C-N 3.33Å; L94-H96 PolarHBondContact O-N 2.68Å; H96-N98 PolarHBondContact O-N 3.49Å; H96-A99 PolarHBondContact O-N 2.88Å; H96-L100 WeakPolarHBondContact O-CG 3.27Å; H96-L100 PolarHBondContact O-N 2.88Å
97L97.4Very high96.3Very high92 Ų9274.9 Ų74.948%0.48241%0.411SS..Hα-helixtrans-61-43.7176.4-72.5173.1000111.7T93 L94 A99 L100 T101T93-L97 HydrophobicContact CG2-CD1 4.02Å; T93-L97 HydrophobicContact CG2-CG 4.38Å; T93-L97 WeakPolarHBondContact O-CB 3.09Å; T93-L97 VanDerWaalsContact O-CG 3.31Å; T93-L97 WeakPolarHBondContact O-CG 3.49Å; T93-L97 PolarHBondContact O-N 2.96Å; L94-L97 PolarHBondContact O-N 3.29Å; L97-A99 VanDerWaalsContact C-N 3.32Å; L97-A99 PolarHBondContact O-N 3.21Å; L97-L100 PolarHBondContact O-N 3.49Å; L97-T101 WeakPolarHBondContact O-CB 3.44Å; L97-T101 PolarHBondContact O-N 3.46Å; L97-T101 PolarHBondContact O-OG1 3.45Å
98N97.2Very high96.3Very high96 Ų9677.1 Ų77.151%0.51341%0.41SS..Hα-helixtrans-61.8-40.2176.2-71.3-8.7000111.9L94 H96 T101 A102L94-N98 WeakPolarHBondContact O-CB 3.32Å; L94-N98 VanDerWaalsContact O-CG 3.26Å; L94-N98 PolarHBondContact O-N 2.96Å; H96-N98 PolarHBondContact O-N 3.49Å; N98-T101 PolarHBondContact O-N 3.06Å; N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 3.39Å
99A96.4Very high96.3Very high54 Ų5480.3 Ų80.345%0.44642%0.423SS..Hα-helixtrans-64.8-42.1174.600000112.4K95 H96 L97 A102 V103K95-A99 PolarHBondContact O-N 3.01Å; K95-A99 VanDerWaalsContact O-N 3.09Å; H96-A99 PolarHBondContact O-N 2.88Å; L97-A99 VanDerWaalsContact C-N 3.32Å; L97-A99 PolarHBondContact O-N 3.21Å; A99-A102 PolarHBondContact O-N 3.17Å; A99-V103 WeakPolarHBondContact O-CG2 3.25Å; A99-V103 PolarHBondContact O-N 3.48Å
100L97.3Very high96Very high83 Ų8387.3 Ų87.344%0.43545%0.453SS..Hα-helixtrans-64.6-41175.5-71.5177000112.3H96 L97 V103 T104H96-L100 WeakPolarHBondContact O-CG 3.27Å; H96-L100 PolarHBondContact O-N 2.88Å; L97-L100 PolarHBondContact O-N 3.49Å; L100-V103 PolarHBondContact O-N 3.04Å; L100-T104 WeakPolarHBondContact O-CB 2.99Å; L100-T104 PolarHBondContact O-N 2.92Å; L100-T104 PolarHBondContact O-OG1 3.25Å
101T97.4Very high95.8Very high87 Ų8786.3 Ų86.353%0.53445%0.447SS..Hα-helixtrans-62-47174.8-60.70000110.8L97 N98 V103 T104 E105L97-T101 WeakPolarHBondContact O-CB 3.44Å; L97-T101 PolarHBondContact O-N 3.46Å; L97-T101 PolarHBondContact O-OG1 3.45Å; N98-T101 PolarHBondContact O-N 3.06Å; T101-V103 PolarHBondContact O-N 3.49Å; T101-T104 WeakPolarHBondContact O-CB 3.4Å; T101-T104 PolarHBondContact O-N 3.13Å; T101-T104 VanDerWaalsContact O-N 3.15Å; T101-E105 WeakPolarHBondContact O-CB 3.4Å; T101-E105 PolarHBondContact O-N 3.11Å
102A97.4Very high95.5Very high44 Ų4484.4 Ų84.436%0.36444%0.44SS..Hα-helixtrans-60.8-41.4177.800000112.7N98 A99 E105 Q106N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 3.39Å; A99-A102 PolarHBondContact O-N 3.17Å; A102-E105 PolarHBondContact O-N 3.37Å; A102-Q106 WeakPolarHBondContact O-CB 3.43Å; A102-Q106 WeakPolarHBondContact O-CG 3.28Å; A102-Q106 PolarHBondContact O-N 3.49Å
103V96.8Very high95.1Very high87 Ų8786 Ų8653%0.52746%0.455SS..Hα-helixtrans-65.2-40.4174.7170.30000111.4A99 L100 T101 Q106 Q107A99-V103 WeakPolarHBondContact O-CG2 3.25Å; A99-V103 PolarHBondContact O-N 3.48Å; L100-V103 PolarHBondContact O-N 3.04Å; T101-V103 PolarHBondContact O-N 3.49Å; V103-Q106 PolarHBondContact O-N 3.49Å; V103-Q107 WeakPolarHBondContact O-CB 3.04Å; V103-Q107 PolarHBondContact O-N 2.88Å
104T96.8Very high94.5Very high87 Ų8789.9 Ų89.953%0.53447%0.474SS..Hα-helixtrans-66.4-40.7178.2-580000111.1L100 T101 Q107 H108L100-T104 WeakPolarHBondContact O-CB 2.99Å; L100-T104 PolarHBondContact O-N 2.92Å; L100-T104 PolarHBondContact O-OG1 3.25Å; T101-T104 WeakPolarHBondContact O-CB 3.4Å; T101-T104 PolarHBondContact O-N 3.13Å; T101-T104 VanDerWaalsContact O-N 3.15Å; T104-Q107 PolarHBondContact O-N 2.89Å; T104-H108 WeakPolarHBondContact O-CB 3.41Å; T104-H108 PolarHBondContact O-N 3.36Å
105E95.8Very high93.9Very high107 Ų10791.9 Ų91.950%0.548%0.481SS..Hα-helixtrans-65.7-46.3175.3-165.9-172160.600111.3T101 A102 Q107 H108 Q109T101-E105 WeakPolarHBondContact O-CB 3.4Å; T101-E105 PolarHBondContact O-N 3.11Å; A102-E105 PolarHBondContact O-N 3.37Å; E105-Q107 VanDerWaalsContact C-N 3.29Å; E105-Q107 PolarHBondContact O-N 3.46Å; E105-H108 WeakPolarHBondContact O-CB 2.9Å; E105-H108 PolarHBondContact O-N 2.8Å; E105-H108 VanDerWaalsContact O-N 3.1Å; E105-Q109 HydrophobicContact CG-CG 4.49Å; E105-Q109 WeakPolarHBondContact O-CB 3.5Å; E105-Q109 VanDerWaalsContact O-CG 3.32Å; E105-Q109 WeakPolarHBondContact O-CG 3.27Å; E105-Q109 PolarHBondContact O-N 3.13Å; E105-Q109 PolarHBondContact OE1-NE2 3.46Å
106Q95.1Very high93.1Very high129 Ų12992.7 Ų92.760%0.60349%0.49SS*.Hα-helixtrans-58.7-40.8173.7-75.5179.2-0.200112.1A102 V103 K110A102-Q106 WeakPolarHBondContact O-CB 3.43Å; A102-Q106 WeakPolarHBondContact O-CG 3.28Å; A102-Q106 PolarHBondContact O-N 3.49Å; V103-Q106 PolarHBondContact O-N 3.49Å; Q106-K110 VanDerWaalsContact O-CB 3.32Å; Q106-K110 WeakPolarHBondContact O-CB 3.28Å; Q106-K110 PolarHBondContact O-N 2.75Å
107Q95.7Very high91.2Very high120 Ų12093.1 Ų93.156%0.56151%0.508SS*.Hα-helixtrans-64.8-41.3174.8-173.3179.10.800111.4V103 T104 E105 K110 I111V103-Q107 WeakPolarHBondContact O-CB 3.04Å; V103-Q107 PolarHBondContact O-N 2.88Å; T104-Q107 PolarHBondContact O-N 2.89Å; E105-Q107 VanDerWaalsContact C-N 3.29Å; E105-Q107 PolarHBondContact O-N 3.46Å; Q107-K110 PolarHBondContact O-N 3.46Å; Q107-I111 HydrophobicContact CG-CD1 4.08Å; Q107-I111 VanDerWaalsContact O-CG1 3.27Å; Q107-I111 WeakPolarHBondContact O-CG1 3.46Å; Q107-I111 PolarHBondContact O-N 3.37Å
108H95.4Very high88.9Confident113 Ų11393.7 Ų93.752%0.52351%0.512SS..Hα-helixtrans-65.2-46.9177.2-174.655.7000112T104 E105 K110 I111 I112T104-H108 WeakPolarHBondContact O-CB 3.41Å; T104-H108 PolarHBondContact O-N 3.36Å; E105-H108 WeakPolarHBondContact O-CB 2.9Å; E105-H108 PolarHBondContact O-N 2.8Å; E105-H108 VanDerWaalsContact O-N 3.1Å; H108-K110 VanDerWaalsContact C-N 3.29Å; H108-K110 PolarHBondContact O-N 2.82Å; H108-I111 PolarHBondContact O-N 2.92Å; H108-I111 VanDerWaalsContact O-N 3.13Å; H108-I112 WeakPolarHBondContact NE2-CD1 3.49Å; H108-I112 WeakPolarHBondContact O-CG1 3.48Å; H108-I112 PolarHBondContact O-N 3.37Å
109Q94Very high86.7Confident106 Ų10698.7 Ų98.750%0.49552%0.523SS..Hα-helixtrans-57.1-42.3173.2-69.6174.28.800111.3E105 I112 A113E105-Q109 HydrophobicContact CG-CG 4.49Å; E105-Q109 WeakPolarHBondContact O-CB 3.5Å; E105-Q109 VanDerWaalsContact O-CG 3.32Å; E105-Q109 WeakPolarHBondContact O-CG 3.27Å; E105-Q109 PolarHBondContact O-N 3.13Å; E105-Q109 PolarHBondContact OE1-NE2 3.46Å; Q109-I112 PolarHBondContact O-N 3.46Å; Q109-A113 WeakPolarHBondContact O-CB 3.44Å; Q109-A113 PolarHBondContact O-N 3.15Å
110K90.4Very high84.3Confident148 Ų148100.5 Ų100.564%0.64353%0.533SS*.Hα-helixtrans-65-39.4175.3-174.6174.8-178.2176.60112.7Q106 Q107 H108 A113 L114Q106-K110 VanDerWaalsContact O-CB 3.32Å; Q106-K110 WeakPolarHBondContact O-CB 3.28Å; Q106-K110 PolarHBondContact O-N 2.75Å; Q107-K110 PolarHBondContact O-N 3.46Å; H108-K110 VanDerWaalsContact C-N 3.29Å; H108-K110 PolarHBondContact O-N 2.82Å; K110-A113 PolarHBondContact O-N 2.94Å; K110-L114 HydrophobicContact CG-CD1 4.38Å; K110-L114 VanDerWaalsContact O-CG 3.27Å; K110-L114 WeakPolarHBondContact O-CG 3.32Å; K110-L114 PolarHBondContact O-N 3.38Å; K110-L114 VanDerWaalsContact O-N 3.11Å
111I91.6Very high82.2Confident69 Ų69102.1 Ų102.135%0.35454%0.541SS..Hα-helixtrans-64.5-45.1174.4-70.5162.4000110.2Q107 H108 A113 L114 Q115Q107-I111 HydrophobicContact CG-CD1 4.08Å; Q107-I111 VanDerWaalsContact O-CG1 3.27Å; Q107-I111 WeakPolarHBondContact O-CG1 3.46Å; Q107-I111 PolarHBondContact O-N 3.37Å; H108-I111 PolarHBondContact O-N 2.92Å; H108-I111 VanDerWaalsContact O-N 3.13Å; I111-A113 PolarHBondContact O-N 2.96Å; I111-L114 PolarHBondContact O-N 3.26Å; I111-Q115 HydrophobicContact CG2-CG 4.28Å; I111-Q115 WeakPolarHBondContact O-CB 3.38Å; I111-Q115 VanDerWaalsContact O-CG 3.31Å; I111-Q115 WeakPolarHBondContact O-CG 3.04Å; I111-Q115 PolarHBondContact O-N 3.38Å
112I90.2Very high79.9Confident59 Ų59101.1 Ų101.130%0.30353%0.529SS..Hα-helixtrans-60.6-45176.5-71.2169.2000110.9H108 Q109 L114 Q115 N116H108-I112 WeakPolarHBondContact NE2-CD1 3.49Å; H108-I112 WeakPolarHBondContact O-CG1 3.48Å; H108-I112 PolarHBondContact O-N 3.37Å; Q109-I112 PolarHBondContact O-N 3.46Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.06Å; I112-Q115 PolarHBondContact O-N 3.15Å; I112-Q115 VanDerWaalsContact O-N 3.13Å; I112-N116 VanDerWaalsContact CG2-ND2 3.25Å; I112-N116 WeakPolarHBondContact CG2-ND2 3.47Å; I112-N116 VanDerWaalsContact O-CB 3.28Å; I112-N116 WeakPolarHBondContact O-CB 3.32Å; I112-N116 PolarHBondContact O-N 3.04Å; I112-N116 PolarHBondContact O-OD1 2.94Å
113A86.7Confident77.9Confident46 Ų46101.5 Ų101.538%0.3853%0.528SS..Hα-helixtrans-59.3-41.4176.800000112.4Q109 K110 I111 D118Q109-A113 WeakPolarHBondContact O-CB 3.44Å; Q109-A113 PolarHBondContact O-N 3.15Å; K110-A113 PolarHBondContact O-N 2.94Å; I111-A113 PolarHBondContact O-N 2.96Å; A113-D118 PolarHBondContact O-N 3.41Å
114L84.2Confident75.9Confident100 Ų100102.7 Ų102.752%0.52454%0.538SS..Hα-helixtrans-68.7-33175.2-68.1168.7000113K110 I111 I112 L121K110-L114 HydrophobicContact CG-CD1 4.38Å; K110-L114 VanDerWaalsContact O-CG 3.27Å; K110-L114 WeakPolarHBondContact O-CG 3.32Å; K110-L114 PolarHBondContact O-N 3.38Å; K110-L114 VanDerWaalsContact O-N 3.11Å; I111-L114 PolarHBondContact O-N 3.26Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.06Å; L114-L121 HydrophobicContact CD2-CD1 3.7Å; L114-L121 HydrophobicContact CD2-CG 4.39Å
115Q84.1Confident74.2Confident143 Ų143104.1 Ų104.167%0.66854%0.541SS*.Hα-helixtrans-80.1-36.9179.7-75.8177.4-13.600113.2I111 I112 G117I111-Q115 HydrophobicContact CG2-CG 4.28Å; I111-Q115 WeakPolarHBondContact O-CB 3.38Å; I111-Q115 VanDerWaalsContact O-CG 3.31Å; I111-Q115 WeakPolarHBondContact O-CG 3.04Å; I111-Q115 PolarHBondContact O-N 3.38Å; I112-Q115 PolarHBondContact O-N 3.15Å; I112-Q115 VanDerWaalsContact O-N 3.13Å; Q115-G117 PolarHBondContact O-N 3.09Å
116N78.4Confident72.6Confident127 Ų127102.7 Ų102.768%0.67953%0.534SS*.THydrogen-bonded Turntrans-71.17.9-179-72.7-1.1000113.5I112 D118I112-N116 VanDerWaalsContact CG2-ND2 3.25Å; I112-N116 WeakPolarHBondContact CG2-ND2 3.47Å; I112-N116 VanDerWaalsContact O-CB 3.28Å; I112-N116 WeakPolarHBondContact O-CB 3.32Å; I112-N116 PolarHBondContact O-N 3.04Å; I112-N116 PolarHBondContact O-OD1 2.94Å; N116-D118 VanDerWaalsContact C-N 3.33Å; N116-D118 PolarHBondContact O-N 3.24Å
117G56.3Low71.4Confident58 Ų58100.3 Ų100.360%0.59853%0.528SS*.THydrogen-bonded Turntrans72.824.4175.900000113.6Q115 R119Q115-G117 PolarHBondContact O-N 3.09Å; G117-R119 PolarHBondContact O-N 3.41Å
118D49.2Very low70.4Confident105 Ų105100 Ų10056%0.56153%0.531SS*.  trans-71.373.8164.3-163.5-7.4000109.8A113 N116 S120 L121A113-D118 PolarHBondContact O-N 3.41Å; N116-D118 VanDerWaalsContact C-N 3.33Å; N116-D118 PolarHBondContact O-N 3.24Å; D118-S120 PolarHBondContact O-N 2.92Å; D118-S120 WeakPolarHBondContact OD1-CB 3.4Å; D118-S120 PolarHBondContact OD1-N 3.19Å; D118-L121 PolarHBondContact O-N 3.23Å
119R51.8Low69.9Low200 Ų20096.9 Ų96.976%0.75552%0.518SS*.THydrogen-bonded Turntrans-74.234.8168.2-160.3-169.9-91.9-114.97.8110.2G117 L121 K122G117-R119 PolarHBondContact O-N 3.41Å; R119-L121 VanDerWaalsContact C-C 3.45Å; R119-L121 VanDerWaalsContact CG-O 3.3Å; R119-L121 WeakPolarHBondContact CG-O 3.31Å; R119-L121 CarbonylContact O-C 3.12Å; R119-K122 PolarHBondContact O-N 3.47Å
120S46.7Very low69.3Low92 Ų9294.8 Ų94.864%0.64351%0.51SS*.THydrogen-bonded Turntrans-71.5-0.5146.4-161.50000112D118 K122D118-S120 PolarHBondContact O-N 2.92Å; D118-S120 WeakPolarHBondContact OD1-CB 3.4Å; D118-S120 PolarHBondContact OD1-N 3.19Å; S120-K122 PolarHBondContact O-N 2.6Å
121L51.6Low69.1Low117 Ų11790.4 Ų90.461%0.61350%0.501SS*.  -67.365.3128.4-65.9-172.2000110.6L114 D118 R119L114-L121 HydrophobicContact CD2-CD1 3.7Å; L114-L121 HydrophobicContact CD2-CG 4.39Å; D118-L121 PolarHBondContact O-N 3.23Å; R119-L121 VanDerWaalsContact C-C 3.45Å; R119-L121 VanDerWaalsContact CG-O 3.3Å; R119-L121 WeakPolarHBondContact CG-O 3.31Å; R119-L121 CarbonylContact O-C 3.12Å
122K50.5Low69Low66 Ų6691.3 Ų91.329%0.28750%0.503SS..  trans-47.7123.7148.1-82.8-175175-1720104.9R119 S120 H126 D130R119-K122 PolarHBondContact O-N 3.47Å; S120-K122 PolarHBondContact O-N 2.6Å; K122-H126 HydrophobicContact CB-CB 3.79Å; K122-H126 HydrophobicContact CD-CB 4.29Å; K122-H126 WeakPolarHBondContact CD-ND1 3.22Å; K122-H126 WeakPolarHBondContact CE-CE1 3.49Å; K122-H126 WeakPolarHBondContact CE-NE2 3.3Å; K122-H126 HydrophobicContact CG-CB 3.99Å; K122-H126 PolarHBondContact NZ-CE1 3.35Å; K122-H126 VanDerWaalsContact NZ-CE1 3.28Å; K122-D130 WeakPolarHBondContact CD-OD2 3.31Å; K122-D130 WeakPolarHBondContact CE-OD2 3.41Å; K122-D130 IonicContact NZ-OD1 2.73Å; K122-D130 PolarHBondContact NZ-OD1 3.02Å; K122-D130 IonicContact NZ-OD2 2.83Å; K122-D130 PolarHBondContact NZ-OD2 2.98Å
123P55.1Low68.9Low52 Ų5290.1 Ų90.134%0.33850%0.496SS..  trans-52.2156.7174.521.7-32.7000108.3I125 H126 T127P123-I125 HydrophobicContact CB-CB 4.36Å; P123-I125 HydrophobicContact CG-CB 4.34Å; P123-I125 CarbonylContact O-C 3.48Å; P123-I125 PolarHBondContact O-N 3.45Å; P123-H126 HydrophobicContact CG-CB 3.93Å; P123-H126 PolarHBondContact O-N 3.04Å; P123-T127 PolarHBondContact O-N 3.35Å; P123-T127 VanDerWaalsContact O-N 3.13Å
124P55.2Low69.1Low112 Ų11291 Ų9173%0.72750%0.499SS*.Hα-helixtrans-49.6-31.117717-29.9000112.1T127 D128P124-T127 PolarHBondContact O-N 2.87Å; P124-D128 WeakPolarHBondContact O-CB 3.31Å; P124-D128 PolarHBondContact O-N 2.94Å
125I59.7Low69.4Low118 Ų11888.2 Ų88.261%0.60549%0.494SS*.Hα-helixtrans-54-49167.6-55.1170.8000113.6P123 D128 L129P123-I125 HydrophobicContact CB-CB 4.36Å; P123-I125 HydrophobicContact CG-CB 4.34Å; P123-I125 CarbonylContact O-C 3.48Å; P123-I125 PolarHBondContact O-N 3.45Å; I125-D128 PolarHBondContact O-N 3.27Å; I125-L129 HydrophobicContact CG2-CD1 4.07Å; I125-L129 WeakPolarHBondContact O-CB 3.46Å; I125-L129 WeakPolarHBondContact O-CG 3.49Å; I125-L129 PolarHBondContact O-N 3.37Å
126H63.2Low69.9Low77 Ų7783.5 Ų83.536%0.35647%0.472SS..Hα-helixtrans-79.8-27.5-177.5-168.9-13.3000112.4K122 P123 D130K122-H126 HydrophobicContact CB-CB 3.79Å; K122-H126 HydrophobicContact CD-CB 4.29Å; K122-H126 WeakPolarHBondContact CD-ND1 3.22Å; K122-H126 WeakPolarHBondContact CE-CE1 3.49Å; K122-H126 WeakPolarHBondContact CE-NE2 3.3Å; K122-H126 HydrophobicContact CG-CB 3.99Å; K122-H126 PolarHBondContact NZ-CE1 3.35Å; K122-H126 VanDerWaalsContact NZ-CE1 3.28Å; P123-H126 HydrophobicContact CG-CB 3.93Å; P123-H126 PolarHBondContact O-N 3.04Å; H126-D130 IonicContact CE1-OD1 3.59Å; H126-D130 PolarHBondContact CE1-OD1 2.98Å; H126-D130 IonicContact ND1-OD1 3.83Å; H126-D130 PolarHBondContact ND1-OD1 3.5Å; H126-D130 VanDerWaalsContact ND1-OD1 3.12Å; H126-D130 PolarHBondContact O-N 3.32Å
127T68.7Low70.5Confident79 Ų7982 Ų8249%0.48546%0.461SS..Hα-helixtrans-68.4-38.9168.4-49.50000111.2P123 P124 D130 A131P123-T127 PolarHBondContact O-N 3.35Å; P123-T127 VanDerWaalsContact O-N 3.13Å; P124-T127 PolarHBondContact O-N 2.87Å; T127-D130 PolarHBondContact O-N 3.44Å; T127-A131 WeakPolarHBondContact O-CB 3.41Å; T127-A131 PolarHBondContact O-N 2.74Å
128D75.1Confident72.3Confident113 Ų11382.7 Ų82.760%0.60445%0.453SS*.Hα-helixtrans-66.6-41.1172.8-172.940.8000111.6P124 I125 A131 F132P124-D128 WeakPolarHBondContact O-CB 3.31Å; P124-D128 PolarHBondContact O-N 2.94Å; I125-D128 PolarHBondContact O-N 3.27Å; D128-A131 WeakPolarHBondContact O-CB 3.35Å; D128-A131 PolarHBondContact O-N 3.45Å; D128-F132 WeakPolarHBondContact O-CB 3.37Å; D128-F132 PolarHBondContact O-N 2.8Å
129L84.3Confident74.4Confident48 Ų4881.1 Ų81.125%0.25145%0.45SS..Hα-helixtrans-63.8-39.9171.5-72168.9000112.2I125 A131 F132 H133I125-L129 HydrophobicContact CG2-CD1 4.07Å; I125-L129 WeakPolarHBondContact O-CB 3.46Å; I125-L129 WeakPolarHBondContact O-CG 3.49Å; I125-L129 PolarHBondContact O-N 3.37Å; L129-A131 VanDerWaalsContact C-N 3.33Å; L129-A131 PolarHBondContact O-N 2.81Å; L129-F132 PolarHBondContact O-N 3.1Å; L129-H133 VanDerWaalsContact O-CB 3.31Å; L129-H133 WeakPolarHBondContact O-CB 3.47Å; L129-H133 PolarHBondContact O-CD2 3.38Å; L129-H133 PolarHBondContact O-N 3.36Å
130D82.4Confident76.3Confident62 Ų6272.5 Ų72.533%0.33242%0.421SS..Hα-helixtrans-62.1-41.7173.6-71.8-12000111.4K122 H126 T127 H133 S134K122-D130 WeakPolarHBondContact CD-OD2 3.31Å; K122-D130 WeakPolarHBondContact CE-OD2 3.41Å; K122-D130 IonicContact NZ-OD1 2.73Å; K122-D130 PolarHBondContact NZ-OD1 3.02Å; K122-D130 IonicContact NZ-OD2 2.83Å; K122-D130 PolarHBondContact NZ-OD2 2.98Å; H126-D130 IonicContact CE1-OD1 3.59Å; H126-D130 PolarHBondContact CE1-OD1 2.98Å; H126-D130 IonicContact ND1-OD1 3.83Å; H126-D130 PolarHBondContact ND1-OD1 3.5Å; H126-D130 VanDerWaalsContact ND1-OD1 3.12Å; H126-D130 PolarHBondContact O-N 3.32Å; T127-D130 PolarHBondContact O-N 3.44Å; D130-H133 PolarHBondContact O-N 3.49Å; D130-S134 WeakPolarHBondContact O-CB 3.43Å; D130-S134 PolarHBondContact O-N 3.48Å; D130-S134 PolarHBondContact O-OG 3.44Å
131A86.3Confident78.3Confident56 Ų5674.3 Ų74.346%0.46342%0.418SS..Hα-helixtrans-64.3-42.2175.700000111.5T127 D128 L129 S134 G135T127-A131 WeakPolarHBondContact O-CB 3.41Å; T127-A131 PolarHBondContact O-N 2.74Å; D128-A131 WeakPolarHBondContact O-CB 3.35Å; D128-A131 PolarHBondContact O-N 3.45Å; L129-A131 VanDerWaalsContact C-N 3.33Å; L129-A131 PolarHBondContact O-N 2.81Å; A131-S134 WeakPolarHBondContact CA-OG 3.48Å; A131-S134 PolarHBondContact O-OG 3.46Å; A131-G135 PolarHBondContact O-N 2.87Å
132F88.9Confident80.3Confident88 Ų8874.4 Ų74.439%0.38642%0.415SS..Hα-helixtrans-63.8-45.3173.3178.2-104.2000112D128 L129 S134 G135 F136 F174D128-F132 WeakPolarHBondContact O-CB 3.37Å; D128-F132 PolarHBondContact O-N 2.8Å; L129-F132 PolarHBondContact O-N 3.1Å; F132-S134 PolarHBondContact O-N 2.69Å; F132-G135 PolarHBondContact O-N 2.87Å; F132-F136 VanDerWaalsContact O-CB 3.25Å; F132-F136 WeakPolarHBondContact O-CB 3.48Å; F132-F136 PolarHBondContact O-N 3.3Å; F132-F174 HydrophobicContact CE1-CB 4.42Å; F132-F174 HydrophobicContact CE1-CD1 4.29Å; F132-F174 AromaticContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CE2 4.28Å; F132-F174 AromaticContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CZ-CD2 4.44Å; F132-F174 HydrophobicContact CZ-CE2 4.31Å; F132-F174 HydrophobicContact CZ-CZ 4.42Å
133H89.6Confident82.3Confident33 Ų3374.1 Ų74.115%0.15342%0.419CS..Hα-helixtrans-65.7-39.3-179.9-80.8-128.4000111.7L129 D130 Q137 L171 Q175L129-H133 VanDerWaalsContact O-CB 3.31Å; L129-H133 WeakPolarHBondContact O-CB 3.47Å; L129-H133 PolarHBondContact O-CD2 3.38Å; L129-H133 PolarHBondContact O-N 3.36Å; D130-H133 PolarHBondContact O-N 3.49Å; H133-Q137 WeakPolarHBondContact O-CB 3.32Å; H133-Q137 PolarHBondContact O-N 2.91Å; H133-L171 HydrophobicContact CB-CD1 4.28Å; H133-Q175 PolarHBondContact CE1-NE2 2.88Å
134S89Confident83.8Confident66 Ų6674.1 Ų74.146%0.46242%0.416SS..Hα-helixtrans-71.1-40.6175.353.70000112.3D130 A131 F132 Q137 T138D130-S134 WeakPolarHBondContact O-CB 3.43Å; D130-S134 PolarHBondContact O-N 3.48Å; D130-S134 PolarHBondContact O-OG 3.44Å; A131-S134 WeakPolarHBondContact CA-OG 3.48Å; A131-S134 PolarHBondContact O-OG 3.46Å; F132-S134 PolarHBondContact O-N 2.69Å; S134-Q137 PolarHBondContact O-N 2.92Å; S134-T138 WeakPolarHBondContact O-CB 3.25Å; S134-T138 PolarHBondContact O-N 3.37Å; S134-T138 PolarHBondContact O-OG1 3.23Å
135G92.5Very high85.4Confident40 Ų4074 Ų7441%0.41241%0.405SS..Hα-helixtrans-60.9-46.5171.100000112.6A131 F132 T138 C139A131-G135 PolarHBondContact O-N 2.87Å; F132-G135 PolarHBondContact O-N 2.87Å; G135-T138 PolarHBondContact O-N 2.97Å; G135-T138 VanDerWaalsContact O-N 3.16Å; G135-C139 PolarHBondContact O-N 3.46Å
136F93.4Very high86.8Confident45 Ų4576 Ų7620%0.19741%0.406CS..Hα-helixtrans-61.8-45.2176.4-175.5-84.8000111.8F132 T138 C139 A140 L167 V170 L171F132-F136 VanDerWaalsContact O-CB 3.25Å; F132-F136 WeakPolarHBondContact O-CB 3.48Å; F132-F136 PolarHBondContact O-N 3.3Å; F136-T138 VanDerWaalsContact C-N 3.27Å; F136-T138 PolarHBondContact O-N 3.01Å; F136-C139 PolarHBondContact O-N 2.86Å; F136-A140 VanDerWaalsContact O-CB 3.25Å; F136-A140 WeakPolarHBondContact O-CB 3.5Å; F136-A140 PolarHBondContact O-N 2.91Å; F136-L167 HydrophobicContact CE1-CB 4.41Å; F136-L167 HydrophobicContact CE1-CD2 4.44Å; F136-L167 HydrophobicContact CZ-CD2 3.95Å; F136-V170 HydrophobicContact CE2-CG1 3.97Å; F136-V170 HydrophobicContact CZ-CB 4.24Å; F136-V170 HydrophobicContact CZ-CG1 3.81Å; F136-L171 HydrophobicContact CD1-CB 4.23Å; F136-L171 HydrophobicContact CD1-CD1 3.82Å; F136-L171 HydrophobicContact CD1-CD2 4.48Å; F136-L171 HydrophobicContact CD1-CG 4.41Å; F136-L171 HydrophobicContact CE1-CB 3.96Å; F136-L171 HydrophobicContact CE1-CD1 4.39Å; F136-L171 HydrophobicContact CG-CD1 4.31Å
137Q91.7Very high88Confident95 Ų9573.5 Ų73.544%0.44440%0.395SS..Hα-helixtrans-61.4-35.4174-85.4-155.121.400112.9H133 S134 K141 L171H133-Q137 WeakPolarHBondContact O-CB 3.32Å; H133-Q137 PolarHBondContact O-N 2.91Å; S134-Q137 PolarHBondContact O-N 2.92Å; Q137-K141 WeakPolarHBondContact O-CD 3.48Å; Q137-K141 VanDerWaalsContact O-CG 3.24Å; Q137-K141 WeakPolarHBondContact O-CG 3.32Å; Q137-K141 PolarHBondContact O-N 3.39Å; Q137-L171 HydrophobicContact CG-CD2 4.21Å
138T93.1Very high88.8Confident73 Ų7372.4 Ų72.445%0.44839%0.391SS..Hα-helixtrans-69-49.8179.1-55.50000110.3S134 G135 F136 A140 K141 E142S134-T138 WeakPolarHBondContact O-CB 3.25Å; S134-T138 PolarHBondContact O-N 3.37Å; S134-T138 PolarHBondContact O-OG1 3.23Å; G135-T138 PolarHBondContact O-N 2.97Å; G135-T138 VanDerWaalsContact O-N 3.16Å; F136-T138 VanDerWaalsContact C-N 3.27Å; F136-T138 PolarHBondContact O-N 3.01Å; T138-A140 VanDerWaalsContact C-N 3.34Å; T138-A140 PolarHBondContact O-N 3.03Å; T138-K141 WeakPolarHBondContact O-CB 3.39Å; T138-K141 PolarHBondContact O-N 2.92Å; T138-K141 VanDerWaalsContact O-N 3.14Å; T138-E142 PolarHBondContact O-N 3.31Å
139C93.9Very high89.3Confident71 Ų7173.5 Ų73.548%0.4839%0.393SS..Hα-helixtrans-57.2-43.6172.8179.50000112.4G135 F136 K141 E142 V143G135-C139 PolarHBondContact O-N 3.46Å; F136-C139 PolarHBondContact O-N 2.86Å; C139-K141 VanDerWaalsContact C-N 3.32Å; C139-K141 PolarHBondContact O-N 3.42Å; C139-E142 PolarHBondContact O-N 2.99Å; C139-V143 WeakPolarHBondContact O-CG2 3.42Å; C139-V143 PolarHBondContact O-N 3.23Å
140A91.6Very high89.2Confident20 Ų2073.8 Ų73.817%0.16540%0.402CS..Hα-helixtrans-60.4-39.4176.600000112.7F136 T138 L144 L167F136-A140 VanDerWaalsContact O-CB 3.25Å; F136-A140 WeakPolarHBondContact O-CB 3.5Å; F136-A140 PolarHBondContact O-N 2.91Å; T138-A140 VanDerWaalsContact C-N 3.34Å; T138-A140 PolarHBondContact O-N 3.03Å; A140-L144 PolarHBondContact O-N 2.93Å; A140-L167 HydrophobicContact CB-CD1 4Å
141K89.8Confident89.1Confident129 Ų12976.2 Ų76.256%0.56141%0.411SS*.Hα-helixtrans-68-43.1174.6-72.6165.7-172.3170.60111.6Q137 T138 C139 L144 Q145Q137-K141 WeakPolarHBondContact O-CD 3.48Å; Q137-K141 VanDerWaalsContact O-CG 3.24Å; Q137-K141 WeakPolarHBondContact O-CG 3.32Å; Q137-K141 PolarHBondContact O-N 3.39Å; T138-K141 WeakPolarHBondContact O-CB 3.39Å; T138-K141 PolarHBondContact O-N 2.92Å; T138-K141 VanDerWaalsContact O-N 3.14Å; C139-K141 VanDerWaalsContact C-N 3.32Å; C139-K141 PolarHBondContact O-N 3.42Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 3.45Å; K141-Q145 WeakPolarHBondContact O-CB 3.45Å; K141-Q145 PolarHBondContact O-N 2.92Å
142E92.8Very high88.8Confident119 Ų11979.2 Ų79.256%0.55642%0.42SS*.Hα-helixtrans-62.9-41.5176.8-73.1-178168.400112.3T138 C139 L144 Q145 Y146T138-E142 PolarHBondContact O-N 3.31Å; C139-E142 PolarHBondContact O-N 2.99Å; E142-L144 PolarHBondContact O-N 2.95Å; E142-Q145 PolarHBondContact O-N 2.96Å; E142-Y146 WeakPolarHBondContact O-CB 3.44Å; E142-Y146 PolarHBondContact O-N 2.92Å
143V91.6Very high88.4Confident60 Ų6077 Ų7736%0.36441%0.408SS..Hα-helixtrans-61.3-44.4174.7169.40000111.1C139 Y146 L147 L163C139-V143 WeakPolarHBondContact O-CG2 3.42Å; C139-V143 PolarHBondContact O-N 3.23Å; V143-Y146 PolarHBondContact O-N 3.46Å; V143-L147 HydrophobicContact CG1-CD1 4.01Å; V143-L147 WeakPolarHBondContact O-CB 3.39Å; V143-L147 VanDerWaalsContact O-CG 3.31Å; V143-L147 WeakPolarHBondContact O-CG 3.48Å; V143-L147 PolarHBondContact O-N 2.92Å; V143-L163 HydrophobicContact CG1-CD2 4.29Å
144L87.9Confident87.7Confident53 Ų5378.7 Ų78.728%0.27742%0.422SS..Hα-helixtrans-62.1-44.3174.1-107.165.5000112.2A140 K141 E142 L147 S148 L163 I164 L167A140-L144 PolarHBondContact O-N 2.93Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 3.45Å; E142-L144 PolarHBondContact O-N 2.95Å; L144-L147 PolarHBondContact O-N 3.4Å; L144-S148 WeakPolarHBondContact O-CB 3.45Å; L144-S148 PolarHBondContact O-N 3.5Å; L144-S148 PolarHBondContact O-OG 3.02Å; L144-L163 HydrophobicContact CD1-CD2 4.06Å; L144-L163 HydrophobicContact CD1-CG 4.4Å; L144-I164 HydrophobicContact CD1-CG1 4.1Å; L144-I164 HydrophobicContact CD2-CD1 3.91Å; L144-I164 HydrophobicContact CD2-CG1 3.73Å; L144-I164 HydrophobicContact CG-CG1 4.38Å; L144-L167 HydrophobicContact CD1-CD1 4.27Å
145Q88.6Confident86.8Confident110 Ų11080.4 Ų80.451%0.51444%0.439SS..Hα-helixtrans-62.5-44.9178.7-172.8173.221.400110.9K141 E142 S148 Q149K141-Q145 WeakPolarHBondContact O-CB 3.45Å; K141-Q145 PolarHBondContact O-N 2.92Å; E142-Q145 PolarHBondContact O-N 2.96Å; Q145-S148 PolarHBondContact O-N 3.37Å; Q145-S148 PolarHBondContact O-OG 3.19Å; Q145-Q149 WeakPolarHBondContact O-CG 3.43Å; Q145-Q149 PolarHBondContact O-N 3.26Å
146Y89.6Confident85.8Confident159 Ų15988.9 Ų88.962%0.62446%0.459SS*.Hα-helixtrans-59.8-49.5174.3178.4-97.8000112E142 V143 S148 Q149 A150E142-Y146 WeakPolarHBondContact O-CB 3.44Å; E142-Y146 PolarHBondContact O-N 2.92Å; V143-Y146 PolarHBondContact O-N 3.46Å; Y146-S148 VanDerWaalsContact C-N 3.32Å; Y146-S148 PolarHBondContact O-N 3.36Å; Y146-Q149 PolarHBondContact O-N 3.09Å; Y146-Q149 VanDerWaalsContact O-N 3.14Å; Y146-A150 HydrophobicContact CD1-CB 4.44Å; Y146-A150 HydrophobicContact CD2-CB 4.41Å; Y146-A150 HydrophobicContact CE1-CB 4.05Å; Y146-A150 HydrophobicContact CE2-CB 4.02Å; Y146-A150 VanDerWaalsContact O-CB 3.28Å; Y146-A150 WeakPolarHBondContact O-CB 3.42Å; Y146-A150 PolarHBondContact O-N 3.46Å
147L87.1Confident85.2Confident24 Ų2489.2 Ų89.213%0.12646%0.461CS..Hα-helixtrans-64-35.4179.5-70.1170.4000112.7V143 L144 E151 N152 W153 L163V143-L147 HydrophobicContact CG1-CD1 4.01Å; V143-L147 WeakPolarHBondContact O-CB 3.39Å; V143-L147 VanDerWaalsContact O-CG 3.31Å; V143-L147 WeakPolarHBondContact O-CG 3.48Å; V143-L147 PolarHBondContact O-N 2.92Å; L144-L147 PolarHBondContact O-N 3.4Å; L147-E151 CarbonylContact O-C 3.5Å; L147-E151 WeakPolarHBondContact O-CA 3.37Å; L147-E151 PolarHBondContact O-N 3.24Å; L147-E151 VanDerWaalsContact O-N 3.09Å; L147-N152 PolarHBondContact O-N 3.36Å; L147-W153 HydrophobicContact CB-CB 4.42Å; L147-W153 HydrophobicContact CB-CD2 4.32Å; L147-W153 HydrophobicContact CB-CG 4.26Å; L147-W153 HydrophobicContact CD1-CE3 4.27Å; L147-W153 HydrophobicContact CD1-CZ3 4.24Å; L147-W153 PolarHBondContact O-N 2.96Å; L147-L163 HydrophobicContact CD1-CD2 3.41Å; L147-L163 VanDerWaalsContact CD1-CD2 3.41Å
148S86.3Confident84.8Confident56 Ų5691.2 Ų91.239%0.39247%0.47SS..Hα-helixtrans-69.6-29.517468.50000113.8L144 Q145 Y146 N152L144-S148 WeakPolarHBondContact O-CB 3.45Å; L144-S148 PolarHBondContact O-N 3.5Å; L144-S148 PolarHBondContact O-OG 3.02Å; Q145-S148 PolarHBondContact O-N 3.37Å; Q145-S148 PolarHBondContact O-OG 3.19Å; Y146-S148 VanDerWaalsContact C-N 3.32Å; Y146-S148 PolarHBondContact O-N 3.36Å; S148-N152 VanDerWaalsContact O-CA 3.31Å; S148-N152 WeakPolarHBondContact O-CA 3.31Å
149Q85.8Confident84.3Confident137 Ų13793.7 Ų93.764%0.6447%0.472SS*.Hα-helixtrans-89.3-41.9179.1-70.1178.623.800113.2Q145 Y146Q145-Q149 WeakPolarHBondContact O-CG 3.43Å; Q145-Q149 PolarHBondContact O-N 3.26Å; Y146-Q149 PolarHBondContact O-N 3.09Å; Y146-Q149 VanDerWaalsContact O-N 3.14Å
150A81.9Confident83.8Confident54 Ų5491 Ų9145%0.44645%0.453SS..Hα-helixtrans-83.8-40.5-175.300000112.8Y146Y146-A150 HydrophobicContact CD1-CB 4.44Å; Y146-A150 HydrophobicContact CD2-CB 4.41Å; Y146-A150 HydrophobicContact CE1-CB 4.05Å; Y146-A150 HydrophobicContact CE2-CB 4.02Å; Y146-A150 VanDerWaalsContact O-CB 3.28Å; Y146-A150 WeakPolarHBondContact O-CB 3.42Å; Y146-A150 PolarHBondContact O-N 3.46Å
151E79.4Confident83.5Confident112 Ų11291.7 Ų91.752%0.52346%0.459SS..SBendtrans-113.23.7-176.6-66.2-169.9-162.300113.4L147 W153L147-E151 CarbonylContact O-C 3.5Å; L147-E151 WeakPolarHBondContact O-CA 3.37Å; L147-E151 PolarHBondContact O-N 3.24Å; L147-E151 VanDerWaalsContact O-N 3.09Å; E151-W153 HydrophobicContact CB-CG 4.48Å; E151-W153 PolarHBondContact O-N 2.97Å; E151-W153 PolarHBondContact OE2-NE1 3.06Å
152N80.7Confident83.5Confident120 Ų12091.5 Ų91.564%0.64246%0.46SS*.  trans55.229.2-178-62.9-86.4000114.2L147 S148 T154L147-N152 PolarHBondContact O-N 3.36Å; S148-N152 VanDerWaalsContact O-CA 3.31Å; S148-N152 WeakPolarHBondContact O-CA 3.31Å; N152-T154 PolarHBondContact O-N 3.41Å
153W81.4Confident83.3Confident40 Ų4087.9 Ų87.915%0.15245%0.445CS..  trans-59.4111180-80.135.9000110.6L147 E151 E157 R159 C160 L163L147-W153 HydrophobicContact CB-CB 4.42Å; L147-W153 HydrophobicContact CB-CD2 4.32Å; L147-W153 HydrophobicContact CB-CG 4.26Å; L147-W153 HydrophobicContact CD1-CE3 4.27Å; L147-W153 HydrophobicContact CD1-CZ3 4.24Å; L147-W153 PolarHBondContact O-N 2.96Å; E151-W153 HydrophobicContact CB-CG 4.48Å; E151-W153 PolarHBondContact O-N 2.97Å; E151-W153 PolarHBondContact OE2-NE1 3.06Å; W153-E157 WeakPolarHBondContact CA-OE1 3.38Å; W153-R159 HydrophobicContact CE3-CB 4.23Å; W153-R159 HydrophobicContact CH2-CB 3.8Å; W153-R159 HydrophobicContact CZ2-CB 4.41Å; W153-R159 HydrophobicContact CZ3-CB 3.7Å; W153-C160 HydrophobicContact CE3-CB 3.94Å; W153-L163 HydrophobicContact CZ3-CD2 4.32Å
154T74.6Confident83.1Confident70 Ų7087.6 Ų87.643%0.42944%0.44SS..  trans-81.6149.1179.5640000110.7N152 R156 E157N152-T154 PolarHBondContact O-N 3.41Å; T154-R156 PolarHBondContact O-N 3.4Å; T154-E157 PolarHBondContact N-OE1 3.14Å; T154-E157 WeakPolarHBondContact O-CB 3.44Å; T154-E157 PolarHBondContact O-N 2.69Å; T154-E157 PolarHBondContact OG1-OE1 2.9Å
155A69.7Low83.2Confident101 Ų10189.3 Ų89.384%0.83545%0.45SS*.THydrogen-bonded Turntrans-61.1-9.2175.700000114.2
156R70.4Confident83.3Confident219 Ų21989.3 Ų89.383%0.82645%0.45SS*.THydrogen-bonded Turntrans-85.2-16.2174.1-168.3177.1-68.5120.2-2.2112.8T154T154-R156 PolarHBondContact O-N 3.4Å
157E82.1Confident83.4Confident51 Ų5183.2 Ų83.224%0.23843%0.428CS..  trans-74.7131180-79.7173.9-110.300112.6W153 T154 R159 C160 A161W153-E157 WeakPolarHBondContact CA-OE1 3.38Å; T154-E157 PolarHBondContact N-OE1 3.14Å; T154-E157 WeakPolarHBondContact O-CB 3.44Å; T154-E157 PolarHBondContact O-N 2.69Å; T154-E157 PolarHBondContact OG1-OE1 2.9Å; E157-R159 PolarHBondContact O-N 3.5Å; E157-R159 VanDerWaalsContact O-N 3.16Å; E157-R159 IonicContact OE2-CZ 3.53Å; E157-R159 IonicContact OE2-NE 3.76Å; E157-R159 PolarHBondContact OE2-NE 3.46Å; E157-R159 IonicContact OE2-NH2 2.73Å; E157-R159 PolarHBondContact OE2-NH2 3.04Å; E157-C160 HydrophobicContact CB-CB 4.43Å; E157-C160 WeakPolarHBondContact O-CB 3.48Å; E157-C160 PolarHBondContact O-N 3.2Å; E157-A161 PolarHBondContact O-N 2.88Å
158Q82.8Confident83.4Confident137 Ų13787.7 Ų87.764%0.6445%0.448SS*.Hα-helixtrans-58.1-31.1177.5-63-59.6-49.700112.4A161 Q162Q158-A161 PolarHBondContact O-N 3.11Å; Q158-Q162 VanDerWaalsContact O-CB 3.31Å; Q158-Q162 WeakPolarHBondContact O-CB 3.35Å; Q158-Q162 WeakPolarHBondContact O-CG 3.47Å; Q158-Q162 PolarHBondContact O-N 3.04Å
159R82.1Confident83.6Confident125 Ų12591.5 Ų91.547%0.47246%0.457SS..Hα-helixtrans-65.4-40.7176.3-60.4-176.7-63.3155.35.1112.3W153 E157 Q162 L163W153-R159 HydrophobicContact CE3-CB 4.23Å; W153-R159 HydrophobicContact CH2-CB 3.8Å; W153-R159 HydrophobicContact CZ2-CB 4.41Å; W153-R159 HydrophobicContact CZ3-CB 3.7Å; E157-R159 PolarHBondContact O-N 3.5Å; E157-R159 VanDerWaalsContact O-N 3.16Å; E157-R159 IonicContact OE2-CZ 3.53Å; E157-R159 IonicContact OE2-NE 3.76Å; E157-R159 PolarHBondContact OE2-NE 3.46Å; E157-R159 IonicContact OE2-NH2 2.73Å; E157-R159 PolarHBondContact OE2-NH2 3.04Å; R159-Q162 PolarHBondContact O-N 3.02Å; R159-L163 WeakPolarHBondContact O-CB 3.25Å; R159-L163 PolarHBondContact O-N 3.48Å
160C84.1Confident83.7Confident14 Ų1486.4 Ų86.410%0.09544%0.435CS..Hα-helixtrans-65-47.4175.5-171.10000110.6W153 E157 Q162 L163 I164W153-C160 HydrophobicContact CE3-CB 3.94Å; E157-C160 HydrophobicContact CB-CB 4.43Å; E157-C160 WeakPolarHBondContact O-CB 3.48Å; E157-C160 PolarHBondContact O-N 3.2Å; C160-Q162 VanDerWaalsContact C-N 3.34Å; C160-Q162 PolarHBondContact O-N 3.35Å; C160-L163 PolarHBondContact O-N 2.89Å; C160-I164 VanDerWaalsContact O-CG1 3.31Å; C160-I164 WeakPolarHBondContact O-CG1 3.34Å; C160-I164 PolarHBondContact O-N 3.21Å
161A85.4Confident84Confident35 Ų3585 Ų8529%0.28942%0.42SS..Hα-helixtrans-61-39.317500000112.9E157 Q158 N165E157-A161 PolarHBondContact O-N 2.88Å; Q158-A161 PolarHBondContact O-N 3.11Å; A161-N165 WeakPolarHBondContact O-CB 3.33Å; A161-N165 PolarHBondContact O-N 2.94Å; A161-N165 PolarHBondContact O-ND2 3.47Å
162Q89.1Confident84.2Confident125 Ų12582.4 Ų82.458%0.58442%0.418SS*.Hα-helixtrans-64.3-43.1175.7-76.5164.58.100112Q158 R159 C160 N165 H166Q158-Q162 VanDerWaalsContact O-CB 3.31Å; Q158-Q162 WeakPolarHBondContact O-CB 3.35Å; Q158-Q162 WeakPolarHBondContact O-CG 3.47Å; Q158-Q162 PolarHBondContact O-N 3.04Å; R159-Q162 PolarHBondContact O-N 3.02Å; C160-Q162 VanDerWaalsContact C-N 3.34Å; C160-Q162 PolarHBondContact O-N 3.35Å; Q162-N165 PolarHBondContact O-N 2.94Å; Q162-H166 WeakPolarHBondContact O-CB 3.46Å; Q162-H166 PolarHBondContact O-N 2.73Å
163L89.3Confident84.2Confident44 Ų4484 Ų8423%0.2342%0.421CS..Hα-helixtrans-63.2-47.3176.9179.461.2000111.8V143 L144 L147 W153 R159 C160 N165 H166 L167V143-L163 HydrophobicContact CG1-CD2 4.29Å; L144-L163 HydrophobicContact CD1-CD2 4.06Å; L144-L163 HydrophobicContact CD1-CG 4.4Å; L147-L163 HydrophobicContact CD1-CD2 3.41Å; L147-L163 VanDerWaalsContact CD1-CD2 3.41Å; W153-L163 HydrophobicContact CZ3-CD2 4.32Å; R159-L163 WeakPolarHBondContact O-CB 3.25Å; R159-L163 PolarHBondContact O-N 3.48Å; C160-L163 PolarHBondContact O-N 2.89Å; L163-N165 VanDerWaalsContact C-N 3.35Å; L163-N165 PolarHBondContact O-N 3.26Å; L163-H166 WeakPolarHBondContact O-CB 3.3Å; L163-H166 PolarHBondContact O-N 2.95Å; L163-H166 VanDerWaalsContact O-N 3.13Å; L163-L167 HydrophobicContact CD1-CD1 4.13Å; L163-L167 HydrophobicContact CD1-CG 4.26Å; L163-L167 HydrophobicContact CG-CD1 4.03Å; L163-L167 WeakPolarHBondContact O-CG 3.37Å; L163-L167 PolarHBondContact O-N 2.92Å
164I87.6Confident83.7Confident53 Ų5386.8 Ų86.827%0.27244%0.435SS..Hα-helixtrans-58.1-48176.2-65.4163.4000110.6L144 C160 H166 L167 H168L144-I164 HydrophobicContact CD1-CG1 4.1Å; L144-I164 HydrophobicContact CD2-CD1 3.91Å; L144-I164 HydrophobicContact CD2-CG1 3.73Å; L144-I164 HydrophobicContact CG-CG1 4.38Å; C160-I164 VanDerWaalsContact O-CG1 3.31Å; C160-I164 WeakPolarHBondContact O-CG1 3.34Å; C160-I164 PolarHBondContact O-N 3.21Å; I164-H166 VanDerWaalsContact C-N 3.28Å; I164-H166 PolarHBondContact O-N 2.81Å; I164-L167 PolarHBondContact O-N 3.42Å; I164-H168 VanDerWaalsContact CG2-CE1 3.48Å; I164-H168 WeakPolarHBondContact CG2-CE1 3.23Å; I164-H168 WeakPolarHBondContact O-CB 3.43Å; I164-H168 VanDerWaalsContact O-CG 3.32Å; I164-H168 PolarHBondContact O-N 2.88Å
165N88.9Confident83.3Confident89 Ų8988.4 Ų88.448%0.47644%0.437SS..Hα-helixtrans-63.4-33.6177.4-82.5-70.9000112.6A161 Q162 L163 K169A161-N165 WeakPolarHBondContact O-CB 3.33Å; A161-N165 PolarHBondContact O-N 2.94Å; A161-N165 PolarHBondContact O-ND2 3.47Å; Q162-N165 PolarHBondContact O-N 2.94Å; L163-N165 VanDerWaalsContact C-N 3.35Å; L163-N165 PolarHBondContact O-N 3.26Å; N165-K169 WeakPolarHBondContact O-CB 3.21Å; N165-K169 WeakPolarHBondContact O-CG 3.4Å; N165-K169 PolarHBondContact O-N 3.39Å
166H91.1Very high82.7Confident111 Ų11188.9 Ų88.951%0.51443%0.432SS..Hα-helixtrans-67.9-48.1174.1-176.864.9000111.3Q162 L163 I164 H168 K169 V170Q162-H166 WeakPolarHBondContact O-CB 3.46Å; Q162-H166 PolarHBondContact O-N 2.73Å; L163-H166 WeakPolarHBondContact O-CB 3.3Å; L163-H166 PolarHBondContact O-N 2.95Å; L163-H166 VanDerWaalsContact O-N 3.13Å; I164-H166 VanDerWaalsContact C-N 3.28Å; I164-H166 PolarHBondContact O-N 2.81Å; H166-H168 VanDerWaalsContact C-N 3.34Å; H166-H168 PolarHBondContact O-N 3.23Å; H166-K169 PolarHBondContact O-N 3.12Å; H166-K169 VanDerWaalsContact O-N 3.14Å; H166-V170 WeakPolarHBondContact O-CG2 3.41Å; H166-V170 PolarHBondContact O-N 3.44Å
167L90.7Very high81.7Confident31 Ų3186 Ų8616%0.16243%0.433CS..Hα-helixtrans-61.2-40.2177.6-67.6168.5000111.9F136 A140 L144 L163 I164 V170 L171F136-L167 HydrophobicContact CE1-CB 4.41Å; F136-L167 HydrophobicContact CE1-CD2 4.44Å; F136-L167 HydrophobicContact CZ-CD2 3.95Å; A140-L167 HydrophobicContact CB-CD1 4Å; L144-L167 HydrophobicContact CD1-CD1 4.27Å; L163-L167 HydrophobicContact CD1-CD1 4.13Å; L163-L167 HydrophobicContact CD1-CG 4.26Å; L163-L167 HydrophobicContact CG-CD1 4.03Å; L163-L167 WeakPolarHBondContact O-CG 3.37Å; L163-L167 PolarHBondContact O-N 2.92Å; I164-L167 PolarHBondContact O-N 3.42Å; L167-V170 PolarHBondContact O-N 3.35Å; L167-L171 WeakPolarHBondContact O-CB 3.43Å; L167-L171 PolarHBondContact O-N 3.17Å
168H87.7Confident79.6Confident117 Ų11786.9 Ų86.954%0.54245%0.449SS..Hα-helixtrans-66.4-39.3173.3-69.1173.1000112.8I164 H166 L171 A172I164-H168 VanDerWaalsContact CG2-CE1 3.48Å; I164-H168 WeakPolarHBondContact CG2-CE1 3.23Å; I164-H168 WeakPolarHBondContact O-CB 3.43Å; I164-H168 VanDerWaalsContact O-CG 3.32Å; I164-H168 PolarHBondContact O-N 2.88Å; H166-H168 VanDerWaalsContact C-N 3.34Å; H166-H168 PolarHBondContact O-N 3.23Å; H168-L171 PolarHBondContact O-N 2.86Å; H168-A172 WeakPolarHBondContact O-CB 3.37Å; H168-A172 PolarHBondContact O-N 2.9Å
169K90.4Very high77.7Confident137 Ų13785.4 Ų85.460%0.59645%0.451SS*.Hα-helixtrans-64.5-41.5174.1-78.6172.7-179.3-1760112.1N165 H166 A172 Q173N165-K169 WeakPolarHBondContact O-CB 3.21Å; N165-K169 WeakPolarHBondContact O-CG 3.4Å; N165-K169 PolarHBondContact O-N 3.39Å; H166-K169 PolarHBondContact O-N 3.12Å; H166-K169 VanDerWaalsContact O-N 3.14Å; K169-A172 PolarHBondContact O-N 3.06Å; K169-Q173 WeakPolarHBondContact O-CG 3.12Å; K169-Q173 PolarHBondContact O-N 2.92Å
170V88.5Confident75.6Confident30 Ų3085.3 Ų85.318%0.18247%0.467CS..Hα-helixtrans-63.2-47.2175.4169.90000110.1F136 H166 L167 A172 Q173 F174F136-V170 HydrophobicContact CE2-CG1 3.97Å; F136-V170 HydrophobicContact CZ-CB 4.24Å; F136-V170 HydrophobicContact CZ-CG1 3.81Å; H166-V170 WeakPolarHBondContact O-CG2 3.41Å; H166-V170 PolarHBondContact O-N 3.44Å; L167-V170 PolarHBondContact O-N 3.35Å; V170-A172 VanDerWaalsContact C-N 3.27Å; V170-A172 PolarHBondContact O-N 2.83Å; V170-Q173 WeakPolarHBondContact O-CB 2.94Å; V170-Q173 PolarHBondContact O-N 3.44Å; V170-Q173 VanDerWaalsContact O-N 3.08Å; V170-F174 HydrophobicContact CG1-CD2 4.29Å; V170-F174 HydrophobicContact CG1-CE2 3.7Å; V170-F174 WeakPolarHBondContact O-CD2 3.48Å; V170-F174 PolarHBondContact O-N 3.42Å
171L86.9Confident73.3Confident25 Ų2592.4 Ų92.413%0.13150%0.503CS..Hα-helixtrans-60.5-34.1175.5-172.562.2000113H133 F136 Q137 L167 H168 F174H133-L171 HydrophobicContact CB-CD1 4.28Å; F136-L171 HydrophobicContact CD1-CB 4.23Å; F136-L171 HydrophobicContact CD1-CD1 3.82Å; F136-L171 HydrophobicContact CD1-CD2 4.48Å; F136-L171 HydrophobicContact CD1-CG 4.41Å; F136-L171 HydrophobicContact CE1-CB 3.96Å; F136-L171 HydrophobicContact CE1-CD1 4.39Å; F136-L171 HydrophobicContact CG-CD1 4.31Å; Q137-L171 HydrophobicContact CG-CD2 4.21Å; L167-L171 WeakPolarHBondContact O-CB 3.43Å; L167-L171 PolarHBondContact O-N 3.17Å; H168-L171 PolarHBondContact O-N 2.86Å; L171-F174 PolarHBondContact O-N 2.89Å
172A84.1Confident71Confident56 Ų5699.3 Ų99.346%0.46353%0.529SS..Hα-helixtrans-72.5-28.1175.300000113.3H168 K169 V170 F174 Q175H168-A172 WeakPolarHBondContact O-CB 3.37Å; H168-A172 PolarHBondContact O-N 2.9Å; K169-A172 PolarHBondContact O-N 3.06Å; V170-A172 VanDerWaalsContact C-N 3.27Å; V170-A172 PolarHBondContact O-N 2.83Å; A172-F174 VanDerWaalsContact C-N 3.26Å; A172-F174 PolarHBondContact O-N 3.45Å; A172-Q175 WeakPolarHBondContact O-CB 3.32Å; A172-Q175 PolarHBondContact O-N 3.26Å
173Q81.3Confident68.7Low153 Ų153102.3 Ų102.372%0.71554%0.543SS*.Hα-helixtrans-70.7-20.2175.1-73.1169.711.500113.2K169 V170 Q175K169-Q173 WeakPolarHBondContact O-CG 3.12Å; K169-Q173 PolarHBondContact O-N 2.92Å; V170-Q173 WeakPolarHBondContact O-CB 2.94Å; V170-Q173 PolarHBondContact O-N 3.44Å; V170-Q173 VanDerWaalsContact O-N 3.08Å; Q173-Q175 VanDerWaalsContact C-N 3.35Å
174F70.6Confident66.1Low100 Ų100109.2 Ų109.244%0.43957%0.574SS.*THydrogen-bonded Turntrans-86.4-1.3174.3-68.2-68.9000113.9F132 V170 L171 A172F132-F174 HydrophobicContact CE1-CB 4.42Å; F132-F174 HydrophobicContact CE1-CD1 4.29Å; F132-F174 AromaticContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CD2 3.96Å; F132-F174 HydrophobicContact CE1-CE2 4.28Å; F132-F174 AromaticContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CE1-CG 3.97Å; F132-F174 HydrophobicContact CZ-CD2 4.44Å; F132-F174 HydrophobicContact CZ-CE2 4.31Å; F132-F174 HydrophobicContact CZ-CZ 4.42Å; V170-F174 HydrophobicContact CG1-CD2 4.29Å; V170-F174 HydrophobicContact CG1-CE2 3.7Å; V170-F174 WeakPolarHBondContact O-CD2 3.48Å; V170-F174 PolarHBondContact O-N 3.42Å; L171-F174 PolarHBondContact O-N 2.89Å; A172-F174 VanDerWaalsContact C-N 3.26Å; A172-F174 PolarHBondContact O-N 3.45Å
175Q67.4Low63.3Low104 Ų104113.9 Ų113.949%0.48660%0.599SS.*SBendtrans-77.2129.9173.3-69.5-70-4.500110.8H133 A172 Q173 D177H133-Q175 PolarHBondContact CE1-NE2 2.88Å; A172-Q175 WeakPolarHBondContact O-CB 3.32Å; A172-Q175 PolarHBondContact O-N 3.26Å; Q173-Q175 VanDerWaalsContact C-N 3.35Å; Q175-D177 PolarHBondContact O-N 3.48Å
176P55.2Low61.3Low111 Ų111115.2 Ų115.272%0.72161%0.612SS**THydrogen-bonded Turntrans-7712.1-170.330.9-36.7000115.9
177D50.5Low58.3Low157 Ų157115 Ų11584%0.8463%0.63SS**THydrogen-bonded Turntrans-138.743.4-173.2-157.821.6000113.5Q175Q175-D177 PolarHBondContact O-N 3.48Å
178A38.8Very low55.4Low71 Ų71117.3 Ų117.359%0.58766%0.661SS**  trans-109.5124.4168.700000110.1
179P41.1Very low52.7Low105 Ų105119.8 Ų119.868%0.68268%0.679SS**  trans-65147.9174.628.2-34.4000110.1L181P179-L181 PolarHBondContact O-N 2.85Å
180P38.7Very low49.9Very low124 Ų124117.5 Ų117.581%0.80569%0.685SS**  trans-70.893.5-178.529.5-34.6000110.1Q182P180-Q182 PolarHBondContact O-N 3.14Å; P180-Q182 VanDerWaalsContact O-N 3.16Å
181L36.8Very low47.4Very low162 Ų162125.2 Ų125.285%0.84872%0.719SS**PPolyproline II helixtrans-63.8118.8164.7-72.3-165.3000108.4P179P179-L181 PolarHBondContact O-N 2.85Å
182Q36.6Very low44.5Very low181 Ų181131.8 Ų131.885%0.84675%0.754SS**PPolyproline II helixtrans-55.6143.1177.3-68.1-176.3-54.800110.7P180 Q184P180-Q182 PolarHBondContact O-N 3.14Å; P180-Q182 VanDerWaalsContact O-N 3.16Å; Q182-Q184 PolarHBondContact O-N 3.24Å; Q182-Q184 VanDerWaalsContact O-N 3.14Å
183H41.5Very low41.9Very low188 Ų188132.9 Ų132.987%0.8776%0.763SS**PPolyproline II helixtrans-54.1116.7163-12075.2000109.3
184Q33.2Very low39.6Very low188 Ų188134.3 Ų134.388%0.87977%0.77SS**  trans-138.8108.8165.1-151171.924.200110.4Q182Q182-Q184 PolarHBondContact O-N 3.24Å; Q182-Q184 VanDerWaalsContact O-N 3.14Å
185L28.8Very low37.6Very low151 Ų151138.7 Ų138.779%0.79179%0.789SS**  trans-111.2154.1161-93.2135.5000108
186P48.5Very low35.7Very low118 Ų118139.7 Ų139.777%0.76681%0.807SS**  trans-103.3154.8-151.538.1-35.6000114.8
187A27.3Very low34.6Very low106 Ų106140.8 Ų140.888%0.87681%0.807SS**  trans-173.3137.7148.400000113.4
188G29.1Very low33.5Very low80 Ų80139.5 Ų139.583%0.82581%0.809SS**  trans95.2117.1137.800000120.2
189D30.7Very low33.3Very low169 Ų169143.9 Ų143.990%0.90482%0.817SS**  trans-58.7145.3167.8-72.3-100.9000115.7
190A33.3Very low32.8Very low88 Ų88144.9 Ų144.973%0.72782%0.822SS**  156.8125.4107.400000115.5
191Q34.3Very low32.7Very low192 Ų192145.1 Ų145.190%0.89782%0.816SS**  trans56.6109145.5-61.8-168.8-43.300123.8
192D27.3Very low33.3Very low164 Ų164143.6 Ų143.688%0.87782%0.818SS**  75.1155.1117.2-154.2-136.2000123.7
193A29.4Very low33.3Very low78 Ų78141 Ų14165%0.64581%0.814SS**  trans8484.7162.900000121.4
194Q32.1Very low33.5Very low184 Ų184137.4 Ų137.486%0.8681%0.807SS**  71.794.3115.5-161.3160.7-104.500122.7
195K28.4Very low33.9Very low191 Ų191135.3 Ų135.383%0.8381%0.807SS**  51.2113.4118.2-159.9-178.1-170.2-179.70120.6
196S28.9Very low35Very low126 Ų126134.9 Ų134.988%0.88180%0.804SS**  trans-156.5157.5135.1460000112.2
197D30.8Very low34.8Very low133 Ų133137.9 Ų137.971%0.71181%0.808SS**  trans-94.3164.8-161.8-129.5-60.1000114.3
198C27.4Very low35Very low131 Ų131144.1 Ų144.189%0.88581%0.809SS**  trans169.975.8133.5-93.70000113.7
199Q34.2Very low35.4Very low162 Ų162146.3 Ų146.376%0.75781%0.806SS**  trans-11.7132.7146-179.8-173.928.300119.4
200T32.2Very low35.7Very low127 Ų127147.3 Ų147.378%0.77981%0.806SS**  trans-145107.2138.454.60000113.9
201N36.1Very low35.7Very low128 Ų128146.9 Ų146.968%0.68481%0.809SS**  trans59.485.1136.9-53-41.4000121.2
202C48.4Very low35.8Very low130 Ų130141 Ų14188%0.87880%0.8SS**  trans-115.9122.2143.3-70.60000108.6
203V38.3Very low36.1Very low127 Ų127142.3 Ų142.377%0.7780%0.801SS**PPolyproline II helixtrans-99.2117.8178179.10000109.5V205V203-V205 PolarHBondContact O-N 3.46Å
204P45.3Very low36.8Very low113 Ų113146.6 Ų146.673%0.73481%0.812SS**PPolyproline II helixtrans-74.9122.517030-31.4000109.8I206P204-I206 PolarHBondContact O-N 2.79Å
205V41.2Very low37.4Very low144 Ų144144.7 Ų144.787%0.87381%0.808SS**PPolyproline II helixtrans-73127.1170.9173.30000109.1V203V203-V205 PolarHBondContact O-N 3.46Å
206I51.7Low38.3Very low141 Ų141144.5 Ų144.572%0.72381%0.81SS**PPolyproline II helixtrans-68.7127.1-163.7-65.6157.8000112.4P204 R208P204-I206 PolarHBondContact O-N 2.79Å; I206-R208 HydrophobicContact CG2-CG 4.23Å
207Q43.6Very low39.5Very low181 Ų181145.5 Ų145.585%0.84681%0.805SS**PPolyproline II helixtrans-77.6118.9161.6-166.3173.322.600108.4
208R32.6Very low40.3Very low238 Ų238146 Ų14690%0.89881%0.808SS**PPolyproline II helixtrans-96.7128.7176.5-93-170178.7136.8-0.1111.6I206I206-R208 HydrophobicContact CG2-CG 4.23Å
209T37.7Very low41.3Very low126 Ų126145.2 Ų145.277%0.77380%0.799SS**  trans-118.1114.3174.650.60000110.9
210Q36.3Very low42.1Very low190 Ų190144.9 Ų144.989%0.88880%0.803SS**  trans-151.4129.2159.1-63.5-176.3-5.100103.8
211G33.8Very low43.1Very low78 Ų78144.4 Ų144.480%0.80480%0.8SS**  cis82.899.815.200000110.7
212G36.3Very low43.2Very low68 Ų68145.2 Ų145.270%0.70180%0.804SS**  cis152.6101.1-11.400000111.8
213E33.7Very low43.5Very low193 Ų193145 Ų14590%0.90280%0.804SS**  trans-157.5178177.642.2-148.3106.300113.3
214L44.8Very low44Very low168 Ų168141.4 Ų141.488%0.8879%0.792SS**  trans-105.4149.8-148.2-63.2156.8000113.7
215N44.8Very low43.9Very low143 Ų143147 Ų14777%0.76580%0.801SS**  trans51.4104.4141.1-176.693.8000118.8
216E47.1Very low44.3Very low188 Ų188142.9 Ų142.988%0.87979%0.787SS**  trans-153139.3142.352.3-160.4152.800111.6
217N53.1Low43.9Very low147 Ų147139.1 Ų139.179%0.78678%0.784SS**  trans-98.8134.3168.1-57-58.7000107.5
218D48.2Very low44Very low144 Ų144138.2 Ų138.277%0.7778%0.779SS**  trans-162115.1146.5-107.2-25.2000107.6
219T48.9Very low44.5Very low113 Ų113130.7 Ų130.769%0.69377%0.768SS**  64.1105.690.867.50000114.4
220D49.3Very low44.6Very low156 Ų156132 Ų13283%0.83477%0.765SS**  trans-148.291139.1-136.9-17.9000107.8
221T54.1Low44.6Very low117 Ų117130.8 Ų130.872%0.71876%0.757SS**  54.8124.591.619.90000118.2
222D38.2Very low44.7Very low145 Ų145132 Ų13278%0.77575%0.754SS**  trans69.988.6143.2-15726000121.1
223S53.9Low44.5Very low125 Ų125136.3 Ų136.387%0.87476%0.76SS**  -161.5130.5109.2-157.50000109.8
224G50.5Low44.8Very low51 Ų51129.7 Ų129.753%0.52674%0.744SS.*  cis140.387.43.200000111.4
225Y43.1Very low44.3Very low231 Ų231131 Ų13191%0.90674%0.743SS**  trans68.5140.7147.1-150-98.4000118.5
226G48.7Very low43.8Very low57 Ų57131.7 Ų131.759%0.58875%0.746SS**  cis164.6152.1-4.400000110.9
227G42.9Very low43.4Very low63 Ų63132.1 Ų132.165%0.64975%0.745SS**  trans79.1158.6155.200000119.5
228E45.5Very low42.4Very low161 Ų161134.1 Ų134.175%0.75275%0.75SS**  cis-153.8162-6.6-67.2-64.1126.100109
229A44.2Very low41.4Very low80 Ų80132.7 Ų132.766%0.66175%0.75SS**  trans42.7140.6137.900000122.1
230E40Very low40.6Very low155 Ų155134.1 Ų134.172%0.72475%0.749SS**  cis180-175.34.7-109.5-169.9116.300108.2
231K36Very low39.8Very low164 Ų164136.8 Ų136.871%0.71375%0.747SS**  trans84.890.6154.6-41-160.7-176.8-174.40116.1
232S35.8Very low38.8Very low104 Ų104137.2 Ų137.273%0.72775%0.745SS**  83119.874.768.90000114.3
233D32.3Very low38.6Very low157 Ų157139.6 Ų139.684%0.8475%0.749SS**  -170.9166.893-145-91.6000110
234G39.9Very low37.5Very low55 Ų55138.5 Ų138.557%0.56775%0.747SS**  trans-124.3169.6-170.600000114.6
235K33.3Very low36.6Very low196 Ų196142.8 Ų142.885%0.85276%0.762SS**  trans-169.8115.9147.8-119.1160.7-173.5135.70114.1
236D35.3Very low36.2Very low156 Ų156141.3 Ų141.383%0.83476%0.761SS**  trans-68.7143.7156.9-63.7-73.3000111.3
237K38.1Very low35.7Very low197 Ų197145.8 Ų145.886%0.85777%0.77SS**  trans-150.9108.6151.3-80.7-151174-170.50111.2
238E32.2Very low35.4Very low190 Ų190152.1 Ų152.189%0.88878%0.779SS**  trans-72.5143.3159-176.9-172.6170.500110.7
239C26.4Very low34.6Very low114 Ų114151.8 Ų151.877%0.7778%0.778SS**  trans-176.3138.3136.1-168.70000110.8
240E32.8Very low34.2Very low143 Ų143155.3 Ų155.367%0.66878%0.781SS**  trans-50.8152.8170.8-64.9175.766.900115N242E240-N242 PolarHBondContact OE1-ND2 2.9Å
241R31.6Very low33.6Very low211 Ų211157.9 Ų157.980%0.79679%0.79SS**  -156110.3124.1-171.3155.2-74.6127.8-1.9113.5
242N33.8Very low33.5Very low127 Ų127152.4 Ų152.468%0.67978%0.779SS**  trans-44.7137.5160.1-74-79.8000113.3E240E240-N242 PolarHBondContact OE1-ND2 2.9Å
243K34.4Very low33.1Very low195 Ų195154.7 Ų154.785%0.84878%0.783SS**  trans-158.8128.7151.4-111.7160.8-167.9-176.60112.4
244A30.1Very low33Very low101 Ų101154 Ų15484%0.83578%0.78SS**  trans-70143.4-169.100000114.5
245V32.6Very low32.7Very low141 Ų141162.6 Ų162.686%0.85580%0.795SS**  trans-86.5122.6160.8176.30000107.9
246K33.5Very low32.6Very low200 Ų200158.4 Ų158.487%0.8780%0.797SS**  trans-102.9111.3-178.5-163.8168.2-173.7171.90110.4
247I39.1Very low32.5Very low152 Ų152155.4 Ų155.478%0.77979%0.794SS**  trans-67137.6171.2-66.1168.5000109.4
248K36Very low32.6Very low195 Ų195155.6 Ų155.685%0.84880%0.795SS**  trans-158.899.3163.9-170.5172.7-176.8-176.70105.7
249Q29.6Very low32.6Very low154 Ų154155.4 Ų155.472%0.7279%0.791SS**  68.1135.161.7-156171.211.100113.2
250E35.9Very low32.8Very low155 Ų155157 Ų15772%0.72480%0.798SS**  trans-68.9162.6-153.558.1-109.9114.600118.6
251F26.6Very low32.9Very low209 Ų209159.6 Ų159.692%0.91781%0.807SS**  trans-153.1143141.4-162.2-99.6000110
252G34.7Very low32.8Very low48 Ų48157.2 Ų157.250%0.49581%0.807SS.*  trans-115.6-172.3-176.300000114.7
253D27.6Very low32.3Very low152 Ų152156.4 Ų156.481%0.81381%0.81SS**  trans62.2151.7179.2-86.9-64.9000117.2
254D29.8Very low31.8Very low142 Ų142158 Ų15876%0.75981%0.811SS**  cis-148.3175.912.5-150.3-42.1000111.9
255R33Very low31.8Very low236 Ų236158.5 Ų158.589%0.89181%0.808SS**  trans-77.8154.3-178.3-71.5170.5159.3147.6-6.4114.9
256A31Very low31.6Very low108 Ų108155.5 Ų155.589%0.89381%0.806SS**  trans-154.6137.3143.100000113.1
257A33.1Very low31.4Very low94 Ų94153.8 Ų153.878%0.77781%0.806SS**  trans-103.9154.9-168.700000115.2
258K40.3Very low30.9Very low200 Ų200151.2 Ų151.287%0.8781%0.807SS**  trans-135.986.7155.6-75.7-169.6-179173.40113.9
259K33.4Very low30.5Very low186 Ų186149.2 Ų149.281%0.80981%0.806SS**  trans4127.5137.849.4-174.9169-173.60118.3
260T30.4Very low31.4Very low149 Ų149146.4 Ų146.491%0.91480%0.801SS**  trans-141.2140.9134-74.30000108.4
261K34Very low31.1Very low197 Ų197146.1 Ų146.186%0.85781%0.81SS**  trans-129120.5-166.4174.7-174.6-178-179.20108.3
262M30.2Very low31.4Very low160 Ų160145.2 Ų145.279%0.78880%0.801SS**  trans-150.6117.7159.2-155.263.6170.600109.5
263C23.3Very low31.7Very low110 Ų110148.8 Ų148.874%0.74382%0.815SS**  trans-136.9133.9170.2-178.50000106
264W24.5Very low31.7Very low229 Ų229146 Ų14687%0.86780%0.801SS**  trans-116.9128163.2-91.572.3000107.2
265S29.3Very low32.1Very low111 Ų111146.1 Ų146.178%0.77681%0.806SS**  trans-137.1134169.1-177.80000107.1
266G28.3Very low32.2Very low79 Ų79139 Ų13981%0.81480%0.798SS**  trans-159.5114.7-177.400000108.1
267N28.6Very low32.6Very low163 Ų163142.8 Ų142.887%0.87279%0.794SS**  trans-109.1139.8-164.6-144.8-6.1000109.7
268A28.6Very low32.8Very low98 Ų98145.9 Ų145.981%0.8179%0.794SS**  trans170140.6144.100000113.8
269D29.2Very low32.7Very low153 Ų153144 Ų14482%0.81879%0.794SS**  trans-78.6-171.7177-1384.5000112.1
270P47.2Very low32.9Very low96 Ų96141 Ų14162%0.62380%0.796SS**  cis-132.2162.4-21.636.7-20.6000115.2
271T30.8Very low33.2Very low149 Ų149141.2 Ų141.291%0.91479%0.791SS**  trans-173.3128.7141.510.50000113.6
272R31.8Very low33.5Very low190 Ų190139.7 Ų139.772%0.71779%0.789SS**  trans-101.6160.2165.1-136.7-168152.8176.5-8.9107.9D274R272-D274 IonicContact CZ-OD1 2.68Å; R272-D274 IonicContact NH2-OD1 2.6Å; R272-D274 PolarHBondContact NH2-OD1 2.72Å
273P41.1Very low33.7Very low123 Ų123135.2 Ų135.280%0.79978%0.784SS**  -124.1142.655.57.217.9000112.7
274D28.6Very low34.4Very low94 Ų94138.4 Ų138.450%0.50379%0.793SS.*  82.1115.676.2-162.743.1000116.3R272 A276R272-D274 IonicContact CZ-OD1 2.68Å; R272-D274 IonicContact NH2-OD1 2.6Å; R272-D274 PolarHBondContact NH2-OD1 2.72Å; D274-A276 PolarHBondContact OD1-N 3.12Å
275V36.8Very low35.1Very low144 Ų144133.5 Ų133.587%0.87379%0.794SS**  trans-156.366.6145.8-88.20000108.5F277V275-F277 VanDerWaalsContact C-N 3.35Å; V275-F277 PolarHBondContact O-N 3.25Å
276A36.3Very low35.3Very low87 Ų87131.9 Ų131.972%0.71979%0.794SS**  trans-80.285162.600000109.2D274D274-A276 PolarHBondContact OD1-N 3.12Å
277F39.3Very low35.7Very low187 Ų187135.8 Ų135.882%0.8280%0.802SS**  trans-129.5139.1174.6-151.1-103.2000111.1V275V275-F277 VanDerWaalsContact C-N 3.35Å; V275-F277 PolarHBondContact O-N 3.25Å
278M37.2Very low35.9Very low158 Ų158131.2 Ų131.278%0.77879%0.793SS**SBendtrans69.975.9-173.6-45.5-157.4-54.900116.2
279N38.2Very low36.8Very low162 Ų162135.8 Ų135.887%0.86680%0.798SS**SBend-174.570.8125.1-94.8-35.3000112.3
280S37.9Very low37Very low122 Ų122137.1 Ų137.185%0.85380%0.799SS**  trans-171.7106156.5-86.80000111.2
281L36.4Very low36.7Very low154 Ų154137.7 Ų137.781%0.80680%0.801SS**  trans-157.1128.3146.8-153.371.9000110.1
282M39.5Very low37.7Very low164 Ų164136.8 Ų136.881%0.80880%0.798SS**  trans57.9101.8178-45.1-45.3-173.900115.7
283G34.1Very low38.2Very low66 Ų66135 Ų13568%0.6880%0.801SS**  cis81106.57.200000113.1
284L39.6Very low37.9Very low178 Ų178134.9 Ų134.993%0.93280%0.801SS**  trans-174.8134.3140.9-101.6168.6000110
285S38.1Very low39.3Very low126 Ų126138 Ų13888%0.88181%0.814SS**  trans-73.8145.5171.7-56.90000111.1
286G34.4Very low39.6Very low77 Ų77136.4 Ų136.479%0.79481%0.808SS**  trans-153.3125.717400000111.7
287V36.9Very low39.8Very low161 Ų161141.9 Ų141.998%0.97682%0.815SS**  trans-78.1132.9174.7-179.60000108.9
288G32.3Very low40Very low66 Ų66143.4 Ų143.468%0.6882%0.817SS**  trans155.6132.6167.700000115.7Q290G288-Q290 PolarHBondContact O-N 3.43Å
289Q46.4Very low40.3Very low194 Ų194146 Ų14691%0.90782%0.824SS**  trans-28.6122.5164.7-62.3-69.7-25.600114.3
290Q34.7Very low40.5Very low181 Ų181146.4 Ų146.485%0.84683%0.825SS**  trans-107.4105.9172.8-165.8173.821.500111G288G288-Q290 PolarHBondContact O-N 3.43Å
291T40.8Very low40.4Very low109 Ų109147.6 Ų147.667%0.66982%0.822SS**  trans-74.4147.5169.846.70000111.1I293T291-I293 PolarHBondContact O-N 3.49Å
292P50.6Low40.8Very low130 Ų130146 Ų14684%0.84482%0.821SS**  trans-74.6115.3177.629.5-32.9000110.9C294P292-C294 PolarHBondContact O-N 3.09Å
293I43.3Very low40.7Very low153 Ų153143.6 Ų143.679%0.78582%0.82SS**  trans-78.4110.9176.410.9175000110.3T291T291-I293 PolarHBondContact O-N 3.49Å
294C35.5Very low40.8Very low119 Ų119145.1 Ų145.180%0.80483%0.826SS**  trans-76.3128.7172-178.20000110.5P292P292-C294 PolarHBondContact O-N 3.09Å
295M57.1Low40.6Very low159 Ų159141.5 Ų141.578%0.78382%0.822SS**  trans-115122171.3-75.2-68.6-75.500109.8
296P43.5Very low40.5Very low112 Ų112140 Ų14073%0.72782%0.818SS**  trans-81.1128.4-176.930.9-33.4000112.2Y298P296-Y298 PolarHBondContact O-N 2.89Å
297F40.3Very low40.8Very low201 Ų201142 Ų14288%0.88282%0.816SS**  trans-80.2106.6172.3-76.2-90.5000111.8
298Y43.8Very low40.8Very low219 Ų219144.4 Ų144.486%0.85981%0.809SS**  trans-154.2104.9154.3-80.5-67.6000111.4P296P296-Y298 PolarHBondContact O-N 2.89Å
299F43.7Very low41.8Very low212 Ų212148.8 Ų148.893%0.9381%0.814SS**  trans-177.966.2145-107.4-65.5000112.4
300I42.7Very low41.6Very low172 Ų172143.5 Ų143.588%0.88280%0.797SS**  trans-135.1123.5157.6-57.1-177.9000108.2
301N34.4Very low42Very low146 Ų146144.9 Ų144.978%0.78180%0.8SS**  trans-103.9124.4-172.1-171.1-20.2000109.8S303N301-S303 PolarHBondContact O-N 3.12Å
302P44.7Very low42.3Very low121 Ų121148.7 Ų148.779%0.78681%0.808SS**  trans-99.684.7-171.936.9-32.7000113.2
303S38.1Very low41.8Very low114 Ų114148.8 Ų148.880%0.79780%0.801SS**  trans-164.7104.3155.5-165.20000113.7N301N301-S303 PolarHBondContact O-N 3.12Å
304A36.8Very low42Very low98 Ų98151 Ų15181%0.8181%0.805SS**  trans-179.2126.9137.500000113.1
305A35.2Very low42.6Very low101 Ų101149.6 Ų149.684%0.83580%0.796SS**  trans73.6126.8148.100000123
306A34.5Very low41.9Very low96 Ų96149.3 Ų149.379%0.79380%0.798SS**  trans75.3108.8149.400000120.6
307P41.2Very low41.9Very low118 Ų118151.1 Ų151.177%0.76680%0.8SS**  trans-86.2121.4162.333.3-29.1000111.4
308Y37.3Very low42.1Very low212 Ų212151.3 Ų151.383%0.83180%0.804SS**  trans-85.2116162.9177.1-97.1000109
309M53Low42.3Very low158 Ų158149.5 Ų149.578%0.77880%0.8SS**PPolyproline II helixtrans-98.4122.2177-78.6-69.7-174.900110.8
310P41.6Very low42.5Very low83 Ų83149.1 Ų149.154%0.53979%0.794SS.*PPolyproline II helixtrans-66.8138166.3-18.732.9000111.3F312P310-F312 PolarHBondContact O-N 3.01Å
311F44.8Very low42.4Very low209 Ų209149.7 Ų149.792%0.91780%0.795SS**PPolyproline II helixtrans-69.9122.7-180-147.6-97.9000110.4
312F45.3Very low42.3Very low190 Ų190152.4 Ų152.483%0.83380%0.796SS**PPolyproline II helixtrans-101.1131.7169.7-86.7-82.3000110.7P310P310-F312 PolarHBondContact O-N 3.01Å
313D40.6Very low42.4Very low131 Ų131152.3 Ų152.370%0.70180%0.795SS**PPolyproline II helixtrans-69.1148.5-179.9-17735000112.3S315D313-S315 PolarHBondContact OD2-OG 2.75Å
314K47.9Very low42Very low201 Ų201151.3 Ų151.387%0.87479%0.794SS**SBendtrans-114.256-155.6-160.7178.2-178-179.80112
315S48.3Very low41.7Very low88 Ų88151.2 Ų151.262%0.61579%0.793SS**SBendtrans-139.11.5-170.7620000116.9D313D313-S315 PolarHBondContact OD2-OG 2.75Å
316N42.2Very low41.6Very low153 Ų153151.4 Ų151.482%0.81879%0.794SS**SBendtrans-149.547.3-175.5-144.8-97.5000117.3
317I43.6Very low41.4Very low151 Ų151150.8 Ų150.877%0.77479%0.79SS**  trans-126.3-16.4179.4-48.5179.7000113.6K319I317-K319 PolarHBondContact O-N 3.23Å
318E45Very low41.1Very low205 Ų205153.4 Ų153.496%0.95880%0.796SS**THydrogen-bonded Turntrans-7414.9-172.4-61.4-170.1148.700116.5
319K48.2Very low40.9Very low181 Ų181148.4 Ų148.479%0.78780%0.799SS**THydrogen-bonded Turntrans-108.1-13.5-175.8-111.6-177.3-178.7-179.10117.4I317I317-K319 PolarHBondContact O-N 3.23Å
320Y48.1Very low39.9Very low204 Ų204146.3 Ų146.380%0.880%0.799SS**SBendtrans-144.8100.9177.7-67.7-78.3000111.8
321M39.2Very low40.1Very low183 Ų183148 Ų14890%0.90181%0.81SS**  trans148.8114.9142.5-80.5-59.416700110.3
322Y33.5Very low39.5Very low204 Ų204146.5 Ų146.580%0.880%0.804SS**  trans-137.8110.4169.4-168.4-89.8000109.6A324Y322-A324 HydrophobicContact CE1-CB 4.3Å
323P45.5Very low39.3Very low118 Ų118143.4 Ų143.477%0.76680%0.803SS**  trans-88.8126.5162.3-2.922.6000109.1
324A30.3Very low39.3Very low94 Ų94148.2 Ų148.278%0.77781%0.811SS**  trans-69.9137.9-179.900000112.3Y322Y322-A324 HydrophobicContact CE1-CB 4.3Å
325A31.4Very low38.6Very low95 Ų95147 Ų14779%0.78581%0.813SS**  trans-107.7128.6176.900000111.6
326A32.2Very low37.7Very low105 Ų105152.9 Ų152.987%0.86882%0.823SS**  trans172.9139.8155.700000107.4
327A30.2Very low37.8Very low84 Ų84150.9 Ų150.969%0.69482%0.819SS**  cis-151.3145.59.600000112.9
328L34.8Very low37.1Very low173 Ų173147.2 Ų147.291%0.90681%0.811SS**  trans43.5108.4135.3-54.3173.4000120.7
329A32.7Very low36.6Very low107 Ų107145.5 Ų145.588%0.88480%0.803SS**  -179.2129113.400000112.2
330S32.9Very low35.8Very low113 Ų113141.8 Ų141.879%0.7981%0.806SS**  trans-94170.6166.755.20000110
331P45.5Very low35Very low118 Ų118137.3 Ų137.377%0.76680%0.804SS**  cis-137.5179.216.641.3-21.9000117.4
332F32.6Very low34.8Very low179 Ų179132.7 Ų132.779%0.78580%0.796SS**  trans-59.1159.7166.3-82-93.7000112.8
333P41.5Very low34.8Very low124 Ų124127.4 Ų127.481%0.80579%0.794SS**  -136.5157.899.534.4-21.6000115.4
334W39.3Very low34.3Very low233 Ų233126.7 Ų126.788%0.88380%0.798SS**  trans-63.7154.9171.6-71.415.4000113.3
335L32.8Very low34.6Very low175 Ų175126.8 Ų126.892%0.91680%0.799SS**  trans-166.7125.9140.5-102154.8000111.4
336Y29.7Very low34.8Very low211 Ų211126.7 Ų126.783%0.82780%0.798SS**  trans-101.2164.5157.8-131.1-117.3000106.2
337P44.8Very low34.9Very low111 Ų111126.2 Ų126.272%0.72179%0.794SS**  cis-153.2169.638.342.5-21.3000120.4
338A28.8Very low35.2Very low75 Ų75127.3 Ų127.362%0.6280%0.803SS**  trans64.9149.5153.100000118
339H35.2Very low35.1Very low169 Ų169124 Ų12478%0.78280%0.801SS**  cis-169.4146.923.839.9-74.6000111.6
340A30Very low35.1Very low103 Ų103123.3 Ų123.385%0.85180%0.795SS**  trans59.8159.716200000118.2
341S31.7Very low34.9Very low109 Ų109122 Ų12276%0.76279%0.791SS**  cis-157.4165.6-2.398.70000110.6
342A35.1Very low34.3Very low87 Ų87126.1 Ų126.172%0.71980%0.797SS**  trans62.1112.816300000118.2
343A33.4Very low34.9Very low93 Ų93123.3 Ų123.377%0.76980%0.797SS**  67.1108.982.100000113
344A35.2Very low34.3Very low103 Ų103121 Ų12185%0.85180%0.795SS**  66.8130.873.300000112.5
345A36.8Very low34Very low95 Ų95118 Ų11879%0.78580%0.796SS**  cis-159.2-175.83.600000112.8
346A35.7Very low33.8Very low93 Ų93115.2 Ų115.277%0.76979%0.791SS**  trans-31.9141.9160.500000115
347A34.7Very low33.8Very low96 Ų96109.6 Ų109.679%0.79379%0.788SS**  cis99.2140.14100000114.7
348A35.7Very low33.3Very low106 Ų106112.3 Ų112.388%0.87679%0.79SS**  trans75.8114.816100000120.9
349A33Very low33.3Very low104 Ų104116.7 Ų116.786%0.8680%0.803SS**  175.8161.6126.900000109
350A32.2Very low33Very low93 Ų93111.7 Ų111.777%0.76980%0.797SS**  cis167.4137.9-37.500000107.1
351A29.8Very low32.8Very low84 Ų84112.2 Ų112.269%0.69480%0.802SS**  trans69.2113.6159.600000121.9
352F32Very low32.7Very low205 Ų205111.7 Ų111.790%0.89980%0.804SS**  44.7163.4116.5-63.9-63.3000122.6
353P45.7Very low32.6Very low121 Ų121111.7 Ų111.779%0.78680%0.803SS**  cis-139.5166.5-26.835-16.3000116.2
354G27.8Very low32.4Very low74 Ų74116 Ų11676%0.76381%0.808SS**  trans103.4144130.800000122.7
355L33.8Very low32.6Very low171 Ų171115.8 Ų115.890%0.89580%0.798SS**  trans83.2103.3149.2-60.1176.9000123.3
356S29.1Very low32.3Very low117 Ų117119.6 Ų119.682%0.81880%0.796SS**  86.1156.6111.4-146.60000123.8
357A30.4Very low31.9Very low92 Ų92120.5 Ų120.576%0.7679%0.788SS**  trans81.787.5155.700000121.6
358H33.6Very low31.7Very low168 Ų168120.5 Ų120.578%0.77878%0.783SS**  trans-33.6137.1145.6169.8-75.6000118.3
359L29.5Very low31.3Very low167 Ų167124.2 Ų124.287%0.87478%0.782SS**  trans173.6143.7143-95150.3000107.1
360G28.5Very low31.1Very low65 Ų65126.4 Ų126.467%0.6778%0.778SS**  cis154126.61.500000107.6
361A25.8Very low31.1Very low114 Ų114129.3 Ų129.394%0.94278%0.776SS**  trans-142.5132.5-17800000111.6
362A28.7Very low31Very low98 Ų98131.5 Ų131.581%0.8178%0.776SS**  trans-121.6148.9-176.300000112.8
363A32.9Very low31Very low86 Ų86128.8 Ų128.871%0.71177%0.771SS**  trans64.6122.9152.800000120.9
364Q29.6Very low30.3Very low185 Ų185127.7 Ų127.786%0.86477%0.766SS**  trans-141.2159.1134-82.5-52.3-81.100110.3
365P39.6Very low30.5Very low98 Ų98127.4 Ų127.464%0.63676%0.763SS**  trans-133.3-169.5-149.142.2-24.6000116.1
366K29.4Very low30.6Very low174 Ų174124.4 Ų124.476%0.75776%0.756SS**  trans74.9154.5162.1-76.4177153.9-112.10117.2
367D27.2Very low30.9Very low112 Ų112129.6 Ų129.660%0.59976%0.758SS**  cis-159.9161-4.9-112.9-28.5000106.3
368S31.6Very low30.8Very low96 Ų96134.2 Ų134.267%0.67176%0.764SS**  cis-176.4147.9-16-122.50000107.9
369Q27.1Very low30.9Very low184 Ų184130.5 Ų130.586%0.8676%0.762SS**  trans-170.4117.1153.6-109.3177.9-100.500115.4
370L28.8Very low30.9Very low151 Ų151131.1 Ų131.179%0.79176%0.761SS**  trans31.2131.1133.6-64167.4000119.1
371Q31.6Very low31.1Very low154 Ų154132.1 Ų132.172%0.7276%0.763SS**  -172.4157.353.2-132.5176.6-50.900113.7
372D27.7Very low31.3Very low129 Ų129132.7 Ų132.769%0.6976%0.76SS**  trans51.2116.7151.8-58.9-25000120.8
373D32.5Very low31.6Very low149 Ų149133 Ų13380%0.79776%0.756SS**  91.5129.481.3-167.1-96.9000110.9
374S31.2Very low32.2Very low97 Ų97133.8 Ų133.868%0.67875%0.754SS**  cis-147.3155.121.45.10000109.7
375G32.3Very low32.3Very low69 Ų69132.9 Ų132.971%0.71175%0.75SS**  76.7131.790.400000113.9
376S34.9Very low31.9Very low107 Ų107136.4 Ų136.475%0.74876%0.757SS**  cis-165.81514.8-62.50000112
377R35.2Very low32Very low226 Ų226137.1 Ų137.185%0.85376%0.763SS**  trans66.1123.2150.1-68.9166.5177171.4-1.8117.9
378E29.8Very low32.3Very low190 Ų190139.9 Ų139.989%0.88877%0.773SS**  cis61.4127.848.7-53.3-156.5138.900113.3
379A34.6Very low32.3Very low89 Ų89142.5 Ų142.574%0.73677%0.774SS**  cis-154.7-164.4-5.900000108.2
380E30.3Very low32.7Very low180 Ų180139.2 Ų139.284%0.84177%0.767SS**  cis-156146.111.1-141.9-161.911900112.9
381A32Very low33.7Very low86 Ų86138.3 Ų138.371%0.71177%0.77SS**  trans48.6114.5138.800000124.2
382S30.8Very low33.7Very low126 Ų126135.2 Ų135.288%0.88177%0.771SS**  -164.1150.9116.2-171.20000111.6
383S34.3Very low34.2Very low104 Ų104134.5 Ų134.573%0.72778%0.776SS**  trans-97-176.6179.9-126.30000111.4
384P46.7Very low34.4Very low103 Ų103134.8 Ų134.867%0.66978%0.777SS**  -131.9-160.1-51.730.5-8.5000112
385E30.9Very low34.7Very low167 Ų167138.1 Ų138.178%0.7879%0.787SS**  trans102.1128.9148.1-81.3-176.1165.600122.6
386E31Very low35.1Very low171 Ų171138.5 Ų138.580%0.79979%0.791SS**  trans57.6116.3141.9-50.2-91.69700120.8
387H32.6Very low35.3Very low190 Ų190143.2 Ų143.288%0.8880%0.802SS**  -161.9129128.3-133.4-70.4000113.2
388E32Very low35.3Very low170 Ų170136.4 Ų136.479%0.79480%0.802SS**  trans-117.3177.1159.3-144.1-162.7139.200110
389E32.2Very low35.6Very low151 Ų151134.4 Ų134.471%0.70680%0.797SS**  trans80.3113.6156.8-115.6-170.4113.400122.9
390T35.1Very low35.9Very low115 Ų115136 Ų13671%0.70680%0.797SS**  trans68.5132.9141.645.90000123.4
391P49.6Very low36.2Very low131 Ų131134.4 Ų134.485%0.85180%0.795SS**  trans-95164.5163.538.7-32.9000112.8
392A31.9Very low36.4Very low89 Ų89136.8 Ų136.874%0.73680%0.795SS**  trans-124.1152.5177.200000112.4
393S37.4Very low36.6Very low114 Ų114136.8 Ų136.880%0.79779%0.79SS**  trans42.1133.7148.8-47.30000121.5
394D38.5Very low36.6Very low155 Ų155137 Ų13783%0.82979%0.792SS**  -174.2143.599.9-155.9-139.1000111.4
395D37.8Very low37Very low167 Ų167137.2 Ų137.289%0.89379%0.793SS**  trans-114.8129.9173.3-84.7-67.8000109.1
396G39.7Very low37Very low77 Ų77135.8 Ų135.879%0.79479%0.791SS**  trans-144.9129.9-17700000114
397E38.8Very low37.2Very low207 Ų207133.4 Ų133.497%0.96779%0.793SS**  trans-81.6156.3-175.3-55.8176.5109.200113.6
398G36.3Very low37.3Very low83 Ų83133.4 Ų133.486%0.85679%0.791SS**  trans-179.3133.9170.800000113.7
399D34.5Very low37.3Very low148 Ų148133.1 Ų133.179%0.79180%0.795SS**  trans-126.3152.6-163.7-171.2-148.7000112.7
400V41.4Very low37.4Very low121 Ų121131.2 Ų131.273%0.73380%0.798SS**  trans47.5145.7174-99.20000119.6
401D36.4Very low38.1Very low148 Ų148130.8 Ų130.879%0.79180%0.797SS**  -164-16657.6-160.9-104.6000113
402D35.6Very low37.3Very low135 Ų135132 Ų13272%0.72279%0.791SS**  trans-104-174.1-155.2-163.4-88.6000114.7
403T36.1Very low37.4Very low126 Ų126135 Ų13577%0.77379%0.79SS**  trans94.3120.3156.54.20000121.8
404S34.1Very low37.4Very low109 Ų109137.5 Ų137.576%0.76279%0.789SS**  trans-81.1-173.5167.2-97.70000113.2
405P56Low37.2Very low108 Ų108137.9 Ų137.970%0.70179%0.79SS**  cis-138.3-159.2-29.535.4-14000113.3
406D30.4Very low37.1Very low137 Ų137135.3 Ų135.373%0.73379%0.786SS**  trans84.2109.5148.8-110.8-60.5000120.6
407S35.1Very low37.2Very low121 Ų121136 Ų13685%0.84678%0.784SS**  -173.3133.1118.6-83.90000114.9
408K34.1Very low37.4Very low189 Ų189132.6 Ų132.682%0.82278%0.781SS**  trans-39.6146.5171.3-62.4156.6174.5167.10116.6
409N32.4Very low38.1Very low165 Ų165137 Ų13788%0.88278%0.78SS**  -161.4131.4118.4-128.4-20.4000115.7
410S34Very low38.7Very low111 Ų111136.2 Ų136.278%0.77678%0.78SS**  trans-174.8141.5163.5-153.10000106.7
411P50.2Low39.2Very low105 Ų105139.3 Ų139.368%0.68281%0.807SS**  -156.6-17983.140.9-20.9000117.5
412Q32.6Very low39.4Very low157 Ų157138.9 Ų138.973%0.73481%0.808SS**  trans72.8146.1155.9-99.1176.3-92.700118.3
413E33.3Very low39.6Very low152 Ų152139.1 Ų139.171%0.7181%0.813SS**  cis-136.5144.39.8-60.4-163.3117.800110
414Q37.6Very low39.8Very low167 Ų167139.8 Ų139.878%0.7882%0.815SS**  88.6154.962.6-133-174.534.100115.6
415L34.8Very low40.1Very low162 Ų162141.6 Ų141.685%0.84882%0.818SS**  trans88.4141.5-178.3-53.3176.5000117.3
416S35.8Very low39.1Very low114 Ų114143.8 Ų143.880%0.79783%0.825SS**  cis-161.8162.4-24.1-166.10000109.9
417A42.3Very low39.7Very low91 Ų91144.2 Ų144.275%0.75283%0.832SS**  trans-88.5153.7-17800000113.9
418C42.4Very low40Very low135 Ų135145.9 Ų145.991%0.91283%0.831SS**  trans-82.5144.9169.6-67.70000112
419Q51.5Low40.5Very low177 Ų177142.5 Ų142.583%0.82783%0.831SS**  trans-112.8-178.4174.5-80.6-173.923.900111
420T46.7Very low41.2Very low131 Ų131140.7 Ų140.780%0.80483%0.827SS**  trans91.6137.5164.582.10000115.6
421S52.6Low41.8Very low186 Ų186143.4 Ų143.4100%1.30183%0.832SS**  cis-149.20-3-150.20000113.6

Retrieved 421 of 421 residues in 126.5 ms (Link to these results)