A0A087Y2T9_POEFO Loading...

Cyclic AMP-responsive element-binding protein 3-like protein 2

AlphaFold DB , UniProt , Accession A0A087Y2T9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 541 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
1M40.6Very low36.4Very low231 Ų231151.8 Ų151.8100%1.13882%0.818SS**  096.60-168.5165.2-177.700105
2E36Very low36Very low169 Ų169152.8 Ų152.879%0.7981%0.813SS**  trans-67.2150.9-171.4-66.895.5152.500112.2
3I34.7Very low36.2Very low168 Ų168158.7 Ų158.786%0.86282%0.818SS**  trans-96.2110.6168-56.3174.5000105.5
4L44.2Very low36Very low157 Ų157154.1 Ų154.182%0.82280%0.795SS**  trans-83121.2169.9-96.5121.4000109.3
5D38.5Very low36.4Very low143 Ų143159.3 Ų159.377%0.76580%0.8SS**  trans-87140.4167.5-178.916.8000109.8
6S31.9Very low36.4Very low103 Ų103156.8 Ų156.872%0.7279%0.791SS**  trans-167.677.3173.5-76.60000111.8
7S36.1Very low36.5Very low97 Ų97156.6 Ų156.668%0.67879%0.791SS**  trans45.7107.713864.90000120.3
8E32Very low36.4Very low198 Ų198154.3 Ų154.393%0.92579%0.792SS**  trans-128.9164.3133.8-74.1-159.9141.500109.2
9S38.3Very low36.4Very low107 Ų107155.6 Ų155.675%0.74879%0.794SS**  trans-143157.6-172.9-67.50000111.6
10L31.4Very low36.4Very low160 Ų160156.7 Ų156.784%0.83880%0.801SS**  trans66.9146.8-173.4-89.661.4000113.3
11L36.6Very low36.3Very low137 Ų137155 Ų15572%0.71780%0.803SS**  cis-123.71398.7-74163.4000112.3
12H32.4Very low36.4Very low163 Ų163153.2 Ų153.276%0.75579%0.792SS**  trans-85.3121.5162.5165.5-76.4000109.1D14H12-D14 PolarHBondContact O-N 2.96Å
13W37.6Very low36.5Very low230 Ų230150.2 Ų150.287%0.87180%0.796SS**  trans-74.4110.1175.4-73.990.7000110.5
14D34.3Very low36.5Very low94 Ų94146 Ų14650%0.50379%0.794SS.*  trans-69.8132.4176.9-166.8-4.3000111.2H12 N16H12-D14 PolarHBondContact O-N 2.96Å; D14-N16 PolarHBondContact OD1-N 3.02Å; D14-N16 PolarHBondContact OD1-ND2 3.4Å
15R41Very low36.6Very low232 Ų232148 Ų14888%0.87580%0.799SS**  trans-113.337.5-175.6-171.5135.168.8152.4-0.3112.4
16N37.5Very low36.9Very low120 Ų120149.1 Ų149.164%0.64280%0.804SS**  trans-120.49.9-180-63.4-79.6000114.1D14D14-N16 PolarHBondContact OD1-N 3.02Å; D14-N16 PolarHBondContact OD1-ND2 3.4Å
17L36.9Very low37.2Very low154 Ų154151.4 Ų151.481%0.80681%0.808SS**SBendtrans-98.622.7-175.3-66.2176.7000114.7
18S36.1Very low37.1Very low114 Ų114153 Ų15380%0.79782%0.819SS**SBendtrans-121.3-2.3-176-57.40000115.5
19E36.3Very low37.6Very low179 Ų179149.3 Ų149.384%0.83681%0.81SS**SBendtrans-112.223.6-173-62.2-169.9150.300114
20L35.9Very low38.1Very low178 Ų178151.3 Ų151.393%0.93281%0.812SS**  trans-125.133.5-179.4-68.9177.7000114
21S34.9Very low38.4Very low120 Ų120154 Ų15484%0.83981%0.812SS**SBendtrans-114.34.7175.4-166.50000114.5
22E41.6Very low38.5Very low195 Ų195153 Ų15391%0.91181%0.812SS**  trans-121.866.8-173-164.3174.9179.400112.6
23A38.1Very low38.5Very low106 Ų106150.9 Ų150.988%0.87681%0.806SS**  trans-162.4100.3164.400000110.1
24G34.1Very low39Very low79 Ų79147 Ų14781%0.81480%0.798SS**  trans-178.55.3-176.800000119.6L26G24-L26 PolarHBondContact O-N 3.35Å
25E46.5Very low39Very low199 Ų199149.9 Ų149.993%0.9381%0.806SS**  trans-7482177.2-69.1-165.9130.500112.5
26L44.7Very low39.2Very low166 Ų166143 Ų14387%0.86979%0.793SS**SBendtrans-163.145.9168.7-118.6163.1000117.7G24G24-L26 PolarHBondContact O-N 3.35Å
27D38.4Very low39.4Very low151 Ų151144.4 Ų144.481%0.80780%0.796SS**SBendtrans-151.1-5.7163.1-141.35.3000117V29D27-V29 VanDerWaalsContact C-N 3.28Å; D27-V29 PolarHBondContact O-N 3.04Å
28S34.8Very low39.8Very low131 Ų131143.7 Ų143.792%0.91679%0.792SS**THydrogen-bonded Turntrans-86.542.2-171.9-154.70000114.8
29V43.1Very low40.4Very low120 Ų120143.2 Ų143.273%0.72778%0.78SS**THydrogen-bonded Turntrans-112.8-10.2-168.7-178.70000114.1D27D27-V29 VanDerWaalsContact C-N 3.28Å; D27-V29 PolarHBondContact O-N 3.04Å
30L48.5Very low40.8Very low150 Ų150141.3 Ų141.379%0.78578%0.776SS**SBendtrans-119.910.6-166.7-70.6177.6000117.5
31Y36.3Very low41.1Very low215 Ų215139.9 Ų139.984%0.84377%0.769SS**  trans-137.359.8176.1-97.7-75000115.3N33Y31-N33 PolarHBondContact O-N 2.99Å
32T38.6Very low41.6Very low116 Ų116140.3 Ų140.371%0.71276%0.762SS**  trans-65.5121.3162.6-49.20000110.6
33N34Very low41.9Very low120 Ų120134 Ų13464%0.64274%0.738SS**  trans-148.281.4169-88.6-69.4000112.1Y31 F35Y31-N33 PolarHBondContact O-N 2.99Å; N33-F35 PolarHBondContact O-N 3.38Å
34H46.6Very low42.5Very low148 Ų148133.4 Ų133.469%0.68573%0.726SS**SBendtrans29.565.5142.8-51.9-68.1000118.2
35F35Very low43.1Very low154 Ų154137 Ų13768%0.67572%0.721SS**  trans-145-26.9163.2-152.5-96.3000114N33 E37 L38N33-F35 PolarHBondContact O-N 3.38Å; F35-E37 VanDerWaalsContact C-N 3.33Å; F35-E37 PolarHBondContact O-N 2.94Å; F35-L38 PolarHBondContact O-N 2.95Å
36S44.3Very low43.5Very low88 Ų88130.6 Ų130.662%0.61570%0.703SS**G310 helixtrans-64.5-31.6-179-50.20000114.3L38 L39S36-L38 PolarHBondContact O-N 3.28Å; S36-L39 PolarHBondContact O-N 3.38Å
37E42.3Very low43.7Very low150 Ų150128.9 Ų128.970%0.70169%0.694SS**G310 helixtrans-60.6-12.8179.7-67.2176.412600113.8F35F35-E37 VanDerWaalsContact C-N 3.33Å; F35-E37 PolarHBondContact O-N 2.94Å
38L46.1Very low44.3Very low138 Ų138127.1 Ų127.172%0.72368%0.684SS**G310 helixtrans-97.10.9174.9-118.291.7000114.6F35 S36F35-L38 PolarHBondContact O-N 2.95Å; S36-L38 PolarHBondContact O-N 3.28Å
39L48.3Very low45.1Very low105 Ų105123.1 Ų123.155%0.5566%0.663SS.*THydrogen-bonded Turntrans-112.5-26.1-177.4-65.7177.1000113.4S36 D41 L42S36-L39 PolarHBondContact O-N 3.38Å; L39-D41 PolarHBondContact O-N 3.05Å; L39-L42 PolarHBondContact O-N 3.48Å
40D43.6Very low45.6Very low139 Ų139124.2 Ų124.274%0.74366%0.66SS**THydrogen-bonded Turntrans-68-22.8176.8-69.3-34.4000113.1L42D40-L42 PolarHBondContact O-N 2.83Å
41D43.5Very low45.4Very low148 Ų148124.1 Ų124.179%0.79166%0.66SS**THydrogen-bonded Turntrans-71.4-9.2174.2-90.1-11.9000113.8L39 S43L39-D41 PolarHBondContact O-N 3.05Å; D41-S43 PolarHBondContact O-N 3.49Å
42L45.8Very low46Very low129 Ų129121.2 Ų121.268%0.67566%0.658SS**  trans-102.954.1-178.1-70.5175000112.9L39 D40L39-L42 PolarHBondContact O-N 3.48Å; D40-L42 PolarHBondContact O-N 2.83Å
43S47.4Very low46.3Very low61 Ų61118.7 Ų118.743%0.42765%0.645SS.*  trans-61.6127.2171.6177.10000111.8D41 E45 A46D41-S43 PolarHBondContact O-N 3.49Å; S43-E45 PolarHBondContact O-N 2.74Å; S43-E45 PolarHBondContact OG-N 3.31Å; S43-A46 PolarHBondContact O-N 2.97Å
44P50.4Low46.5Very low95 Ų95116.5 Ų116.562%0.61763%0.633SS**Hα-helixtrans-65.3-24.317926.9-34.5000112.9A46 L47 L48P44-A46 VanDerWaalsContact C-N 3.32Å; P44-A46 PolarHBondContact O-N 3.42Å; P44-L47 PolarHBondContact O-N 3.22Å; P44-L48 PolarHBondContact O-N 3.36Å
45E47.4Very low46.7Very low153 Ų153114.1 Ų114.172%0.71563%0.631SS**Hα-helixtrans-62.5-39.9177.1-145.572.5-16000111.4S43 G49S43-E45 PolarHBondContact O-N 2.74Å; S43-E45 PolarHBondContact OG-N 3.31Å; E45-G49 PolarHBondContact O-N 3.35Å; E45-G49 VanDerWaalsContact O-N 3.15Å
46A54.1Low47Very low65 Ų65115.9 Ų115.954%0.53764%0.639SS.*Hα-helixtrans-70.1-35.7179.700000112.1S43 P44 G49 Q50S43-A46 PolarHBondContact O-N 2.97Å; P44-A46 VanDerWaalsContact C-N 3.32Å; P44-A46 PolarHBondContact O-N 3.42Å; A46-G49 PolarHBondContact O-N 3.06Å; A46-Q50 PolarHBondContact O-N 3.42Å
47L49Very low46.9Very low130 Ų130119 Ų11968%0.68165%0.647SS**Hα-helixtrans-68.8-37.7179.5-148.181.8000111.9P44 L51P44-L47 PolarHBondContact O-N 3.22Å; L47-L51 PolarHBondContact O-N 3.28Å
48L51.8Low47.1Very low115 Ų115116.5 Ų116.560%0.60265%0.647SS**Hα-helixtrans-65-43.8171.5-9877.6000111.8P44 Q50 L51 L52P44-L48 PolarHBondContact O-N 3.36Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; L48-Q50 PolarHBondContact O-N 2.96Å; L48-L51 PolarHBondContact O-N 3.17Å; L48-L52 WeakPolarHBondContact O-CG 3.42Å; L48-L52 PolarHBondContact O-N 3.2Å
49G51.2Low46.5Very low46 Ų46113.4 Ų113.447%0.47465%0.648SS.*Hα-helixtrans-59-44.1177.500000112.6E45 A46E45-G49 PolarHBondContact O-N 3.35Å; E45-G49 VanDerWaalsContact O-N 3.15Å; A46-G49 PolarHBondContact O-N 3.06Å
50Q53Low46Very low144 Ų144115.4 Ų115.467%0.67366%0.659SS**Hα-helixtrans-67.4-40.3-179.2-159.368.960.200112.3A46 L48 L52 S53A46-Q50 PolarHBondContact O-N 3.42Å; L48-Q50 VanDerWaalsContact C-N 3.34Å; L48-Q50 PolarHBondContact O-N 2.96Å; Q50-L52 VanDerWaalsContact C-N 3.31Å; Q50-L52 PolarHBondContact O-N 3.15Å; Q50-S53 PolarHBondContact NE2-OG 3.08Å; Q50-S53 PolarHBondContact O-N 3.21Å; Q50-S53 PolarHBondContact O-OG 3.46Å
51L44.6Very low45.7Very low147 Ų147118.6 Ų118.677%0.7767%0.667SS**Hα-helixtrans-66.9-29.6-178.7-171.165.8000113.2L47 L48 S53L47-L51 PolarHBondContact O-N 3.28Å; L48-L51 PolarHBondContact O-N 3.17Å; L51-S53 VanDerWaalsContact C-N 3.26Å; L51-S53 PolarHBondContact O-N 3.15Å
52L48.3Very low45.2Very low154 Ų154114.9 Ų114.981%0.80666%0.663SS**THydrogen-bonded Turntrans-81.7-0.9176.9-68.1170.7000113.7L48 Q50L48-L52 WeakPolarHBondContact O-CG 3.42Å; L48-L52 PolarHBondContact O-N 3.2Å; Q50-L52 VanDerWaalsContact C-N 3.31Å; Q50-L52 PolarHBondContact O-N 3.15Å
53S45.2Very low44.5Very low63 Ų63112.1 Ų112.144%0.44167%0.666SS.*THydrogen-bonded Turntrans-108.125-174.3690000114.4Q50 L51 P55Q50-S53 PolarHBondContact NE2-OG 3.08Å; Q50-S53 PolarHBondContact O-N 3.21Å; Q50-S53 PolarHBondContact O-OG 3.46Å; L51-S53 VanDerWaalsContact C-N 3.26Å; L51-S53 PolarHBondContact O-N 3.15Å; S53-P55 WeakPolarHBondContact O-CD 3.45Å
54D39Very low44Very low75 Ų75115.9 Ų115.940%0.40169%0.686SS.*  trans-70.6118.1-179.6-168.5-20.4000112.4F56 L57D54-F56 PolarHBondContact O-N 3.23Å; D54-F56 WeakPolarHBondContact OD1-CB 3.42Å; D54-F56 WeakPolarHBondContact OD1-CD2 3.47Å; D54-F56 PolarHBondContact OD1-N 3.15Å; D54-L57 PolarHBondContact O-N 3.25Å
55P49.8Very low43.3Very low98 Ų98120.1 Ų120.164%0.63670%0.698SS**G310 helixtrans-60-24.4176.6-23.535.3000114.5S53 L57 S58S53-P55 WeakPolarHBondContact O-CD 3.45Å; P55-L57 PolarHBondContact O-N 3.26Å; P55-S58 WeakPolarHBondContact O-CB 3.48Å; P55-S58 PolarHBondContact O-N 2.99Å
56F42.3Very low43Very low191 Ų191118.3 Ų118.384%0.83870%0.702SS**G310 helixtrans-71.8-10.9-177.6-70.8-76000114.1D54D54-F56 PolarHBondContact O-N 3.23Å; D54-F56 WeakPolarHBondContact OD1-CB 3.42Å; D54-F56 WeakPolarHBondContact OD1-CD2 3.47Å; D54-F56 PolarHBondContact OD1-N 3.15Å
57L42.8Very low42.2Very low152 Ų152123.7 Ų123.780%0.79672%0.718SS**G310 helixtrans-89.2-11.2168.7-62.7177.6000113.1D54 P55 G59D54-L57 PolarHBondContact O-N 3.25Å; P55-L57 PolarHBondContact O-N 3.26Å; L57-G59 VanDerWaalsContact C-N 3.33Å; L57-G59 PolarHBondContact O-N 3.35Å; L57-G59 VanDerWaalsContact O-N 3.08Å
58S45.8Very low41.6Very low99 Ų99126.3 Ų126.369%0.69273%0.727SS**SBendtrans-85.971.8178-62.10000110.9P55 D60P55-S58 WeakPolarHBondContact O-CB 3.48Å; P55-S58 PolarHBondContact O-N 2.99Å; S58-D60 PolarHBondContact O-N 3.45Å
59G32.8Very low40.8Very low73 Ų73124.9 Ų124.975%0.75374%0.739SS**  trans-56.8119.4-176.700000113.7L57L57-G59 VanDerWaalsContact C-N 3.33Å; L57-G59 PolarHBondContact O-N 3.35Å; L57-G59 VanDerWaalsContact O-N 3.08Å
60D38.2Very low40.4Very low146 Ų146132 Ų13278%0.78176%0.76SS**  trans-58.8135179.7171.736.8000113.1S58 G62S58-D60 PolarHBondContact O-N 3.45Å; D60-G62 PolarHBondContact OD1-N 3.34Å
61K36.5Very low39.8Very low207 Ų207133.2 Ų133.290%0.977%0.771SS**  trans-153.268.1151.3-120.1-176-175.1-173.80112.3
62G33.2Very low39.6Very low69 Ų69129.4 Ų129.471%0.71177%0.768SS**  trans-64.6140.1160.800000111.8D60D60-G62 PolarHBondContact OD1-N 3.34Å
63G32Very low38.9Very low71 Ų71126 Ų12673%0.73277%0.77SS**  trans166.286.4178.100000116.1
64V36.1Very low38.8Very low140 Ų140131.5 Ų131.585%0.84879%0.789SS**  trans-19.2132.2157.9-140.30000114.3
65E35.2Very low38.7Very low185 Ų185135.3 Ų135.386%0.86481%0.809SS**  -174.6170.784.1-87.3-168.814400112.9
66S42.3Very low38.1Very low114 Ų114136.2 Ų136.280%0.79782%0.817SS**  trans-110.3137.4178.3-52.30000112
67M36.5Very low38Very low178 Ų178133.1 Ų133.188%0.87782%0.816SS**  trans-157.9152.3152.5-15559.172.200112.2
68E37.8Very low37.5Very low186 Ų186131.7 Ų131.787%0.86982%0.819SS**  trans-80159.3168.1-58161.3119.800110.6
69G34.9Very low37Very low84 Ų84132.4 Ų132.487%0.86682%0.824SS**  trans172.3147.417200000115.2
70E41.4Very low37.5Very low196 Ų196134.9 Ų134.992%0.91683%0.827SS**  trans-105.7158.7178.4-67.1-177.984.900113
71D41Very low37.8Very low169 Ų169135.6 Ų135.690%0.90483%0.829SS**  trans70.3145.7150.3-159.732.1000122
72G39.4Very low38.3Very low68 Ų68130.8 Ų130.870%0.70182%0.819SS**  trans84.7111147.800000120.4
73G34.8Very low39.1Very low83 Ų83133.3 Ų133.386%0.85682%0.823SS**  trans147.7118.115200000117.2
74E42.6Very low39.6Very low178 Ų178137.7 Ų137.783%0.83282%0.824SS**  trans-77.2149.1178.3-55.1174.3120.300114
75L37Very low39.9Very low155 Ų155138.7 Ų138.781%0.81282%0.823SS**  158144.6109.9-82.6-179.4000114.4
76S36.7Very low40.1Very low116 Ų116133.6 Ų133.681%0.81181%0.805SS**  trans109.3147.7163.4-50.70000116.7
77P40.8Very low40.7Very low127 Ų127133.1 Ų133.183%0.82581%0.808SS**PPolyproline II helixtrans-100.9145.7-148.236.9-35000115.7
78S33.4Very low41.4Very low122 Ų122131.2 Ų131.285%0.85380%0.797SS**PPolyproline II helixtrans-88135.6167.1-68.80000112
79S35.3Very low41.8Very low113 Ų113130.1 Ų130.179%0.7979%0.791SS**PPolyproline II helixtrans-70153.1162.9-74.40000111
80P42Very low42.3Very low125 Ų125131.6 Ų131.681%0.81279%0.789SS**PPolyproline II helixtrans-71.1132.5-172.627.9-35000113.1
81L45.8Very low42.6Very low161 Ų161132.4 Ų132.484%0.84379%0.785SS**PPolyproline II helixtrans-68.2140.6172.4-162.672.9000110.5
82P46.3Very low43.1Very low106 Ų106129.4 Ų129.469%0.68878%0.777SS**PPolyproline II helixtrans-62141.8176.324.7-34.4000111.7H84P82-H84 PolarHBondContact O-N 3.38Å
83P50.3Low43.3Very low122 Ų122134.8 Ų134.879%0.79279%0.789SS**PPolyproline II helixtrans-70124.4-170.826.7-34.5000112.8I85P83-I85 PolarHBondContact O-N 3.07Å
84H41.1Very low43.7Very low163 Ų163136.6 Ų136.676%0.75579%0.787SS**  trans-68.6113.6173.2178.3-79.8000110.7P82 T86P82-H84 PolarHBondContact O-N 3.38Å; H84-T86 PolarHBondContact O-N 3.46Å; H84-T86 VanDerWaalsContact O-N 3.17Å
85I42.5Very low43.5Very low161 Ų161131.5 Ų131.583%0.82678%0.783SS**  trans-72.8106.4178.4-57.7174.4000109P83P83-I85 PolarHBondContact O-N 3.07Å
86T40.7Very low43.8Very low78 Ų78131.2 Ų131.248%0.47978%0.782SS.*  trans-82.4127.6172.563.40000111H84 E88H84-T86 PolarHBondContact O-N 3.46Å; H84-T86 VanDerWaalsContact O-N 3.17Å; T86-E88 VanDerWaalsContact C-N 3.27Å; T86-E88 WeakPolarHBondContact CB-OE1 3.32Å; T86-E88 PolarHBondContact O-N 2.94Å; T86-E88 VanDerWaalsContact O-N 3.14Å; T86-E88 PolarHBondContact OG1-OE1 3.36Å
87A53.8Low44Very low105 Ų105131.2 Ų131.287%0.86878%0.782SS**  trans-89.645.6-171.800000112.9
88E52.4Low44.5Very low137 Ų137136 Ų13664%0.6478%0.784SS**  trans-117.746.1-165.663-162151.200114.4T86T86-E88 VanDerWaalsContact C-N 3.27Å; T86-E88 WeakPolarHBondContact CB-OE1 3.32Å; T86-E88 PolarHBondContact O-N 2.94Å; T86-E88 VanDerWaalsContact O-N 3.14Å; T86-E88 PolarHBondContact OG1-OE1 3.36Å
89H44.9Very low45.1Very low163 Ų163136.1 Ų136.176%0.75578%0.781SS**  trans-117.766.2168.1-72-3.4000111.2Y91H89-Y91 HydrophobicContact CB-CE2 4.44Å; H89-Y91 PolarHBondContact O-N 3.41Å
90S47.1Very low45.4Very low116 Ų116139.8 Ų139.881%0.81179%0.786SS**  trans-71.8102.1171.2-68.90000110.6S92S90-S92 PolarHBondContact O-N 3.25Å
91Y46.8Very low45.2Very low213 Ų213139.1 Ų139.184%0.83578%0.784SS**  trans-81.2109.4171.9-83.3-85.1000111H89 L93H89-Y91 HydrophobicContact CB-CE2 4.44Å; H89-Y91 PolarHBondContact O-N 3.41Å; Y91-L93 PolarHBondContact O-N 3.43Å
92S52.3Low45Very low106 Ų106137.5 Ų137.574%0.74178%0.784SS**  trans-63.6128.1175.8-60.50000112.2S90 C94S90-S92 PolarHBondContact O-N 3.25Å; S92-C94 VanDerWaalsContact C-N 3.34Å; S92-C94 PolarHBondContact O-N 2.87Å
93L44.1Very low44.5Very low181 Ų181139.4 Ų139.495%0.94879%0.787SS**  trans-71.384.3168.4-87.2155.9000110.7Y91Y91-L93 PolarHBondContact O-N 3.43Å
94C43Very low43.8Very low120 Ų120139.3 Ų139.381%0.81179%0.789SS**  trans-80.8129.5158.8-71.60000109S92S92-C94 VanDerWaalsContact C-N 3.34Å; S92-C94 PolarHBondContact O-N 2.87Å
95G38.1Very low43.5Very low72 Ų72139 Ų13974%0.74279%0.788SS**  trans-88.5174.2-16700000116.2
96D43.4Very low43.1Very low149 Ų149139.3 Ų139.380%0.79779%0.791SS**  trans46102.4155.4-162.418.6000119.9
97S41.3Very low42.6Very low116 Ų116142.2 Ų142.281%0.81181%0.808SS**  trans-161.8104.6138.4-830000110.3
98R50.7Low41.6Very low228 Ų228140.5 Ų140.586%0.8680%0.801SS**PPolyproline II helixtrans-68.5127.8166.7-81176.8166.6167.4-4.9110Q100R98-Q100 PolarHBondContact O-N 2.82Å
99P46.5Very low40.5Very low124 Ų124141.9 Ų141.981%0.80581%0.807SS**PPolyproline II helixtrans-68.1119.6166.328-32.1000109.7
100Q40.9Very low39.9Very low189 Ų189142.7 Ų142.788%0.88381%0.811SS**PPolyproline II helixtrans-70.6141.2176-68.2176.9-44.900111.2R98R98-Q100 PolarHBondContact O-N 2.82Å
101S38.1Very low39.1Very low111 Ų111140.4 Ų140.478%0.77681%0.806SS**PPolyproline II helixtrans-76.5135.9166.5-530000110.3L103S101-L103 PolarHBondContact O-N 3.36Å
102P41.7Very low38.4Very low128 Ų128134.9 Ų134.983%0.83180%0.798SS**PPolyproline II helixtrans-75.7122.318029.6-33.6000111.6
103L34.3Very low37.3Very low145 Ų145138.8 Ų138.876%0.75981%0.805SS**PPolyproline II helixtrans-78.9137.2168.6-81167.7000110.9S101S101-L103 PolarHBondContact O-N 3.36Å
104S37.2Very low36.8Very low121 Ų121133.9 Ų133.985%0.84679%0.791SS**PPolyproline II helixtrans-91.3126.7159.9-64.10000108.7
105H33.9Very low36.4Very low156 Ų156136.7 Ų136.772%0.72279%0.792SS**  trans-95.6-173178.1-78.1-92.1000111.9
106L33.5Very low36.2Very low168 Ų168137.1 Ų137.188%0.8878%0.783SS**  trans81.2123-168.9-47-179.8000111.6
107T31.1Very low35.7Very low138 Ų138136.7 Ų136.785%0.84778%0.781SS**  cis-145.4166.612-41.70000110.7
108G32.3Very low35.5Very low69 Ų69135.5 Ų135.571%0.71178%0.778SS**  trans-74.2-169170.400000113.5
109E30.5Very low34.6Very low167 Ų167132.5 Ų132.578%0.7878%0.779SS**  cis-166.4151.614.4-169.8-17863.500110.5
110H31.6Very low34.4Very low180 Ų180131.3 Ų131.383%0.83377%0.774SS**  trans59.4159.2178.7-59.4-58.7000116.1
111G30Very low34.8Very low68 Ų68127.6 Ų127.670%0.70177%0.766SS**  cis146.1140.8-0.300000109.1
112S32Very low34.3Very low97 Ų97128.6 Ų128.668%0.67876%0.763SS**  cis-161.9178.52.6-66.80000110.2
113E29.6Very low33.8Very low187 Ų187133.5 Ų133.587%0.87477%0.765SS**  trans67.5158.8162.1-68.4140.9-117.200118.5
114A34.3Very low33.4Very low79 Ų79131.2 Ų131.265%0.65377%0.767SS**  cis-169.8158.9-2900000110.3
115E34.3Very low32.8Very low179 Ų179133.2 Ų133.284%0.83677%0.765SS**  trans55.6178.2168.1-50.7-59.98100118
116S33.2Very low32.9Very low80 Ų80134 Ų13456%0.55977%0.769SS**  -150.8173.9-64.574.40000109.4
117D32.1Very low32.6Very low140 Ų140135.1 Ų135.175%0.74977%0.77SS**  trans40.6123.8155.2-42.3-45.9000120.4
118A38.9Very low32.6Very low91 Ų91136.5 Ų136.575%0.75277%0.767SS**  61.3109.158.500000114.7
119D31.8Very low32.7Very low165 Ų165142.5 Ų142.588%0.88278%0.776SS**  -170.5177.294.1-136.1-34.8000114
120S41.8Very low32.6Very low99 Ų99138.4 Ų138.469%0.69277%0.771SS**  trans-88.9-163.7170.5-1300000110.7
121P48.7Very low32.7Very low111 Ų111137.8 Ų137.872%0.72177%0.772SS**  cis-120.2-1320.127.4-0.2000111.5
122D28Very low32.6Very low132 Ų132143.6 Ų143.671%0.70678%0.781SS**  cis-159.4-158.77.9-155.668.8000112.8
123W30.4Very low32.4Very low231 Ų231142.1 Ų142.188%0.87578%0.781SS**  trans-108.4157.9-159.9-61.784.3000116.9
124A26.7Very low32.4Very low98 Ų98140.7 Ų140.781%0.8178%0.778SS**  trans-155.1105.4139.700000107.4
125M25.2Very low32Very low163 Ų163143.9 Ų143.980%0.80378%0.784SS**  86.1137.472.4-157.3-168.8117.200113.3
126E35.5Very low31.7Very low171 Ų171140.9 Ų140.980%0.79978%0.781SS**  trans-76160.5-174.6-53.7141.5121.800113.4
127Q27.5Very low31.4Very low193 Ų193143.1 Ų143.190%0.90279%0.791SS**  trans-154.5164.1134.1-159.2148.6-6.200112.8
128E31.5Very low31.4Very low167 Ų167142.6 Ų142.678%0.7879%0.793SS**  trans-122.7148.4-164.7159.8-169.5-126.600111
129E32.4Very low31.5Very low194 Ų194143.5 Ų143.591%0.90779%0.791SS**  trans-165.8125.9157-111.7172.7-165.700108.1
130A29.7Very low31.4Very low82 Ų82140.6 Ų140.668%0.67878%0.784SS**  cis107.375.99.600000116.6
131I33.4Very low30.9Very low167 Ų167144 Ų14486%0.85679%0.794SS**  trans-153.7119.4152.9-23169.9000105.7
132E28.2Very low30.2Very low189 Ų189146 Ų14688%0.88380%0.797SS**  cis90.2114.933-165.7170.9-147.600115.7
133G26.9Very low30.4Very low66 Ų66145.3 Ų145.368%0.6880%0.8SS**  trans106138.1158.900000117.2
134L29.3Very low30.2Very low157 Ų157139.6 Ų139.682%0.82279%0.791SS**  cis-151.5143-5.6-85.5171.5000111.7
135L27.1Very low30.3Very low147 Ų147142.9 Ų142.977%0.7779%0.794SS**  trans7.8126.6145.5-49.2172.7000119.5
136C26.5Very low30.5Very low115 Ų115140.3 Ų140.378%0.77779%0.792SS**  175.5125.399.6-92.50000116.5
137V28.6Very low30Very low127 Ų127140.5 Ų140.577%0.7780%0.798SS**  56.1110.1126.5-176.20000120.1
138T31.2Very low30Very low130 Ų130137.4 Ų137.480%0.79880%0.797SS**  trans-65.9150.3152.737.40000112.4
139P40.7Very low29.8Very low109 Ų109136.2 Ų136.271%0.70880%0.801SS**  -139147.7111.937.4-26.9000115.6
140S30.1Very low29.5Very low105 Ų105131.4 Ų131.473%0.73480%0.795SS**  trans20.6131.6137.9-45.20000120.6
141L31.4Very low29.4Very low170 Ų170132.5 Ų132.589%0.8980%0.798SS**  -179.3150.897.2-91.3170.4000112
142L33Very low29.2Very low152 Ų152129.2 Ų129.280%0.79679%0.789SS**  trans-82166.7167.1-66.5170.9000110.5
143P34Very low29.2Very low118 Ų118129.4 Ų129.477%0.76679%0.79SS**  -136.8135.1114.336.2-26.5000115.1
144T26.5Very low29.3Very low112 Ų112132.6 Ų132.669%0.68779%0.792SS**  trans-66.8143.6156.8-54.30000110.1
145L28.3Very low30.1Very low166 Ų166130.1 Ų130.187%0.86979%0.785SS**  trans-133.4126.2159.3-73.4178000110.8
146S28Very low30.4Very low110 Ų110134 Ų13477%0.76979%0.789SS**  trans-101.6161.7173.5-58.70000111
147L26.4Very low30.5Very low175 Ų175132.2 Ų132.292%0.91679%0.79SS**  trans-65.7148.7172.2-61.2105.4000112.1
148S27.4Very low31.4Very low127 Ų127132 Ų13289%0.88879%0.791SS**  trans-156.5169.8149-150.60000112.2
149V26.3Very low31.3Very low142 Ų142135 Ų13586%0.86180%0.797SS**  trans-129.5122.7-165.4171.60000112.5
150A25.8Very low30.6Very low93 Ų93133 Ų13377%0.76980%0.795SS**  trans-168.9133.3154.200000106.5
151S27.4Very low31.5Very low106 Ų106134 Ų13474%0.74180%0.799SS**  cis87.6125.643.9-165.70000114.8
152S29.8Very low31.4Very low98 Ų98130 Ų13069%0.68579%0.791SS**  trans79.3136.9154.4180000122.3
153E29.4Very low31.5Very low193 Ų193131.2 Ų131.290%0.90280%0.797SS**  trans81.5109.3151.2-67.7177.3109.900122.3
154D27.9Very low31.4Very low133 Ų133129.7 Ų129.771%0.71180%0.795SS**  trans-91.2148.3157.5162.554.5000108.9R156D154-R156 PolarHBondContact OD1-N 3.33Å
155P47.1Very low32.5Very low105 Ų105129.9 Ų129.968%0.68280%0.798SS**  -150.7119.5112.134.1-14.7000117.2
156R32Very low32.7Very low228 Ų228128.4 Ų128.486%0.8680%0.795SS**  trans52.5126.9133.4-56.8-175.4-66.8170.9-3121.5D154D154-R156 PolarHBondContact OD1-N 3.33Å
157G30.1Very low33.1Very low77 Ų77127 Ų12779%0.79479%0.791SS**  trans-169.7132.3156.400000113.5
158P46Very low33.6Very low122 Ų122126.9 Ų126.979%0.79279%0.786SS**  trans-116.7166.1-173.841.6-33.3000115.7
159E29.8Very low33.9Very low195 Ų195126.6 Ų126.691%0.91178%0.778SS**  trans163.3163138.4-85.5-85.376.200110.6
160G26.2Very low34.3Very low66 Ų66124.4 Ų124.468%0.6878%0.775SS**  trans-116.5-147.3175.700000112.7
161P49.3Very low34.7Very low125 Ų125123.8 Ų123.881%0.81277%0.771SS**  cis-142175.4-6.842.9-25.5000116.5
162A29.1Very low35.1Very low87 Ų87124.5 Ų124.572%0.71978%0.775SS**  trans54.5125.3145.600000123.4
163L35.1Very low35.2Very low177 Ų177124.9 Ų124.993%0.92778%0.778SS**  -173162.2107.3-96.7166.3000112.1
164A31Very low35.3Very low87 Ų87122.4 Ų122.472%0.71977%0.769SS**  trans-141.2-174.6178.700000109.1
165P50.9Low35.5Very low115 Ų115122 Ų12275%0.74777%0.772SS**  -159.8-173.564.541.6-17.8000118.3
166V32.3Very low34.6Very low135 Ų135124.5 Ų124.582%0.81878%0.78SS**  trans67.2121.6162.8-173.50000117.2
167A35.5Very low34.7Very low82 Ų82123.6 Ų123.668%0.67879%0.785SS**  cis-162.8-145.3-1400000106.4
168Q38.1Very low34.8Very low172 Ų172123.1 Ų123.180%0.80478%0.781SS**  cis-172.1156.7-10-130.7171.9111.100103.6
169T33.3Very low34.1Very low120 Ų120127.5 Ų127.574%0.73679%0.787SS**  cis-176.3149.9-26.7310000104.5
170A34Very low34.1Very low96 Ų96123.1 Ų123.179%0.79378%0.784SS**  cis-161.3-157-9.300000105.2
171A34.8Very low34.5Very low81 Ų81127.7 Ų127.767%0.66979%0.791SS**  cis-162.21744.700000109.6
172S34.5Very low33.7Very low120 Ų120131.6 Ų131.684%0.83980%0.795SS**  trans68.7142.6161.8-560000118.4
173S33Very low34.2Very low106 Ų106135.1 Ų135.174%0.74180%0.801SS**  cis-174.4172-15.569.90000107.9
174I31.7Very low34Very low141 Ų141135.5 Ų135.572%0.72380%0.795SS**  cis-158.8157.12.5-147.1174.6000111.5
175T30.6Very low34.5Very low125 Ų125140 Ų14077%0.76780%0.801SS**  trans53.1129.8164.852.50000123.7
176N29.6Very low33.7Very low158 Ų158142.3 Ų142.385%0.84580%0.802SS**  trans-88.7154.3155.1-55.3-76.7000111.7
177Q34.2Very low34.3Very low208 Ų208145.4 Ų145.497%0.97280%0.804SS**  trans-165.4156.1134.1-69.1-150.270.800108
178G30.9Very low34.5Very low68 Ų68148.2 Ų148.270%0.70181%0.806SS**  cis161.8123.8-8.500000112.5
179K31.2Very low34.9Very low214 Ų214147.4 Ų147.493%0.9381%0.806SS**  trans30126.1163.2-81.6176171.2172.60120.7
180A30.1Very low35Very low102 Ų102147 Ų14784%0.84381%0.805SS**  -175.9161.6115.300000112.8
181I35.9Very low35Very low162 Ų162150.5 Ų150.583%0.83181%0.805SS**  trans-129.8126.8177.1-59.7164.6000109.2
182K31.7Very low35.2Very low207 Ų207153.8 Ų153.890%0.981%0.81SS**  trans-170.4149.5132.7-113.3175.3-179.6-179.30114.2
183I39.1Very low35.2Very low162 Ų162156.3 Ų156.383%0.83181%0.806SS**  trans-80.9139.9174.3-60.3160.6000109.1
184K32.3Very low36.1Very low184 Ų184158.9 Ų158.980%0.881%0.81SS**  trans-146138.4142.2-152-172175.9-152.80110.3
185E41.7Very low36.5Very low182 Ų182159.1 Ų159.185%0.8581%0.809SS**  trans-85123.9178.7175.4-178.4-156.200110
186E33.4Very low37.2Very low164 Ų164158 Ų15877%0.76680%0.803SS**  trans-153.8153164.7-158.1145.5-157.900111.2
187K43.8Very low37.8Very low199 Ų199158.2 Ų158.287%0.86580%0.799SS**  trans-103.694.7-156.1-178.9-172.1177.2-176.80112.5
188I40Very low38.4Very low142 Ų142155.6 Ų155.673%0.72879%0.787SS**  trans-127.6141170.7-64.191.1000110
189I46.9Very low39.1Very low155 Ų155155.6 Ų155.680%0.79577%0.773SS**  trans-97.7124.4176.1-61.9164.2000109.1
190P34.8Very low39.7Very low111 Ų111151.5 Ų151.572%0.72176%0.761SS**  trans-101.8106.9149.730.5-18.9000108.1
191E34Very low40.2Very low170 Ų170154 Ų15479%0.79476%0.756SS**  66.794.187.3-168.7168.4-131.800111.2K193E191-K193 PolarHBondContact O-N 2.83Å; E191-K193 VanDerWaalsContact O-N 3.14Å
192I40Very low40.6Very low150 Ų150154.3 Ų154.377%0.76975%0.751SS**  trans-69.4109.4176.3-55.4174.4000107.5L194I192-L194 HydrophobicContact CG2-CG 4.08Å; I192-L194 PolarHBondContact O-N 3.39Å
193K33.8Very low41.2Very low173 Ų173151.3 Ų151.375%0.75274%0.744SS**  trans-75.177.7177.4-165.7170.3-176.8179.70111.3E191 E195E191-K193 PolarHBondContact O-N 2.83Å; E191-K193 VanDerWaalsContact O-N 3.14Å; K193-E195 VanDerWaalsContact CE-OE2 3.31Å; K193-E195 WeakPolarHBondContact CE-OE2 3.47Å; K193-E195 IonicContact NZ-OE2 3.76Å; K193-E195 PolarHBondContact O-N 2.91Å
194L51.8Low41.3Very low159 Ų159150.3 Ų150.383%0.83274%0.741SS**  trans-75.5100.1167.3-82.6166.4000109.6I192I192-L194 HydrophobicContact CG2-CG 4.08Å; I192-L194 PolarHBondContact O-N 3.39Å
195E40.4Very low41.6Very low147 Ų147150.7 Ų150.769%0.68774%0.743SS**  trans-147.1134.7170.4-136.3-167.3140.400108.3K193K193-E195 VanDerWaalsContact CE-OE2 3.31Å; K193-E195 WeakPolarHBondContact CE-OE2 3.47Å; K193-E195 IonicContact NZ-OE2 3.76Å; K193-E195 PolarHBondContact O-N 2.91Å
196P45.2Very low41.2Very low101 Ų101146.3 Ų146.366%0.65673%0.732SS**  -114.2156.2-59.234.9-29.7000111.9E198P196-E198 PolarHBondContact O-N 2.92Å
197H43.4Very low41.8Very low162 Ų162144.6 Ų144.675%0.7574%0.735SS**  trans-77.7100.6176.3-172.540.6000109.5V199H197-V199 VanDerWaalsContact CE1-CG1 3.41Å; H197-V199 WeakPolarHBondContact CE1-CG1 3.22Å; H197-V199 WeakPolarHBondContact NE2-CG1 3.31Å; H197-V199 PolarHBondContact O-N 2.79Å
198E45.4Very low41.7Very low153 Ų153144.6 Ų144.672%0.71574%0.735SS**THydrogen-bonded Turntrans-72.465.1-179.9-65.9-166.2147.600113.1P196P196-E198 PolarHBondContact O-N 2.92Å
199V46.2Very low41.7Very low68 Ų68141.3 Ų141.341%0.41274%0.736SS.*THydrogen-bonded Turntrans-100.9-17.1174.8-71.80000114.1H197 Q201 F202H197-V199 VanDerWaalsContact CE1-CG1 3.41Å; H197-V199 WeakPolarHBondContact CE1-CG1 3.22Å; H197-V199 WeakPolarHBondContact NE2-CG1 3.31Å; H197-V199 PolarHBondContact O-N 2.79Å; V199-Q201 PolarHBondContact O-N 3.1Å; V199-F202 WeakPolarHBondContact O-CD2 3.45Å; V199-F202 PolarHBondContact O-N 3.2Å
200D44.3Very low41.3Very low128 Ų128142 Ų14268%0.68474%0.741SS**G310 helixtrans-75.6-5177.7-87.8-19.4000114.2F202D200-F202 PolarHBondContact O-N 3.45Å
201Q40.6Very low41.3Very low156 Ų156146 Ų14673%0.72975%0.749SS**G310 helixtrans-72-8.2171.2-154.9169.7112.500112.8V199V199-Q201 PolarHBondContact O-N 3.1Å
202F43.2Very low41.7Very low167 Ų167142.4 Ų142.473%0.73274%0.743SS**G310 helixtrans-93.4-2.9179.1-67.2-79.7000115V199 D200V199-F202 WeakPolarHBondContact O-CD2 3.45Å; V199-F202 PolarHBondContact O-N 3.2Å; D200-F202 PolarHBondContact O-N 3.45Å
203L44.4Very low42Very low144 Ų144143.7 Ų143.775%0.75475%0.751SS**SBendtrans-12023.6-174.7-69.9176.3000114.9
204N40.7Very low42.4Very low142 Ų142143.1 Ų143.176%0.75975%0.751SS**  trans-124.247.7179.4-113.1-64.8000115.4
205F38.8Very low42.4Very low192 Ų192142.9 Ų142.984%0.84275%0.747SS**  trans-96.488.5161.8-73.7-72.5000111
206S34.8Very low43Very low89 Ų89140.9 Ų140.962%0.62275%0.747SS**  trans-62135168.6-171.40000110.1K208S206-K208 PolarHBondContact O-N 3.14Å
207P45.3Very low43.3Very low128 Ų128141.3 Ų141.383%0.83175%0.75SS**SBendtrans-74.387.8-169.229.1-35.9000112.6
208K42.2Very low43.6Very low199 Ų199139.6 Ų139.687%0.86575%0.751SS**  trans-137.164.4171.3-66.5-173-179.2179.20110.4S206S206-K208 PolarHBondContact O-N 3.14Å
209G40.2Very low44Very low73 Ų73137.6 Ų137.675%0.75375%0.751SS**  trans-162.211.3-17400000116.3
210L37Very low44.4Very low171 Ų171140 Ų14090%0.89577%0.768SS**  trans-97.979.7166.7-86.8170.2000109.2S212L210-S212 VanDerWaalsContact C-N 3.27Å; L210-S212 PolarHBondContact O-N 3.3Å; L210-S212 VanDerWaalsContact O-N 3.15Å
211E36.5Very low43.9Very low193 Ų193139.8 Ų139.890%0.90278%0.777SS**  trans-71.296.5148.1-75.3-156.1136.400107
212S40.5Very low43.8Very low95 Ų95138 Ų13866%0.66478%0.782SS**  trans-56.615115950.30000109L210 Q214L210-S212 VanDerWaalsContact C-N 3.27Å; L210-S212 PolarHBondContact O-N 3.3Å; L210-S212 VanDerWaalsContact O-N 3.15Å; S212-Q214 PolarHBondContact O-N 3.3Å
213L47.1Very low43.9Very low178 Ų178138.5 Ų138.593%0.93279%0.786SS**  trans-66.275.5-176.5-73.5163.2000112M215L213-M215 PolarHBondContact O-N 3.33Å
214Q42.8Very low43.7Very low161 Ų161134.6 Ų134.675%0.75278%0.78SS**  trans-77.490175.5-172159.41.700109.5S212S212-Q214 PolarHBondContact O-N 3.3Å
215M52.5Low43.7Very low153 Ų153132.4 Ų132.475%0.75478%0.776SS**  trans-42.7139.5158.2-75.5-78.3-76.100109.7L213L213-M215 PolarHBondContact O-N 3.33Å
216P52.3Low43.7Very low106 Ų106130.7 Ų130.769%0.68878%0.776SS**PPolyproline II helixtrans-57.1131.817825-33.9000108.9T218P216-T218 PolarHBondContact O-N 3.48Å; P216-T218 VanDerWaalsContact O-N 3.07Å
217P50.9Low43.8Very low109 Ų109131.8 Ų131.871%0.70878%0.784SS**PPolyproline II helixtrans-59.7119.7-176.423.4-33.1000109.4
218T49.3Very low43.5Very low127 Ų127135 Ų13578%0.77979%0.788SS**PPolyproline II helixtrans-55132.2171.540.20000109P216P216-T218 PolarHBondContact O-N 3.48Å; P216-T218 VanDerWaalsContact O-N 3.07Å
219P55.2Low43.3Very low111 Ų111128.9 Ų128.972%0.72178%0.781SS**PPolyproline II helixtrans-60.1141.2179.326.1-34.3000109.7S221P219-S221 PolarHBondContact O-N 3.15Å
220P53Low43.1Very low117 Ų117131 Ų13176%0.7678%0.784SS**PPolyproline II helixtrans-61.6126.8-179.625.1-33.7000110S222P220-S222 PolarHBondContact O-N 3.3Å
221S35.6Very low43.1Very low124 Ų124131.4 Ų131.487%0.86778%0.781SS**  trans-59.5111.5173.7-74.40000109.3P219 H223P219-S221 PolarHBondContact O-N 3.15Å; S221-H223 PolarHBondContact O-N 2.92Å; S221-H223 VanDerWaalsContact O-N 3.15Å
222S37.8Very low43.1Very low119 Ų119127 Ų12783%0.83277%0.772SS**  trans-74.4104.2175.2-63.90000108.7P220 G224P220-S222 PolarHBondContact O-N 3.3Å; S222-G224 PolarHBondContact O-N 3.3Å
223H45.4Very low43.3Very low177 Ų177128.6 Ų128.682%0.81978%0.78SS**  trans-74.266.4175.4-166.7-7.9000110.5S221 S225S221-H223 PolarHBondContact O-N 2.92Å; S221-H223 VanDerWaalsContact O-N 3.15Å; H223-S225 PolarHBondContact O-N 3.41Å
224G39.1Very low42.8Very low62 Ų62126.7 Ų126.764%0.63978%0.776SS**  trans-82.9105.8169.300000109.7S222 D226S222-G224 PolarHBondContact O-N 3.3Å; G224-D226 VanDerWaalsContact C-N 3.33Å; G224-D226 PolarHBondContact O-N 3.4Å
225S41.9Very low42.2Very low97 Ų97127.6 Ų127.668%0.67878%0.779SS**  trans-9153.3-172.5-174.10000113.3H223 S227H223-S225 PolarHBondContact O-N 3.41Å; S225-S227 PolarHBondContact O-N 3.22Å
226D38.1Very low41.5Very low156 Ų156124.6 Ų124.683%0.83478%0.779SS**  trans-87.892.2176.5-68.2-45.6000110.9G224 E228G224-D226 VanDerWaalsContact C-N 3.33Å; G224-D226 PolarHBondContact O-N 3.4Å; D226-E228 PolarHBondContact O-N 2.71Å
227S37.8Very low41.1Very low112 Ų112125.5 Ų125.578%0.78378%0.784SS**  trans-92.570-175.5-175.80000112.8S225 G229S225-S227 PolarHBondContact O-N 3.22Å; S227-G229 PolarHBondContact O-N 3.46Å; S227-G229 VanDerWaalsContact O-N 3.07Å
228E39.2Very low41.2Very low196 Ų196126 Ų12692%0.91679%0.788SS**  trans-73.494.2167.5-75.3-133.799.600111D226 S230D226-E228 PolarHBondContact O-N 2.71Å; E228-S230 PolarHBondContact O-N 3.18Å
229G36.3Very low40.3Very low70 Ų70125.3 Ų125.372%0.72279%0.788SS**  trans-70.9110.6179.800000113S227 Q231S227-G229 PolarHBondContact O-N 3.46Å; S227-G229 VanDerWaalsContact O-N 3.07Å; G229-Q231 PolarHBondContact O-N 3.26Å
230S36.3Very low39.3Very low117 Ų117128 Ų12882%0.81880%0.795SS**  trans-71.9122175.459.60000112.4E228E228-S230 PolarHBondContact O-N 3.18Å
231Q38.3Very low38.3Very low180 Ų180128 Ų12884%0.84180%0.799SS**  trans-124.4155.1165.5-86-69.42.200111.3G229G229-Q231 PolarHBondContact O-N 3.26Å
232S35.6Very low38.1Very low101 Ų101128 Ų12871%0.70680%0.797SS**  trans-78156.7-164.9-73.90000114.9
233P45.5Very low38.6Very low128 Ų128128 Ų12883%0.83179%0.794SS**  trans-77.3133.7-174.730.6-35.7000113.6
234V35.1Very low37.8Very low138 Ų138125.4 Ų125.484%0.83679%0.791SS**  trans-135.5157.3169.8-1760000109.4
235H32.3Very low37.4Very low180 Ų180127.4 Ų127.483%0.83380%0.795SS**  trans-81.5139.1-164.7-69-121.9000115.6
236A36.8Very low38Very low89 Ų89128.6 Ų128.674%0.73680%0.801SS**  trans67.4158.6137.700000120.9
237P44.1Very low37.5Very low125 Ų125126.4 Ų126.481%0.81280%0.798SS**  cis-129-134.4-35.444.4-26.6000110.5
238P53.3Low37.3Very low120 Ų120126.2 Ų126.278%0.77980%0.796SS**  trans-125.8148.4-144.536.7-14.4000118.5
239S30Very low37.7Very low113 Ų113122.6 Ų122.679%0.7979%0.79SS**  trans-157.1113.4162.260.90000116
240L34.6Very low38.5Very low166 Ų166124.9 Ų124.987%0.86979%0.792SS**  trans26.9121.4139.2-52.8173000120.8
241S31.8Very low38.9Very low118 Ų118125.3 Ų125.383%0.82579%0.792SS**  162.5142.7111.6-700000114.2
242C30.9Very low38.7Very low124 Ų124122.7 Ų122.784%0.83879%0.794SS**  trans-110.9172.1163.8-47.30000108.6
243P47.3Very low38.8Very low118 Ų118127.2 Ų127.277%0.76680%0.804SS**  cis-120.6-151.549.723.61.5000111.2
244T30.3Very low38.2Very low123 Ų123126.3 Ų126.376%0.75581%0.806SS**  cis-152.6-15713-31.40000111.4
245S29.6Very low38.2Very low104 Ų104125.1 Ų125.173%0.72780%0.804SS**  trans-159.7-169.5-179.4-43.20000107.7
246P54.5Low38.4Very low123 Ų123124.1 Ų124.180%0.79981%0.811SS**  cis-138.6180-10.941.6-24.5000115.2
247S28.7Very low38.4Very low110 Ų110129.4 Ų129.477%0.76982%0.817SS**  154.6121.7127.4-1740000117.4
248S32.2Very low37.9Very low107 Ų107130.5 Ų130.575%0.74882%0.821SS**  trans-11.8174.3146-44.40000122.4
249P48.5Very low36.9Very low121 Ų121129.7 Ų129.779%0.78682%0.818SS**  cis-135.9-176.3-10.725.9-0.5000115.9
250P53.6Low37.5Very low117 Ų117129.7 Ų129.776%0.7682%0.816SS**  trans-113.5173.7179.441.8-34000116.2
251P44.3Very low37.6Very low127 Ų127133.7 Ų133.783%0.82582%0.819SS**  trans-140.8139.1149.737.7-22.4000118.5
252S33.8Very low38.1Very low125 Ų125133.1 Ų133.187%0.87482%0.821SS**  trans15.3148.7147.7-55.90000126.9
253Q38.5Very low38.2Very low196 Ų196131.7 Ų131.792%0.91682%0.818SS**  trans-46.7158.9171.6-54.7167.80.800118.8
254A32.4Very low37.6Very low108 Ų108131.5 Ų131.589%0.89382%0.82SS**  trans-142.4153.6148.600000110.4
255S35.1Very low38.2Very low113 Ų113131.1 Ų131.179%0.7982%0.823SS**  trans-137.8137-173.661.70000113
256V35.7Very low38.6Very low160 Ų160134.9 Ų134.997%0.9783%0.833SS**  trans-142.6155.5172.9-102.60000111.7
257K37.7Very low38.3Very low200 Ų200133.9 Ų133.987%0.8783%0.83SS**  trans-144.7121.2-161.8169-164.9172.8-174.10111.3
258V33.5Very low38.7Very low148 Ų148136 Ų13690%0.89783%0.832SS**  trans-140.8149.9164.7-174.50000109.6
259S32.6Very low38.7Very low103 Ų103136 Ų13672%0.7283%0.832SS**  trans-88.1148.1-174.4-175.20000113.3
260P41.6Very low38.4Very low113 Ų113136.4 Ų136.473%0.73483%0.834SS**  trans-71.9163.8163.832.6-36000112.2
261R36.8Very low38Very low250 Ų250138.2 Ų138.294%0.94384%0.837SS**  trans-121.6152.8157.6-71.5-175.8-179.6170.51.2108.4
262A42.1Very low38Very low105 Ų105140.6 Ų140.687%0.86884%0.842SS**  trans-91152.3-168.500000114
263A33.3Very low38.5Very low94 Ų94141.4 Ų141.478%0.77784%0.842SS**  trans-141.7127158.500000110.2
264S35.4Very low38Very low115 Ų115136.4 Ų136.480%0.80483%0.834SS**  trans1.9121.316452.20000121
265S43.1Very low38.6Very low115 Ų115137.6 Ų137.680%0.80483%0.833SS**  trans2.7116.8140.9-49.30000120
266L36.8Very low38.6Very low182 Ų182139.4 Ų139.495%0.95383%0.828SS**  -137.4123.9120.7-80.7-174.8000108.8
267S48.8Very low38.7Very low103 Ų103139.6 Ų139.672%0.7282%0.816SS**  trans-96130.1-176.953.20000111.8
268N36.7Very low38.9Very low155 Ų155138.1 Ų138.183%0.82982%0.817SS**  trans-172.395.2136.6-91.9-23.9000112.4
269S32.7Very low39.5Very low105 Ų105140.6 Ų140.673%0.73482%0.819SS**  trans49.287.4148.7-570000121.4
270P41.1Very low39.4Very low130 Ų130138.6 Ų138.684%0.84481%0.814SS**  trans-92.2101.215834.1-27.6000111.2
271L46.1Very low39.5Very low156 Ų156138.7 Ų138.782%0.81782%0.818SS**  trans-142.325.3-176.1-113.6176.1000116.7
272L43.4Very low39.7Very low177 Ų177128.6 Ų128.693%0.92779%0.791SS**  trans-116.926.8179.5-69.1179.5000115.3
273T44.3Very low39.6Very low141 Ų141128.8 Ų128.887%0.86578%0.784SS**  trans-133.875.3176.2-46.40000112.5
274A29.8Very low40.1Very low92 Ų92129.4 Ų129.476%0.7677%0.773SS**  trans-156.187.8170.200000112.8H276A274-H276 VanDerWaalsContact C-N 3.33Å; A274-H276 PolarHBondContact O-N 3.43Å; A274-H276 VanDerWaalsContact O-N 3.1Å
275P43.7Very low40.5Very low132 Ų132131.7 Ų131.786%0.85778%0.775SS**  trans-86.460.1-178.835.9-35.9000112.6
276H35.7Very low40.7Very low151 Ų151128 Ų12870%0.69975%0.746SS**  trans-143.2117179-150.5-117.7000115.9A274A274-H276 VanDerWaalsContact C-N 3.33Å; A274-H276 PolarHBondContact O-N 3.43Å; A274-H276 VanDerWaalsContact O-N 3.1Å
277K38.3Very low41.7Very low165 Ų165123.7 Ų123.772%0.71773%0.727SS**  trans42.773.9151.2-52.3-73.3-177.3171.30117.8
278L41Very low41.8Very low169 Ų169122.4 Ų122.489%0.88571%0.71SS**  trans-109.278.7152.1-74-179.7000110.9G280L278-G280 PolarHBondContact O-N 3.03Å; L278-G280 VanDerWaalsContact O-N 3.13Å
279Q45.4Very low42.4Very low200 Ų200122.3 Ų122.394%0.93570%0.704SS**  trans-81.969.3164.3-174.4173.9-12.700108.4
280G31.4Very low43.7Very low61 Ų61121 Ų12163%0.62969%0.687SS**SBendtrans-156.9137.6-174.400000112.1L278 G282L278-G280 PolarHBondContact O-N 3.03Å; L278-G280 VanDerWaalsContact O-N 3.13Å; G280-G282 PolarHBondContact O-N 3.47Å
281S44.4Very low44.7Very low115 Ų115120.1 Ų120.180%0.80467%0.667SS**  trans-74.5103.3-179.9174.70000110.9
282G40.2Very low45.1Very low38 Ų38120.4 Ų120.439%0.39266%0.657SS.*  trans-135.5147.5170.900000111.1G280 L284G280-G282 PolarHBondContact O-N 3.47Å; G282-L284 PolarHBondContact O-N 2.87Å
283P40.7Very low46Very low109 Ų109114.4 Ų114.471%0.70863%0.628SS**  trans-59.6136.7176.1-22.233.6000111.6I285P283-I285 PolarHBondContact O-N 3.02Å; P283-I285 VanDerWaalsContact O-N 3.13Å
284L43.6Very low46.8Very low106 Ų106108.2 Ų108.256%0.55559%0.589SS**  trans-68.9110.6169.5-109.575.7000109G282 L286 L315G282-L284 PolarHBondContact O-N 2.87Å; L284-L286 VanDerWaalsContact C-N 3.29Å; L284-L286 PolarHBondContact O-N 3.36Å; L284-L315 HydrophobicContact CD2-CD2 4.35Å
285I43.8Very low48.4Very low163 Ų163107.6 Ų107.684%0.83658%0.576SS**  trans-7389.4168.3-54.7175.9000107.5P283P283-I285 PolarHBondContact O-N 3.02Å; P283-I285 VanDerWaalsContact O-N 3.13Å
286L47.6Very low49.1Very low39 Ų39105.5 Ų105.520%0.20457%0.57CS.*  trans-74.6137.1158.2-63.3174.7000107.6L284 E290L284-L286 VanDerWaalsContact C-N 3.29Å; L284-L286 PolarHBondContact O-N 3.36Å; L286-E290 VanDerWaalsContact CA-OE2 3.26Å; L286-E290 WeakPolarHBondContact CA-OE2 3.4Å; L286-E290 HydrophobicContact CB-CB 4.18Å; L286-E290 WeakPolarHBondContact CD2-OE2 3.49Å
287T56.3Low50.1Low91 Ų91102.2 Ų102.256%0.55856%0.555SS**  trans-65.9154.4176.613.30000110.8E289 E290 R291T287-E289 PolarHBondContact O-N 2.88Å; T287-E289 VanDerWaalsContact O-N 3.08Å; T287-E290 PolarHBondContact N-OE2 3.32Å; T287-E290 VanDerWaalsContact N-OE2 3.1Å; T287-E290 WeakPolarHBondContact O-CA 3.37Å; T287-E290 WeakPolarHBondContact O-CB 3.42Å; T287-E290 PolarHBondContact O-N 3.31Å; T287-E290 PolarHBondContact OG1-OE2 2.9Å; T287-R291 PolarHBondContact O-N 3.49Å
288E52Low50.5Low76 Ų7697.4 Ų97.436%0.35555%0.552SS.*Hα-helixtrans-56-31.7-174.3172.260.1-174.700113.2R291 R292E288-R291 VanDerWaalsContact CD-NH2 3.25Å; E288-R291 PolarHBondContact O-N 3.3Å; E288-R291 IonicContact OE1-CZ 2.84Å; E288-R291 IonicContact OE1-NH2 2.73Å; E288-R291 PolarHBondContact OE1-NH2 3.02Å; E288-R291 IonicContact OE2-CZ 2.77Å; E288-R291 IonicContact OE2-NE 2.86Å; E288-R291 PolarHBondContact OE2-NE 2.67Å; E288-R291 IonicContact OE2-NH2 3.87Å; E288-R291 PolarHBondContact OE2-NH2 3.09Å; E288-R292 VanDerWaalsContact O-CG 3.29Å; E288-R292 WeakPolarHBondContact O-CG 3.33Å; E288-R292 PolarHBondContact O-N 3.49Å; E288-R292 IonicContact OE1-CZ 2.92Å; E288-R292 VanDerWaalsContact OE1-CZ 3.29Å; E288-R292 IonicContact OE1-NE 3.29Å; E288-R292 PolarHBondContact OE1-NE 3.18Å; E288-R292 IonicContact OE1-NH2 3.97Å; E288-R292 PolarHBondContact OE1-NH2 3.28Å
289E50Low51Low152 Ų15294.9 Ų94.971%0.7153%0.532SS*.Hα-helixtrans-71.6-37.2174.5-62.7-178.4118.200113.4T287 R291 R292 T293T287-E289 PolarHBondContact O-N 2.88Å; T287-E289 VanDerWaalsContact O-N 3.08Å; E289-R291 VanDerWaalsContact C-N 3.31Å; E289-R292 PolarHBondContact O-N 3.43Å; E289-T293 WeakPolarHBondContact O-CB 3.35Å; E289-T293 PolarHBondContact O-N 3.09Å; E289-T293 PolarHBondContact O-OG1 3.23Å
290E59Low51Low78 Ų7890.7 Ų90.736%0.36452%0.522SS..Hα-helixtrans-63.1-42.2171.6-62.4-171.1114.900110L286 T287 T293 L294L286-E290 VanDerWaalsContact CA-OE2 3.26Å; L286-E290 WeakPolarHBondContact CA-OE2 3.4Å; L286-E290 HydrophobicContact CB-CB 4.18Å; L286-E290 WeakPolarHBondContact CD2-OE2 3.49Å; T287-E290 PolarHBondContact N-OE2 3.32Å; T287-E290 VanDerWaalsContact N-OE2 3.1Å; T287-E290 WeakPolarHBondContact O-CA 3.37Å; T287-E290 WeakPolarHBondContact O-CB 3.42Å; T287-E290 PolarHBondContact O-N 3.31Å; T287-E290 PolarHBondContact OG1-OE2 2.9Å; E290-T293 PolarHBondContact O-N 3.44Å; E290-L294 WeakPolarHBondContact O-CB 3.21Å; E290-L294 PolarHBondContact O-N 3.35Å
291R61.1Low51.9Low112 Ų11289.9 Ų89.942%0.42351%0.505SS..Hα-helixtrans-61.6-47.8176.8-167.4-178.170.897.32.1111.6T287 E288 E289 T293 L294 V295 V301T287-R291 PolarHBondContact O-N 3.49Å; E288-R291 VanDerWaalsContact CD-NH2 3.25Å; E288-R291 PolarHBondContact O-N 3.3Å; E288-R291 IonicContact OE1-CZ 2.84Å; E288-R291 IonicContact OE1-NH2 2.73Å; E288-R291 PolarHBondContact OE1-NH2 3.02Å; E288-R291 IonicContact OE2-CZ 2.77Å; E288-R291 IonicContact OE2-NE 2.86Å; E288-R291 PolarHBondContact OE2-NE 2.67Å; E288-R291 IonicContact OE2-NH2 3.87Å; E288-R291 PolarHBondContact OE2-NH2 3.09Å; E289-R291 VanDerWaalsContact C-N 3.31Å; R291-T293 PolarHBondContact O-N 3.46Å; R291-L294 PolarHBondContact O-N 2.99Å; R291-V295 WeakPolarHBondContact O-CG2 3.35Å; R291-V295 PolarHBondContact O-N 3.44Å; R291-V295 VanDerWaalsContact O-N 3.09Å; R291-V301 HydrophobicContact CG-CG1 4.2Å; R291-V301 HydrophobicContact CG-CG2 3.86Å
292R56.4Low52.4Low161 Ų16187.7 Ų87.761%0.60849%0.488SS*.Hα-helixtrans-59.8-44.7176.5-74171.9-171.5-166.43.5111.9E288 E289 L294 V295 A296E288-R292 VanDerWaalsContact O-CG 3.29Å; E288-R292 WeakPolarHBondContact O-CG 3.33Å; E288-R292 PolarHBondContact O-N 3.49Å; E288-R292 IonicContact OE1-CZ 2.92Å; E288-R292 VanDerWaalsContact OE1-CZ 3.29Å; E288-R292 IonicContact OE1-NE 3.29Å; E288-R292 PolarHBondContact OE1-NE 3.18Å; E288-R292 IonicContact OE1-NH2 3.97Å; E288-R292 PolarHBondContact OE1-NH2 3.28Å; E289-R292 PolarHBondContact O-N 3.43Å; R292-L294 VanDerWaalsContact C-N 3.33Å; R292-L294 PolarHBondContact O-N 3.24Å; R292-V295 PolarHBondContact O-N 3.06Å; R292-A296 WeakPolarHBondContact O-CB 3.16Å; R292-A296 PolarHBondContact O-N 3.27Å
293T61.3Low53.1Low52 Ų5291.4 Ų91.432%0.31950%0.503SS..Hα-helixtrans-62.7-39.1178.3-55.50000112E289 E290 R291 A296 E297 I322E289-T293 WeakPolarHBondContact O-CB 3.35Å; E289-T293 PolarHBondContact O-N 3.09Å; E289-T293 PolarHBondContact O-OG1 3.23Å; E290-T293 PolarHBondContact O-N 3.44Å; R291-T293 PolarHBondContact O-N 3.46Å; T293-A296 PolarHBondContact O-N 3.45Å; T293-E297 WeakPolarHBondContact O-CG 3.28Å; T293-E297 PolarHBondContact O-N 2.91Å; T293-I322 HydrophobicContact CG2-CG1 4.46Å
294L61.5Low53.3Low10 Ų1095 Ų955%0.05251%0.507CS..Hα-helixtrans-72.1-36.5-178.1-158.1152.3000112.2E290 R291 R292 Y299 I318E290-L294 WeakPolarHBondContact O-CB 3.21Å; E290-L294 PolarHBondContact O-N 3.35Å; R291-L294 PolarHBondContact O-N 2.99Å; R292-L294 VanDerWaalsContact C-N 3.33Å; R292-L294 PolarHBondContact O-N 3.24Å; L294-Y299 WeakPolarHBondContact CD2-O 3.44Å; L294-Y299 PolarHBondContact O-N 3.24Å; L294-I318 HydrophobicContact CD1-CG2 4.06Å; L294-I318 HydrophobicContact CG-CG2 4.31Å
295V62.1Low53.9Low80 Ų8093.9 Ų93.949%0.48550%0.501SS..Hα-helixtrans-69.2-41.7172.31740000111.6R291 R292 E297 G298 V301R291-V295 WeakPolarHBondContact O-CG2 3.35Å; R291-V295 PolarHBondContact O-N 3.44Å; R291-V295 VanDerWaalsContact O-N 3.09Å; R292-V295 PolarHBondContact O-N 3.06Å; V295-E297 PolarHBondContact O-N 2.93Å; V295-G298 PolarHBondContact O-N 3.32Å; V295-V301 HydrophobicContact CG2-CG2 3.56Å
296A59.4Low54.5Low88 Ų8892 Ų9273%0.72750%0.5SS*.Hα-helixtrans-65.1-24.4178.800000113.7R292 T293 G298R292-A296 WeakPolarHBondContact O-CB 3.16Å; R292-A296 PolarHBondContact O-N 3.27Å; T293-A296 PolarHBondContact O-N 3.45Å; A296-G298 VanDerWaalsContact C-N 3.29Å
297E56.6Low55Low81 Ų8192.1 Ų92.138%0.37950%0.501SS..THydrogen-bonded Turntrans-86.46171.4-66.1-90.4149.200113.1T293 V295 Y299 K325T293-E297 WeakPolarHBondContact O-CG 3.28Å; T293-E297 PolarHBondContact O-N 2.91Å; V295-E297 PolarHBondContact O-N 2.93Å; E297-Y299 HydrophobicContact CB-CD2 4.31Å; E297-Y299 WeakPolarHBondContact O-CD2 3.33Å; E297-Y299 VanDerWaalsContact O-CE2 3.23Å; E297-Y299 WeakPolarHBondContact O-CE2 3.35Å; E297-K325 IonicContact OE1-NZ 3.2Å; E297-K325 PolarHBondContact OE1-NZ 3.08Å
298G45.8Very low55.7Low65 Ų6591.4 Ų91.467%0.6750%0.496SS*.THydrogen-bonded Turntrans84.517.2170.400000116.6V295 A296V295-G298 PolarHBondContact O-N 3.32Å; A296-G298 VanDerWaalsContact C-N 3.29Å
299Y51.6Low56.8Low115 Ų11595.8 Ų95.845%0.45151%0.514SS..  trans-108.6138.2-178.9-66.4-85.5000112.6L294 E297 I318L294-Y299 WeakPolarHBondContact CD2-O 3.44Å; L294-Y299 PolarHBondContact O-N 3.24Å; E297-Y299 HydrophobicContact CB-CD2 4.31Å; E297-Y299 WeakPolarHBondContact O-CD2 3.33Å; E297-Y299 VanDerWaalsContact O-CE2 3.23Å; E297-Y299 WeakPolarHBondContact O-CE2 3.35Å; Y299-I318 HydrophobicContact CG-CD1 4.49Å
300P47Very low57.9Low113 Ų11391.8 Ų91.873%0.73451%0.507SS*.  trans-69.4138.2177.828.6-34.3000111.3P302P300-P302 VanDerWaalsContact O-CD 3.23Å; P300-P302 WeakPolarHBondContact O-CD 3.33Å
301V49.1Very low58.7Low44 Ų4491.8 Ų91.827%0.26751%0.507SS..  trans-74.4113.4-178.2179.30000110.3R291 V295 T303R291-V301 HydrophobicContact CG-CG1 4.2Å; R291-V301 HydrophobicContact CG-CG2 3.86Å; V295-V301 HydrophobicContact CG2-CG2 3.56Å; V301-T303 PolarHBondContact O-N 3.2Å; V301-T303 PolarHBondContact O-OG1 2.88Å
302P54.9Low59.6Low68 Ų6891.7 Ų91.744%0.44251%0.511SS..  trans-72.3101.4-175.9-17.433000111.4P300 L307P300-P302 VanDerWaalsContact O-CD 3.23Å; P300-P302 WeakPolarHBondContact O-CD 3.33Å; P302-L307 HydrophobicContact CB-CD1 3.91Å
303T55.1Low60.8Low116 Ų11691.1 Ų91.171%0.71251%0.513SS*.  trans-97.6-4.6-168-11.30000115.2V301V301-T303 PolarHBondContact O-N 3.2Å; V301-T303 PolarHBondContact O-OG1 2.88Å
304K44.3Very low61.7Low184 Ų18490.8 Ų90.880%0.852%0.516SS*.SBendtrans-140.1136.4-178.8-64.2-171.5179.8-177.90111.7
305L57Low62.6Low83 Ų8391.6 Ų91.644%0.43552%0.52SS..SBendtrans-94.2163.3171-85.9111.3000110.4L307L305-L307 HydrophobicContact CD2-CB 4.09Å; L305-L307 HydrophobicContact CG-CB 4.22Å
306P56.4Low63.8Low124 Ų12495.9 Ų95.981%0.80553%0.532SS*.SBendcis-73125.25.729.6-35000113.2
307L58.8Low65.2Low42 Ų4298.9 Ų98.922%0.2253%0.529CS..PPolyproline II helixtrans-70.6128.3175.2-158.571.8000108.9P302 L305 E311 E312P302-L307 HydrophobicContact CB-CD1 3.91Å; L305-L307 HydrophobicContact CD2-CB 4.09Å; L305-L307 HydrophobicContact CG-CB 4.22Å; L307-E311 HydrophobicContact CD1-CB 3.74Å; L307-E311 HydrophobicContact CD1-CG 4.4Å; L307-E311 HydrophobicContact CD2-CB 4.3Å; L307-E311 HydrophobicContact CG-CB 3.67Å; L307-E312 HydrophobicContact CD2-CG 4.08Å; L307-E312 HydrophobicContact CG-CG 4.48Å
308T70.8Confident66.6Low75 Ų7596.5 Ų96.546%0.4652%0.519SS..PPolyproline II helixtrans-73.6155.1-178.367.10000111.5A310 E311 E312T308-A310 PolarHBondContact O-N 2.99Å; T308-E311 VanDerWaalsContact CB-OE2 3.27Å; T308-E311 WeakPolarHBondContact CB-OE2 3.47Å; T308-E311 WeakPolarHBondContact CG2-OE2 3.5Å; T308-E311 PolarHBondContact N-OE2 3.34Å; T308-E311 PolarHBondContact O-N 3.45Å; T308-E311 WeakPolarHBondContact OG1-CG 3.45Å; T308-E311 PolarHBondContact OG1-OE2 2.88Å; T308-E312 PolarHBondContact O-N 3.25Å
309K73.8Confident68.7Low168 Ų16899.3 Ų99.373%0.7351%0.509SS*.Hα-helixtrans-59-12.7176.6-69.5-175.9177.5177.90114.3K313K309-K313 WeakPolarHBondContact O-CD 3.28Å; K309-K313 WeakPolarHBondContact O-CG 3.29Å
310A73.8Confident70.6Confident69 Ų69103.2 Ų103.257%0.5752%0.523SS*.Hα-helixtrans-81.6-46.8171.400000111.4T308 K313 A314T308-A310 PolarHBondContact O-N 2.99Å; A310-K313 WeakPolarHBondContact O-CB 3.45Å; A310-K313 PolarHBondContact O-N 2.88Å; A310-A314 PolarHBondContact O-N 2.98Å
311E76.6Confident72.8Confident78 Ų78103.5 Ų103.536%0.36451%0.512SS..Hα-helixtrans-66.4-37.6178-68.6162.9114.500112.3L307 T308 K313 A314 L315L307-E311 HydrophobicContact CD1-CB 3.74Å; L307-E311 HydrophobicContact CD1-CG 4.4Å; L307-E311 HydrophobicContact CD2-CB 4.3Å; L307-E311 HydrophobicContact CG-CB 3.67Å; T308-E311 VanDerWaalsContact CB-OE2 3.27Å; T308-E311 WeakPolarHBondContact CB-OE2 3.47Å; T308-E311 WeakPolarHBondContact CG2-OE2 3.5Å; T308-E311 PolarHBondContact N-OE2 3.34Å; T308-E311 PolarHBondContact O-N 3.45Å; T308-E311 WeakPolarHBondContact OG1-CG 3.45Å; T308-E311 PolarHBondContact OG1-OE2 2.88Å; E311-K313 VanDerWaalsContact C-N 3.3Å; E311-K313 PolarHBondContact O-N 2.9Å; E311-A314 WeakPolarHBondContact O-CB 3.35Å; E311-A314 PolarHBondContact O-N 2.85Å; E311-A314 VanDerWaalsContact O-N 3.13Å; E311-L315 WeakPolarHBondContact O-CB 3.21Å; E311-L315 PolarHBondContact O-N 3.12Å
312E78.9Confident74.7Confident109 Ų109103.4 Ų103.451%0.50951%0.51SS..Hα-helixtrans-56.3-44170.8-68.4-176.613100111.9L307 T308 L315 K316L307-E312 HydrophobicContact CD2-CG 4.08Å; L307-E312 HydrophobicContact CG-CG 4.48Å; T308-E312 PolarHBondContact O-N 3.25Å; E312-L315 PolarHBondContact O-N 2.9Å; E312-K316 PolarHBondContact O-N 2.75Å
313K82.8Confident76.6Confident150 Ų150108.1 Ų108.165%0.65252%0.524SS*.Hα-helixtrans-68.5-34.7176.9-71.3174.8-178.3179.40111.6K309 A310 E311 K317K309-K313 WeakPolarHBondContact O-CD 3.28Å; K309-K313 WeakPolarHBondContact O-CG 3.29Å; A310-K313 WeakPolarHBondContact O-CB 3.45Å; A310-K313 PolarHBondContact O-N 2.88Å; E311-K313 VanDerWaalsContact C-N 3.3Å; E311-K313 PolarHBondContact O-N 2.9Å; K313-K317 WeakPolarHBondContact O-CG 3.39Å; K313-K317 PolarHBondContact O-N 3.49Å
314A79.1Confident78.6Confident45 Ų45108 Ų10837%0.37252%0.519SS..Hα-helixtrans-66.5-48.4173.700000111.4A310 E311 K316 K317 I318A310-A314 PolarHBondContact O-N 2.98Å; E311-A314 WeakPolarHBondContact O-CB 3.35Å; E311-A314 PolarHBondContact O-N 2.85Å; E311-A314 VanDerWaalsContact O-N 3.13Å; A314-K316 VanDerWaalsContact C-N 3.3Å; A314-K316 PolarHBondContact O-N 3.41Å; A314-K317 WeakPolarHBondContact O-CA 3.37Å; A314-K317 WeakPolarHBondContact O-CB 3.22Å; A314-K317 PolarHBondContact O-N 3.03Å; A314-I318 WeakPolarHBondContact O-CG1 3.48Å; A314-I318 PolarHBondContact O-N 2.79Å
315L81.4Confident81Confident27 Ų27104.4 Ų104.414%0.14150%0.503CS..Hα-helixtrans-61-37.6178.2-172.662.8000111.9L284 E311 E312 K317 I318 R319L284-L315 HydrophobicContact CD2-CD2 4.35Å; E311-L315 WeakPolarHBondContact O-CB 3.21Å; E311-L315 PolarHBondContact O-N 3.12Å; E312-L315 PolarHBondContact O-N 2.9Å; L315-K317 PolarHBondContact O-N 2.71Å; L315-I318 PolarHBondContact O-N 3.07Å; L315-R319 WeakPolarHBondContact O-CB 3.33Å; L315-R319 WeakPolarHBondContact O-CG 3.46Å; L315-R319 PolarHBondContact O-N 3.34Å
316K86.9Confident82.7Confident169 Ų169105.3 Ų105.374%0.73551%0.507SS*.Hα-helixtrans-62.8-38.8172-172.4170.3-178.5173.70112.6E312 A314 R320E312-K316 PolarHBondContact O-N 2.75Å; A314-K316 VanDerWaalsContact C-N 3.3Å; A314-K316 PolarHBondContact O-N 3.41Å; K316-R320 PolarHBondContact O-N 3.06Å
317K89.1Confident84.6Confident151 Ų151102.9 Ų102.966%0.65749%0.493SS*.Hα-helixtrans-66.9-42.3173.3-72.5175.5177.5-177.50111.8K313 A314 L315 R320 K321K313-K317 WeakPolarHBondContact O-CG 3.39Å; K313-K317 PolarHBondContact O-N 3.49Å; A314-K317 WeakPolarHBondContact O-CA 3.37Å; A314-K317 WeakPolarHBondContact O-CB 3.22Å; A314-K317 PolarHBondContact O-N 3.03Å; L315-K317 PolarHBondContact O-N 2.71Å; K317-R320 PolarHBondContact O-N 3.06Å; K317-K321 PolarHBondContact O-N 3.01Å
318I85.8Confident86.5Confident32 Ų32102.9 Ų102.916%0.16450%0.499CS..Hα-helixtrans-64.5-48.7178.8-67.7166.3000110.7L294 Y299 A314 L315 R320 K321 I322L294-I318 HydrophobicContact CD1-CG2 4.06Å; L294-I318 HydrophobicContact CG-CG2 4.31Å; Y299-I318 HydrophobicContact CG-CD1 4.49Å; A314-I318 WeakPolarHBondContact O-CG1 3.48Å; A314-I318 PolarHBondContact O-N 2.79Å; L315-I318 PolarHBondContact O-N 3.07Å; I318-R320 VanDerWaalsContact C-N 3.26Å; I318-R320 PolarHBondContact O-N 3.05Å; I318-K321 WeakPolarHBondContact O-CA 3.35Å; I318-K321 WeakPolarHBondContact O-CB 3.16Å; I318-K321 PolarHBondContact O-N 3.49Å; I318-I322 HydrophobicContact CG2-CD1 3.82Å; I318-I322 HydrophobicContact CG2-CG1 4.39Å; I318-I322 WeakPolarHBondContact O-CG1 3.32Å; I318-I322 PolarHBondContact O-N 3.35Å
319R89.3Confident87.8Confident124 Ų124104.8 Ų104.847%0.46850%0.503SS..Hα-helixtrans-55.7-39.5174-75.2176.2169.5168.4-2.9112.5L315 K323L315-R319 WeakPolarHBondContact O-CB 3.33Å; L315-R319 WeakPolarHBondContact O-CG 3.46Å; L315-R319 PolarHBondContact O-N 3.34Å; R319-K323 PolarHBondContact O-N 2.91Å
320R91.4Very high88.9Confident196 Ų196101.1 Ų101.174%0.7449%0.488SS*.Hα-helixtrans-66.6-41.6173.8-165.7178.577.1164.55.3112.4K316 K317 I318 N324K316-R320 PolarHBondContact O-N 3.06Å; K317-R320 PolarHBondContact O-N 3.06Å; I318-R320 VanDerWaalsContact C-N 3.26Å; I318-R320 PolarHBondContact O-N 3.05Å; R320-N324 WeakPolarHBondContact O-CB 3.5Å; R320-N324 PolarHBondContact O-N 3.4Å
321K94.5Very high90Very high119 Ų119101.8 Ų101.852%0.51749%0.489SS..Hα-helixtrans-59.2-49.1173.7-82.2-171.9167.8-167.30111.3K317 I318 N324 K325K317-K321 PolarHBondContact O-N 3.01Å; I318-K321 WeakPolarHBondContact O-CA 3.35Å; I318-K321 WeakPolarHBondContact O-CB 3.16Å; I318-K321 PolarHBondContact O-N 3.49Å; K321-N324 PolarHBondContact O-N 2.87Å; K321-K325 WeakPolarHBondContact O-CB 3.37Å; K321-K325 PolarHBondContact O-N 3.36Å
322I88.4Confident91.1Very high43 Ų43107.4 Ų107.422%0.22151%0.506CS..Hα-helixtrans-61-50.5-179.3-66.1169.7000110.7T293 I318 N324 K325 I326T293-I322 HydrophobicContact CG2-CG1 4.46Å; I318-I322 HydrophobicContact CG2-CD1 3.82Å; I318-I322 HydrophobicContact CG2-CG1 4.39Å; I318-I322 WeakPolarHBondContact O-CG1 3.32Å; I318-I322 PolarHBondContact O-N 3.35Å; I322-N324 VanDerWaalsContact C-N 3.27Å; I322-N324 PolarHBondContact O-N 3Å; I322-K325 PolarHBondContact O-N 2.87Å; I322-K325 VanDerWaalsContact O-N 3.16Å; I322-I326 HydrophobicContact CG2-CD1 3.83Å; I322-I326 WeakPolarHBondContact O-CG1 3.34Å; I322-I326 PolarHBondContact O-N 3.34Å
323K94.9Very high92Very high166 Ų166108.3 Ų108.372%0.72251%0.505SS*.Hα-helixtrans-58.3-39.5176.6-174.1173.9-179.3177.60112.1R319 S327R319-K323 PolarHBondContact O-N 2.91Å; K323-S327 VanDerWaalsContact O-CB 3.27Å; K323-S327 WeakPolarHBondContact O-CB 3.42Å; K323-S327 PolarHBondContact O-N 2.97Å
324N95.8Very high92.8Very high114 Ų114108.1 Ų108.161%0.6151%0.505SS*.Hα-helixtrans-68.7-40.7177.3-164.443000112.5R320 K321 I322 S327 A328R320-N324 WeakPolarHBondContact O-CB 3.5Å; R320-N324 PolarHBondContact O-N 3.4Å; K321-N324 PolarHBondContact O-N 2.87Å; I322-N324 VanDerWaalsContact C-N 3.27Å; I322-N324 PolarHBondContact O-N 3Å; N324-S327 PolarHBondContact O-N 3.21Å; N324-A328 VanDerWaalsContact O-CB 3.3Å; N324-A328 WeakPolarHBondContact O-CB 3.49Å; N324-A328 PolarHBondContact O-N 3.44Å
325K96.6Very high93.7Very high109 Ų109113 Ų11347%0.47452%0.517SS..Hα-helixtrans-59.7-48.3176.5-171.9177.6-177178.80110.8E297 K321 I322 A328 Q329E297-K325 IonicContact OE1-NZ 3.2Å; E297-K325 PolarHBondContact OE1-NZ 3.08Å; K321-K325 WeakPolarHBondContact O-CB 3.37Å; K321-K325 PolarHBondContact O-N 3.36Å; I322-K325 PolarHBondContact O-N 2.87Å; I322-K325 VanDerWaalsContact O-N 3.16Å; K325-A328 PolarHBondContact O-N 3.45Å; K325-Q329 WeakPolarHBondContact O-CB 3.41Å; K325-Q329 PolarHBondContact O-N 2.9Å
326I92.1Very high94.5Very high102 Ų102117.8 Ų117.852%0.52354%0.537SS..Hα-helixtrans-62.7-49.1176.1-63.7168.4000110.6I322 A328 Q329 E330I322-I326 HydrophobicContact CG2-CD1 3.83Å; I322-I326 WeakPolarHBondContact O-CG1 3.34Å; I322-I326 PolarHBondContact O-N 3.34Å; I326-A328 VanDerWaalsContact C-N 3.31Å; I326-A328 PolarHBondContact O-N 3.41Å; I326-Q329 PolarHBondContact O-N 3.36Å; I326-E330 WeakPolarHBondContact O-CB 3.38Å; I326-E330 PolarHBondContact O-N 3.14Å
327S96.7Very high95Very high73 Ų73114.4 Ų114.451%0.5152%0.524SS..Hα-helixtrans-61.8-35.8-179.4-166.20000113.3K323 N324 S331K323-S327 VanDerWaalsContact O-CB 3.27Å; K323-S327 WeakPolarHBondContact O-CB 3.42Å; K323-S327 PolarHBondContact O-N 2.97Å; N324-S327 PolarHBondContact O-N 3.21Å; S327-S331 VanDerWaalsContact O-CB 3.31Å; S327-S331 WeakPolarHBondContact O-CB 3.39Å; S327-S331 PolarHBondContact O-N 3.36Å
328A97.6Very high95.5Very high41 Ų41114.6 Ų114.634%0.33952%0.522SS..Hα-helixtrans-74.3-36.817600000112.2N324 K325 I326 R332N324-A328 VanDerWaalsContact O-CB 3.3Å; N324-A328 WeakPolarHBondContact O-CB 3.49Å; N324-A328 PolarHBondContact O-N 3.44Å; K325-A328 PolarHBondContact O-N 3.45Å; I326-A328 VanDerWaalsContact C-N 3.31Å; I326-A328 PolarHBondContact O-N 3.41Å; A328-R332 WeakPolarHBondContact O-CD 3.46Å; A328-R332 VanDerWaalsContact O-CG 3.24Å; A328-R332 WeakPolarHBondContact O-CG 3.39Å; A328-R332 PolarHBondContact O-N 3.19Å; A328-R332 VanDerWaalsContact O-N 3.11Å
329Q97.8Very high96.1Very high116 Ų116116.9 Ų116.954%0.54253%0.533SS..Hα-helixtrans-65.2-43.3173.5-176.1175.23.200111.3K325 I326 R332 R333K325-Q329 WeakPolarHBondContact O-CB 3.41Å; K325-Q329 PolarHBondContact O-N 2.9Å; I326-Q329 PolarHBondContact O-N 3.36Å; Q329-R332 PolarHBondContact O-N 3.33Å; Q329-R333 WeakPolarHBondContact O-CB 3.38Å; Q329-R333 PolarHBondContact O-N 2.89Å
330E96.7Very high96.5Very high90 Ų90114 Ų11442%0.42153%0.526SS..Hα-helixtrans-69.8-38.8-180-165.159.3-162.100112.2I326 R332 R333 K334I326-E330 WeakPolarHBondContact O-CB 3.38Å; I326-E330 PolarHBondContact O-N 3.14Å; E330-R332 VanDerWaalsContact C-N 3.32Å; E330-R332 PolarHBondContact O-N 3.23Å; E330-R333 PolarHBondContact O-N 2.95Å; E330-R333 IonicContact OE2-CZ 2.66Å; E330-R333 IonicContact OE2-NE 3.33Å; E330-R333 PolarHBondContact OE2-NE 3.48Å; E330-K334 WeakPolarHBondContact O-CB 3.3Å; E330-K334 PolarHBondContact O-N 2.89Å
331S98.4Very high96.9Very high83 Ų83107 Ų10758%0.5851%0.511SS*.Hα-helixtrans-59.8-40.8170.7174.70000112.3S327 K335S327-S331 VanDerWaalsContact O-CB 3.31Å; S327-S331 WeakPolarHBondContact O-CB 3.39Å; S327-S331 PolarHBondContact O-N 3.36Å; S331-K335 WeakPolarHBondContact O-CB 3.37Å; S331-K335 PolarHBondContact O-N 3.19Å
332R98.5Very high97.1Very high196 Ų196105 Ų10574%0.7451%0.505SS*.Hα-helixtrans-67.7-43175-71.9169.2-177.7-163.3-0.6112.1A328 Q329 E330 K335 K336A328-R332 WeakPolarHBondContact O-CD 3.46Å; A328-R332 VanDerWaalsContact O-CG 3.24Å; A328-R332 WeakPolarHBondContact O-CG 3.39Å; A328-R332 PolarHBondContact O-N 3.19Å; A328-R332 VanDerWaalsContact O-N 3.11Å; Q329-R332 PolarHBondContact O-N 3.33Å; E330-R332 VanDerWaalsContact C-N 3.32Å; E330-R332 PolarHBondContact O-N 3.23Å; R332-K335 PolarHBondContact O-N 2.9Å; R332-K336 PolarHBondContact O-N 3.4Å
333R98.4Very high97.6Very high128 Ų128108.6 Ų108.648%0.48352%0.521SS..Hα-helixtrans-56.4-55.5174.7-179.8-167.8-64.3-134.30.1110.4Q329 E330 K335 K336 E337Q329-R333 WeakPolarHBondContact O-CB 3.38Å; Q329-R333 PolarHBondContact O-N 2.89Å; E330-R333 PolarHBondContact O-N 2.95Å; E330-R333 IonicContact OE2-CZ 2.66Å; E330-R333 IonicContact OE2-NE 3.33Å; E330-R333 PolarHBondContact OE2-NE 3.48Å; R333-K335 VanDerWaalsContact C-N 3.29Å; R333-K335 PolarHBondContact O-N 3.22Å; R333-K336 CarbonylContact O-C 3.58Å; R333-K336 WeakPolarHBondContact O-CA 3.28Å; R333-K336 WeakPolarHBondContact O-CB 3.42Å; R333-K336 PolarHBondContact O-N 3.32Å; R333-E337 VanDerWaalsContact CD-OE1 3.28Å; R333-E337 WeakPolarHBondContact CD-OE1 3.48Å; R333-E337 HydrophobicContact CG-CG 4.33Å; R333-E337 WeakPolarHBondContact CG-OE1 3.45Å; R333-E337 WeakPolarHBondContact O-CG 3.27Å; R333-E337 PolarHBondContact O-N 3.34Å
334K98.6Very high97.7Very high147 Ų147107.1 Ų107.164%0.63952%0.515SS*.Hα-helixtrans-63.3-31.7-178.8-170.4165.1-175.2168.70113.2E330 Y338E330-K334 WeakPolarHBondContact O-CB 3.3Å; E330-K334 PolarHBondContact O-N 2.89Å; K334-Y338 WeakPolarHBondContact O-CB 3.42Å; K334-Y338 PolarHBondContact O-N 3.09Å
335K98.4Very high97.9Very high146 Ų146108.9 Ų108.964%0.63552%0.517SS*.Hα-helixtrans-67-39.4170-177.8172.4177.9177.70112.1S331 R332 R333 M339S331-K335 WeakPolarHBondContact O-CB 3.37Å; S331-K335 PolarHBondContact O-N 3.19Å; R332-K335 PolarHBondContact O-N 2.9Å; R333-K335 VanDerWaalsContact C-N 3.29Å; R333-K335 PolarHBondContact O-N 3.22Å; K335-M339 PolarHBondContact O-N 2.99Å
336K98.4Very high98Very high129 Ų129108.3 Ų108.356%0.56152%0.522SS*.Hα-helixtrans-64.6-51.8173.8-170.2-170-174.6-58.50110.6R332 R333 Y338 M339 D340R332-K336 PolarHBondContact O-N 3.4Å; R333-K336 CarbonylContact O-C 3.58Å; R333-K336 WeakPolarHBondContact O-CA 3.28Å; R333-K336 WeakPolarHBondContact O-CB 3.42Å; R333-K336 PolarHBondContact O-N 3.32Å; K336-Y338 PolarHBondContact O-N 2.89Å; K336-M339 CarbonylContact O-C 3.57Å; K336-M339 WeakPolarHBondContact O-CA 3.45Å; K336-M339 WeakPolarHBondContact O-CB 3.48Å; K336-M339 PolarHBondContact O-N 2.91Å; K336-D340 WeakPolarHBondContact CG-OD1 3.43Å; K336-D340 IonicContact NZ-OD1 2.7Å; K336-D340 PolarHBondContact NZ-OD1 3.15Å; K336-D340 IonicContact NZ-OD2 2.63Å; K336-D340 PolarHBondContact NZ-OD2 2.72Å; K336-D340 VanDerWaalsContact O-CG 3.26Å; K336-D340 PolarHBondContact O-N 2.85Å
337E98.6Very high98.3Very high97 Ų97109 Ų10945%0.45352%0.524SS..Hα-helixtrans-56-36.6179.2-69.1166.5172.800112.6R333 A341R333-E337 VanDerWaalsContact CD-OE1 3.28Å; R333-E337 WeakPolarHBondContact CD-OE1 3.48Å; R333-E337 HydrophobicContact CG-CG 4.33Å; R333-E337 WeakPolarHBondContact CG-OE1 3.45Å; R333-E337 WeakPolarHBondContact O-CG 3.27Å; R333-E337 PolarHBondContact O-N 3.34Å; E337-A341 WeakPolarHBondContact O-CB 3.39Å; E337-A341 PolarHBondContact O-N 3.39Å
338Y98.6Very high98.4Very high156 Ų156108.3 Ų108.361%0.61252%0.516SS*.Hα-helixtrans-66.7-38.9172.2175.2-97.8000113.1K334 K336 L342K334-Y338 WeakPolarHBondContact O-CB 3.42Å; K334-Y338 PolarHBondContact O-N 3.09Å; K336-Y338 PolarHBondContact O-N 2.89Å; Y338-L342 WeakPolarHBondContact O-CB 3.26Å; Y338-L342 PolarHBondContact O-N 2.92Å
339M98.8Very high98.4Very high80 Ų80109.9 Ų109.939%0.39452%0.524SS..Hα-helixtrans-68.7-51.5176.2-156.574.675.800111K335 K336 A341 L342 E343K335-M339 PolarHBondContact O-N 2.99Å; K336-M339 CarbonylContact O-C 3.57Å; K336-M339 WeakPolarHBondContact O-CA 3.45Å; K336-M339 WeakPolarHBondContact O-CB 3.48Å; K336-M339 PolarHBondContact O-N 2.91Å; M339-A341 PolarHBondContact O-N 2.92Å; M339-L342 WeakPolarHBondContact O-CA 3.36Å; M339-L342 WeakPolarHBondContact O-CB 3.27Å; M339-L342 PolarHBondContact O-N 3.35Å; M339-E343 VanDerWaalsContact CG-OE1 3.31Å; M339-E343 WeakPolarHBondContact CG-OE1 3.02Å; M339-E343 WeakPolarHBondContact O-CG 3.26Å; M339-E343 PolarHBondContact O-N 3.3Å
340D98.4Very high98.4Very high62 Ų62107.2 Ų107.233%0.33252%0.518SS..Hα-helixtrans-53.1-40.2175.8-61.1-2.7000111.1K336 K344K336-D340 WeakPolarHBondContact CG-OD1 3.43Å; K336-D340 IonicContact NZ-OD1 2.7Å; K336-D340 PolarHBondContact NZ-OD1 3.15Å; K336-D340 IonicContact NZ-OD2 2.63Å; K336-D340 PolarHBondContact NZ-OD2 2.72Å; K336-D340 VanDerWaalsContact O-CG 3.26Å; K336-D340 PolarHBondContact O-N 2.85Å; D340-K344 VanDerWaalsContact O-CB 3.29Å; D340-K344 WeakPolarHBondContact O-CB 3.35Å; D340-K344 PolarHBondContact O-N 2.8Å
341A98.6Very high98.5Very high51 Ų51107.6 Ų107.642%0.42152%0.523SS..Hα-helixtrans-75.1-26.6177.200000114E337 M339 K345E337-A341 WeakPolarHBondContact O-CB 3.39Å; E337-A341 PolarHBondContact O-N 3.39Å; M339-A341 PolarHBondContact O-N 2.92Å; A341-K345 WeakPolarHBondContact O-CG 3.47Å; A341-K345 PolarHBondContact O-N 3.48Å
342L98.7Very high98.5Very high76 Ų76108.9 Ų108.940%0.39852%0.52SS..Hα-helixtrans-76.5-46.1173.5-178.661000110.6Y338 M339 K344 K345 V346Y338-L342 WeakPolarHBondContact O-CB 3.26Å; Y338-L342 PolarHBondContact O-N 2.92Å; M339-L342 WeakPolarHBondContact O-CA 3.36Å; M339-L342 WeakPolarHBondContact O-CB 3.27Å; M339-L342 PolarHBondContact O-N 3.35Å; L342-K344 VanDerWaalsContact C-N 3.34Å; L342-K344 PolarHBondContact O-N 3.03Å; L342-K345 WeakPolarHBondContact O-CB 3.38Å; L342-K345 PolarHBondContact O-N 3.18Å; L342-V346 PolarHBondContact O-N 3.45Å
343E98.5Very high98.5Very high118 Ų118103 Ų10355%0.55150%0.503SS*.Hα-helixtrans-54.8-49.4173.1-70.7168-169.400110.6M339 K345 V346 E347M339-E343 VanDerWaalsContact CG-OE1 3.31Å; M339-E343 WeakPolarHBondContact CG-OE1 3.02Å; M339-E343 WeakPolarHBondContact O-CG 3.26Å; M339-E343 PolarHBondContact O-N 3.3Å; E343-K345 VanDerWaalsContact C-N 3.29Å; E343-K345 PolarHBondContact O-N 3.02Å; E343-V346 PolarHBondContact O-N 2.87Å; E343-V346 VanDerWaalsContact O-N 3.12Å; E343-E347 PolarHBondContact O-N 3.14Å
344K98.6Very high98.5Very high135 Ų135100.7 Ų100.759%0.58750%0.5SS*.Hα-helixtrans-60.1-33.8174.7-175.7170.1-177.1173.20113.7D340 L342 T348D340-K344 VanDerWaalsContact O-CB 3.29Å; D340-K344 WeakPolarHBondContact O-CB 3.35Å; D340-K344 PolarHBondContact O-N 2.8Å; L342-K344 VanDerWaalsContact C-N 3.34Å; L342-K344 PolarHBondContact O-N 3.03Å; K344-T348 WeakPolarHBondContact O-CB 3.46Å; K344-T348 PolarHBondContact O-N 2.92Å; K344-T348 PolarHBondContact O-OG1 2.79Å
345K98.6Very high98.5Very high151 Ų15198.3 Ų98.366%0.65749%0.491SS*.Hα-helixtrans-69.1-40.2174.5-81.8177.8175.7-170.60112A341 L342 E343 T348 C349A341-K345 WeakPolarHBondContact O-CG 3.47Å; A341-K345 PolarHBondContact O-N 3.48Å; L342-K345 WeakPolarHBondContact O-CB 3.38Å; L342-K345 PolarHBondContact O-N 3.18Å; E343-K345 VanDerWaalsContact C-N 3.29Å; E343-K345 PolarHBondContact O-N 3.02Å; K345-T348 PolarHBondContact O-N 3.4Å; K345-C349 VanDerWaalsContact O-CB 3.3Å; K345-C349 WeakPolarHBondContact O-CB 3.03Å; K345-C349 PolarHBondContact O-N 3.31Å
346V98.6Very high98.5Very high98 Ų9896.3 Ų96.359%0.59449%0.487SS*.Hα-helixtrans-64.1-44.4174.5177.60000110.6L342 E343 C349 S350L342-V346 PolarHBondContact O-N 3.45Å; E343-V346 PolarHBondContact O-N 2.87Å; E343-V346 VanDerWaalsContact O-N 3.12Å; V346-C349 PolarHBondContact O-N 3.39Å; V346-S350 VanDerWaalsContact O-CB 3.24Å; V346-S350 WeakPolarHBondContact O-CB 3.31Å; V346-S350 PolarHBondContact O-N 3.49Å
347E98.6Very high98.6Very high117 Ų11798 Ų9855%0.54749%0.49SS..Hα-helixtrans-58.1-49.4173.7179.5-176.9-132.500111.9E343 C349 S350 N351E343-E347 PolarHBondContact O-N 3.14Å; E347-C349 PolarHBondContact O-N 3.42Å; E347-S350 PolarHBondContact O-N 3.19Å; E347-N351 WeakPolarHBondContact O-CB 3.45Å; E347-N351 VanDerWaalsContact O-CG 3.28Å; E347-N351 PolarHBondContact O-N 2.76Å; E347-N351 PolarHBondContact O-ND2 2.98Å
348T98.4Very high98.6Very high58 Ų58100.9 Ų100.936%0.35650%0.496SS..Hα-helixtrans-60.2-49.7179.7-54.40000111.1K344 K345 S350 N351 E352K344-T348 WeakPolarHBondContact O-CB 3.46Å; K344-T348 PolarHBondContact O-N 2.92Å; K344-T348 PolarHBondContact O-OG1 2.79Å; K345-T348 PolarHBondContact O-N 3.4Å; T348-S350 VanDerWaalsContact C-N 3.33Å; T348-S350 PolarHBondContact O-N 3.19Å; T348-N351 PolarHBondContact O-N 3.17Å; T348-E352 WeakPolarHBondContact O-CG 3.24Å; T348-E352 PolarHBondContact O-N 2.93Å
349C98.4Very high98.6Very high74 Ų7498.2 Ų98.250%0.549%0.488SS..Hα-helixtrans-64.7-35.7178.8-174.20000112.3K345 V346 E347 N353K345-C349 VanDerWaalsContact O-CB 3.3Å; K345-C349 WeakPolarHBondContact O-CB 3.03Å; K345-C349 PolarHBondContact O-N 3.31Å; V346-C349 PolarHBondContact O-N 3.39Å; E347-C349 PolarHBondContact O-N 3.42Å; C349-N353 VanDerWaalsContact O-CB 3.29Å; C349-N353 WeakPolarHBondContact O-CB 3.29Å; C349-N353 PolarHBondContact O-N 3.32Å
350S98.6Very high98.5Very high60 Ų6098.2 Ų98.242%0.4249%0.492SS..Hα-helixtrans-63.7-44.4173.4-170.40000111.6V346 E347 T348 N353 N354V346-S350 VanDerWaalsContact O-CB 3.24Å; V346-S350 WeakPolarHBondContact O-CB 3.31Å; V346-S350 PolarHBondContact O-N 3.49Å; E347-S350 PolarHBondContact O-N 3.19Å; T348-S350 VanDerWaalsContact C-N 3.33Å; T348-S350 PolarHBondContact O-N 3.19Å; S350-N353 PolarHBondContact O-N 2.68Å; S350-N354 WeakPolarHBondContact O-CB 3.32Å; S350-N354 PolarHBondContact O-N 2.99Å; S350-N354 PolarHBondContact O-ND2 3.21Å
351N98.6Very high98.6Very high97 Ų97101.6 Ų101.652%0.51951%0.506SS..Hα-helixtrans-63.7-44.5177.4-71.1-26.5000111.9E347 T348 N353 N354 E355E347-N351 WeakPolarHBondContact O-CB 3.45Å; E347-N351 VanDerWaalsContact O-CG 3.28Å; E347-N351 PolarHBondContact O-N 2.76Å; E347-N351 PolarHBondContact O-ND2 2.98Å; T348-N351 PolarHBondContact O-N 3.17Å; N351-N353 PolarHBondContact O-N 3.35Å; N351-N354 PolarHBondContact O-N 2.89Å; N351-E355 PolarHBondContact O-N 2.92Å
352E98.5Very high98.6Very high110 Ų110103 Ų10351%0.51451%0.51SS..Hα-helixtrans-59.7-44.1173-71.5169.9-175.600111.8T348 N354 E355 L356T348-E352 WeakPolarHBondContact O-CG 3.24Å; T348-E352 PolarHBondContact O-N 2.93Å; E352-N354 PolarHBondContact O-N 3.49Å; E352-E355 PolarHBondContact O-N 2.91Å; E352-L356 WeakPolarHBondContact O-CB 3.35Å; E352-L356 VanDerWaalsContact O-CG 3.31Å; E352-L356 WeakPolarHBondContact O-CG 3.28Å; E352-L356 PolarHBondContact O-N 2.92Å
353N98.4Very high98.6Very high73 Ų73105.1 Ų105.139%0.3952%0.521SS..Hα-helixtrans-62.2-42.3177.4-158.4-71000111.5C349 S350 N351 L356 R357C349-N353 VanDerWaalsContact O-CB 3.29Å; C349-N353 WeakPolarHBondContact O-CB 3.29Å; C349-N353 PolarHBondContact O-N 3.32Å; S350-N353 PolarHBondContact O-N 2.68Å; N351-N353 PolarHBondContact O-N 3.35Å; N353-L356 PolarHBondContact O-N 3.29Å; N353-R357 VanDerWaalsContact O-CG 3.28Å; N353-R357 WeakPolarHBondContact O-CG 3.31Å; N353-R357 PolarHBondContact O-N 2.93Å; N353-R357 PolarHBondContact OD1-NE 2.89Å; N353-R357 PolarHBondContact OD1-NH2 3.31Å
354N98.5Very high98.6Very high79 Ų79103.9 Ų103.942%0.42252%0.515SS..Hα-helixtrans-66.8-37.4176-74.8-46000112.6S350 N351 E352 R358S350-N354 WeakPolarHBondContact O-CB 3.32Å; S350-N354 PolarHBondContact O-N 2.99Å; S350-N354 PolarHBondContact O-ND2 3.21Å; N351-N354 PolarHBondContact O-N 2.89Å; E352-N354 PolarHBondContact O-N 3.49Å; N354-R358 PolarHBondContact O-N 3.27Å; N354-R358 VanDerWaalsContact O-N 3.09Å
355E98.5Very high98.5Very high97 Ų97101.5 Ų101.545%0.45351%0.514SS..Hα-helixtrans-67.1-42.4173.9-163.4-168.914700111.5N351 E352 R358 K359N351-E355 PolarHBondContact O-N 2.92Å; E352-E355 PolarHBondContact O-N 2.91Å; E355-R358 PolarHBondContact O-N 3.29Å; E355-K359 WeakPolarHBondContact O-CG 3.45Å; E355-K359 PolarHBondContact O-N 2.91Å; E355-K359 WeakPolarHBondContact OE1-CE 3.41Å; E355-K359 IonicContact OE1-NZ 2.61Å; E355-K359 PolarHBondContact OE1-NZ 3.3Å
356L98.7Very high98.5Very high104 Ų10497.7 Ų97.755%0.54550%0.504SS..Hα-helixtrans-62.6-42.8175.5-72.8168.4000111.8E352 N353 R358 K359 V360E352-L356 WeakPolarHBondContact O-CB 3.35Å; E352-L356 VanDerWaalsContact O-CG 3.31Å; E352-L356 WeakPolarHBondContact O-CG 3.28Å; E352-L356 PolarHBondContact O-N 2.92Å; N353-L356 PolarHBondContact O-N 3.29Å; L356-R358 PolarHBondContact O-N 2.61Å; L356-K359 WeakPolarHBondContact O-CB 3.4Å; L356-K359 PolarHBondContact O-N 3.12Å; L356-V360 WeakPolarHBondContact O-CG2 3.48Å; L356-V360 PolarHBondContact O-N 3.29Å
357R98.6Very high98.5Very high165 Ų16597.3 Ų97.362%0.62350%0.499SS*.Hα-helixtrans-57.5-47.5173.2-74.7169.4-172.8-108.4-1.5111.9N353 K359 V360 E361N353-R357 VanDerWaalsContact O-CG 3.28Å; N353-R357 WeakPolarHBondContact O-CG 3.31Å; N353-R357 PolarHBondContact O-N 2.93Å; N353-R357 PolarHBondContact OD1-NE 2.89Å; N353-R357 PolarHBondContact OD1-NH2 3.31Å; R357-K359 VanDerWaalsContact C-N 3.31Å; R357-K359 PolarHBondContact O-N 2.98Å; R357-V360 PolarHBondContact O-N 3.47Å; R357-E361 WeakPolarHBondContact O-CB 3.41Å; R357-E361 PolarHBondContact O-N 3.41Å
358R98.6Very high98.5Very high157 Ų15797 Ų9759%0.59250%0.496SS*.Hα-helixtrans-63-36.1177.7-165.6-173.9-59.7146.33.7112.2N354 E355 L356 T362N354-R358 PolarHBondContact O-N 3.27Å; N354-R358 VanDerWaalsContact O-N 3.09Å; E355-R358 PolarHBondContact O-N 3.29Å; L356-R358 PolarHBondContact O-N 2.61Å; R358-T362 WeakPolarHBondContact O-CB 3.35Å; R358-T362 PolarHBondContact O-N 2.86Å; R358-T362 PolarHBondContact O-OG1 2.95Å
359K98.6Very high98.5Very high101 Ų10196.6 Ų96.644%0.43950%0.495SS..Hα-helixtrans-65-45172.9-73.6169.5-177.5167.50111.5E355 L356 R357 T362 L363E355-K359 WeakPolarHBondContact O-CG 3.45Å; E355-K359 PolarHBondContact O-N 2.91Å; E355-K359 WeakPolarHBondContact OE1-CE 3.41Å; E355-K359 IonicContact OE1-NZ 2.61Å; E355-K359 PolarHBondContact OE1-NZ 3.3Å; L356-K359 WeakPolarHBondContact O-CB 3.4Å; L356-K359 PolarHBondContact O-N 3.12Å; R357-K359 VanDerWaalsContact C-N 3.31Å; R357-K359 PolarHBondContact O-N 2.98Å; K359-T362 PolarHBondContact O-N 3.5Å; K359-L363 WeakPolarHBondContact O-CB 3.42Å; K359-L363 VanDerWaalsContact O-CG 3.27Å; K359-L363 WeakPolarHBondContact O-CG 3.3Å; K359-L363 PolarHBondContact O-N 2.96Å
360V98.7Very high98.5Very high79 Ų7997.7 Ų97.748%0.47950%0.495SS..Hα-helixtrans-60.5-48.9175.4171.80000111L356 R357 T362 L363 E364L356-V360 WeakPolarHBondContact O-CG2 3.48Å; L356-V360 PolarHBondContact O-N 3.29Å; R357-V360 PolarHBondContact O-N 3.47Å; V360-T362 VanDerWaalsContact C-N 3.32Å; V360-T362 PolarHBondContact O-N 3.49Å; V360-L363 PolarHBondContact O-N 3.44Å; V360-L363 VanDerWaalsContact O-N 3.15Å; V360-E364 HydrophobicContact CG1-CG 4.46Å; V360-E364 WeakPolarHBondContact O-CB 3.47Å; V360-E364 PolarHBondContact O-N 3.44Å
361E98.6Very high98.5Very high134 Ų13499 Ų9963%0.62650%0.497SS*.Hα-helixtrans-56.4-43.6175.9179.7179.6-149.400112.4R357 E364 C365R357-E361 WeakPolarHBondContact O-CB 3.41Å; R357-E361 PolarHBondContact O-N 3.41Å; E361-E364 PolarHBondContact O-N 3.42Å; E361-C365 WeakPolarHBondContact O-CB 3.47Å; E361-C365 PolarHBondContact O-N 3.28Å
362T98.6Very high98.4Very high81 Ų81100.7 Ų100.750%0.49750%0.502SS..Hα-helixtrans-65-42.7176.6-55.70000111.7R358 K359 V360 C365 T366R358-T362 WeakPolarHBondContact O-CB 3.35Å; R358-T362 PolarHBondContact O-N 2.86Å; R358-T362 PolarHBondContact O-OG1 2.95Å; K359-T362 PolarHBondContact O-N 3.5Å; V360-T362 VanDerWaalsContact C-N 3.32Å; V360-T362 PolarHBondContact O-N 3.49Å; T362-C365 PolarHBondContact O-N 2.87Å; T362-T366 WeakPolarHBondContact O-CG2 3.37Å; T362-T366 PolarHBondContact O-N 3.04Å; T362-T366 PolarHBondContact O-OG1 3.2Å
363L98.7Very high98.4Very high119 Ų119100.5 Ų100.562%0.62350%0.501SS*.Hα-helixtrans-67.3-39.4177.1-72.5170.7000111.9K359 V360 T366 N367K359-L363 WeakPolarHBondContact O-CB 3.42Å; K359-L363 VanDerWaalsContact O-CG 3.27Å; K359-L363 WeakPolarHBondContact O-CG 3.3Å; K359-L363 PolarHBondContact O-N 2.96Å; V360-L363 PolarHBondContact O-N 3.44Å; V360-L363 VanDerWaalsContact O-N 3.15Å; L363-T366 WeakPolarHBondContact CA-OG1 3.4Å; L363-T366 PolarHBondContact O-OG1 2.91Å; L363-N367 WeakPolarHBondContact O-CB 3.29Å; L363-N367 PolarHBondContact O-N 3Å
364E98.6Very high98.3Very high93 Ų93102.1 Ų102.144%0.43551%0.509SS..Hα-helixtrans-62.7-46171.7-80.3-170.3-143.100112.1V360 E361 T366 N367 K368V360-E364 HydrophobicContact CG1-CG 4.46Å; V360-E364 WeakPolarHBondContact O-CB 3.47Å; V360-E364 PolarHBondContact O-N 3.44Å; E361-E364 PolarHBondContact O-N 3.42Å; E364-T366 PolarHBondContact O-N 2.83Å; E364-N367 PolarHBondContact O-N 3.01Å; E364-K368 WeakPolarHBondContact O-CB 3.41Å; E364-K368 WeakPolarHBondContact O-CD 3.41Å; E364-K368 WeakPolarHBondContact O-CG 3.48Å; E364-K368 PolarHBondContact O-N 2.81Å; E364-K368 IonicContact OE2-NZ 2.67Å; E364-K368 PolarHBondContact OE2-NZ 2.93Å
365C98.3Very high98.2Very high85 Ų85104.4 Ų104.457%0.57452%0.517SS*.Hα-helixtrans-61.9-44.2179.5-172.60000111.5E361 T362 S369E361-C365 WeakPolarHBondContact O-CB 3.47Å; E361-C365 PolarHBondContact O-N 3.28Å; T362-C365 PolarHBondContact O-N 2.87Å; C365-S369 PolarHBondContact O-N 3.06Å
366T98.3Very high98.1Very high70 Ų70102.3 Ų102.343%0.42952%0.517SS..Hα-helixtrans-68-39.4176.148.40000112.3T362 L363 E364 S369 L370T362-T366 WeakPolarHBondContact O-CG2 3.37Å; T362-T366 PolarHBondContact O-N 3.04Å; T362-T366 PolarHBondContact O-OG1 3.2Å; L363-T366 WeakPolarHBondContact CA-OG1 3.4Å; L363-T366 PolarHBondContact O-OG1 2.91Å; E364-T366 PolarHBondContact O-N 2.83Å; T366-S369 PolarHBondContact O-N 3.25Å; T366-L370 WeakPolarHBondContact O-CG 3.4Å; T366-L370 PolarHBondContact O-N 3.17Å
367N98.4Very high97.9Very high91 Ų91102 Ų10249%0.48752%0.515SS..Hα-helixtrans-63.2-46.9174.8-169.4-65.5000111.8L363 E364 S369 L370 L371L363-N367 WeakPolarHBondContact O-CB 3.29Å; L363-N367 PolarHBondContact O-N 3Å; E364-N367 PolarHBondContact O-N 3.01Å; N367-S369 VanDerWaalsContact C-N 3.31Å; N367-S369 PolarHBondContact O-N 2.69Å; N367-L370 PolarHBondContact O-N 3.03Å; N367-L370 VanDerWaalsContact O-N 3.12Å; N367-L371 WeakPolarHBondContact O-CG 3.33Å; N367-L371 PolarHBondContact O-N 3.14Å; N367-L371 VanDerWaalsContact OD1-CD1 3.28Å; N367-L371 WeakPolarHBondContact OD1-CD1 3.42Å
368K98.3Very high97.7Very high111 Ų111100.8 Ų100.848%0.48352%0.516SS..Hα-helixtrans-55.6-44.3173.6-71.2161-168.8166.60111.1E364 L371 Q372E364-K368 WeakPolarHBondContact O-CB 3.41Å; E364-K368 WeakPolarHBondContact O-CD 3.41Å; E364-K368 WeakPolarHBondContact O-CG 3.48Å; E364-K368 PolarHBondContact O-N 2.81Å; E364-K368 IonicContact OE2-NZ 2.67Å; E364-K368 PolarHBondContact OE2-NZ 2.93Å; K368-L371 PolarHBondContact O-N 2.84Å; K368-Q372 WeakPolarHBondContact O-CG 3.47Å; K368-Q372 PolarHBondContact O-N 3.3Å
369S98.4Very high97.4Very high49 Ų4996.5 Ų96.534%0.34351%0.514SS..Hα-helixtrans-64.3-41.3175.1-178.20000113.2C365 T366 N367 Q372 Q373C365-S369 PolarHBondContact O-N 3.06Å; T366-S369 PolarHBondContact O-N 3.25Å; N367-S369 VanDerWaalsContact C-N 3.31Å; N367-S369 PolarHBondContact O-N 2.69Å; S369-Q372 PolarHBondContact O-N 3.21Å; S369-Q373 WeakPolarHBondContact O-CG 3.5Å; S369-Q373 PolarHBondContact O-N 3.45Å
370L98.4Very high97Very high97 Ų9797.1 Ų97.151%0.50852%0.52SS..Hα-helixtrans-68-38.9178.1-72.5168.7000111.7T366 N367 Q373 L374T366-L370 WeakPolarHBondContact O-CG 3.4Å; T366-L370 PolarHBondContact O-N 3.17Å; N367-L370 PolarHBondContact O-N 3.03Å; N367-L370 VanDerWaalsContact O-N 3.12Å; L370-Q373 PolarHBondContact O-N 2.63Å; L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 3.35Å
371L98.1Very high96.6Very high88 Ų8897.2 Ų97.246%0.46152%0.521SS..Hα-helixtrans-62.8-42.2173.3-71.6173.9000111.8N367 K368 Q373 L374 Q375N367-L371 WeakPolarHBondContact O-CG 3.33Å; N367-L371 PolarHBondContact O-N 3.14Å; N367-L371 VanDerWaalsContact OD1-CD1 3.28Å; N367-L371 WeakPolarHBondContact OD1-CD1 3.42Å; K368-L371 PolarHBondContact O-N 2.84Å; L371-Q373 PolarHBondContact O-N 2.7Å; L371-L374 PolarHBondContact O-N 2.85Å; L371-Q375 WeakPolarHBondContact O-CB 3.4Å; L371-Q375 WeakPolarHBondContact O-CG 3.39Å; L371-Q375 PolarHBondContact O-N 2.88Å
372Q97.7Very high95.6Very high131 Ų13192.9 Ų92.961%0.61251%0.508SS*.Hα-helixtrans-61.4-42.2173.6-73.7170.5-8.300112.1K368 S369 Q375 A376K368-Q372 WeakPolarHBondContact O-CG 3.47Å; K368-Q372 PolarHBondContact O-N 3.3Å; S369-Q372 PolarHBondContact O-N 3.21Å; Q372-Q375 PolarHBondContact O-N 2.82Å; Q372-A376 WeakPolarHBondContact O-CB 3.31Å; Q372-A376 PolarHBondContact O-N 3.2Å
373Q97.6Very high94Very high106 Ų10690.9 Ų90.950%0.49550%0.503SS..Hα-helixtrans-63.7-43175.1-71.4173.420.400112S369 L370 L371 A376 L377S369-Q373 WeakPolarHBondContact O-CG 3.5Å; S369-Q373 PolarHBondContact O-N 3.45Å; L370-Q373 PolarHBondContact O-N 2.63Å; L371-Q373 PolarHBondContact O-N 2.7Å; Q373-A376 PolarHBondContact O-N 2.95Å; Q373-L377 WeakPolarHBondContact O-CB 3.14Å; Q373-L377 VanDerWaalsContact O-CG 3.28Å; Q373-L377 WeakPolarHBondContact O-CG 3.28Å; Q373-L377 PolarHBondContact O-N 3.37Å
374L97.2Very high92.2Very high107 Ų10793.3 Ų93.356%0.5651%0.509SS*.Hα-helixtrans-63.2-42.3175.7-73.6170.6000112L370 L371 L377 Q378L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 3.35Å; L371-L374 PolarHBondContact O-N 2.85Å; L374-L377 PolarHBondContact O-N 3.05Å; L374-Q378 VanDerWaalsContact O-CB 3.29Å; L374-Q378 WeakPolarHBondContact O-CB 3.24Å; L374-Q378 PolarHBondContact O-N 3.27Å
375Q96Very high90.2Very high127 Ų12793.8 Ų93.859%0.59351%0.513SS*.Hα-helixtrans-63.2-42.8174.8-74.2175.4-5.700112L371 Q372 Q378 A379L371-Q375 WeakPolarHBondContact O-CB 3.4Å; L371-Q375 WeakPolarHBondContact O-CG 3.39Å; L371-Q375 PolarHBondContact O-N 2.88Å; Q372-Q375 PolarHBondContact O-N 2.82Å; Q375-Q378 PolarHBondContact O-N 3.27Å; Q375-A379 WeakPolarHBondContact O-CB 3.3Å; Q375-A379 PolarHBondContact O-N 3.27Å
376A95.3Very high88Confident54 Ų5497.3 Ų97.345%0.44652%0.521SS..Hα-helixtrans-63.9-42176.100000112.3Q372 Q373 A379 M380Q372-A376 WeakPolarHBondContact O-CB 3.31Å; Q372-A376 PolarHBondContact O-N 3.2Å; Q373-A376 PolarHBondContact O-N 2.95Å; A376-A379 PolarHBondContact O-N 3.29Å; A376-M380 WeakPolarHBondContact O-CG 3.23Å; A376-M380 PolarHBondContact O-N 2.99Å; A376-M380 VanDerWaalsContact O-N 3.07Å
377L95.6Very high85.5Confident97 Ų97103 Ų10351%0.50854%0.54SS..Hα-helixtrans-62.8-46.2172.9-73.1166.5000111.4Q373 L374 A379 M380 V381Q373-L377 WeakPolarHBondContact O-CB 3.14Å; Q373-L377 VanDerWaalsContact O-CG 3.28Å; Q373-L377 WeakPolarHBondContact O-CG 3.28Å; Q373-L377 PolarHBondContact O-N 3.37Å; L374-L377 PolarHBondContact O-N 3.05Å; L377-A379 VanDerWaalsContact C-N 3.34Å; L377-A379 PolarHBondContact O-N 3.18Å; L377-M380 HydrophobicContact CD2-CE 4.01Å; L377-M380 PolarHBondContact O-N 3.11Å; L377-V381 WeakPolarHBondContact O-CB 3.37Å; L377-V381 VanDerWaalsContact O-CG2 3.31Å; L377-V381 WeakPolarHBondContact O-CG2 3.49Å; L377-V381 PolarHBondContact O-N 3.05Å
378Q93.8Very high83.1Confident140 Ų140104.3 Ų104.365%0.65456%0.556SS**Hα-helixtrans-61.1-40.8177.7-176.1175.7-7.600111.7L374 Q375 V381 A382L374-Q378 VanDerWaalsContact O-CB 3.29Å; L374-Q378 WeakPolarHBondContact O-CB 3.24Å; L374-Q378 PolarHBondContact O-N 3.27Å; Q375-Q378 PolarHBondContact O-N 3.27Å; Q378-V381 PolarHBondContact O-N 3.33Å; Q378-A382 VanDerWaalsContact O-CB 3.22Å; Q378-A382 WeakPolarHBondContact O-CB 3.21Å; Q378-A382 PolarHBondContact O-N 2.86Å
379A91.6Very high80.5Confident66 Ų66104.2 Ų104.255%0.54557%0.568SS.*Hα-helixtrans-62.6-46174.700000112.1Q375 A376 L377 V381 G383Q375-A379 WeakPolarHBondContact O-CB 3.3Å; Q375-A379 PolarHBondContact O-N 3.27Å; A376-A379 PolarHBondContact O-N 3.29Å; L377-A379 VanDerWaalsContact C-N 3.34Å; L377-A379 PolarHBondContact O-N 3.18Å; A379-V381 VanDerWaalsContact C-N 3.32Å; A379-V381 PolarHBondContact O-N 2.97Å; A379-G383 PolarHBondContact O-N 2.87Å
380M91.2Very high77.8Confident115 Ų115113.2 Ų113.257%0.56760%0.595SS**Hα-helixtrans-64.2-33.9176.2-74.1-167.1-70.800113.4A376 L377 K384A376-M380 WeakPolarHBondContact O-CG 3.23Å; A376-M380 PolarHBondContact O-N 2.99Å; A376-M380 VanDerWaalsContact O-N 3.07Å; L377-M380 HydrophobicContact CD2-CE 4.01Å; L377-M380 PolarHBondContact O-N 3.11Å; M380-K384 WeakPolarHBondContact O-CG 3.43Å
381V89.1Confident75.3Confident80 Ų80116.8 Ų116.849%0.48561%0.611SS.*Hα-helixtrans-76.6-47.9177.9169.70000111L377 Q378 A379 G383 K384 I385L377-V381 WeakPolarHBondContact O-CB 3.37Å; L377-V381 VanDerWaalsContact O-CG2 3.31Å; L377-V381 WeakPolarHBondContact O-CG2 3.49Å; L377-V381 PolarHBondContact O-N 3.05Å; Q378-V381 PolarHBondContact O-N 3.33Å; A379-V381 VanDerWaalsContact C-N 3.32Å; A379-V381 PolarHBondContact O-N 2.97Å; V381-G383 VanDerWaalsContact C-N 3.35Å; V381-G383 PolarHBondContact O-N 2.85Å; V381-K384 PolarHBondContact O-N 2.97Å; V381-K384 VanDerWaalsContact O-N 3.08Å; V381-I385 HydrophobicContact CG1-CD1 3.56Å; V381-I385 HydrophobicContact CG1-CG1 4.32Å; V381-I385 WeakPolarHBondContact O-CG1 3.2Å; V381-I385 PolarHBondContact O-N 2.66Å
382A79.2Confident72.7Confident43 Ų43117.5 Ų117.536%0.35563%0.63SS.*Hα-helixtrans-59.2-44.5177.100000111.8Q378 K384 I385 Q386Q378-A382 VanDerWaalsContact O-CB 3.22Å; Q378-A382 WeakPolarHBondContact O-CB 3.21Å; Q378-A382 PolarHBondContact O-N 2.86Å; A382-K384 PolarHBondContact O-N 3.3Å; A382-I385 PolarHBondContact O-N 3.43Å; A382-I385 VanDerWaalsContact O-N 3.17Å; A382-Q386 PolarHBondContact O-N 3.03Å
383G64.6Low70.6Confident39 Ų39114.2 Ų114.240%0.40263%0.631SS.*Hα-helixtrans-63.1-19.9176.300000114.7A379 V381A379-G383 PolarHBondContact O-N 2.87Å; V381-G383 VanDerWaalsContact C-N 3.35Å; V381-G383 PolarHBondContact O-N 2.85Å
384K60.3Low68.5Low171 Ų171115.3 Ų115.374%0.74365%0.645SS**Hα-helixtrans-89.5-37.7171.4-77.6173.9176.1171.40112.8M380 V381 A382M380-K384 WeakPolarHBondContact O-CG 3.43Å; V381-K384 PolarHBondContact O-N 2.97Å; V381-K384 VanDerWaalsContact O-N 3.08Å; A382-K384 PolarHBondContact O-N 3.3Å
385I56.4Low66.6Low103 Ų103117.5 Ų117.553%0.52865%0.652SS.*Hα-helixtrans-75.9-38.3-175.1-68.3175.2000112.8V381 A382 K387 S388V381-I385 HydrophobicContact CG1-CD1 3.56Å; V381-I385 HydrophobicContact CG1-CG1 4.32Å; V381-I385 WeakPolarHBondContact O-CG1 3.2Å; V381-I385 PolarHBondContact O-N 2.66Å; A382-I385 PolarHBondContact O-N 3.43Å; A382-I385 VanDerWaalsContact O-N 3.17Å; I385-K387 PolarHBondContact O-N 2.85Å; I385-S388 PolarHBondContact O-N 2.84Å
386Q51.8Low64.6Low158 Ų158116.6 Ų116.674%0.73866%0.655SS**THydrogen-bonded Turntrans-59-17.9-172.8-81.5-173-34.800115.5A382A382-Q386 PolarHBondContact O-N 3.03Å
387K45.8Very low63.1Low191 Ų191117.9 Ų117.983%0.8366%0.661SS**THydrogen-bonded Turntrans-95-8.9-174-64.7178.9-177.2174.10114.9I385I385-K387 PolarHBondContact O-N 2.85Å
388S49Very low61.8Low117 Ų117116.2 Ų116.282%0.81866%0.658SS**THydrogen-bonded Turntrans-122-9.4-174.9-165.60000115.7I385I385-S388 PolarHBondContact O-N 2.84Å
389C43.5Very low60.6Low110 Ų110113.3 Ų113.374%0.74365%0.652SS**  trans-117.924-174.7-150.30000113.9M391C389-M391 PolarHBondContact O-N 3.16Å
390R42.4Very low60.3Low238 Ų238115.6 Ų115.690%0.89865%0.654SS**SBendtrans-79.790.6178-158.5-172.6-138.6-114.87.9111
391M46.1Very low59.7Low172 Ų172116.7 Ų116.785%0.84766%0.66SS**  trans68.865.2160-156.579.290.300117.3C389C389-M391 PolarHBondContact O-N 3.16Å
392A42.4Very low59.5Low103 Ų103117 Ų11785%0.85166%0.662SS**  trans-100.770.2153.500000109.2T394A392-T394 PolarHBondContact O-N 2.89Å
393G54.3Low59.9Low62 Ų62118.2 Ų118.264%0.63967%0.665SS**  trans-77.9100.7-167.900000114.4
394T53.3Low61Low129 Ų129121 Ų12179%0.79167%0.674SS**  trans-168.2168.8158.13.60000111.3A392 T396A392-T394 PolarHBondContact O-N 2.89Å; T394-T396 PolarHBondContact O-N 3.37Å; T394-T396 VanDerWaalsContact O-N 3.15Å
395Q56.2Low62.1Low152 Ų152117.7 Ų117.771%0.7166%0.663SS**SBendtrans72.3-15.1167.9-147.4177.529.200119.9S397 S398Q395-S397 PolarHBondContact O-N 3.04Å; Q395-S398 WeakPolarHBondContact O-CB 3.45Å; Q395-S398 PolarHBondContact O-N 3.47Å
396T55.2Low63.5Low108 Ų108116.4 Ų116.466%0.66366%0.663SS**Hα-helixtrans-66.4-38173.4-46.20000112.6T394 S398 C399 L400T394-T396 PolarHBondContact O-N 3.37Å; T394-T396 VanDerWaalsContact O-N 3.15Å; T396-S398 PolarHBondContact O-N 2.93Å; T396-C399 PolarHBondContact O-N 3.23Å; T396-C399 VanDerWaalsContact O-N 3.15Å; T396-L400 PolarHBondContact O-N 3.29Å
397S62.6Low65Low81 Ų81115.2 Ų115.257%0.56666%0.655SS**Hα-helixtrans-60-34.4175.251.50000112.5Q395 C399 L400 M401Q395-S397 PolarHBondContact O-N 3.04Å; S397-C399 VanDerWaalsContact C-N 3.33Å; S397-C399 PolarHBondContact O-N 2.69Å; S397-L400 PolarHBondContact O-N 3.33Å; S397-M401 WeakPolarHBondContact O-CB 3.27Å; S397-M401 WeakPolarHBondContact O-CG 3.37Å; S397-M401 PolarHBondContact O-N 3.32Å
398S69.4Low66.7Low63 Ų63108.9 Ų108.944%0.44164%0.639SS.*Hα-helixtrans-61.3-39.7175.6-48.50000112.1Q395 T396 V402Q395-S398 WeakPolarHBondContact O-CB 3.45Å; Q395-S398 PolarHBondContact O-N 3.47Å; T396-S398 PolarHBondContact O-N 2.93Å; S398-V402 WeakPolarHBondContact O-CG2 3.31Å; S398-V402 PolarHBondContact O-N 2.99Å
399C69Low68.3Low79 Ų79108.3 Ų108.353%0.53463%0.626SS.*Hα-helixtrans-67.4-44.4177.3-170.50000111.8T396 S397 V402 V403T396-C399 PolarHBondContact O-N 3.23Å; T396-C399 VanDerWaalsContact O-N 3.15Å; S397-C399 VanDerWaalsContact C-N 3.33Å; S397-C399 PolarHBondContact O-N 2.69Å; C399-V402 PolarHBondContact O-N 3.15Å; C399-V403 WeakPolarHBondContact O-CG2 3.4Å; C399-V403 PolarHBondContact O-N 3.07Å
400L84.3Confident70.2Confident113 Ų113108.9 Ų108.959%0.59262%0.616SS**Hα-helixtrans-64.6-40.8177.9-64176.5000111.6T396 S397 V402 V403 V404T396-L400 PolarHBondContact O-N 3.29Å; S397-L400 PolarHBondContact O-N 3.33Å; L400-V402 VanDerWaalsContact C-N 3.33Å; L400-V402 PolarHBondContact O-N 2.93Å; L400-V403 PolarHBondContact O-N 3.3Å; L400-V404 WeakPolarHBondContact O-CG2 3.41Å; L400-V404 PolarHBondContact O-N 3.3Å
401M79.8Confident71.9Confident139 Ų139102.4 Ų102.469%0.68560%0.599SS**Hα-helixtrans-58.7-42172.6-74.6-75.9-72.200112.2S397 L405S397-M401 WeakPolarHBondContact O-CB 3.27Å; S397-M401 WeakPolarHBondContact O-CG 3.37Å; S397-M401 PolarHBondContact O-N 3.32Å; M401-L405 VanDerWaalsContact O-CB 3.22Å; M401-L405 WeakPolarHBondContact O-CB 3.35Å; M401-L405 PolarHBondContact O-N 3.22Å
402V84.8Confident73.1Confident85 Ų8596.5 Ų96.552%0.51558%0.582SS.*Hα-helixtrans-66.2-42.1176.2168.40000111.6S398 C399 L400 L405 C406S398-V402 WeakPolarHBondContact O-CG2 3.31Å; S398-V402 PolarHBondContact O-N 2.99Å; C399-V402 PolarHBondContact O-N 3.15Å; L400-V402 VanDerWaalsContact C-N 3.33Å; L400-V402 PolarHBondContact O-N 2.93Å; V402-L405 PolarHBondContact O-N 3.49Å; V402-C406 WeakPolarHBondContact O-CB 3.42Å; V402-C406 PolarHBondContact O-N 2.97Å; V402-C406 PolarHBondContact O-SG 3Å; V402-C406 VanDerWaalsContact O-SG 3.36Å
403V87.1Confident74.2Confident70 Ų7095.7 Ų95.742%0.42457%0.57SS.*Hα-helixtrans-62.7-47.5176.4172.80000111.2C399 L400 L405 C406 F407C399-V403 WeakPolarHBondContact O-CG2 3.4Å; C399-V403 PolarHBondContact O-N 3.07Å; L400-V403 PolarHBondContact O-N 3.3Å; V403-L405 VanDerWaalsContact C-N 3.33Å; V403-L405 PolarHBondContact O-N 3.43Å; V403-C406 PolarHBondContact O-N 3.09Å; V403-F407 HydrophobicContact CG1-CD2 3.93Å; V403-F407 HydrophobicContact CG1-CE2 3.94Å; V403-F407 WeakPolarHBondContact O-CD2 3.48Å; V403-F407 PolarHBondContact O-N 3.43Å
404V87.7Confident74.5Confident98 Ų9899.4 Ų99.459%0.59457%0.569SS**Hα-helixtrans-61.2-41.2176.5171.90000111.3L400 F407 A408L400-V404 WeakPolarHBondContact O-CG2 3.41Å; L400-V404 PolarHBondContact O-N 3.3Å; V404-F407 PolarHBondContact O-N 2.79Å; V404-A408 WeakPolarHBondContact O-CB 3.41Å; V404-A408 PolarHBondContact O-N 3.49Å
405L83.4Confident75Confident100 Ų100101.6 Ų101.652%0.52456%0.564SS.*Hα-helixtrans-64.1-40.2175.5-178.262.2000112.1M401 V402 V403 A408 L409M401-L405 VanDerWaalsContact O-CB 3.22Å; M401-L405 WeakPolarHBondContact O-CB 3.35Å; M401-L405 PolarHBondContact O-N 3.22Å; V402-L405 PolarHBondContact O-N 3.49Å; V403-L405 VanDerWaalsContact C-N 3.33Å; V403-L405 PolarHBondContact O-N 3.43Å; L405-A408 PolarHBondContact O-N 3.02Å; L405-L409 HydrophobicContact CD1-CD1 4.14Å; L405-L409 HydrophobicContact CD1-CG 4.15Å; L405-L409 HydrophobicContact CG-CD1 4Å; L405-L409 HydrophobicContact CG-CG 4.42Å; L405-L409 WeakPolarHBondContact O-CB 3.46Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.29Å; L405-L409 PolarHBondContact O-N 3.26Å
406C84.6Confident75Confident76 Ų7699 Ų9951%0.51456%0.56SS.*Hα-helixtrans-62.4-43.6174-75.30000112V402 V403 F410V402-C406 WeakPolarHBondContact O-CB 3.42Å; V402-C406 PolarHBondContact O-N 2.97Å; V402-C406 PolarHBondContact O-SG 3Å; V402-C406 VanDerWaalsContact O-SG 3.36Å; V403-C406 PolarHBondContact O-N 3.09Å; C406-F410 VanDerWaalsContact O-CB 3.27Å; C406-F410 WeakPolarHBondContact O-CB 3.46Å; C406-F410 PolarHBondContact O-N 2.89Å
407F84.8Confident75Confident133 Ų13398.9 Ų98.958%0.58356%0.564SS**Hα-helixtrans-64.1-41.7174.3-86.6-77.2000112.4V403 V404 F410 L411V403-F407 HydrophobicContact CG1-CD2 3.93Å; V403-F407 HydrophobicContact CG1-CE2 3.94Å; V403-F407 WeakPolarHBondContact O-CD2 3.48Å; V403-F407 PolarHBondContact O-N 3.43Å; V404-F407 PolarHBondContact O-N 2.79Å; F407-F410 PolarHBondContact O-N 3.4Å; F407-L411 WeakPolarHBondContact O-CB 3.43Å; F407-L411 WeakPolarHBondContact O-CG 3.39Å; F407-L411 PolarHBondContact O-N 2.97Å
408A81.9Confident74.8Confident58 Ų5899 Ų9948%0.47956%0.564SS.*Hα-helixtrans-64.6-43177.600000112.6V404 L405 G412V404-A408 WeakPolarHBondContact O-CB 3.41Å; V404-A408 PolarHBondContact O-N 3.49Å; L405-A408 PolarHBondContact O-N 3.02Å; A408-G412 PolarHBondContact O-N 2.93Å
409L82.3Confident74Confident105 Ų105105.6 Ų105.655%0.5559%0.585SS.*Hα-helixtrans-68.2-36.8175.9-70.9172.8000112.2L405 S413L405-L409 HydrophobicContact CD1-CD1 4.14Å; L405-L409 HydrophobicContact CD1-CG 4.15Å; L405-L409 HydrophobicContact CG-CD1 4Å; L405-L409 HydrophobicContact CG-CG 4.42Å; L405-L409 WeakPolarHBondContact O-CB 3.46Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.29Å; L405-L409 PolarHBondContact O-N 3.26Å; L409-S413 VanDerWaalsContact O-CB 3.26Å; L409-S413 WeakPolarHBondContact O-CB 3.45Å; L409-S413 PolarHBondContact O-N 2.92Å; L409-S413 PolarHBondContact O-OG 2.77Å
410F83.3Confident73Confident122 Ų122108.3 Ų108.354%0.53560%0.6SS.*Hα-helixtrans-64-55.3174.4-171.5-95.7000110.9C406 F407 G412 S413 F414C406-F410 VanDerWaalsContact O-CB 3.27Å; C406-F410 WeakPolarHBondContact O-CB 3.46Å; C406-F410 PolarHBondContact O-N 2.89Å; F407-F410 PolarHBondContact O-N 3.4Å; F410-G412 VanDerWaalsContact C-N 3.35Å; F410-G412 PolarHBondContact O-N 3.25Å; F410-S413 PolarHBondContact O-N 3.32Å; F410-F414 HydrophobicContact CD1-CD2 4.41Å; F410-F414 HydrophobicContact CD1-CE2 4.4Å; F410-F414 AromaticContact CD2-CE2 3.99Å; F410-F414 HydrophobicContact CD2-CE2 3.99Å; F410-F414 HydrophobicContact CE1-CD2 4.29Å; F410-F414 HydrophobicContact CE1-CE2 4Å; F410-F414 HydrophobicContact CE1-CZ 4.27Å; F410-F414 HydrophobicContact CE2-CD2 4.4Å; F410-F414 AromaticContact CE2-CE2 3.54Å; F410-F414 HydrophobicContact CE2-CE2 3.54Å; F410-F414 AromaticContact CE2-CZ 3.98Å; F410-F414 HydrophobicContact CE2-CZ 3.98Å; F410-F414 HydrophobicContact CG-CE2 4.4Å; F410-F414 HydrophobicContact CZ-CD2 4.28Å; F410-F414 HydrophobicContact CZ-CE1 4.47Å; F410-F414 AromaticContact CZ-CE2 3.55Å; F410-F414 HydrophobicContact CZ-CE2 3.55Å; F410-F414 AromaticContact CZ-CZ 3.66Å; F410-F414 HydrophobicContact CZ-CZ 3.66Å; F410-F414 VanDerWaalsContact O-CD2 3.26Å; F410-F414 WeakPolarHBondContact O-CD2 3.43Å; F410-F414 PolarHBondContact O-N 2.88Å
411L77.9Confident71.1Confident103 Ų103110.7 Ų110.754%0.53961%0.612SS.*Hα-helixtrans-61.6-40.9179.4-68.9168000112.2F407 S413 F414 Y415F407-L411 WeakPolarHBondContact O-CB 3.43Å; F407-L411 WeakPolarHBondContact O-CG 3.39Å; F407-L411 PolarHBondContact O-N 2.97Å; L411-S413 PolarHBondContact O-N 3.04Å; L411-F414 PolarHBondContact O-N 3.31Å; L411-Y415 PolarHBondContact O-N 3.2Å
412G70.7Confident69.5Low48 Ų48111.9 Ų111.950%0.49562%0.621SS.*Hα-helixtrans-65.2-35.1176.100000113.8A408 F410 F414A408-G412 PolarHBondContact O-N 2.93Å; F410-G412 VanDerWaalsContact C-N 3.35Å; F410-G412 PolarHBondContact O-N 3.25Å; G412-F414 VanDerWaalsContact C-N 3.32Å
413S65.8Low67.1Low85 Ų85113.7 Ų113.759%0.59464%0.637SS**Hα-helixtrans-75.8-18.8177.6-57.50000113.5L409 F410 L411 P416L409-S413 VanDerWaalsContact O-CB 3.26Å; L409-S413 WeakPolarHBondContact O-CB 3.45Å; L409-S413 PolarHBondContact O-N 2.92Å; L409-S413 PolarHBondContact O-OG 2.77Å; F410-S413 PolarHBondContact O-N 3.32Å; L411-S413 PolarHBondContact O-N 3.04Å; S413-P416 WeakPolarHBondContact O-CD 3.36Å
414F61.4Low64.5Low140 Ų140116.2 Ų116.261%0.61466%0.657SS**Hα-helixtrans-88.5-12.9176.2-86-112.4000113.6F410 L411 G412F410-F414 HydrophobicContact CD1-CD2 4.41Å; F410-F414 HydrophobicContact CD1-CE2 4.4Å; F410-F414 AromaticContact CD2-CE2 3.99Å; F410-F414 HydrophobicContact CD2-CE2 3.99Å; F410-F414 HydrophobicContact CE1-CD2 4.29Å; F410-F414 HydrophobicContact CE1-CE2 4Å; F410-F414 HydrophobicContact CE1-CZ 4.27Å; F410-F414 HydrophobicContact CE2-CD2 4.4Å; F410-F414 AromaticContact CE2-CE2 3.54Å; F410-F414 HydrophobicContact CE2-CE2 3.54Å; F410-F414 AromaticContact CE2-CZ 3.98Å; F410-F414 HydrophobicContact CE2-CZ 3.98Å; F410-F414 HydrophobicContact CG-CE2 4.4Å; F410-F414 HydrophobicContact CZ-CD2 4.28Å; F410-F414 HydrophobicContact CZ-CE1 4.47Å; F410-F414 AromaticContact CZ-CE2 3.55Å; F410-F414 HydrophobicContact CZ-CE2 3.55Å; F410-F414 AromaticContact CZ-CZ 3.66Å; F410-F414 HydrophobicContact CZ-CZ 3.66Å; F410-F414 VanDerWaalsContact O-CD2 3.26Å; F410-F414 WeakPolarHBondContact O-CD2 3.43Å; F410-F414 PolarHBondContact O-N 2.88Å; L411-F414 PolarHBondContact O-N 3.31Å; G412-F414 VanDerWaalsContact C-N 3.32Å
415Y62.9Low62.1Low176 Ų176119 Ų11969%0.6967%0.667SS**  trans-121.350.1174-73.5-85.2000115.1L411 S417L411-Y415 PolarHBondContact O-N 3.2Å; Y415-S417 PolarHBondContact O-N 2.86Å
416P56.4Low59.5Low98 Ų98120.6 Ų120.664%0.63668%0.681SS**THydrogen-bonded Turntrans-80.446.9-176.237.7-38.8000113.1S413S413-P416 WeakPolarHBondContact O-CD 3.36Å
417S55.3Low57Low105 Ų105125.4 Ų125.473%0.73470%0.697SS**THydrogen-bonded Turntrans-150.3-10.3-176-66.80000117Y415Y415-S417 PolarHBondContact O-N 2.86Å
418S57.2Low54.5Low82 Ų82125.5 Ų125.557%0.57371%0.708SS**SBendtrans-99.2-6.7-165.5-56.40000116.9
419F54.2Low52.1Low203 Ų203125.8 Ų125.889%0.8972%0.717SS**SBendtrans-125.812.1-174.5-74.3-70.8000115.8L421F419-L421 VanDerWaalsContact C-N 3.31Å; F419-L421 PolarHBondContact O-N 3.46Å
420T47.2Very low49.8Very low136 Ų136128.2 Ų128.283%0.83474%0.736SS**  trans-94.234.9177.9-32.40000112.9
421L44.7Very low47.4Very low162 Ų162127 Ų12785%0.84875%0.748SS**SBendtrans-134.533.4-179.1-136.8175.8000113.9F419F419-L421 VanDerWaalsContact C-N 3.31Å; F419-L421 PolarHBondContact O-N 3.46Å
422L45.8Very low45.1Very low165 Ų165128.1 Ų128.186%0.86476%0.764SS**SBendtrans-152.574.5158.3-160.267.5000113.7
423S35.2Very low43.2Very low123 Ų123136.8 Ų136.886%0.8678%0.782SS**  trans-157.179.6159.7-81.70000110.4I425S423-I425 PolarHBondContact O-N 2.95Å
424S31.2Very low41.6Very low122 Ų122142.1 Ų142.185%0.85380%0.798SS**  trans-83.587.6173.4-177.70000110.1
425I37.8Very low40Very low156 Ų156143.6 Ų143.680%0.881%0.809SS**  trans-175.5116.1148.3-102.4158.1000109.4S423S423-I425 PolarHBondContact O-N 2.95Å
426T29Very low39.1Very low134 Ų134139.6 Ų139.682%0.82280%0.804SS**  -174.6121.6127.531.50000107.7
427E32.2Very low37.8Very low178 Ų178141.9 Ų141.983%0.83281%0.806SS**  trans-76.5169.5163.3-159.3-174.8135.700109.5
428T33Very low36.8Very low135 Ų135141 Ų14183%0.82880%0.8SS**  trans69.8147-174.578.80000114.7
429G31.4Very low35.6Very low64 Ų64145.7 Ų145.766%0.6681%0.807SS**  cis157.4154-8.400000112.6
430V34Very low34.8Very low156 Ų156142.4 Ų142.495%0.94580%0.803SS**  trans73.5143.2179-170.10000114.8
431A31.3Very low34.1Very low95 Ų95140 Ų14079%0.78580%0.797SS**  trans-132.9168-177.300000110.7
432S30.5Very low33.8Very low127 Ų127138.7 Ų138.789%0.88880%0.796SS**  trans-154.7162.1142.9-160.30000111.9
433R31.7Very low33.1Very low231 Ų231138.1 Ų138.187%0.87280%0.799SS**  trans-94.2153.5-179.3-68.1170.4147.3-149.8-4.7111.4
434Q30.5Very low33.5Very low197 Ų197142 Ų14292%0.92180%0.8SS**  -158.8164.1119.1-109.8161.10.100113.1
435M28.3Very low33.9Very low171 Ų171140.7 Ų140.784%0.84279%0.791SS**  trans-147.9176.8-170.6-93.8-80.8-160.200105.9
436P43.6Very low34.1Very low92 Ų92144 Ų14460%0.59779%0.794SS**  cis-133.7180-2.7215.3000115.3
437E29.2Very low34.3Very low146 Ų146143.7 Ų143.768%0.68280%0.797SS**  trans38.4141.5138.2-60.3161.3129.100121.1Y439E437-Y439 HydrophobicContact CB-CE1 4.43Å
438S35Very low34.5Very low87 Ų87142.1 Ų142.161%0.60879%0.793SS**  -175.7124.891.8-73.10000115.2
439Y32.1Very low34.6Very low180 Ų180142.7 Ų142.771%0.70679%0.79SS**  trans36.5136.3143.6-15.1-59.4000121E437E437-Y439 HydrophobicContact CB-CE1 4.43Å
440T36.8Very low34.6Very low134 Ų134144.6 Ų144.682%0.82279%0.794SS**  -168.2164.353.839.20000113.9
441A33.9Very low34.5Very low85 Ų85142.7 Ų142.770%0.70278%0.783SS**  trans32.8116.3155.500000120.7
442T38.4Very low34.7Very low134 Ų134147.3 Ų147.382%0.82279%0.786SS**  66.893.154.875.80000117.4
443V31Very low34.7Very low153 Ų153150.3 Ų150.393%0.92779%0.786SS**  trans-135.3134.9142.3179.10000108.5
444K43.4Very low34.9Very low204 Ų204146.2 Ų146.289%0.88778%0.781SS**  trans-124.1117-175170.5177.9176.4172.50110.3
445S37.9Very low35.1Very low95 Ų95145 Ų14566%0.66478%0.775SS**  trans-148.589169-168.40000114.8
446R43Very low35.3Very low227 Ų227145.2 Ų145.286%0.85777%0.774SS**  trans5789.9133.7-55.7163.1-169-175.12.1117.6
447S33.4Very low35.3Very low126 Ų126145.2 Ų145.288%0.88177%0.774SS**  trans-104.4154.4132.1-169.50000108.1
448L36.9Very low35.2Very low145 Ų145147.4 Ų147.476%0.75978%0.784SS**  trans-114.1141.9-171-81.6171.5000113
449L34.8Very low35.2Very low147 Ų147151.3 Ų151.377%0.7780%0.797SS**  trans50.187.5148.8-62.6167.5000117
450S31.6Very low35.3Very low105 Ų105151.1 Ų151.173%0.73481%0.807SS**  trans-87.3134.6138.7177.20000108.3
451T31.3Very low35Very low116 Ų116148 Ų14871%0.71280%0.801SS**  trans-133.9123.1166.344.30000109.1
452F36.1Very low35Very low192 Ų192152.6 Ų152.684%0.84281%0.813SS**  trans-79.3143.2168.2-90.8-119.2000109.8
453E30.4Very low34.8Very low190 Ų190150.3 Ų150.389%0.88882%0.816SS**  trans-174.7102.1156.9-102167.1154.500103
454D35.8Very low34.7Very low144 Ų144146.7 Ų146.777%0.7781%0.81SS**  cis85.3134.940.1-152.921.6000113.9
455E34.1Very low34.1Very low173 Ų173146.1 Ų146.181%0.80881%0.81SS**  trans51.9127.8179.1-67.4-90.976.400120.3
456Q33Very low34.1Very low175 Ų175151.7 Ų151.782%0.81882%0.818SS**  trans-80174.1152.9-110.2-16220.600109.6
457P42.7Very low34Very low92 Ų92145.4 Ų145.460%0.59781%0.807SS**  cis-129.1171.3-4.140.2-26.4000113.7
458H27.5Very low34.5Very low191 Ų191148.8 Ų148.888%0.88481%0.809SS**  trans-167.7156.4135.2-93-37.6000112.4
459L34.6Very low34.7Very low170 Ų170149.7 Ų149.789%0.8981%0.809SS**  trans-71.3133.3-179.3-81.1156.7000112.8
460L34.1Very low35.1Very low176 Ų176153.3 Ų153.392%0.92181%0.813SS**  trans-154.2125137.3-105.2175000108.7
461G31.2Very low35.7Very low67 Ų67156.9 Ų156.969%0.69182%0.818SS**  trans-93.9141.6-173.200000113.6
462L34.1Very low36.5Very low183 Ų183156.7 Ų156.796%0.95881%0.812SS**  trans-124.288.2161.1-73.2175.9000108.3
463G33.4Very low37.3Very low85 Ų85150.4 Ų150.488%0.87680%0.795SS**  trans-72.2137.4170.400000110.7
464G28.8Very low38.5Very low77 Ų77144.9 Ų144.979%0.79478%0.776SS**  trans-155.573.1179.100000109.5
465E32.3Very low39.9Very low192 Ų192140.2 Ų140.290%0.89776%0.757SS**  trans-67.9132.4-179.362.1-147127.700111.7
466Y36.2Very low41.6Very low212 Ų212135.8 Ų135.883%0.83174%0.742SS**  trans-102.8121.7-175.8-154.4-89.7000109.5E468Y466-E468 PolarHBondContact O-N 3.44Å
467P41.4Very low43.5Very low95 Ų95132.1 Ų132.162%0.61773%0.731SS**  trans-72.499.6-174.8-21.934.8000114Q469P467-Q469 VanDerWaalsContact C-N 3.26Å; P467-Q469 PolarHBondContact O-N 3.02Å
468E43.7Very low44.8Very low197 Ų197133.3 Ų133.392%0.92173%0.731SS**  trans-68.279.4166.4-70.7-160.7140.400111.3Y466Y466-E468 PolarHBondContact O-N 3.44Å
469Q41.9Very low46.8Very low164 Ų164126.5 Ų126.577%0.76671%0.707SS**  trans-142.16.4176.2-156.4163.952.900114.2P467P467-Q469 VanDerWaalsContact C-N 3.26Å; P467-Q469 PolarHBondContact O-N 3.02Å
470W42.1Very low48.7Very low224 Ų224122.3 Ų122.385%0.84869%0.689SS**SBendtrans-102.3-18.3-175-76.573.1000114.8
471E44.6Very low50.7Low180 Ų180122.2 Ų122.284%0.84168%0.677SS**SBendtrans-81.4-29.3-177.6-55-141.4141.500113.3P474E471-P474 VanDerWaalsContact O-CD 3.28Å; E471-P474 WeakPolarHBondContact O-CD 3.23Å; E471-P474 VanDerWaalsContact O-CG 3.32Å; E471-P474 WeakPolarHBondContact O-CG 3.48Å
472D47.8Very low52.7Low112 Ų112126.2 Ų126.260%0.59967%0.671SS**Hα-helixtrans-76.8-25.9-175.9-127.6-9.1000113.1A475 V476D472-A475 WeakPolarHBondContact O-CB 3.38Å; D472-A475 PolarHBondContact O-N 2.93Å; D472-A475 VanDerWaalsContact O-N 3.14Å; D472-V476 WeakPolarHBondContact O-CG2 3.45Å; D472-V476 PolarHBondContact O-N 3.08Å
473A52.8Low54Low59 Ų59125.9 Ų125.949%0.48866%0.657SS.*Hα-helixtrans-56.2-51.1-178.800000114A475 V477A473-A475 VanDerWaalsContact C-N 3.34Å; A473-V477 WeakPolarHBondContact O-CG2 3.46Å; A473-V477 PolarHBondContact O-N 2.81Å
474P57.3Low55.6Low74 Ų74125 Ų12548%0.48164%0.637SS.*Hα-helixtrans-66.1-33.2173.926.2-35.6000113.2E471 V477 M478E471-P474 VanDerWaalsContact O-CD 3.28Å; E471-P474 WeakPolarHBondContact O-CD 3.23Å; E471-P474 VanDerWaalsContact O-CG 3.32Å; E471-P474 WeakPolarHBondContact O-CG 3.48Å; P474-V477 PolarHBondContact O-N 3.48Å; P474-M478 PolarHBondContact O-N 2.88Å
475A64.3Low57.1Low46 Ų46125 Ų12538%0.3862%0.617SS.*Hα-helixtrans-65.4-46.4178.600000111.6D472 A473 V477 M478 A479D472-A475 WeakPolarHBondContact O-CB 3.38Å; D472-A475 PolarHBondContact O-N 2.93Å; D472-A475 VanDerWaalsContact O-N 3.14Å; A473-A475 VanDerWaalsContact C-N 3.34Å; A475-V477 PolarHBondContact O-N 3Å; A475-M478 PolarHBondContact O-N 3.5Å; A475-A479 WeakPolarHBondContact O-CB 3.42Å; A475-A479 PolarHBondContact O-N 2.95Å
476V70.4Confident58.4Low81 Ų81122.2 Ų122.249%0.49160%0.603SS.*Hα-helixtrans-63.6-38.7176.1172.20000111.8D472 A479 T480D472-V476 WeakPolarHBondContact O-CG2 3.45Å; D472-V476 PolarHBondContact O-N 3.08Å; V476-A479 PolarHBondContact O-N 3.2Å; V476-T480 HydrophobicContact CG1-CG2 4.44Å; V476-T480 WeakPolarHBondContact O-CB 3.46Å; V476-T480 WeakPolarHBondContact O-CG2 3.47Å; V476-T480 PolarHBondContact O-N 3.03Å; V476-T480 PolarHBondContact O-OG1 3.02Å
477V72.8Confident59.2Low97 Ų97118.7 Ų118.759%0.58859%0.594SS**Hα-helixtrans-64.7-43.3175170.90000111.5A473 P474 A475 T480 W481A473-V477 WeakPolarHBondContact O-CG2 3.46Å; A473-V477 PolarHBondContact O-N 2.81Å; P474-V477 PolarHBondContact O-N 3.48Å; A475-V477 PolarHBondContact O-N 3Å; V477-T480 WeakPolarHBondContact CA-OG1 3.38Å; V477-T480 PolarHBondContact O-OG1 3.33Å; V477-W481 WeakPolarHBondContact O-CB 3.34Å; V477-W481 PolarHBondContact O-N 2.83Å
478M69.4Low59.7Low118 Ų118120.7 Ų120.758%0.58159%0.593SS**Hα-helixtrans-68.8-35.5175.4-71.9-165.2-71.500113P474 A475 R482P474-M478 PolarHBondContact O-N 2.88Å; A475-M478 PolarHBondContact O-N 3.5Å; M478-R482 WeakPolarHBondContact O-CB 3.26Å; M478-R482 PolarHBondContact O-N 3.15Å
479A69.8Low59.8Low48 Ų48118.9 Ų118.940%0.39759%0.589SS.*Hα-helixtrans-68-40.8176.900000112.5A475 V476 R482 R483A475-A479 WeakPolarHBondContact O-CB 3.42Å; A475-A479 PolarHBondContact O-N 2.95Å; V476-A479 PolarHBondContact O-N 3.2Å; A479-R482 PolarHBondContact O-N 3.27Å; A479-R483 WeakPolarHBondContact O-CB 3.37Å; A479-R483 PolarHBondContact O-N 3.29Å
480T74.1Confident59.9Low82 Ų82114.3 Ų114.350%0.50359%0.586SS.*Hα-helixtrans-68.9-40.1176.147.60000112V476 V477 R483 S484V476-T480 HydrophobicContact CG1-CG2 4.44Å; V476-T480 WeakPolarHBondContact O-CB 3.46Å; V476-T480 WeakPolarHBondContact O-CG2 3.47Å; V476-T480 PolarHBondContact O-N 3.03Å; V476-T480 PolarHBondContact O-OG1 3.02Å; V477-T480 WeakPolarHBondContact CA-OG1 3.38Å; V477-T480 PolarHBondContact O-OG1 3.33Å; T480-R483 PolarHBondContact O-N 3.21Å; T480-S484 PolarHBondContact O-N 3.44Å
481W76.9Confident59.9Low174 Ų174107.7 Ų107.766%0.65957%0.574SS**Hα-helixtrans-60.3-47.1172.2-175.283.4000112.2V477 R483 S484 E485V477-W481 WeakPolarHBondContact O-CB 3.34Å; V477-W481 PolarHBondContact O-N 2.83Å; W481-R483 VanDerWaalsContact C-N 3.31Å; W481-R483 PolarHBondContact O-N 3.49Å; W481-S484 WeakPolarHBondContact O-CB 3.27Å; W481-S484 PolarHBondContact O-N 3.07Å; W481-S484 VanDerWaalsContact O-N 3.07Å; W481-E485 HydrophobicContact CH2-CG 4.3Å; W481-E485 HydrophobicContact CZ2-CG 4.08Å; W481-E485 PolarHBondContact O-N 2.84Å
482R72.6Confident59.6Low151 Ų151107 Ų10757%0.5757%0.571SS**Hα-helixtrans-59.2-40.1177.1-169.3-174.9-62.1127.8-0.2112.3M478 A479 S484 Q486M478-R482 WeakPolarHBondContact O-CB 3.26Å; M478-R482 PolarHBondContact O-N 3.15Å; A479-R482 PolarHBondContact O-N 3.27Å; R482-S484 VanDerWaalsContact C-N 3.34Å; R482-Q486 WeakPolarHBondContact O-CG 3.49Å; R482-Q486 PolarHBondContact O-N 2.73Å
483R61.1Low59.2Low175 Ų175106.7 Ų106.766%0.6658%0.575SS**Hα-helixtrans-66.1-34.5175.6-174.6174.1-72174.6-1.7112.4A479 T480 W481 Q486 Q487A479-R483 WeakPolarHBondContact O-CB 3.37Å; A479-R483 PolarHBondContact O-N 3.29Å; T480-R483 PolarHBondContact O-N 3.21Å; W481-R483 VanDerWaalsContact C-N 3.31Å; W481-R483 PolarHBondContact O-N 3.49Å; R483-Q486 PolarHBondContact O-N 2.96Å; R483-Q487 PolarHBondContact O-N 3.01Å; R483-Q487 VanDerWaalsContact O-N 3.09Å
484S66.5Low58.3Low66 Ų66111 Ų11146%0.46259%0.59SS.*Hα-helixtrans-66.2-45.8176.8-170.40000112.5T480 W481 R482 Q486 Q487 K488T480-S484 PolarHBondContact O-N 3.44Å; W481-S484 WeakPolarHBondContact O-CB 3.27Å; W481-S484 PolarHBondContact O-N 3.07Å; W481-S484 VanDerWaalsContact O-N 3.07Å; R482-S484 VanDerWaalsContact C-N 3.34Å; S484-Q486 VanDerWaalsContact C-N 3.3Å; S484-Q486 PolarHBondContact O-N 3.31Å; S484-Q487 PolarHBondContact O-N 3.1Å; S484-K488 WeakPolarHBondContact O-CB 3.47Å; S484-K488 PolarHBondContact O-N 3.49Å; S484-K488 VanDerWaalsContact O-N 3.09Å
485E61.5Low57Low79 Ų79118.7 Ų118.737%0.36961%0.609SS.*Hα-helixtrans-66.4-32.4176.9-73.7-64.1115.500111.9W481 K488 L489W481-E485 HydrophobicContact CH2-CG 4.3Å; W481-E485 HydrophobicContact CZ2-CG 4.08Å; W481-E485 PolarHBondContact O-N 2.84Å; E485-K488 PolarHBondContact O-N 2.96Å; E485-K488 WeakPolarHBondContact OE1-CD 3.39Å; E485-K488 IonicContact OE1-NZ 2.71Å; E485-K488 PolarHBondContact OE1-NZ 2.8Å; E485-K488 IonicContact OE2-NZ 2.75Å; E485-K488 PolarHBondContact OE2-NZ 2.96Å; E485-L489 PolarHBondContact O-N 3.38Å; E485-L489 VanDerWaalsContact O-N 3.14Å
486Q59.9Low55.4Low132 Ų132120.3 Ų120.362%0.61762%0.622SS**Hα-helixtrans-65.4-41172.2-74.4179-30.700113R482 R483 S484 K488 L489 G490R482-Q486 WeakPolarHBondContact O-CG 3.49Å; R482-Q486 PolarHBondContact O-N 2.73Å; R483-Q486 PolarHBondContact O-N 2.96Å; S484-Q486 VanDerWaalsContact C-N 3.3Å; S484-Q486 PolarHBondContact O-N 3.31Å; Q486-K488 VanDerWaalsContact C-N 3.34Å; Q486-K488 PolarHBondContact O-N 2.62Å; Q486-L489 PolarHBondContact O-N 3.13Å; Q486-G490 PolarHBondContact O-N 2.94Å; Q486-G490 VanDerWaalsContact O-N 3.1Å
487Q53.1Low53.7Low138 Ų138124.4 Ų124.465%0.64564%0.636SS**Hα-helixtrans-65.9-36.2175.5-75.3-171.6-48.700112.8R483 S484 L489 G490 S491R483-Q487 PolarHBondContact O-N 3.01Å; R483-Q487 VanDerWaalsContact O-N 3.09Å; S484-Q487 PolarHBondContact O-N 3.1Å; Q487-L489 VanDerWaalsContact C-N 3.29Å; Q487-L489 PolarHBondContact O-N 3.21Å; Q487-G490 PolarHBondContact O-N 3.01Å; Q487-S491 PolarHBondContact O-OG 3.49Å
488K51.1Low51.6Low137 Ų137130.6 Ų130.660%0.59665%0.649SS**Hα-helixtrans-67.1-26.1176180-172.8169.5-157.60113.2S484 E485 Q486S484-K488 WeakPolarHBondContact O-CB 3.47Å; S484-K488 PolarHBondContact O-N 3.49Å; S484-K488 VanDerWaalsContact O-N 3.09Å; E485-K488 PolarHBondContact O-N 2.96Å; E485-K488 WeakPolarHBondContact OE1-CD 3.39Å; E485-K488 IonicContact OE1-NZ 2.71Å; E485-K488 PolarHBondContact OE1-NZ 2.8Å; E485-K488 IonicContact OE2-NZ 2.75Å; E485-K488 PolarHBondContact OE2-NZ 2.96Å; Q486-K488 VanDerWaalsContact C-N 3.34Å; Q486-K488 PolarHBondContact O-N 2.62Å
489L46.5Very low49.8Very low160 Ų160132.7 Ų132.784%0.83866%0.657SS**Hα-helixtrans-85.8-22.5172.1-152.974.8000112.9E485 Q486 Q487E485-L489 PolarHBondContact O-N 3.38Å; E485-L489 VanDerWaalsContact O-N 3.14Å; Q486-L489 PolarHBondContact O-N 3.13Å; Q487-L489 VanDerWaalsContact C-N 3.29Å; Q487-L489 PolarHBondContact O-N 3.21Å
490G42.6Very low48.1Very low68 Ų68135.8 Ų135.870%0.70167%0.673SS**SBendtrans-94.816.3-176.100000116.2Q486 Q487Q486-G490 PolarHBondContact O-N 2.94Å; Q486-G490 VanDerWaalsContact O-N 3.1Å; Q487-G490 PolarHBondContact O-N 3.01Å
491S42.4Very low46.6Very low85 Ų85137.9 Ų137.959%0.59469%0.688SS**  trans-126.248.6-171.5400000114.4Q487 P493Q487-S491 PolarHBondContact O-OG 3.49Å; S491-P493 WeakPolarHBondContact O-CD 3.32Å
492E37.7Very low44.4Very low165 Ų165139.6 Ų139.677%0.77170%0.7SS**  trans-87.6112.9168.7-125.7-63.2110.300110.3N494E492-N494 PolarHBondContact O-N 3.13Å; E492-N494 VanDerWaalsContact O-N 3.15Å
493P39.6Very low42.3Very low105 Ų105144.1 Ų144.168%0.68272%0.717SS**  trans-87.285.7-174.134.2-33.9000111.9S491 R495S491-P493 WeakPolarHBondContact O-CD 3.32Å; P493-R495 PolarHBondContact O-N 3.19Å
494N34.1Very low40.7Very low149 Ų149142.6 Ų142.680%0.79772%0.722SS**  trans-54.497.9173.4-177.1-19.4000111.6E492 A496E492-N494 PolarHBondContact O-N 3.13Å; E492-N494 VanDerWaalsContact O-N 3.15Å; N494-A496 PolarHBondContact O-N 3.1Å
495R30.7Very low38.9Very low237 Ų237149 Ų14989%0.89474%0.742SS**  trans-90.888.8-177.5-173176.4-179.7163.60.9110.5P493 E497P493-R495 PolarHBondContact O-N 3.19Å; R495-E497 PolarHBondContact O-N 3.13Å
496A30.8Very low37.4Very low79 Ų79149.6 Ų149.665%0.65376%0.755SS**  trans-49.3129176.900000113.3N494N494-A496 PolarHBondContact O-N 3.1Å
497E33.8Very low36.2Very low167 Ų167150 Ų15078%0.7876%0.761SS**  trans-62.5138.5175.1-175.9177.9-142.500111.6R495 H499R495-E497 PolarHBondContact O-N 3.13Å; E497-H499 IonicContact OE1-NE2 3.95Å
498R28.9Very low35.3Very low228 Ų228149.6 Ų149.686%0.8676%0.764SS**  trans-155.689.6173.8-163.8-179.2-64.1176.80.8113.1
499H32.1Very low34.4Very low161 Ų161148.3 Ų148.375%0.74577%0.767SS**  trans-69.4142.8168.3-78.2-79.9000112.9E497E497-H499 IonicContact OE1-NE2 3.95Å
500P34Very low33.7Very low114 Ų114147.8 Ų147.874%0.7476%0.76SS**  trans-117.4166.514319.9-0.5000111.4
501P41.8Very low33.2Very low125 Ų125151.9 Ų151.981%0.81276%0.759SS**  trans-109.3165.6-138.338.9-36.2000117.3
502F31.2Very low32.8Very low210 Ų210154.3 Ų154.392%0.92177%0.765SS**  trans-55.7142.8169.5-80.5-96.4000113.7
503R28.6Very low32.7Very low246 Ų246153.3 Ų153.393%0.92877%0.765SS**  trans-145.5125.5146.9-161.3174.4-171.7-176.44111.5
504N28.5Very low32.4Very low143 Ų143155.8 Ų155.877%0.76577%0.771SS**  trans-91.8147.6-172.8-171.16.7000112.6
505K29.3Very low32.6Very low202 Ų202155.1 Ų155.188%0.87877%0.767SS**  trans-163.6156.6157.8-113.1178.6-178.8-169.90111.1
506S29.1Very low32.6Very low90 Ų90150.2 Ų150.263%0.62976%0.759SS**  trans-141.9149.5-150.456.10000115.3
507N35.1Very low32.7Very low140 Ų140153 Ų15375%0.74976%0.761SS**  trans64.1171.6166-41.4-6.4000115.7
508D32.8Very low32.7Very low131 Ų131153 Ų15370%0.70176%0.761SS**  cis-157.1131.912.5-118-50.2000107.6
509T33.3Very low32.6Very low110 Ų110154.1 Ų154.168%0.67577%0.765SS**  158.9144.394.327.70000106.9
510Q31Very low32.7Very low148 Ų148150.3 Ų150.369%0.69276%0.757SS**  cis97.4128.341.8-162.9-15226.900113.6
511K32.8Very low32.5Very low154 Ų154153 Ų15367%0.6776%0.76SS**  trans115.7114.2167.4-65.5148.1-160.5160.80112.9
512N34.7Very low32Very low137 Ų137153.2 Ų153.273%0.73376%0.759SS**  83.7144.273.4-70.1-16000112.5
513L34.5Very low32.1Very low144 Ų144147.8 Ų147.875%0.75475%0.753SS**  cis-174.5172.4-8.4-111.5170.1000108.2
514L33.1Very low32.2Very low156 Ų156143.1 Ų143.182%0.81775%0.746SS**  trans73.8148.2151.7-145.1153.6000116.6
515L38.3Very low32.5Very low136 Ų136146.9 Ų146.971%0.71275%0.75SS**  cis-178.4168-39.1-120.6165.1000107.5
516D31.8Very low32.7Very low134 Ų134142.5 Ų142.572%0.71774%0.744SS**  trans64.6159.8162.2-77.6-3.9000120.7
517L32.3Very low32.9Very low136 Ų136143.8 Ų143.871%0.71275%0.753SS**  cis-168.4143.8-33.9-169.462.8000111.1
518H33.8Very low32.8Very low168 Ų168142.2 Ų142.278%0.77875%0.753SS**  trans19.7132161.5-79.3-142.3000122.5
519R28Very low33.2Very low251 Ų251145.5 Ų145.595%0.94776%0.762SS**  -144.1160.9119.9-169.6151.1-86.2-123.3-1.8111.2
520S32.3Very low33.3Very low82 Ų82146 Ų14657%0.57376%0.764SS**  trans-133.8168.8-158.3-171.80000113.3
521Q30.3Very low33.6Very low171 Ų171145.8 Ų145.880%0.79977%0.767SS**  trans71.1136.4165.5-69.4154.66200116.6
522T31.1Very low33.8Very low129 Ų129146.7 Ų146.779%0.79177%0.773SS**  -158.2154.251.542.40000115.8
523A33.1Very low34.2Very low96 Ų96148.6 Ų148.679%0.79378%0.783SS**  trans11.1158.9138.200000123.1
524N32.1Very low34.2Very low147 Ų147148 Ų14879%0.78678%0.781SS**  cis178.6169-15.4-175.87.3000109
525R33.5Very low34.5Very low223 Ų223150.3 Ų150.384%0.84278%0.778SS**  trans72.5154.4167.9-73.8-175.9170.7-166.4-3.4117.3
526S33.7Very low34.6Very low109 Ų109148.5 Ų148.576%0.76278%0.777SS**  cis-178.5161.2-10.451.70000108.8
527S32.5Very low35.1Very low117 Ų117148.1 Ų148.182%0.81878%0.779SS**  cis-159.9171.10.5176.50000109.6
528S34.9Very low35.7Very low107 Ų107148.9 Ų148.975%0.74878%0.784SS**  trans-99.8-179.3176.6-35.20000114.6
529K40.8Very low36.4Very low201 Ų201150 Ų15087%0.87479%0.79SS**  trans115149.1158.9-68.9-173.1-179.7-173.90116.3
530V35.5Very low37.3Very low120 Ų120144.6 Ų144.673%0.72779%0.785SS**  cis-170.1175.9-12.8122.20000110.7
531L37.1Very low38.1Very low144 Ų144150.2 Ų150.275%0.75482%0.824SS**  trans82.9133.7175.4-67.3139.5000116.3
532E36.9Very low38.5Very low172 Ų172149.2 Ų149.280%0.80483%0.825SS**  cis88.611912.7-162178.7-161.700117.8
533L42.5Very low38.8Very low178 Ų178150.3 Ų150.393%0.93283%0.827SS**  trans-162170.5155.2-13678.2000111.3
534D35.3Very low39.2Very low132 Ų132153.3 Ų153.371%0.70683%0.829SS**  trans-121.8-177.3-147-165.322.6000117.5
535R39.7Very low39.6Very low203 Ų203153.6 Ų153.677%0.76683%0.832SS**  trans-53.9150.4-173.3-70.3159.2159.190.7-4.7120.5
536S39.6Very low40Very low98 Ų98149.3 Ų149.369%0.68583%0.831SS**  177.7133.4122.650.80000107.7
537V41.8Very low40.4Very low127 Ų127152 Ų15277%0.7784%0.836SS**  cis71.5103.431.9-166.90000113.5
538N44.4Very low40.9Very low151 Ų151154.5 Ų154.581%0.80784%0.837SS**  trans-133.6125.6178.5-60.954.2000108.8
539E49.2Very low41.4Very low192 Ų192158.2 Ų158.290%0.89784%0.844SS**  trans-98.8164.2175-67.3-171.6127.400112.5
540T47.4Very low41.4Very low138 Ų138154.6 Ų154.685%0.84784%0.841SS**  trans-98.615617648.90000112.4
541S48Very low42Very low200 Ų200157.7 Ų157.7100%1.39985%0.851SS**  trans-1390158.9-63.70000109.4

Retrieved 541 of 541 residues in 315.3 ms (Link to these results)