A0A3Q0KP31_SCHMA Loading...

Putative progesterone-induced-blocking factor

AlphaFold DB , UniProt , Accession A0A3Q0KP31, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,130 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
1M29.6Very low33.2Very low237 Ų237178.1 Ų178.1100%1.16786%0.856SS**  088.20-82.5177.9177.600108.9
2F30.6Very low33Very low205 Ų205182.2 Ų182.290%0.89986%0.856SS**  trans175.299.5163.7-95.4-66.9000105.8
3M33.1Very low32.9Very low179 Ų179183.8 Ų183.888%0.88286%0.858SS**  trans-152.377.1167.6-77.1-66.5-100.900108.2
4K35.1Very low32.7Very low218 Ų218183.9 Ų183.995%0.94886%0.858SS**  trans-85.4103.9159.8-81.1-176.2175.61800106.6
5S36.4Very low32.7Very low84 Ų84184.5 Ų184.559%0.58786%0.861SS**  trans-120.6109.9168520000108.8F7S5-F7 PolarHBondContact O-N 3.33Å
6S34.9Very low32.6Very low118 Ų118181.6 Ų181.683%0.82586%0.86SS**  trans-75.2106.3174.831.10000109.6L8S6-L8 PolarHBondContact O-N 2.9Å; S6-L8 VanDerWaalsContact O-N 3.15Å
7F34.9Very low32.4Very low183 Ų183176 Ų17680%0.80385%0.852SS**  trans-71.294168.6-94.1-98.9000110.2S5S5-F7 PolarHBondContact O-N 3.33Å
8L30.3Very low32.3Very low172 Ų172176 Ų17690%0.90186%0.856SS**  trans-93.495156.6-90.6162.8000107.7S6S6-L8 PolarHBondContact O-N 2.9Å; S6-L8 VanDerWaalsContact O-N 3.15Å
9R34Very low32.2Very low198 Ų198175.8 Ų175.875%0.74785%0.853SS**  trans-99.1105.2170.4-133.5-179.1-161.6-162.44.1108.4F11R9-F11 PolarHBondContact O-N 3.18Å
10Q32.7Very low32.3Very low180 Ų180172.8 Ų172.884%0.84185%0.847SS**  trans-51.1126.2163.9-81.8169.3-33.100110.4
11F33.6Very low32.2Very low185 Ų185170.2 Ų170.281%0.81184%0.842SS**  trans-106104154-82.2-81.5000107.8R9R9-F11 PolarHBondContact O-N 3.18Å
12R30.3Very low32.2Very low227 Ų227162.2 Ų162.286%0.85782%0.819SS**  trans-54.5129.8165.2-77.4-179.2-179.8-176.5-1.4108.8
13K32.3Very low32.2Very low204 Ų204161.8 Ų161.889%0.88782%0.818SS**  trans-91.7118.1154.7-87.1-177.5174.3-1790107.1E15K13-E15 PolarHBondContact O-N 3.19Å
14E29.7Very low32Very low184 Ų184158.8 Ų158.886%0.8681%0.814SS**  trans-69.6108175.3-69.7169.4156.500109T16E14-T16 PolarHBondContact O-N 3.23Å
15E33.4Very low31.5Very low193 Ų193157.1 Ų157.190%0.90281%0.81SS**  trans-76.9111.1163.8-78.1176.7162.800107.9K13 A17K13-E15 PolarHBondContact O-N 3.19Å; E15-A17 PolarHBondContact O-N 2.89Å
16T30.7Very low31.2Very low138 Ų138159.1 Ų159.185%0.84782%0.821SS**PPolyproline II helixtrans-73.5120.7177.62.80000108.9E14 L18E14-T16 PolarHBondContact O-N 3.23Å; T16-L18 PolarHBondContact O-N 3.46Å
17A29.2Very low31Very low87 Ų87158.3 Ų158.372%0.71982%0.815SS**PPolyproline II helixtrans-57.6120.7177.500000112.2E15E15-A17 PolarHBondContact O-N 2.89Å
18L30.6Very low30.7Very low176 Ų176158.8 Ų158.892%0.92182%0.82SS**PPolyproline II helixtrans-94.5118.6151.2-84.1162.1000107.3T16T16-L18 PolarHBondContact O-N 3.46Å
19H30Very low30.7Very low172 Ų172158.7 Ų158.780%0.79682%0.819SS**PPolyproline II helixtrans-58.4148.4-171.4-95.1-77.1000114
20P34.5Very low30.6Very low115 Ų115156 Ų15675%0.74782%0.819SS**PPolyproline II helixtrans-78124-174.431.6-31.4000111.2G22P20-G22 PolarHBondContact O-N 3.21Å
21V30.9Very low30.4Very low120 Ų120152.9 Ų152.973%0.72782%0.817SS**  trans-77.9110.9163176.10000107F23V21-F23 PolarHBondContact O-N 3.49Å
22G28.9Very low30.3Very low68 Ų68153.6 Ų153.670%0.70182%0.82SS**  trans-61112.9-179.500000111.6P20P20-G22 PolarHBondContact O-N 3.21Å
23F30.5Very low30.3Very low197 Ų197151.5 Ų151.586%0.86482%0.817SS**  trans-89.6105.3162-80.3-84.1000108.2V21V21-F23 PolarHBondContact O-N 3.49Å
24S29.4Very low30.1Very low115 Ų115147.9 Ų147.980%0.80481%0.814SS**  trans-59.8131169.9-46.90000110.3
25E25.1Very low30.2Very low184 Ų184144.1 Ų144.186%0.8681%0.808SS**  trans-39.3116.9175.3-147.2168.7-162.300113.7S27E25-S27 PolarHBondContact O-N 3.34Å
26P29.1Very low30Very low126 Ų126139.3 Ų139.382%0.81880%0.796SS**  trans-75.6105.3164.2-5.923000108.1Q28P26-Q28 PolarHBondContact O-N 2.91Å
27S30Very low30.1Very low101 Ų101140.7 Ų140.771%0.70680%0.797SS**  trans-37.9121.516649.20000113E25 I29E25-S27 PolarHBondContact O-N 3.34Å; S27-I29 PolarHBondContact O-N 3.29Å
28Q29.8Very low30.3Very low192 Ų192142.8 Ų142.890%0.89780%0.795SS**  trans1493.9149.4-71.1178.3-17.900115.7P26P26-Q28 PolarHBondContact O-N 2.91Å
29I31.1Very low30.4Very low171 Ų171145.6 Ų145.688%0.87779%0.794SS**  trans-95.1107.7152.9-63.7177.3000106.2S27 S31S27-I29 PolarHBondContact O-N 3.29Å; I29-S31 PolarHBondContact O-N 3.25Å
30D30.9Very low30.5Very low140 Ų140146.9 Ų146.975%0.74980%0.797SS**  trans-34.5121.7173.1-97.7-39.1000112.2K32D30-K32 PolarHBondContact O-N 2.81Å
31S28.3Very low30.2Very low116 Ų116144.1 Ų144.181%0.81179%0.789SS**  trans-60.580.3166.443.50000110I29 K33I29-S31 PolarHBondContact O-N 3.25Å; S31-K33 VanDerWaalsContact C-N 3.29Å; S31-K33 PolarHBondContact O-N 3.01Å
32K32.1Very low30.2Very low199 Ų199146.1 Ų146.187%0.86580%0.795SS**  trans-66.896.3163.3-82.2-173.5179177.40108.5D30D30-K32 PolarHBondContact O-N 2.81Å
33K30.6Very low30.4Very low184 Ų184151.5 Ų151.580%0.880%0.802SS**  trans-1.7129.1163.6-80.3175.2172.6175.70116.1S31 S35S31-K33 VanDerWaalsContact C-N 3.29Å; S31-K33 PolarHBondContact O-N 3.01Å; K33-S35 PolarHBondContact O-N 3.45Å; K33-S35 VanDerWaalsContact O-N 3.11Å
34P27.8Very low30.7Very low128 Ų128148.8 Ų148.883%0.83180%0.796SS**  trans-65.1114.4170.729.7-31.2000108.1S36P34-S36 VanDerWaalsContact C-N 3.28Å; P34-S36 PolarHBondContact O-N 3.24Å
35S30.4Very low30.8Very low104 Ų104147 Ų14773%0.72780%0.796SS**  trans-68.893168.453.80000107.6K33 L37K33-S35 PolarHBondContact O-N 3.45Å; K33-S35 VanDerWaalsContact O-N 3.11Å; S35-L37 PolarHBondContact O-N 2.66Å
36S30.6Very low31.1Very low93 Ų93144.9 Ų144.965%0.6579%0.791SS**  trans-53.7109.9162.958.60000107.8P34 I38P34-S36 VanDerWaalsContact C-N 3.28Å; P34-S36 PolarHBondContact O-N 3.24Å; S36-I38 PolarHBondContact O-N 3.16Å
37L32.5Very low31.3Very low167 Ų167143.4 Ų143.487%0.87479%0.789SS**  trans-73.561.9172-135.799.4000108.4S35S35-L37 PolarHBondContact O-N 2.66Å
38I33.4Very low31.3Very low130 Ų130143.8 Ų143.867%0.66779%0.792SS**  trans-98.2109.8166.9-65.4176.7000105.1S36 K40S36-I38 PolarHBondContact O-N 3.16Å; I38-K40 VanDerWaalsContact C-N 3.26Å; I38-K40 PolarHBondContact O-N 3.46Å
39W32.9Very low31.6Very low236 Ų236139.8 Ų139.889%0.89479%0.785SS**  trans7.775.6143.4-64.591.7000113.2G41W39-G41 PolarHBondContact O-N 3.48Å; W39-G41 VanDerWaalsContact O-N 3.12Å
40K31.7Very low31.7Very low198 Ų198135.9 Ų135.986%0.86177%0.769SS**  trans-69.6110.8165.6-162.5176.3-177.3-174.30103.5I38 L42I38-K40 VanDerWaalsContact C-N 3.26Å; I38-K40 PolarHBondContact O-N 3.46Å; K40-L42 PolarHBondContact O-N 3.46Å
41G28.1Very low31.8Very low57 Ų57135 Ų13559%0.58877%0.773SS**  trans-42.2135.6-169.600000111.4W39 E43W39-G41 PolarHBondContact O-N 3.48Å; W39-G41 VanDerWaalsContact O-N 3.12Å; G41-E43 PolarHBondContact O-N 2.6Å
42L30.2Very low32.1Very low162 Ų162135.4 Ų135.485%0.84877%0.766SS**  trans-51.392.2144.6-79.2147.9000105.1K40 D44K40-L42 PolarHBondContact O-N 3.46Å; L42-D44 PolarHBondContact O-N 3.39Å
43E34.9Very low32.2Very low182 Ų182133.2 Ų133.285%0.8576%0.763SS**  trans-55.6112164.3-80.5176.9170.100104.5G41 G45G41-E43 PolarHBondContact O-N 2.6Å; E43-G45 PolarHBondContact O-N 2.65Å
44D36.5Very low32.5Very low139 Ų139131.2 Ų131.274%0.74376%0.761SS**  trans-51.188161.1-70.2-47.1000106.9L42 N46L42-D44 PolarHBondContact O-N 3.39Å; D44-N46 PolarHBondContact O-N 2.83Å
45G31.6Very low32.9Very low78 Ų78131.2 Ų131.280%0.80475%0.754SS**  trans-66.579.3165.800000106.7E43 A47E43-G45 PolarHBondContact O-N 2.65Å; G45-A47 PolarHBondContact O-N 2.73Å
46N31.3Very low33.5Very low140 Ų140133 Ų13375%0.74976%0.755SS**  trans-40.7136.8175-75.2-42.9000110.4D44 S48D44-N46 PolarHBondContact O-N 2.83Å; N46-S48 PolarHBondContact O-N 3.46Å
47A32Very low33.9Very low94 Ų94136.8 Ų136.878%0.77777%0.768SS**  trans-34.5105.4167.400000111.3G45 S49G45-A47 PolarHBondContact O-N 2.73Å; A47-S49 PolarHBondContact O-N 2.87Å
48S29.9Very low34.6Very low110 Ų110139 Ų13977%0.76977%0.766SS**  trans-75.665.8160.6-176.50000107.9N46 T50N46-S48 PolarHBondContact O-N 3.46Å; S48-T50 PolarHBondContact O-N 3.34Å
49S36.1Very low34.6Very low108 Ų108142.3 Ų142.376%0.75578%0.776SS**  trans-71.188.6153.6163.20000106.2A47A47-S49 PolarHBondContact O-N 2.87Å
50T33.1Very low34.8Very low89 Ų89140.5 Ų140.555%0.54678%0.778SS.*  trans-154.264.8166.8-18.30000107.7S48 D52S48-T50 PolarHBondContact O-N 3.34Å; T50-D52 HydrophobicContact CG2-CB 4.19Å; T50-D52 VanDerWaalsContact CG2-OD2 3.26Å; T50-D52 WeakPolarHBondContact CG2-OD2 3.19Å; T50-D52 PolarHBondContact O-N 3.18Å
51C33.2Very low34.8Very low121 Ų121134.2 Ų134.282%0.81877%0.769SS**  trans-85.864.1148.2-69.10000106.4L53C51-L53 PolarHBondContact O-N 3.45Å; C51-L53 VanDerWaalsContact O-N 3.1Å
52D35.7Very low35.2Very low124 Ų124138.7 Ų138.766%0.66378%0.78SS**  trans-78.788.5162.1-73.5-19.9000105.2T50 D54T50-D52 HydrophobicContact CG2-CB 4.19Å; T50-D52 VanDerWaalsContact CG2-OD2 3.26Å; T50-D52 WeakPolarHBondContact CG2-OD2 3.19Å; T50-D52 PolarHBondContact O-N 3.18Å; D52-D54 PolarHBondContact O-N 2.99Å; D52-D54 VanDerWaalsContact O-N 3.16Å
53L34.7Very low35.2Very low154 Ų154140 Ų14081%0.80678%0.781SS**  trans-7578.1163.1-70.5166.6000106.3C51 D55C51-L53 PolarHBondContact O-N 3.45Å; C51-L53 VanDerWaalsContact O-N 3.1Å; L53-D55 PolarHBondContact O-N 3.47Å
54D36.5Very low35Very low141 Ų141139.3 Ų139.375%0.75478%0.776SS**  trans-85.292.4166.1-78.6-17.2000107.9D52D52-D54 PolarHBondContact O-N 2.99Å; D52-D54 VanDerWaalsContact O-N 3.16Å
55D36.4Very low34.7Very low129 Ų129139.6 Ų139.669%0.6977%0.774SS**  43122.6126.3-63.7-21.3000120.6L53L53-D55 PolarHBondContact O-N 3.47Å
56D42.2Very low34.6Very low141 Ų141142.1 Ų142.175%0.75478%0.779SS**  78.746.8129.5-61.5-18.3000122.2
57D39.8Very low34.8Very low172 Ų172140.2 Ų140.292%0.9278%0.775SS**  trans-106.933.9160.3-80.7-24.2000113.4
58Y45.6Very low34.6Very low213 Ų213142.6 Ų142.684%0.83577%0.774SS**  trans-100.40.6177.8-154.8-99.7000115
59F34.3Very low34.6Very low201 Ų201146.8 Ų146.888%0.88278%0.782SS**  trans-117.566.2175.6-70.5-74.6000112.1G61F59-G61 PolarHBondContact O-N 3.31Å
60E36.4Very low34.1Very low197 Ų197147.1 Ų147.192%0.92178%0.779SS**  trans-82.199.5161.2-119.7-178.2179.900109.8
61G32.8Very low33.9Very low66 Ų66149.4 Ų149.468%0.6879%0.788SS**  trans86.297.7140.100000118.1F59 H63F59-G61 PolarHBondContact O-N 3.31Å; G61-H63 PolarHBondContact O-N 3.45Å
62D35.2Very low33.6Very low151 Ų151151.4 Ų151.481%0.80779%0.79SS**  trans-50.798.7154.8-79.5-42.6000111.8
63H31.9Very low33.2Very low191 Ų191150.1 Ų150.188%0.88479%0.791SS**  trans-116.263.7158.1-82.8-9.8000110G61 M65G61-H63 PolarHBondContact O-N 3.45Å; H63-M65 PolarHBondContact O-N 3.34Å
64F30.3Very low32.8Very low167 Ų167150.6 Ų150.673%0.73279%0.793SS**  trans-71.8118.3157.1-107.8-100.1000109.5
65M29.3Very low32.5Very low145 Ų145149.7 Ų149.771%0.71479%0.794SS**  trans73.398.7155.1-52.2-64.7148.500117.2H63 P67H63-M65 PolarHBondContact O-N 3.34Å; M65-P67 VanDerWaalsContact O-CD 3.3Å; M65-P67 WeakPolarHBondContact O-CD 3.22Å
66S29.4Very low32.3Very low130 Ų130148.6 Ų148.691%0.90980%0.797SS**  trans-86.4108.4141.7-93.40000108.5
67P36Very low31.7Very low101 Ų101151.8 Ų151.866%0.65680%0.804SS**  trans-82.1154.5171.634.4-31.8000110.2M65M65-P67 VanDerWaalsContact O-CD 3.3Å; M65-P67 WeakPolarHBondContact O-CD 3.22Å
68N27.3Very low31.2Very low143 Ų143149.4 Ų149.477%0.76580%0.796SS**  trans89.992.4174.5-54-23000115.1
69E29.7Very low30.5Very low199 Ų199145.6 Ų145.693%0.9379%0.79SS**  -154.885.8119.1-106.3172.5-159.300108.7
70T27.4Very low30.3Very low114 Ų114146.3 Ų146.370%0.69979%0.787SS**  trans-75133.4161.7-260000107.5
71N27.6Very low30.3Very low138 Ų138143.3 Ų143.374%0.73878%0.777SS**  trans81.6104.7174.5-45.8-52.8000114.9
72L26.9Very low30.6Very low162 Ų162148.1 Ų148.185%0.84879%0.787SS**  -175.8117.4109.8-94.2158.6000111.4
73S27.1Very low30.8Very low97 Ų97145.4 Ų145.468%0.67877%0.773SS**  trans60.5104.4143.735.70000120.7
74I27.3Very low31.2Very low165 Ų165145.4 Ų145.485%0.84677%0.77SS**  trans-1.8103.8142.7-53.5170.3000113.7S76I74-S76 PolarHBondContact O-N 3.34Å
75P29.1Very low31.6Very low121 Ų121146.4 Ų146.479%0.78677%0.769SS**  trans-72123.3175.53.19.3000110K77P75-K77 PolarHBondContact O-N 2.56Å
76S32Very low32.2Very low107 Ų107144.2 Ų144.275%0.74877%0.768SS**  trans-47.4128.4169.946.30000112.7I74 T78I74-S76 PolarHBondContact O-N 3.34Å; S76-T78 PolarHBondContact O-N 3.35Å
77K29.7Very low32.9Very low208 Ų208147.5 Ų147.590%0.90477%0.766SS**  trans-20.398.8162.4-74.2174.2173.3175.90113.4P75 N79P75-K77 PolarHBondContact O-N 2.56Å; K77-N79 PolarHBondContact O-N 3.34Å
78T29.7Very low33.1Very low122 Ų122150.1 Ų150.175%0.74877%0.771SS**  trans-65.3117.5161.9-4.40000107.5S76 W80S76-T78 PolarHBondContact O-N 3.35Å; T78-W80 PolarHBondContact O-N 3.33Å
79N31.8Very low33.5Very low133 Ų133149.6 Ų149.671%0.71177%0.768SS**  trans-68.8103.2178.2-172.91.2000108.7K77 N81K77-N79 PolarHBondContact O-N 3.34Å; N79-N81 PolarHBondContact O-N 2.91Å
80W28.8Very low33.9Very low216 Ų216149.6 Ų149.682%0.81877%0.765SS**  trans-71.947.5179.9-89.865.5000113.2T78T78-W80 PolarHBondContact O-N 3.33Å
81N37.9Very low34.3Very low134 Ų134152.5 Ų152.572%0.71777%0.768SS**  trans-106.25.8-175-109.511.7000116.6N79N79-N81 PolarHBondContact O-N 2.91Å
82D37.2Very low34.6Very low167 Ų167149.5 Ų149.589%0.89377%0.77SS**  trans-106.434.5173.6-79.1-26.3000113.1K84D82-K84 PolarHBondContact O-N 3.5Å
83N39.8Very low34.8Very low94 Ų94149.6 Ų149.650%0.50377%0.771SS.*  trans-81.5104.5172.6-139.7-3.2000109.8W85 S86N83-W85 PolarHBondContact O-N 2.85Å; N83-S86 PolarHBondContact O-N 2.6Å
84K41.1Very low34.9Very low191 Ų191154.1 Ų154.183%0.8378%0.782SS**G310 helixtrans-54.6-4.2-175.9-140.4173.2-177179.80115.1D82D82-K84 PolarHBondContact O-N 3.5Å
85W38.5Very low35.2Very low188 Ų188151.4 Ų151.471%0.71278%0.775SS**G310 helixtrans-77.1-26.6178.5-69.981.6000113.9N83 K87 M88N83-W85 PolarHBondContact O-N 2.85Å; W85-K87 VanDerWaalsContact C-N 3.25Å; W85-K87 PolarHBondContact O-N 3.43Å; W85-M88 PolarHBondContact O-N 3.08Å
86S41.7Very low35.2Very low98 Ų98155.1 Ų155.169%0.68578%0.779SS**G310 helixtrans-73.5-10.6-178.1-58.60000114.6N83N83-S86 PolarHBondContact O-N 2.6Å
87K44Very low35.1Very low200 Ų200159.7 Ų159.787%0.8779%0.785SS**G310 helixtrans-87.2-12174.2-76.5-175.4179.6176.10114.1W85W85-K87 VanDerWaalsContact C-N 3.25Å; W85-K87 PolarHBondContact O-N 3.43Å
88M40.3Very low34.9Very low156 Ų156160.8 Ų160.877%0.76878%0.783SS**SBendtrans-93.8-2.9177-94.5172.166.100114.5W85W85-M88 PolarHBondContact O-N 3.08Å
89L36.5Very low34.9Very low132 Ų132162.2 Ų162.269%0.69179%0.787SS**  trans-118.943.2-176.1-96.3130.1000113.6
90K36.6Very low34.7Very low198 Ų198164 Ų16486%0.86180%0.795SS**  trans-104.276.3156.1-73.2-162.7177.2-170.80109.1G92K90-G92 PolarHBondContact O-N 2.91Å
91F37.1Very low34.8Very low175 Ų175159.2 Ų159.277%0.76879%0.79SS**  trans-74.7110.9160.7-80.4-86.6000107.2D93F91-D93 PolarHBondContact O-N 3.36Å
92G33.6Very low34.4Very low76 Ų76158.4 Ų158.478%0.78479%0.792SS**  trans-67.9116.7169.400000108.9K90 E94K90-G92 PolarHBondContact O-N 2.91Å; G92-E94 PolarHBondContact O-N 3.01Å; G92-E94 VanDerWaalsContact O-N 3.12Å
93D30.6Very low34Very low164 Ų164160.3 Ų160.388%0.87779%0.793SS**  trans-64.899.5163.7-75-42.5000108.8F91F91-D93 PolarHBondContact O-N 3.36Å
94E30.3Very low33.5Very low191 Ų191161.8 Ų161.889%0.89381%0.805SS**  trans-118.8118.5158.5-112.3-162.4171.900110.3G92G92-E94 PolarHBondContact O-N 3.01Å; G92-E94 VanDerWaalsContact O-N 3.12Å
95P33.6Very low32.9Very low109 Ų109158.6 Ų158.671%0.70880%0.804SS**  trans-92.2143.8-173.834.9-32000112.6
96K28.6Very low32.4Very low198 Ų198158.9 Ų158.986%0.86181%0.813SS**  trans67.1115.4154.2-63.3173.2-179.8175.50117.3
97K30.7Very low31.7Very low204 Ų204159.1 Ų159.189%0.88782%0.815SS**  -165.9133104.5-99.7166.6-173.8-177.40110.8
98R25.3Very low31.2Very low230 Ų230155.6 Ų155.687%0.86881%0.812SS**  trans-66.9131.7167.1-66174.4-174.4161.90.2107.6
99D29.3Very low30.7Very low153 Ų153157.9 Ų157.982%0.81882%0.818SS**  trans-139.6109146.2-84.3-39.6000107.3V101D99-V101 PolarHBondContact O-N 3.08Å
100L27Very low30.2Very low169 Ų169159 Ų15989%0.88582%0.823SS**  trans-71114.9163.8-9394.4000107.1
101V30.6Very low30Very low117 Ų117154.7 Ų154.771%0.70982%0.818SS**  trans-124122.2160.1-1790000107.4D99 F103D99-V101 PolarHBondContact O-N 3.08Å; V101-F103 PolarHBondContact O-N 3.5Å
102P29.7Very low29.5Very low117 Ų117153.3 Ų153.376%0.7682%0.818SS**  trans-76.3125.6-171.530.7-33.6000110.7T104P102-T104 PolarHBondContact O-N 3.05Å
103F30.1Very low29.5Very low207 Ų207158 Ų15891%0.90882%0.824SS**  trans-76.3108.3172.6-91.8-94.4000110.4V101V101-F103 PolarHBondContact O-N 3.5Å
104T28.9Very low29.3Very low125 Ų125160.7 Ų160.777%0.76782%0.822SS**  trans-78.3131.7158.828.40000109.7P102 E106P102-T104 PolarHBondContact O-N 3.05Å; T104-E106 PolarHBondContact O-N 3.45Å
105P27.8Very low29.1Very low123 Ų123158.3 Ų158.380%0.79982%0.816SS**  trans-85.6109.9-175.231.6-30.4000110.9
106E28.7Very low29Very low194 Ų194160.1 Ų160.191%0.90783%0.825SS**  trans-86.3124.6167.4-80.4-165.9148.900111T104T104-E106 PolarHBondContact O-N 3.45Å
107S27.2Very low29.1Very low103 Ų103155.7 Ų155.772%0.7282%0.819SS**  trans-72144.8-177.6-40.50000112.3K109S107-K109 PolarHBondContact O-N 3.47Å
108P32.8Very low28.9Very low126 Ų126154.8 Ų154.882%0.81882%0.818SS**  trans-77.2113.6-174.923.6-18.7000111.2I110P108-I110 PolarHBondContact O-N 3.42Å
109K29.9Very low29.1Very low204 Ų204153.9 Ų153.989%0.88782%0.82SS**  trans-71.8119.7174.3-74.5174.3179.8167.40110.3S107 S111S107-K109 PolarHBondContact O-N 3.47Å; K109-S111 PolarHBondContact O-N 2.71Å
110I26.8Very low29Very low156 Ų156151.5 Ų151.580%0.882%0.816SS**  trans-66.5107172.5-58.9163.1000108.4P108 N112P108-I110 PolarHBondContact O-N 3.42Å; I110-N112 PolarHBondContact O-N 3.19Å
111S31.4Very low28.9Very low107 Ų107151.8 Ų151.875%0.74881%0.812SS**  trans-88105.3175.155.70000110.9K109 L113K109-S111 PolarHBondContact O-N 2.71Å; S111-L113 PolarHBondContact O-N 3.35Å
112N27.5Very low28.8Very low147 Ų147152.7 Ų152.779%0.78682%0.817SS**  trans-64.7118163.8-78.4-41.3000110.4I110I110-N112 PolarHBondContact O-N 3.19Å
113L33.2Very low28.6Very low173 Ų173153.8 Ų153.891%0.90682%0.817SS**  trans-127.496.9159.5-79172.2000109.6S111S111-L113 PolarHBondContact O-N 3.35Å
114R26.1Very low28.4Very low222 Ų222153.1 Ų153.184%0.83881%0.813SS**  trans-84.6135.5169-162-178.5-167.1177.74.7107.6
115N26.2Very low28.3Very low141 Ų141152.6 Ų152.675%0.75481%0.81SS**  trans70.4105.2162.1-60.5-14.1000118.7
116T32.1Very low28.3Very low147 Ų147154.4 Ų154.490%0.90281%0.812SS**  -152.2139.8125.815.60000110.8
117S30Very low28.1Very low104 Ų104152.8 Ų152.873%0.72781%0.807SS**  trans-59.8143.6-171.1500000116.5
118Q26.2Very low28.1Very low186 Ų186151.9 Ų151.987%0.86980%0.801SS**  trans10.9117.2138.2-69.2178.3-23.800117.4
119K30.2Very low27.9Very low211 Ų211154.5 Ų154.592%0.91781%0.808SS**  -163.1149122.9-106.5167.9-175.1-179.80111.9
120S25.9Very low27.8Very low103 Ų103151.1 Ų151.172%0.7280%0.799SS**  trans-55143.1-163.547.20000118.6
121H25Very low27.8Very low174 Ų174150.7 Ų150.781%0.80680%0.799SS**  trans-4.6116.2144.8-83.6-69.3000116.6
122V29.2Very low27.7Very low136 Ų136154.5 Ų154.582%0.82481%0.81SS**  trans-133.6109144.4178.80000107.7
123N26Very low27.8Very low140 Ų140153.1 Ų153.175%0.74980%0.802SS**  trans-62129.6164.1-73.7-30.1000109.6
124K25.4Very low27.6Very low193 Ų193152.6 Ų152.684%0.83980%0.795SS**  trans174.1104.8142-98.1165-179.7-175.30107.5
125T27.4Very low27.7Very low114 Ų114147 Ų14770%0.69980%0.796SS**  112.4114.979.5-62.20000105.9I127T125-I127 PolarHBondContact O-N 3.4Å
126I26.3Very low27.7Very low162 Ų162150 Ų15083%0.83180%0.797SS**  trans-43.9105.7170.8-63.4158.9000108.2S128I126-S128 PolarHBondContact O-N 2.71Å
127I25.8Very low27.6Very low159 Ų159148.6 Ų148.682%0.81579%0.79SS**  trans-79108.6168.6-66.4175.9000105.4T125 L129T125-I127 PolarHBondContact O-N 3.4Å; I127-L129 PolarHBondContact O-N 2.81Å
128S27.5Very low27.4Very low85 Ų85151.1 Ų151.159%0.59479%0.79SS**  trans-42128.9162.2-84.70000110.1I126 D130I126-S128 PolarHBondContact O-N 2.71Å; S128-D130 PolarHBondContact O-N 2.63Å
129L28.8Very low27.5Very low181 Ų181147.3 Ų147.395%0.94878%0.784SS**  trans-77.862.4171-158.675.1000109.1I127I127-L129 PolarHBondContact O-N 2.81Å
130D27.9Very low27.5Very low132 Ų132143.1 Ų143.171%0.70678%0.779SS**  trans-98.4126.8160.5-83-34.2000106.8S128S128-D130 PolarHBondContact O-N 2.63Å
131N26Very low27.5Very low148 Ų148146.2 Ų146.279%0.79179%0.786SS**  trans118.666.8176.3-60.4-20.2000113.5
132L29.9Very low27.8Very low187 Ų187145.9 Ų145.998%0.97979%0.79SS**  trans-107.777.4139.1-159.275.5000107
133D27.8Very low27.8Very low117 Ų117146.3 Ų146.363%0.62679%0.788SS**  trans-88.8135.6179.6-140.77.6000109.4
134Q29.2Very low27.9Very low162 Ų162147.9 Ų147.976%0.75780%0.795SS**  trans67.497.7152.6-63.717033.500120
135A29.2Very low28Very low104 Ų104141.7 Ų141.786%0.8679%0.787SS**  trans-142.682131.600000109.1P137A135-P137 WeakPolarHBondContact O-CD 2.89Å
136R26.1Very low28.2Very low206 Ų206142.9 Ų142.978%0.77779%0.794SS**  trans-90112.9172.6-176.4-175.5-168.7176.74.8108Q138R136-Q138 HydrophobicContact CG-CG 4.27Å; R136-Q138 PolarHBondContact O-N 3.13Å
137P30.9Very low28.4Very low116 Ų116140.8 Ų140.875%0.75379%0.79SS**  trans-80.5105.7154.811.76000106.6A135 S139A135-P137 WeakPolarHBondContact O-CD 2.89Å; P137-S139 PolarHBondContact O-N 3Å
138Q24.6Very low28.9Very low157 Ų157142.8 Ų142.873%0.73479%0.793SS**  trans-66117.9159.4-77.7178.1-2400107.6R136R136-Q138 HydrophobicContact CG-CG 4.27Å; R136-Q138 PolarHBondContact O-N 3.13Å
139S28.5Very low29.2Very low107 Ų107147.3 Ų147.375%0.74880%0.802SS**  trans-127.4137.8152.138.30000108.2P137P137-S139 PolarHBondContact O-N 3Å
140P31.3Very low29.3Very low123 Ų123142.6 Ų142.680%0.79979%0.789SS**  trans-81.8153.4-153.2-10.329.5000112.7D142P140-D142 PolarHBondContact O-N 3.31Å; P140-D142 VanDerWaalsContact O-N 3.12Å
141L25.3Very low29.9Very low168 Ų168142.4 Ų142.488%0.8880%0.795SS**  trans-39.1105.4162.5-13378000111.4
142D30.1Very low30.4Very low166 Ų166140.2 Ų140.289%0.88878%0.78SS**  trans-101.1100.3151.8-89.9-30000107.3P140 L144P140-D142 PolarHBondContact O-N 3.31Å; P140-D142 VanDerWaalsContact O-N 3.12Å; D142-L144 PolarHBondContact O-N 2.91Å
143D29Very low30.9Very low146 Ų146134 Ų13478%0.78175%0.753SS**  trans-68.2105166.8-170.314.6000108
144L28.3Very low32Very low172 Ų172133.9 Ų133.990%0.90176%0.758SS**  trans-172.3112.8156.8-103.3154.2000110.8D142D142-L144 PolarHBondContact O-N 2.91Å
145G27.8Very low32.6Very low64 Ų64132.7 Ų132.766%0.6675%0.754SS**  trans10585.6154.300000114.8P147G145-P147 WeakPolarHBondContact O-CD 3.07Å
146V31.3Very low33.7Very low139 Ų139132.2 Ų132.284%0.84274%0.737SS**  trans-37.6112.9155.1176.90000109.3K148V146-K148 PolarHBondContact O-N 3.25Å; V146-K148 VanDerWaalsContact O-N 3.13Å
147P31.7Very low34.8Very low117 Ų117126.4 Ų126.476%0.7672%0.721SS**  trans-66.4120.4178.225.2-30.4000107.7G145 K149G145-P147 WeakPolarHBondContact O-CD 3.07Å; P147-K149 PolarHBondContact O-N 3.45Å
148K34.9Very low36.1Very low201 Ų201128.2 Ų128.287%0.87472%0.718SS**  trans-36.5121.6175.2-71171.3177173.40110.3V146 A150V146-K148 PolarHBondContact O-N 3.25Å; V146-K148 VanDerWaalsContact O-N 3.13Å; K148-A150 PolarHBondContact O-N 3Å
149K33.8Very low37.1Very low181 Ų181126.6 Ų126.679%0.78771%0.713SS**  trans-43.3128.4162.1-79.9-177.5171.5-173.50108.3P147P147-K149 PolarHBondContact O-N 3.45Å
150A32.5Very low38Very low82 Ų82125.4 Ų125.468%0.67871%0.705SS**  trans-47.1140.9169.500000109.3K148 E152K148-A150 PolarHBondContact O-N 3Å; A150-E152 PolarHBondContact O-N 3.48Å
151P38.9Very low38.3Very low127 Ų127128 Ų12883%0.82570%0.704SS**  trans-62.2109.7-171.626.3-32.6000108.8S153P151-S153 PolarHBondContact O-N 2.91Å
152E37.5Very low38.8Very low102 Ų102127.3 Ų127.348%0.47769%0.694SS.*  trans-52.7132.6168-74.8171.4-175.200107.9A150 L156A150-E152 PolarHBondContact O-N 3.48Å; E152-L156 HydrophobicContact CB-CB 4.49Å
153S41Very low39.1Very low58 Ų58124.9 Ų124.941%0.40669%0.687SS.*  trans-45143-174.854.30000111.3P151 M155 L156P151-S153 PolarHBondContact O-N 2.91Å; S153-M155 PolarHBondContact O-N 3.39Å; S153-L156 PolarHBondContact O-N 3.46Å
154P51.1Low39.4Very low114 Ų114124.4 Ų124.474%0.7470%0.695SS**Hα-helixtrans-50.5-28.1-177.8-27.433.5000113.4N157 F158P154-N157 PolarHBondContact O-N 3.49Å; P154-F158 WeakPolarHBondContact O-CB 3.26Å; P154-F158 PolarHBondContact O-N 3.2Å
155M41.7Very low39.6Very low137 Ų137119.8 Ų119.868%0.67568%0.682SS**Hα-helixtrans-64.5-38.6176.5-157171.671.900113.7S153 F158 L159S153-M155 PolarHBondContact O-N 3.39Å; M155-F158 PolarHBondContact O-N 3.29Å; M155-L159 HydrophobicContact CG-CD1 4.42Å; M155-L159 WeakPolarHBondContact O-CB 3.27Å; M155-L159 WeakPolarHBondContact O-CG 2.96Å; M155-L159 PolarHBondContact O-N 3.04Å
156L50.7Low39.7Very low94 Ų94121.5 Ų121.549%0.49268%0.683SS.*Hα-helixtrans-75-32.7177.4-83.1165.5000112.6E152 S153 L159 S160E152-L156 HydrophobicContact CB-CB 4.49Å; S153-L156 PolarHBondContact O-N 3.46Å; L156-L159 PolarHBondContact O-N 2.9Å; L156-S160 WeakPolarHBondContact O-CB 3.35Å; L156-S160 PolarHBondContact O-N 3.37Å; L156-S160 PolarHBondContact O-OG 3.43Å
157N50.7Low39.6Very low84 Ų84125 Ų12545%0.44969%0.687SS.*Hα-helixtrans-71.9-30.7171-93.5-41000112.8P154 S160 K161P154-N157 PolarHBondContact O-N 3.49Å; N157-S160 PolarHBondContact O-OG 3.11Å; N157-K161 PolarHBondContact O-N 3.27Å
158F57Low39.5Very low154 Ų154127.8 Ų127.868%0.67569%0.693SS**Hα-helixtrans-72.9-34.7173.7-153.1-92.5000111.9P154 M155P154-F158 WeakPolarHBondContact O-CB 3.26Å; P154-F158 PolarHBondContact O-N 3.2Å; M155-F158 PolarHBondContact O-N 3.29Å
159L46.1Very low39.2Very low122 Ų122126.5 Ų126.564%0.63969%0.69SS**Hα-helixtrans-77-31.2178-69.8171.9000113.5M155 L156M155-L159 HydrophobicContact CG-CD1 4.42Å; M155-L159 WeakPolarHBondContact O-CB 3.27Å; M155-L159 WeakPolarHBondContact O-CG 2.96Å; M155-L159 PolarHBondContact O-N 3.04Å; L156-L159 PolarHBondContact O-N 2.9Å
160S47.8Very low39Very low83 Ų83122.5 Ų122.558%0.5869%0.685SS**Hα-helixtrans-80.2-17178.555.80000114.5L156 N157L156-S160 WeakPolarHBondContact O-CB 3.35Å; L156-S160 PolarHBondContact O-N 3.37Å; L156-S160 PolarHBondContact O-OG 3.43Å; N157-S160 PolarHBondContact O-OG 3.11Å
161K37.8Very low39Very low177 Ų177124.1 Ų124.177%0.7769%0.688SS**THydrogen-bonded Turntrans-10015.5-179.4-81.6-171.4176.3-178.80115.4N157N157-K161 PolarHBondContact O-N 3.27Å
162K35.8Very low38.6Very low154 Ų154125 Ų12567%0.6769%0.686SS**SBendtrans-88.9125.7165.5-81.1-165.1172.5-1780110.3S164K162-S164 PolarHBondContact O-N 3.34Å
163P35.8Very low38.4Very low114 Ų114122.9 Ų122.974%0.7469%0.686SS**  trans-55.9128.9178.5-18.829.2000110.1A165P163-A165 PolarHBondContact O-N 3.38Å
164S34.8Very low37.9Very low136 Ų136128.1 Ų128.195%0.95170%0.704SS**  trans-62.775.9164.224.70000109.6K162K162-S164 PolarHBondContact O-N 3.34Å
165A32Very low36.9Very low76 Ų76124.2 Ų124.263%0.62868%0.677SS**  trans-117.6103.7166.100000107.6P163P163-A165 PolarHBondContact O-N 3.38Å
166S30.9Very low36.5Very low99 Ų99123.4 Ų123.469%0.69268%0.679SS**  trans48.3106.1166.757.70000116.5M168S166-M168 PolarHBondContact O-N 3.46Å
167F28.6Very low35.6Very low212 Ų212120.7 Ų120.793%0.9367%0.668SS**  trans-27.695.9149.1-98.3-104.1000111.6Q169F167-Q169 VanDerWaalsContact C-N 3.28Å; F167-Q169 PolarHBondContact O-N 3.19Å
168M29.4Very low34.7Very low176 Ų176121.5 Ų121.587%0.86768%0.676SS**  trans-85.188.9157.4-83.2-98.6127.600105S166S166-M168 PolarHBondContact O-N 3.46Å
169Q30.3Very low33.4Very low175 Ų175117.9 Ų117.982%0.81867%0.67SS**  trans-48.9138.1164.2-158166.71.400108.4F167F167-Q169 VanDerWaalsContact C-N 3.28Å; F167-Q169 PolarHBondContact O-N 3.19Å
170S27.7Very low33.1Very low97 Ų97117.6 Ų117.668%0.67868%0.678SS**  trans-36.2135.6-174.7-69.10000113.1D172S170-D172 PolarHBondContact O-N 3.24Å
171P33.2Very low32.5Very low115 Ų115121.3 Ų121.375%0.74769%0.686SS**  trans-72.378.1177.731.1-32.3000109A173P171-A173 VanDerWaalsContact C-N 3.29Å; P171-A173 PolarHBondContact O-N 3.37Å
172D31.7Very low32.2Very low145 Ų145120.8 Ų120.878%0.77569%0.692SS**  trans-64.997.5160.7-96.4-28.9000107.2S170 H174S170-D172 PolarHBondContact O-N 3.24Å; D172-H174 PolarHBondContact O-N 2.74Å
173A31.9Very low32.1Very low59 Ų59116.8 Ų116.849%0.48868%0.684SS.*  trans3772.3160.300000112.6P171 N175 K890P171-A173 VanDerWaalsContact C-N 3.29Å; P171-A173 PolarHBondContact O-N 3.37Å; A173-N175 PolarHBondContact O-N 2.74Å; A173-K890 VanDerWaalsContact CB-NZ 3.34Å; A173-K890 PolarHBondContact O-NZ 3.47Å
174H31.7Very low32.4Very low167 Ų167117.1 Ų117.177%0.77368%0.683SS**  trans-50109.5162-96.6-66000107.3D172 V176D172-H174 PolarHBondContact O-N 2.74Å; H174-V176 VanDerWaalsContact C-N 3.26Å; H174-V176 PolarHBondContact O-N 3.47Å
175N30.3Very low32.6Very low32 Ų32120.4 Ų120.417%0.17168%0.676CS.*  trans-55.795.2164.6-75.1-37.5000107.8A173 S177 Q883 K886A173-N175 PolarHBondContact O-N 2.74Å; N175-S177 PolarHBondContact O-N 3.35Å; N175-Q883 VanDerWaalsContact CG-OE1 3.22Å; N175-Q883 PolarHBondContact ND2-NE2 3.46Å; N175-Q883 PolarHBondContact ND2-OE1 3.15Å; N175-Q883 VanDerWaalsContact ND2-OE1 3.08Å; N175-K886 HydrophobicContact CB-CD 4.39Å; N175-K886 WeakPolarHBondContact OD1-CD 3.3Å
176V32.1Very low32.6Very low120 Ų120125.7 Ų125.773%0.72769%0.685SS**  trans-68.198.4151.9179.20000104H174 T178 K886H174-V176 VanDerWaalsContact C-N 3.26Å; H174-V176 PolarHBondContact O-N 3.47Å; V176-T178 PolarHBondContact O-N 3.28Å; V176-K886 PolarHBondContact O-NZ 3.39Å
177S31.3Very low32.8Very low37 Ų37128 Ų12826%0.25969%0.685SS.*  trans-44126.2162.5-550000107.2N175 S179N175-S177 PolarHBondContact O-N 3.35Å; S177-S179 PolarHBondContact O-N 2.71Å
178T31.9Very low33.3Very low102 Ų102128.6 Ų128.663%0.62668%0.681SS**  trans-54.483.1165.646.80000109V176 S882V176-T178 PolarHBondContact O-N 3.28Å; T178-S882 PolarHBondContact OG1-OG 3.09Å
179S30.9Very low33.6Very low78 Ų78124.4 Ų124.455%0.54567%0.674SS.*  trans-87.9103.6152.8570000105.8S177 E181S177-S179 PolarHBondContact O-N 2.71Å; S179-E181 VanDerWaalsContact C-N 3.3Å; S179-E181 PolarHBondContact O-N 2.68Å
180S39.3Very low33.8Very low115 Ų115121.4 Ų121.480%0.80467%0.673SS**  trans-47.189.7169.3163.40000110.9
181E34.7Very low34Very low161 Ų161123.8 Ų123.875%0.75267%0.671SS**  trans-158.162167-111.7165.6-153.400107.9S179S179-E181 VanDerWaalsContact C-N 3.3Å; S179-E181 PolarHBondContact O-N 2.68Å
182D32.2Very low34.2Very low166 Ų166124 Ų12489%0.88867%0.67SS**  trans-158.847158.4-95.4-23.2000109.8
183S34Very low34.3Very low71 Ų71123.1 Ų123.150%0.49767%0.674SS.*  trans-103.915.7159.8-170.20000111.2Y185S183-Y185 VanDerWaalsContact C-N 3.29Å; S183-Y185 PolarHBondContact O-N 3.37Å
184V42.4Very low34.3Very low121 Ų121127.3 Ų127.373%0.73368%0.683SS**THydrogen-bonded Turntrans-78.9-11.2-178.1-178.80000112.6
185Y37.9Very low34.2Very low205 Ų205125.5 Ų125.580%0.80468%0.679SS**THydrogen-bonded Turntrans-111.8-3.3-175-118.3-91.6000118.3S183S183-Y185 VanDerWaalsContact C-N 3.29Å; S183-Y185 PolarHBondContact O-N 3.37Å
186F32.5Very low34.3Very low186 Ų186134.7 Ų134.782%0.81671%0.713SS**THydrogen-bonded Turntrans-124.72.2177.8-96.2-80000117.2
187H35.5Very low34.4Very low147 Ų147135 Ų13568%0.68172%0.716SS**SBendtrans-92.36.5166.5-77.6-39.6000115.3
188R39Very low34.2Very low225 Ų225136.2 Ų136.285%0.84973%0.734SS**SBendtrans-85.6-8176.4-148.6173.1-157.3-178.65.6115.4
189A34.5Very low34.1Very low88 Ų88140.2 Ų140.273%0.72775%0.745SS**SBendtrans-105.50.6-178.100000115.6
190S35.3Very low34.2Very low113 Ų113143.4 Ų143.479%0.7976%0.761SS**SBendtrans-133.725.6178.3-62.40000115.6
191K31.7Very low33.6Very low147 Ų147146.2 Ų146.264%0.63976%0.759SS**SBendtrans-136.326.6169.8-117.7-174.8-178.9-163.10116.2
192V37.7Very low33.4Very low120 Ų120144.3 Ų144.373%0.72776%0.758SS**SBendtrans-90.20.1168.4179.40000112.5
193C33.3Very low33.2Very low126 Ų126145.5 Ų145.585%0.85176%0.758SS**SBendtrans-115.77.4175.4-70.80000116
194Q32.2Very low32.9Very low147 Ų147149.1 Ų149.169%0.68777%0.771SS**SBendtrans-140.382.9172-91.3175.8-19.300109
195D30.1Very low32.2Very low128 Ų128149.7 Ų149.768%0.68477%0.77SS**  trans179.355.9140.9-80.6-21000108.2T197D195-T197 PolarHBondContact O-N 3.2Å
196Y32.3Very low31.9Very low225 Ų225148.7 Ų148.788%0.88277%0.77SS**SBendtrans-87.149157-94.4-81.5000108.9
197T33.8Very low31.8Very low128 Ų128146.6 Ų146.679%0.78577%0.772SS**  trans-159.182.9170.945.90000107.5D195D195-T197 PolarHBondContact O-N 3.2Å
198G27.2Very low31.6Very low62 Ų62148.3 Ų148.364%0.63978%0.78SS**SBendtrans-17689.9-178.600000110.4V200G198-V200 PolarHBondContact O-N 2.71Å
199E30.9Very low31.1Very low185 Ų185145.2 Ų145.286%0.86478%0.781SS**  trans-31.6103.8173.9-64.9169.2151.300113.1K201E199-K201 PolarHBondContact O-N 2.74Å
200V31.1Very low30.9Very low145 Ų145149.9 Ų149.988%0.87978%0.784SS**  trans-73.792.3164.8179.10000106.7G198 T202G198-V200 PolarHBondContact O-N 2.71Å; V200-T202 PolarHBondContact O-N 3.17Å
201K27.2Very low30.8Very low175 Ų175149.8 Ų149.876%0.76178%0.781SS**  trans-42106.6160.2-79.7172.8175171.40109.4E199 H203E199-K201 PolarHBondContact O-N 2.74Å; K201-H203 PolarHBondContact O-N 2.89Å
202T30.6Very low31.1Very low121 Ų121149.4 Ų149.474%0.74279%0.79SS**  trans-0.691.8140.243.60000114.5V200 L204V200-T202 PolarHBondContact O-N 3.17Å; T202-L204 VanDerWaalsContact C-N 3.29Å; T202-L204 PolarHBondContact O-N 3.33Å
203H27.9Very low30.8Very low190 Ų190148 Ų14888%0.8878%0.783SS**  trans-84.689.3149.8-117.8-72.3000107.2K201 D205K201-H203 PolarHBondContact O-N 2.89Å; H203-D205 PolarHBondContact O-N 3.41Å
204L27Very low30.7Very low148 Ų148151 Ų15178%0.77578%0.784SS**  trans-65.5100.1173.1-162.896000108.4T202T202-L204 VanDerWaalsContact C-N 3.29Å; T202-L204 PolarHBondContact O-N 3.33Å
205D29.6Very low30.8Very low133 Ų133152.4 Ų152.471%0.71179%0.788SS**  trans-111.488.1159.1-111.8-19.9000109.2H203 V207H203-D205 PolarHBondContact O-N 3.41Å; D205-V207 PolarHBondContact O-N 3.38Å
206K29.9Very low30.9Very low183 Ų183151 Ų15180%0.79679%0.788SS**  trans36.375.6138.4-61.3174.4-178.4171.30115.9
207V32.1Very low30.9Very low143 Ų143146.8 Ų146.887%0.86779%0.786SS**  trans-107.8117.7147.5179.70000106.5D205 D209D205-V207 PolarHBondContact O-N 3.38Å; V207-D209 PolarHBondContact O-N 3.39Å
208H29.5Very low30.9Very low182 Ų182149.2 Ų149.284%0.84379%0.788SS**  trans-42.7119.7-167.1-79.5-58.2000115.8K210H208-K210 PolarHBondContact O-N 2.94Å
209D28.4Very low31.2Very low161 Ų161153.5 Ų153.586%0.86180%0.796SS**  trans-54.5100.4150.1-72.9-43.4000109.1V207V207-D209 PolarHBondContact O-N 3.39Å
210K31.4Very low31.5Very low186 Ų186154.2 Ų154.281%0.80980%0.797SS**  trans-84.4127.5150.8-89.6-176.8177.1177.80106.7H208 V212H208-K210 PolarHBondContact O-N 2.94Å; K210-V212 PolarHBondContact O-N 3.34Å; K210-V212 VanDerWaalsContact O-N 3.08Å
211P33.7Very low31.8Very low110 Ų110152.1 Ų152.171%0.71479%0.788SS**  trans-65.3116.1-168.127.6-33.4000109.2T213P211-T213 PolarHBondContact O-N 3.36Å; P211-T213 PolarHBondContact O-OG1 3.5Å
212V36.5Very low32.7Very low139 Ų139150.3 Ų150.384%0.84279%0.787SS**  trans-6394.9163.2177.10000105.7K210 E214K210-V212 PolarHBondContact O-N 3.34Å; K210-V212 VanDerWaalsContact O-N 3.08Å; V212-E214 PolarHBondContact O-N 2.97Å
213T32.5Very low34Very low92 Ų92148.6 Ų148.656%0.56478%0.777SS**  trans-70.9109.5173.7-39.60000105.8P211 F215P211-T213 PolarHBondContact O-N 3.36Å; P211-T213 PolarHBondContact O-OG1 3.5Å; T213-F215 HydrophobicContact CG2-CD2 4.05Å; T213-F215 HydrophobicContact CG2-CE2 3.68Å; T213-F215 HydrophobicContact CG2-CZ 4.3Å; T213-F215 PolarHBondContact O-N 2.91Å
214E31.5Very low35.4Very low189 Ų189146.6 Ų146.688%0.88377%0.772SS**  trans-57.1101.3166-73.6177.4152.600107.9V212 S216V212-E214 PolarHBondContact O-N 2.97Å; E214-S216 PolarHBondContact O-N 3.49Å
215F33Very low36.9Very low175 Ų175144.1 Ų144.177%0.76877%0.766SS**  trans-89103.5171.6-90.9-84.3000109.1T213 V217T213-F215 HydrophobicContact CG2-CD2 4.05Å; T213-F215 HydrophobicContact CG2-CE2 3.68Å; T213-F215 HydrophobicContact CG2-CZ 4.3Å; T213-F215 PolarHBondContact O-N 2.91Å; F215-V217 PolarHBondContact O-N 2.84Å
216S32.5Very low38.7Very low99 Ų99142.5 Ų142.569%0.69276%0.757SS**  trans-51.5128.2162.3-178.90000110.1E214 E218E214-S216 PolarHBondContact O-N 3.49Å; S216-E218 PolarHBondContact O-N 3.39Å
217V33.3Very low40.8Very low136 Ų136139.1 Ų139.182%0.82475%0.748SS**  trans-74.6105.9176.2177.30000107.9F215F215-V217 PolarHBondContact O-N 2.84Å
218E33Very low42.9Very low179 Ų179137.9 Ų137.984%0.83674%0.735SS**  trans-124.2127.3164.8-97170.1165.700110.4S216S216-E218 PolarHBondContact O-N 3.39Å
219D33.3Very low45.3Very low152 Ų152136.9 Ų136.981%0.81373%0.729SS**  trans-48.3128.2-179.1-72.2-51000113.4
220K38.1Very low47.7Very low200 Ų200135.3 Ų135.387%0.8771%0.714SS**  trans-167.4130130.3-98.1149-167.2-179.40110.3D222K220-D222 PolarHBondContact O-N 3.49Å
221S37.3Very low50.1Low101 Ų101131.7 Ų131.771%0.70670%0.704SS**  trans-37.7126.2164.749.60000112.6
222D46Very low52.6Low137 Ų137134.1 Ų134.173%0.73370%0.7SS**  -173.4128.8118.1-87.3-26.9000113.2K220K220-D222 PolarHBondContact O-N 3.49Å
223T57.5Low54.9Low85 Ų85134.9 Ų134.952%0.52169%0.692SS.*  trans66.3109.8165.177.90000119.6C225 D226T223-C225 PolarHBondContact O-N 3.32Å; T223-D226 PolarHBondContact O-N 2.92Å; T223-D226 VanDerWaalsContact O-N 3.08Å; T223-D226 PolarHBondContact OG1-OD2 2.99Å
224L56.6Low57.5Low148 Ų148138.6 Ų138.678%0.77570%0.695SS**Hα-helixtrans-48.1-22169-149120.8000114.1L228L224-L228 PolarHBondContact O-N 3.46Å; L224-L228 VanDerWaalsContact O-N 3.11Å
225C60.4Low60.2Low96 Ų96135.6 Ų135.665%0.64968%0.684SS**Hα-helixtrans-68.4-39.3179.6-142.20000112.5T223 L228 K229T223-C225 PolarHBondContact O-N 3.32Å; C225-L228 PolarHBondContact O-N 2.9Å; C225-K229 PolarHBondContact O-N 3.14Å
226D65.7Low62.9Low100 Ų100134.3 Ų134.354%0.53568%0.675SS.*Hα-helixtrans-70.5-37.6178.8-73.1-26.6000111.4T223 L228 K229 F230T223-D226 PolarHBondContact O-N 2.92Å; T223-D226 VanDerWaalsContact O-N 3.08Å; T223-D226 PolarHBondContact OG1-OD2 2.99Å; D226-L228 PolarHBondContact O-N 3.25Å; D226-K229 PolarHBondContact O-N 3.33Å; D226-F230 WeakPolarHBondContact O-CB 3.26Å; D226-F230 PolarHBondContact O-N 3.4Å
227N73.9Confident65.6Low112 Ų112134.2 Ų134.260%0.59966%0.663SS**Hα-helixtrans-62.8-40.2171.7-76.5-17.2000112.2F230 L231N227-F230 PolarHBondContact O-N 3.26Å; N227-L231 WeakPolarHBondContact O-CB 3.39Å; N227-L231 WeakPolarHBondContact O-CG 3Å; N227-L231 PolarHBondContact O-N 3.1Å
228L77.6Confident68.2Low116 Ų116132.9 Ų132.961%0.60765%0.648SS**Hα-helixtrans-67.1-40.8177.5-150.487.7000111.7L224 C225 D226 L231 Y232L224-L228 PolarHBondContact O-N 3.46Å; L224-L228 VanDerWaalsContact O-N 3.11Å; C225-L228 PolarHBondContact O-N 2.9Å; D226-L228 PolarHBondContact O-N 3.25Å; L228-L231 PolarHBondContact O-N 2.74Å; L228-Y232 WeakPolarHBondContact O-CB 2.86Å; L228-Y232 PolarHBondContact O-N 2.81Å
229K79Confident70.9Confident161 Ų161127 Ų12770%0.763%0.63SS**Hα-helixtrans-66.6-38.9177.2-160174.7-173.8178.50111.5C225 D226 Y232 K233C225-K229 PolarHBondContact O-N 3.14Å; D226-K229 PolarHBondContact O-N 3.33Å; K229-Y232 PolarHBondContact O-N 3.16Å; K229-K233 WeakPolarHBondContact O-CB 3.02Å; K229-K233 PolarHBondContact O-N 3.4Å
230F80Confident73.5Confident128 Ų128124 Ų12456%0.56161%0.611SS**Hα-helixtrans-63.8-47173-177.3-96.4000111.9D226 N227 Y232 K233 R234D226-F230 WeakPolarHBondContact O-CB 3.26Å; D226-F230 PolarHBondContact O-N 3.4Å; N227-F230 PolarHBondContact O-N 3.26Å; F230-Y232 PolarHBondContact O-N 3.38Å; F230-K233 PolarHBondContact O-N 2.82Å; F230-R234 WeakPolarHBondContact O-CB 3.44Å; F230-R234 PolarHBondContact O-N 3.2Å
231L81.8Confident76Confident111 Ų111117.8 Ų117.858%0.58159%0.587SS**Hα-helixtrans-59.4-43.4175.1-82.3163.7000112N227 L228 R234 L235N227-L231 WeakPolarHBondContact O-CB 3.39Å; N227-L231 WeakPolarHBondContact O-CG 3Å; N227-L231 PolarHBondContact O-N 3.1Å; L228-L231 PolarHBondContact O-N 2.74Å; L231-R234 PolarHBondContact O-N 2.79Å; L231-L235 WeakPolarHBondContact O-CB 3.46Å; L231-L235 PolarHBondContact O-N 3.43Å
232Y85.5Confident78.5Confident161 Ų161118.3 Ų118.363%0.63158%0.582SS**Hα-helixtrans-62.2-43.5176.2-173.7-95.4000111.9L228 K229 F230 R234 L235 R236L228-Y232 WeakPolarHBondContact O-CB 2.86Å; L228-Y232 PolarHBondContact O-N 2.81Å; K229-Y232 PolarHBondContact O-N 3.16Å; F230-Y232 PolarHBondContact O-N 3.38Å; Y232-R234 PolarHBondContact O-N 2.8Å; Y232-L235 PolarHBondContact O-N 2.76Å; Y232-R236 WeakPolarHBondContact O-CB 3.28Å; Y232-R236 PolarHBondContact O-N 2.74Å
233K85.3Confident80.5Confident155 Ų155116.2 Ų116.267%0.67457%0.567SS**Hα-helixtrans-63.4-41.3177-166.8177-178.4-178.60111.6K229 F230 R236 Q237K229-K233 WeakPolarHBondContact O-CB 3.02Å; K229-K233 PolarHBondContact O-N 3.4Å; F230-K233 PolarHBondContact O-N 2.82Å; K233-R236 PolarHBondContact O-N 3.41Å; K233-Q237 WeakPolarHBondContact O-CB 3.32Å; K233-Q237 PolarHBondContact O-N 3.44Å
234R87.4Confident82Confident170 Ų170116.5 Ų116.564%0.64257%0.569SS**Hα-helixtrans-66.8-43176.3-170.8170.5-179.3138.6-0.3112.1F230 L231 Y232 R236 Q237 E238F230-R234 WeakPolarHBondContact O-CB 3.44Å; F230-R234 PolarHBondContact O-N 3.2Å; L231-R234 PolarHBondContact O-N 2.79Å; Y232-R234 PolarHBondContact O-N 2.8Å; R234-R236 VanDerWaalsContact C-N 3.34Å; R234-R236 PolarHBondContact O-N 2.76Å; R234-Q237 PolarHBondContact O-N 2.76Å; R234-E238 WeakPolarHBondContact O-CB 3.29Å; R234-E238 PolarHBondContact O-N 2.97Å
235L88Confident83.6Confident125 Ų125118 Ų11865%0.65456%0.564SS**Hα-helixtrans-62.9-41.4176.5-167.280.3000111.4L231 Y232 E238 A239L231-L235 WeakPolarHBondContact O-CB 3.46Å; L231-L235 PolarHBondContact O-N 3.43Å; Y232-L235 PolarHBondContact O-N 2.76Å; L235-E238 PolarHBondContact O-N 3.41Å; L235-A239 WeakPolarHBondContact O-CB 3.01Å; L235-A239 PolarHBondContact O-N 3.48Å
236R89.2Confident85Confident149 Ų149118.4 Ų118.456%0.56256%0.555SS**Hα-helixtrans-64-45.8175.6-176.8179177164.76111.8Y232 K233 R234 E238 A239 E240Y232-R236 WeakPolarHBondContact O-CB 3.28Å; Y232-R236 PolarHBondContact O-N 2.74Å; K233-R236 PolarHBondContact O-N 3.41Å; R234-R236 VanDerWaalsContact C-N 3.34Å; R234-R236 PolarHBondContact O-N 2.76Å; R236-E238 VanDerWaalsContact C-N 3.26Å; R236-E238 PolarHBondContact O-N 3.34Å; R236-A239 PolarHBondContact O-N 2.95Å; R236-E240 IonicContact NE-OE1 3.32Å; R236-E240 PolarHBondContact NE-OE1 2.98Å; R236-E240 VanDerWaalsContact NE-OE1 3.17Å; R236-E240 WeakPolarHBondContact O-CG 3.44Å; R236-E240 PolarHBondContact O-N 3.24Å
237Q88.3Confident86.1Confident97 Ų97116.4 Ų116.445%0.45355%0.549SS..Hα-helixtrans-58.7-41.7175.5-16968.949.700111.1K233 R234 E240 N241K233-Q237 WeakPolarHBondContact O-CB 3.32Å; K233-Q237 PolarHBondContact O-N 3.44Å; R234-Q237 PolarHBondContact O-N 2.76Å; Q237-E240 PolarHBondContact O-N 3.4Å; Q237-N241 WeakPolarHBondContact O-CB 3.47Å; Q237-N241 PolarHBondContact O-N 3.5Å; Q237-N241 PolarHBondContact O-ND2 2.84Å; Q237-N241 PolarHBondContact O-OD1 3.11Å
238E89Confident86.8Confident108 Ų108114 Ų11451%0.50554%0.54SS..Hα-helixtrans-70.8-34179.4-154.267.2172.500112.7R234 L235 R236 N241 L242R234-E238 WeakPolarHBondContact O-CB 3.29Å; R234-E238 PolarHBondContact O-N 2.97Å; L235-E238 PolarHBondContact O-N 3.41Å; R236-E238 VanDerWaalsContact C-N 3.26Å; R236-E238 PolarHBondContact O-N 3.34Å; E238-N241 PolarHBondContact O-N 3.05Å; E238-N241 PolarHBondContact OE2-ND2 3.46Å; E238-N241 VanDerWaalsContact OE2-ND2 3.14Å; E238-L242 WeakPolarHBondContact O-CB 3.43Å; E238-L242 WeakPolarHBondContact O-CG 3.38Å; E238-L242 PolarHBondContact O-N 3.47Å
239A88.6Confident87.3Confident56 Ų56111.4 Ų111.446%0.46353%0.529SS..Hα-helixtrans-65-40.6171.200000111.9L235 R236 L242 E243L235-A239 WeakPolarHBondContact O-CB 3.01Å; L235-A239 PolarHBondContact O-N 3.48Å; R236-A239 PolarHBondContact O-N 2.95Å; A239-L242 PolarHBondContact O-N 2.96Å; A239-E243 PolarHBondContact O-N 3.35Å
240E89.4Confident87.8Confident88 Ų88108.1 Ų108.141%0.41152%0.517SS..Hα-helixtrans-65.7-41174.3-71.8169.9-167.300111.3R236 Q237 L242 E243 T244R236-E240 IonicContact NE-OE1 3.32Å; R236-E240 PolarHBondContact NE-OE1 2.98Å; R236-E240 VanDerWaalsContact NE-OE1 3.17Å; R236-E240 WeakPolarHBondContact O-CG 3.44Å; R236-E240 PolarHBondContact O-N 3.24Å; Q237-E240 PolarHBondContact O-N 3.4Å; E240-L242 VanDerWaalsContact C-N 3.35Å; E240-L242 PolarHBondContact O-N 2.9Å; E240-E243 PolarHBondContact O-N 2.88Å; E240-T244 WeakPolarHBondContact O-CG2 3.44Å; E240-T244 PolarHBondContact O-N 3.21Å; E240-T244 PolarHBondContact O-OG1 3.4Å; E240-T244 VanDerWaalsContact O-OG1 3.11Å
241N89.7Confident88.1Confident70 Ų70105.4 Ų105.437%0.37451%0.514SS..Hα-helixtrans-61.8-41.1173.2-68-17.9000111.8Q237 E238 T244 W245Q237-N241 WeakPolarHBondContact O-CB 3.47Å; Q237-N241 PolarHBondContact O-N 3.5Å; Q237-N241 PolarHBondContact O-ND2 2.84Å; Q237-N241 PolarHBondContact O-OD1 3.11Å; E238-N241 PolarHBondContact O-N 3.05Å; E238-N241 PolarHBondContact OE2-ND2 3.46Å; E238-N241 VanDerWaalsContact OE2-ND2 3.14Å; N241-T244 WeakPolarHBondContact CA-OG1 3.17Å; N241-T244 PolarHBondContact O-OG1 3.44Å; N241-W245 WeakPolarHBondContact O-CB 3.44Å; N241-W245 PolarHBondContact O-N 3.22Å
242L89.4Confident88.5Confident111 Ų111106.1 Ų106.158%0.58151%0.513SS*.Hα-helixtrans-66.8-39.4176.4-79.1166.7000112.3E238 A239 E240 W245 K246E238-L242 WeakPolarHBondContact O-CB 3.43Å; E238-L242 WeakPolarHBondContact O-CG 3.38Å; E238-L242 PolarHBondContact O-N 3.47Å; A239-L242 PolarHBondContact O-N 2.96Å; E240-L242 VanDerWaalsContact C-N 3.35Å; E240-L242 PolarHBondContact O-N 2.9Å; L242-W245 PolarHBondContact O-N 2.78Å; L242-K246 WeakPolarHBondContact O-CB 3.47Å; L242-K246 PolarHBondContact O-N 3.4Å
243E89.1Confident88.8Confident93 Ų93104 Ų10444%0.43551%0.512SS..Hα-helixtrans-68.6-41.2177.8-165.861.3-152.500111.4A239 E240 W245 K246 C247A239-E243 PolarHBondContact O-N 3.35Å; E240-E243 PolarHBondContact O-N 2.88Å; E243-W245 VanDerWaalsContact C-N 3.32Å; E243-W245 PolarHBondContact O-N 3.15Å; E243-K246 WeakPolarHBondContact O-CB 3.36Å; E243-K246 PolarHBondContact O-N 3.48Å; E243-K246 IonicContact OE1-NZ 2.89Å; E243-K246 PolarHBondContact OE1-NZ 3Å; E243-K246 IonicContact OE2-NZ 3.71Å; E243-K246 PolarHBondContact OE2-NZ 3.24Å; E243-C247 PolarHBondContact O-N 2.78Å; E243-C247 PolarHBondContact O-SG 3.32Å
244T88.4Confident89Confident91 Ų91102.2 Ų102.256%0.55851%0.506SS*.Hα-helixtrans-63.1-38.8173.753.20000112.1E240 N241 C247 C248E240-T244 WeakPolarHBondContact O-CG2 3.44Å; E240-T244 PolarHBondContact O-N 3.21Å; E240-T244 PolarHBondContact O-OG1 3.4Å; E240-T244 VanDerWaalsContact O-OG1 3.11Å; N241-T244 WeakPolarHBondContact CA-OG1 3.17Å; N241-T244 PolarHBondContact O-OG1 3.44Å; T244-C247 PolarHBondContact O-N 3.36Å; T244-C248 WeakPolarHBondContact O-CB 3.32Å; T244-C248 PolarHBondContact O-N 3.04Å
245W89.3Confident89.1Confident179 Ų17999.6 Ų99.668%0.67850%0.501SS*.Hα-helixtrans-65.2-40.2174.5-163.575.1000112.1N241 L242 E243 C248 T249N241-W245 WeakPolarHBondContact O-CB 3.44Å; N241-W245 PolarHBondContact O-N 3.22Å; L242-W245 PolarHBondContact O-N 2.78Å; E243-W245 VanDerWaalsContact C-N 3.32Å; E243-W245 PolarHBondContact O-N 3.15Å; W245-C248 PolarHBondContact O-N 2.84Å; W245-T249 HydrophobicContact CD2-CG2 4.18Å; W245-T249 HydrophobicContact CE3-CG2 4.37Å; W245-T249 HydrophobicContact CH2-CG2 4.46Å; W245-T249 HydrophobicContact CZ2-CG2 4.28Å; W245-T249 WeakPolarHBondContact O-CB 3.01Å; W245-T249 WeakPolarHBondContact O-CG2 3.33Å; W245-T249 PolarHBondContact O-N 2.8Å; W245-T249 PolarHBondContact O-OG1 2.81Å
246K90.1Very high89.3Confident105 Ų10599.2 Ų99.246%0.45749%0.494SS..Hα-helixtrans-63.3-44.9174.1177.3179.9154.4-135.80112.3L242 E243 T249 M250L242-K246 WeakPolarHBondContact O-CB 3.47Å; L242-K246 PolarHBondContact O-N 3.4Å; E243-K246 WeakPolarHBondContact O-CB 3.36Å; E243-K246 PolarHBondContact O-N 3.48Å; E243-K246 IonicContact OE1-NZ 2.89Å; E243-K246 PolarHBondContact OE1-NZ 3Å; E243-K246 IonicContact OE2-NZ 3.71Å; E243-K246 PolarHBondContact OE2-NZ 3.24Å; K246-T249 WeakPolarHBondContact CA-OG1 3.05Å; K246-T249 PolarHBondContact O-N 2.91Å; K246-T249 PolarHBondContact O-OG1 2.97Å; K246-M250 VanDerWaalsContact O-CB 3.29Å; K246-M250 WeakPolarHBondContact O-CB 3.34Å; K246-M250 PolarHBondContact O-N 3.27Å
247C88.7Confident89.4Confident58 Ų5895.3 Ų95.339%0.39249%0.489SS..Hα-helixtrans-61.1-46.7174.4-70.90000111.7E243 T244 T249 M250 S251E243-C247 PolarHBondContact O-N 2.78Å; E243-C247 PolarHBondContact O-SG 3.32Å; T244-C247 PolarHBondContact O-N 3.36Å; C247-T249 PolarHBondContact O-N 3.43Å; C247-M250 PolarHBondContact O-N 2.83Å; C247-S251 PolarHBondContact O-N 3.41Å; C247-S251 PolarHBondContact O-OG 2.83Å
248C88.6Confident89.5Confident63 Ų6396 Ų9643%0.42650%0.495SS..Hα-helixtrans-63-40.2179.7-1750000112.4T244 W245 K252T244-C248 WeakPolarHBondContact O-CB 3.32Å; T244-C248 PolarHBondContact O-N 3.04Å; W245-C248 PolarHBondContact O-N 2.84Å; C248-K252 WeakPolarHBondContact O-CG 3.37Å; C248-K252 PolarHBondContact O-N 3.38Å
249T87.7Confident89.6Confident60 Ų6093.4 Ų93.437%0.36849%0.485SS..Hα-helixtrans-69.6-36.8176.4490000112.4W245 K246 C247 K252 L253W245-T249 HydrophobicContact CD2-CG2 4.18Å; W245-T249 HydrophobicContact CE3-CG2 4.37Å; W245-T249 HydrophobicContact CH2-CG2 4.46Å; W245-T249 HydrophobicContact CZ2-CG2 4.28Å; W245-T249 WeakPolarHBondContact O-CB 3.01Å; W245-T249 WeakPolarHBondContact O-CG2 3.33Å; W245-T249 PolarHBondContact O-N 2.8Å; W245-T249 PolarHBondContact O-OG1 2.81Å; K246-T249 WeakPolarHBondContact CA-OG1 3.05Å; K246-T249 PolarHBondContact O-N 2.91Å; K246-T249 PolarHBondContact O-OG1 2.97Å; C247-T249 PolarHBondContact O-N 3.43Å; T249-K252 PolarHBondContact O-N 3.43Å; T249-L253 WeakPolarHBondContact O-CB 3.5Å; T249-L253 PolarHBondContact O-N 2.97Å
250M89.7Confident89.7Confident92 Ų9295.7 Ų95.745%0.45349%0.488SS..Hα-helixtrans-65.9-45.4175.6-170.1164.149.500112.2K246 C247 K252 L253 E254K246-M250 VanDerWaalsContact O-CB 3.29Å; K246-M250 WeakPolarHBondContact O-CB 3.34Å; K246-M250 PolarHBondContact O-N 3.27Å; C247-M250 PolarHBondContact O-N 2.83Å; M250-K252 VanDerWaalsContact C-N 3.33Å; M250-K252 PolarHBondContact O-N 3.44Å; M250-L253 WeakPolarHBondContact O-CB 3.41Å; M250-L253 PolarHBondContact O-N 3.23Å; M250-L253 VanDerWaalsContact O-N 3.08Å; M250-E254 PolarHBondContact O-N 3.43Å
251S87.9Confident89.8Confident72 Ų7297.3 Ų97.350%0.50350%0.496SS..Hα-helixtrans-62-39.5175.6-60.20000112.7C247 L253 E254 E255C247-S251 PolarHBondContact O-N 3.41Å; C247-S251 PolarHBondContact O-OG 2.83Å; S251-L253 VanDerWaalsContact C-N 3.3Å; S251-L253 PolarHBondContact O-N 3.44Å; S251-E254 PolarHBondContact O-N 3.26Å; S251-E255 PolarHBondContact O-N 3.29Å
252K90.1Very high89.9Confident125 Ų12597.1 Ų97.154%0.54350%0.5SS..Hα-helixtrans-64.2-35.1173.6-75.2177.3-179.7178.30112.3C248 T249 M250 K256C248-K252 WeakPolarHBondContact O-CG 3.37Å; C248-K252 PolarHBondContact O-N 3.38Å; T249-K252 PolarHBondContact O-N 3.43Å; M250-K252 VanDerWaalsContact C-N 3.33Å; M250-K252 PolarHBondContact O-N 3.44Å; K252-K256 VanDerWaalsContact O-CG 3.24Å; K252-K256 WeakPolarHBondContact O-CG 3.42Å; K252-K256 PolarHBondContact O-N 2.89Å; K252-K256 VanDerWaalsContact O-N 3.11Å
253L90.1Very high90Very high117 Ų11798.8 Ų98.861%0.61350%0.5SS*.Hα-helixtrans-70.1-41177.3-164.373.8000111.3T249 M250 S251 K256 C257T249-L253 WeakPolarHBondContact O-CB 3.5Å; T249-L253 PolarHBondContact O-N 2.97Å; M250-L253 WeakPolarHBondContact O-CB 3.41Å; M250-L253 PolarHBondContact O-N 3.23Å; M250-L253 VanDerWaalsContact O-N 3.08Å; S251-L253 VanDerWaalsContact C-N 3.3Å; S251-L253 PolarHBondContact O-N 3.44Å; L253-K256 PolarHBondContact O-N 3.45Å; L253-C257 PolarHBondContact O-N 3.42Å
254E90.9Very high90.2Very high118 Ų118100.6 Ų100.655%0.55151%0.508SS*.Hα-helixtrans-62.5-44.1175-73.3174.8171.100112.1M250 S251 K256 C257 L258M250-E254 PolarHBondContact O-N 3.43Å; S251-E254 PolarHBondContact O-N 3.26Å; E254-K256 VanDerWaalsContact C-N 3.31Å; E254-K256 PolarHBondContact O-N 2.92Å; E254-C257 WeakPolarHBondContact O-CB 3.13Å; E254-C257 PolarHBondContact O-N 2.9Å; E254-C257 VanDerWaalsContact O-N 3.17Å; E254-L258 PolarHBondContact O-N 3.38Å
255E89.4Confident90.4Very high115 Ų11599.5 Ų99.554%0.53750%0.504SS..Hα-helixtrans-57.7-44.7173.3-172.1-175.9-179.100111S251 C257 L258 D259S251-E255 PolarHBondContact O-N 3.29Å; E255-C257 VanDerWaalsContact C-N 3.35Å; E255-C257 PolarHBondContact O-N 2.82Å; E255-L258 PolarHBondContact O-N 2.83Å; E255-D259 PolarHBondContact O-N 3.12Å
256K91.1Very high90.5Very high116 Ų11695.4 Ų95.450%0.50450%0.495SS..Hα-helixtrans-66.4-33.5176.6-70.5-73.8151.3-129.70113.1K252 L253 E254 D259 L260K252-K256 VanDerWaalsContact O-CG 3.24Å; K252-K256 WeakPolarHBondContact O-CG 3.42Å; K252-K256 PolarHBondContact O-N 2.89Å; K252-K256 VanDerWaalsContact O-N 3.11Å; L253-K256 PolarHBondContact O-N 3.45Å; E254-K256 VanDerWaalsContact C-N 3.31Å; E254-K256 PolarHBondContact O-N 2.92Å; K256-D259 IonicContact NZ-OD2 3.54Å; K256-D259 PolarHBondContact NZ-OD2 3.34Å; K256-L260 WeakPolarHBondContact O-CB 3.14Å; K256-L260 PolarHBondContact O-N 3.17Å
257C91.1Very high90.6Very high67 Ų6793.6 Ų93.645%0.45349%0.492SS..Hα-helixtrans-66.7-40.9173.1-80.90000112.1L253 E254 E255 L260 Q261L253-C257 PolarHBondContact O-N 3.42Å; E254-C257 WeakPolarHBondContact O-CB 3.13Å; E254-C257 PolarHBondContact O-N 2.9Å; E254-C257 VanDerWaalsContact O-N 3.17Å; E255-C257 VanDerWaalsContact C-N 3.35Å; E255-C257 PolarHBondContact O-N 2.82Å; C257-L260 PolarHBondContact O-N 2.86Å; C257-Q261 PolarHBondContact O-N 3.34Å
258L91.6Very high90.7Very high113 Ų11394.8 Ų94.859%0.59249%0.492SS*.Hα-helixtrans-65.8-42.9175.1-73169.4000111.7E254 E255 L260 Q261 S262E254-L258 PolarHBondContact O-N 3.38Å; E255-L258 PolarHBondContact O-N 2.83Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.35Å; L258-Q261 PolarHBondContact O-N 2.74Å; L258-S262 PolarHBondContact O-N 3.11Å
259D90.5Very high90.9Very high53 Ų5395.3 Ų95.328%0.28349%0.491SS..Hα-helixtrans-54.5-50.3172.7-76.7-18.4000110.4E255 K256 Q261 S262 Y263E255-D259 PolarHBondContact O-N 3.12Å; K256-D259 IonicContact NZ-OD2 3.54Å; K256-D259 PolarHBondContact NZ-OD2 3.34Å; D259-Q261 PolarHBondContact O-N 3.24Å; D259-S262 WeakPolarHBondContact O-CB 3.45Å; D259-S262 PolarHBondContact O-N 2.82Å; D259-S262 VanDerWaalsContact O-N 3.16Å; D259-S262 PolarHBondContact O-OG 3.27Å; D259-Y263 HydrophobicContact CB-CE2 4.27Å; D259-Y263 WeakPolarHBondContact O-CD2 3.1Å; D259-Y263 PolarHBondContact O-N 3.49Å
260L91.4Very high91Very high103 Ų10397.3 Ų97.354%0.53950%0.499SS..Hα-helixtrans-57.7-46178.7-94.6155.4000112.8K256 C257 L258 S262 Y263 E264K256-L260 WeakPolarHBondContact O-CB 3.14Å; K256-L260 PolarHBondContact O-N 3.17Å; C257-L260 PolarHBondContact O-N 2.86Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.35Å; L260-S262 VanDerWaalsContact C-N 3.3Å; L260-S262 PolarHBondContact O-N 2.87Å; L260-Y263 PolarHBondContact O-N 3.46Å; L260-E264 WeakPolarHBondContact O-CG 3.33Å; L260-E264 PolarHBondContact O-N 3.1Å
261Q92Very high91.2Very high123 Ų123100.3 Ų100.358%0.57551%0.505SS*.Hα-helixtrans-62.1-37.6176.5-74.9180-8.600112.3C257 L258 D259 E264 S265C257-Q261 PolarHBondContact O-N 3.34Å; L258-Q261 PolarHBondContact O-N 2.74Å; D259-Q261 PolarHBondContact O-N 3.24Å; Q261-E264 PolarHBondContact O-N 3.2Å; Q261-S265 WeakPolarHBondContact O-CB 3.33Å; Q261-S265 PolarHBondContact O-N 3.45Å
262S91.5Very high91.4Very high65 Ų65104.1 Ų104.146%0.45551%0.508SS..Hα-helixtrans-64.8-40.717683.40000111.8L258 D259 L260 S265 L266L258-S262 PolarHBondContact O-N 3.11Å; D259-S262 WeakPolarHBondContact O-CB 3.45Å; D259-S262 PolarHBondContact O-N 2.82Å; D259-S262 VanDerWaalsContact O-N 3.16Å; D259-S262 PolarHBondContact O-OG 3.27Å; L260-S262 VanDerWaalsContact C-N 3.3Å; L260-S262 PolarHBondContact O-N 2.87Å; S262-S265 PolarHBondContact O-N 2.75Å; S262-L266 WeakPolarHBondContact O-CB 3.21Å; S262-L266 PolarHBondContact O-N 3.32Å
263Y91.7Very high91.4Very high147 Ų147100.7 Ų100.758%0.57650%0.503SS*.Hα-helixtrans-67.7-40.8176.2-72.6-60.3000111.9D259 L260 L266 V267D259-Y263 HydrophobicContact CB-CE2 4.27Å; D259-Y263 WeakPolarHBondContact O-CD2 3.1Å; D259-Y263 PolarHBondContact O-N 3.49Å; L260-Y263 PolarHBondContact O-N 3.46Å; Y263-L266 PolarHBondContact O-N 2.79Å; Y263-V267 VanDerWaalsContact O-CG2 3.29Å; Y263-V267 WeakPolarHBondContact O-CG2 3.4Å; Y263-V267 PolarHBondContact O-N 3.5Å
264E92.7Very high91.4Very high131 Ų131100.4 Ų100.461%0.61250%0.502SS*.Hα-helixtrans-61.5-44.4174.6-75.4-179.6169.100111.7L260 Q261 L266 V267 E268L260-E264 WeakPolarHBondContact O-CG 3.33Å; L260-E264 PolarHBondContact O-N 3.1Å; Q261-E264 PolarHBondContact O-N 3.2Å; E264-L266 VanDerWaalsContact C-N 3.33Å; E264-L266 PolarHBondContact O-N 2.88Å; E264-V267 PolarHBondContact O-N 3.32Å; E264-E268 WeakPolarHBondContact O-CB 3.24Å; E264-E268 PolarHBondContact O-N 2.85Å
265S92.3Very high91.4Very high67 Ų67100 Ų10047%0.46950%0.503SS..Hα-helixtrans-60.7-42.5175-171.80000111.9Q261 S262 E268 N269Q261-S265 WeakPolarHBondContact O-CB 3.33Å; Q261-S265 PolarHBondContact O-N 3.45Å; S262-S265 PolarHBondContact O-N 2.75Å; S265-E268 PolarHBondContact O-N 2.82Å; S265-N269 WeakPolarHBondContact O-CB 3.15Å; S265-N269 PolarHBondContact O-N 3.02Å; S265-N269 PolarHBondContact O-ND2 3.08Å
266L92.5Very high91.5Very high94 Ų94100.6 Ų100.649%0.49251%0.506SS..Hα-helixtrans-63.4-44.9176.4-178.463.6000111.9S262 Y263 E264 E268 N269 L270S262-L266 WeakPolarHBondContact O-CB 3.21Å; S262-L266 PolarHBondContact O-N 3.32Å; Y263-L266 PolarHBondContact O-N 2.79Å; E264-L266 VanDerWaalsContact C-N 3.33Å; E264-L266 PolarHBondContact O-N 2.88Å; L266-E268 VanDerWaalsContact C-N 3.31Å; L266-E268 PolarHBondContact O-N 3.42Å; L266-N269 PolarHBondContact O-N 3.45Å; L266-L270 HydrophobicContact CG-CD1 4.23Å; L266-L270 WeakPolarHBondContact O-CB 3.13Å; L266-L270 WeakPolarHBondContact O-CG 3.47Å; L266-L270 PolarHBondContact O-N 3.11Å
267V90.7Very high91.4Very high66 Ų6699.7 Ų99.740%0.451%0.506SS..Hα-helixtrans-60.7-41.8176.6169.20000110.8Y263 E264 L270 R271Y263-V267 VanDerWaalsContact O-CG2 3.29Å; Y263-V267 WeakPolarHBondContact O-CG2 3.4Å; Y263-V267 PolarHBondContact O-N 3.5Å; E264-V267 PolarHBondContact O-N 3.32Å; V267-L270 PolarHBondContact O-N 3.4Å; V267-R271 WeakPolarHBondContact O-CG 3.37Å; V267-R271 PolarHBondContact O-N 3.47Å
268E91.7Very high91.4Very high83 Ų83101.5 Ų101.539%0.38851%0.508SS..Hα-helixtrans-70.6-36.2179.9-164.754.8-145.200112.6E264 S265 L266 R271 R272E264-E268 WeakPolarHBondContact O-CB 3.24Å; E264-E268 PolarHBondContact O-N 2.85Å; S265-E268 PolarHBondContact O-N 2.82Å; L266-E268 VanDerWaalsContact C-N 3.31Å; L266-E268 PolarHBondContact O-N 3.42Å; E268-R271 PolarHBondContact O-N 2.87Å; E268-R271 IonicContact OE2-NH1 2.76Å; E268-R271 PolarHBondContact OE2-NH1 3.5Å; E268-R271 VanDerWaalsContact OE2-NH1 3.09Å; E268-R272 PolarHBondContact O-N 2.94Å
269N91.7Very high91.3Very high74 Ų74101.3 Ų101.340%0.39651%0.506SS..Hα-helixtrans-63.9-42171.3-70.7-26.7000111.6S265 L266 R272 A273S265-N269 WeakPolarHBondContact O-CB 3.15Å; S265-N269 PolarHBondContact O-N 3.02Å; S265-N269 PolarHBondContact O-ND2 3.08Å; L266-N269 PolarHBondContact O-N 3.45Å; N269-R272 PolarHBondContact O-N 2.96Å; N269-R272 PolarHBondContact OD1-NH2 3.02Å; N269-A273 WeakPolarHBondContact O-CB 3.46Å; N269-A273 PolarHBondContact O-N 2.81Å
270L91.5Very high91.2Very high103 Ų103103 Ų10354%0.53951%0.514SS..Hα-helixtrans-64.9-39.1175.8-74.8170.5000112L266 V267 A273 N274L266-L270 HydrophobicContact CG-CD1 4.23Å; L266-L270 WeakPolarHBondContact O-CB 3.13Å; L266-L270 WeakPolarHBondContact O-CG 3.47Å; L266-L270 PolarHBondContact O-N 3.11Å; V267-L270 PolarHBondContact O-N 3.4Å; L270-A273 PolarHBondContact O-N 3.27Å; L270-N274 WeakPolarHBondContact O-CB 3.49Å; L270-N274 PolarHBondContact O-N 2.83Å
271R92.6Very high91Very high154 Ų154103.7 Ų103.758%0.58152%0.516SS*.Hα-helixtrans-60.3-47.3173.1-78.5-177.5-176.5140.7-0.7111.8V267 E268 N274 L275V267-R271 WeakPolarHBondContact O-CG 3.37Å; V267-R271 PolarHBondContact O-N 3.47Å; E268-R271 PolarHBondContact O-N 2.87Å; E268-R271 IonicContact OE2-NH1 2.76Å; E268-R271 PolarHBondContact OE2-NH1 3.5Å; E268-R271 VanDerWaalsContact OE2-NH1 3.09Å; R271-N274 PolarHBondContact O-N 2.99Å; R271-L275 PolarHBondContact O-N 3.39Å
272R91.7Very high90.9Very high153 Ų153102.7 Ų102.758%0.57751%0.512SS*.Hα-helixtrans-60.8-45.9176.7-79.5-172.9-82.6164.5-5.8112.2E268 N269 N274 L275 E276E268-R272 PolarHBondContact O-N 2.94Å; N269-R272 PolarHBondContact O-N 2.96Å; N269-R272 PolarHBondContact OD1-NH2 3.02Å; R272-N274 PolarHBondContact O-N 2.95Å; R272-L275 PolarHBondContact O-N 2.81Å; R272-E276 PolarHBondContact O-N 2.79Å
273A90.4Very high90.8Very high52 Ų52102.8 Ų102.843%0.4351%0.509SS..Hα-helixtrans-62.9-40.1178.100000112.7N269 L270 E276 L277N269-A273 WeakPolarHBondContact O-CB 3.46Å; N269-A273 PolarHBondContact O-N 2.81Å; L270-A273 PolarHBondContact O-N 3.27Å; A273-E276 PolarHBondContact O-N 3.42Å; A273-L277 WeakPolarHBondContact O-CB 3.35Å; A273-L277 PolarHBondContact O-N 3.08Å
274N89.4Confident90.6Very high111 Ų111100.4 Ų100.459%0.59451%0.51SS*.Hα-helixtrans-64.5-41.1175-101.9-10.9000112.2L270 R271 R272 L277 Q278L270-N274 WeakPolarHBondContact O-CB 3.49Å; L270-N274 PolarHBondContact O-N 2.83Å; R271-N274 PolarHBondContact O-N 2.99Å; R272-N274 PolarHBondContact O-N 2.95Å; N274-L277 PolarHBondContact O-N 3.24Å; N274-Q278 WeakPolarHBondContact O-CB 3.45Å; N274-Q278 PolarHBondContact O-N 3.35Å
275L92.4Very high90.3Very high111 Ų11197.8 Ų97.858%0.58151%0.506SS*.Hα-helixtrans-65.7-41.3178.7-148.9116.9000111.3R271 R272 Q278 M279R271-L275 PolarHBondContact O-N 3.39Å; R272-L275 PolarHBondContact O-N 2.81Å; L275-Q278 PolarHBondContact O-N 3.1Å; L275-M279 WeakPolarHBondContact O-CG 3.46Å; L275-M279 PolarHBondContact O-N 2.88Å
276E91.1Very high90Very high126 Ų12699.7 Ų99.759%0.58951%0.511SS*.Hα-helixtrans-63.9-42.5174.8-173.9175-174.900111.9R272 A273 Q278 M279 N280R272-E276 PolarHBondContact O-N 2.79Å; A273-E276 PolarHBondContact O-N 3.42Å; E276-Q278 VanDerWaalsContact C-N 3.34Å; E276-Q278 PolarHBondContact O-N 3.24Å; E276-M279 PolarHBondContact O-N 2.91Å; E276-N280 WeakPolarHBondContact O-CB 3.33Å; E276-N280 VanDerWaalsContact O-CG 3.29Å; E276-N280 PolarHBondContact O-N 3.25Å; E276-N280 PolarHBondContact O-ND2 3.11Å
277L89.9Confident89.8Confident98 Ų98102 Ų10251%0.51352%0.517SS..Hα-helixtrans-62.1-42.4175-174.766.8000111.6A273 N274 N280 M281A273-L277 WeakPolarHBondContact O-CB 3.35Å; A273-L277 PolarHBondContact O-N 3.08Å; N274-L277 PolarHBondContact O-N 3.24Å; L277-N280 PolarHBondContact O-N 2.98Å; L277-M281 WeakPolarHBondContact O-CG 3.44Å; L277-M281 PolarHBondContact O-N 3.3Å
278Q89.8Confident89.7Confident104 Ų104105.5 Ų105.549%0.48652%0.524SS..Hα-helixtrans-61.5-47.3176.7-174.3178.6-13.400111.5N274 L275 E276 N280 M281 E282N274-Q278 WeakPolarHBondContact O-CB 3.45Å; N274-Q278 PolarHBondContact O-N 3.35Å; L275-Q278 PolarHBondContact O-N 3.1Å; E276-Q278 VanDerWaalsContact C-N 3.34Å; E276-Q278 PolarHBondContact O-N 3.24Å; Q278-N280 VanDerWaalsContact C-N 3.32Å; Q278-N280 PolarHBondContact O-N 3.39Å; Q278-M281 PolarHBondContact O-N 2.79Å; Q278-E282 PolarHBondContact NE2-OE1 3.28Å; Q278-E282 WeakPolarHBondContact O-CG 3.47Å; Q278-E282 PolarHBondContact O-N 3.08Å
279M88.8Confident89.5Confident110 Ų110108.5 Ų108.554%0.54254%0.536SS..Hα-helixtrans-60.5-40.4176-74.9-175.362.200112.5L275 E276 E282 T283L275-M279 WeakPolarHBondContact O-CG 3.46Å; L275-M279 PolarHBondContact O-N 2.88Å; E276-M279 PolarHBondContact O-N 2.91Å; M279-E282 PolarHBondContact O-N 3.34Å; M279-T283 WeakPolarHBondContact O-CB 3.2Å; M279-T283 PolarHBondContact O-N 3.46Å; M279-T283 PolarHBondContact O-OG1 3.32Å
280N89.1Confident89.4Confident88 Ų88110 Ų11047%0.47154%0.543SS..Hα-helixtrans-65.1-42.4177-75.7-30.9000111.7E276 L277 Q278 T283 V284E276-N280 WeakPolarHBondContact O-CB 3.33Å; E276-N280 VanDerWaalsContact O-CG 3.29Å; E276-N280 PolarHBondContact O-N 3.25Å; E276-N280 PolarHBondContact O-ND2 3.11Å; L277-N280 PolarHBondContact O-N 2.98Å; Q278-N280 VanDerWaalsContact C-N 3.32Å; Q278-N280 PolarHBondContact O-N 3.39Å; N280-T283 PolarHBondContact O-N 3.31Å; N280-V284 WeakPolarHBondContact O-CG2 3.39Å; N280-V284 PolarHBondContact O-N 3.25Å
281M88.6Confident89.2Confident117 Ų117109.7 Ų109.758%0.57654%0.539SS*.Hα-helixtrans-63.8-43.2175.3-73.5-164.6-57.600112.3L277 Q278 T283 V284 S285L277-M281 WeakPolarHBondContact O-CG 3.44Å; L277-M281 PolarHBondContact O-N 3.3Å; Q278-M281 PolarHBondContact O-N 2.79Å; M281-T283 VanDerWaalsContact C-N 3.32Å; M281-T283 PolarHBondContact O-N 2.92Å; M281-V284 PolarHBondContact O-N 2.94Å; M281-S285 WeakPolarHBondContact O-CB 3.25Å; M281-S285 PolarHBondContact O-N 2.76Å
282E89.8Confident88.9Confident103 Ų103106.1 Ų106.148%0.48153%0.531SS..Hα-helixtrans-61.3-41.7175.6-75.3175.2-166.500111.4Q278 M279 S285 L286Q278-E282 PolarHBondContact NE2-OE1 3.28Å; Q278-E282 WeakPolarHBondContact O-CG 3.47Å; Q278-E282 PolarHBondContact O-N 3.08Å; M279-E282 PolarHBondContact O-N 3.34Å; E282-S285 PolarHBondContact O-N 3.13Å; E282-L286 PolarHBondContact O-N 2.84Å
283T89.3Confident88.7Confident66 Ų66101.4 Ų101.441%0.40553%0.525SS..Hα-helixtrans-63.8-42.5176.6-55.60000112M279 N280 M281 L286 K287M279-T283 WeakPolarHBondContact O-CB 3.2Å; M279-T283 PolarHBondContact O-N 3.46Å; M279-T283 PolarHBondContact O-OG1 3.32Å; N280-T283 PolarHBondContact O-N 3.31Å; M281-T283 VanDerWaalsContact C-N 3.32Å; M281-T283 PolarHBondContact O-N 2.92Å; T283-L286 PolarHBondContact O-N 2.87Å; T283-K287 WeakPolarHBondContact O-CG 3.42Å; T283-K287 PolarHBondContact O-N 3.49Å
284V86.1Confident88.5Confident97 Ų97103 Ų10359%0.58853%0.529SS*.Hα-helixtrans-65.9-41.2175.6171.50000110.8N280 M281 L286 K287 Y288N280-V284 WeakPolarHBondContact O-CG2 3.39Å; N280-V284 PolarHBondContact O-N 3.25Å; M281-V284 PolarHBondContact O-N 2.94Å; V284-L286 PolarHBondContact O-N 3.47Å; V284-K287 PolarHBondContact O-N 2.86Å; V284-Y288 WeakPolarHBondContact O-CB 3.14Å; V284-Y288 PolarHBondContact O-N 3.48Å
285S86.7Confident88.3Confident77 Ų77105.4 Ų105.454%0.53853%0.53SS..Hα-helixtrans-64.1-38.7177.6-170.90000112.3M281 E282 K289M281-S285 WeakPolarHBondContact O-CB 3.25Å; M281-S285 PolarHBondContact O-N 2.76Å; E282-S285 PolarHBondContact O-N 3.13Å; S285-K289 WeakPolarHBondContact O-CB 3.25Å; S285-K289 PolarHBondContact O-N 3.44Å
286L86.9Confident88.1Confident107 Ų107106.2 Ų106.256%0.5653%0.531SS*.Hα-helixtrans-64.5-47.9174.3-82160000111.2E282 T283 V284 Y288 K289 D290E282-L286 PolarHBondContact O-N 2.84Å; T283-L286 PolarHBondContact O-N 2.87Å; V284-L286 PolarHBondContact O-N 3.47Å; L286-Y288 VanDerWaalsContact C-N 3.32Å; L286-Y288 PolarHBondContact O-N 3.31Å; L286-K289 WeakPolarHBondContact O-CB 3.34Å; L286-K289 PolarHBondContact O-N 3.02Å; L286-K289 VanDerWaalsContact O-N 3.16Å; L286-D290 PolarHBondContact O-N 3.27Å
287K88.1Confident88.1Confident143 Ų143106.6 Ų106.662%0.62253%0.531SS*.Hα-helixtrans-59.4-41.8176.1-74.1-178.9179.1-1780112.6T283 V284 K289 D290 E291T283-K287 WeakPolarHBondContact O-CG 3.42Å; T283-K287 PolarHBondContact O-N 3.49Å; V284-K287 PolarHBondContact O-N 2.86Å; K287-K289 VanDerWaalsContact C-N 3.34Å; K287-D290 PolarHBondContact O-N 2.94Å; K287-E291 WeakPolarHBondContact O-CB 3.44Å; K287-E291 PolarHBondContact O-N 3.17Å
288Y87.3Confident87.8Confident139 Ų139105.8 Ų105.855%0.54553%0.526SS..Hα-helixtrans-65.1-38.8177.3-177.6-107.8000112V284 L286 E291 L292V284-Y288 WeakPolarHBondContact O-CB 3.14Å; V284-Y288 PolarHBondContact O-N 3.48Å; L286-Y288 VanDerWaalsContact C-N 3.32Å; L286-Y288 PolarHBondContact O-N 3.31Å; Y288-E291 PolarHBondContact O-N 2.88Å; Y288-L292 HydrophobicContact CD1-CD1 3.84Å; Y288-L292 HydrophobicContact CD1-CG 4.49Å; Y288-L292 HydrophobicContact CE1-CD1 3.34Å; Y288-L292 HydrophobicContact CE1-CG 4.09Å; Y288-L292 WeakPolarHBondContact O-CB 3.41Å; Y288-L292 WeakPolarHBondContact O-CG 3.46Å; Y288-L292 PolarHBondContact O-N 3.03Å
289K89.3Confident87.6Confident146 Ų146104.2 Ų104.264%0.63553%0.527SS*.Hα-helixtrans-64.8-41.7175.2-169.5179179.5-177.90111.9S285 L286 K287 L292 A293S285-K289 WeakPolarHBondContact O-CB 3.25Å; S285-K289 PolarHBondContact O-N 3.44Å; L286-K289 WeakPolarHBondContact O-CB 3.34Å; L286-K289 PolarHBondContact O-N 3.02Å; L286-K289 VanDerWaalsContact O-N 3.16Å; K287-K289 VanDerWaalsContact C-N 3.34Å; K289-L292 PolarHBondContact O-N 2.72Å; K289-A293 PolarHBondContact O-N 2.95Å
290D89.3Confident87.5Confident104 Ų104105.1 Ų105.156%0.55653%0.53SS*.Hα-helixtrans-65.8-40.9175.8-68.6-19.4000111.6L286 K287 A293 V294L286-D290 PolarHBondContact O-N 3.27Å; K287-D290 PolarHBondContact O-N 2.94Å; D290-A293 PolarHBondContact O-N 2.97Å; D290-V294 WeakPolarHBondContact O-CG2 3.35Å; D290-V294 PolarHBondContact O-N 3.45Å
291E86.3Confident87.4Confident97 Ų97105.8 Ų105.845%0.45353%0.53SS..Hα-helixtrans-64.3-41.5176.2-165.9-175.5159.100111.8K287 Y288 V294 R295K287-E291 WeakPolarHBondContact O-CB 3.44Å; K287-E291 PolarHBondContact O-N 3.17Å; Y288-E291 PolarHBondContact O-N 2.88Å; E291-V294 PolarHBondContact O-N 3.42Å; E291-R295 WeakPolarHBondContact O-CG 3.45Å; E291-R295 PolarHBondContact O-N 3.25Å; E291-R295 IonicContact OE1-CZ 3.79Å; E291-R295 IonicContact OE1-NE 3.66Å; E291-R295 PolarHBondContact OE1-NE 3.28Å; E291-R295 IonicContact OE1-NH2 2.8Å; E291-R295 PolarHBondContact OE1-NH2 2.68Å
292L86.1Confident87.3Confident80 Ų80106.9 Ų106.942%0.41953%0.532SS..Hα-helixtrans-60.5-45173.7-82.7173.2000111.9Y288 K289 V294 R295 E296Y288-L292 HydrophobicContact CD1-CD1 3.84Å; Y288-L292 HydrophobicContact CD1-CG 4.49Å; Y288-L292 HydrophobicContact CE1-CD1 3.34Å; Y288-L292 HydrophobicContact CE1-CG 4.09Å; Y288-L292 WeakPolarHBondContact O-CB 3.41Å; Y288-L292 WeakPolarHBondContact O-CG 3.46Å; Y288-L292 PolarHBondContact O-N 3.03Å; K289-L292 PolarHBondContact O-N 2.72Å; L292-V294 VanDerWaalsContact C-N 3.3Å; L292-V294 PolarHBondContact O-N 3.21Å; L292-R295 PolarHBondContact O-N 3.41Å; L292-E296 WeakPolarHBondContact O-CB 3.4Å; L292-E296 PolarHBondContact O-N 3.33Å
293A87.6Confident87Confident53 Ų53105 Ų10544%0.43853%0.53SS..Hα-helixtrans-61.8-37.5177.600000112.3K289 D290 K297K289-A293 PolarHBondContact O-N 2.95Å; D290-A293 PolarHBondContact O-N 2.97Å; A293-K297 WeakPolarHBondContact O-CB 3.36Å; A293-K297 PolarHBondContact O-N 2.83Å
294V87.5Confident86.8Confident87 Ų87104 Ų10453%0.52753%0.528SS..Hα-helixtrans-67.8-42.2174.9173.10000111.4D290 E291 L292 K297 L298D290-V294 WeakPolarHBondContact O-CG2 3.35Å; D290-V294 PolarHBondContact O-N 3.45Å; E291-V294 PolarHBondContact O-N 3.42Å; L292-V294 VanDerWaalsContact C-N 3.3Å; L292-V294 PolarHBondContact O-N 3.21Å; V294-K297 PolarHBondContact O-N 3.23Å; V294-L298 HydrophobicContact CG1-CD1 4.1Å; V294-L298 WeakPolarHBondContact O-CB 3.44Å; V294-L298 PolarHBondContact O-N 3.1Å
295R85.5Confident86.7Confident160 Ų160103.7 Ų103.760%0.60452%0.522SS*.Hα-helixtrans-64.7-39.8176.6-73.2-178.8-174.8-148.84.9112.2E291 L292 L298 S299E291-R295 WeakPolarHBondContact O-CG 3.45Å; E291-R295 PolarHBondContact O-N 3.25Å; E291-R295 IonicContact OE1-CZ 3.79Å; E291-R295 IonicContact OE1-NE 3.66Å; E291-R295 PolarHBondContact OE1-NE 3.28Å; E291-R295 IonicContact OE1-NH2 2.8Å; E291-R295 PolarHBondContact OE1-NH2 2.68Å; L292-R295 PolarHBondContact O-N 3.41Å; R295-L298 PolarHBondContact O-N 3.05Å; R295-S299 WeakPolarHBondContact O-CB 3.42Å; R295-S299 PolarHBondContact O-N 2.95Å
296E88.1Confident86.7Confident128 Ų128107.2 Ų107.260%0.59853%0.528SS*.Hα-helixtrans-64.3-46.8176.9-167.3167.3-155.100110.8L292 L298 S299 E300L292-E296 WeakPolarHBondContact O-CB 3.4Å; L292-E296 PolarHBondContact O-N 3.33Å; E296-L298 VanDerWaalsContact C-N 3.33Å; E296-L298 PolarHBondContact O-N 3.35Å; E296-S299 WeakPolarHBondContact O-CB 3.44Å; E296-S299 PolarHBondContact O-N 3.42Å; E296-S299 VanDerWaalsContact O-N 3.08Å; E296-E300 PolarHBondContact O-N 2.8Å
297K89.3Confident86.5Confident135 Ų135108.6 Ų108.659%0.58753%0.532SS*.Hα-helixtrans-61-38.3174.6-168.7174.7-176176.60113.1A293 V294 Q301A293-K297 WeakPolarHBondContact O-CB 3.36Å; A293-K297 PolarHBondContact O-N 2.83Å; V294-K297 PolarHBondContact O-N 3.23Å; K297-Q301 WeakPolarHBondContact O-CG 3.35Å; K297-Q301 PolarHBondContact O-N 3.45Å; K297-Q301 VanDerWaalsContact O-N 3.08Å
298L85Confident86.3Confident81 Ų81108 Ų10842%0.42453%0.531SS..Hα-helixtrans-65.7-41.7172.9-88.3161.1000111.6V294 R295 E296 Q301 F302V294-L298 HydrophobicContact CG1-CD1 4.1Å; V294-L298 WeakPolarHBondContact O-CB 3.44Å; V294-L298 PolarHBondContact O-N 3.1Å; R295-L298 PolarHBondContact O-N 3.05Å; E296-L298 VanDerWaalsContact C-N 3.33Å; E296-L298 PolarHBondContact O-N 3.35Å; L298-Q301 PolarHBondContact O-N 3.37Å; L298-F302 HydrophobicContact CD2-CE2 4.45Å; L298-F302 VanDerWaalsContact O-CD2 3.27Å; L298-F302 WeakPolarHBondContact O-CD2 3.2Å; L298-F302 PolarHBondContact O-N 3.46Å
299S85.6Confident86Confident70 Ų70104.3 Ų104.349%0.4953%0.525SS..Hα-helixtrans-61.9-41.7176.9-171.90000112.1R295 E296 F302 S303R295-S299 WeakPolarHBondContact O-CB 3.42Å; R295-S299 PolarHBondContact O-N 2.95Å; E296-S299 WeakPolarHBondContact O-CB 3.44Å; E296-S299 PolarHBondContact O-N 3.42Å; E296-S299 VanDerWaalsContact O-N 3.08Å; S299-F302 PolarHBondContact O-N 3.43Å; S299-S303 WeakPolarHBondContact O-CB 3.45Å; S299-S303 PolarHBondContact O-N 3.42Å; S299-S303 PolarHBondContact O-OG 3.2Å
300E86.7Confident85.7Confident129 Ų12999.9 Ų99.960%0.60351%0.51SS*.Hα-helixtrans-61.8-44.8172.8-72.1179.6170.400111.7E296 S303 A304E296-E300 PolarHBondContact O-N 2.8Å; E300-S303 PolarHBondContact O-N 3.43Å; E300-A304 PolarHBondContact O-N 2.84Å
301Q87.3Confident85.4Confident103 Ų10398.3 Ų98.348%0.48150%0.504SS..Hα-helixtrans-62.9-42.9175.8-74.5-178.8-4.300112.3K297 L298 S303 A304 I305K297-Q301 WeakPolarHBondContact O-CG 3.35Å; K297-Q301 PolarHBondContact O-N 3.45Å; K297-Q301 VanDerWaalsContact O-N 3.08Å; L298-Q301 PolarHBondContact O-N 3.37Å; Q301-S303 VanDerWaalsContact C-N 3.32Å; Q301-S303 PolarHBondContact O-N 2.85Å; Q301-A304 PolarHBondContact O-N 3.31Å; Q301-I305 WeakPolarHBondContact O-CB 3.37Å; Q301-I305 VanDerWaalsContact O-CG1 3.27Å; Q301-I305 WeakPolarHBondContact O-CG1 3.43Å; Q301-I305 PolarHBondContact O-N 2.9Å
302F84.6Confident85.2Confident139 Ų13999.1 Ų99.161%0.6151%0.511SS*.Hα-helixtrans-62.5-39.4174.9-90.5-69.6000112L298 S299 I305 K306L298-F302 HydrophobicContact CD2-CE2 4.45Å; L298-F302 VanDerWaalsContact O-CD2 3.27Å; L298-F302 WeakPolarHBondContact O-CD2 3.2Å; L298-F302 PolarHBondContact O-N 3.46Å; S299-F302 PolarHBondContact O-N 3.43Å; F302-I305 PolarHBondContact O-N 3.48Å; F302-K306 WeakPolarHBondContact O-CB 3.25Å; F302-K306 PolarHBondContact O-N 3.16Å
303S84.5Confident85Confident64 Ų64101.2 Ų101.245%0.44852%0.519SS..Hα-helixtrans-65.6-41.4176.2-60.50000111.6S299 E300 Q301 K306 Q307S299-S303 WeakPolarHBondContact O-CB 3.45Å; S299-S303 PolarHBondContact O-N 3.42Å; S299-S303 PolarHBondContact O-OG 3.2Å; E300-S303 PolarHBondContact O-N 3.43Å; Q301-S303 VanDerWaalsContact C-N 3.32Å; Q301-S303 PolarHBondContact O-N 2.85Å; S303-K306 PolarHBondContact O-N 3.4Å; S303-Q307 PolarHBondContact O-N 3.24Å
304A85.4Confident84.8Confident45 Ų45103 Ų10337%0.37252%0.521SS..Hα-helixtrans-64.8-42.8174.600000112.3E300 Q301 Q307 Q308E300-A304 PolarHBondContact O-N 2.84Å; Q301-A304 PolarHBondContact O-N 3.31Å; A304-Q307 PolarHBondContact O-N 2.87Å; A304-Q308 WeakPolarHBondContact O-CG 3.36Å; A304-Q308 PolarHBondContact O-N 3.43Å
305I83.7Confident84.7Confident90 Ų90105 Ų10546%0.46252%0.522SS..Hα-helixtrans-62.9-43.9174.9-69.7166.3000110.2Q301 F302 Q307 Q308 C309Q301-I305 WeakPolarHBondContact O-CB 3.37Å; Q301-I305 VanDerWaalsContact O-CG1 3.27Å; Q301-I305 WeakPolarHBondContact O-CG1 3.43Å; Q301-I305 PolarHBondContact O-N 2.9Å; F302-I305 PolarHBondContact O-N 3.48Å; I305-Q307 PolarHBondContact O-N 3.04Å; I305-Q308 WeakPolarHBondContact O-CB 3.32Å; I305-Q308 PolarHBondContact O-N 3.05Å; I305-Q308 VanDerWaalsContact O-N 3.11Å; I305-C309 PolarHBondContact O-N 3.02Å; I305-C309 PolarHBondContact O-SG 3.21Å; I305-C309 VanDerWaalsContact O-SG 3.4Å
306K85.8Confident84.4Confident152 Ų15299.6 Ų99.666%0.66151%0.512SS*.Hα-helixtrans-60.4-44.3177.9-169.3176.8-179.1-176.90111.5F302 S303 Q308 C309 T310F302-K306 WeakPolarHBondContact O-CB 3.25Å; F302-K306 PolarHBondContact O-N 3.16Å; S303-K306 PolarHBondContact O-N 3.4Å; K306-Q308 VanDerWaalsContact C-N 3.33Å; K306-Q308 PolarHBondContact O-N 3.45Å; K306-C309 PolarHBondContact O-N 3.49Å; K306-T310 WeakPolarHBondContact O-CG2 3.36Å; K306-T310 PolarHBondContact O-N 3.45Å; K306-T310 PolarHBondContact O-OG1 2.91Å
307Q84Confident84.1Confident136 Ų13699.8 Ų99.864%0.63651%0.513SS*.Hα-helixtrans-63.4-35.5173.8-76.1-178-10.400113.1S303 A304 I305 T310 T311S303-Q307 PolarHBondContact O-N 3.24Å; A304-Q307 PolarHBondContact O-N 2.87Å; I305-Q307 PolarHBondContact O-N 3.04Å; Q307-T310 WeakPolarHBondContact CA-OG1 3.28Å; Q307-T310 PolarHBondContact O-OG1 3.34Å; Q307-T311 WeakPolarHBondContact O-CB 3.38Å; Q307-T311 PolarHBondContact O-N 3.11Å; Q307-T311 PolarHBondContact O-OG1 2.98Å
308Q84.1Confident83.8Confident129 Ų12999.7 Ų99.760%0.60351%0.512SS*.Hα-helixtrans-68.4-40174.4-74.41790.100111.9A304 I305 K306 T311 L312A304-Q308 WeakPolarHBondContact O-CG 3.36Å; A304-Q308 PolarHBondContact O-N 3.43Å; I305-Q308 WeakPolarHBondContact O-CB 3.32Å; I305-Q308 PolarHBondContact O-N 3.05Å; I305-Q308 VanDerWaalsContact O-N 3.11Å; K306-Q308 VanDerWaalsContact C-N 3.33Å; K306-Q308 PolarHBondContact O-N 3.45Å; Q308-T311 PolarHBondContact O-N 3.38Å; Q308-L312 WeakPolarHBondContact O-CB 3.36Å; Q308-L312 WeakPolarHBondContact O-CG 3.42Å; Q308-L312 PolarHBondContact O-N 2.95Å
309C81.2Confident83.7Confident62 Ų62101.3 Ų101.342%0.41952%0.521SS..Hα-helixtrans-61.5-50.1174.4-72.10000111.4I305 K306 T311 L312 E313I305-C309 PolarHBondContact O-N 3.02Å; I305-C309 PolarHBondContact O-SG 3.21Å; I305-C309 VanDerWaalsContact O-SG 3.4Å; K306-C309 PolarHBondContact O-N 3.49Å; C309-T311 VanDerWaalsContact C-N 3.28Å; C309-T311 PolarHBondContact O-N 3Å; C309-L312 WeakPolarHBondContact O-CB 3.48Å; C309-L312 PolarHBondContact O-N 3.02Å; C309-E313 WeakPolarHBondContact O-CG 3.36Å; C309-E313 PolarHBondContact O-N 3.43Å
310T82.6Confident83.5Confident53 Ų53104.3 Ų104.333%0.32553%0.529SS..Hα-helixtrans-61.8-38.1177.557.70000111.5K306 Q307 L312 E313 L314K306-T310 WeakPolarHBondContact O-CG2 3.36Å; K306-T310 PolarHBondContact O-N 3.45Å; K306-T310 PolarHBondContact O-OG1 2.91Å; Q307-T310 WeakPolarHBondContact CA-OG1 3.28Å; Q307-T310 PolarHBondContact O-OG1 3.34Å; T310-L312 VanDerWaalsContact C-N 3.33Å; T310-L312 PolarHBondContact O-N 2.97Å; T310-E313 PolarHBondContact O-N 3.42Å; T310-L314 WeakPolarHBondContact O-CB 3.3Å; T310-L314 PolarHBondContact O-N 3.31Å
311T83.1Confident83.2Confident71 Ų71104 Ų10444%0.43653%0.527SS..Hα-helixtrans-64.9-35.2174.4-57.80000112.6Q307 Q308 C309 K315Q307-T311 WeakPolarHBondContact O-CB 3.38Å; Q307-T311 PolarHBondContact O-N 3.11Å; Q307-T311 PolarHBondContact O-OG1 2.98Å; Q308-T311 PolarHBondContact O-N 3.38Å; C309-T311 VanDerWaalsContact C-N 3.28Å; C309-T311 PolarHBondContact O-N 3Å; T311-K315 HydrophobicContact CG2-CD 4.48Å; T311-K315 WeakPolarHBondContact O-CB 3.33Å; T311-K315 VanDerWaalsContact O-CG 3.29Å; T311-K315 WeakPolarHBondContact O-CG 3.32Å; T311-K315 PolarHBondContact O-N 3.19Å; T311-K315 VanDerWaalsContact O-N 3.12Å
312L81Confident82.8Confident114 Ų114101.1 Ų101.160%0.59752%0.521SS*.Hα-helixtrans-72.9-39.4176.2-78.3169.4000111.8Q308 C309 T310 K315 A316Q308-L312 WeakPolarHBondContact O-CB 3.36Å; Q308-L312 WeakPolarHBondContact O-CG 3.42Å; Q308-L312 PolarHBondContact O-N 2.95Å; C309-L312 WeakPolarHBondContact O-CB 3.48Å; C309-L312 PolarHBondContact O-N 3.02Å; T310-L312 VanDerWaalsContact C-N 3.33Å; T310-L312 PolarHBondContact O-N 2.97Å; L312-K315 PolarHBondContact O-N 2.93Å; L312-A316 WeakPolarHBondContact O-CB 3.5Å; L312-A316 PolarHBondContact O-N 3.12Å
313E81.9Confident82.4Confident124 Ų12498.7 Ų98.758%0.57951%0.514SS*.Hα-helixtrans-59.9-49.7173.8-74.3167.916900110.7C309 T310 K315 A316 E317C309-E313 WeakPolarHBondContact O-CG 3.36Å; C309-E313 PolarHBondContact O-N 3.43Å; T310-E313 PolarHBondContact O-N 3.42Å; E313-K315 VanDerWaalsContact C-N 3.26Å; E313-K315 PolarHBondContact O-N 3.31Å; E313-A316 WeakPolarHBondContact O-CA 3.37Å; E313-A316 WeakPolarHBondContact O-CB 3.37Å; E313-A316 PolarHBondContact O-N 3.01Å; E313-E317 PolarHBondContact O-N 3.29Å
314L83.9Confident82.3Confident92 Ų92101 Ų10148%0.48252%0.521SS..Hα-helixtrans-61.9-32.9176.8-126.5151.5000112.7T310 K318T310-L314 WeakPolarHBondContact O-CB 3.3Å; T310-L314 PolarHBondContact O-N 3.31Å; L314-K318 WeakPolarHBondContact O-CG 3.45Å; L314-K318 PolarHBondContact O-N 3.37Å
315K84.5Confident82Confident128 Ų128103 Ų10356%0.55752%0.524SS*.Hα-helixtrans-72-38172.6-79.2176-178.5177.40111.9T311 L312 E313 L319T311-K315 HydrophobicContact CG2-CD 4.48Å; T311-K315 WeakPolarHBondContact O-CB 3.33Å; T311-K315 VanDerWaalsContact O-CG 3.29Å; T311-K315 WeakPolarHBondContact O-CG 3.32Å; T311-K315 PolarHBondContact O-N 3.19Å; T311-K315 VanDerWaalsContact O-N 3.12Å; L312-K315 PolarHBondContact O-N 2.93Å; E313-K315 VanDerWaalsContact C-N 3.26Å; E313-K315 PolarHBondContact O-N 3.31Å; K315-L319 WeakPolarHBondContact O-CB 3.46Å; K315-L319 PolarHBondContact O-N 3.22Å; K315-L319 VanDerWaalsContact O-N 3.1Å
316A80.7Confident81.5Confident46 Ų46103.6 Ų103.638%0.3853%0.528SS..Hα-helixtrans-68-42.3178.300000111.5L312 E313 L319 M320L312-A316 WeakPolarHBondContact O-CB 3.5Å; L312-A316 PolarHBondContact O-N 3.12Å; E313-A316 WeakPolarHBondContact O-CA 3.37Å; E313-A316 WeakPolarHBondContact O-CB 3.37Å; E313-A316 PolarHBondContact O-N 3.01Å; A316-L319 CarbonylContact O-C 3.59Å; A316-L319 WeakPolarHBondContact O-CA 3.29Å; A316-L319 WeakPolarHBondContact O-CB 3.41Å; A316-L319 PolarHBondContact O-N 3.13Å; A316-L319 VanDerWaalsContact O-N 3.12Å; A316-M320 WeakPolarHBondContact O-CG 3.49Å; A316-M320 PolarHBondContact O-N 3.47Å
317E81.5Confident81Confident132 Ų132101.9 Ų101.962%0.61752%0.522SS*.Hα-helixtrans-59.6-48.6173.6-82.4-179.5159.800111.9E313 L319 M320 E321E313-E317 PolarHBondContact O-N 3.29Å; E317-L319 PolarHBondContact O-N 2.87Å; E317-M320 PolarHBondContact O-N 2.87Å; E317-M320 VanDerWaalsContact O-N 3.08Å; E317-E321 PolarHBondContact O-N 3.33Å
318K83.6Confident80.7Confident134 Ų13498.4 Ų98.458%0.58351%0.512SS*.Hα-helixtrans-57.9-33.1174.4-74.8178.2-179.4-179.90112.7L314 A322L314-K318 WeakPolarHBondContact O-CG 3.45Å; L314-K318 PolarHBondContact O-N 3.37Å; K318-A322 VanDerWaalsContact O-CB 3.27Å; K318-A322 WeakPolarHBondContact O-CB 3.32Å; K318-A322 PolarHBondContact O-N 3.44Å
319L81.7Confident80.4Confident114 Ų11498.9 Ų98.960%0.59751%0.513SS*.Hα-helixtrans-74.1-39.4177-131.4156.5000111.6K315 A316 E317 A322 N323K315-L319 WeakPolarHBondContact O-CB 3.46Å; K315-L319 PolarHBondContact O-N 3.22Å; K315-L319 VanDerWaalsContact O-N 3.1Å; A316-L319 CarbonylContact O-C 3.59Å; A316-L319 WeakPolarHBondContact O-CA 3.29Å; A316-L319 WeakPolarHBondContact O-CB 3.41Å; A316-L319 PolarHBondContact O-N 3.13Å; A316-L319 VanDerWaalsContact O-N 3.12Å; E317-L319 PolarHBondContact O-N 2.87Å; L319-A322 PolarHBondContact O-N 3.46Å; L319-N323 WeakPolarHBondContact O-CB 3.44Å; L319-N323 PolarHBondContact O-N 2.94Å
320M81.2Confident80.1Confident133 Ų133102.6 Ų102.666%0.65552%0.522SS*.Hα-helixtrans-63.7-45.1173.1-72.9-170.3-174.400111.4A316 E317 N323 L324A316-M320 WeakPolarHBondContact O-CG 3.49Å; A316-M320 PolarHBondContact O-N 3.47Å; E317-M320 PolarHBondContact O-N 2.87Å; E317-M320 VanDerWaalsContact O-N 3.08Å; M320-N323 PolarHBondContact O-N 2.87Å; M320-L324 WeakPolarHBondContact O-CG 3.29Å; M320-L324 PolarHBondContact O-N 2.85Å
321E82.1Confident79.6Confident124 Ų124103.4 Ų103.458%0.57953%0.529SS*.Hα-helixtrans-62.5-43.7176.4-166.8-179.5-171.900111.3E317 N323 L324 I325E317-E321 PolarHBondContact O-N 3.33Å; E321-N323 VanDerWaalsContact C-N 3.35Å; E321-N323 PolarHBondContact O-N 2.89Å; E321-L324 PolarHBondContact O-N 3.49Å; E321-I325 HydrophobicContact CG-CD1 4.45Å; E321-I325 WeakPolarHBondContact O-CG1 3.31Å; E321-I325 PolarHBondContact O-N 3.23Å
322A78.1Confident79.2Confident42 Ų42105.7 Ų105.735%0.34753%0.534SS..Hα-helixtrans-61.2-40.8173.600000112.5K318 L319 I325 I326K318-A322 VanDerWaalsContact O-CB 3.27Å; K318-A322 WeakPolarHBondContact O-CB 3.32Å; K318-A322 PolarHBondContact O-N 3.44Å; L319-A322 PolarHBondContact O-N 3.46Å; A322-I325 PolarHBondContact O-N 3.46Å; A322-I326 VanDerWaalsContact O-CG1 3.24Å; A322-I326 WeakPolarHBondContact O-CG1 3.45Å; A322-I326 PolarHBondContact O-N 3.44Å
323N77Confident78.6Confident87 Ų87103.7 Ų103.747%0.46553%0.53SS..Hα-helixtrans-64.2-42.9175.6-98.94.1000112.1L319 M320 E321 I325 I326 E327L319-N323 WeakPolarHBondContact O-CB 3.44Å; L319-N323 PolarHBondContact O-N 2.94Å; M320-N323 PolarHBondContact O-N 2.87Å; E321-N323 VanDerWaalsContact C-N 3.35Å; E321-N323 PolarHBondContact O-N 2.89Å; N323-I325 VanDerWaalsContact C-N 3.31Å; N323-I325 PolarHBondContact O-N 3.27Å; N323-I326 PolarHBondContact O-N 3.26Å; N323-I326 VanDerWaalsContact O-N 3.13Å; N323-E327 PolarHBondContact O-N 2.87Å
324L81.5Confident78.3Confident113 Ų113102.6 Ų102.659%0.59253%0.525SS*.Hα-helixtrans-61-40.2175.4-75.4169.1000111.8M320 E321 E327 S328M320-L324 WeakPolarHBondContact O-CG 3.29Å; M320-L324 PolarHBondContact O-N 2.85Å; E321-L324 PolarHBondContact O-N 3.49Å; L324-E327 PolarHBondContact O-N 2.83Å; L324-S328 VanDerWaalsContact O-CB 3.29Å; L324-S328 WeakPolarHBondContact O-CB 3.44Å; L324-S328 PolarHBondContact O-N 3.35Å
325I79.4Confident77.8Confident86 Ų86103.5 Ų103.544%0.44153%0.529SS..Hα-helixtrans-64.7-40.9174.4-66.4166.5000110.9E321 A322 N323 K329E321-I325 HydrophobicContact CG-CD1 4.45Å; E321-I325 WeakPolarHBondContact O-CG1 3.31Å; E321-I325 PolarHBondContact O-N 3.23Å; A322-I325 PolarHBondContact O-N 3.46Å; N323-I325 VanDerWaalsContact C-N 3.31Å; N323-I325 PolarHBondContact O-N 3.27Å; I325-K329 HydrophobicContact CG2-CD 4.46Å; I325-K329 WeakPolarHBondContact O-CB 3.24Å; I325-K329 WeakPolarHBondContact O-CG 3.43Å; I325-K329 PolarHBondContact O-N 2.91Å
326I73.6Confident77.3Confident103 Ų103101.5 Ų101.553%0.52853%0.528SS..Hα-helixtrans-65.8-46177.3-70.2165000110.8A322 N323 K329 F330A322-I326 VanDerWaalsContact O-CG1 3.24Å; A322-I326 WeakPolarHBondContact O-CG1 3.45Å; A322-I326 PolarHBondContact O-N 3.44Å; N323-I326 PolarHBondContact O-N 3.26Å; N323-I326 VanDerWaalsContact O-N 3.13Å; I326-K329 PolarHBondContact O-N 2.82Å; I326-F330 WeakPolarHBondContact O-CB 3.04Å; I326-F330 PolarHBondContact O-N 3.45Å
327E74.6Confident76.9Confident117 Ų117103.6 Ų103.655%0.54753%0.532SS..Hα-helixtrans-61.7-42.9176.8-77.4-176.3169.400111.8N323 L324 K329 F330 C331N323-E327 PolarHBondContact O-N 2.87Å; L324-E327 PolarHBondContact O-N 2.83Å; E327-K329 PolarHBondContact O-N 3.18Å; E327-F330 PolarHBondContact O-N 2.93Å; E327-C331 PolarHBondContact O-N 3.32Å; E327-C331 PolarHBondContact O-SG 3.45Å
328S76.7Confident76.8Confident62 Ų62101.6 Ų101.643%0.43453%0.526SS..Hα-helixtrans-59.8-45.6174.1176.60000111.7L324 F330 C331 Q332L324-S328 VanDerWaalsContact O-CB 3.29Å; L324-S328 WeakPolarHBondContact O-CB 3.44Å; L324-S328 PolarHBondContact O-N 3.35Å; S328-F330 VanDerWaalsContact C-N 3.33Å; S328-F330 PolarHBondContact O-N 3.36Å; S328-C331 PolarHBondContact O-N 2.88Å; S328-Q332 WeakPolarHBondContact O-CG 3.32Å; S328-Q332 PolarHBondContact O-N 3.29Å
329K78.8Confident76.3Confident140 Ų14098.1 Ų98.161%0.60952%0.519SS*.Hα-helixtrans-65-35.3174.7-76.2-176.2179-179.60112.7I325 I326 E327 S333I325-K329 HydrophobicContact CG2-CD 4.46Å; I325-K329 WeakPolarHBondContact O-CB 3.24Å; I325-K329 WeakPolarHBondContact O-CG 3.43Å; I325-K329 PolarHBondContact O-N 2.91Å; I326-K329 PolarHBondContact O-N 2.82Å; E327-K329 PolarHBondContact O-N 3.18Å; K329-S333 WeakPolarHBondContact O-CB 3.49Å; K329-S333 PolarHBondContact O-N 2.94Å
330F74.1Confident75.9Confident140 Ų14096.4 Ų96.461%0.61451%0.51SS*.Hα-helixtrans-67.2-45.3176.1-169.6-93.4000111.1I326 E327 S328 Q332 S333 E334I326-F330 WeakPolarHBondContact O-CB 3.04Å; I326-F330 PolarHBondContact O-N 3.45Å; E327-F330 PolarHBondContact O-N 2.93Å; S328-F330 VanDerWaalsContact C-N 3.33Å; S328-F330 PolarHBondContact O-N 3.36Å; F330-Q332 PolarHBondContact O-N 2.95Å; F330-S333 CarbonylContact O-C 3.5Å; F330-S333 WeakPolarHBondContact O-CB 3.37Å; F330-S333 PolarHBondContact O-N 3.3Å; F330-S333 VanDerWaalsContact O-N 3.16Å; F330-E334 WeakPolarHBondContact O-CB 3.32Å; F330-E334 PolarHBondContact O-N 3.08Å
331C73.2Confident75.7Confident69 Ų6995 Ų9547%0.46650%0.504SS..Hα-helixtrans-60.4-43.3174.3-67.90000111.7E327 S328 E334 I335E327-C331 PolarHBondContact O-N 3.32Å; E327-C331 PolarHBondContact O-SG 3.45Å; S328-C331 PolarHBondContact O-N 2.88Å; C331-E334 PolarHBondContact O-N 3.37Å; C331-I335 VanDerWaalsContact O-CG1 3.31Å; C331-I335 WeakPolarHBondContact O-CG1 3.5Å; C331-I335 PolarHBondContact O-N 3.23Å
332Q73.6Confident75.4Confident119 Ų11992.6 Ų92.656%0.55650%0.501SS*.Hα-helixtrans-61.1-43.9173.6-73.1177.64.100112S328 F330 E334 I335 V336S328-Q332 WeakPolarHBondContact O-CG 3.32Å; S328-Q332 PolarHBondContact O-N 3.29Å; F330-Q332 PolarHBondContact O-N 2.95Å; Q332-E334 VanDerWaalsContact C-N 3.31Å; Q332-E334 PolarHBondContact O-N 3.44Å; Q332-I335 PolarHBondContact O-N 3.07Å; Q332-V336 WeakPolarHBondContact O-CG2 3.3Å; Q332-V336 PolarHBondContact O-N 3.24Å
333S69.5Low75.3Confident73 Ų7395 Ų9551%0.5151%0.507SS..Hα-helixtrans-61-39.1174.8176.70000111.9K329 F330 V336 N337K329-S333 WeakPolarHBondContact O-CB 3.49Å; K329-S333 PolarHBondContact O-N 2.94Å; F330-S333 CarbonylContact O-C 3.5Å; F330-S333 WeakPolarHBondContact O-CB 3.37Å; F330-S333 PolarHBondContact O-N 3.3Å; F330-S333 VanDerWaalsContact O-N 3.16Å; S333-V336 PolarHBondContact O-N 3.47Å; S333-N337 VanDerWaalsContact O-CB 3.3Å; S333-N337 WeakPolarHBondContact O-CB 3.48Å; S333-N337 PolarHBondContact O-N 3.01Å
334E74.3Confident75.2Confident100 Ų10097.4 Ų97.447%0.46751%0.514SS..Hα-helixtrans-67.2-41.7177.7-170.1169.8-16800111.8F330 C331 Q332 V336 N337 N338F330-E334 WeakPolarHBondContact O-CB 3.32Å; F330-E334 PolarHBondContact O-N 3.08Å; C331-E334 PolarHBondContact O-N 3.37Å; Q332-E334 VanDerWaalsContact C-N 3.31Å; Q332-E334 PolarHBondContact O-N 3.44Å; E334-V336 PolarHBondContact O-N 2.95Å; E334-N337 PolarHBondContact O-N 3.34Å; E334-N338 WeakPolarHBondContact O-CB 3.39Å; E334-N338 VanDerWaalsContact O-CG 3.28Å; E334-N338 PolarHBondContact O-N 3.01Å; E334-N338 PolarHBondContact O-ND2 3.34Å
335I74.8Confident75.1Confident111 Ų11198.6 Ų98.657%0.56951%0.514SS*.Hα-helixtrans-60.2-44.7173-66.8165000111C331 Q332 N338 S339C331-I335 VanDerWaalsContact O-CG1 3.31Å; C331-I335 WeakPolarHBondContact O-CG1 3.5Å; C331-I335 PolarHBondContact O-N 3.23Å; Q332-I335 PolarHBondContact O-N 3.07Å; I335-N338 PolarHBondContact O-N 3.34Å; I335-S339 WeakPolarHBondContact O-CB 3.38Å; I335-S339 PolarHBondContact O-N 3.4Å; I335-S339 PolarHBondContact O-OG 2.78Å
336V73.6Confident75Confident87 Ų8798 Ų9853%0.52751%0.514SS..Hα-helixtrans-64.7-42.5177172.80000111Q332 S333 E334 S339 L340Q332-V336 WeakPolarHBondContact O-CG2 3.3Å; Q332-V336 PolarHBondContact O-N 3.24Å; S333-V336 PolarHBondContact O-N 3.47Å; E334-V336 PolarHBondContact O-N 2.95Å; V336-S339 WeakPolarHBondContact O-CB 3.4Å; V336-S339 PolarHBondContact O-N 3.46Å; V336-L340 HydrophobicContact CG1-CD1 4.1Å; V336-L340 PolarHBondContact O-N 2.89Å
337N72.2Confident75Confident89 Ų8997 Ų9748%0.47651%0.509SS..Hα-helixtrans-65.8-41.8179.1-165.834.5000111.8S333 E334 S339 L340 L341S333-N337 VanDerWaalsContact O-CB 3.3Å; S333-N337 WeakPolarHBondContact O-CB 3.48Å; S333-N337 PolarHBondContact O-N 3.01Å; E334-N337 PolarHBondContact O-N 3.34Å; N337-S339 VanDerWaalsContact C-N 3.33Å; N337-S339 PolarHBondContact O-N 3.24Å; N337-L340 PolarHBondContact O-N 2.77Å; N337-L341 WeakPolarHBondContact O-CB 3.32Å; N337-L341 PolarHBondContact O-N 2.82Å
338N78.7Confident75.1Confident91 Ų9197.6 Ų97.649%0.48751%0.51SS..Hα-helixtrans-63.8-39.1174.7-74.2-26.6000111.9E334 I335 L341 S342E334-N338 WeakPolarHBondContact O-CB 3.39Å; E334-N338 VanDerWaalsContact O-CG 3.28Å; E334-N338 PolarHBondContact O-N 3.01Å; E334-N338 PolarHBondContact O-ND2 3.34Å; I335-N338 PolarHBondContact O-N 3.34Å; N338-L341 PolarHBondContact O-N 3.34Å; N338-S342 PolarHBondContact O-N 2.83Å
339S74Confident75.5Confident61 Ų6198.6 Ų98.643%0.42751%0.511SS..Hα-helixtrans-64-44.2174.1-58.30000111.6I335 V336 N337 S342 I343I335-S339 WeakPolarHBondContact O-CB 3.38Å; I335-S339 PolarHBondContact O-N 3.4Å; I335-S339 PolarHBondContact O-OG 2.78Å; V336-S339 WeakPolarHBondContact O-CB 3.4Å; V336-S339 PolarHBondContact O-N 3.46Å; N337-S339 VanDerWaalsContact C-N 3.33Å; N337-S339 PolarHBondContact O-N 3.24Å; S339-S342 WeakPolarHBondContact O-CB 3.47Å; S339-S342 PolarHBondContact O-N 2.94Å; S339-I343 WeakPolarHBondContact O-CG1 3.29Å; S339-I343 PolarHBondContact O-N 2.89Å
340L72.6Confident75.5Confident77 Ų7796 Ų9640%0.40350%0.503SS..Hα-helixtrans-62-44.2174.2-81.3165.7000111.9V336 N337 S342 I343 F344V336-L340 HydrophobicContact CG1-CD1 4.1Å; V336-L340 PolarHBondContact O-N 2.89Å; N337-L340 PolarHBondContact O-N 2.77Å; L340-S342 VanDerWaalsContact C-N 3.3Å; L340-S342 PolarHBondContact O-N 3.43Å; L340-I343 PolarHBondContact O-N 3.36Å; L340-F344 HydrophobicContact CB-CD2 4.42Å; L340-F344 HydrophobicContact CB-CE2 4.43Å; L340-F344 HydrophobicContact CD2-CE2 4.37Å; L340-F344 WeakPolarHBondContact O-CB 3.42Å; L340-F344 WeakPolarHBondContact O-CD2 3.29Å; L340-F344 PolarHBondContact O-N 3.03Å
341L76.8Confident75.5Confident104 Ų10494.8 Ų94.855%0.54550%0.503SS..Hα-helixtrans-59.3-41.1175.8-110.3133.3000111.8N337 N338 F344 K345N337-L341 WeakPolarHBondContact O-CB 3.32Å; N337-L341 PolarHBondContact O-N 2.82Å; N338-L341 PolarHBondContact O-N 3.34Å; L341-F344 PolarHBondContact O-N 3.36Å; L341-K345 WeakPolarHBondContact O-CB 3.43Å; L341-K345 PolarHBondContact O-N 2.95Å
342S75.9Confident75.8Confident73 Ų7395.2 Ų95.251%0.5150%0.499SS..Hα-helixtrans-64.5-42.4174.7-1720000112.3N338 S339 L340 K345 T346N338-S342 PolarHBondContact O-N 2.83Å; S339-S342 WeakPolarHBondContact O-CB 3.47Å; S339-S342 PolarHBondContact O-N 2.94Å; L340-S342 VanDerWaalsContact C-N 3.3Å; L340-S342 PolarHBondContact O-N 3.43Å; S342-K345 PolarHBondContact O-N 3.47Å; S342-T346 PolarHBondContact O-N 2.9Å; S342-T346 PolarHBondContact O-OG1 3.15Å
343I76.8Confident76.2Confident94 Ų9494 Ų9448%0.48249%0.494SS..Hα-helixtrans-63.6-46.7174.6-67.7164.7000110.6S339 L340 K345 T346 I347S339-I343 WeakPolarHBondContact O-CG1 3.29Å; S339-I343 PolarHBondContact O-N 2.89Å; L340-I343 PolarHBondContact O-N 3.36Å; I343-K345 VanDerWaalsContact C-N 3.3Å; I343-K345 PolarHBondContact O-N 3.37Å; I343-T346 WeakPolarHBondContact O-CB 3.48Å; I343-T346 PolarHBondContact O-N 3.18Å; I343-I347 HydrophobicContact CG2-CD1 3.74Å; I343-I347 HydrophobicContact CG2-CG1 4.35Å; I343-I347 WeakPolarHBondContact O-CG1 3.46Å; I343-I347 PolarHBondContact O-N 3.18Å
344F73.6Confident76.6Confident137 Ų13796.1 Ų96.160%0.60150%0.496SS*.Hα-helixtrans-62-38.1177-82.1-62.5000112.3L340 L341 I347 K348L340-F344 HydrophobicContact CB-CD2 4.42Å; L340-F344 HydrophobicContact CB-CE2 4.43Å; L340-F344 HydrophobicContact CD2-CE2 4.37Å; L340-F344 WeakPolarHBondContact O-CB 3.42Å; L340-F344 WeakPolarHBondContact O-CD2 3.29Å; L340-F344 PolarHBondContact O-N 3.03Å; L341-F344 PolarHBondContact O-N 3.36Å; F344-I347 PolarHBondContact O-N 3.41Å; F344-K348 VanDerWaalsContact O-CB 3.27Å; F344-K348 WeakPolarHBondContact O-CB 3.38Å; F344-K348 PolarHBondContact O-N 3.09Å
345K79.3Confident76.2Confident138 Ų13894.9 Ų94.960%0.650%0.498SS*.Hα-helixtrans-64.4-46.2174.6-166.6174.9-179.7-177.10110.9L341 S342 I343 I347 K348 D349L341-K345 WeakPolarHBondContact O-CB 3.43Å; L341-K345 PolarHBondContact O-N 2.95Å; S342-K345 PolarHBondContact O-N 3.47Å; I343-K345 VanDerWaalsContact C-N 3.3Å; I343-K345 PolarHBondContact O-N 3.37Å; K345-I347 PolarHBondContact O-N 2.94Å; K345-K348 PolarHBondContact O-N 3.01Å; K345-D349 WeakPolarHBondContact O-CB 3.46Å; K345-D349 PolarHBondContact O-N 3.38Å
346T77.7Confident76.6Confident72 Ų7293.4 Ų93.444%0.44249%0.492SS..Hα-helixtrans-59.3-43.8174.6-53.70000112.1S342 I343 D349 N350S342-T346 PolarHBondContact O-N 2.9Å; S342-T346 PolarHBondContact O-OG1 3.15Å; I343-T346 WeakPolarHBondContact O-CB 3.48Å; I343-T346 PolarHBondContact O-N 3.18Å; T346-D349 PolarHBondContact O-N 3.1Å; T346-N350 WeakPolarHBondContact O-CB 3.36Å; T346-N350 PolarHBondContact O-N 2.88Å; T346-N350 PolarHBondContact O-ND2 3.02Å
347I74.1Confident76.9Confident83 Ų8393.8 Ų93.843%0.42649%0.486SS..Hα-helixtrans-64.6-43.4176.7-69.1168.9000111I343 F344 K345 N350 L351I343-I347 HydrophobicContact CG2-CD1 3.74Å; I343-I347 HydrophobicContact CG2-CG1 4.35Å; I343-I347 WeakPolarHBondContact O-CG1 3.46Å; I343-I347 PolarHBondContact O-N 3.18Å; F344-I347 PolarHBondContact O-N 3.41Å; K345-I347 PolarHBondContact O-N 2.94Å; I347-N350 PolarHBondContact O-N 3.49Å; I347-L351 HydrophobicContact CG2-CD1 3.95Å; I347-L351 WeakPolarHBondContact O-CB 3.41Å; I347-L351 WeakPolarHBondContact O-CG 3.47Å; I347-L351 PolarHBondContact O-N 2.93Å
348K77.2Confident76.7Confident130 Ų13093.6 Ų93.657%0.56549%0.491SS*.Hα-helixtrans-61.9-46.5177.2179.8-175.8174.5-176.40111.1F344 K345 L351 I352F344-K348 VanDerWaalsContact O-CB 3.27Å; F344-K348 WeakPolarHBondContact O-CB 3.38Å; F344-K348 PolarHBondContact O-N 3.09Å; K345-K348 PolarHBondContact O-N 3.01Å; K348-L351 PolarHBondContact O-N 3.25Å; K348-I352 HydrophobicContact CG-CD1 3.95Å; K348-I352 VanDerWaalsContact O-CG1 3.3Å; K348-I352 WeakPolarHBondContact O-CG1 3.45Å; K348-I352 PolarHBondContact O-N 3.28Å
349D84.2Confident76.5Confident82 Ų8293.1 Ų93.144%0.43949%0.488SS..Hα-helixtrans-65.4-41.2-179.7-66.1-17.8000110.5K345 T346 L351 I352 E353K345-D349 WeakPolarHBondContact O-CB 3.46Å; K345-D349 PolarHBondContact O-N 3.38Å; T346-D349 PolarHBondContact O-N 3.1Å; D349-L351 PolarHBondContact O-N 3.12Å; D349-I352 PolarHBondContact O-N 3.49Å; D349-E353 WeakPolarHBondContact O-CB 3.04Å; D349-E353 PolarHBondContact O-N 2.89Å
350N78.9Confident76.6Confident86 Ų8694.6 Ų94.646%0.4649%0.491SS..Hα-helixtrans-61.8-41.6171.7-80-22.9000112.9T346 I347 E353 Q354T346-N350 WeakPolarHBondContact O-CB 3.36Å; T346-N350 PolarHBondContact O-N 2.88Å; T346-N350 PolarHBondContact O-ND2 3.02Å; I347-N350 PolarHBondContact O-N 3.49Å; N350-E353 PolarHBondContact O-N 3.44Å; N350-Q354 WeakPolarHBondContact O-CB 3.46Å; N350-Q354 VanDerWaalsContact O-CG 3.28Å; N350-Q354 WeakPolarHBondContact O-CG 3.44Å; N350-Q354 PolarHBondContact O-N 2.94Å
351L75.3Confident76.8Confident115 Ų11598 Ų9860%0.60250%0.503SS*.Hα-helixtrans-65.4-39.8176.3-84.6165.3000111.8I347 K348 D349 Q354 S355I347-L351 HydrophobicContact CG2-CD1 3.95Å; I347-L351 WeakPolarHBondContact O-CB 3.41Å; I347-L351 WeakPolarHBondContact O-CG 3.47Å; I347-L351 PolarHBondContact O-N 2.93Å; K348-L351 PolarHBondContact O-N 3.25Å; D349-L351 PolarHBondContact O-N 3.12Å; L351-Q354 PolarHBondContact O-N 2.79Å; L351-S355 VanDerWaalsContact O-CB 3.23Å; L351-S355 WeakPolarHBondContact O-CB 3.49Å; L351-S355 PolarHBondContact O-N 3.2Å
352I79.6Confident76.3Confident77 Ų7799.1 Ų99.140%0.39550%0.503SS..Hα-helixtrans-64.1-44.3174.2-69.3167000110K348 D349 S355 N356K348-I352 HydrophobicContact CG-CD1 3.95Å; K348-I352 VanDerWaalsContact O-CG1 3.3Å; K348-I352 WeakPolarHBondContact O-CG1 3.45Å; K348-I352 PolarHBondContact O-N 3.28Å; D349-I352 PolarHBondContact O-N 3.49Å; I352-S355 PolarHBondContact O-N 3.38Å; I352-N356 WeakPolarHBondContact O-CB 3.49Å; I352-N356 VanDerWaalsContact O-CG 3.24Å; I352-N356 PolarHBondContact O-N 3.37Å; I352-N356 PolarHBondContact O-ND2 3.44Å
353E81.7Confident76.4Confident93 Ų93100.4 Ų100.444%0.43550%0.499SS..Hα-helixtrans-61.5-45176.6-167.7-170.2157.300111.7D349 N350 N356 K357D349-E353 WeakPolarHBondContact O-CB 3.04Å; D349-E353 PolarHBondContact O-N 2.89Å; N350-E353 PolarHBondContact O-N 3.44Å; E353-N356 PolarHBondContact O-N 2.84Å; E353-K357 WeakPolarHBondContact O-CG 3.48Å; E353-K357 PolarHBondContact O-N 3.4Å; E353-K357 WeakPolarHBondContact OE1-CE 3.22Å; E353-K357 IonicContact OE1-NZ 2.81Å; E353-K357 PolarHBondContact OE1-NZ 2.91Å
354Q76.5Confident76.3Confident118 Ų118102.7 Ų102.755%0.55151%0.508SS*.Hα-helixtrans-65.9-39.4176.7-70.6-64.6-21.300112.2N350 L351 K357 C358N350-Q354 WeakPolarHBondContact O-CB 3.46Å; N350-Q354 VanDerWaalsContact O-CG 3.28Å; N350-Q354 WeakPolarHBondContact O-CG 3.44Å; N350-Q354 PolarHBondContact O-N 2.94Å; L351-Q354 PolarHBondContact O-N 2.79Å; Q354-K357 PolarHBondContact O-N 3.49Å; Q354-C358 WeakPolarHBondContact O-CB 3.4Å; Q354-C358 PolarHBondContact O-N 2.88Å
355S67.7Low75.8Confident74 Ų7498.8 Ų98.852%0.51750%0.498SS..Hα-helixtrans-62.3-44.1174.6-179.60000111.2L351 I352 C358 L359L351-S355 VanDerWaalsContact O-CB 3.23Å; L351-S355 WeakPolarHBondContact O-CB 3.49Å; L351-S355 PolarHBondContact O-N 3.2Å; I352-S355 PolarHBondContact O-N 3.38Å; S355-C358 PolarHBondContact O-N 3.27Å; S355-L359 WeakPolarHBondContact O-CB 3.43Å; S355-L359 PolarHBondContact O-N 2.91Å
356N82.1Confident75.3Confident81 Ų8197.2 Ų97.243%0.43349%0.493SS..Hα-helixtrans-64.1-45.1175.7-71-23.1000111.5I352 E353 C358 L359 D360I352-N356 WeakPolarHBondContact O-CB 3.49Å; I352-N356 VanDerWaalsContact O-CG 3.24Å; I352-N356 PolarHBondContact O-N 3.37Å; I352-N356 PolarHBondContact O-ND2 3.44Å; E353-N356 PolarHBondContact O-N 2.84Å; N356-C358 VanDerWaalsContact C-N 3.28Å; N356-C358 PolarHBondContact O-N 3.35Å; N356-L359 PolarHBondContact O-N 3.22Å; N356-D360 WeakPolarHBondContact O-CB 3.24Å; N356-D360 VanDerWaalsContact O-CG 3.32Å; N356-D360 PolarHBondContact O-N 2.83Å
357K79.7Confident75.3Confident94 Ų94101.4 Ų101.441%0.40951%0.505SS..Hα-helixtrans-58.5-39.3174-76176-175.9168.40112.4E353 Q354 K361E353-K357 WeakPolarHBondContact O-CG 3.48Å; E353-K357 PolarHBondContact O-N 3.4Å; E353-K357 WeakPolarHBondContact OE1-CE 3.22Å; E353-K357 IonicContact OE1-NZ 2.81Å; E353-K357 PolarHBondContact OE1-NZ 2.91Å; Q354-K357 PolarHBondContact O-N 3.49Å; K357-K361 WeakPolarHBondContact O-CG 3.36Å; K357-K361 PolarHBondContact O-N 3.35Å; K357-K361 VanDerWaalsContact O-N 3.08Å
358C68.6Low75.3Confident86 Ų86102.8 Ų102.858%0.58151%0.513SS*.Hα-helixtrans-69.3-42177.1-160.50000111.3Q354 S355 N356 K361 F362Q354-C358 WeakPolarHBondContact O-CB 3.4Å; Q354-C358 PolarHBondContact O-N 2.88Å; S355-C358 PolarHBondContact O-N 3.27Å; N356-C358 VanDerWaalsContact C-N 3.28Å; N356-C358 PolarHBondContact O-N 3.35Å; C358-K361 PolarHBondContact O-N 3.22Å; C358-F362 WeakPolarHBondContact O-CB 3.38Å; C358-F362 PolarHBondContact O-N 2.97Å
359L73.6Confident74.8Confident80 Ų80100.6 Ų100.642%0.41951%0.51SS..Hα-helixtrans-64.1-39.4175.9-174.466.2000112.1S355 N356 F362 K363S355-L359 WeakPolarHBondContact O-CB 3.43Å; S355-L359 PolarHBondContact O-N 2.91Å; N356-L359 PolarHBondContact O-N 3.22Å; L359-F362 PolarHBondContact O-N 2.65Å; L359-K363 WeakPolarHBondContact O-CG 3.44Å; L359-K363 PolarHBondContact O-N 3.48Å
360D77Confident74.1Confident92 Ų9299.9 Ų99.949%0.49251%0.509SS..Hα-helixtrans-66.9-43.8176.5-70.7-23000111.1N356 F362 K363 E364N356-D360 WeakPolarHBondContact O-CB 3.24Å; N356-D360 VanDerWaalsContact O-CG 3.32Å; N356-D360 PolarHBondContact O-N 2.83Å; D360-F362 VanDerWaalsContact C-N 3.29Å; D360-F362 PolarHBondContact O-N 3.25Å; D360-K363 PolarHBondContact O-N 3.34Å; D360-E364 WeakPolarHBondContact O-CB 3.45Å; D360-E364 PolarHBondContact O-N 3.38Å
361K75.9Confident73.9Confident150 Ų15097.1 Ų97.165%0.65250%0.5SS*.Hα-helixtrans-60.1-38.4171.5-75.6-179.2179.5-174.30112.4K357 C358 E364 S365K357-K361 WeakPolarHBondContact O-CG 3.36Å; K357-K361 PolarHBondContact O-N 3.35Å; K357-K361 VanDerWaalsContact O-N 3.08Å; C358-K361 PolarHBondContact O-N 3.22Å; K361-E364 PolarHBondContact O-N 3.38Å; K361-S365 PolarHBondContact O-N 3.25Å; K361-S365 PolarHBondContact O-OG 3.46Å
362F67.6Low74Confident126 Ų12697.8 Ų97.855%0.55350%0.498SS*.Hα-helixtrans-67-42.1176.1-176.6-91000111.8C358 L359 D360 E364 S365 E366C358-F362 WeakPolarHBondContact O-CB 3.38Å; C358-F362 PolarHBondContact O-N 2.97Å; L359-F362 PolarHBondContact O-N 2.65Å; D360-F362 VanDerWaalsContact C-N 3.29Å; D360-F362 PolarHBondContact O-N 3.25Å; F362-E364 VanDerWaalsContact C-N 3.3Å; F362-E364 PolarHBondContact O-N 2.93Å; F362-S365 WeakPolarHBondContact CA-OG 3.41Å; F362-S365 PolarHBondContact O-N 3.4Å; F362-S365 PolarHBondContact O-OG 3.32Å; F362-E366 VanDerWaalsContact O-CB 3.26Å; F362-E366 WeakPolarHBondContact O-CB 3.35Å; F362-E366 PolarHBondContact O-N 2.95Å
363K77.1Confident73.5Confident100 Ų10097.9 Ų97.944%0.43550%0.499SS..Hα-helixtrans-64.6-36.2174.2-74.1172.2-178.6169.80112L359 D360 K367L359-K363 WeakPolarHBondContact O-CG 3.44Å; L359-K363 PolarHBondContact O-N 3.48Å; D360-K363 PolarHBondContact O-N 3.34Å; K363-K367 WeakPolarHBondContact O-CB 3.21Å; K363-K367 WeakPolarHBondContact O-CG 3.49Å; K363-K367 PolarHBondContact O-N 2.94Å
364E75.6Confident73.3Confident143 Ų14398.4 Ų98.467%0.66850%0.504SS*.Hα-helixtrans-68.7-41.5176.5-165.2167.8-15800111.4D360 K361 F362 K367 L368D360-E364 WeakPolarHBondContact O-CB 3.45Å; D360-E364 PolarHBondContact O-N 3.38Å; K361-E364 PolarHBondContact O-N 3.38Å; F362-E364 VanDerWaalsContact C-N 3.3Å; F362-E364 PolarHBondContact O-N 2.93Å; E364-K367 PolarHBondContact O-N 3.48Å; E364-L368 PolarHBondContact O-N 2.98Å
365S63.2Low73.3Confident55 Ų5597.8 Ų97.839%0.38550%0.504SS..Hα-helixtrans-68.6-37.5173.368.40000112.6K361 F362 L368 V369K361-S365 PolarHBondContact O-N 3.25Å; K361-S365 PolarHBondContact O-OG 3.46Å; F362-S365 WeakPolarHBondContact CA-OG 3.41Å; F362-S365 PolarHBondContact O-N 3.4Å; F362-S365 PolarHBondContact O-OG 3.32Å; S365-L368 WeakPolarHBondContact O-CB 3.29Å; S365-L368 PolarHBondContact O-N 3.21Å; S365-V369 VanDerWaalsContact O-CG2 3.3Å; S365-V369 WeakPolarHBondContact O-CG2 3.48Å; S365-V369 PolarHBondContact O-N 3.4Å
366E67.9Low73.3Confident105 Ų10599.8 Ų99.849%0.49151%0.508SS..Hα-helixtrans-62.4-43.8173.5-174.4179.7-160.600111.3F362 L368 V369 T370F362-E366 VanDerWaalsContact O-CB 3.26Å; F362-E366 WeakPolarHBondContact O-CB 3.35Å; F362-E366 PolarHBondContact O-N 2.95Å; E366-L368 VanDerWaalsContact C-N 3.33Å; E366-L368 PolarHBondContact O-N 2.99Å; E366-V369 PolarHBondContact O-N 3.01Å; E366-T370 WeakPolarHBondContact O-CB 3.5Å; E366-T370 WeakPolarHBondContact O-CG2 3.48Å; E366-T370 PolarHBondContact O-N 3.4Å; E366-T370 PolarHBondContact O-OG1 2.98Å
367K77.1Confident73Confident159 Ų159100.8 Ų100.869%0.69151%0.511SS*.Hα-helixtrans-60.3-40.3172-79.3-179.8-179.8-1780112.5K363 E364 T370 G371K363-K367 WeakPolarHBondContact O-CB 3.21Å; K363-K367 WeakPolarHBondContact O-CG 3.49Å; K363-K367 PolarHBondContact O-N 2.94Å; E364-K367 PolarHBondContact O-N 3.48Å; K367-T370 VanDerWaalsContact CA-OG1 3.28Å; K367-T370 WeakPolarHBondContact CA-OG1 3.49Å; K367-T370 PolarHBondContact O-OG1 2.96Å; K367-G371 PolarHBondContact O-N 3.48Å
368L76Confident72.7Confident113 Ų113100 Ų10059%0.59251%0.514SS*.Hα-helixtrans-67.3-42.4177.3-173.968.8000111.8E364 S365 E366 G371 K372E364-L368 PolarHBondContact O-N 2.98Å; S365-L368 WeakPolarHBondContact O-CB 3.29Å; S365-L368 PolarHBondContact O-N 3.21Å; E366-L368 VanDerWaalsContact C-N 3.33Å; E366-L368 PolarHBondContact O-N 2.99Å; L368-G371 PolarHBondContact O-N 2.96Å; L368-K372 WeakPolarHBondContact O-CG 3.45Å; L368-K372 PolarHBondContact O-N 3.4Å
369V65.5Low72.8Confident83 Ų83101.8 Ų101.850%0.50352%0.517SS..Hα-helixtrans-67.1-45.7178170.40000110.8S365 E366 G371 K372 I373S365-V369 VanDerWaalsContact O-CG2 3.3Å; S365-V369 WeakPolarHBondContact O-CG2 3.48Å; S365-V369 PolarHBondContact O-N 3.4Å; E366-V369 PolarHBondContact O-N 3.01Å; V369-G371 VanDerWaalsContact C-N 3.32Å; V369-G371 PolarHBondContact O-N 3.33Å; V369-K372 PolarHBondContact O-N 3.06Å; V369-I373 HydrophobicContact CG1-CD1 3.85Å; V369-I373 HydrophobicContact CG1-CG1 4.4Å; V369-I373 VanDerWaalsContact O-CG1 3.32Å; V369-I373 WeakPolarHBondContact O-CG1 3.3Å; V369-I373 PolarHBondContact O-N 3.4Å
370T69.7Low72.9Confident68 Ų68103.8 Ų103.842%0.41752%0.524SS..Hα-helixtrans-62.2-39.417647.50000111.9E366 K367 I373 L374E366-T370 WeakPolarHBondContact O-CB 3.5Å; E366-T370 WeakPolarHBondContact O-CG2 3.48Å; E366-T370 PolarHBondContact O-N 3.4Å; E366-T370 PolarHBondContact O-OG1 2.98Å; K367-T370 VanDerWaalsContact CA-OG1 3.28Å; K367-T370 WeakPolarHBondContact CA-OG1 3.49Å; K367-T370 PolarHBondContact O-OG1 2.96Å; T370-I373 PolarHBondContact O-N 2.86Å; T370-L374 PolarHBondContact O-N 3.15Å
371G74.5Confident72.9Confident27 Ų27105.8 Ų105.828%0.27853%0.531SS..Hα-helixtrans-58.6-47.3170.500000112.6K367 L368 V369 I373 L374 D375K367-G371 PolarHBondContact O-N 3.48Å; L368-G371 PolarHBondContact O-N 2.96Å; V369-G371 VanDerWaalsContact C-N 3.32Å; V369-G371 PolarHBondContact O-N 3.33Å; G371-I373 VanDerWaalsContact C-N 3.33Å; G371-I373 PolarHBondContact O-N 3.37Å; G371-L374 WeakPolarHBondContact O-CB 3.34Å; G371-L374 PolarHBondContact O-N 2.86Å; G371-D375 PolarHBondContact O-N 3.3Å
372K76.7Confident72.7Confident129 Ų129102 Ų10256%0.56152%0.523SS*.Hα-helixtrans-66.7-30.9177-73.9-165.7177.4-169.30114L368 V369 D375 L376L368-K372 WeakPolarHBondContact O-CG 3.45Å; L368-K372 PolarHBondContact O-N 3.4Å; V369-K372 PolarHBondContact O-N 3.06Å; K372-D375 PolarHBondContact O-N 2.77Å; K372-L376 WeakPolarHBondContact O-CB 3.49Å; K372-L376 VanDerWaalsContact O-CG 3.3Å; K372-L376 WeakPolarHBondContact O-CG 3.41Å; K372-L376 PolarHBondContact O-N 2.95Å
373I70Confident73.1Confident80 Ų80103.4 Ų103.441%0.4153%0.526SS..Hα-helixtrans-66.4-45.7174.1-71167.1000109.7V369 T370 G371 D375 L376 E377V369-I373 HydrophobicContact CG1-CD1 3.85Å; V369-I373 HydrophobicContact CG1-CG1 4.4Å; V369-I373 VanDerWaalsContact O-CG1 3.32Å; V369-I373 WeakPolarHBondContact O-CG1 3.3Å; V369-I373 PolarHBondContact O-N 3.4Å; T370-I373 PolarHBondContact O-N 2.86Å; G371-I373 VanDerWaalsContact C-N 3.33Å; G371-I373 PolarHBondContact O-N 3.37Å; I373-D375 VanDerWaalsContact C-N 3.33Å; I373-D375 PolarHBondContact O-N 3.35Å; I373-L376 PolarHBondContact O-N 2.79Å; I373-L376 VanDerWaalsContact O-N 3.14Å; I373-E377 HydrophobicContact CG2-CG 4.44Å; I373-E377 WeakPolarHBondContact O-CG 3.27Å; I373-E377 PolarHBondContact O-N 2.94Å
374L77.1Confident73.1Confident103 Ų103102.6 Ų102.654%0.53953%0.525SS..Hα-helixtrans-59.8-41.6173.5-83.7158000112.1T370 G371 L376 E377 T378T370-L374 PolarHBondContact O-N 3.15Å; G371-L374 WeakPolarHBondContact O-CB 3.34Å; G371-L374 PolarHBondContact O-N 2.86Å; L374-L376 VanDerWaalsContact C-N 3.32Å; L374-L376 PolarHBondContact O-N 3Å; L374-E377 PolarHBondContact O-N 3.06Å; L374-T378 WeakPolarHBondContact O-CG2 3.48Å; L374-T378 PolarHBondContact O-N 3.48Å; L374-T378 PolarHBondContact O-OG1 2.95Å
375D76.6Confident73.1Confident106 Ų10698.4 Ų98.457%0.56752%0.515SS*.Hα-helixtrans-63.1-37.8174.7-66.8-21.8000111.8G371 K372 I373 T378 L379G371-D375 PolarHBondContact O-N 3.3Å; K372-D375 PolarHBondContact O-N 2.77Å; I373-D375 VanDerWaalsContact C-N 3.33Å; I373-D375 PolarHBondContact O-N 3.35Å; D375-T378 WeakPolarHBondContact CA-OG1 3.44Å; D375-T378 PolarHBondContact O-OG1 2.89Å; D375-L379 WeakPolarHBondContact O-CB 3.32Å; D375-L379 PolarHBondContact O-N 3.34Å
376L67.6Low73.6Confident115 Ų115100.4 Ų100.460%0.60252%0.519SS*.Hα-helixtrans-71.2-39.3176-76.9169.7000112.4K372 I373 L374 L379 Q380K372-L376 WeakPolarHBondContact O-CB 3.49Å; K372-L376 VanDerWaalsContact O-CG 3.3Å; K372-L376 WeakPolarHBondContact O-CG 3.41Å; K372-L376 PolarHBondContact O-N 2.95Å; I373-L376 PolarHBondContact O-N 2.79Å; I373-L376 VanDerWaalsContact O-N 3.14Å; L374-L376 VanDerWaalsContact C-N 3.32Å; L374-L376 PolarHBondContact O-N 3Å; L376-L379 PolarHBondContact O-N 3.45Å; L376-Q380 VanDerWaalsContact O-CB 3.29Å; L376-Q380 WeakPolarHBondContact O-CB 3.35Å; L376-Q380 PolarHBondContact O-N 3.45Å
377E75Confident74Confident102 Ų10298.7 Ų98.748%0.47751%0.513SS..Hα-helixtrans-62.8-45.6175.3-75175.7168.100110.7I373 L374 L379 Q380 E381I373-E377 HydrophobicContact CG2-CG 4.44Å; I373-E377 WeakPolarHBondContact O-CG 3.27Å; I373-E377 PolarHBondContact O-N 2.94Å; L374-E377 PolarHBondContact O-N 3.06Å; E377-L379 PolarHBondContact O-N 3.21Å; E377-Q380 WeakPolarHBondContact O-CB 3.29Å; E377-Q380 PolarHBondContact O-N 2.81Å; E377-E381 WeakPolarHBondContact O-CG 3.44Å; E377-E381 PolarHBondContact O-N 3.3Å
378T74.8Confident74.1Confident79 Ų7997 Ų9749%0.48551%0.508SS..Hα-helixtrans-65.1-37.3175.351.70000112.6L374 D375 Q380 S382L374-T378 WeakPolarHBondContact O-CG2 3.48Å; L374-T378 PolarHBondContact O-N 3.48Å; L374-T378 PolarHBondContact O-OG1 2.95Å; D375-T378 WeakPolarHBondContact CA-OG1 3.44Å; D375-T378 PolarHBondContact O-OG1 2.89Å; T378-Q380 VanDerWaalsContact C-N 3.35Å; T378-S382 WeakPolarHBondContact O-CB 3.49Å; T378-S382 PolarHBondContact O-N 2.73Å
379L70Confident74.2Confident122 Ų12298.6 Ų98.664%0.63951%0.51SS*.Hα-helixtrans-65.9-38.6173.2-155.689.5000111.6D375 L376 E377 S382 Y383D375-L379 WeakPolarHBondContact O-CB 3.32Å; D375-L379 PolarHBondContact O-N 3.34Å; L376-L379 PolarHBondContact O-N 3.45Å; E377-L379 PolarHBondContact O-N 3.21Å; L379-S382 PolarHBondContact O-N 3.39Å; L379-Y383 WeakPolarHBondContact O-CB 3.41Å; L379-Y383 PolarHBondContact O-N 3.19Å
380Q77.1Confident74.6Confident123 Ų12398.2 Ų98.258%0.57551%0.505SS*.Hα-helixtrans-67.6-43.1177.2-176.3174-12.400111.4L376 E377 T378 S382 Y383 I384L376-Q380 VanDerWaalsContact O-CB 3.29Å; L376-Q380 WeakPolarHBondContact O-CB 3.35Å; L376-Q380 PolarHBondContact O-N 3.45Å; E377-Q380 WeakPolarHBondContact O-CB 3.29Å; E377-Q380 PolarHBondContact O-N 2.81Å; T378-Q380 VanDerWaalsContact C-N 3.35Å; Q380-S382 VanDerWaalsContact C-N 3.33Å; Q380-S382 PolarHBondContact O-N 2.96Å; Q380-Y383 WeakPolarHBondContact O-CB 3.42Å; Q380-Y383 PolarHBondContact O-N 3.33Å; Q380-I384 HydrophobicContact CG-CD1 4.21Å; Q380-I384 WeakPolarHBondContact O-CG1 3.49Å; Q380-I384 PolarHBondContact O-N 3.48Å
381E75.8Confident75Confident134 Ų134100.8 Ų100.863%0.62651%0.511SS*.Hα-helixtrans-59.3-44171.6-73.9179.7173.200111.4E377 Y383 I384 A385E377-E381 WeakPolarHBondContact O-CG 3.44Å; E377-E381 PolarHBondContact O-N 3.3Å; E381-Y383 VanDerWaalsContact C-N 3.31Å; E381-Y383 PolarHBondContact O-N 2.85Å; E381-I384 PolarHBondContact O-N 3.29Å; E381-A385 WeakPolarHBondContact O-CB 3.36Å; E381-A385 PolarHBondContact O-N 3.23Å
382S72.3Confident75.2Confident69 Ų69104.8 Ų104.848%0.48353%0.525SS..Hα-helixtrans-63.1-35.7174.6-1790000112.7T378 L379 Q380 M386T378-S382 WeakPolarHBondContact O-CB 3.49Å; T378-S382 PolarHBondContact O-N 2.73Å; L379-S382 PolarHBondContact O-N 3.39Å; Q380-S382 VanDerWaalsContact C-N 3.33Å; Q380-S382 PolarHBondContact O-N 2.96Å; S382-M386 WeakPolarHBondContact O-CB 3.46Å; S382-M386 PolarHBondContact O-N 3.46Å
383Y75.7Confident75.1Confident157 Ų157102.4 Ų102.462%0.61652%0.518SS*.Hα-helixtrans-69.2-43.4176.8-177.8-96.3000111.3L379 Q380 E381 M386 D387L379-Y383 WeakPolarHBondContact O-CB 3.41Å; L379-Y383 PolarHBondContact O-N 3.19Å; Q380-Y383 WeakPolarHBondContact O-CB 3.42Å; Q380-Y383 PolarHBondContact O-N 3.33Å; E381-Y383 VanDerWaalsContact C-N 3.31Å; E381-Y383 PolarHBondContact O-N 2.85Å; Y383-M386 WeakPolarHBondContact O-CB 3.48Å; Y383-M386 PolarHBondContact O-N 3.03Å; Y383-D387 PolarHBondContact O-N 2.97Å
384I78Confident75.4Confident83 Ų83104.9 Ų104.943%0.42653%0.528SS..Hα-helixtrans-60-47.2175.2-68165.6000110.2Q380 E381 M386 D387 E388Q380-I384 HydrophobicContact CG-CD1 4.21Å; Q380-I384 WeakPolarHBondContact O-CG1 3.49Å; Q380-I384 PolarHBondContact O-N 3.48Å; E381-I384 PolarHBondContact O-N 3.29Å; I384-M386 VanDerWaalsContact C-N 3.27Å; I384-M386 PolarHBondContact O-N 3.49Å; I384-D387 PolarHBondContact O-N 2.92Å; I384-D387 VanDerWaalsContact O-N 3.15Å; I384-E388 WeakPolarHBondContact O-CG 3.39Å; I384-E388 PolarHBondContact O-N 2.83Å
385A75.6Confident75.3Confident54 Ų54105.1 Ų105.145%0.44653%0.53SS..Hα-helixtrans-61.3-35.4176.700000112.7E381 K389E381-A385 WeakPolarHBondContact O-CB 3.36Å; E381-A385 PolarHBondContact O-N 3.23Å; A385-K389 WeakPolarHBondContact O-CB 3.47Å; A385-K389 PolarHBondContact O-N 3.18Å; A385-K389 VanDerWaalsContact O-N 3.12Å
386M72.9Confident75.2Confident98 Ų98105 Ų10548%0.48353%0.526SS..Hα-helixtrans-70.3-39.4175-167.2-174.2-52.800112.1S382 Y383 I384 K389 N390S382-M386 WeakPolarHBondContact O-CB 3.46Å; S382-M386 PolarHBondContact O-N 3.46Å; Y383-M386 WeakPolarHBondContact O-CB 3.48Å; Y383-M386 PolarHBondContact O-N 3.03Å; I384-M386 VanDerWaalsContact C-N 3.27Å; I384-M386 PolarHBondContact O-N 3.49Å; M386-K389 PolarHBondContact O-N 3.29Å; M386-N390 WeakPolarHBondContact O-CB 3.24Å; M386-N390 PolarHBondContact O-N 3Å; M386-N390 PolarHBondContact O-ND2 3.35Å
387D76.9Confident75.5Confident68 Ų68104 Ų10436%0.36452%0.521SS..Hα-helixtrans-67.5-40.9177.7-162.751.7000111.7Y383 I384 K389 N390 K391Y383-D387 PolarHBondContact O-N 2.97Å; I384-D387 PolarHBondContact O-N 2.92Å; I384-D387 VanDerWaalsContact O-N 3.15Å; D387-K389 PolarHBondContact O-N 2.9Å; D387-N390 PolarHBondContact O-N 3.45Å; D387-K391 PolarHBondContact O-N 2.87Å
388E79Confident75.7Confident125 Ų125103.6 Ų103.658%0.58452%0.521SS*.Hα-helixtrans-59.4-45.3171.6-73.5-179.9170.500111.6I384 N390 K391 L392I384-E388 WeakPolarHBondContact O-CG 3.39Å; I384-E388 PolarHBondContact O-N 2.83Å; E388-N390 VanDerWaalsContact C-N 3.33Å; E388-N390 PolarHBondContact O-N 3.49Å; E388-K391 PolarHBondContact O-N 3.29Å; E388-L392 PolarHBondContact O-N 3.24Å
389K78.1Confident75.7Confident145 Ų145105.7 Ų105.763%0.6353%0.525SS*.Hα-helixtrans-63.4-38.5176-170.6175.7-178.3175.40112.3A385 M386 D387 L392 L393A385-K389 WeakPolarHBondContact O-CB 3.47Å; A385-K389 PolarHBondContact O-N 3.18Å; A385-K389 VanDerWaalsContact O-N 3.12Å; M386-K389 PolarHBondContact O-N 3.29Å; D387-K389 PolarHBondContact O-N 2.9Å; K389-L392 PolarHBondContact O-N 3.29Å; K389-L393 HydrophobicContact CG-CD1 4.41Å; K389-L393 WeakPolarHBondContact O-CG 3.45Å; K389-L393 PolarHBondContact O-N 3.33Å
390N73.1Confident75.8Confident76 Ų76106.5 Ų106.541%0.40652%0.52SS..Hα-helixtrans-67.7-39.7176.1-79-24.2000112.3M386 D387 E388 L393 Q394M386-N390 WeakPolarHBondContact O-CB 3.24Å; M386-N390 PolarHBondContact O-N 3Å; M386-N390 PolarHBondContact O-ND2 3.35Å; D387-N390 PolarHBondContact O-N 3.45Å; E388-N390 VanDerWaalsContact C-N 3.33Å; E388-N390 PolarHBondContact O-N 3.49Å; N390-L393 PolarHBondContact O-N 2.86Å; N390-Q394 WeakPolarHBondContact O-CB 3.24Å; N390-Q394 WeakPolarHBondContact O-CG 3.32Å; N390-Q394 PolarHBondContact O-N 3.36Å
391K78.7Confident75.5Confident122 Ų122109 Ų10953%0.5352%0.524SS..Hα-helixtrans-60.3-45.7172.5-83.1179.7-179.9166.70111.5D387 E388 L393 Q394 D395D387-K391 PolarHBondContact O-N 2.87Å; E388-K391 PolarHBondContact O-N 3.29Å; K391-L393 VanDerWaalsContact C-N 3.33Å; K391-L393 PolarHBondContact O-N 2.93Å; K391-Q394 WeakPolarHBondContact O-CB 3.42Å; K391-Q394 PolarHBondContact O-N 3.41Å; K391-Q394 VanDerWaalsContact O-N 3.1Å; K391-D395 PolarHBondContact O-N 3.37Å
392L79.3Confident75.5Confident111 Ų111108.2 Ų108.258%0.58152%0.52SS*.Hα-helixtrans-60.5-43178.1-137.8149.5000111.6E388 K389 D395 E396E388-L392 PolarHBondContact O-N 3.24Å; K389-L392 PolarHBondContact O-N 3.29Å; L392-D395 PolarHBondContact O-N 2.95Å; L392-E396 WeakPolarHBondContact O-CG 3.47Å; L392-E396 PolarHBondContact O-N 3.16Å
393L73.7Confident75.8Confident79 Ų79109.9 Ų109.941%0.41452%0.519SS..Hα-helixtrans-65.7-36173.5-77.9165.4000113.2K389 N390 K391 L397K389-L393 HydrophobicContact CG-CD1 4.41Å; K389-L393 WeakPolarHBondContact O-CG 3.45Å; K389-L393 PolarHBondContact O-N 3.33Å; N390-L393 PolarHBondContact O-N 2.86Å; K391-L393 VanDerWaalsContact C-N 3.33Å; K391-L393 PolarHBondContact O-N 2.93Å; L393-L397 WeakPolarHBondContact O-CB 3.43Å; L393-L397 PolarHBondContact O-N 2.9Å
394Q75.3Confident75.5Confident131 Ų131107.5 Ų107.561%0.61251%0.513SS*.Hα-helixtrans-67-41.8175.3-80.1-177.50.200111.7N390 K391 L397 L398N390-Q394 WeakPolarHBondContact O-CB 3.24Å; N390-Q394 WeakPolarHBondContact O-CG 3.32Å; N390-Q394 PolarHBondContact O-N 3.36Å; K391-Q394 WeakPolarHBondContact O-CB 3.42Å; K391-Q394 PolarHBondContact O-N 3.41Å; K391-Q394 VanDerWaalsContact O-N 3.1Å; Q394-L397 PolarHBondContact O-N 2.95Å; Q394-L398 WeakPolarHBondContact O-CB 3.47Å; Q394-L398 PolarHBondContact O-N 3.31Å
395D76.1Confident75.2Confident108 Ų108109.1 Ų109.158%0.57852%0.519SS*.Hα-helixtrans-64.3-42.1176.3-71.7-19.5000111.2K391 L392 L398 H399K391-D395 PolarHBondContact O-N 3.37Å; L392-D395 PolarHBondContact O-N 2.95Å; D395-L398 PolarHBondContact O-N 2.95Å; D395-H399 WeakPolarHBondContact O-CB 3.43Å; D395-H399 PolarHBondContact O-N 2.66Å
396E75Confident75.1Confident103 Ų103110.1 Ų110.148%0.48152%0.522SS..Hα-helixtrans-61.3-45.9172.3-76.3-177.8171.900112L392 L398 H399 W400L392-E396 WeakPolarHBondContact O-CG 3.47Å; L392-E396 PolarHBondContact O-N 3.16Å; E396-L398 VanDerWaalsContact C-N 3.32Å; E396-L398 PolarHBondContact O-N 3.01Å; E396-H399 PolarHBondContact O-N 3.38Å; E396-W400 PolarHBondContact O-N 3.45Å
397L73Confident75.1Confident96 Ų96108.5 Ų108.550%0.50352%0.516SS..Hα-helixtrans-61.7-38.8176.2-95.2160.5000112.3L393 Q394 W400 R401L393-L397 WeakPolarHBondContact O-CB 3.43Å; L393-L397 PolarHBondContact O-N 2.9Å; Q394-L397 PolarHBondContact O-N 2.95Å; L397-W400 PolarHBondContact O-N 2.95Å; L397-R401 WeakPolarHBondContact O-CG 3.46Å; L397-R401 PolarHBondContact O-N 3.13Å
398L78.9Confident74.8Confident93 Ų93109.8 Ų109.849%0.48752%0.522SS..Hα-helixtrans-65.5-44.5176.4-171.273.5000110.6Q394 D395 E396 W400 R401 Q402Q394-L398 WeakPolarHBondContact O-CB 3.47Å; Q394-L398 PolarHBondContact O-N 3.31Å; D395-L398 PolarHBondContact O-N 2.95Å; E396-L398 VanDerWaalsContact C-N 3.32Å; E396-L398 PolarHBondContact O-N 3.01Å; L398-W400 PolarHBondContact O-N 3.4Å; L398-R401 PolarHBondContact O-N 3.1Å; L398-Q402 WeakPolarHBondContact O-CG 3.35Å; L398-Q402 PolarHBondContact O-N 3.44Å
399H76.4Confident74.6Confident122 Ų122108 Ų10857%0.56552%0.515SS*.Hα-helixtrans-59.3-45.1175.8-173.764.9000111.8D395 E396 Q402 K403D395-H399 WeakPolarHBondContact O-CB 3.43Å; D395-H399 PolarHBondContact O-N 2.66Å; E396-H399 PolarHBondContact O-N 3.38Å; H399-Q402 PolarHBondContact O-N 3.42Å; H399-K403 WeakPolarHBondContact O-CB 3.38Å; H399-K403 PolarHBondContact O-N 2.97Å
400W71Confident74.1Confident139 Ų139106.4 Ų106.453%0.52751%0.51SS..Hα-helixtrans-63.4-41.7175.4-84.1106.9000113E396 L397 L398 K403 H404E396-W400 PolarHBondContact O-N 3.45Å; L397-W400 PolarHBondContact O-N 2.95Å; L398-W400 PolarHBondContact O-N 3.4Å; W400-K403 HydrophobicContact CE3-CD 4.45Å; W400-K403 HydrophobicContact CZ3-CD 4.34Å; W400-K403 PolarHBondContact O-N 3.37Å; W400-H404 AromaticContact CE3-NE2 3.89Å; W400-H404 PolarHBondContact O-CD2 3.22Å; W400-H404 PolarHBondContact O-N 3.31Å
401R71.6Confident73.7Confident176 Ų176107.8 Ų107.866%0.66452%0.515SS*.Hα-helixtrans-62.7-43.1175.4-76.6-173.5-146.1-161.55.8112.2L397 L398 K403 H404 H405L397-R401 WeakPolarHBondContact O-CG 3.46Å; L397-R401 PolarHBondContact O-N 3.13Å; L398-R401 PolarHBondContact O-N 3.1Å; R401-K403 VanDerWaalsContact C-N 3.34Å; R401-H404 PolarHBondContact O-N 3.5Å; R401-H405 WeakPolarHBondContact O-CB 3.26Å; R401-H405 PolarHBondContact O-N 3.11Å
402Q74.9Confident73.2Confident118 Ų118106.6 Ų106.655%0.55151%0.512SS*.Hα-helixtrans-62.9-42.8177.7-74.7175.8-8.300111.3L398 H399 H405 S406L398-Q402 WeakPolarHBondContact O-CG 3.35Å; L398-Q402 PolarHBondContact O-N 3.44Å; H399-Q402 PolarHBondContact O-N 3.42Å; Q402-H405 PolarHBondContact O-N 3.12Å; Q402-S406 PolarHBondContact O-N 3.33Å
403K78.5Confident72.9Confident104 Ų104104.7 Ų104.745%0.45250%0.504SS..Hα-helixtrans-60.1-51.7174.6-174.1176.6179.4179.10111.9H399 W400 R401 H405 S406 D407H399-K403 WeakPolarHBondContact O-CB 3.38Å; H399-K403 PolarHBondContact O-N 2.97Å; W400-K403 HydrophobicContact CE3-CD 4.45Å; W400-K403 HydrophobicContact CZ3-CD 4.34Å; W400-K403 PolarHBondContact O-N 3.37Å; R401-K403 VanDerWaalsContact C-N 3.34Å; K403-H405 VanDerWaalsContact C-N 3.27Å; K403-H405 PolarHBondContact O-N 3.39Å; K403-S406 WeakPolarHBondContact O-CB 3.48Å; K403-S406 PolarHBondContact O-N 2.89Å; K403-S406 VanDerWaalsContact O-N 3.12Å; K403-D407 VanDerWaalsContact O-CG 3.27Å; K403-D407 PolarHBondContact O-N 2.83Å
404H69.9Low72.5Confident107 Ų107105.4 Ų105.450%0.49551%0.506SS..Hα-helixtrans-59.1-37.5176.7-79.4-60000112.9W400 R401 D407 I408W400-H404 AromaticContact CE3-NE2 3.89Å; W400-H404 PolarHBondContact O-CD2 3.22Å; W400-H404 PolarHBondContact O-N 3.31Å; R401-H404 PolarHBondContact O-N 3.5Å; H404-D407 PolarHBondContact O-N 3.32Å; H404-I408 VanDerWaalsContact O-CG1 3.24Å; H404-I408 WeakPolarHBondContact O-CG1 3.42Å; H404-I408 PolarHBondContact O-N 3.03Å
405H70.7Confident72Confident117 Ų117103.5 Ų103.554%0.54250%0.499SS..Hα-helixtrans-66.7-41.3176.4-169.359.9000111.9R401 Q402 K403 D407 I408 I409R401-H405 WeakPolarHBondContact O-CB 3.26Å; R401-H405 PolarHBondContact O-N 3.11Å; Q402-H405 PolarHBondContact O-N 3.12Å; K403-H405 VanDerWaalsContact C-N 3.27Å; K403-H405 PolarHBondContact O-N 3.39Å; H405-D407 VanDerWaalsContact C-N 3.35Å; H405-I408 PolarHBondContact O-N 3.46Å; H405-I409 WeakPolarHBondContact O-CG1 3.49Å; H405-I409 PolarHBondContact O-N 3.39Å
406S73.9Confident71.8Confident74 Ų74102.5 Ų102.552%0.51749%0.493SS..Hα-helixtrans-62.3-42174.6-156.60000111.8Q402 K403 I409 Q410Q402-S406 PolarHBondContact O-N 3.33Å; K403-S406 WeakPolarHBondContact O-CB 3.48Å; K403-S406 PolarHBondContact O-N 2.89Å; K403-S406 VanDerWaalsContact O-N 3.12Å; S406-I409 PolarHBondContact O-N 3.32Å; S406-Q410 PolarHBondContact O-N 2.88Å
407D73.5Confident71.5Confident64 Ų64103.1 Ų103.134%0.34250%0.496SS..Hα-helixtrans-63.6-40.5176.3-62.5-19.7000111.4K403 H404 H405 Q410 M411K403-D407 VanDerWaalsContact O-CG 3.27Å; K403-D407 PolarHBondContact O-N 2.83Å; H404-D407 PolarHBondContact O-N 3.32Å; H405-D407 VanDerWaalsContact C-N 3.35Å; D407-Q410 PolarHBondContact O-N 2.87Å; D407-M411 HydrophobicContact CB-CE 4.47Å; D407-M411 WeakPolarHBondContact O-CE 3.39Å; D407-M411 WeakPolarHBondContact O-CG 3.4Å; D407-M411 PolarHBondContact O-N 2.89Å
408I69.9Low71.1Confident96 Ų96103.9 Ų103.949%0.49250%0.5SS..Hα-helixtrans-64.5-44.4176.1-71.5166.1000111.3H404 H405 Q410 M411 Q412H404-I408 VanDerWaalsContact O-CG1 3.24Å; H404-I408 WeakPolarHBondContact O-CG1 3.42Å; H404-I408 PolarHBondContact O-N 3.03Å; H405-I408 PolarHBondContact O-N 3.46Å; I408-Q410 VanDerWaalsContact C-N 3.31Å; I408-Q410 PolarHBondContact O-N 3.37Å; I408-M411 HydrophobicContact CG1-CE 4.27Å; I408-M411 PolarHBondContact O-N 3.06Å; I408-Q412 WeakPolarHBondContact O-CB 3.33Å; I408-Q412 PolarHBondContact O-N 3.39Å
409I75.4Confident70.6Confident87 Ų87102.2 Ų102.245%0.44650%0.497SS..Hα-helixtrans-60.6-44.2176.9-70.5164.8000110H405 S406 Q412 T413H405-I409 WeakPolarHBondContact O-CG1 3.49Å; H405-I409 PolarHBondContact O-N 3.39Å; S406-I409 PolarHBondContact O-N 3.32Å; I409-Q412 PolarHBondContact O-N 3.32Å; I409-T413 PolarHBondContact O-N 3.08Å; I409-T413 PolarHBondContact O-OG1 2.88Å
410Q67.7Low70.3Confident111 Ų111100.3 Ų100.352%0.51949%0.493SS..Hα-helixtrans-59.7-49.4176.9-175.1178.6-11.800111.6S406 D407 I408 Q412 T413 E414S406-Q410 PolarHBondContact O-N 2.88Å; D407-Q410 PolarHBondContact O-N 2.87Å; I408-Q410 VanDerWaalsContact C-N 3.31Å; I408-Q410 PolarHBondContact O-N 3.37Å; Q410-Q412 VanDerWaalsContact C-N 3.33Å; Q410-Q412 PolarHBondContact O-N 3.2Å; Q410-T413 WeakPolarHBondContact O-CB 3.42Å; Q410-T413 PolarHBondContact O-N 2.95Å; Q410-T413 VanDerWaalsContact O-N 3.16Å; Q410-E414 PolarHBondContact NE2-OE1 3.38Å; Q410-E414 PolarHBondContact O-N 3.46Å; Q410-E414 VanDerWaalsContact O-N 3.07Å
411M63.4Low70Confident105 Ų10599.1 Ų99.152%0.51749%0.494SS..Hα-helixtrans-60.7-39.6177.6-74.2-174.4-76.400112.7D407 I408 T413 E414 I415D407-M411 HydrophobicContact CB-CE 4.47Å; D407-M411 WeakPolarHBondContact O-CE 3.39Å; D407-M411 WeakPolarHBondContact O-CG 3.4Å; D407-M411 PolarHBondContact O-N 2.89Å; I408-M411 HydrophobicContact CG1-CE 4.27Å; I408-M411 PolarHBondContact O-N 3.06Å; M411-T413 VanDerWaalsContact C-N 3.32Å; M411-T413 PolarHBondContact O-N 3.29Å; M411-E414 PolarHBondContact O-N 3.31Å; M411-I415 WeakPolarHBondContact O-CG1 3.5Å; M411-I415 PolarHBondContact O-N 3.03Å
412Q69.9Low70Confident98 Ų9894.8 Ų94.846%0.45848%0.484SS..Hα-helixtrans-63.1-41.7176.5-169.56645.500111.2I408 I409 Q410 E414 I415 D416I408-Q412 WeakPolarHBondContact O-CB 3.33Å; I408-Q412 PolarHBondContact O-N 3.39Å; I409-Q412 PolarHBondContact O-N 3.32Å; Q410-Q412 VanDerWaalsContact C-N 3.33Å; Q410-Q412 PolarHBondContact O-N 3.2Å; Q412-E414 VanDerWaalsContact C-N 3.31Å; Q412-E414 PolarHBondContact O-N 2.98Å; Q412-I415 PolarHBondContact O-N 3.08Å; Q412-D416 PolarHBondContact NE2-OD1 3.37Å; Q412-D416 VanDerWaalsContact O-CG 3.26Å; Q412-D416 PolarHBondContact O-N 3.4Å
413T72.5Confident69.8Low70 Ų7094.3 Ų94.343%0.42948%0.484SS..Hα-helixtrans-63.3-38.8178.5-40.10000111.4I409 Q410 M411 Q417I409-T413 PolarHBondContact O-N 3.08Å; I409-T413 PolarHBondContact O-OG1 2.88Å; Q410-T413 WeakPolarHBondContact O-CB 3.42Å; Q410-T413 PolarHBondContact O-N 2.95Å; Q410-T413 VanDerWaalsContact O-N 3.16Å; M411-T413 VanDerWaalsContact C-N 3.32Å; M411-T413 PolarHBondContact O-N 3.29Å; T413-Q417 WeakPolarHBondContact O-CG 3.49Å; T413-Q417 PolarHBondContact O-N 3.24Å; T413-Q417 VanDerWaalsContact O-N 3.16Å
414E64.8Low69.4Low95 Ų9595.8 Ų95.844%0.44449%0.492SS..Hα-helixtrans-67.7-39.7175-71.4173.8-165.200112.2Q410 M411 Q412 D416 Q417 L418Q410-E414 PolarHBondContact NE2-OE1 3.38Å; Q410-E414 PolarHBondContact O-N 3.46Å; Q410-E414 VanDerWaalsContact O-N 3.07Å; M411-E414 PolarHBondContact O-N 3.31Å; Q412-E414 VanDerWaalsContact C-N 3.31Å; Q412-E414 PolarHBondContact O-N 2.98Å; E414-D416 VanDerWaalsContact C-N 3.35Å; E414-D416 PolarHBondContact O-N 3.47Å; E414-Q417 PolarHBondContact O-N 3.44Å; E414-L418 WeakPolarHBondContact O-CG 3.35Å; E414-L418 PolarHBondContact O-N 2.91Å
415I64.2Low69.4Low90 Ų9096 Ų9646%0.46250%0.497SS..Hα-helixtrans-63.6-40.7175.6-71167.4000111.5M411 Q412 Q417 L418 S419M411-I415 WeakPolarHBondContact O-CG1 3.5Å; M411-I415 PolarHBondContact O-N 3.03Å; Q412-I415 PolarHBondContact O-N 3.08Å; I415-Q417 VanDerWaalsContact C-N 3.35Å; I415-L418 PolarHBondContact O-N 2.96Å; I415-S419 WeakPolarHBondContact O-CB 3.48Å; I415-S419 PolarHBondContact O-N 3.36Å; I415-S419 PolarHBondContact O-OG 2.84Å
416D72.1Confident69.4Low87 Ų8796.8 Ų96.847%0.46550%0.498SS..Hα-helixtrans-67.4-37179.4-66.7-17.5000111.2Q412 E414 S419 T420Q412-D416 PolarHBondContact NE2-OD1 3.37Å; Q412-D416 VanDerWaalsContact O-CG 3.26Å; Q412-D416 PolarHBondContact O-N 3.4Å; E414-D416 VanDerWaalsContact C-N 3.35Å; E414-D416 PolarHBondContact O-N 3.47Å; D416-S419 PolarHBondContact O-N 3.13Å; D416-T420 PolarHBondContact O-N 3.01Å; D416-T420 VanDerWaalsContact O-N 3.13Å; D416-T420 PolarHBondContact O-OG1 3.44Å
417Q69.8Low69.3Low117 Ų11799.6 Ų99.655%0.54750%0.503SS..Hα-helixtrans-63.9-47.6172.2-75.5176.4-3.200112.2T413 E414 I415 S419 T420 E421T413-Q417 WeakPolarHBondContact O-CG 3.49Å; T413-Q417 PolarHBondContact O-N 3.24Å; T413-Q417 VanDerWaalsContact O-N 3.16Å; E414-Q417 PolarHBondContact O-N 3.44Å; I415-Q417 VanDerWaalsContact C-N 3.35Å; Q417-S419 VanDerWaalsContact C-N 3.26Å; Q417-S419 PolarHBondContact O-N 3.08Å; Q417-T420 WeakPolarHBondContact CA-OG1 3.39Å; Q417-T420 PolarHBondContact O-N 2.92Å; Q417-T420 PolarHBondContact O-OG1 2.96Å; Q417-E421 PolarHBondContact O-N 3.48Å; Q417-E421 VanDerWaalsContact O-N 3.13Å
418L63.6Low69.1Low111 Ų111102.3 Ų102.358%0.58152%0.517SS*.Hα-helixtrans-64.7-32.3177.8-69.4172000112.6E414 I415 N422E414-L418 WeakPolarHBondContact O-CG 3.35Å; E414-L418 PolarHBondContact O-N 2.91Å; I415-L418 PolarHBondContact O-N 2.96Å; L418-N422 WeakPolarHBondContact O-CB 3.45Å; L418-N422 PolarHBondContact O-N 3.27Å; L418-N422 VanDerWaalsContact O-N 3.12Å
419S68.3Low69Low59 Ų59104.2 Ų104.241%0.41352%0.524SS..Hα-helixtrans-69.3-37.4177.4-62.70000112.1I415 D416 Q417 I423I415-S419 WeakPolarHBondContact O-CB 3.48Å; I415-S419 PolarHBondContact O-N 3.36Å; I415-S419 PolarHBondContact O-OG 2.84Å; D416-S419 PolarHBondContact O-N 3.13Å; Q417-S419 VanDerWaalsContact C-N 3.26Å; Q417-S419 PolarHBondContact O-N 3.08Å; S419-I423 WeakPolarHBondContact O-CG1 3.45Å; S419-I423 PolarHBondContact O-N 2.92Å
420T69.9Low68.9Low81 Ų81107.7 Ų107.750%0.49754%0.536SS..Hα-helixtrans-68.1-44.7176.137.80000111.5D416 Q417 N422 I423 E424D416-T420 PolarHBondContact O-N 3.01Å; D416-T420 VanDerWaalsContact O-N 3.13Å; D416-T420 PolarHBondContact O-OG1 3.44Å; Q417-T420 WeakPolarHBondContact CA-OG1 3.39Å; Q417-T420 PolarHBondContact O-N 2.92Å; Q417-T420 PolarHBondContact O-OG1 2.96Å; T420-N422 VanDerWaalsContact C-N 3.31Å; T420-N422 PolarHBondContact O-N 3.17Å; T420-I423 PolarHBondContact O-N 3.37Å; T420-E424 PolarHBondContact O-N 3Å
421E65.1Low69.1Low115 Ų115106.9 Ų106.954%0.53754%0.539SS..Hα-helixtrans-59.4-38.4174.9-70.7-179.5176.800113Q417 I423 E424 L425Q417-E421 PolarHBondContact O-N 3.48Å; Q417-E421 VanDerWaalsContact O-N 3.13Å; E421-I423 VanDerWaalsContact C-N 3.34Å; E421-I423 PolarHBondContact O-N 3.23Å; E421-E424 PolarHBondContact O-N 3.05Å; E421-L425 PolarHBondContact O-N 2.9Å
422N71.5Confident69.3Low84 Ų84107.7 Ų107.745%0.44954%0.544SS..Hα-helixtrans-68.5-31.9178.9-16819.4000112.9L418 T420 K426L418-N422 WeakPolarHBondContact O-CB 3.45Å; L418-N422 PolarHBondContact O-N 3.27Å; L418-N422 VanDerWaalsContact O-N 3.12Å; T420-N422 VanDerWaalsContact C-N 3.31Å; T420-N422 PolarHBondContact O-N 3.17Å; N422-K426 WeakPolarHBondContact O-CG 3.49Å; N422-K426 PolarHBondContact O-N 3.29Å
423I71.7Confident69.2Low108 Ų108109 Ų10955%0.55455%0.552SS**Hα-helixtrans-68.7-44.7175.2-68.2166.2000110S419 T420 E421 L425 K426 E427S419-I423 WeakPolarHBondContact O-CG1 3.45Å; S419-I423 PolarHBondContact O-N 2.92Å; T420-I423 PolarHBondContact O-N 3.37Å; E421-I423 VanDerWaalsContact C-N 3.34Å; E421-I423 PolarHBondContact O-N 3.23Å; I423-L425 VanDerWaalsContact C-N 3.34Å; I423-L425 PolarHBondContact O-N 3.41Å; I423-K426 PolarHBondContact O-N 3.38Å; I423-E427 PolarHBondContact O-N 2.86Å; I423-E427 VanDerWaalsContact O-N 3.12Å
424E70.8Confident68.8Low135 Ų135109.2 Ų109.263%0.63156%0.556SS**Hα-helixtrans-61-41.5177.4-67.5-178.7175.600111.9T420 E421 K426 E427 L428T420-E424 PolarHBondContact O-N 3Å; E421-E424 PolarHBondContact O-N 3.05Å; E424-K426 PolarHBondContact O-N 3.45Å; E424-E427 PolarHBondContact O-N 3.01Å; E424-L428 PolarHBondContact O-N 3.26Å; E424-L428 VanDerWaalsContact O-N 3.1Å
425L68.9Low68.9Low113 Ų113108.4 Ų108.459%0.59256%0.557SS**Hα-helixtrans-62.3-40.9175.4-82.8167.5000113E421 I423 L428 E429E421-L425 PolarHBondContact O-N 2.9Å; I423-L425 VanDerWaalsContact C-N 3.34Å; I423-L425 PolarHBondContact O-N 3.41Å; L425-L428 WeakPolarHBondContact O-CB 3.44Å; L425-L428 PolarHBondContact O-N 3.33Å; L425-E429 PolarHBondContact O-N 3.24Å
426K71.3Confident68.8Low132 Ų132108.7 Ų108.757%0.57456%0.56SS**Hα-helixtrans-67.1-36.6178.2-78179.8-179.7175.60112.8N422 I423 E424 K430N422-K426 WeakPolarHBondContact O-CG 3.49Å; N422-K426 PolarHBondContact O-N 3.29Å; I423-K426 PolarHBondContact O-N 3.38Å; E424-K426 PolarHBondContact O-N 3.45Å; K426-K430 WeakPolarHBondContact O-CB 3.45Å; K426-K430 PolarHBondContact O-N 2.89Å; K426-K430 VanDerWaalsContact O-N 3.12Å
427E71.6Confident68.7Low133 Ų133111.1 Ų111.162%0.62157%0.568SS**Hα-helixtrans-66.7-38.8173.9-86.9-171.4148.300112.1I423 E424 K430 T431I423-E427 PolarHBondContact O-N 2.86Å; I423-E427 VanDerWaalsContact O-N 3.12Å; E424-E427 PolarHBondContact O-N 3.01Å; E427-K430 PolarHBondContact O-N 3.34Å; E427-T431 PolarHBondContact O-N 2.96Å; E427-T431 VanDerWaalsContact O-N 3.13Å; E427-T431 PolarHBondContact O-OG1 3.36Å
428L68.6Low68.6Low122 Ų122113.1 Ų113.164%0.63958%0.575SS**Hα-helixtrans-61.9-45.2175.4-150.189000111.6E424 L425 K430 T431 L432E424-L428 PolarHBondContact O-N 3.26Å; E424-L428 VanDerWaalsContact O-N 3.1Å; L425-L428 WeakPolarHBondContact O-CB 3.44Å; L425-L428 PolarHBondContact O-N 3.33Å; L428-K430 PolarHBondContact O-N 2.93Å; L428-T431 PolarHBondContact O-N 2.9Å; L428-L432 PolarHBondContact O-N 3.4Å; L428-L432 VanDerWaalsContact O-N 3.11Å
429E68.7Low68.6Low135 Ų135112 Ų11263%0.63157%0.57SS**Hα-helixtrans-62-43178.7-170.3177.7-164.300112L425 T431 L432 M433L425-E429 PolarHBondContact O-N 3.24Å; E429-T431 VanDerWaalsContact C-N 3.31Å; E429-T431 PolarHBondContact O-N 3.08Å; E429-L432 PolarHBondContact O-N 3.37Å; E429-M433 PolarHBondContact O-N 2.85Å
430K72Confident68.7Low161 Ų161114.8 Ų114.870%0.758%0.58SS**Hα-helixtrans-62.6-39178.5-160.8177.6-175.8-177.60112K426 E427 L428 C434K426-K430 WeakPolarHBondContact O-CB 3.45Å; K426-K430 PolarHBondContact O-N 2.89Å; K426-K430 VanDerWaalsContact O-N 3.12Å; E427-K430 PolarHBondContact O-N 3.34Å; L428-K430 PolarHBondContact O-N 2.93Å; K430-C434 PolarHBondContact O-N 2.85Å
431T71.8Confident68.6Low94 Ų94114.2 Ų114.258%0.57758%0.579SS**Hα-helixtrans-66.8-40.2177.4-50.10000111.2E427 L428 E429 T435E427-T431 PolarHBondContact O-N 2.96Å; E427-T431 VanDerWaalsContact O-N 3.13Å; E427-T431 PolarHBondContact O-OG1 3.36Å; L428-T431 PolarHBondContact O-N 2.9Å; E429-T431 VanDerWaalsContact C-N 3.31Å; E429-T431 PolarHBondContact O-N 3.08Å; T431-T435 PolarHBondContact O-N 2.98Å; T431-T435 PolarHBondContact O-OG1 2.88Å
432L67.4Low68.6Low121 Ų121113.5 Ų113.563%0.63458%0.578SS**Hα-helixtrans-65-43.4178.8-147.3104.6000112L428 E429 T435 N436L428-L432 PolarHBondContact O-N 3.4Å; L428-L432 VanDerWaalsContact O-N 3.11Å; E429-L432 PolarHBondContact O-N 3.37Å; L432-T435 WeakPolarHBondContact O-CB 3.29Å; L432-T435 PolarHBondContact O-N 3.47Å; L432-T435 VanDerWaalsContact O-N 3.16Å; L432-N436 PolarHBondContact O-N 3.31Å; L432-N436 VanDerWaalsContact O-N 3.11Å
433M68.8Low68.4Low125 Ų125114 Ų11462%0.61658%0.58SS**Hα-helixtrans-58.1-48.5177.1-80-88.1-73.100112.5E429 T435 N436 E437E429-M433 PolarHBondContact O-N 2.85Å; M433-T435 PolarHBondContact O-N 3.26Å; M433-N436 PolarHBondContact O-N 3.39Å; M433-N436 VanDerWaalsContact O-N 3.15Å; M433-E437 PolarHBondContact O-N 3.42Å
434C64.4Low68.4Low76 Ų76115.6 Ų115.651%0.51458%0.583SS.*Hα-helixtrans-61.2-29.9177.2-87.60000113.3K430K430-C434 PolarHBondContact O-N 2.85Å
435T66.5Low68.2Low77 Ų77117.6 Ų117.647%0.47259%0.585SS.*Hα-helixtrans-74.7-36.9178.6-40.10000110.9T431 L432 M433 K438 N439T431-T435 PolarHBondContact O-N 2.98Å; T431-T435 PolarHBondContact O-OG1 2.88Å; L432-T435 WeakPolarHBondContact O-CB 3.29Å; L432-T435 PolarHBondContact O-N 3.47Å; L432-T435 VanDerWaalsContact O-N 3.16Å; M433-T435 PolarHBondContact O-N 3.26Å; T435-K438 PolarHBondContact O-N 2.91Å; T435-N439 PolarHBondContact O-N 3.42Å
436N62.7Low68Low97 Ų97117.6 Ų117.652%0.51958%0.584SS.*Hα-helixtrans-69.6-39.3-179.3-123.87.5000113.1L432 M433 K438 N439 L440L432-N436 PolarHBondContact O-N 3.31Å; L432-N436 VanDerWaalsContact O-N 3.11Å; M433-N436 PolarHBondContact O-N 3.39Å; M433-N436 VanDerWaalsContact O-N 3.15Å; N436-K438 VanDerWaalsContact C-N 3.31Å; N436-K438 PolarHBondContact O-N 2.91Å; N436-N439 PolarHBondContact O-N 2.92Å; N436-L440 PolarHBondContact O-N 2.89Å; N436-L440 VanDerWaalsContact O-N 3.15Å
437E68.7Low67.9Low137 Ų137117.3 Ų117.364%0.6459%0.585SS**Hα-helixtrans-61.1-38.9175.8-78.9-174.9153.300112.5M433 N439 L440 S441M433-E437 PolarHBondContact O-N 3.42Å; E437-N439 VanDerWaalsContact C-N 3.33Å; E437-N439 PolarHBondContact O-N 3.32Å; E437-L440 PolarHBondContact O-N 3.49Å; E437-S441 PolarHBondContact O-N 3.15Å
438K67.6Low67.8Low160 Ų160116 Ų11670%0.69658%0.583SS**Hα-helixtrans-62.3-40.2176.4-73.1-179.7179.7177.10112T435 N436 S441 L442T435-K438 PolarHBondContact O-N 2.91Å; N436-K438 VanDerWaalsContact C-N 3.31Å; N436-K438 PolarHBondContact O-N 2.91Å; K438-S441 PolarHBondContact O-N 2.96Å; K438-L442 PolarHBondContact O-N 3.41Å
439N64.4Low67.6Low86 Ų86113 Ų11346%0.4658%0.576SS.*Hα-helixtrans-68.5-41.5179.9-69.9-19.7000112.4T435 N436 E437 S441 L442 I443T435-N439 PolarHBondContact O-N 3.42Å; N436-N439 PolarHBondContact O-N 2.92Å; E437-N439 VanDerWaalsContact C-N 3.33Å; E437-N439 PolarHBondContact O-N 3.32Å; N439-S441 VanDerWaalsContact C-N 3.31Å; N439-S441 PolarHBondContact O-N 2.89Å; N439-L442 WeakPolarHBondContact O-CB 3.48Å; N439-L442 PolarHBondContact O-N 3.17Å; N439-I443 WeakPolarHBondContact O-CG1 3.48Å; N439-I443 PolarHBondContact O-N 2.93Å
440L70.2Confident67.4Low119 Ų119112 Ų11262%0.62357%0.573SS**Hα-helixtrans-61.1-39176.5-91.5151.8000112.6N436 E437 L442 I443 K444N436-L440 PolarHBondContact O-N 2.89Å; N436-L440 VanDerWaalsContact O-N 3.15Å; E437-L440 PolarHBondContact O-N 3.49Å; L440-L442 VanDerWaalsContact C-N 3.31Å; L440-L442 PolarHBondContact O-N 3.24Å; L440-I443 PolarHBondContact O-N 3.33Å; L440-K444 PolarHBondContact O-N 3.47Å
441S67.9Low67.1Low68 Ų68107.1 Ų107.148%0.47656%0.563SS.*Hα-helixtrans-65.2-34.1177.3-157.80000112.6E437 K438 N439E437-S441 PolarHBondContact O-N 3.15Å; K438-S441 PolarHBondContact O-N 2.96Å; N439-S441 VanDerWaalsContact C-N 3.31Å; N439-S441 PolarHBondContact O-N 2.89Å
442L65.4Low66.7Low101 Ų101109.5 Ų109.553%0.52957%0.568SS.*Hα-helixtrans-70.3-42.7177.2-16974000112.2K438 N439 L440 K444 R445 L446K438-L442 PolarHBondContact O-N 3.41Å; N439-L442 WeakPolarHBondContact O-CB 3.48Å; N439-L442 PolarHBondContact O-N 3.17Å; L440-L442 VanDerWaalsContact C-N 3.31Å; L440-L442 PolarHBondContact O-N 3.24Å; L442-K444 VanDerWaalsContact C-N 3.3Å; L442-K444 PolarHBondContact O-N 3.29Å; L442-R445 PolarHBondContact O-N 3.16Å; L442-L446 PolarHBondContact O-N 3.26Å
443I67.3Low66.4Low94 Ų94110.9 Ų110.948%0.48257%0.571SS.*Hα-helixtrans-61-40.2-179.4-68.4168.3000111.2N439 L440 R445 L446 Q447N439-I443 WeakPolarHBondContact O-CG1 3.48Å; N439-I443 PolarHBondContact O-N 2.93Å; L440-I443 PolarHBondContact O-N 3.33Å; I443-R445 PolarHBondContact O-N 3.15Å; I443-L446 PolarHBondContact O-N 2.92Å; I443-Q447 PolarHBondContact O-N 2.94Å
444K71.1Confident66.2Low142 Ų142112.3 Ų112.362%0.61757%0.573SS**Hα-helixtrans-63.6-41.2-178.6-162.8171.6-177.4-179.30112.6L440 L442 L446 Q447 D448L440-K444 PolarHBondContact O-N 3.47Å; L442-K444 VanDerWaalsContact C-N 3.3Å; L442-K444 PolarHBondContact O-N 3.29Å; K444-L446 VanDerWaalsContact C-N 3.29Å; K444-L446 PolarHBondContact O-N 3.22Å; K444-Q447 PolarHBondContact O-N 3.26Å; K444-D448 PolarHBondContact O-N 3.04Å
445R66.7Low66.1Low177 Ų177113.9 Ų113.967%0.66858%0.576SS**Hα-helixtrans-63.3-32.9176.5-72.3-172.2-155151.67.5113.5L442 I443L442-R445 PolarHBondContact O-N 3.16Å; I443-R445 PolarHBondContact O-N 3.15Å
446L65.6Low65.8Low112 Ų112115.8 Ų115.859%0.58658%0.583SS**Hα-helixtrans-72.1-33.8178.8-73.9168.1000112L442 I443 K444 I450L442-L446 PolarHBondContact O-N 3.26Å; I443-L446 PolarHBondContact O-N 2.92Å; K444-L446 VanDerWaalsContact C-N 3.29Å; K444-L446 PolarHBondContact O-N 3.22Å; L446-I450 WeakPolarHBondContact O-CG1 3.47Å; L446-I450 PolarHBondContact O-N 3.37Å
447Q68.8Low65.7Low126 Ų126113.2 Ų113.259%0.58958%0.579SS**Hα-helixtrans-67.9-39.1177.9-72.6178.3-30.500112.2I443 K444 A449 I450 A451I443-Q447 PolarHBondContact O-N 2.94Å; K444-Q447 PolarHBondContact O-N 3.26Å; Q447-A449 VanDerWaalsContact C-N 3.32Å; Q447-A449 PolarHBondContact O-N 2.88Å; Q447-I450 PolarHBondContact O-N 2.91Å; Q447-A451 PolarHBondContact O-N 3.48Å
448D69.3Low65.2Low106 Ų106112.7 Ų112.757%0.56758%0.577SS**Hα-helixtrans-63.7-37.6179.6-64.6-24.4000111.8K444 I450 A451K444-D448 PolarHBondContact O-N 3.04Å; D448-I450 PolarHBondContact O-N 2.87Å; D448-A451 PolarHBondContact O-N 2.85Å
449A64.3Low64.6Low60 Ų60110.4 Ų110.450%0.49657%0.572SS.*Hα-helixtrans-67.2-35178.400000113.7Q447Q447-A449 VanDerWaalsContact C-N 3.32Å; Q447-A449 PolarHBondContact O-N 2.88Å
450I65.6Low64.1Low113 Ų113109.1 Ų109.158%0.57957%0.574SS**Hα-helixtrans-71.6-31.9-178.7-67.2168.9000111.6L446 Q447 D448L446-I450 WeakPolarHBondContact O-CG1 3.47Å; L446-I450 PolarHBondContact O-N 3.37Å; Q447-I450 PolarHBondContact O-N 2.91Å; D448-I450 PolarHBondContact O-N 2.87Å
451A64.4Low63.3Low59 Ų59110 Ų11049%0.48857%0.574SS.*Hα-helixtrans-68-35.2-179.600000112.5Q447 D448 K454Q447-A451 PolarHBondContact O-N 3.48Å; D448-A451 PolarHBondContact O-N 2.85Å; A451-K454 PolarHBondContact O-N 3.28Å
452E64.6Low62.5Low143 Ų143113.8 Ų113.867%0.66859%0.585SS**Hα-helixtrans-70.6-35-177.8-157170.5-154.800112.3K454E452-K454 PolarHBondContact O-N 3.39Å
453E60.7Low61.7Low151 Ų151117.4 Ų117.471%0.70660%0.601SS**Hα-helixtrans-68.4-33.5177.8-161.8174.8-160.800112.5I455 N456E453-I455 PolarHBondContact O-N 2.93Å; E453-N456 PolarHBondContact O-N 3.11Å
454K63.1Low61Low154 Ų154119.8 Ų119.867%0.6761%0.614SS**Hα-helixtrans-67-37-178.1-128.7180-178.1-174.30113.3A451 E452 N456 G457A451-K454 PolarHBondContact O-N 3.28Å; E452-K454 PolarHBondContact O-N 3.39Å; K454-N456 VanDerWaalsContact C-N 3.35Å; K454-N456 PolarHBondContact O-N 3.46Å; K454-G457 PolarHBondContact O-N 2.97Å
455I63.3Low59.9Low110 Ų110121.4 Ų121.456%0.56462%0.621SS**Hα-helixtrans-68.5-35.2-178.5-64.7171.8000111.4E453E453-I455 PolarHBondContact O-N 2.93Å
456N61.1Low58.7Low117 Ų117119.4 Ų119.463%0.62662%0.624SS**Hα-helixtrans-70.5-31.1179-74.1-28.6000112.7E453 K454E453-N456 PolarHBondContact O-N 3.11Å; K454-N456 VanDerWaalsContact C-N 3.35Å; K454-N456 PolarHBondContact O-N 3.46Å
457G60.2Low57.3Low42 Ų42122 Ų12243%0.43364%0.638SS.*Hα-helixtrans-68-40.8177.300000113.6K454 N459 A460 E461K454-G457 PolarHBondContact O-N 2.97Å; G457-N459 PolarHBondContact O-N 3.44Å; G457-A460 PolarHBondContact O-N 3.4Å; G457-E461 PolarHBondContact O-N 2.88Å
458E57.7Low56Low126 Ų126121.2 Ų121.259%0.58965%0.647SS**Hα-helixtrans-68-32.1-175.1-71.8177.4172.500112.9A460 E461 Q462E458-A460 VanDerWaalsContact C-N 3.34Å; E458-A460 PolarHBondContact O-N 3.27Å; E458-E461 PolarHBondContact O-N 2.87Å; E458-Q462 PolarHBondContact O-N 3Å
459N55Low54.7Low112 Ų112125.7 Ų125.760%0.59966%0.661SS**Hα-helixtrans-67.2-31.5175.1-83.9-23.7000113.3G457G457-N459 PolarHBondContact O-N 3.44Å
460A53Low53.6Low60 Ų60131 Ų13150%0.49668%0.676SS.*Hα-helixtrans-76.4-36.8178.200000112G457 E458 Q462 M463G457-A460 PolarHBondContact O-N 3.4Å; E458-A460 VanDerWaalsContact C-N 3.34Å; E458-A460 PolarHBondContact O-N 3.27Å; A460-Q462 VanDerWaalsContact C-N 3.34Å; A460-Q462 PolarHBondContact O-N 2.99Å; A460-M463 PolarHBondContact O-N 3.39Å
461E54.6Low52.9Low136 Ų136132.1 Ų132.164%0.63668%0.683SS**Hα-helixtrans-69.1-30.9178.5-105.3-174.8162.400113G457 E458 M463 L464 K465G457-E461 PolarHBondContact O-N 2.88Å; E458-E461 PolarHBondContact O-N 2.87Å; E461-M463 VanDerWaalsContact C-N 3.33Å; E461-M463 PolarHBondContact O-N 3.44Å; E461-L464 PolarHBondContact O-N 3.03Å; E461-K465 PolarHBondContact O-N 3.33Å
462Q51Low52.5Low149 Ų149134.3 Ų134.370%0.69669%0.686SS**Hα-helixtrans-72.3-25.3-179.3-151.6163.420.100113.1E458 A460E458-Q462 PolarHBondContact O-N 3Å; A460-Q462 VanDerWaalsContact C-N 3.34Å; A460-Q462 PolarHBondContact O-N 2.99Å
463M49.2Very low51.7Low176 Ų176135.5 Ų135.587%0.86769%0.692SS**Hα-helixtrans-77.2-30172.3-77.9-149.2149.900113.4A460 E461A460-M463 PolarHBondContact O-N 3.39Å; E461-M463 VanDerWaalsContact C-N 3.33Å; E461-M463 PolarHBondContact O-N 3.44Å
464L52.2Low51Low145 Ų145133.5 Ų133.576%0.75969%0.685SS**Hα-helixtrans-83.6-18.8-176.7-81.7162.8000113.8E461 N466E461-L464 PolarHBondContact O-N 3.03Å; L464-N466 VanDerWaalsContact C-N 3.3Å; L464-N466 PolarHBondContact O-N 3.02Å
465K47.6Very low50.6Low175 Ų175135.5 Ų135.576%0.76169%0.689SS**THydrogen-bonded Turntrans-79.4-2.2-170.2-135.8166.7-172.7167.10116E461E461-K465 PolarHBondContact O-N 3.33Å
466N40.7Very low50Low136 Ų136136.7 Ų136.773%0.72770%0.697SS**THydrogen-bonded Turntrans-104.36.7-172.6-80.6-8.5000117.1L464L464-N466 VanDerWaalsContact C-N 3.3Å; L464-N466 PolarHBondContact O-N 3.02Å
467N37.5Very low49.6Very low165 Ų165135.5 Ų135.588%0.88269%0.689SS**  trans-151.295.8170.8-84.2-42.1000114.1
468S41.4Very low49.4Very low111 Ų111137.4 Ų137.478%0.77669%0.693SS**  trans-97.2139.9151.763.20000107.2
469K42Very low49.2Very low199 Ų199135 Ų13587%0.86569%0.694SS**  cis-173.2108.239.5-152.6-177.4-165.8-179.10107.2
470E41.7Very low49Very low172 Ų172135.1 Ų135.180%0.80469%0.691SS**  trans179.4140.2139.2-102.8177.3-174.700108.4L474E470-L474 VanDerWaalsContact O-CD1 3.23Å; E470-L474 WeakPolarHBondContact O-CD1 3.49Å
471N50.1Low48.9Very low137 Ų137137.1 Ų137.173%0.73369%0.692SS**  trans-96.4132-151.5-131.513.3000112.3E473N471-E473 PolarHBondContact O-N 3Å
472D55.6Low48.7Very low104 Ų104132 Ų13256%0.55668%0.675SS**SBendtrans69.9-18.8146.1-59.3-35.5000122.1L474D472-L474 VanDerWaalsContact C-N 3.28Å
473E47.8Very low49Very low168 Ų168131.6 Ų131.679%0.78568%0.678SS**THydrogen-bonded Turntrans-80.5-14161.3-76.4-17717400112.7N471 R475 D476 L477N471-E473 PolarHBondContact O-N 3Å; E473-R475 PolarHBondContact O-N 3.39Å; E473-D476 PolarHBondContact O-N 3.38Å; E473-L477 PolarHBondContact O-N 2.98Å; E473-L477 VanDerWaalsContact O-N 3.15Å
474L46.1Very low49.4Very low109 Ų109130 Ų13057%0.57167%0.667SS**Hα-helixtrans-56.8-14.6167-103.9154.2000113E470 D472 V478E470-L474 VanDerWaalsContact O-CD1 3.23Å; E470-L474 WeakPolarHBondContact O-CD1 3.49Å; D472-L474 VanDerWaalsContact C-N 3.28Å; L474-V478 WeakPolarHBondContact O-CB 3.41Å; L474-V478 WeakPolarHBondContact O-CG2 3.39Å; L474-V478 PolarHBondContact O-N 2.74Å
475R54.2Low49.7Very low196 Ų196128.3 Ų128.374%0.7466%0.658SS**Hα-helixtrans-84.5-28.1179.6-152.6177.4-72.4-130.82.2114.3E473E473-R475 PolarHBondContact O-N 3.39Å
476D52.4Low50.1Low136 Ų136125.8 Ų125.873%0.72765%0.652SS**Hα-helixtrans-96.3-23.9171.3-87.60.1000112.3E473 V478 A479E473-D476 PolarHBondContact O-N 3.38Å; D476-V478 PolarHBondContact O-N 3.22Å; D476-A479 WeakPolarHBondContact O-CA 3.49Å; D476-A479 VanDerWaalsContact O-CB 3.24Å; D476-A479 WeakPolarHBondContact O-CB 3.12Å; D476-A479 PolarHBondContact O-N 3.46Å
477L52.4Low50.6Low91 Ų91125.8 Ų125.848%0.47664%0.643SS.*Hα-helixtrans-68-23.7169.8-132.5132000111.7E473 A479 Q480 I481E473-L477 PolarHBondContact O-N 2.98Å; E473-L477 VanDerWaalsContact O-N 3.15Å; L477-A479 PolarHBondContact O-N 3.42Å; L477-Q480 HydrophobicContact CD2-CB 4.39Å; L477-Q480 HydrophobicContact CG-CB 4.4Å; L477-Q480 HydrophobicContact CG-CG 4.32Å; L477-Q480 CarbonylContact O-C 3.57Å; L477-Q480 WeakPolarHBondContact O-CA 3.38Å; L477-Q480 VanDerWaalsContact O-CB 3.26Å; L477-Q480 WeakPolarHBondContact O-CB 3.48Å; L477-Q480 PolarHBondContact O-N 3.31Å; L477-I481 PolarHBondContact O-N 3.02Å
478V56.3Low51.8Low83 Ų83122.1 Ų122.150%0.50363%0.627SS.*Hα-helixtrans-63.5-11.1165.4163.20000112.9L474 D476 I481L474-V478 WeakPolarHBondContact O-CB 3.41Å; L474-V478 WeakPolarHBondContact O-CG2 3.39Å; L474-V478 PolarHBondContact O-N 2.74Å; D476-V478 PolarHBondContact O-N 3.22Å; V478-I481 HydrophobicContact CB-CD1 4.26Å; V478-I481 HydrophobicContact CG2-CD1 3.76Å
479A53.2Low52.5Low74 Ų74122.2 Ų122.261%0.61262%0.618SS**Hα-helixtrans-87.6-25.3162.400000113.3D476 L477 I481 G482D476-A479 WeakPolarHBondContact O-CA 3.49Å; D476-A479 VanDerWaalsContact O-CB 3.24Å; D476-A479 WeakPolarHBondContact O-CB 3.12Å; D476-A479 PolarHBondContact O-N 3.46Å; L477-A479 PolarHBondContact O-N 3.42Å; A479-I481 PolarHBondContact O-N 3.1Å; A479-G482 PolarHBondContact O-N 3.34Å
480Q50.8Low53.2Low116 Ų116118 Ų11854%0.54260%0.601SS.*Hα-helixtrans-68.4-13166.9-63.9-177.612.600113L477 G482 D483 K484L477-Q480 HydrophobicContact CD2-CB 4.39Å; L477-Q480 HydrophobicContact CG-CB 4.4Å; L477-Q480 HydrophobicContact CG-CG 4.32Å; L477-Q480 CarbonylContact O-C 3.57Å; L477-Q480 WeakPolarHBondContact O-CA 3.38Å; L477-Q480 VanDerWaalsContact O-CB 3.26Å; L477-Q480 WeakPolarHBondContact O-CB 3.48Å; L477-Q480 PolarHBondContact O-N 3.31Å; Q480-G482 VanDerWaalsContact C-N 3.26Å; Q480-G482 PolarHBondContact O-N 3.1Å; Q480-D483 PolarHBondContact O-N 3.38Å; Q480-K484 PolarHBondContact O-N 3.44Å
481I50.3Low54Low102 Ų102115.3 Ų115.352%0.52359%0.59SS.*Hα-helixtrans-72-15.7171.9-65.5178.8000112.4L477 V478 A479 N485L477-I481 PolarHBondContact O-N 3.02Å; V478-I481 HydrophobicContact CB-CD1 4.26Å; V478-I481 HydrophobicContact CG2-CD1 3.76Å; A479-I481 PolarHBondContact O-N 3.1Å; I481-N485 PolarHBondContact O-ND2 3.1Å
482G49.9Very low54.4Low27 Ų27116 Ų11628%0.27859%0.586SS.*Hα-helixtrans-63.8-73.1158.200000110.2A479 Q480 K484 N485A479-G482 PolarHBondContact O-N 3.34Å; Q480-G482 VanDerWaalsContact C-N 3.26Å; Q480-G482 PolarHBondContact O-N 3.1Å; G482-K484 VanDerWaalsContact C-N 3.29Å; G482-K484 PolarHBondContact O-N 2.97Å; G482-N485 WeakPolarHBondContact O-CB 3.43Å; G482-N485 PolarHBondContact O-N 2.92Å
483D56.9Low54.6Low142 Ų142115.4 Ų115.476%0.75958%0.583SS**Hα-helixtrans-64.3-28.8-156.726.4-93.3000115.1Q480 L486Q480-D483 PolarHBondContact O-N 3.38Å; D483-L486 WeakPolarHBondContact O-CB 3.47Å; D483-L486 PolarHBondContact O-N 3.32Å; D483-L486 VanDerWaalsContact O-N 3.16Å
484K58.5Low55.2Low142 Ų142110.7 Ų110.762%0.61757%0.566SS**THydrogen-bonded Turntrans-83.1-2.7176.4-88.3-176.8178.1171.30114.4Q480 G482 L486 Y487 V488Q480-K484 PolarHBondContact O-N 3.44Å; G482-K484 VanDerWaalsContact C-N 3.29Å; G482-K484 PolarHBondContact O-N 2.97Å; K484-L486 PolarHBondContact O-N 3.37Å; K484-L486 VanDerWaalsContact O-N 3.15Å; K484-Y487 WeakPolarHBondContact O-CA 3.36Å; K484-Y487 WeakPolarHBondContact O-CB 3.37Å; K484-Y487 PolarHBondContact O-N 3.17Å; K484-V488 PolarHBondContact O-N 3.35Å
485N58.1Low55.6Low109 Ų109110.4 Ų110.458%0.58357%0.565SS**Hα-helixtrans-62.7-12.9157.7-74.1-37.8000111.5I481 G482 V488I481-N485 PolarHBondContact O-ND2 3.1Å; G482-N485 WeakPolarHBondContact O-CB 3.43Å; G482-N485 PolarHBondContact O-N 2.92Å; N485-V488 WeakPolarHBondContact O-CB 3.32Å
486L55.5Low56Low122 Ų122105.4 Ų105.464%0.63955%0.553SS**Hα-helixtrans-73.7-29.7161.8-15286.1000113.4D483 K484 V488 L489 E490D483-L486 WeakPolarHBondContact O-CB 3.47Å; D483-L486 PolarHBondContact O-N 3.32Å; D483-L486 VanDerWaalsContact O-N 3.16Å; K484-L486 PolarHBondContact O-N 3.37Å; K484-L486 VanDerWaalsContact O-N 3.15Å; L486-V488 VanDerWaalsContact C-N 3.28Å; L486-V488 PolarHBondContact O-N 3.3Å; L486-L489 WeakPolarHBondContact O-CA 3.45Å; L486-L489 WeakPolarHBondContact O-CB 3.48Å; L486-L489 PolarHBondContact O-N 2.94Å; L486-E490 PolarHBondContact O-N 2.83Å
487Y52.8Low56.4Low137 Ų137106 Ų10654%0.53755%0.549SS..Hα-helixtrans-68.2-29172.2179.1-92.6000111.7K484 L489 E490 M491K484-Y487 WeakPolarHBondContact O-CA 3.36Å; K484-Y487 WeakPolarHBondContact O-CB 3.37Å; K484-Y487 PolarHBondContact O-N 3.17Å; Y487-L489 PolarHBondContact O-N 3.3Å; Y487-E490 WeakPolarHBondContact CD2-OE2 3.43Å; Y487-E490 WeakPolarHBondContact O-CA 3.35Å; Y487-E490 WeakPolarHBondContact O-CB 3.27Å; Y487-E490 PolarHBondContact O-N 3.08Å; Y487-E490 VanDerWaalsContact O-N 3.09Å; Y487-M491 PolarHBondContact O-N 3.45Å
488V61.4Low56.8Low88 Ų88108.3 Ų108.353%0.53356%0.555SS.*Hα-helixtrans-62.8-31.3169-176.80000110.7K484 N485 L486 M491 F492K484-V488 PolarHBondContact O-N 3.35Å; N485-V488 WeakPolarHBondContact O-CB 3.32Å; L486-V488 VanDerWaalsContact C-N 3.28Å; L486-V488 PolarHBondContact O-N 3.3Å; V488-M491 VanDerWaalsContact O-CB 3.27Å; V488-M491 WeakPolarHBondContact O-CB 3.46Å; V488-M491 PolarHBondContact O-N 2.88Å; V488-F492 PolarHBondContact O-N 3.31Å
489L57.2Low56.9Low112 Ų112111.1 Ų111.159%0.58656%0.561SS**Hα-helixtrans-69.4-36.4170.6-155.574.6000112.2L486 Y487 M491 F492 N493L486-L489 WeakPolarHBondContact O-CA 3.45Å; L486-L489 WeakPolarHBondContact O-CB 3.48Å; L486-L489 PolarHBondContact O-N 2.94Å; Y487-L489 PolarHBondContact O-N 3.3Å; L489-M491 VanDerWaalsContact C-N 3.28Å; L489-M491 PolarHBondContact O-N 2.76Å; L489-F492 WeakPolarHBondContact O-CB 3.34Å; L489-F492 PolarHBondContact O-N 3.14Å; L489-F492 VanDerWaalsContact O-N 3.12Å; L489-N493 PolarHBondContact O-N 3.47Å
490E55.5Low57.5Low111 Ų111111.5 Ų111.552%0.51955%0.552SS.*Hα-helixtrans-63.6-34.1170-74.1-172.2132.900112.3L486 Y487 F492 N493 T494L486-E490 PolarHBondContact O-N 2.83Å; Y487-E490 WeakPolarHBondContact CD2-OE2 3.43Å; Y487-E490 WeakPolarHBondContact O-CA 3.35Å; Y487-E490 WeakPolarHBondContact O-CB 3.27Å; Y487-E490 PolarHBondContact O-N 3.08Å; Y487-E490 VanDerWaalsContact O-N 3.09Å; E490-F492 VanDerWaalsContact C-N 3.29Å; E490-F492 PolarHBondContact O-N 2.86Å; E490-N493 WeakPolarHBondContact O-CB 3.47Å; E490-N493 PolarHBondContact O-N 3.12Å; E490-T494 PolarHBondContact O-N 3.27Å; E490-T494 PolarHBondContact O-OG1 3.28Å
491M60.1Low58.1Low115 Ų115111 Ų11157%0.56755%0.552SS**Hα-helixtrans-63.4-35.1171.3-108.7-141.954.300112.3Y487 V488 L489 T494 L495Y487-M491 PolarHBondContact O-N 3.45Å; V488-M491 VanDerWaalsContact O-CB 3.27Å; V488-M491 WeakPolarHBondContact O-CB 3.46Å; V488-M491 PolarHBondContact O-N 2.88Å; L489-M491 VanDerWaalsContact C-N 3.28Å; L489-M491 PolarHBondContact O-N 2.76Å; M491-T494 WeakPolarHBondContact O-CB 3.43Å; M491-T494 PolarHBondContact O-N 3.12Å; M491-L495 PolarHBondContact O-N 3.1Å
492F56.9Low58.4Low151 Ų151110.9 Ų110.966%0.66255%0.552SS**Hα-helixtrans-69.3-39.8173.4-152.1-90.6000112.1V488 L489 E490 T494 L495 N496V488-F492 PolarHBondContact O-N 3.31Å; L489-F492 WeakPolarHBondContact O-CB 3.34Å; L489-F492 PolarHBondContact O-N 3.14Å; L489-F492 VanDerWaalsContact O-N 3.12Å; E490-F492 VanDerWaalsContact C-N 3.29Å; E490-F492 PolarHBondContact O-N 2.86Å; F492-T494 PolarHBondContact O-N 2.86Å; F492-L495 WeakPolarHBondContact O-CA 3.42Å; F492-L495 VanDerWaalsContact O-CB 3.24Å; F492-L495 WeakPolarHBondContact O-CB 3.41Å; F492-L495 PolarHBondContact O-N 3.2Å; F492-L495 VanDerWaalsContact O-N 3.1Å; F492-N496 PolarHBondContact O-N 2.85Å
493N60.9Low58.7Low92 Ų92115.3 Ų115.349%0.49257%0.566SS.*Hα-helixtrans-62-32.1169.7-81.6-29000112.6L489 E490 L495 N496 K497L489-N493 PolarHBondContact O-N 3.47Å; E490-N493 WeakPolarHBondContact O-CB 3.47Å; E490-N493 PolarHBondContact O-N 3.12Å; N493-L495 VanDerWaalsContact C-N 3.34Å; N493-N496 WeakPolarHBondContact O-CB 3.43Å; N493-N496 PolarHBondContact O-N 3.38Å; N493-K497 PolarHBondContact O-N 3.09Å
494T59.6Low59Low69 Ų69112.7 Ų112.742%0.42355%0.551SS.*Hα-helixtrans-69-34.5174.5-53.50000111.4E490 M491 F492 N496 K497 K498E490-T494 PolarHBondContact O-N 3.27Å; E490-T494 PolarHBondContact O-OG1 3.28Å; M491-T494 WeakPolarHBondContact O-CB 3.43Å; M491-T494 PolarHBondContact O-N 3.12Å; F492-T494 PolarHBondContact O-N 2.86Å; T494-N496 VanDerWaalsContact C-N 3.35Å; T494-K497 PolarHBondContact O-N 3.21Å; T494-K498 PolarHBondContact O-N 2.92Å
495L55.7Low59.1Low104 Ų104111.4 Ų111.455%0.54555%0.548SS..Hα-helixtrans-64.5-39.8170.3-147.984.8000111.5M491 F492 N493 K497 K498 F499M491-L495 PolarHBondContact O-N 3.1Å; F492-L495 WeakPolarHBondContact O-CA 3.42Å; F492-L495 VanDerWaalsContact O-CB 3.24Å; F492-L495 WeakPolarHBondContact O-CB 3.41Å; F492-L495 PolarHBondContact O-N 3.2Å; F492-L495 VanDerWaalsContact O-N 3.1Å; N493-L495 VanDerWaalsContact C-N 3.34Å; L495-K497 VanDerWaalsContact C-N 3.35Å; L495-K497 PolarHBondContact O-N 3.17Å; L495-K498 WeakPolarHBondContact O-CB 3.35Å; L495-K498 PolarHBondContact O-N 3.19Å; L495-K498 VanDerWaalsContact O-N 3.09Å; L495-F499 PolarHBondContact O-N 2.92Å; L495-F499 VanDerWaalsContact O-N 3.13Å
496N61.5Low58.8Low91 Ų91110 Ų11049%0.48754%0.543SS..Hα-helixtrans-65-36.4176.1-160.125.3000112.3F492 N493 T494 K498 F499 I500F492-N496 PolarHBondContact O-N 2.85Å; N493-N496 WeakPolarHBondContact O-CB 3.43Å; N493-N496 PolarHBondContact O-N 3.38Å; T494-N496 VanDerWaalsContact C-N 3.35Å; N496-K498 VanDerWaalsContact C-N 3.3Å; N496-K498 PolarHBondContact O-N 3.47Å; N496-F499 WeakPolarHBondContact O-CB 3.46Å; N496-F499 PolarHBondContact O-N 2.86Å; N496-F499 VanDerWaalsContact O-N 3.09Å; N496-I500 PolarHBondContact O-N 2.95Å
497K61.5Low59.1Low149 Ų149107 Ų10765%0.64853%0.53SS*.Hα-helixtrans-61.5-36.4170.4-71.7176.6-178.51750112.5N493 T494 L495 F499 I500 L501N493-K497 PolarHBondContact O-N 3.09Å; T494-K497 PolarHBondContact O-N 3.21Å; L495-K497 VanDerWaalsContact C-N 3.35Å; L495-K497 PolarHBondContact O-N 3.17Å; K497-F499 VanDerWaalsContact C-N 3.28Å; K497-F499 PolarHBondContact O-N 3.36Å; K497-I500 PolarHBondContact O-N 3.11Å; K497-L501 PolarHBondContact O-N 3.41Å
498K61.2Low59.3Low138 Ų138103.8 Ų103.860%0.653%0.525SS*.Hα-helixtrans-67.8-29.5173.7-69.8-178.3177.1-1790112.2T494 L495 N496 L501 L502T494-K498 PolarHBondContact O-N 2.92Å; L495-K498 WeakPolarHBondContact O-CB 3.35Å; L495-K498 PolarHBondContact O-N 3.19Å; L495-K498 VanDerWaalsContact O-N 3.09Å; N496-K498 VanDerWaalsContact C-N 3.3Å; N496-K498 PolarHBondContact O-N 3.47Å; K498-L501 WeakPolarHBondContact O-CB 3.39Å; K498-L501 PolarHBondContact O-N 2.88Å; K498-L502 PolarHBondContact O-N 3.01Å
499F58.2Low58.9Low143 Ų143105 Ų10563%0.62753%0.528SS*.Hα-helixtrans-71.2-41.3174.2-157.8-94000112.2L495 N496 K497 L501 L502 E503L495-F499 PolarHBondContact O-N 2.92Å; L495-F499 VanDerWaalsContact O-N 3.13Å; N496-F499 WeakPolarHBondContact O-CB 3.46Å; N496-F499 PolarHBondContact O-N 2.86Å; N496-F499 VanDerWaalsContact O-N 3.09Å; K497-F499 VanDerWaalsContact C-N 3.28Å; K497-F499 PolarHBondContact O-N 3.36Å; F499-L501 PolarHBondContact O-N 3.47Å; F499-L502 WeakPolarHBondContact O-CB 3.36Å; F499-L502 PolarHBondContact O-N 3.16Å; F499-L502 VanDerWaalsContact O-N 3.12Å; F499-E503 PolarHBondContact O-N 3.49Å; F499-E503 VanDerWaalsContact O-N 3.12Å
500I64.9Low59Low82 Ų82108.2 Ų108.242%0.42153%0.532SS..Hα-helixtrans-62.1-33.5171.9-64.3169.4000111.3N496 K497 L502 E503 N504N496-I500 PolarHBondContact O-N 2.95Å; K497-I500 PolarHBondContact O-N 3.11Å; I500-L502 VanDerWaalsContact C-N 3.34Å; I500-L502 PolarHBondContact O-N 3.18Å; I500-E503 PolarHBondContact O-N 3.5Å; I500-N504 PolarHBondContact O-N 3.01Å; I500-N504 PolarHBondContact O-ND2 2.9Å
501L62.9Low59.2Low105 Ų105105.9 Ų105.955%0.5553%0.528SS..Hα-helixtrans-62.5-40.1174-166.277.2000112K497 K498 F499 N504 Q505K497-L501 PolarHBondContact O-N 3.41Å; K498-L501 WeakPolarHBondContact O-CB 3.39Å; K498-L501 PolarHBondContact O-N 2.88Å; F499-L501 PolarHBondContact O-N 3.47Å; L501-N504 PolarHBondContact O-N 2.92Å; L501-Q505 WeakPolarHBondContact O-CG 3.27Å; L501-Q505 PolarHBondContact O-N 3.46Å
502L56.4Low58.8Low100 Ų100106.6 Ų106.652%0.52453%0.53SS..Hα-helixtrans-65.4-36.8173.8-83.1150.1000111.9K498 F499 I500 Q505 T506K498-L502 PolarHBondContact O-N 3.01Å; F499-L502 WeakPolarHBondContact O-CB 3.36Å; F499-L502 PolarHBondContact O-N 3.16Å; F499-L502 VanDerWaalsContact O-N 3.12Å; I500-L502 VanDerWaalsContact C-N 3.34Å; I500-L502 PolarHBondContact O-N 3.18Å; L502-Q505 PolarHBondContact O-N 3.26Å; L502-T506 PolarHBondContact O-N 3.39Å; L502-T506 PolarHBondContact O-OG1 2.87Å
503E56.1Low58.7Low120 Ų120106.6 Ų106.656%0.56153%0.53SS*.Hα-helixtrans-66.4-40.3175.1-168.3172.4-162.100112.1F499 I500 Q505 T506 T507F499-E503 PolarHBondContact O-N 3.49Å; F499-E503 VanDerWaalsContact O-N 3.12Å; I500-E503 PolarHBondContact O-N 3.5Å; E503-Q505 VanDerWaalsContact C-N 3.34Å; E503-Q505 PolarHBondContact O-N 2.92Å; E503-T506 WeakPolarHBondContact O-CA 3.36Å; E503-T506 WeakPolarHBondContact O-CB 3.5Å; E503-T506 PolarHBondContact O-N 3.33Å; E503-T507 PolarHBondContact O-N 2.79Å; E503-T507 VanDerWaalsContact O-N 3.08Å
504N64.6Low58.7Low86 Ų86109.3 Ų109.346%0.4654%0.537SS..Hα-helixtrans-66.9-32.1174-74.6-29.1000113.1I500 L501 T506 T507 T508I500-N504 PolarHBondContact O-N 3.01Å; I500-N504 PolarHBondContact O-ND2 2.9Å; L501-N504 PolarHBondContact O-N 2.92Å; N504-T506 PolarHBondContact O-N 3.49Å; N504-T507 WeakPolarHBondContact CA-OG1 3.33Å; N504-T507 PolarHBondContact O-N 3.47Å; N504-T507 PolarHBondContact O-OG1 2.85Å; N504-T508 WeakPolarHBondContact O-CB 3.47Å; N504-T508 PolarHBondContact O-N 3.45Å; N504-T508 PolarHBondContact O-OG1 3.02Å
505Q61Low58.3Low115 Ų115110 Ų11054%0.53754%0.544SS..Hα-helixtrans-64-31.2169.8-74.1176.6-19.900111.5L501 L502 E503 L509L501-Q505 WeakPolarHBondContact O-CG 3.27Å; L501-Q505 PolarHBondContact O-N 3.46Å; L502-Q505 PolarHBondContact O-N 3.26Å; E503-Q505 VanDerWaalsContact C-N 3.34Å; E503-Q505 PolarHBondContact O-N 2.92Å; Q505-L509 PolarHBondContact O-N 3.19Å
506T51.7Low58.1Low79 Ų79112.2 Ų112.249%0.48555%0.549SS..Hα-helixtrans-73.2-36.7176.7-440000112.6L502 E503 N504 R510L502-T506 PolarHBondContact O-N 3.39Å; L502-T506 PolarHBondContact O-OG1 2.87Å; E503-T506 WeakPolarHBondContact O-CA 3.36Å; E503-T506 WeakPolarHBondContact O-CB 3.5Å; E503-T506 PolarHBondContact O-N 3.33Å; N504-T506 PolarHBondContact O-N 3.49Å; T506-R510 PolarHBondContact O-N 2.85Å
507T61.7Low57.7Low61 Ų61112.2 Ų112.237%0.37455%0.553SS.*Hα-helixtrans-75.5-34.2176.357.90000112.7E503 N504 L509 R510 S511E503-T507 PolarHBondContact O-N 2.79Å; E503-T507 VanDerWaalsContact O-N 3.08Å; N504-T507 WeakPolarHBondContact CA-OG1 3.33Å; N504-T507 PolarHBondContact O-N 3.47Å; N504-T507 PolarHBondContact O-OG1 2.85Å; T507-L509 VanDerWaalsContact C-N 3.34Å; T507-R510 WeakPolarHBondContact O-CB 3.43Å; T507-R510 PolarHBondContact O-N 3.49Å; T507-R510 VanDerWaalsContact O-N 3.16Å; T507-S511 PolarHBondContact O-N 2.81Å
508T55.3Low57.7Low68 Ų68110.1 Ų110.142%0.41755%0.549SS..Hα-helixtrans-61.7-44.3173.6-510000110.4N504 R510 S511 H512N504-T508 WeakPolarHBondContact O-CB 3.47Å; N504-T508 PolarHBondContact O-N 3.45Å; N504-T508 PolarHBondContact O-OG1 3.02Å; T508-R510 VanDerWaalsContact C-N 3.31Å; T508-R510 PolarHBondContact O-N 3.13Å; T508-S511 PolarHBondContact O-N 2.94Å; T508-S511 PolarHBondContact O-OG 3.42Å; T508-H512 PolarHBondContact O-CD2 3.42Å; T508-H512 PolarHBondContact O-N 3.36Å; T508-H512 VanDerWaalsContact O-N 3.08Å
509L54.8Low57.7Low115 Ų115110.7 Ų110.760%0.60255%0.551SS**Hα-helixtrans-56.6-43.3172.9-126.482000111.9Q505 T507 S511 H512 F513Q505-L509 PolarHBondContact O-N 3.19Å; T507-L509 VanDerWaalsContact C-N 3.34Å; L509-S511 PolarHBondContact O-N 3.01Å; L509-H512 PolarHBondContact O-N 3.42Å; L509-F513 WeakPolarHBondContact O-CD2 3.45Å; L509-F513 PolarHBondContact O-N 3.31Å
510R58.4Low57.7Low179 Ų179107.6 Ų107.668%0.67554%0.54SS*.Hα-helixtrans-64.7-35.4178.7-163.8179.9-67161.9-0112.9T506 T507 T508 K514T506-R510 PolarHBondContact O-N 2.85Å; T507-R510 WeakPolarHBondContact O-CB 3.43Å; T507-R510 PolarHBondContact O-N 3.49Å; T507-R510 VanDerWaalsContact O-N 3.16Å; T508-R510 VanDerWaalsContact C-N 3.31Å; T508-R510 PolarHBondContact O-N 3.13Å; R510-K514 PolarHBondContact O-N 3.44Å
511S60.6Low57.4Low62 Ų62105.3 Ų105.343%0.43454%0.537SS..Hα-helixtrans-74.4-36.4177.975.10000113T507 T508 L509 K514 C515T507-S511 PolarHBondContact O-N 2.81Å; T508-S511 PolarHBondContact O-N 2.94Å; T508-S511 PolarHBondContact O-OG 3.42Å; L509-S511 PolarHBondContact O-N 3.01Å; S511-K514 WeakPolarHBondContact O-CB 3.18Å; S511-K514 PolarHBondContact O-N 2.78Å; S511-C515 PolarHBondContact O-N 2.93Å
512H51.7Low57.4Low130 Ų130105.5 Ų105.560%0.60254%0.539SS*.Hα-helixtrans-66.9-42.8177.2-79.2-145.8000111.1T508 L509 K514 C515 F516T508-H512 PolarHBondContact O-CD2 3.42Å; T508-H512 PolarHBondContact O-N 3.36Å; T508-H512 VanDerWaalsContact O-N 3.08Å; L509-H512 PolarHBondContact O-N 3.42Å; H512-K514 VanDerWaalsContact C-N 3.31Å; H512-K514 PolarHBondContact O-N 2.93Å; H512-C515 PolarHBondContact O-N 2.96Å; H512-F516 PolarHBondContact O-N 3.21Å
513F54.7Low57.2Low150 Ų150106.4 Ų106.466%0.65854%0.542SS*.Hα-helixtrans-58.8-41.9172.4-91.8-76.9000111.9L509 F516 T517L509-F513 WeakPolarHBondContact O-CD2 3.45Å; L509-F513 PolarHBondContact O-N 3.31Å; F513-F516 WeakPolarHBondContact O-CB 3.37Å; F513-F516 PolarHBondContact O-N 3Å; F513-T517 PolarHBondContact O-N 3Å; F513-T517 PolarHBondContact O-OG1 3.18Å
514K60.7Low57.4Low149 Ų149105.2 Ų105.265%0.64854%0.538SS*.Hα-helixtrans-64.7-38.9176.7-166.1174.3-175.3177.70113R510 S511 H512 F516 T517 N518R510-K514 PolarHBondContact O-N 3.44Å; S511-K514 WeakPolarHBondContact O-CB 3.18Å; S511-K514 PolarHBondContact O-N 2.78Å; H512-K514 VanDerWaalsContact C-N 3.31Å; H512-K514 PolarHBondContact O-N 2.93Å; K514-F516 VanDerWaalsContact C-N 3.31Å; K514-T517 PolarHBondContact O-N 3.22Å; K514-N518 PolarHBondContact O-N 3.35Å
515C51.6Low57.2Low84 Ų84103.8 Ų103.857%0.56854%0.538SS*.Hα-helixtrans-66.3-35.8174.5-165.90000111.7S511 H512 K519S511-C515 PolarHBondContact O-N 2.93Å; H512-C515 PolarHBondContact O-N 2.96Å; C515-K519 PolarHBondContact O-N 3.06Å; C515-K519 VanDerWaalsContact O-N 3.11Å
516F50.2Low57.3Low150 Ų150105.6 Ų105.666%0.65854%0.544SS*.Hα-helixtrans-64.7-44.6175.4-139.7-88.6000111.4H512 F513 K514 K519 I520H512-F516 PolarHBondContact O-N 3.21Å; F513-F516 WeakPolarHBondContact O-CB 3.37Å; F513-F516 PolarHBondContact O-N 3Å; K514-F516 VanDerWaalsContact C-N 3.31Å; F516-K519 PolarHBondContact O-N 3.49Å; F516-I520 HydrophobicContact CD1-CD1 4.04Å; F516-I520 HydrophobicContact CE1-CD1 4.44Å; F516-I520 WeakPolarHBondContact O-CG1 3.49Å; F516-I520 PolarHBondContact O-N 3.37Å
517T53.3Low57.4Low92 Ų92107.7 Ų107.756%0.56455%0.552SS**Hα-helixtrans-64.7-41.2177.3-42.60000112.3F513 K514 K519 I520 G521F513-T517 PolarHBondContact O-N 3Å; F513-T517 PolarHBondContact O-OG1 3.18Å; K514-T517 PolarHBondContact O-N 3.22Å; T517-K519 PolarHBondContact O-N 3.27Å; T517-I520 PolarHBondContact O-N 3.07Å; T517-G521 PolarHBondContact O-N 3.23Å
518N62.4Low57.3Low104 Ų104109 Ų10956%0.55656%0.556SS**Hα-helixtrans-66.2-36.1177.5-85.42.6000113K514 G521 N522K514-N518 PolarHBondContact O-N 3.35Å; N518-G521 PolarHBondContact O-N 3.34Å; N518-N522 PolarHBondContact O-N 2.94Å
519K61.1Low57.3Low151 Ų151108.7 Ų108.766%0.65756%0.557SS**Hα-helixtrans-69.9-35.6178.7-143.6170.4-172.8177.10111.5C515 F516 T517 N522 M523C515-K519 PolarHBondContact O-N 3.06Å; C515-K519 VanDerWaalsContact O-N 3.11Å; F516-K519 PolarHBondContact O-N 3.49Å; T517-K519 PolarHBondContact O-N 3.27Å; K519-N522 PolarHBondContact O-N 2.94Å; K519-M523 PolarHBondContact O-N 2.91Å; K519-M523 VanDerWaalsContact O-N 3.12Å
520I58.5Low57.2Low77 Ų77108.4 Ų108.440%0.39555%0.551SS.*Hα-helixtrans-62.3-44.5169.2-67.3169.8000110.4F516 T517 N522 M523 I524F516-I520 HydrophobicContact CD1-CD1 4.04Å; F516-I520 HydrophobicContact CE1-CD1 4.44Å; F516-I520 WeakPolarHBondContact O-CG1 3.49Å; F516-I520 PolarHBondContact O-N 3.37Å; T517-I520 PolarHBondContact O-N 3.07Å; I520-N522 VanDerWaalsContact C-N 3.33Å; I520-N522 PolarHBondContact O-N 3.44Å; I520-M523 HydrophobicContact CB-CE 4.49Å; I520-M523 HydrophobicContact CG1-CE 4.1Å; I520-M523 PolarHBondContact O-N 3.42Å; I520-I524 HydrophobicContact CG2-CD1 3.8Å; I520-I524 WeakPolarHBondContact O-CG1 3.48Å; I520-I524 PolarHBondContact O-N 2.86Å
521G56.8Low57.1Low34 Ų34105.3 Ų105.335%0.35154%0.544SS..Hα-helixtrans-57.7-41.717500000113.4T517 N518 I524 A525T517-G521 PolarHBondContact O-N 3.23Å; N518-G521 PolarHBondContact O-N 3.34Å; G521-I524 PolarHBondContact O-N 3.28Å; G521-A525 WeakPolarHBondContact O-CB 3.44Å; G521-A525 PolarHBondContact O-N 3.28Å
522N64.8Low56.8Low110 Ų110107.1 Ų107.159%0.58855%0.552SS**Hα-helixtrans-69.8-33.4177.6-77.1-8.9000113.4N518 K519 I520 K526N518-N522 PolarHBondContact O-N 2.94Å; K519-N522 PolarHBondContact O-N 2.94Å; I520-N522 VanDerWaalsContact C-N 3.33Å; I520-N522 PolarHBondContact O-N 3.44Å; N522-K526 WeakPolarHBondContact O-CB 3.42Å; N522-K526 PolarHBondContact O-N 3.47Å
523M51.1Low57Low119 Ų119107.5 Ų107.559%0.58656%0.555SS**Hα-helixtrans-66.7-40.8172.9-73-174.8-62.700111.4K519 I520 L527K519-M523 PolarHBondContact O-N 2.91Å; K519-M523 VanDerWaalsContact O-N 3.12Å; I520-M523 HydrophobicContact CB-CE 4.49Å; I520-M523 HydrophobicContact CG1-CE 4.1Å; I520-M523 PolarHBondContact O-N 3.42Å; M523-L527 WeakPolarHBondContact O-CB 3.2Å; M523-L527 PolarHBondContact O-N 3.16Å; M523-L527 VanDerWaalsContact O-N 3.13Å
524I61.1Low56.5Low95 Ų95107.2 Ų107.249%0.48756%0.555SS.*Hα-helixtrans-68.1-42.1177.4-65.1167.6000110.9I520 G521 L527 N528I520-I524 HydrophobicContact CG2-CD1 3.8Å; I520-I524 WeakPolarHBondContact O-CG1 3.48Å; I520-I524 PolarHBondContact O-N 2.86Å; G521-I524 PolarHBondContact O-N 3.28Å; I524-L527 PolarHBondContact O-N 3.45Å; I524-N528 PolarHBondContact O-N 2.86Å
525A59.9Low55.3Low55 Ų55107.2 Ų107.246%0.45556%0.558SS.*Hα-helixtrans-65.5-39.9178.800000112.6G521 N528 S529G521-A525 WeakPolarHBondContact O-CB 3.44Å; G521-A525 PolarHBondContact O-N 3.28Å; A525-N528 PolarHBondContact O-N 3.46Å; A525-S529 WeakPolarHBondContact O-CB 3.37Å; A525-S529 PolarHBondContact O-N 3Å; A525-S529 PolarHBondContact O-OG 3.35Å
526K63.2Low54.7Low153 Ų153110.3 Ų110.367%0.66557%0.569SS**Hα-helixtrans-67-42.2176-82.6-172173.9-1700112.3N522 N528 S529 F530N522-K526 WeakPolarHBondContact O-CB 3.42Å; N522-K526 PolarHBondContact O-N 3.47Å; K526-N528 VanDerWaalsContact C-N 3.32Å; K526-N528 PolarHBondContact O-N 2.83Å; K526-S529 WeakPolarHBondContact CA-OG 3.49Å; K526-S529 PolarHBondContact O-N 3.44Å; K526-S529 PolarHBondContact O-OG 3.24Å; K526-F530 PolarHBondContact O-N 3.39Å
527L53.2Low54.2Low123 Ų123107.2 Ų107.264%0.64457%0.566SS**Hα-helixtrans-59.2-44.6176.5-133133.4000110.9M523 I524 Q531M523-L527 WeakPolarHBondContact O-CB 3.2Å; M523-L527 PolarHBondContact O-N 3.16Å; M523-L527 VanDerWaalsContact O-N 3.13Å; I524-L527 PolarHBondContact O-N 3.45Å; L527-Q531 WeakPolarHBondContact O-CB 3.48Å; L527-Q531 PolarHBondContact O-N 2.81Å; L527-Q531 VanDerWaalsContact O-N 3.11Å
528N59.5Low53.8Low88 Ų88112.6 Ų112.647%0.47158%0.581SS.*Hα-helixtrans-70.6-37.1177.2-69.5-15.2000112.8I524 A525 K526 F530 Q531 V532I524-N528 PolarHBondContact O-N 2.86Å; A525-N528 PolarHBondContact O-N 3.46Å; K526-N528 VanDerWaalsContact C-N 3.32Å; K526-N528 PolarHBondContact O-N 2.83Å; N528-F530 VanDerWaalsContact C-N 3.34Å; N528-F530 PolarHBondContact O-N 2.97Å; N528-Q531 PolarHBondContact O-N 2.91Å; N528-V532 WeakPolarHBondContact O-CG2 3.48Å; N528-V532 PolarHBondContact O-N 3.26Å; N528-V532 VanDerWaalsContact O-N 3.1Å
529S56.1Low53.1Low62 Ų62116.2 Ų116.243%0.43460%0.595SS.*Hα-helixtrans-66.7-34.8177.370.80000112.8A525 K526 V532 Q533A525-S529 WeakPolarHBondContact O-CB 3.37Å; A525-S529 PolarHBondContact O-N 3Å; A525-S529 PolarHBondContact O-OG 3.35Å; K526-S529 WeakPolarHBondContact CA-OG 3.49Å; K526-S529 PolarHBondContact O-N 3.44Å; K526-S529 PolarHBondContact O-OG 3.24Å; S529-V532 PolarHBondContact O-N 2.8Å; S529-Q533 PolarHBondContact O-N 2.98Å
530F53.3Low52.4Low109 Ų109118 Ų11848%0.47861%0.606SS.*Hα-helixtrans-69.5-37173-111.3-84.6000111.6K526 N528 V532 Q534 M541K526-F530 PolarHBondContact O-N 3.39Å; N528-F530 VanDerWaalsContact C-N 3.34Å; N528-F530 PolarHBondContact O-N 2.97Å; F530-V532 PolarHBondContact O-N 2.96Å; F530-Q534 PolarHBondContact O-N 3.5Å; F530-M541 HydrophobicContact CE1-SD 4.45Å
531Q55.1Low51.5Low115 Ų115117.9 Ų117.954%0.53760%0.604SS.*Hα-helixtrans-71-13.4176.6-149.5166.6-2.200113L527 N528 Q534L527-Q531 WeakPolarHBondContact O-CB 3.48Å; L527-Q531 PolarHBondContact O-N 2.81Å; L527-Q531 VanDerWaalsContact O-N 3.11Å; N528-Q531 PolarHBondContact O-N 2.91Å; Q531-Q534 WeakPolarHBondContact O-CB 3.47Å; Q531-Q534 PolarHBondContact O-OE1 3Å
532V53.9Low51.2Low99 Ų99121.8 Ų121.860%0.662%0.621SS**Hα-helixtrans-100.3-32.6175.4174.10000112.9N528 S529 F530 Q534 E535N528-V532 WeakPolarHBondContact O-CG2 3.48Å; N528-V532 PolarHBondContact O-N 3.26Å; N528-V532 VanDerWaalsContact O-N 3.1Å; S529-V532 PolarHBondContact O-N 2.8Å; F530-V532 PolarHBondContact O-N 2.96Å; V532-Q534 PolarHBondContact O-N 3Å; V532-E535 PolarHBondContact O-N 3.05Å
533Q56.8Low50.7Low139 Ų139122.9 Ų122.965%0.6563%0.625SS**Hα-helixtrans-68.7-9.1165.7-86.1-176.1-21.600113.1S529 E535S529-Q533 PolarHBondContact O-N 2.98Å; Q533-E535 PolarHBondContact O-N 2.71Å
534Q43.5Very low50.8Low144 Ų144123 Ų12367%0.67363%0.628SS**THydrogen-bonded Turntrans-57.6-16162.3-150.8172.434.100113.2F530 Q531 V532 N536F530-Q534 PolarHBondContact O-N 3.5Å; Q531-Q534 WeakPolarHBondContact O-CB 3.47Å; Q531-Q534 PolarHBondContact O-OE1 3Å; V532-Q534 PolarHBondContact O-N 3Å; Q534-N536 PolarHBondContact O-N 2.94Å
535E35.9Very low50.4Low149 Ų149122.8 Ų122.870%0.69663%0.628SS**SBendtrans-80.998.2165.8-70.4-172.6165.800110.9V532 Q533V532-E535 PolarHBondContact O-N 3.05Å; Q533-E535 PolarHBondContact O-N 2.71Å
536N39.6Very low50.5Low149 Ų149127.5 Ų127.580%0.79764%0.638SS**SBendtrans108.418.8143.5-55.1-34.7000122.4Q534Q534-N536 PolarHBondContact O-N 2.94Å
537S38.4Very low50.5Low85 Ų85125 Ų12559%0.59463%0.632SS**  trans-133.276.516756.80000113E539S537-E539 PolarHBondContact O-N 3.43Å
538K46.5Very low51.1Low205 Ų205125.1 Ų125.189%0.89163%0.629SS**  trans-67.692.9172.5-72179.2177.1176.80109.6
539E47.3Very low51.4Low180 Ų180127.5 Ų127.584%0.84164%0.637SS**SBend172.2-21.4120.5-94.1171.4168.400114.4S537 M541S537-E539 PolarHBondContact O-N 3.43Å; E539-M541 PolarHBondContact O-N 3.41Å
540E46.7Very low52Low189 Ų189130.2 Ų130.288%0.88364%0.643SS**THydrogen-bonded Turntrans-85.3-0.5-170-145.7164.2-168.800115.7
541M39.3Very low52.9Low74 Ų74129.9 Ų129.937%0.36565%0.646SS.*THydrogen-bonded Turntrans-95.83.8-172.9-148.4-170.8-57.800115.8F530 E539F530-M541 HydrophobicContact CE1-SD 4.45Å; E539-M541 PolarHBondContact O-N 3.41Å
542V49.4Very low53.4Low116 Ų116130.2 Ų130.270%0.70365%0.651SS**THydrogen-bonded Turntrans-85.3-22.1-177.51760000113.3
543I54.2Low54.1Low133 Ų133133.5 Ų133.568%0.68266%0.657SS**THydrogen-bonded Turntrans-84.6-46.4-173.3-61.6177000111.5L545 K546I543-L545 VanDerWaalsContact C-N 3.29Å; I543-L545 PolarHBondContact O-N 3.06Å; I543-K546 PolarHBondContact O-N 2.8Å; I543-K546 VanDerWaalsContact O-N 3.16Å
544D54.2Low54.6Low122 Ų122133.5 Ų133.565%0.65266%0.655SS**Hα-helixtrans-65.7-26.8-177-71.9-18.3000114K546 E548D544-K546 VanDerWaalsContact C-N 3.28Å; D544-K546 PolarHBondContact O-N 3.4Å; D544-E548 PolarHBondContact O-N 2.96Å
545L52.6Low55.8Low90 Ų90132.1 Ų132.147%0.47165%0.651SS.*Hα-helixtrans-67.9-25.4176.8-91162.7000113.5I543 Q549I543-L545 VanDerWaalsContact C-N 3.29Å; I543-L545 PolarHBondContact O-N 3.06Å; L545-Q549 PolarHBondContact O-N 2.99Å
546K62.2Low57.4Low154 Ų154127.9 Ų127.967%0.6764%0.642SS**Hα-helixtrans-77.6-38.3-176-149.7174.5-173.9178.50111.6I543 D544 Q550I543-K546 PolarHBondContact O-N 2.8Å; I543-K546 VanDerWaalsContact O-N 3.16Å; D544-K546 VanDerWaalsContact C-N 3.28Å; D544-K546 PolarHBondContact O-N 3.4Å; K546-Q550 PolarHBondContact O-N 3.17Å
547D63.3Low58.6Low100 Ų100127 Ų12754%0.53563%0.633SS.*Hα-helixtrans-71.8-37.7179-76.4-7.9000111.8Q550 N551D547-Q550 PolarHBondContact O-N 3.44Å; D547-N551 PolarHBondContact O-N 3.27Å
548E64.5Low60Low125 Ų125129.8 Ų129.858%0.58463%0.634SS**Hα-helixtrans-72.7-34.5-179.4-134.1167.5-169.500112.6D544 Q550 N551 I552D544-E548 PolarHBondContact O-N 2.96Å; E548-Q550 VanDerWaalsContact C-N 3.29Å; E548-Q550 PolarHBondContact O-N 3.29Å; E548-N551 PolarHBondContact O-N 3.46Å; E548-I552 WeakPolarHBondContact O-CG1 3.36Å; E548-I552 PolarHBondContact O-N 3.49Å
549Q66.2Low61.1Low139 Ų139125.5 Ų125.565%0.6562%0.62SS**Hα-helixtrans-61-37.2169.1-87.2-168.5-13.200112.5L545 N551 I552 K553L545-Q549 PolarHBondContact O-N 2.99Å; Q549-N551 VanDerWaalsContact C-N 3.34Å; Q549-I552 PolarHBondContact O-N 3.26Å; Q549-K553 PolarHBondContact O-N 3.43Å
550Q68.1Low62.1Low119 Ų119122 Ų12256%0.55661%0.607SS**Hα-helixtrans-71.2-31.9-178.5-155159.9-6.500111.9K546 D547 E548 K554K546-Q550 PolarHBondContact O-N 3.17Å; D547-Q550 PolarHBondContact O-N 3.44Å; E548-Q550 VanDerWaalsContact C-N 3.29Å; E548-Q550 PolarHBondContact O-N 3.29Å; Q550-K554 PolarHBondContact O-N 2.94Å
551N73.6Confident63Low102 Ų102118.5 Ų118.555%0.54559%0.591SS.*Hα-helixtrans-69.4-40.4173.3-76.8-29.4000113D547 E548 Q549 K553 K554 L555D547-N551 PolarHBondContact O-N 3.27Å; E548-N551 PolarHBondContact O-N 3.46Å; Q549-N551 VanDerWaalsContact C-N 3.34Å; N551-K553 VanDerWaalsContact C-N 3.32Å; N551-K553 PolarHBondContact O-N 3.31Å; N551-K554 PolarHBondContact O-N 2.91Å; N551-L555 PolarHBondContact O-N 3.29Å; N551-L555 VanDerWaalsContact O-N 3.14Å
552I65.3Low64.3Low122 Ų122122.5 Ų122.563%0.62661%0.606SS**Hα-helixtrans-63.3-39.5176.7-66.6171.4000110.8E548 Q549 K554 L555 A556E548-I552 WeakPolarHBondContact O-CG1 3.36Å; E548-I552 PolarHBondContact O-N 3.49Å; Q549-I552 PolarHBondContact O-N 3.26Å; I552-K554 PolarHBondContact O-N 3.4Å; I552-L555 PolarHBondContact O-N 2.98Å; I552-A556 PolarHBondContact O-N 2.84Å; I552-A556 VanDerWaalsContact O-N 3.08Å
553K68.3Low65.1Low168 Ų168120 Ų12073%0.7359%0.594SS**Hα-helixtrans-60.4-42.7175.1-106.4-178.5176.9177.20112.9Q549 N551 L555 A556 Q557Q549-K553 PolarHBondContact O-N 3.43Å; N551-K553 VanDerWaalsContact C-N 3.32Å; N551-K553 PolarHBondContact O-N 3.31Å; K553-L555 VanDerWaalsContact C-N 3.33Å; K553-L555 PolarHBondContact O-N 2.81Å; K553-A556 PolarHBondContact O-N 2.93Å; K553-Q557 PolarHBondContact O-N 3.47Å
554K66.9Low65.6Low139 Ų139118.6 Ų118.660%0.60459%0.586SS**Hα-helixtrans-64.3-36.5176.3-77.5-179.2178.5173.40112.5Q550 N551 I552 K558Q550-K554 PolarHBondContact O-N 2.94Å; N551-K554 PolarHBondContact O-N 2.91Å; I552-K554 PolarHBondContact O-N 3.4Å; K554-K558 PolarHBondContact O-N 3.33Å
555L68.4Low66Low114 Ų114117.7 Ų117.760%0.59759%0.585SS**Hα-helixtrans-69.6-40.5179.6-162.274000111.8N551 I552 K553 Q557 K558 I559N551-L555 PolarHBondContact O-N 3.29Å; N551-L555 VanDerWaalsContact O-N 3.14Å; I552-L555 PolarHBondContact O-N 2.98Å; K553-L555 VanDerWaalsContact C-N 3.33Å; K553-L555 PolarHBondContact O-N 2.81Å; L555-Q557 VanDerWaalsContact C-N 3.32Å; L555-Q557 PolarHBondContact O-N 3.49Å; L555-K558 PolarHBondContact O-N 2.9Å; L555-I559 WeakPolarHBondContact O-CG1 3.44Å; L555-I559 PolarHBondContact O-N 2.84Å
556A69.8Low66.6Low60 Ų60118.3 Ų118.350%0.49659%0.588SS.*Hα-helixtrans-60.7-39.7176.600000112.3I552 K553 I559 N560I552-A556 PolarHBondContact O-N 2.84Å; I552-A556 VanDerWaalsContact O-N 3.08Å; K553-A556 PolarHBondContact O-N 2.93Å; A556-I559 PolarHBondContact O-N 3.4Å; A556-N560 PolarHBondContact O-N 3.48Å
557Q65.8Low66.7Low130 Ų130117.1 Ų117.161%0.60758%0.584SS**Hα-helixtrans-65.2-41.7178.4-162.7171.51.100112.5K553 L555 I559 N560 E561K553-Q557 PolarHBondContact O-N 3.47Å; L555-Q557 VanDerWaalsContact C-N 3.32Å; L555-Q557 PolarHBondContact O-N 3.49Å; Q557-I559 VanDerWaalsContact C-N 3.31Å; Q557-I559 PolarHBondContact O-N 3.29Å; Q557-N560 PolarHBondContact O-N 3.5Å; Q557-E561 PolarHBondContact O-N 2.85Å
558K67.9Low66.7Low145 Ų145120.3 Ų120.363%0.6359%0.593SS**Hα-helixtrans-63.1-33.5175-82.3-175.3176.3179.70113.6K554 L555 K562K554-K558 PolarHBondContact O-N 3.33Å; L555-K558 PolarHBondContact O-N 2.9Å; K558-K562 PolarHBondContact O-N 3.42Å
559I68.8Low66.7Low114 Ų114121.3 Ų121.359%0.58560%0.596SS**Hα-helixtrans-68.4-40.7176.9-69.5170.7000110.1L555 A556 Q557 E561 K562 S563L555-I559 WeakPolarHBondContact O-CG1 3.44Å; L555-I559 PolarHBondContact O-N 2.84Å; A556-I559 PolarHBondContact O-N 3.4Å; Q557-I559 VanDerWaalsContact C-N 3.31Å; Q557-I559 PolarHBondContact O-N 3.29Å; I559-E561 PolarHBondContact O-N 3.4Å; I559-K562 PolarHBondContact O-N 2.89Å; I559-S563 PolarHBondContact O-N 3.31Å; I559-S563 VanDerWaalsContact O-N 3.11Å
560N69Low66.6Low106 Ų106119.3 Ų119.357%0.56759%0.587SS**Hα-helixtrans-64.8-40.7179.5-161.249.8000112.3A556 Q557 K562 S563 I564A556-N560 PolarHBondContact O-N 3.48Å; Q557-N560 PolarHBondContact O-N 3.5Å; N560-K562 PolarHBondContact O-N 2.97Å; N560-S563 WeakPolarHBondContact O-CB 3.49Å; N560-S563 PolarHBondContact O-N 3.3Å; N560-I564 PolarHBondContact O-N 3.28Å
561E64.3Low66.6Low117 Ų117117.8 Ų117.855%0.54759%0.589SS.*Hα-helixtrans-61.9-41.3175.4-72173.4-177.500112.6Q557 I559 S563 I564Q557-E561 PolarHBondContact O-N 2.85Å; I559-E561 PolarHBondContact O-N 3.4Å; E561-S563 VanDerWaalsContact C-N 3.33Å; E561-S563 PolarHBondContact O-N 3.31Å; E561-I564 PolarHBondContact O-N 2.97Å
562K66.7Low66.1Low157 Ų157116.6 Ų116.668%0.68359%0.589SS**Hα-helixtrans-66.7-33176.9-75.6-171.5175.3-171.60113K558 I559 N560 I564 V565 I566K558-K562 PolarHBondContact O-N 3.42Å; I559-K562 PolarHBondContact O-N 2.89Å; N560-K562 PolarHBondContact O-N 2.97Å; K562-I564 VanDerWaalsContact C-N 3.35Å; K562-I564 PolarHBondContact O-N 3.31Å; K562-V565 PolarHBondContact O-N 2.78Å; K562-I566 WeakPolarHBondContact O-CG1 3.48Å; K562-I566 PolarHBondContact O-N 2.79Å
563S67.5Low66Low64 Ų64115.2 Ų115.245%0.44858%0.582SS.*Hα-helixtrans-61.7-41.3177.4-166.30000112.1I559 N560 E561 V565 I566 H567I559-S563 PolarHBondContact O-N 3.31Å; I559-S563 VanDerWaalsContact O-N 3.11Å; N560-S563 WeakPolarHBondContact O-CB 3.49Å; N560-S563 PolarHBondContact O-N 3.3Å; E561-S563 VanDerWaalsContact C-N 3.33Å; E561-S563 PolarHBondContact O-N 3.31Å; S563-V565 VanDerWaalsContact C-N 3.32Å; S563-V565 PolarHBondContact O-N 2.88Å; S563-I566 PolarHBondContact O-N 3.12Å; S563-H567 PolarHBondContact O-N 3.41Å
564I64.1Low65.8Low103 Ų103116 Ų11653%0.52858%0.582SS.*Hα-helixtrans-64.4-35.7179.9-63.6171.5000111.9N560 E561 K562 K568N560-I564 PolarHBondContact O-N 3.28Å; E561-I564 PolarHBondContact O-N 2.97Å; K562-I564 VanDerWaalsContact C-N 3.35Å; K562-I564 PolarHBondContact O-N 3.31Å; I564-K568 PolarHBondContact O-N 3.37Å
565V63.4Low65.8Low103 Ų103114.9 Ų114.962%0.62458%0.579SS**Hα-helixtrans-69.2-39.6178.4177.80000111.6K562 S563 H567 K568 F569K562-V565 PolarHBondContact O-N 2.78Å; S563-V565 VanDerWaalsContact C-N 3.32Å; S563-V565 PolarHBondContact O-N 2.88Å; V565-H567 PolarHBondContact O-N 3.11Å; V565-K568 PolarHBondContact O-N 3.42Å; V565-F569 PolarHBondContact O-N 2.75Å
566I64.3Low65.6Low104 Ų104113.1 Ų113.153%0.53357%0.573SS.*Hα-helixtrans-62.5-44.1179.4-67.9169.4000110.6K562 S563 K568 F569 E570K562-I566 WeakPolarHBondContact O-CG1 3.48Å; K562-I566 PolarHBondContact O-N 2.79Å; S563-I566 PolarHBondContact O-N 3.12Å; I566-K568 VanDerWaalsContact C-N 3.33Å; I566-K568 PolarHBondContact O-N 3.48Å; I566-F569 WeakPolarHBondContact O-CB 3.44Å; I566-F569 PolarHBondContact O-N 3.08Å; I566-F569 VanDerWaalsContact O-N 3.1Å; I566-E570 PolarHBondContact O-N 3.38Å; I566-E570 VanDerWaalsContact O-N 3.16Å
567H65Low65.3Low128 Ų128113.8 Ų113.859%0.59357%0.573SS**Hα-helixtrans-62.3-35.8179.6-106-17.7000113.8S563 V565 F569 E570 S571S563-H567 PolarHBondContact O-N 3.41Å; V565-H567 PolarHBondContact O-N 3.11Å; H567-F569 VanDerWaalsContact C-N 3.32Å; H567-F569 PolarHBondContact O-N 3.06Å; H567-E570 IonicContact CE1-OE2 3.69Å; H567-E570 IonicContact ND1-OE2 2.66Å; H567-E570 PolarHBondContact ND1-OE2 2.96Å; H567-E570 PolarHBondContact O-N 3.45Å; H567-S571 PolarHBondContact O-N 3.5Å
568K63.5Low65.5Low167 Ų167111.1 Ų111.173%0.72657%0.566SS**Hα-helixtrans-65.3-35.2174.7-78.2-173.8176.7-178.60112.6I564 V565 I566 S572I564-K568 PolarHBondContact O-N 3.37Å; V565-K568 PolarHBondContact O-N 3.42Å; I566-K568 VanDerWaalsContact C-N 3.33Å; I566-K568 PolarHBondContact O-N 3.48Å; K568-S572 PolarHBondContact O-N 3.42Å
569F64.8Low65.6Low147 Ų147108.2 Ų108.265%0.64556%0.557SS**Hα-helixtrans-70.4-40179.8-163.5-98.5000111.7V565 I566 H567 S571 S572 L573V565-F569 PolarHBondContact O-N 2.75Å; I566-F569 WeakPolarHBondContact O-CB 3.44Å; I566-F569 PolarHBondContact O-N 3.08Å; I566-F569 VanDerWaalsContact O-N 3.1Å; H567-F569 VanDerWaalsContact C-N 3.32Å; H567-F569 PolarHBondContact O-N 3.06Å; F569-S571 PolarHBondContact O-N 3.33Å; F569-S572 PolarHBondContact O-N 3.38Å; F569-L573 HydrophobicContact CD1-CD1 3.79Å; F569-L573 HydrophobicContact CE1-CD1 3.56Å; F569-L573 HydrophobicContact CE1-CG 4.37Å; F569-L573 PolarHBondContact O-N 3.14Å
570E62.6Low65.7Low97 Ų97107.8 Ų107.845%0.45356%0.555SS.*Hα-helixtrans-60.5-43.4176.3-72.5177.4154.500112.6I566 H567 S572 L573 Y574I566-E570 PolarHBondContact O-N 3.38Å; I566-E570 VanDerWaalsContact O-N 3.16Å; H567-E570 IonicContact CE1-OE2 3.69Å; H567-E570 IonicContact ND1-OE2 2.66Å; H567-E570 PolarHBondContact ND1-OE2 2.96Å; H567-E570 PolarHBondContact O-N 3.45Å; E570-S572 VanDerWaalsContact C-N 3.34Å; E570-S572 PolarHBondContact O-N 2.88Å; E570-L573 PolarHBondContact O-N 3.41Å; E570-Y574 PolarHBondContact O-N 2.9Å; E570-Y574 VanDerWaalsContact O-N 3.13Å
571S68Low65.7Low86 Ų86107.5 Ų107.560%0.60156%0.557SS**Hα-helixtrans-62.8-36.9177.8-62.90000113.2H567 F569 Q575H567-S571 PolarHBondContact O-N 3.5Å; F569-S571 PolarHBondContact O-N 3.33Å; S571-Q575 PolarHBondContact O-N 3.01Å
572S63Low66.1Low77 Ų77107.9 Ų107.954%0.53856%0.56SS.*Hα-helixtrans-68.8-36.6178-170.30000112.7K568 F569 E570 T576K568-S572 PolarHBondContact O-N 3.42Å; F569-S572 PolarHBondContact O-N 3.38Å; E570-S572 VanDerWaalsContact C-N 3.34Å; E570-S572 PolarHBondContact O-N 2.88Å; S572-T576 PolarHBondContact O-N 2.87Å; S572-T576 PolarHBondContact O-OG1 3.44Å
573L63.9Low66.2Low94 Ų94106.3 Ų106.349%0.49256%0.556SS.*Hα-helixtrans-66.1-44176.2-91.8163.8000111.5F569 E570 Q575 T576 C577F569-L573 HydrophobicContact CD1-CD1 3.79Å; F569-L573 HydrophobicContact CE1-CD1 3.56Å; F569-L573 HydrophobicContact CE1-CG 4.37Å; F569-L573 PolarHBondContact O-N 3.14Å; E570-L573 PolarHBondContact O-N 3.41Å; L573-Q575 VanDerWaalsContact C-N 3.35Å; L573-Q575 PolarHBondContact O-N 3.31Å; L573-T576 PolarHBondContact O-N 3.4Å; L573-C577 PolarHBondContact O-N 2.83Å; L573-C577 VanDerWaalsContact O-N 3.12Å; L573-C577 PolarHBondContact O-SG 2.86Å
574Y63.5Low66.4Low185 Ų185106.7 Ų106.773%0.72556%0.558SS**Hα-helixtrans-57.8-45.3177.3-106.5-80.7000112.4E570 T576 C577 V578E570-Y574 PolarHBondContact O-N 2.9Å; E570-Y574 VanDerWaalsContact O-N 3.13Å; Y574-T576 VanDerWaalsContact C-N 3.32Å; Y574-T576 PolarHBondContact O-N 3.36Å; Y574-C577 PolarHBondContact O-N 2.87Å; Y574-V578 WeakPolarHBondContact O-CG2 3.49Å; Y574-V578 PolarHBondContact O-N 3.45Å
575Q67Low67Low115 Ų115106.2 Ų106.254%0.53755%0.554SS.*Hα-helixtrans-63.8-37.5179.5-169.561.441.400112.6S571 L573 V578 N579S571-Q575 PolarHBondContact O-N 3.01Å; L573-Q575 VanDerWaalsContact C-N 3.35Å; L573-Q575 PolarHBondContact O-N 3.31Å; Q575-V578 PolarHBondContact O-N 3.27Å; Q575-N579 PolarHBondContact NE2-OD1 3.22Å; Q575-N579 PolarHBondContact O-N 2.85Å
576T65.2Low67.6Low76 Ų76106 Ų10647%0.46655%0.548SS..Hα-helixtrans-67.5-41.6179.6-52.20000111.4S572 L573 Y574 V578 N579 L580S572-T576 PolarHBondContact O-N 2.87Å; S572-T576 PolarHBondContact O-OG1 3.44Å; L573-T576 PolarHBondContact O-N 3.4Å; Y574-T576 VanDerWaalsContact C-N 3.32Å; Y574-T576 PolarHBondContact O-N 3.36Å; T576-V578 PolarHBondContact O-N 3.47Å; T576-N579 PolarHBondContact O-N 2.94Å; T576-L580 PolarHBondContact O-N 3.43Å
577C64.3Low68.2Low75 Ų75106.5 Ų106.551%0.50755%0.551SS.*Hα-helixtrans-63.3-40176.8-69.60000112.6L573 Y574 L580 V581L573-C577 PolarHBondContact O-N 2.83Å; L573-C577 VanDerWaalsContact O-N 3.12Å; L573-C577 PolarHBondContact O-SG 2.86Å; Y574-C577 PolarHBondContact O-N 2.87Å; C577-L580 PolarHBondContact O-N 2.84Å; C577-V581 WeakPolarHBondContact O-CG2 3.35Å; C577-V581 PolarHBondContact O-N 3.22Å
578V69.3Low68.8Low74 Ų74106.4 Ų106.445%0.44855%0.549SS..Hα-helixtrans-63.9-42.2178.91720000111.5Y574 Q575 T576 L580 V581 M582Y574-V578 WeakPolarHBondContact O-CG2 3.49Å; Y574-V578 PolarHBondContact O-N 3.45Å; Q575-V578 PolarHBondContact O-N 3.27Å; T576-V578 PolarHBondContact O-N 3.47Å; V578-L580 PolarHBondContact O-N 2.86Å; V578-V581 PolarHBondContact O-N 2.92Å; V578-M582 PolarHBondContact O-N 3.2Å
579N70.7Confident69.5Low83 Ų83102.8 Ų102.844%0.44454%0.536SS..Hα-helixtrans-62.7-42.1178.7-69.6-7.4000112.1Q575 T576 V581 M582 E583Q575-N579 PolarHBondContact NE2-OD1 3.22Å; Q575-N579 PolarHBondContact O-N 2.85Å; T576-N579 PolarHBondContact O-N 2.94Å; N579-V581 PolarHBondContact O-N 3.42Å; N579-M582 PolarHBondContact O-N 3.19Å; N579-E583 PolarHBondContact O-N 2.92Å; N579-E583 VanDerWaalsContact O-N 3.1Å
580L70.5Confident70.2Confident106 Ų106100.2 Ų100.256%0.55553%0.53SS*.Hα-helixtrans-64.6-36.9179.2-75168.5000113.1T576 C577 V578 S584T576-L580 PolarHBondContact O-N 3.43Å; C577-L580 PolarHBondContact O-N 2.84Å; V578-L580 PolarHBondContact O-N 2.86Å; L580-S584 PolarHBondContact O-N 2.85Å
581V68.6Low71Confident100 Ų100105.2 Ų105.261%0.60654%0.544SS*.Hα-helixtrans-67.2-40.2176.9173.40000111C577 V578 N579 S584 E585C577-V581 WeakPolarHBondContact O-CG2 3.35Å; C577-V581 PolarHBondContact O-N 3.22Å; V578-V581 PolarHBondContact O-N 2.92Å; N579-V581 PolarHBondContact O-N 3.42Å; V581-S584 PolarHBondContact O-N 3.08Å; V581-E585 PolarHBondContact O-N 2.8Å
582M72.8Confident71.7Confident124 Ų124107.2 Ų107.261%0.61154%0.544SS*.Hα-helixtrans-66.7-41.7178.2-68.1-123.2-63.800112.6V578 N579 S584 E585 I586V578-M582 PolarHBondContact O-N 3.2Å; N579-M582 PolarHBondContact O-N 3.19Å; M582-S584 VanDerWaalsContact C-N 3.32Å; M582-S584 PolarHBondContact O-N 3.36Å; M582-E585 PolarHBondContact O-N 3.05Å; M582-I586 WeakPolarHBondContact O-CG1 3.44Å; M582-I586 PolarHBondContact O-N 3.24Å; M582-I586 VanDerWaalsContact O-N 3.16Å
583E68.8Low72.7Confident125 Ų125108 Ų10858%0.58454%0.542SS*.Hα-helixtrans-60.8-39.7175.7-81.2-177163.500112.5N579 E585 L587N579-E583 PolarHBondContact O-N 2.92Å; N579-E583 VanDerWaalsContact O-N 3.1Å; E583-E585 PolarHBondContact O-N 3.01Å; E583-L587 WeakPolarHBondContact O-CG 3.4Å; E583-L587 PolarHBondContact O-N 3.29Å
584S70.4Confident73.7Confident72 Ų72108.4 Ų108.450%0.50354%0.544SS..Hα-helixtrans-61.7-41.5176.9177.80000112.6L580 V581 M582 K588L580-S584 PolarHBondContact O-N 2.85Å; V581-S584 PolarHBondContact O-N 3.08Å; M582-S584 VanDerWaalsContact C-N 3.32Å; M582-S584 PolarHBondContact O-N 3.36Å; S584-K588 PolarHBondContact O-N 2.96Å
585E77Confident74.7Confident93 Ų93103.6 Ų103.644%0.43553%0.534SS..Hα-helixtrans-75.3-33.4-176.5-14561.5-159.800112.1V581 M582 E583 K588 I589V581-E585 PolarHBondContact O-N 2.8Å; M582-E585 PolarHBondContact O-N 3.05Å; E583-E585 PolarHBondContact O-N 3.01Å; E585-K588 PolarHBondContact O-N 3.19Å; E585-K588 IonicContact OE1-NZ 2.97Å; E585-K588 PolarHBondContact OE1-NZ 2.8Å; E585-I589 WeakPolarHBondContact O-CG1 3.45Å; E585-I589 PolarHBondContact O-N 2.97Å
586I76Confident75.5Confident99 Ų99101.9 Ų101.951%0.50853%0.529SS..Hα-helixtrans-60.6-48.2172.3-67.8169.1000110.6M582 K588 I589 D590M582-I586 WeakPolarHBondContact O-CG1 3.44Å; M582-I586 PolarHBondContact O-N 3.24Å; M582-I586 VanDerWaalsContact O-N 3.16Å; I586-K588 PolarHBondContact O-N 3.49Å; I586-I589 PolarHBondContact O-N 3.5Å; I586-D590 PolarHBondContact O-N 2.91Å
587L78.2Confident76.3Confident113 Ų113103.5 Ų103.559%0.59253%0.534SS*.Hα-helixtrans-61.6-30179.3-75171.3000113.4E583 R591E583-L587 WeakPolarHBondContact O-CG 3.4Å; E583-L587 PolarHBondContact O-N 3.29Å; L587-R591 PolarHBondContact O-N 3.46Å
588K77.9Confident77.3Confident126 Ų126104.7 Ų104.755%0.54854%0.535SS..Hα-helixtrans-72.2-43177.9-167.8179.3170.6-165.60111.5S584 E585 I586 R591 E592S584-K588 PolarHBondContact O-N 2.96Å; E585-K588 PolarHBondContact O-N 3.19Å; E585-K588 IonicContact OE1-NZ 2.97Å; E585-K588 PolarHBondContact OE1-NZ 2.8Å; I586-K588 PolarHBondContact O-N 3.49Å; K588-R591 PolarHBondContact O-N 2.85Å; K588-E592 PolarHBondContact O-N 3.18Å
589I76.8Confident78.1Confident91 Ų91108.1 Ų108.147%0.46754%0.54SS..Hα-helixtrans-63.7-42.2175.9-66.9168.6000110.7E585 I586 R591 E592 N593E585-I589 WeakPolarHBondContact O-CG1 3.45Å; E585-I589 PolarHBondContact O-N 2.97Å; I586-I589 PolarHBondContact O-N 3.5Å; I589-R591 VanDerWaalsContact C-N 3.34Å; I589-R591 PolarHBondContact O-N 3.31Å; I589-E592 PolarHBondContact O-N 2.8Å; I589-N593 PolarHBondContact O-N 3.41Å; I589-N593 PolarHBondContact O-ND2 3.47Å
590D79.6Confident78.7Confident94 Ų94110.5 Ų110.550%0.50355%0.547SS..Hα-helixtrans-62.9-39.1178.4-76.7-18000112.7I586 L594I586-D590 PolarHBondContact O-N 2.91Å; D590-L594 PolarHBondContact O-N 2.88Å; D590-L594 VanDerWaalsContact O-N 3.08Å
591R80.3Confident79.3Confident201 Ų201108.7 Ų108.776%0.75854%0.54SS*.Hα-helixtrans-63-41.6174.4-85.6-177.2175167.80.4112.5L587 K588 I589 L594 V595L587-R591 PolarHBondContact O-N 3.46Å; K588-R591 PolarHBondContact O-N 2.85Å; I589-R591 VanDerWaalsContact C-N 3.34Å; I589-R591 PolarHBondContact O-N 3.31Å; R591-L594 PolarHBondContact O-N 3.33Å; R591-V595 WeakPolarHBondContact O-CG2 3.26Å; R591-V595 PolarHBondContact O-N 3.32Å
592E81.8Confident80.2Confident129 Ų129109.8 Ų109.860%0.60354%0.537SS*.Hα-helixtrans-67.9-40.7-179.5-166.4168.1-165.600111.7K588 I589 L594 V595 N596K588-E592 PolarHBondContact O-N 3.18Å; I589-E592 PolarHBondContact O-N 2.8Å; E592-L594 PolarHBondContact O-N 3.34Å; E592-V595 PolarHBondContact O-N 2.9Å; E592-N596 PolarHBondContact O-N 3.24Å; E592-N596 VanDerWaalsContact O-N 3.13Å; E592-N596 PolarHBondContact O-ND2 3.36Å
593N84.9Confident80.9Confident92 Ų92109.3 Ų109.349%0.49253%0.533SS..Hα-helixtrans-62.1-41.1174.6-74.3-26000112.5I589 V595 N596 L597I589-N593 PolarHBondContact O-N 3.41Å; I589-N593 PolarHBondContact O-ND2 3.47Å; N593-V595 PolarHBondContact O-N 3.47Å; N593-N596 PolarHBondContact O-N 2.9Å; N593-L597 WeakPolarHBondContact O-CB 3.38Å; N593-L597 PolarHBondContact O-N 2.88Å
594L84.6Confident81.6Confident103 Ų103107.7 Ų107.754%0.53953%0.528SS..Hα-helixtrans-62.8-41178-174.665.4000112.2D590 R591 E592 L597 N598D590-L594 PolarHBondContact O-N 2.88Å; D590-L594 VanDerWaalsContact O-N 3.08Å; R591-L594 PolarHBondContact O-N 3.33Å; E592-L594 PolarHBondContact O-N 3.34Å; L594-L597 PolarHBondContact O-N 2.87Å; L594-N598 PolarHBondContact O-N 3.45Å; L594-N598 VanDerWaalsContact O-N 3.1Å
595V84.1Confident82.4Confident84 Ų84109.4 Ų109.451%0.50953%0.528SS..Hα-helixtrans-65.2-43.4177.5172.30000111.3R591 E592 N593 N598 R599R591-V595 WeakPolarHBondContact O-CG2 3.26Å; R591-V595 PolarHBondContact O-N 3.32Å; E592-V595 PolarHBondContact O-N 2.9Å; N593-V595 PolarHBondContact O-N 3.47Å; V595-N598 PolarHBondContact O-N 3.17Å; V595-R599 PolarHBondContact O-N 2.65Å; V595-R599 VanDerWaalsContact O-N 3.13Å
596N83.5Confident82.8Confident80 Ų80110.2 Ų110.243%0.42853%0.53SS..Hα-helixtrans-65.2-38.6178.2-76.1-29.8000112.4E592 N593 R599 K600E592-N596 PolarHBondContact O-N 3.24Å; E592-N596 VanDerWaalsContact O-N 3.13Å; E592-N596 PolarHBondContact O-ND2 3.36Å; N593-N596 PolarHBondContact O-N 2.9Å; N596-R599 PolarHBondContact O-N 3.07Å; N596-K600 PolarHBondContact O-N 3.08Å
597L81.8Confident83.2Confident109 Ų109110 Ų11057%0.57153%0.526SS*.Hα-helixtrans-64.4-45.2176.8-168.768.1000111.5N593 L594 R599 K600 V601N593-L597 WeakPolarHBondContact O-CB 3.38Å; N593-L597 PolarHBondContact O-N 2.88Å; L594-L597 PolarHBondContact O-N 2.87Å; L597-R599 VanDerWaalsContact C-N 3.32Å; L597-R599 PolarHBondContact O-N 2.89Å; L597-K600 PolarHBondContact O-N 3.5Å; L597-K600 VanDerWaalsContact O-N 3.17Å; L597-V601 WeakPolarHBondContact O-CG2 3.37Å; L597-V601 PolarHBondContact O-N 2.88Å
598N85.1Confident83.5Confident100 Ų100110.2 Ų110.254%0.53553%0.527SS..Hα-helixtrans-61.4-38.4177.5-77.5-20.6000112.6L594 V595 K600 V601 F602L594-N598 PolarHBondContact O-N 3.45Å; L594-N598 VanDerWaalsContact O-N 3.1Å; V595-N598 PolarHBondContact O-N 3.17Å; N598-K600 PolarHBondContact O-N 3.39Å; N598-V601 PolarHBondContact O-N 3.44Å; N598-F602 PolarHBondContact O-N 2.98Å; N598-F602 VanDerWaalsContact O-N 3.14Å
599R86.2Confident83.9Confident146 Ų146109.3 Ų109.355%0.55153%0.525SS*.Hα-helixtrans-61.6-43.6174.8-171.9-178.7-65.21471.9111.6V595 N596 L597 F602 E603V595-R599 PolarHBondContact O-N 2.65Å; V595-R599 VanDerWaalsContact O-N 3.13Å; N596-R599 PolarHBondContact O-N 3.07Å; L597-R599 VanDerWaalsContact C-N 3.32Å; L597-R599 PolarHBondContact O-N 2.89Å; R599-F602 PolarHBondContact O-N 3.42Å; R599-E603 PolarHBondContact O-N 3.11Å; R599-E603 VanDerWaalsContact O-N 3.16Å
600K84.1Confident84.4Confident134 Ų134111 Ų11158%0.58353%0.529SS*.Hα-helixtrans-65-40179.3-165.1110.3-175.81780112.4N596 L597 N598 E603 L604N596-K600 PolarHBondContact O-N 3.08Å; L597-K600 PolarHBondContact O-N 3.5Å; L597-K600 VanDerWaalsContact O-N 3.17Å; N598-K600 PolarHBondContact O-N 3.39Å; K600-E603 PolarHBondContact O-N 3.32Å; K600-L604 WeakPolarHBondContact O-CG 3.49Å; K600-L604 PolarHBondContact O-N 3.35Å
601V82.6Confident84.7Confident68 Ų68113 Ų11341%0.41253%0.531SS..Hα-helixtrans-62.3-45.6176.7171.70000110.7L597 N598 E603 L604 E605L597-V601 WeakPolarHBondContact O-CG2 3.37Å; L597-V601 PolarHBondContact O-N 2.88Å; N598-V601 PolarHBondContact O-N 3.44Å; V601-E603 PolarHBondContact O-N 3.09Å; V601-L604 PolarHBondContact O-N 3.44Å; V601-E605 HydrophobicContact CG1-CG 4.49Å; V601-E605 WeakPolarHBondContact O-CG 3.46Å; V601-E605 PolarHBondContact O-N 3.03Å
602F87.4Confident84.9Confident123 Ų123108.7 Ų108.754%0.53952%0.519SS..Hα-helixtrans-61.6-40.5178.7-177.8-98.9000113.2N598 R599 E605 K606N598-F602 PolarHBondContact O-N 2.98Å; N598-F602 VanDerWaalsContact O-N 3.14Å; R599-F602 PolarHBondContact O-N 3.42Å; F602-E605 PolarHBondContact O-N 2.78Å; F602-K606 HydrophobicContact CE1-CG 4.24Å; F602-K606 HydrophobicContact CZ-CG 4.38Å; F602-K606 PolarHBondContact O-N 2.92Å; F602-K606 VanDerWaalsContact O-N 3.15Å
603E87.2Confident85Confident113 Ų113109.3 Ų109.353%0.52852%0.523SS..Hα-helixtrans-62.4-41.6175.3-73.5174.5-179.700112R599 K600 V601 K606 E607R599-E603 PolarHBondContact O-N 3.11Å; R599-E603 VanDerWaalsContact O-N 3.16Å; K600-E603 PolarHBondContact O-N 3.32Å; V601-E603 PolarHBondContact O-N 3.09Å; E603-K606 PolarHBondContact O-N 3.27Å; E603-E607 PolarHBondContact O-N 2.89Å; E603-E607 VanDerWaalsContact O-N 3.1Å
604L85.1Confident85.1Confident91 Ų91108.9 Ų108.948%0.47652%0.521SS..Hα-helixtrans-67.4-38.1177.5-72.3170000112.4K600 V601 K606 E607 I608K600-L604 WeakPolarHBondContact O-CG 3.49Å; K600-L604 PolarHBondContact O-N 3.35Å; V601-L604 PolarHBondContact O-N 3.44Å; L604-K606 VanDerWaalsContact C-N 3.33Å; L604-K606 PolarHBondContact O-N 3.12Å; L604-E607 PolarHBondContact O-N 3.13Å; L604-I608 WeakPolarHBondContact O-CG1 3.44Å; L604-I608 PolarHBondContact O-N 3.46Å
605E85.8Confident85.1Confident109 Ų109108.1 Ų108.151%0.50952%0.515SS..Hα-helixtrans-60.8-42.7174.7-73.6175161.300111.4V601 F602 E607 I608 E609V601-E605 HydrophobicContact CG1-CG 4.49Å; V601-E605 WeakPolarHBondContact O-CG 3.46Å; V601-E605 PolarHBondContact O-N 3.03Å; F602-E605 PolarHBondContact O-N 2.78Å; E605-E607 VanDerWaalsContact C-N 3.35Å; E605-E607 PolarHBondContact O-N 3.33Å; E605-I608 PolarHBondContact O-N 2.86Å; E605-E609 PolarHBondContact O-N 3.37Å
606K86.9Confident85.3Confident109 Ų109108 Ų10847%0.47451%0.511SS..Hα-helixtrans-63.1-39.2175.4-77.7-75.7159-146.10112.8F602 E603 L604 E609 F610F602-K606 HydrophobicContact CE1-CG 4.24Å; F602-K606 HydrophobicContact CZ-CG 4.38Å; F602-K606 PolarHBondContact O-N 2.92Å; F602-K606 VanDerWaalsContact O-N 3.15Å; E603-K606 PolarHBondContact O-N 3.27Å; L604-K606 VanDerWaalsContact C-N 3.33Å; L604-K606 PolarHBondContact O-N 3.12Å; K606-E609 IonicContact NZ-OE2 3.01Å; K606-E609 PolarHBondContact NZ-OE2 2.85Å; K606-F610 PolarHBondContact O-N 3.28Å
607E84.2Confident85.4Confident94 Ų94107.2 Ų107.244%0.43952%0.516SS..Hα-helixtrans-66.6-41.3177.9-148.5-172.5158.200111.5E603 L604 E605 F610 Y611E603-E607 PolarHBondContact O-N 2.89Å; E603-E607 VanDerWaalsContact O-N 3.1Å; L604-E607 PolarHBondContact O-N 3.13Å; E605-E607 VanDerWaalsContact C-N 3.35Å; E605-E607 PolarHBondContact O-N 3.33Å; E607-F610 PolarHBondContact O-N 2.83Å; E607-Y611 HydrophobicContact CG-CD2 4.22Å; E607-Y611 HydrophobicContact CG-CE2 3.63Å; E607-Y611 WeakPolarHBondContact O-CD2 3.33Å; E607-Y611 PolarHBondContact O-N 3.34Å; E607-Y611 WeakPolarHBondContact OE1-CE2 3.31Å; E607-Y611 PolarHBondContact OE1-OH 2.89Å; E607-Y611 VanDerWaalsContact OE1-OH 3.07Å
608I84.5Confident85.5Confident119 Ų119107.6 Ų107.661%0.6152%0.518SS*.Hα-helixtrans-62.9-44.3176.4-68.7168.1000111.3L604 E605 F610 Y611 H612L604-I608 WeakPolarHBondContact O-CG1 3.44Å; L604-I608 PolarHBondContact O-N 3.46Å; E605-I608 PolarHBondContact O-N 2.86Å; I608-F610 VanDerWaalsContact C-N 3.29Å; I608-F610 PolarHBondContact O-N 3.26Å; I608-Y611 PolarHBondContact O-N 3.47Å; I608-H612 PolarHBondContact O-N 2.91Å
609E85.6Confident85.5Confident106 Ų106110 Ų11050%0.49552%0.52SS..Hα-helixtrans-56.1-44.4175-77.8-179.116300111.6E605 K606 H612 M613E605-E609 PolarHBondContact O-N 3.37Å; K606-E609 IonicContact NZ-OE2 3.01Å; K606-E609 PolarHBondContact NZ-OE2 2.85Å; E609-H612 PolarHBondContact O-N 3.08Å; E609-M613 PolarHBondContact O-N 3.18Å
610F88.3Confident85.5Confident126 Ų126105.2 Ų105.255%0.55352%0.516SS*.Hα-helixtrans-63.1-46.9179.2179.2-98.7000112.3K606 E607 I608 H612 M613 N614K606-F610 PolarHBondContact O-N 3.28Å; E607-F610 PolarHBondContact O-N 2.83Å; I608-F610 VanDerWaalsContact C-N 3.29Å; I608-F610 PolarHBondContact O-N 3.26Å; F610-H612 VanDerWaalsContact C-N 3.27Å; F610-H612 PolarHBondContact O-N 3.39Å; F610-M613 PolarHBondContact O-N 2.84Å; F610-N614 PolarHBondContact O-N 2.94Å; F610-N614 VanDerWaalsContact O-N 3.1Å
611Y84.7Confident85.5Confident137 Ų137101.8 Ų101.854%0.53751%0.512SS..Hα-helixtrans-61.2-37.9176.7-74.2-62.6000112E607 I608 N614 E615E607-Y611 HydrophobicContact CG-CD2 4.22Å; E607-Y611 HydrophobicContact CG-CE2 3.63Å; E607-Y611 WeakPolarHBondContact O-CD2 3.33Å; E607-Y611 PolarHBondContact O-N 3.34Å; E607-Y611 WeakPolarHBondContact OE1-CE2 3.31Å; E607-Y611 PolarHBondContact OE1-OH 2.89Å; E607-Y611 VanDerWaalsContact OE1-OH 3.07Å; I608-Y611 PolarHBondContact O-N 3.47Å; Y611-N614 PolarHBondContact O-N 2.76Å; Y611-E615 WeakPolarHBondContact O-CB 3.34Å; Y611-E615 PolarHBondContact O-N 2.97Å
612H84.2Confident85.6Confident110 Ų110103.7 Ų103.751%0.50952%0.519SS..Hα-helixtrans-68.7-37.7179.7-152.454.7000112.7I608 E609 F610 N614 E615 N616I608-H612 PolarHBondContact O-N 2.91Å; E609-H612 PolarHBondContact O-N 3.08Å; F610-H612 VanDerWaalsContact C-N 3.27Å; F610-H612 PolarHBondContact O-N 3.39Å; H612-N614 VanDerWaalsContact C-N 3.33Å; H612-E615 IonicContact ND1-OE2 3.38Å; H612-N616 PolarHBondContact O-N 3.39Å; H612-N616 PolarHBondContact O-ND2 3.4Å; H612-N616 VanDerWaalsContact O-ND2 3.09Å
613M85.5Confident85.6Confident142 Ų142104.8 Ų104.870%0.752%0.524SS*.Hα-helixtrans-61.1-43.2171.1-74.1-177.76600111.8E609 F610 N616 A617E609-M613 PolarHBondContact O-N 3.18Å; F610-M613 PolarHBondContact O-N 2.84Å; M613-N616 PolarHBondContact O-N 2.97Å; M613-A617 PolarHBondContact O-N 3.46Å; M613-A617 VanDerWaalsContact O-N 3.12Å
614N85.5Confident85.5Confident84 Ų84106.9 Ų106.945%0.44953%0.531SS..Hα-helixtrans-68.7-39.1-178-144.821000111.9F610 Y611 H612 N616 A617 L618F610-N614 PolarHBondContact O-N 2.94Å; F610-N614 VanDerWaalsContact O-N 3.1Å; Y611-N614 PolarHBondContact O-N 2.76Å; H612-N614 VanDerWaalsContact C-N 3.33Å; N614-N616 VanDerWaalsContact C-N 3.35Å; N614-N616 PolarHBondContact O-N 2.9Å; N614-A617 PolarHBondContact O-N 3.31Å; N614-L618 WeakPolarHBondContact O-CG 3.45Å; N614-L618 PolarHBondContact O-N 2.92Å
615E85.4Confident85.2Confident86 Ų86106.5 Ų106.540%0.40254%0.535SS..Hα-helixtrans-59.1-44.5173.6-166.7-161.6152.400111.7Y611 H612 A617 L618 R619Y611-E615 WeakPolarHBondContact O-CB 3.34Å; Y611-E615 PolarHBondContact O-N 2.97Å; H612-E615 IonicContact ND1-OE2 3.38Å; E615-A617 PolarHBondContact O-N 3.28Å; E615-L618 PolarHBondContact O-N 3.24Å; E615-R619 WeakPolarHBondContact O-CB 3.5Å; E615-R619 PolarHBondContact O-N 3.35Å; E615-R619 IonicContact OE1-CZ 3.41Å; E615-R619 IonicContact OE1-NH2 2.73Å; E615-R619 PolarHBondContact OE1-NH2 2.81Å
616N87.9Confident85.2Confident82 Ų82106.4 Ų106.444%0.43954%0.535SS..Hα-helixtrans-64.8-39.4178.6-76.7-41.1000112.4H612 M613 N614 R619 G620H612-N616 PolarHBondContact O-N 3.39Å; H612-N616 PolarHBondContact O-ND2 3.4Å; H612-N616 VanDerWaalsContact O-ND2 3.09Å; M613-N616 PolarHBondContact O-N 2.97Å; N614-N616 VanDerWaalsContact C-N 3.35Å; N614-N616 PolarHBondContact O-N 2.9Å; N616-R619 PolarHBondContact O-N 2.92Å; N616-G620 PolarHBondContact O-N 3.3Å
617A85.9Confident85Confident64 Ų64104.4 Ų104.453%0.52953%0.532SS..Hα-helixtrans-62.6-45.5174.600000111.8M613 N614 E615 R619 G620 A621M613-A617 PolarHBondContact O-N 3.46Å; M613-A617 VanDerWaalsContact O-N 3.12Å; N614-A617 PolarHBondContact O-N 3.31Å; E615-A617 PolarHBondContact O-N 3.28Å; A617-R619 PolarHBondContact O-N 3.22Å; A617-G620 PolarHBondContact O-N 3.19Å; A617-A621 PolarHBondContact O-N 3.44Å
618L83.9Confident85.1Confident117 Ų117105.6 Ų105.661%0.61354%0.537SS*.Hα-helixtrans-62.6-41.4176.2-73.1170.6000112N614 E615 G620 A621 L622N614-L618 WeakPolarHBondContact O-CG 3.45Å; N614-L618 PolarHBondContact O-N 2.92Å; E615-L618 PolarHBondContact O-N 3.24Å; L618-G620 VanDerWaalsContact C-N 3.32Å; L618-G620 PolarHBondContact O-N 3.44Å; L618-A621 PolarHBondContact O-N 3.36Å; L618-L622 PolarHBondContact O-N 3.46Å
619R85.2Confident85Confident151 Ų151105.2 Ų105.257%0.5754%0.537SS*.Hα-helixtrans-61.8-40.4176.5-165.6-177.4-66-1512.1111.8E615 N616 A617 K623E615-R619 WeakPolarHBondContact O-CB 3.5Å; E615-R619 PolarHBondContact O-N 3.35Å; E615-R619 IonicContact OE1-CZ 3.41Å; E615-R619 IonicContact OE1-NH2 2.73Å; E615-R619 PolarHBondContact OE1-NH2 2.81Å; N616-R619 PolarHBondContact O-N 2.92Å; A617-R619 PolarHBondContact O-N 3.22Å; R619-K623 PolarHBondContact O-N 2.86Å
620G86.9Confident85Confident45 Ų45106 Ų10646%0.46454%0.541SS..Hα-helixtrans-63.1-44.4173.600000112.9N616 A617 L618 K623 K624N616-G620 PolarHBondContact O-N 3.3Å; A617-G620 PolarHBondContact O-N 3.19Å; L618-G620 VanDerWaalsContact C-N 3.32Å; L618-G620 PolarHBondContact O-N 3.44Å; G620-K623 PolarHBondContact O-N 2.88Å; G620-K624 PolarHBondContact O-N 2.77Å
621A83.9Confident84.9Confident61 Ų61106.6 Ų106.650%0.50454%0.543SS..Hα-helixtrans-62.8-42.3177.200000112.3A617 L618 K623 K624 C625A617-A621 PolarHBondContact O-N 3.44Å; L618-A621 PolarHBondContact O-N 3.36Å; A621-K623 PolarHBondContact O-N 3.47Å; A621-K624 PolarHBondContact O-N 3.35Å; A621-C625 PolarHBondContact O-N 3.46Å
622L84.6Confident84.8Confident108 Ų108104.7 Ų104.757%0.56554%0.541SS*.Hα-helixtrans-58.9-46.3176.9-170.779.3000111.5L618 K624 C625 Q626L618-L622 PolarHBondContact O-N 3.46Å; L622-K624 VanDerWaalsContact C-N 3.34Å; L622-K624 PolarHBondContact O-N 2.91Å; L622-C625 WeakPolarHBondContact O-CB 3.38Å; L622-C625 PolarHBondContact O-N 2.92Å; L622-C625 VanDerWaalsContact O-N 3.17Å; L622-Q626 WeakPolarHBondContact O-CG 3.4Å; L622-Q626 PolarHBondContact O-N 2.75Å
623K86.2Confident84.8Confident147 Ų147104.3 Ų104.364%0.63954%0.54SS*.Hα-helixtrans-64.2-38.3-179-158.2172.7-173.5178.60112.2R619 G620 A621 Q626 T627R619-K623 PolarHBondContact O-N 2.86Å; G620-K623 PolarHBondContact O-N 2.88Å; A621-K623 PolarHBondContact O-N 3.47Å; K623-Q626 PolarHBondContact O-N 2.94Å; K623-T627 PolarHBondContact O-N 3.31Å; K623-T627 PolarHBondContact O-OG1 3.41Å
624K85.9Confident84.7Confident157 Ų157103.2 Ų103.268%0.68354%0.536SS*.Hα-helixtrans-63-42.6173.8-169.2177.6-179.2-178.80111.5G620 A621 L622 T627 Q628G620-K624 PolarHBondContact O-N 2.77Å; A621-K624 PolarHBondContact O-N 3.35Å; L622-K624 VanDerWaalsContact C-N 3.34Å; L622-K624 PolarHBondContact O-N 2.91Å; K624-T627 PolarHBondContact O-N 2.99Å; K624-Q628 PolarHBondContact O-N 2.9Å
625C79Confident84.6Confident83 Ų83103.8 Ų103.856%0.56154%0.537SS*.Hα-helixtrans-64.5-42.8177.8-149.20000111.8A621 L622 Q628 N629A621-C625 PolarHBondContact O-N 3.46Å; L622-C625 WeakPolarHBondContact O-CB 3.38Å; L622-C625 PolarHBondContact O-N 2.92Å; L622-C625 VanDerWaalsContact O-N 3.17Å; C625-Q628 PolarHBondContact O-N 3.4Å; C625-N629 WeakPolarHBondContact O-CB 3.29Å; C625-N629 PolarHBondContact O-N 2.86Å
626Q84.4Confident84.4Confident106 Ų106103.5 Ų103.550%0.49554%0.539SS..Hα-helixtrans-58.8-48.4174.4-74.5174.9-30.900112L622 K623 Q628 N629 E630L622-Q626 WeakPolarHBondContact O-CG 3.4Å; L622-Q626 PolarHBondContact O-N 2.75Å; K623-Q626 PolarHBondContact O-N 2.94Å; Q626-Q628 VanDerWaalsContact C-N 3.27Å; Q626-Q628 PolarHBondContact O-N 2.86Å; Q626-N629 WeakPolarHBondContact O-CB 3.5Å; Q626-N629 PolarHBondContact O-N 3.24Å; Q626-N629 VanDerWaalsContact O-N 3.1Å; Q626-E630 WeakPolarHBondContact O-CG 3.46Å; Q626-E630 PolarHBondContact O-N 2.92Å
627T83.9Confident84.2Confident67 Ų67103.4 Ų103.441%0.41154%0.538SS..Hα-helixtrans-61.5-37.6179.2-44.40000111.7K623 K624 K631K623-T627 PolarHBondContact O-N 3.31Å; K623-T627 PolarHBondContact O-OG1 3.41Å; K624-T627 PolarHBondContact O-N 2.99Å; T627-K631 WeakPolarHBondContact O-CG 3.49Å; T627-K631 PolarHBondContact O-N 2.69Å
628Q85.6Confident84.1Confident119 Ų119103.9 Ų103.956%0.55654%0.538SS*.Hα-helixtrans-69-37.2176.6-173.2170.7-11.500111.9K624 C625 Q626 K631 L632K624-Q628 PolarHBondContact O-N 2.9Å; C625-Q628 PolarHBondContact O-N 3.4Å; Q626-Q628 VanDerWaalsContact C-N 3.27Å; Q626-Q628 PolarHBondContact O-N 2.86Å; Q628-K631 PolarHBondContact O-N 3.16Å; Q628-L632 WeakPolarHBondContact O-CG 3.45Å; Q628-L632 PolarHBondContact O-N 3.07Å
629N83.6Confident84.1Confident111 Ų111102.7 Ų102.759%0.59453%0.531SS*.Hα-helixtrans-67.6-40177.6-150.725.3000111.8C625 Q626 K631 L632 Q633C625-N629 WeakPolarHBondContact O-CB 3.29Å; C625-N629 PolarHBondContact O-N 2.86Å; Q626-N629 WeakPolarHBondContact O-CB 3.5Å; Q626-N629 PolarHBondContact O-N 3.24Å; Q626-N629 VanDerWaalsContact O-N 3.1Å; N629-K631 PolarHBondContact O-N 3.05Å; N629-L632 PolarHBondContact O-N 3.49Å; N629-Q633 PolarHBondContact O-N 3.35Å
630E84.2Confident83.8Confident124 Ų124100.7 Ų100.758%0.57953%0.528SS*.Hα-helixtrans-60.6-42.8173.2-71.7171.1-176.300111.9Q626 L632 Q633 I634Q626-E630 WeakPolarHBondContact O-CG 3.46Å; Q626-E630 PolarHBondContact O-N 2.92Å; E630-L632 PolarHBondContact O-N 3.38Å; E630-Q633 PolarHBondContact O-N 2.9Å; E630-I634 WeakPolarHBondContact O-CG1 3.33Å; E630-I634 PolarHBondContact O-N 2.88Å
631K86.6Confident83.5Confident138 Ų138102.8 Ų102.860%0.653%0.532SS*.Hα-helixtrans-61.1-43.7174.7-73.7-178.5179.5-171.50112.2T627 Q628 N629 Q633 I634 I635T627-K631 WeakPolarHBondContact O-CG 3.49Å; T627-K631 PolarHBondContact O-N 2.69Å; Q628-K631 PolarHBondContact O-N 3.16Å; N629-K631 PolarHBondContact O-N 3.05Å; K631-Q633 VanDerWaalsContact C-N 3.33Å; K631-I634 PolarHBondContact O-N 2.94Å; K631-I635 VanDerWaalsContact O-CG1 3.3Å; K631-I635 WeakPolarHBondContact O-CG1 3.43Å; K631-I635 PolarHBondContact O-N 3.37Å; K631-I635 VanDerWaalsContact O-N 3.1Å
632L83Confident83.2Confident97 Ų97104.7 Ų104.751%0.50853%0.531SS..Hα-helixtrans-63.9-39.6177.2-73.5171.5000111.5Q628 N629 E630 I635 N636Q628-L632 WeakPolarHBondContact O-CG 3.45Å; Q628-L632 PolarHBondContact O-N 3.07Å; N629-L632 PolarHBondContact O-N 3.49Å; E630-L632 PolarHBondContact O-N 3.38Å; L632-I635 PolarHBondContact O-N 3.43Å; L632-N636 WeakPolarHBondContact O-CB 3.41Å; L632-N636 PolarHBondContact O-N 2.9Å
633Q83.6Confident82.9Confident101 Ų101104.9 Ų104.947%0.47253%0.532SS..Hα-helixtrans-60.7-47.3176.3-172.262.333.800111.6N629 E630 K631 I635 N636 D637N629-Q633 PolarHBondContact O-N 3.35Å; E630-Q633 PolarHBondContact O-N 2.9Å; K631-Q633 VanDerWaalsContact C-N 3.33Å; Q633-I635 VanDerWaalsContact C-N 3.32Å; Q633-I635 PolarHBondContact O-N 3.37Å; Q633-N636 PolarHBondContact O-N 3.25Å; Q633-N636 VanDerWaalsContact O-N 3.15Å; Q633-D637 PolarHBondContact NE2-OD1 2.84Å; Q633-D637 PolarHBondContact NE2-OD2 2.91Å; Q633-D637 VanDerWaalsContact O-CG 3.26Å; Q633-D637 PolarHBondContact O-N 2.82Å
634I84.3Confident82.4Confident120 Ų120102.3 Ų102.362%0.61553%0.525SS*.Hα-helixtrans-59.5-43.5177.4-66.6166.8000111.2E630 K631 N636 D637 S638E630-I634 WeakPolarHBondContact O-CG1 3.33Å; E630-I634 PolarHBondContact O-N 2.88Å; K631-I634 PolarHBondContact O-N 2.94Å; I634-N636 VanDerWaalsContact C-N 3.33Å; I634-N636 PolarHBondContact O-N 2.88Å; I634-D637 PolarHBondContact O-N 3.09Å; I634-S638 WeakPolarHBondContact O-CB 3.35Å; I634-S638 PolarHBondContact O-N 3.39Å
635I83.7Confident82Confident95 Ų9597.7 Ų97.749%0.48751%0.512SS..Hα-helixtrans-63-42.3177.4-68.3165.9000110.6K631 L632 Q633 S638 L639K631-I635 VanDerWaalsContact O-CG1 3.3Å; K631-I635 WeakPolarHBondContact O-CG1 3.43Å; K631-I635 PolarHBondContact O-N 3.37Å; K631-I635 VanDerWaalsContact O-N 3.1Å; L632-I635 PolarHBondContact O-N 3.43Å; Q633-I635 VanDerWaalsContact C-N 3.32Å; Q633-I635 PolarHBondContact O-N 3.37Å; I635-S638 WeakPolarHBondContact O-CB 3.47Å; I635-S638 PolarHBondContact O-N 3.46Å; I635-L639 HydrophobicContact CG2-CD1 4.04Å; I635-L639 PolarHBondContact O-N 2.75Å
636N80.6Confident81.8Confident81 Ų8199 Ų9943%0.43351%0.51SS..Hα-helixtrans-67.2-41-178.7-140.619.8000111.7L632 Q633 I634 S638 L639 H640L632-N636 WeakPolarHBondContact O-CB 3.41Å; L632-N636 PolarHBondContact O-N 2.9Å; Q633-N636 PolarHBondContact O-N 3.25Å; Q633-N636 VanDerWaalsContact O-N 3.15Å; I634-N636 VanDerWaalsContact C-N 3.33Å; I634-N636 PolarHBondContact O-N 2.88Å; N636-S638 VanDerWaalsContact C-N 3.33Å; N636-S638 PolarHBondContact O-N 3.48Å; N636-L639 PolarHBondContact O-N 3.45Å; N636-H640 PolarHBondContact O-N 2.85Å
637D84.3Confident81.2Confident79 Ų7997 Ų9742%0.42251%0.508SS..Hα-helixtrans-65.2-37.9176.2-66.1-20.9000111.3Q633 I634 T641Q633-D637 PolarHBondContact NE2-OD1 2.84Å; Q633-D637 PolarHBondContact NE2-OD2 2.91Å; Q633-D637 VanDerWaalsContact O-CG 3.26Å; Q633-D637 PolarHBondContact O-N 2.82Å; I634-D637 PolarHBondContact O-N 3.09Å; D637-T641 PolarHBondContact O-N 3.38Å; D637-T641 PolarHBondContact O-OG1 3.37Å
638S83.7Confident80.7Confident74 Ų74101.8 Ų101.852%0.51752%0.518SS..Hα-helixtrans-63.7-47.4172.8-1750000112.1I634 I635 N636 H640 T641 Q642I634-S638 WeakPolarHBondContact O-CB 3.35Å; I634-S638 PolarHBondContact O-N 3.39Å; I635-S638 WeakPolarHBondContact O-CB 3.47Å; I635-S638 PolarHBondContact O-N 3.46Å; N636-S638 VanDerWaalsContact C-N 3.33Å; N636-S638 PolarHBondContact O-N 3.48Å; S638-H640 VanDerWaalsContact C-N 3.35Å; S638-H640 PolarHBondContact O-N 2.96Å; S638-T641 PolarHBondContact O-N 3.01Å; S638-Q642 PolarHBondContact O-N 3.46Å
639L82.6Confident80.3Confident92 Ų92101 Ų10148%0.48252%0.518SS..Hα-helixtrans-61.7-42.2177.3-80.3167.7000111.5I635 N636 T641 Q642 L643I635-L639 HydrophobicContact CG2-CD1 4.04Å; I635-L639 PolarHBondContact O-N 2.75Å; N636-L639 PolarHBondContact O-N 3.45Å; L639-T641 VanDerWaalsContact C-N 3.3Å; L639-T641 PolarHBondContact O-N 2.91Å; L639-Q642 PolarHBondContact O-N 2.84Å; L639-L643 VanDerWaalsContact O-CB 3.23Å; L639-L643 WeakPolarHBondContact O-CB 3.48Å; L639-L643 PolarHBondContact O-N 3.34Å
640H79.4Confident79.6Confident109 Ų10999.9 Ų99.951%0.50552%0.518SS..Hα-helixtrans-62-38.6175-89.8-41.8000112.7N636 S638 N644N636-H640 PolarHBondContact O-N 2.85Å; S638-H640 VanDerWaalsContact C-N 3.35Å; S638-H640 PolarHBondContact O-N 2.96Å; H640-N644 WeakPolarHBondContact O-CB 3.33Å; H640-N644 PolarHBondContact O-N 3.45Å; H640-N644 PolarHBondContact O-ND2 3.44Å
641T80Confident79Confident89 Ų8997.7 Ų97.755%0.54651%0.513SS..Hα-helixtrans-66-44.6176.6-53.40000111D637 S638 L639 N644 C645D637-T641 PolarHBondContact O-N 3.38Å; D637-T641 PolarHBondContact O-OG1 3.37Å; S638-T641 PolarHBondContact O-N 3.01Å; L639-T641 VanDerWaalsContact C-N 3.3Å; L639-T641 PolarHBondContact O-N 2.91Å; T641-N644 PolarHBondContact O-N 2.81Å; T641-C645 PolarHBondContact O-N 3.22Å; T641-C645 PolarHBondContact O-SG 3.42Å
642Q79.2Confident78.3Confident102 Ų10297.4 Ų97.448%0.47751%0.511SS..Hα-helixtrans-63.2-45.9176.5-173.9176.1-9.500111.9S638 L639 N644 C645 E646S638-Q642 PolarHBondContact O-N 3.46Å; L639-Q642 PolarHBondContact O-N 2.84Å; Q642-N644 VanDerWaalsContact C-N 3.3Å; Q642-N644 PolarHBondContact O-N 2.88Å; Q642-C645 WeakPolarHBondContact O-CB 3.44Å; Q642-C645 PolarHBondContact O-N 3Å; Q642-C645 VanDerWaalsContact O-N 3.07Å; Q642-E646 PolarHBondContact NE2-OE1 3.32Å; Q642-E646 VanDerWaalsContact NE2-OE1 3.11Å; Q642-E646 PolarHBondContact O-N 3.37Å
643L77Confident77.7Confident111 Ų11195.6 Ų95.658%0.58151%0.511SS*.Hα-helixtrans-64.6-35.4-179.3-155.2146.3000111.5L639 S647L639-L643 VanDerWaalsContact O-CB 3.23Å; L639-L643 WeakPolarHBondContact O-CB 3.48Å; L639-L643 PolarHBondContact O-N 3.34Å; L643-S647 WeakPolarHBondContact O-CB 3.24Å; L643-S647 PolarHBondContact O-N 2.94Å
644N76.8Confident77.3Confident93 Ų9394.9 Ų94.950%0.49751%0.51SS..Hα-helixtrans-66.7-39.8171.1-81.1-28.4000112.8H640 T641 Q642 R648H640-N644 WeakPolarHBondContact O-CB 3.33Å; H640-N644 PolarHBondContact O-N 3.45Å; H640-N644 PolarHBondContact O-ND2 3.44Å; T641-N644 PolarHBondContact O-N 2.81Å; Q642-N644 VanDerWaalsContact C-N 3.3Å; Q642-N644 PolarHBondContact O-N 2.88Å; N644-R648 WeakPolarHBondContact O-CG 3.33Å; N644-R648 PolarHBondContact O-N 3.26Å
645C76.5Confident76.8Confident61 Ų6194.3 Ų94.341%0.41251%0.505SS..Hα-helixtrans-65-45.7174.7-75.60000111.7T641 Q642 R648 N649T641-C645 PolarHBondContact O-N 3.22Å; T641-C645 PolarHBondContact O-SG 3.42Å; Q642-C645 WeakPolarHBondContact O-CB 3.44Å; Q642-C645 PolarHBondContact O-N 3Å; Q642-C645 VanDerWaalsContact O-N 3.07Å; C645-R648 PolarHBondContact O-N 2.85Å; C645-N649 PolarHBondContact O-N 3.38Å
646E75.9Confident76.4Confident109 Ų10994.6 Ų94.651%0.50951%0.507SS..Hα-helixtrans-64-41176-74.7179.5-163.800111.8Q642 R648 N649 C650Q642-E646 PolarHBondContact NE2-OE1 3.32Å; Q642-E646 VanDerWaalsContact NE2-OE1 3.11Å; Q642-E646 PolarHBondContact O-N 3.37Å; E646-R648 PolarHBondContact O-N 3.42Å; E646-N649 PolarHBondContact O-N 2.98Å; E646-C650 VanDerWaalsContact O-CB 3.26Å; E646-C650 WeakPolarHBondContact O-CB 3.29Å; E646-C650 PolarHBondContact O-N 3.11Å
647S71.8Confident76Confident66 Ų6697.4 Ų97.446%0.46251%0.513SS..Hα-helixtrans-61.2-42.2174.8-176.30000112.1L643 C650 T651L643-S647 WeakPolarHBondContact O-CB 3.24Å; L643-S647 PolarHBondContact O-N 2.94Å; S647-C650 PolarHBondContact O-N 3.36Å; S647-T651 PolarHBondContact O-N 2.89Å; S647-T651 PolarHBondContact O-OG1 3.41Å
648R73.1Confident75.6Confident167 Ų16797.9 Ų97.963%0.6352%0.515SS*.Hα-helixtrans-64.6-39.3173.9-78.1-179.2-172.6148.62.3112.7N644 C645 E646 T651 K652N644-R648 WeakPolarHBondContact O-CG 3.33Å; N644-R648 PolarHBondContact O-N 3.26Å; C645-R648 PolarHBondContact O-N 2.85Å; E646-R648 PolarHBondContact O-N 3.42Å; R648-T651 VanDerWaalsContact CA-OG1 3.25Å; R648-T651 WeakPolarHBondContact CA-OG1 3.27Å; R648-T651 PolarHBondContact O-OG1 3.5Å; R648-K652 WeakPolarHBondContact O-CG 3.38Å; R648-K652 PolarHBondContact O-N 3.2Å
649N75.9Confident75.3Confident103 Ų103100.6 Ų100.655%0.55152%0.517SS*.Hα-helixtrans-70.1-40177.3-71.8-15.2000111.3C645 E646 K652 A653C645-N649 PolarHBondContact O-N 3.38Å; E646-N649 PolarHBondContact O-N 2.98Å; N649-K652 PolarHBondContact O-N 2.93Å; N649-A653 VanDerWaalsContact O-CB 3.28Å; N649-A653 WeakPolarHBondContact O-CB 3.49Å; N649-A653 PolarHBondContact O-N 3.41Å
650C69.8Low74.9Confident87 Ų8798.8 Ų98.859%0.58852%0.516SS*.Hα-helixtrans-64-42.7175.1-172.70000111.5E646 S647 A653 N654E646-C650 VanDerWaalsContact O-CB 3.26Å; E646-C650 WeakPolarHBondContact O-CB 3.29Å; E646-C650 PolarHBondContact O-N 3.11Å; S647-C650 PolarHBondContact O-N 3.36Å; C650-A653 PolarHBondContact O-N 3.26Å; C650-N654 VanDerWaalsContact O-CB 3.24Å; C650-N654 WeakPolarHBondContact O-CB 3.43Å; C650-N654 PolarHBondContact O-N 2.95Å
651T71.1Confident74.6Confident77 Ų7798.2 Ų98.247%0.47251%0.513SS..Hα-helixtrans-64.2-42.9174.433.30000112.3S647 R648 N654 E655S647-T651 PolarHBondContact O-N 2.89Å; S647-T651 PolarHBondContact O-OG1 3.41Å; R648-T651 VanDerWaalsContact CA-OG1 3.25Å; R648-T651 WeakPolarHBondContact CA-OG1 3.27Å; R648-T651 PolarHBondContact O-OG1 3.5Å; T651-N654 PolarHBondContact O-N 3.48Å; T651-E655 PolarHBondContact O-N 3.24Å
652K73.1Confident74.5Confident132 Ų13296.9 Ų96.957%0.57451%0.511SS*.Hα-helixtrans-62.8-42.8173.1-75.8178.6-179.9179.60112.7R648 N649 N654 E655 N656R648-K652 WeakPolarHBondContact O-CG 3.38Å; R648-K652 PolarHBondContact O-N 3.2Å; N649-K652 PolarHBondContact O-N 2.93Å; K652-N654 VanDerWaalsContact C-N 3.33Å; K652-E655 PolarHBondContact O-N 3.45Å; K652-N656 WeakPolarHBondContact O-CB 3.45Å; K652-N656 VanDerWaalsContact O-CG 3.25Å; K652-N656 PolarHBondContact O-N 2.96Å; K652-N656 PolarHBondContact O-ND2 2.96Å
653A69.8Low74.5Confident60 Ų6097.1 Ų97.150%0.49652%0.515SS..Hα-helixtrans-63.7-40.8176.600000111.2N649 C650 N656 Y657N649-A653 VanDerWaalsContact O-CB 3.28Å; N649-A653 WeakPolarHBondContact O-CB 3.49Å; N649-A653 PolarHBondContact O-N 3.41Å; C650-A653 PolarHBondContact O-N 3.26Å; A653-N656 PolarHBondContact O-N 3.48Å; A653-Y657 WeakPolarHBondContact O-CB 3.45Å; A653-Y657 PolarHBondContact O-N 3.49Å
654N73.8Confident74.6Confident86 Ų8695.4 Ų95.446%0.4651%0.509SS..Hα-helixtrans-68.2-40.3176.5-167.747.2000112.2C650 T651 K652 N656 Y657 L658C650-N654 VanDerWaalsContact O-CB 3.24Å; C650-N654 WeakPolarHBondContact O-CB 3.43Å; C650-N654 PolarHBondContact O-N 2.95Å; T651-N654 PolarHBondContact O-N 3.48Å; K652-N654 VanDerWaalsContact C-N 3.33Å; N654-N656 VanDerWaalsContact C-N 3.33Å; N654-N656 PolarHBondContact O-N 3.37Å; N654-Y657 PolarHBondContact O-N 2.95Å; N654-L658 WeakPolarHBondContact O-CB 3.23Å; N654-L658 VanDerWaalsContact O-CG 3.31Å; N654-L658 WeakPolarHBondContact O-CG 3.46Å; N654-L658 PolarHBondContact O-N 3.06Å
655E73.7Confident74.7Confident108 Ų10896.8 Ų96.851%0.50551%0.511SS..Hα-helixtrans-61.6-41.4171.8-80.8-174.3-177.200111.9T651 K652 L658 K659T651-E655 PolarHBondContact O-N 3.24Å; K652-E655 PolarHBondContact O-N 3.45Å; E655-L658 PolarHBondContact O-N 3.32Å; E655-K659 WeakPolarHBondContact O-CB 3.29Å; E655-K659 VanDerWaalsContact O-CG 3.27Å; E655-K659 WeakPolarHBondContact O-CG 3.45Å; E655-K659 PolarHBondContact O-N 2.86Å
656N76.3Confident74.9Confident100 Ų10099.3 Ų99.354%0.53552%0.517SS..Hα-helixtrans-67.8-39176.2-72.2-19.2000111.7K652 A653 N654 K659 A660K652-N656 WeakPolarHBondContact O-CB 3.45Å; K652-N656 VanDerWaalsContact O-CG 3.25Å; K652-N656 PolarHBondContact O-N 2.96Å; K652-N656 PolarHBondContact O-ND2 2.96Å; A653-N656 PolarHBondContact O-N 3.48Å; N654-N656 VanDerWaalsContact C-N 3.33Å; N654-N656 PolarHBondContact O-N 3.37Å; N656-K659 PolarHBondContact O-N 3.46Å; N656-A660 VanDerWaalsContact O-CB 3.3Å; N656-A660 WeakPolarHBondContact O-CB 3.38Å; N656-A660 PolarHBondContact O-N 2.79Å
657Y72.5Confident75.1Confident140 Ų14098.7 Ų98.755%0.54952%0.516SS..Hα-helixtrans-62-48.1173.5177.2-92.3000111A653 N654 K659 A660 E661A653-Y657 WeakPolarHBondContact O-CB 3.45Å; A653-Y657 PolarHBondContact O-N 3.49Å; N654-Y657 PolarHBondContact O-N 2.95Å; Y657-K659 VanDerWaalsContact C-N 3.35Å; Y657-K659 PolarHBondContact O-N 3.42Å; Y657-A660 CarbonylContact O-C 3.59Å; Y657-A660 PolarHBondContact O-N 3.48Å; Y657-A660 VanDerWaalsContact O-N 3.16Å; Y657-E661 HydrophobicContact CE1-CB 4.47Å; Y657-E661 VanDerWaalsContact CE1-OE2 3.28Å; Y657-E661 WeakPolarHBondContact CE1-OE2 3.5Å; Y657-E661 WeakPolarHBondContact O-CB 3.47Å; Y657-E661 PolarHBondContact O-N 3.27Å
658L74.6Confident75.5Confident90 Ų90100.5 Ų100.547%0.47152%0.517SS..Hα-helixtrans-63.4-38.4177.2-73.7167.3000112.3N654 E655 A662N654-L658 WeakPolarHBondContact O-CB 3.23Å; N654-L658 VanDerWaalsContact O-CG 3.31Å; N654-L658 WeakPolarHBondContact O-CG 3.46Å; N654-L658 PolarHBondContact O-N 3.06Å; E655-L658 PolarHBondContact O-N 3.32Å; L658-A662 VanDerWaalsContact O-CB 3.25Å; L658-A662 WeakPolarHBondContact O-CB 3.4Å; L658-A662 PolarHBondContact O-N 2.77Å
659K78.1Confident75.8Confident130 Ų13097.4 Ų97.457%0.56551%0.51SS*.Hα-helixtrans-65-42.2172.9-76171.5-175.4166.60111.6E655 N656 Y657 L663E655-K659 WeakPolarHBondContact O-CB 3.29Å; E655-K659 VanDerWaalsContact O-CG 3.27Å; E655-K659 WeakPolarHBondContact O-CG 3.45Å; E655-K659 PolarHBondContact O-N 2.86Å; N656-K659 PolarHBondContact O-N 3.46Å; Y657-K659 VanDerWaalsContact C-N 3.35Å; Y657-K659 PolarHBondContact O-N 3.42Å; K659-L663 VanDerWaalsContact O-CB 3.3Å; K659-L663 WeakPolarHBondContact O-CB 3.37Å; K659-L663 PolarHBondContact O-N 3.18Å
660A73.5Confident76.1Confident54 Ų5497.8 Ų97.845%0.44651%0.507SS..Hα-helixtrans-66.3-42.5176.300000111.5N656 Y657 L663 V664N656-A660 VanDerWaalsContact O-CB 3.3Å; N656-A660 WeakPolarHBondContact O-CB 3.38Å; N656-A660 PolarHBondContact O-N 2.79Å; Y657-A660 CarbonylContact O-C 3.59Å; Y657-A660 PolarHBondContact O-N 3.48Å; Y657-A660 VanDerWaalsContact O-N 3.16Å; A660-L663 PolarHBondContact O-N 3.31Å; A660-V664 WeakPolarHBondContact O-CB 3.31Å; A660-V664 VanDerWaalsContact O-CG2 3.28Å; A660-V664 WeakPolarHBondContact O-CG2 3.36Å; A660-V664 PolarHBondContact O-N 3.32Å
661E74.9Confident76.5Confident97 Ų9796.2 Ų96.245%0.45350%0.5SS..Hα-helixtrans-64.5-43.4176.8-171.8178.2-169.600111.2Y657 L663 V664 K665Y657-E661 HydrophobicContact CE1-CB 4.47Å; Y657-E661 VanDerWaalsContact CE1-OE2 3.28Å; Y657-E661 WeakPolarHBondContact CE1-OE2 3.5Å; Y657-E661 WeakPolarHBondContact O-CB 3.47Å; Y657-E661 PolarHBondContact O-N 3.27Å; E661-L663 VanDerWaalsContact C-N 3.31Å; E661-L663 PolarHBondContact O-N 3.15Å; E661-V664 PolarHBondContact O-N 3.38Å; E661-K665 VanDerWaalsContact O-CB 3.26Å; E661-K665 WeakPolarHBondContact O-CB 3.31Å; E661-K665 PolarHBondContact O-N 3.41Å
662A77.8Confident76.9Confident61 Ų6199.2 Ų99.250%0.50450%0.503SS..Hα-helixtrans-61.6-39.6173.400000111.9L658 H666L658-A662 VanDerWaalsContact O-CB 3.25Å; L658-A662 WeakPolarHBondContact O-CB 3.4Å; L658-A662 PolarHBondContact O-N 2.77Å; A662-H666 VanDerWaalsContact O-CB 3.28Å; A662-H666 WeakPolarHBondContact O-CB 3.41Å; A662-H666 PolarHBondContact O-N 2.95Å
663L78.9Confident77.3Confident107 Ų10796.3 Ų96.356%0.5650%0.499SS*.Hα-helixtrans-70.1-41.5177.7-162.6149.4000111.5K659 A660 E661 H666 L667K659-L663 VanDerWaalsContact O-CB 3.3Å; K659-L663 WeakPolarHBondContact O-CB 3.37Å; K659-L663 PolarHBondContact O-N 3.18Å; A660-L663 PolarHBondContact O-N 3.31Å; E661-L663 VanDerWaalsContact C-N 3.31Å; E661-L663 PolarHBondContact O-N 3.15Å; L663-H666 PolarHBondContact O-N 2.88Å; L663-L667 HydrophobicContact CD2-CD1 3.57Å; L663-L667 HydrophobicContact CD2-CG 4.07Å; L663-L667 WeakPolarHBondContact O-CB 3.34Å; L663-L667 VanDerWaalsContact O-CG 3.28Å; L663-L667 WeakPolarHBondContact O-CG 3.35Å; L663-L667 PolarHBondContact O-N 2.98Å
664V78.3Confident77.9Confident75 Ų7596.8 Ų96.846%0.45549%0.493SS..Hα-helixtrans-61-47.7172.61690000110.2A660 E661 H666 L667 E668A660-V664 WeakPolarHBondContact O-CB 3.31Å; A660-V664 VanDerWaalsContact O-CG2 3.28Å; A660-V664 WeakPolarHBondContact O-CG2 3.36Å; A660-V664 PolarHBondContact O-N 3.32Å; E661-V664 PolarHBondContact O-N 3.38Å; V664-H666 VanDerWaalsContact C-N 3.35Å; V664-H666 PolarHBondContact O-N 2.75Å; V664-L667 CarbonylContact O-C 3.54Å; V664-L667 WeakPolarHBondContact O-CB 3.43Å; V664-L667 PolarHBondContact O-N 2.98Å; V664-L667 VanDerWaalsContact O-N 3.11Å; V664-E668 HydrophobicContact CG1-CG 4.29Å; V664-E668 WeakPolarHBondContact O-CB 3.38Å; V664-E668 WeakPolarHBondContact O-CG 3.48Å; V664-E668 PolarHBondContact O-N 2.87Å
665K78.7Confident78.2Confident122 Ų12298 Ų9853%0.5350%0.496SS..Hα-helixtrans-62.7-41.2179-162.2176.1-175.9179.10112E661 E668 E669E661-K665 VanDerWaalsContact O-CB 3.26Å; E661-K665 WeakPolarHBondContact O-CB 3.31Å; E661-K665 PolarHBondContact O-N 3.41Å; K665-E668 PolarHBondContact O-N 3.31Å; K665-E669 WeakPolarHBondContact O-CB 3.42Å; K665-E669 WeakPolarHBondContact O-CG 3.37Å; K665-E669 PolarHBondContact O-N 3.32Å
666H82Confident78.6Confident115 Ų11597.1 Ų97.153%0.53250%0.495SS..Hα-helixtrans-63.9-40.2172.7177.6-88.2000112A662 L663 V664 K670A662-H666 VanDerWaalsContact O-CB 3.28Å; A662-H666 WeakPolarHBondContact O-CB 3.41Å; A662-H666 PolarHBondContact O-N 2.95Å; L663-H666 PolarHBondContact O-N 2.88Å; V664-H666 VanDerWaalsContact C-N 3.35Å; V664-H666 PolarHBondContact O-N 2.75Å; H666-K670 VanDerWaalsContact O-CB 3.25Å; H666-K670 WeakPolarHBondContact O-CB 3.34Å; H666-K670 PolarHBondContact O-N 2.9Å
667L79Confident78.9Confident95 Ų9597.7 Ų97.750%0.49749%0.494SS..Hα-helixtrans-67.5-37.5174.4-73.6176.7000112.3L663 V664 K670 A671L663-L667 HydrophobicContact CD2-CD1 3.57Å; L663-L667 HydrophobicContact CD2-CG 4.07Å; L663-L667 WeakPolarHBondContact O-CB 3.34Å; L663-L667 VanDerWaalsContact O-CG 3.28Å; L663-L667 WeakPolarHBondContact O-CG 3.35Å; L663-L667 PolarHBondContact O-N 2.98Å; V664-L667 CarbonylContact O-C 3.54Å; V664-L667 WeakPolarHBondContact O-CB 3.43Å; V664-L667 PolarHBondContact O-N 2.98Å; V664-L667 VanDerWaalsContact O-N 3.11Å; L667-K670 PolarHBondContact O-N 2.64Å; L667-A671 WeakPolarHBondContact O-CB 3.46Å; L667-A671 PolarHBondContact O-N 3.14Å
668E79.9Confident79.1Confident104 Ų10496 Ų9649%0.48649%0.494SS..Hα-helixtrans-67.2-41.6174.8-75.6180175.200111.9V664 K665 A671 R672V664-E668 HydrophobicContact CG1-CG 4.29Å; V664-E668 WeakPolarHBondContact O-CB 3.38Å; V664-E668 WeakPolarHBondContact O-CG 3.48Å; V664-E668 PolarHBondContact O-N 2.87Å; K665-E668 PolarHBondContact O-N 3.31Å; E668-A671 PolarHBondContact O-N 2.98Å; E668-R672 WeakPolarHBondContact O-CB 3.45Å; E668-R672 PolarHBondContact O-N 3.47Å
669E80.4Confident79.4Confident102 Ų10297.5 Ų97.548%0.47750%0.496SS..Hα-helixtrans-65-44173.8-77.6173-17400110.9K665 R672 S673K665-E669 WeakPolarHBondContact O-CB 3.42Å; K665-E669 WeakPolarHBondContact O-CG 3.37Å; K665-E669 PolarHBondContact O-N 3.32Å; E669-R672 PolarHBondContact O-N 3.15Å; E669-S673 WeakPolarHBondContact O-CB 3.39Å; E669-S673 PolarHBondContact O-N 2.9Å
670K82.6Confident79.6Confident111 Ų11196 Ų9648%0.48350%0.495SS..Hα-helixtrans-62.7-41.4173.4-170.4174.8-177.8179.30111.6H666 L667 S673 N674H666-K670 VanDerWaalsContact O-CB 3.25Å; H666-K670 WeakPolarHBondContact O-CB 3.34Å; H666-K670 PolarHBondContact O-N 2.9Å; L667-K670 PolarHBondContact O-N 2.64Å; K670-S673 PolarHBondContact O-N 2.94Å; K670-N674 WeakPolarHBondContact O-CB 3.4Å; K670-N674 PolarHBondContact O-N 3.45Å; K670-N674 PolarHBondContact O-OD1 3.48Å
671A76.7Confident80Confident55 Ų5598 Ų9846%0.45550%0.497SS..Hα-helixtrans-64.7-40.8175.600000111.7L667 E668 N674 Q675L667-A671 WeakPolarHBondContact O-CB 3.46Å; L667-A671 PolarHBondContact O-N 3.14Å; E668-A671 PolarHBondContact O-N 2.98Å; A671-N674 PolarHBondContact O-N 2.87Å; A671-Q675 VanDerWaalsContact O-CB 3.24Å; A671-Q675 WeakPolarHBondContact O-CB 3.47Å; A671-Q675 PolarHBondContact O-N 2.84Å
672R80.3Confident80.2Confident140 Ų14096.4 Ų96.453%0.52849%0.494SS..Hα-helixtrans-64-44173.4-110.2-178.1-78.2155.2-4.8112E668 E669 Q675 N676E668-R672 WeakPolarHBondContact O-CB 3.45Å; E668-R672 PolarHBondContact O-N 3.47Å; E669-R672 PolarHBondContact O-N 3.15Å; R672-Q675 PolarHBondContact O-N 2.84Å; R672-N676 PolarHBondContact O-N 2.91Å
673S82.1Confident80.3Confident70 Ų7098.8 Ų98.849%0.4950%0.495SS..Hα-helixtrans-59.8-50.2175.5-171.10000110.6E669 K670 Q675 N676 E677E669-S673 WeakPolarHBondContact O-CB 3.39Å; E669-S673 PolarHBondContact O-N 2.9Å; K670-S673 PolarHBondContact O-N 2.94Å; S673-Q675 VanDerWaalsContact C-N 3.31Å; S673-Q675 PolarHBondContact O-N 3.36Å; S673-N676 PolarHBondContact O-N 2.97Å; S673-E677 WeakPolarHBondContact O-CB 3.3Å; S673-E677 PolarHBondContact O-N 3.14Å
674N81.7Confident80.4Confident70 Ų70100 Ų10037%0.37450%0.496SS..Hα-helixtrans-61.7-38.2176.6-705000111.8K670 A671 E677 I678K670-N674 WeakPolarHBondContact O-CB 3.4Å; K670-N674 PolarHBondContact O-N 3.45Å; K670-N674 PolarHBondContact O-OD1 3.48Å; A671-N674 PolarHBondContact O-N 2.87Å; N674-E677 PolarHBondContact O-N 3.2Å; N674-I678 WeakPolarHBondContact O-CB 3.43Å; N674-I678 WeakPolarHBondContact O-CG1 3.41Å; N674-I678 PolarHBondContact O-N 2.94Å
675Q80.2Confident80.2Confident112 Ų11299 Ų9952%0.52350%0.496SS..Hα-helixtrans-68.1-37.2178-170.4173.91400112A671 R672 S673 K679A671-Q675 VanDerWaalsContact O-CB 3.24Å; A671-Q675 WeakPolarHBondContact O-CB 3.47Å; A671-Q675 PolarHBondContact O-N 2.84Å; R672-Q675 PolarHBondContact O-N 2.84Å; S673-Q675 VanDerWaalsContact C-N 3.31Å; S673-Q675 PolarHBondContact O-N 3.36Å; Q675-K679 WeakPolarHBondContact O-CG 3.35Å; Q675-K679 PolarHBondContact O-N 3.47Å
676N82.9Confident80.4Confident89 Ų8999.5 Ų99.548%0.47649%0.494SS..Hα-helixtrans-67.2-43.1172.4-72.3-16.2000111R672 S673 I678 K679 D680R672-N676 PolarHBondContact O-N 2.91Å; S673-N676 PolarHBondContact O-N 2.97Å; N676-I678 PolarHBondContact O-N 2.77Å; N676-K679 WeakPolarHBondContact O-CB 3.44Å; N676-K679 PolarHBondContact O-N 3.26Å; N676-K679 VanDerWaalsContact O-N 3.15Å; N676-D680 PolarHBondContact O-N 3.43Å
677E80.9Confident80.3Confident112 Ų11296.3 Ų96.352%0.52349%0.488SS..Hα-helixtrans-62.6-41.6175.2-170.7174-16700111.8S673 N674 K679 D680 L681S673-E677 WeakPolarHBondContact O-CB 3.3Å; S673-E677 PolarHBondContact O-N 3.14Å; N674-E677 PolarHBondContact O-N 3.2Å; E677-K679 VanDerWaalsContact C-N 3.34Å; E677-K679 PolarHBondContact O-N 3.26Å; E677-D680 PolarHBondContact O-N 2.99Å; E677-L681 HydrophobicContact CG-CD1 4.11Å; E677-L681 HydrophobicContact CG-CG 4.47Å; E677-L681 VanDerWaalsContact O-CB 3.31Å; E677-L681 WeakPolarHBondContact O-CB 3.33Å; E677-L681 VanDerWaalsContact O-CG 3.25Å; E677-L681 WeakPolarHBondContact O-CG 3.5Å; E677-L681 PolarHBondContact O-N 2.76Å
678I77.8Confident80.1Confident105 Ų10596.7 Ų96.754%0.53849%0.489SS..Hα-helixtrans-62-41.8172.9-72.1165.2000110.6N674 N676 L681 T682N674-I678 WeakPolarHBondContact O-CB 3.43Å; N674-I678 WeakPolarHBondContact O-CG1 3.41Å; N674-I678 PolarHBondContact O-N 2.94Å; N676-I678 PolarHBondContact O-N 2.77Å; I678-L681 PolarHBondContact O-N 2.87Å; I678-T682 VanDerWaalsContact O-CB 3.24Å; I678-T682 WeakPolarHBondContact O-CB 3.48Å; I678-T682 PolarHBondContact O-N 2.81Å; I678-T682 PolarHBondContact O-OG1 2.98Å
679K81.3Confident79.9Confident121 Ų12196.3 Ų96.353%0.52649%0.487SS..Hα-helixtrans-61.6-48175.4-81.3178.4179.6178.10111.2Q675 N676 E677 L681 T682 E683Q675-K679 WeakPolarHBondContact O-CG 3.35Å; Q675-K679 PolarHBondContact O-N 3.47Å; N676-K679 WeakPolarHBondContact O-CB 3.44Å; N676-K679 PolarHBondContact O-N 3.26Å; N676-K679 VanDerWaalsContact O-N 3.15Å; E677-K679 VanDerWaalsContact C-N 3.34Å; E677-K679 PolarHBondContact O-N 3.26Å; K679-L681 PolarHBondContact O-N 3.48Å; K679-T682 WeakPolarHBondContact O-CB 3.45Å; K679-T682 PolarHBondContact O-N 3.19Å; K679-T682 VanDerWaalsContact O-N 3.17Å; K679-E683 WeakPolarHBondContact O-CB 3.49Å; K679-E683 PolarHBondContact O-N 3.45Å
680D82.3Confident79.8Confident99 Ų9998 Ų9853%0.52949%0.493SS..Hα-helixtrans-62.9-41.9178.6-76.5-4.6000111.8N676 E677 T682 E683 K684N676-D680 PolarHBondContact O-N 3.43Å; E677-D680 PolarHBondContact O-N 2.99Å; D680-T682 VanDerWaalsContact C-N 3.35Å; D680-E683 PolarHBondContact O-N 3.15Å; D680-K684 WeakPolarHBondContact O-CB 3.32Å; D680-K684 VanDerWaalsContact O-CG 3.29Å; D680-K684 WeakPolarHBondContact O-CG 3.41Å; D680-K684 PolarHBondContact O-N 3.14Å
681L80.5Confident79.5Confident96 Ų9698.6 Ų98.650%0.50350%0.498SS..Hα-helixtrans-66.7-36.3174.5-72.5173000111.8E677 I678 K679 K684 A685E677-L681 HydrophobicContact CG-CD1 4.11Å; E677-L681 HydrophobicContact CG-CG 4.47Å; E677-L681 VanDerWaalsContact O-CB 3.31Å; E677-L681 WeakPolarHBondContact O-CB 3.33Å; E677-L681 VanDerWaalsContact O-CG 3.25Å; E677-L681 WeakPolarHBondContact O-CG 3.5Å; E677-L681 PolarHBondContact O-N 2.76Å; I678-L681 PolarHBondContact O-N 2.87Å; K679-L681 PolarHBondContact O-N 3.48Å; L681-K684 PolarHBondContact O-N 3.33Å; L681-A685 VanDerWaalsContact O-CB 3.24Å; L681-A685 WeakPolarHBondContact O-CB 3.45Å; L681-A685 PolarHBondContact O-N 3.38Å
682T80.9Confident79.5Confident64 Ų64100 Ų10039%0.39350%0.497SS..Hα-helixtrans-69.2-38.3175.4-56.10000111.2I678 K679 D680 A685 R686I678-T682 VanDerWaalsContact O-CB 3.24Å; I678-T682 WeakPolarHBondContact O-CB 3.48Å; I678-T682 PolarHBondContact O-N 2.81Å; I678-T682 PolarHBondContact O-OG1 2.98Å; K679-T682 WeakPolarHBondContact O-CB 3.45Å; K679-T682 PolarHBondContact O-N 3.19Å; K679-T682 VanDerWaalsContact O-N 3.17Å; D680-T682 VanDerWaalsContact C-N 3.35Å; T682-A685 PolarHBondContact O-N 3.49Å; T682-R686 WeakPolarHBondContact O-CB 3.27Å; T682-R686 PolarHBondContact O-N 3.41Å
683E80.1Confident79.5Confident111 Ų11199 Ų9952%0.51950%0.497SS..Hα-helixtrans-63.1-48173.5-156.690.5-12100110.3K679 D680 R686 A687K679-E683 WeakPolarHBondContact O-CB 3.49Å; K679-E683 PolarHBondContact O-N 3.45Å; D680-E683 PolarHBondContact O-N 3.15Å; E683-R686 PolarHBondContact O-N 3.18Å; E683-R686 IonicContact OE1-CZ 3.09Å; E683-R686 IonicContact OE1-NH1 2.8Å; E683-R686 PolarHBondContact OE1-NH1 3.21Å; E683-R686 IonicContact OE1-NH2 3.3Å; E683-A687 PolarHBondContact O-N 2.87Å
684K80.9Confident79.1Confident131 Ų131100.8 Ų100.857%0.5750%0.497SS*.Hα-helixtrans-61.5-43175-75.1173.1-177.9172.50111.8D680 L681 R686 A687 I688D680-K684 WeakPolarHBondContact O-CB 3.32Å; D680-K684 VanDerWaalsContact O-CG 3.29Å; D680-K684 WeakPolarHBondContact O-CG 3.41Å; D680-K684 PolarHBondContact O-N 3.14Å; L681-K684 PolarHBondContact O-N 3.33Å; K684-R686 PolarHBondContact O-N 3.06Å; K684-A687 PolarHBondContact O-N 2.91Å; K684-I688 WeakPolarHBondContact O-CB 3.48Å; K684-I688 VanDerWaalsContact O-CG1 3.27Å; K684-I688 WeakPolarHBondContact O-CG1 3.12Å; K684-I688 PolarHBondContact O-N 3.43Å
685A73.8Confident78.7Confident56 Ų56102.9 Ų102.946%0.46351%0.505SS..Hα-helixtrans-62.7-41.3175.800000111.6L681 T682 I688 E689L681-A685 VanDerWaalsContact O-CB 3.24Å; L681-A685 WeakPolarHBondContact O-CB 3.45Å; L681-A685 PolarHBondContact O-N 3.38Å; T682-A685 PolarHBondContact O-N 3.49Å; A685-I688 PolarHBondContact O-N 2.96Å; A685-E689 WeakPolarHBondContact O-CB 3.32Å; A685-E689 PolarHBondContact O-N 3.34Å
686R81.2Confident78.5Confident132 Ų132106 Ų10650%0.49851%0.511SS..Hα-helixtrans-63.2-40.4173.1-94.3-172.6-86.3118.2-1.9112.4T682 E683 K684 E689 K690T682-R686 WeakPolarHBondContact O-CB 3.27Å; T682-R686 PolarHBondContact O-N 3.41Å; E683-R686 PolarHBondContact O-N 3.18Å; E683-R686 IonicContact OE1-CZ 3.09Å; E683-R686 IonicContact OE1-NH1 2.8Å; E683-R686 PolarHBondContact OE1-NH1 3.21Å; E683-R686 IonicContact OE1-NH2 3.3Å; K684-R686 PolarHBondContact O-N 3.06Å; R686-E689 PolarHBondContact O-N 3.42Å; R686-K690 WeakPolarHBondContact O-CB 3.33Å; R686-K690 PolarHBondContact O-N 3.45Å
687A80.1Confident78.3Confident47 Ų47106.3 Ų106.339%0.38851%0.513SS..Hα-helixtrans-63.5-48.6175.700000111.1E683 K684 E689 K690 E691E683-A687 PolarHBondContact O-N 2.87Å; K684-A687 PolarHBondContact O-N 2.91Å; A687-E689 VanDerWaalsContact C-N 3.31Å; A687-E689 PolarHBondContact O-N 3.4Å; A687-K690 WeakPolarHBondContact O-CB 3.45Å; A687-K690 PolarHBondContact O-N 2.91Å; A687-K690 VanDerWaalsContact O-N 3.12Å; A687-E691 WeakPolarHBondContact O-CG 3.36Å; A687-E691 PolarHBondContact O-N 3.19Å
688I76.1Confident78.1Confident103 Ų103104.3 Ų104.353%0.52851%0.506SS..Hα-helixtrans-61.1-39.5175.6-67.4166.1000110.9K684 A685 K690 E691 L692K684-I688 WeakPolarHBondContact O-CB 3.48Å; K684-I688 VanDerWaalsContact O-CG1 3.27Å; K684-I688 WeakPolarHBondContact O-CG1 3.12Å; K684-I688 PolarHBondContact O-N 3.43Å; A685-I688 PolarHBondContact O-N 2.96Å; I688-K690 VanDerWaalsContact C-N 3.31Å; I688-K690 PolarHBondContact O-N 2.82Å; I688-E691 PolarHBondContact O-N 2.97Å; I688-L692 WeakPolarHBondContact O-CB 3.33Å; I688-L692 PolarHBondContact O-N 3.47Å
689E76.2Confident77.7Confident96 Ų96103 Ų10345%0.44951%0.505SS..Hα-helixtrans-66.4-35177.2-159.7-165.7151.900111.8A685 R686 A687 K693A685-E689 WeakPolarHBondContact O-CB 3.32Å; A685-E689 PolarHBondContact O-N 3.34Å; R686-E689 PolarHBondContact O-N 3.42Å; A687-E689 VanDerWaalsContact C-N 3.31Å; A687-E689 PolarHBondContact O-N 3.4Å; E689-K693 WeakPolarHBondContact O-CB 3.43Å; E689-K693 VanDerWaalsContact O-CG 3.32Å; E689-K693 WeakPolarHBondContact O-CG 3.35Å; E689-K693 PolarHBondContact O-N 3.39Å; E689-K693 VanDerWaalsContact OE1-CE 3.32Å; E689-K693 WeakPolarHBondContact OE1-CE 3.49Å; E689-K693 IonicContact OE1-NZ 2.78Å; E689-K693 PolarHBondContact OE1-NZ 2.86Å
690K78.4Confident77.3Confident137 Ų137100 Ų10060%0.59650%0.499SS*.Hα-helixtrans-69.7-45.5174.3-166.2-175.4175.2-166.80111.2R686 A687 I688 L692 K693 E694R686-K690 WeakPolarHBondContact O-CB 3.33Å; R686-K690 PolarHBondContact O-N 3.45Å; A687-K690 WeakPolarHBondContact O-CB 3.45Å; A687-K690 PolarHBondContact O-N 2.91Å; A687-K690 VanDerWaalsContact O-N 3.12Å; I688-K690 VanDerWaalsContact C-N 3.31Å; I688-K690 PolarHBondContact O-N 2.82Å; K690-L692 VanDerWaalsContact C-N 3.32Å; K690-L692 PolarHBondContact O-N 2.79Å; K690-K693 PolarHBondContact O-N 3.49Å; K690-E694 PolarHBondContact O-N 3.12Å
691E75.6Confident77Confident125 Ų125100.5 Ų100.558%0.58450%0.497SS*.Hα-helixtrans-59.3-42.6172.8-73.5175.7-175.100111.1A687 I688 K693 E694 E695A687-E691 WeakPolarHBondContact O-CG 3.36Å; A687-E691 PolarHBondContact O-N 3.19Å; I688-E691 PolarHBondContact O-N 2.97Å; E691-K693 VanDerWaalsContact C-N 3.34Å; E691-K693 PolarHBondContact O-N 2.86Å; E691-E694 PolarHBondContact O-N 3.24Å; E691-E695 VanDerWaalsContact O-CB 3.31Å; E691-E695 WeakPolarHBondContact O-CB 3.42Å; E691-E695 PolarHBondContact O-N 2.88Å
692L75.6Confident76.4Confident83 Ų8399.9 Ų99.944%0.43550%0.497SS..Hα-helixtrans-65.6-34.6176.5-168.3112.2000112.1I688 K690 R696I688-L692 WeakPolarHBondContact O-CB 3.33Å; I688-L692 PolarHBondContact O-N 3.47Å; K690-L692 VanDerWaalsContact C-N 3.32Å; K690-L692 PolarHBondContact O-N 2.79Å; L692-R696 VanDerWaalsContact O-CB 3.28Å; L692-R696 WeakPolarHBondContact O-CB 3.44Å; L692-R696 WeakPolarHBondContact O-CG 3.47Å; L692-R696 PolarHBondContact O-N 3.3Å
693K80.2Confident76.2Confident121 Ų121103 Ų10353%0.52651%0.505SS..Hα-helixtrans-68.9-42.3172.9-78.3170.7-173.8160.60111.6E689 K690 E691 R696 L697E689-K693 WeakPolarHBondContact O-CB 3.43Å; E689-K693 VanDerWaalsContact O-CG 3.32Å; E689-K693 WeakPolarHBondContact O-CG 3.35Å; E689-K693 PolarHBondContact O-N 3.39Å; E689-K693 VanDerWaalsContact OE1-CE 3.32Å; E689-K693 WeakPolarHBondContact OE1-CE 3.49Å; E689-K693 IonicContact OE1-NZ 2.78Å; E689-K693 PolarHBondContact OE1-NZ 2.86Å; K690-K693 PolarHBondContact O-N 3.49Å; E691-K693 VanDerWaalsContact C-N 3.34Å; E691-K693 PolarHBondContact O-N 2.86Å; K693-R696 PolarHBondContact O-N 3.32Å; K693-L697 WeakPolarHBondContact O-CB 3.48Å; K693-L697 PolarHBondContact O-N 3.38Å
694E74.5Confident75.8Confident107 Ų107103.6 Ų103.650%0.551%0.507SS..Hα-helixtrans-64.2-41.6174-78177.7-169.700111.3K690 E691 L697 N698K690-E694 PolarHBondContact O-N 3.12Å; E691-E694 PolarHBondContact O-N 3.24Å; E694-L697 CarbonylContact O-C 3.59Å; E694-L697 WeakPolarHBondContact O-CB 3.27Å; E694-L697 PolarHBondContact O-N 2.99Å; E694-N698 WeakPolarHBondContact O-CB 3.39Å; E694-N698 VanDerWaalsContact O-CG 3.31Å; E694-N698 PolarHBondContact O-N 2.86Å
695E72.4Confident75.4Confident113 Ų113100.8 Ų100.853%0.52850%0.501SS..Hα-helixtrans-71.1-35.1178.4-163.656.6-152.700112.1E691 L697 N698 C699E691-E695 VanDerWaalsContact O-CB 3.31Å; E691-E695 WeakPolarHBondContact O-CB 3.42Å; E691-E695 PolarHBondContact O-N 2.88Å; E695-L697 VanDerWaalsContact C-N 3.34Å; E695-N698 PolarHBondContact O-N 3.27Å; E695-C699 WeakPolarHBondContact O-CB 3.3Å; E695-C699 PolarHBondContact O-N 2.94Å
696R77Confident75.4Confident177 Ų177102.5 Ų102.567%0.66850%0.502SS*.Hα-helixtrans-62.8-40.2168.9-79.8175.7-179.7-169.22.5111.8L692 K693 S700L692-R696 VanDerWaalsContact O-CB 3.28Å; L692-R696 WeakPolarHBondContact O-CB 3.44Å; L692-R696 WeakPolarHBondContact O-CG 3.47Å; L692-R696 PolarHBondContact O-N 3.3Å; K693-R696 PolarHBondContact O-N 3.32Å; R696-S700 WeakPolarHBondContact O-CB 3.38Å; R696-S700 PolarHBondContact O-N 2.82Å
697L79.6Confident75.1Confident97 Ų97101.1 Ų101.151%0.50850%0.502SS..Hα-helixtrans-66.4-41175.2-175.269000111.1K693 E694 E695 S700 K701K693-L697 WeakPolarHBondContact O-CB 3.48Å; K693-L697 PolarHBondContact O-N 3.38Å; E694-L697 CarbonylContact O-C 3.59Å; E694-L697 WeakPolarHBondContact O-CB 3.27Å; E694-L697 PolarHBondContact O-N 2.99Å; E695-L697 VanDerWaalsContact C-N 3.34Å; L697-S700 WeakPolarHBondContact O-CB 3.48Å; L697-S700 PolarHBondContact O-N 3.12Å; L697-K701 WeakPolarHBondContact O-CG 3.4Å; L697-K701 PolarHBondContact O-N 3.37Å
698N75.3Confident75.1Confident70 Ų70105 Ų10537%0.37451%0.51SS..Hα-helixtrans-65.1-45.8174.8-72.2-19.3000111.4E694 E695 S700 K701 V702E694-N698 WeakPolarHBondContact O-CB 3.39Å; E694-N698 VanDerWaalsContact O-CG 3.31Å; E694-N698 PolarHBondContact O-N 2.86Å; E695-N698 PolarHBondContact O-N 3.27Å; N698-S700 VanDerWaalsContact C-N 3.29Å; N698-S700 PolarHBondContact O-N 3.48Å; N698-K701 CarbonylContact O-C 3.57Å; N698-K701 WeakPolarHBondContact O-CB 3.43Å; N698-K701 PolarHBondContact O-N 2.91Å; N698-K701 VanDerWaalsContact O-N 3.15Å; N698-V702 WeakPolarHBondContact O-CB 3.46Å; N698-V702 VanDerWaalsContact O-CG2 3.3Å; N698-V702 WeakPolarHBondContact O-CG2 3.28Å; N698-V702 PolarHBondContact O-N 3.15Å
699C69.2Low74.9Confident76 Ų76105.6 Ų105.651%0.51451%0.51SS..Hα-helixtrans-58.4-39.7172.2-92.70000111.9E695 V702 K703E695-C699 WeakPolarHBondContact O-CB 3.3Å; E695-C699 PolarHBondContact O-N 2.94Å; C699-V702 PolarHBondContact O-N 2.87Å; C699-K703 VanDerWaalsContact O-CB 3.24Å; C699-K703 WeakPolarHBondContact O-CB 3.46Å; C699-K703 PolarHBondContact O-N 2.9Å
700S73.2Confident74.8Confident59 Ų59106.3 Ų106.341%0.41351%0.513SS..Hα-helixtrans-63.6-43.7174.8-165.30000111.5R696 L697 N698 K703 E704R696-S700 WeakPolarHBondContact O-CB 3.38Å; R696-S700 PolarHBondContact O-N 2.82Å; L697-S700 WeakPolarHBondContact O-CB 3.48Å; L697-S700 PolarHBondContact O-N 3.12Å; N698-S700 VanDerWaalsContact C-N 3.29Å; N698-S700 PolarHBondContact O-N 3.48Å; S700-K703 PolarHBondContact O-N 3.32Å; S700-E704 WeakPolarHBondContact O-CG 3.42Å; S700-E704 PolarHBondContact O-N 2.79Å
701K75.6Confident74.9Confident110 Ų110106.3 Ų106.348%0.47851%0.514SS..Hα-helixtrans-64.4-42.8174.8-71.8174-178172.90112L697 N698 K703 E704 T705L697-K701 WeakPolarHBondContact O-CG 3.4Å; L697-K701 PolarHBondContact O-N 3.37Å; N698-K701 CarbonylContact O-C 3.57Å; N698-K701 WeakPolarHBondContact O-CB 3.43Å; N698-K701 PolarHBondContact O-N 2.91Å; N698-K701 VanDerWaalsContact O-N 3.15Å; K701-K703 VanDerWaalsContact C-N 3.29Å; K701-K703 PolarHBondContact O-N 3.19Å; K701-E704 PolarHBondContact O-N 3.39Å; K701-T705 WeakPolarHBondContact O-CG2 3.44Å; K701-T705 PolarHBondContact O-N 2.81Å; K701-T705 PolarHBondContact O-OG1 2.8Å
702V69Low75Confident82 Ų82105.5 Ų105.550%0.49751%0.508SS..Hα-helixtrans-63.9-37.31761710000110.5N698 C699 T705 L706N698-V702 WeakPolarHBondContact O-CB 3.46Å; N698-V702 VanDerWaalsContact O-CG2 3.3Å; N698-V702 WeakPolarHBondContact O-CG2 3.28Å; N698-V702 PolarHBondContact O-N 3.15Å; C699-V702 PolarHBondContact O-N 2.87Å; V702-T705 WeakPolarHBondContact CA-OG1 3.49Å; V702-T705 PolarHBondContact O-N 3.45Å; V702-T705 PolarHBondContact O-OG1 3.17Å; V702-L706 HydrophobicContact CG1-CD1 4.38Å; V702-L706 WeakPolarHBondContact O-CB 3.43Å; V702-L706 PolarHBondContact O-N 3.47Å
703K76.6Confident75Confident130 Ų130108.3 Ų108.357%0.56552%0.517SS*.Hα-helixtrans-66.8-44.2174.6-171.6-179.7178.5-171.50111.5C699 S700 K701 T705 L706 E707C699-K703 VanDerWaalsContact O-CB 3.24Å; C699-K703 WeakPolarHBondContact O-CB 3.46Å; C699-K703 PolarHBondContact O-N 2.9Å; S700-K703 PolarHBondContact O-N 3.32Å; K701-K703 VanDerWaalsContact C-N 3.29Å; K701-K703 PolarHBondContact O-N 3.19Å; K703-T705 VanDerWaalsContact C-N 3.34Å; K703-T705 PolarHBondContact O-N 2.73Å; K703-L706 PolarHBondContact O-N 3.47Å; K703-E707 VanDerWaalsContact CE-OE1 3.27Å; K703-E707 WeakPolarHBondContact CE-OE1 3.42Å; K703-E707 WeakPolarHBondContact O-CB 3.38Å; K703-E707 WeakPolarHBondContact O-CG 3.47Å; K703-E707 PolarHBondContact O-N 2.81Å
704E72.4Confident74.7Confident123 Ų123109.7 Ų109.758%0.57552%0.52SS*.Hα-helixtrans-61.9-39.9174-76.9177-173.300112.1S700 K701 F708S700-E704 WeakPolarHBondContact O-CG 3.42Å; S700-E704 PolarHBondContact O-N 2.79Å; K701-E704 PolarHBondContact O-N 3.39Å; E704-F708 VanDerWaalsContact O-CB 3.3Å; E704-F708 WeakPolarHBondContact O-CB 3.26Å; E704-F708 PolarHBondContact O-N 3.25Å
705T71.5Confident74.9Confident72 Ų72110.1 Ų110.144%0.44252%0.522SS..Hα-helixtrans-69.3-36.7174.7580000111.7K701 V702 K703 F708 H709K701-T705 WeakPolarHBondContact O-CG2 3.44Å; K701-T705 PolarHBondContact O-N 2.81Å; K701-T705 PolarHBondContact O-OG1 2.8Å; V702-T705 WeakPolarHBondContact CA-OG1 3.49Å; V702-T705 PolarHBondContact O-N 3.45Å; V702-T705 PolarHBondContact O-OG1 3.17Å; K703-T705 VanDerWaalsContact C-N 3.34Å; K703-T705 PolarHBondContact O-N 2.73Å; T705-F708 WeakPolarHBondContact O-CB 3.15Å; T705-F708 PolarHBondContact O-N 2.92Å; T705-H709 WeakPolarHBondContact O-CB 3.5Å; T705-H709 PolarHBondContact O-CD2 3.47Å; T705-H709 PolarHBondContact O-N 2.88Å
706L73.2Confident75.1Confident93 Ų93110.2 Ų110.249%0.48753%0.525SS..Hα-helixtrans-63-48.3172.5-114.8151.7000111.6V702 K703 F708 H709 E710V702-L706 HydrophobicContact CG1-CD1 4.38Å; V702-L706 WeakPolarHBondContact O-CB 3.43Å; V702-L706 PolarHBondContact O-N 3.47Å; K703-L706 PolarHBondContact O-N 3.47Å; L706-F708 VanDerWaalsContact C-N 3.28Å; L706-F708 PolarHBondContact O-N 3.48Å; L706-H709 CarbonylContact O-C 3.53Å; L706-H709 PolarHBondContact O-N 3.48Å; L706-H709 VanDerWaalsContact O-N 3.09Å; L706-E710 WeakPolarHBondContact O-CB 3.38Å; L706-E710 WeakPolarHBondContact O-CG 3.39Å; L706-E710 PolarHBondContact O-N 3.32Å
707E76Confident75.2Confident103 Ų103106.6 Ų106.648%0.48152%0.515SS..Hα-helixtrans-61-38.4175.7-74.5177.7-169.800111.1K703 K711K703-E707 VanDerWaalsContact CE-OE1 3.27Å; K703-E707 WeakPolarHBondContact CE-OE1 3.42Å; K703-E707 WeakPolarHBondContact O-CB 3.38Å; K703-E707 WeakPolarHBondContact O-CG 3.47Å; K703-E707 PolarHBondContact O-N 2.81Å; E707-K711 VanDerWaalsContact O-CB 3.3Å; E707-K711 WeakPolarHBondContact O-CB 3.25Å; E707-K711 PolarHBondContact O-N 2.83Å
708F79.8Confident75.2Confident128 Ų128106.8 Ų106.856%0.56151%0.514SS*.Hα-helixtrans-63.2-44.5171.9176.3-97.7000112E704 T705 L706 K711 K712E704-F708 VanDerWaalsContact O-CB 3.3Å; E704-F708 WeakPolarHBondContact O-CB 3.26Å; E704-F708 PolarHBondContact O-N 3.25Å; T705-F708 WeakPolarHBondContact O-CB 3.15Å; T705-F708 PolarHBondContact O-N 2.92Å; L706-F708 VanDerWaalsContact C-N 3.28Å; L706-F708 PolarHBondContact O-N 3.48Å; F708-K711 PolarHBondContact O-N 3.44Å; F708-K712 HydrophobicContact CE1-CD 4.25Å; F708-K712 HydrophobicContact CZ-CD 4.49Å; F708-K712 WeakPolarHBondContact O-CB 3.39Å; F708-K712 PolarHBondContact O-N 3.35Å
709H72.1Confident75.3Confident116 Ų116106.2 Ų106.254%0.53752%0.516SS..Hα-helixtrans-68.3-38.7177.6-77.9-59.6000112.6T705 L706 K712 F713T705-H709 WeakPolarHBondContact O-CB 3.5Å; T705-H709 PolarHBondContact O-CD2 3.47Å; T705-H709 PolarHBondContact O-N 2.88Å; L706-H709 CarbonylContact O-C 3.53Å; L706-H709 PolarHBondContact O-N 3.48Å; L706-H709 VanDerWaalsContact O-N 3.09Å; H709-K712 PolarHBondContact O-N 3.34Å; H709-F713 VanDerWaalsContact O-CB 3.25Å; H709-F713 WeakPolarHBondContact O-CB 3.38Å; H709-F713 PolarHBondContact O-N 3.23Å
710E73.9Confident75.5Confident110 Ų110106.1 Ų106.151%0.51452%0.516SS..Hα-helixtrans-62.4-46.6173-78-175.7168.200110.6L706 K712 F713 Y714L706-E710 WeakPolarHBondContact O-CB 3.38Å; L706-E710 WeakPolarHBondContact O-CG 3.39Å; L706-E710 PolarHBondContact O-N 3.32Å; E710-K712 VanDerWaalsContact C-N 3.33Å; E710-K712 PolarHBondContact O-N 2.87Å; E710-F713 WeakPolarHBondContact O-CB 3.3Å; E710-F713 PolarHBondContact O-N 2.87Å; E710-Y714 VanDerWaalsContact O-CD2 3.31Å; E710-Y714 WeakPolarHBondContact O-CD2 3.23Å; E710-Y714 PolarHBondContact O-N 3.01Å
711K81.2Confident75.7Confident138 Ų138107.2 Ų107.260%0.652%0.515SS*.Hα-helixtrans-60.4-44.1175.3-172.1177.1179.3-179.10111.5E707 F708 F713 Y714 E715E707-K711 VanDerWaalsContact O-CB 3.3Å; E707-K711 WeakPolarHBondContact O-CB 3.25Å; E707-K711 PolarHBondContact O-N 2.83Å; F708-K711 PolarHBondContact O-N 3.44Å; K711-F713 VanDerWaalsContact C-N 3.32Å; K711-F713 PolarHBondContact O-N 3.48Å; K711-Y714 PolarHBondContact O-N 3.45Å; K711-E715 WeakPolarHBondContact O-CG 3.35Å; K711-E715 PolarHBondContact O-N 3.01Å
712K76.1Confident75.7Confident108 Ų108108.5 Ų108.547%0.4752%0.52SS..Hα-helixtrans-65.8-35.1176.9-156.2-178.6-173.7-174.70112F708 H709 E710 E715 L716F708-K712 HydrophobicContact CE1-CD 4.25Å; F708-K712 HydrophobicContact CZ-CD 4.49Å; F708-K712 WeakPolarHBondContact O-CB 3.39Å; F708-K712 PolarHBondContact O-N 3.35Å; H709-K712 PolarHBondContact O-N 3.34Å; E710-K712 VanDerWaalsContact C-N 3.33Å; E710-K712 PolarHBondContact O-N 2.87Å; K712-E715 PolarHBondContact O-N 3.32Å; K712-L716 WeakPolarHBondContact O-CB 3.34Å; K712-L716 PolarHBondContact O-N 2.87Å
713F77.1Confident76.1Confident142 Ų142109.4 Ų109.462%0.62352%0.522SS*.Hα-helixtrans-68.4-42174.2-175.1-94.6000111.5H709 E710 K711 L716 K717H709-F713 VanDerWaalsContact O-CB 3.25Å; H709-F713 WeakPolarHBondContact O-CB 3.38Å; H709-F713 PolarHBondContact O-N 3.23Å; E710-F713 WeakPolarHBondContact O-CB 3.3Å; E710-F713 PolarHBondContact O-N 2.87Å; K711-F713 VanDerWaalsContact C-N 3.32Å; K711-F713 PolarHBondContact O-N 3.48Å; F713-L716 PolarHBondContact O-N 3.41Å; F713-K717 VanDerWaalsContact O-CB 3.3Å; F713-K717 WeakPolarHBondContact O-CB 3.4Å; F713-K717 PolarHBondContact O-N 3.38Å
714Y73.4Confident76.2Confident149 Ų149107.3 Ų107.358%0.58451%0.514SS*.Hα-helixtrans-61.3-44.3171.4-90.5-74.6000111.4E710 K711 L716 K717 M718E710-Y714 VanDerWaalsContact O-CD2 3.31Å; E710-Y714 WeakPolarHBondContact O-CD2 3.23Å; E710-Y714 PolarHBondContact O-N 3.01Å; K711-Y714 PolarHBondContact O-N 3.45Å; Y714-L716 PolarHBondContact O-N 2.88Å; Y714-K717 PolarHBondContact O-N 3.45Å; Y714-M718 WeakPolarHBondContact O-CB 3.43Å; Y714-M718 VanDerWaalsContact O-CG 3.26Å; Y714-M718 WeakPolarHBondContact O-CG 3.4Å; Y714-M718 PolarHBondContact O-N 3.2Å
715E78.4Confident76.5Confident117 Ų117107.7 Ų107.755%0.54752%0.516SS..Hα-helixtrans-59.9-44174.6-74.5172.6-169.900112K711 K712 M718 S719K711-E715 WeakPolarHBondContact O-CG 3.35Å; K711-E715 PolarHBondContact O-N 3.01Å; K712-E715 PolarHBondContact O-N 3.32Å; E715-M718 PolarHBondContact O-N 3.45Å; E715-S719 WeakPolarHBondContact O-CB 3.49Å; E715-S719 PolarHBondContact O-N 3.37Å
716L75.9Confident76.9Confident114 Ų114107 Ų10760%0.59752%0.518SS*.Hα-helixtrans-63.4-41.9174.2-88.9156.6000112.4K712 F713 Y714 S719 S720K712-L716 WeakPolarHBondContact O-CB 3.34Å; K712-L716 PolarHBondContact O-N 2.87Å; F713-L716 PolarHBondContact O-N 3.41Å; Y714-L716 PolarHBondContact O-N 2.88Å; L716-S719 PolarHBondContact O-N 2.63Å; L716-S720 WeakPolarHBondContact O-CB 3.5Å; L716-S720 PolarHBondContact O-N 2.87Å
717K80.7Confident77Confident102 Ų102106.8 Ų106.844%0.44352%0.516SS..Hα-helixtrans-62.9-47.2176.4-173.9-179.1177.4-174.10110.9F713 Y714 S719 S720 E721F713-K717 VanDerWaalsContact O-CB 3.3Å; F713-K717 WeakPolarHBondContact O-CB 3.4Å; F713-K717 PolarHBondContact O-N 3.38Å; Y714-K717 PolarHBondContact O-N 3.45Å; K717-S719 VanDerWaalsContact C-N 3.3Å; K717-S719 PolarHBondContact O-N 3.23Å; K717-S720 WeakPolarHBondContact O-CB 3.43Å; K717-S720 PolarHBondContact O-N 3.21Å; K717-E721 VanDerWaalsContact CE-OE1 3.27Å; K717-E721 WeakPolarHBondContact CE-OE1 3.31Å; K717-E721 WeakPolarHBondContact O-CG 3.47Å; K717-E721 PolarHBondContact O-N 2.76Å
718M78.4Confident77.2Confident100 Ų100105.3 Ų105.349%0.49351%0.512SS..Hα-helixtrans-62.4-37.4174.9-66.4-53.2-59.400111.8Y714 E715 K722Y714-M718 WeakPolarHBondContact O-CB 3.43Å; Y714-M718 VanDerWaalsContact O-CG 3.26Å; Y714-M718 WeakPolarHBondContact O-CG 3.4Å; Y714-M718 PolarHBondContact O-N 3.2Å; E715-M718 PolarHBondContact O-N 3.45Å; M718-K722 WeakPolarHBondContact O-CB 3.48Å; M718-K722 WeakPolarHBondContact O-CG 3.4Å; M718-K722 PolarHBondContact O-N 2.84Å
719S77.3Confident77.3Confident58 Ų58103.6 Ų103.641%0.40651%0.508SS..Hα-helixtrans-67.3-39.5174.5-169.60000111.9E715 L716 K717 K722 N723E715-S719 WeakPolarHBondContact O-CB 3.49Å; E715-S719 PolarHBondContact O-N 3.37Å; L716-S719 PolarHBondContact O-N 2.63Å; K717-S719 VanDerWaalsContact C-N 3.3Å; K717-S719 PolarHBondContact O-N 3.23Å; S719-K722 PolarHBondContact O-N 3.36Å; S719-N723 WeakPolarHBondContact O-CB 3.45Å; S719-N723 PolarHBondContact O-N 3.48Å; S719-N723 PolarHBondContact O-ND2 3.38Å; S719-N723 PolarHBondContact O-OD1 3.29Å
720S74.4Confident77.6Confident75 Ų75100 Ų10052%0.52450%0.499SS..Hα-helixtrans-66.5-41.5175.9-172.30000111.3L716 K717 N723 Q724L716-S720 WeakPolarHBondContact O-CB 3.5Å; L716-S720 PolarHBondContact O-N 2.87Å; K717-S720 WeakPolarHBondContact O-CB 3.43Å; K717-S720 PolarHBondContact O-N 3.21Å; S720-N723 PolarHBondContact O-N 3.4Å; S720-Q724 WeakPolarHBondContact O-CB 3.32Å; S720-Q724 PolarHBondContact O-N 2.81Å
721E77Confident77.9Confident82 Ų82101.9 Ų101.938%0.38350%0.501SS..Hα-helixtrans-64.5-41.7175.1-75.3173.6-170.900111.4K717 Q724 Q725K717-E721 VanDerWaalsContact CE-OE1 3.27Å; K717-E721 WeakPolarHBondContact CE-OE1 3.31Å; K717-E721 WeakPolarHBondContact O-CG 3.47Å; K717-E721 PolarHBondContact O-N 2.76Å; E721-Q724 PolarHBondContact O-N 3.47Å; E721-Q725 WeakPolarHBondContact O-CG 3.35Å; E721-Q725 PolarHBondContact O-N 3.15Å
722K76.2Confident78Confident137 Ų137100.2 Ų100.260%0.59650%0.497SS*.Hα-helixtrans-62.8-41.7171.9-78.3-179.5179.9-179.20112.6M718 S719 Q724 Q725 A726M718-K722 WeakPolarHBondContact O-CB 3.48Å; M718-K722 WeakPolarHBondContact O-CG 3.4Å; M718-K722 PolarHBondContact O-N 2.84Å; S719-K722 PolarHBondContact O-N 3.36Å; K722-Q724 VanDerWaalsContact C-N 3.33Å; K722-Q725 PolarHBondContact O-N 2.94Å; K722-A726 WeakPolarHBondContact O-CB 3.44Å; K722-A726 PolarHBondContact O-N 3.38Å
723N75.8Confident78.3Confident100 Ų100100.1 Ų100.154%0.53550%0.498SS..Hα-helixtrans-64.6-40175.9-73.1-12000110.9S719 S720 A726 L727S719-N723 WeakPolarHBondContact O-CB 3.45Å; S719-N723 PolarHBondContact O-N 3.48Å; S719-N723 PolarHBondContact O-ND2 3.38Å; S719-N723 PolarHBondContact O-OD1 3.29Å; S720-N723 PolarHBondContact O-N 3.4Å; N723-A726 PolarHBondContact O-N 3.36Å; N723-L727 WeakPolarHBondContact O-CB 3.35Å; N723-L727 PolarHBondContact O-N 3.01Å
724Q79Confident78.3Confident86 Ų8698 Ų9840%0.40249%0.492SS..Hα-helixtrans-63.8-44.6175.1-172.959.443.500111.3S720 E721 K722 A726 L727 D728S720-Q724 WeakPolarHBondContact O-CB 3.32Å; S720-Q724 PolarHBondContact O-N 2.81Å; E721-Q724 PolarHBondContact O-N 3.47Å; K722-Q724 VanDerWaalsContact C-N 3.33Å; Q724-A726 VanDerWaalsContact C-N 3.31Å; Q724-A726 PolarHBondContact O-N 3.22Å; Q724-L727 WeakPolarHBondContact O-CB 3.39Å; Q724-L727 PolarHBondContact O-N 2.82Å; Q724-L727 VanDerWaalsContact O-N 3.14Å; Q724-D728 PolarHBondContact NE2-OD1 2.91Å; Q724-D728 PolarHBondContact NE2-OD2 3.41Å; Q724-D728 WeakPolarHBondContact O-CB 3.43Å; Q724-D728 VanDerWaalsContact O-CG 3.24Å; Q724-D728 PolarHBondContact O-N 3.5Å
725Q80Confident78.7Confident132 Ų13297 Ų9762%0.61749%0.491SS*.Hα-helixtrans-59.7-40.2173.2-73.4173.90.500112.2E721 K722 D728 L729E721-Q725 WeakPolarHBondContact O-CG 3.35Å; E721-Q725 PolarHBondContact O-N 3.15Å; K722-Q725 PolarHBondContact O-N 2.94Å; Q725-D728 PolarHBondContact O-N 3.06Å; Q725-L729 VanDerWaalsContact O-CB 3.32Å; Q725-L729 WeakPolarHBondContact O-CB 3.43Å; Q725-L729 PolarHBondContact O-N 3.34Å
726A78.1Confident78.7Confident57 Ų5796.8 Ų96.847%0.47149%0.49SS..Hα-helixtrans-67-3717500000112.2K722 N723 Q724 A730K722-A726 WeakPolarHBondContact O-CB 3.44Å; K722-A726 PolarHBondContact O-N 3.38Å; N723-A726 PolarHBondContact O-N 3.36Å; Q724-A726 VanDerWaalsContact C-N 3.31Å; Q724-A726 PolarHBondContact O-N 3.22Å; A726-A730 WeakPolarHBondContact O-CB 3.39Å; A726-A730 PolarHBondContact O-N 2.94Å
727L75.4Confident79Confident88 Ų8898.7 Ų98.746%0.46149%0.493SS..Hα-helixtrans-67.7-41.9175.5-126.1156.2000111.5N723 Q724 A730 R731N723-L727 WeakPolarHBondContact O-CB 3.35Å; N723-L727 PolarHBondContact O-N 3.01Å; Q724-L727 WeakPolarHBondContact O-CB 3.39Å; Q724-L727 PolarHBondContact O-N 2.82Å; Q724-L727 VanDerWaalsContact O-N 3.14Å; L727-A730 PolarHBondContact O-N 3.44Å; L727-R731 HydrophobicContact CD2-CG 4.49Å; L727-R731 WeakPolarHBondContact O-CB 3.39Å; L727-R731 VanDerWaalsContact O-CG 3.29Å; L727-R731 WeakPolarHBondContact O-CG 3.33Å; L727-R731 PolarHBondContact O-N 3.15Å
728D80.9Confident79Confident73 Ų7399.3 Ų99.339%0.3950%0.498SS..Hα-helixtrans-68-38.9176.5-66.3-25.9000110.9Q724 Q725 R731 M732Q724-D728 PolarHBondContact NE2-OD1 2.91Å; Q724-D728 PolarHBondContact NE2-OD2 3.41Å; Q724-D728 WeakPolarHBondContact O-CB 3.43Å; Q724-D728 VanDerWaalsContact O-CG 3.24Å; Q724-D728 PolarHBondContact O-N 3.5Å; Q725-D728 PolarHBondContact O-N 3.06Å; D728-R731 PolarHBondContact O-N 3.13Å; D728-R731 IonicContact OD1-NH1 2.82Å; D728-M732 WeakPolarHBondContact O-CB 3.47Å; D728-M732 PolarHBondContact O-N 3.31Å
729L82Confident79.1Confident91 Ų91100.3 Ų100.348%0.47650%0.501SS..Hα-helixtrans-62.3-43.9171.3-176.265.1000111.7Q725 M732 Q733Q725-L729 VanDerWaalsContact O-CB 3.32Å; Q725-L729 WeakPolarHBondContact O-CB 3.43Å; Q725-L729 PolarHBondContact O-N 3.34Å; L729-M732 HydrophobicContact CD1-CE 3.92Å; L729-M732 PolarHBondContact O-N 3.02Å; L729-Q733 WeakPolarHBondContact O-CG 3.48Å; L729-Q733 PolarHBondContact O-N 2.91Å
730A77.6Confident79.2Confident42 Ų42103.2 Ų103.235%0.34751%0.508SS..Hα-helixtrans-64.7-41.2176.600000112A726 L727 M732 Q733 I734A726-A730 WeakPolarHBondContact O-CB 3.39Å; A726-A730 PolarHBondContact O-N 2.94Å; L727-A730 PolarHBondContact O-N 3.44Å; A730-M732 VanDerWaalsContact C-N 3.32Å; A730-M732 PolarHBondContact O-N 3.42Å; A730-Q733 PolarHBondContact O-N 3.1Å; A730-I734 VanDerWaalsContact O-CG1 3.31Å; A730-I734 WeakPolarHBondContact O-CG1 3.41Å; A730-I734 PolarHBondContact O-N 3.05Å
731R81.9Confident79.4Confident149 Ų149104.5 Ų104.556%0.56251%0.506SS*.Hα-helixtrans-61.1-41.4173.6-77170.6175.2178.4-4.2111.8L727 D728 I734 K735L727-R731 HydrophobicContact CD2-CG 4.49Å; L727-R731 WeakPolarHBondContact O-CB 3.39Å; L727-R731 VanDerWaalsContact O-CG 3.29Å; L727-R731 WeakPolarHBondContact O-CG 3.33Å; L727-R731 PolarHBondContact O-N 3.15Å; D728-R731 PolarHBondContact O-N 3.13Å; D728-R731 IonicContact OD1-NH1 2.82Å; R731-I734 PolarHBondContact O-N 2.94Å; R731-K735 WeakPolarHBondContact O-CB 3.26Å; R731-K735 PolarHBondContact O-N 2.89Å
732M83.1Confident79.6Confident102 Ų102104.7 Ų104.750%0.50251%0.507SS..Hα-helixtrans-65.4-41.9176.9-158.7178.760.700111.2D728 L729 A730 K735 E736D728-M732 WeakPolarHBondContact O-CB 3.47Å; D728-M732 PolarHBondContact O-N 3.31Å; L729-M732 HydrophobicContact CD1-CE 3.92Å; L729-M732 PolarHBondContact O-N 3.02Å; A730-M732 VanDerWaalsContact C-N 3.32Å; A730-M732 PolarHBondContact O-N 3.42Å; M732-K735 PolarHBondContact O-N 3.29Å; M732-E736 WeakPolarHBondContact O-CG 3.33Å; M732-E736 PolarHBondContact O-N 2.89Å
733Q80.9Confident80Confident107 Ų107102.2 Ų102.250%0.550%0.497SS..Hα-helixtrans-63.9-39.7173.4-73.4179.3-8.700113L729 A730 K735 E736 K737L729-Q733 WeakPolarHBondContact O-CG 3.48Å; L729-Q733 PolarHBondContact O-N 2.91Å; A730-Q733 PolarHBondContact O-N 3.1Å; Q733-K735 VanDerWaalsContact C-N 3.34Å; Q733-E736 PolarHBondContact O-N 3.27Å; Q733-K737 WeakPolarHBondContact O-CB 3.33Å; Q733-K737 VanDerWaalsContact O-CG 3.23Å; Q733-K737 WeakPolarHBondContact O-CG 3.3Å; Q733-K737 PolarHBondContact O-N 2.92Å
734I77.9Confident80.2Confident97 Ų97101.6 Ų101.650%0.49749%0.493SS..Hα-helixtrans-61.1-46.6173.9-71.6165.6000109.5A730 R731 E736 K737 E738A730-I734 VanDerWaalsContact O-CG1 3.31Å; A730-I734 WeakPolarHBondContact O-CG1 3.41Å; A730-I734 PolarHBondContact O-N 3.05Å; R731-I734 PolarHBondContact O-N 2.94Å; I734-E736 PolarHBondContact O-N 3.39Å; I734-K737 CarbonylContact O-C 3.59Å; I734-K737 WeakPolarHBondContact O-CA 3.37Å; I734-K737 WeakPolarHBondContact O-CB 3.28Å; I734-K737 PolarHBondContact O-N 2.98Å; I734-K737 VanDerWaalsContact O-N 3.07Å; I734-E738 HydrophobicContact CG2-CG 4.27Å; I734-E738 WeakPolarHBondContact O-CG 3.36Å; I734-E738 PolarHBondContact O-N 3.11Å
735K82.3Confident80.4Confident127 Ų127102 Ų10255%0.55249%0.494SS*.Hα-helixtrans-62.3-40.8178.4-165.2179.4177.9-173.70112.5R731 M732 Q733 K737 E738 E739R731-K735 WeakPolarHBondContact O-CB 3.26Å; R731-K735 PolarHBondContact O-N 2.89Å; M732-K735 PolarHBondContact O-N 3.29Å; Q733-K735 VanDerWaalsContact C-N 3.34Å; K735-K737 VanDerWaalsContact C-N 3.32Å; K735-K737 PolarHBondContact O-N 3.42Å; K735-E738 PolarHBondContact O-N 2.86Å; K735-E739 WeakPolarHBondContact O-CG 3.3Å; K735-E739 PolarHBondContact O-N 2.84Å
736E78.2Confident80.6Confident114 Ų114103.1 Ų103.153%0.53349%0.492SS..Hα-helixtrans-61.8-39.2172.1-75.2175.7177.400112M732 Q733 I734 H740M732-E736 WeakPolarHBondContact O-CG 3.33Å; M732-E736 PolarHBondContact O-N 2.89Å; Q733-E736 PolarHBondContact O-N 3.27Å; I734-E736 PolarHBondContact O-N 3.39Å; E736-H740 WeakPolarHBondContact O-CB 3.47Å; E736-H740 PolarHBondContact O-N 3.34Å
737K82.3Confident80.8Confident154 Ų154105 Ų10567%0.6749%0.491SS*.Hα-helixtrans-69.8-36.7176-70.2-70.4-179-175.30112.3Q733 I734 K735 H740 H741Q733-K737 WeakPolarHBondContact O-CB 3.33Å; Q733-K737 VanDerWaalsContact O-CG 3.23Å; Q733-K737 WeakPolarHBondContact O-CG 3.3Å; Q733-K737 PolarHBondContact O-N 2.92Å; I734-K737 CarbonylContact O-C 3.59Å; I734-K737 WeakPolarHBondContact O-CA 3.37Å; I734-K737 WeakPolarHBondContact O-CB 3.28Å; I734-K737 PolarHBondContact O-N 2.98Å; I734-K737 VanDerWaalsContact O-N 3.07Å; K735-K737 VanDerWaalsContact C-N 3.32Å; K735-K737 PolarHBondContact O-N 3.42Å; K737-H740 PolarHBondContact O-N 2.93Å; K737-H741 WeakPolarHBondContact O-CB 3.49Å; K737-H741 PolarHBondContact O-N 3.37Å
738E80.1Confident81.1Confident114 Ų114106.7 Ų106.753%0.53350%0.5SS..Hα-helixtrans-65.1-45.4172.9-73.8172.4170.200111I734 K735 H740 H741 E742I734-E738 HydrophobicContact CG2-CG 4.27Å; I734-E738 WeakPolarHBondContact O-CG 3.36Å; I734-E738 PolarHBondContact O-N 3.11Å; K735-E738 PolarHBondContact O-N 2.86Å; E738-H740 VanDerWaalsContact C-N 3.34Å; E738-H740 PolarHBondContact O-N 3.42Å; E738-H741 WeakPolarHBondContact O-CB 3.48Å; E738-H741 PolarHBondContact O-N 2.77Å; E738-H741 VanDerWaalsContact O-N 3.14Å; E738-E742 PolarHBondContact O-N 3.43Å
739E81.7Confident81.3Confident121 Ų121107 Ų10757%0.56551%0.505SS*.Hα-helixtrans-61.5-41.8174-76.7178.6-170.900111.5K735 H741 E742 E743K735-E739 WeakPolarHBondContact O-CG 3.3Å; K735-E739 PolarHBondContact O-N 2.84Å; E739-H741 VanDerWaalsContact C-N 3.32Å; E739-H741 PolarHBondContact O-N 3.34Å; E739-E742 PolarHBondContact O-N 3.29Å; E739-E743 WeakPolarHBondContact O-CB 3.05Å; E739-E743 PolarHBondContact O-N 2.86Å
740H78.9Confident81.4Confident120 Ų120107 Ų10756%0.55651%0.505SS*.Hα-helixtrans-64.4-36.1173.6-173.7-83.1000112.2E736 K737 E738 L744E736-H740 WeakPolarHBondContact O-CB 3.47Å; E736-H740 PolarHBondContact O-N 3.34Å; K737-H740 PolarHBondContact O-N 2.93Å; E738-H740 VanDerWaalsContact C-N 3.34Å; E738-H740 PolarHBondContact O-N 3.42Å; H740-L744 WeakPolarHBondContact CE1-CD1 3.27Å; H740-L744 VanDerWaalsContact ND1-CD1 3.34Å; H740-L744 WeakPolarHBondContact ND1-CD1 3.26Å; H740-L744 WeakPolarHBondContact O-CB 3.49Å; H740-L744 PolarHBondContact O-N 3.35Å
741H79.1Confident81.6Confident102 Ų102110.2 Ų110.247%0.47252%0.516SS..Hα-helixtrans-69.5-41.8175.8-173.770.8000111.9K737 E738 E739 E743 L744 K745K737-H741 WeakPolarHBondContact O-CB 3.49Å; K737-H741 PolarHBondContact O-N 3.37Å; E738-H741 WeakPolarHBondContact O-CB 3.48Å; E738-H741 PolarHBondContact O-N 2.77Å; E738-H741 VanDerWaalsContact O-N 3.14Å; E739-H741 VanDerWaalsContact C-N 3.32Å; E739-H741 PolarHBondContact O-N 3.34Å; H741-E743 VanDerWaalsContact C-N 3.34Å; H741-L744 WeakPolarHBondContact O-CB 3.3Å; H741-L744 PolarHBondContact O-N 3.34Å; H741-K745 WeakPolarHBondContact NE2-CE 3.39Å; H741-K745 WeakPolarHBondContact O-CG 3.4Å; H741-K745 PolarHBondContact O-N 3.14Å
742E81.3Confident81.6Confident86 Ų86107 Ų10740%0.40251%0.51SS..Hα-helixtrans-65.3-37.1173.5-74.3-57.3132.500111.9E738 E739 K745 R746E738-E742 PolarHBondContact O-N 3.43Å; E739-E742 PolarHBondContact O-N 3.29Å; E742-K745 WeakPolarHBondContact O-CB 3.3Å; E742-K745 PolarHBondContact O-N 3.43Å; E742-K745 IonicContact OE1-NZ 3.61Å; E742-K745 PolarHBondContact OE1-NZ 2.9Å; E742-R746 WeakPolarHBondContact O-CG 3.32Å; E742-R746 PolarHBondContact O-N 2.95Å
743E83.5Confident81.6Confident84 Ų84107 Ų10739%0.39351%0.509SS..Hα-helixtrans-65.2-42.2172.2-175.155.2-147.600111.7E739 H741 K745 R746 Q747E739-E743 WeakPolarHBondContact O-CB 3.05Å; E739-E743 PolarHBondContact O-N 2.86Å; H741-E743 VanDerWaalsContact C-N 3.34Å; E743-K745 VanDerWaalsContact C-N 3.34Å; E743-K745 PolarHBondContact O-N 3.05Å; E743-R746 WeakPolarHBondContact O-CB 3.48Å; E743-R746 PolarHBondContact O-N 3.49Å; E743-R746 IonicContact OE2-NH1 3.29Å; E743-Q747 WeakPolarHBondContact O-CG 3.47Å; E743-Q747 PolarHBondContact O-N 3.47Å; E743-Q747 PolarHBondContact OE1-NE2 2.98Å
744L81.2Confident81.8Confident87 Ų87108 Ų10846%0.45551%0.513SS..Hα-helixtrans-60.3-40.5171.5-101.7144.7000112.4H740 H741 Q747 L748H740-L744 WeakPolarHBondContact CE1-CD1 3.27Å; H740-L744 VanDerWaalsContact ND1-CD1 3.34Å; H740-L744 WeakPolarHBondContact ND1-CD1 3.26Å; H740-L744 WeakPolarHBondContact O-CB 3.49Å; H740-L744 PolarHBondContact O-N 3.35Å; H741-L744 WeakPolarHBondContact O-CB 3.3Å; H741-L744 PolarHBondContact O-N 3.34Å; L744-Q747 PolarHBondContact O-N 2.98Å; L744-L748 WeakPolarHBondContact O-CB 3.47Å; L744-L748 PolarHBondContact O-N 3.36Å
745K82.1Confident82Confident94 Ų94109.5 Ų109.541%0.40952%0.516SS..Hα-helixtrans-62.2-44.1173.8-76.9-178.9-172.7162.10111.4H741 E742 E743 Q747 L748 V749H741-K745 WeakPolarHBondContact NE2-CE 3.39Å; H741-K745 WeakPolarHBondContact O-CG 3.4Å; H741-K745 PolarHBondContact O-N 3.14Å; E742-K745 WeakPolarHBondContact O-CB 3.3Å; E742-K745 PolarHBondContact O-N 3.43Å; E742-K745 IonicContact OE1-NZ 3.61Å; E742-K745 PolarHBondContact OE1-NZ 2.9Å; E743-K745 VanDerWaalsContact C-N 3.34Å; E743-K745 PolarHBondContact O-N 3.05Å; K745-Q747 VanDerWaalsContact C-N 3.34Å; K745-Q747 PolarHBondContact O-N 2.98Å; K745-L748 WeakPolarHBondContact O-CB 3.24Å; K745-L748 PolarHBondContact O-N 3.27Å; K745-V749 WeakPolarHBondContact O-CG2 3.24Å; K745-V749 PolarHBondContact O-N 3.44Å
746R83.8Confident82Confident157 Ų157109 Ų10959%0.59252%0.516SS*.Hα-helixtrans-60.5-43.6175.5-71174.5-170.7-178.92.6111.6E742 E743 V749 N750E742-R746 WeakPolarHBondContact O-CG 3.32Å; E742-R746 PolarHBondContact O-N 2.95Å; E743-R746 WeakPolarHBondContact O-CB 3.48Å; E743-R746 PolarHBondContact O-N 3.49Å; E743-R746 IonicContact OE2-NH1 3.29Å; R746-V749 PolarHBondContact O-N 2.93Å; R746-N750 PolarHBondContact O-N 3.33Å
747Q83.6Confident82.3Confident96 Ų96109.2 Ų109.245%0.44952%0.517SS..Hα-helixtrans-63.6-40.3175.8-70.8175.720.300112.2E743 L744 K745 N750 L751E743-Q747 WeakPolarHBondContact O-CG 3.47Å; E743-Q747 PolarHBondContact O-N 3.47Å; E743-Q747 PolarHBondContact OE1-NE2 2.98Å; L744-Q747 PolarHBondContact O-N 2.98Å; K745-Q747 VanDerWaalsContact C-N 3.34Å; K745-Q747 PolarHBondContact O-N 2.98Å; Q747-N750 PolarHBondContact O-N 2.85Å; Q747-L751 WeakPolarHBondContact O-CB 3.32Å; Q747-L751 PolarHBondContact O-N 3.43Å
748L81.3Confident82.2Confident123 Ų123104.7 Ų104.764%0.64450%0.504SS*.Hα-helixtrans-62.4-43.7175.1-167.586.4000111.6L744 K745 L751 N752L744-L748 WeakPolarHBondContact O-CB 3.47Å; L744-L748 PolarHBondContact O-N 3.36Å; K745-L748 WeakPolarHBondContact O-CB 3.24Å; K745-L748 PolarHBondContact O-N 3.27Å; L748-L751 PolarHBondContact O-N 2.79Å; L748-N752 WeakPolarHBondContact O-CB 3.49Å; L748-N752 PolarHBondContact O-N 3.28Å
749V83.7Confident82.2Confident80 Ų80102.9 Ų102.949%0.48550%0.498SS..Hα-helixtrans-62.3-43.8176171.40000110.8K745 R746 N752 Q753K745-V749 WeakPolarHBondContact O-CG2 3.24Å; K745-V749 PolarHBondContact O-N 3.44Å; R746-V749 PolarHBondContact O-N 2.93Å; V749-N752 PolarHBondContact O-N 2.94Å; V749-Q753 WeakPolarHBondContact O-CG 3.49Å; V749-Q753 PolarHBondContact O-N 3.36Å
750N85.1Confident82.4Confident90 Ų90102.2 Ų102.248%0.48150%0.498SS..Hα-helixtrans-62.8-46.2176.5-72.2-13.1000111.9R746 Q747 N752 Q753 E754R746-N750 PolarHBondContact O-N 3.33Å; Q747-N750 PolarHBondContact O-N 2.85Å; N750-N752 VanDerWaalsContact C-N 3.28Å; N750-N752 PolarHBondContact O-N 3.39Å; N750-Q753 PolarHBondContact O-N 2.86Å; N750-E754 WeakPolarHBondContact O-CG 3.45Å; N750-E754 PolarHBondContact O-N 3.16Å
751L82.1Confident82.7Confident110 Ų110102.5 Ų102.558%0.57650%0.497SS*.Hα-helixtrans-59.5-38.8174.6-88.4162000112.1Q747 L748 E754 K755Q747-L751 WeakPolarHBondContact O-CB 3.32Å; Q747-L751 PolarHBondContact O-N 3.43Å; L748-L751 PolarHBondContact O-N 2.79Å; L751-E754 PolarHBondContact O-N 2.96Å; L751-K755 WeakPolarHBondContact O-CB 3.3Å; L751-K755 PolarHBondContact O-N 3.43Å
752N82.1Confident82.7Confident82 Ų82103.3 Ų103.344%0.43950%0.501SS..Hα-helixtrans-70.1-38.9177.7-159.651.7000111.7L748 V749 N750 K755 E756L748-N752 WeakPolarHBondContact O-CB 3.49Å; L748-N752 PolarHBondContact O-N 3.28Å; V749-N752 PolarHBondContact O-N 2.94Å; N750-N752 VanDerWaalsContact C-N 3.28Å; N750-N752 PolarHBondContact O-N 3.39Å; N752-K755 WeakPolarHBondContact O-CB 3.45Å; N752-K755 PolarHBondContact O-N 2.91Å; N752-E756 WeakPolarHBondContact O-CG 3.41Å; N752-E756 PolarHBondContact O-N 3.48Å
753Q83.4Confident82.7Confident103 Ų103103.5 Ų103.548%0.48150%0.504SS..Hα-helixtrans-63.4-42.1171.7-75.8-177.5-2.900112.1V749 N750 K755 E756 Q757V749-Q753 WeakPolarHBondContact O-CG 3.49Å; V749-Q753 PolarHBondContact O-N 3.36Å; N750-Q753 PolarHBondContact O-N 2.86Å; Q753-K755 VanDerWaalsContact C-N 3.33Å; Q753-K755 PolarHBondContact O-N 3.24Å; Q753-E756 PolarHBondContact O-N 3.34Å; Q753-Q757 WeakPolarHBondContact O-CG 3.37Å; Q753-Q757 PolarHBondContact O-N 2.75Å
754E83.2Confident82.7Confident126 Ų126104.6 Ų104.659%0.58951%0.509SS*.Hα-helixtrans-63.3-39.7174.5-75.4-176.3174.700111.8N750 L751 Q757 S758N750-E754 WeakPolarHBondContact O-CG 3.45Å; N750-E754 PolarHBondContact O-N 3.16Å; L751-E754 PolarHBondContact O-N 2.96Å; E754-Q757 PolarHBondContact O-N 2.87Å; E754-S758 VanDerWaalsContact O-CB 3.32Å; E754-S758 WeakPolarHBondContact O-CB 3.15Å; E754-S758 PolarHBondContact O-N 3.48Å
755K82.8Confident82.8Confident130 Ų130105.4 Ų105.457%0.56551%0.513SS*.Hα-helixtrans-61.9-46.3173.3-176.8-175.7176.6-174.10111.3L751 N752 Q753 S758 I759L751-K755 WeakPolarHBondContact O-CB 3.3Å; L751-K755 PolarHBondContact O-N 3.43Å; N752-K755 WeakPolarHBondContact O-CB 3.45Å; N752-K755 PolarHBondContact O-N 2.91Å; Q753-K755 VanDerWaalsContact C-N 3.33Å; Q753-K755 PolarHBondContact O-N 3.24Å; K755-S758 WeakPolarHBondContact O-CB 3.46Å; K755-S758 PolarHBondContact O-N 2.81Å; K755-I759 HydrophobicContact CG-CD1 4.07Å; K755-I759 VanDerWaalsContact O-CG1 3.29Å; K755-I759 WeakPolarHBondContact O-CG1 3.45Å; K755-I759 PolarHBondContact O-N 3.12Å
756E81.8Confident82.9Confident117 Ų117104.4 Ų104.455%0.54752%0.515SS..Hα-helixtrans-60.7-43.8175.5-76.5177.6-173.700111.8N752 Q753 S758 I759 L760N752-E756 WeakPolarHBondContact O-CG 3.41Å; N752-E756 PolarHBondContact O-N 3.48Å; Q753-E756 PolarHBondContact O-N 3.34Å; E756-S758 VanDerWaalsContact C-N 3.33Å; E756-S758 PolarHBondContact O-N 2.94Å; E756-I759 PolarHBondContact O-N 2.83Å; E756-L760 WeakPolarHBondContact O-CB 3.19Å; E756-L760 PolarHBondContact O-N 3.3Å
757Q84.8Confident83Confident117 Ų117101 Ų10155%0.54751%0.509SS..Hα-helixtrans-63.3-38.2174.3-72.7-176.414.500112.5Q753 E754 L760 K761Q753-Q757 WeakPolarHBondContact O-CG 3.37Å; Q753-Q757 PolarHBondContact O-N 2.75Å; E754-Q757 PolarHBondContact O-N 2.87Å; Q757-L760 PolarHBondContact O-N 3.43Å; Q757-K761 WeakPolarHBondContact O-CG 3.42Å; Q757-K761 PolarHBondContact O-N 3.38Å
758S80.8Confident83.1Confident59 Ų59101 Ų10141%0.41351%0.512SS..Hα-helixtrans-65.6-43.2175.8-173.30000111.5E754 K755 E756 L760 K761 Q762E754-S758 VanDerWaalsContact O-CB 3.32Å; E754-S758 WeakPolarHBondContact O-CB 3.15Å; E754-S758 PolarHBondContact O-N 3.48Å; K755-S758 WeakPolarHBondContact O-CB 3.46Å; K755-S758 PolarHBondContact O-N 2.81Å; E756-S758 VanDerWaalsContact C-N 3.33Å; E756-S758 PolarHBondContact O-N 2.94Å; S758-L760 VanDerWaalsContact C-N 3.34Å; S758-L760 PolarHBondContact O-N 2.94Å; S758-K761 PolarHBondContact O-N 2.95Å; S758-Q762 WeakPolarHBondContact O-CG 3.5Å; S758-Q762 PolarHBondContact O-N 2.9Å
759I80.6Confident83.2Confident77 Ų7799.9 Ų99.940%0.39551%0.506SS..Hα-helixtrans-61.4-43.4173-68.3165.7000110.2K755 E756 K761 Q762 I763K755-I759 HydrophobicContact CG-CD1 4.07Å; K755-I759 VanDerWaalsContact O-CG1 3.29Å; K755-I759 WeakPolarHBondContact O-CG1 3.45Å; K755-I759 PolarHBondContact O-N 3.12Å; E756-I759 PolarHBondContact O-N 2.83Å; I759-K761 VanDerWaalsContact C-N 3.34Å; I759-K761 PolarHBondContact O-N 3.32Å; I759-Q762 WeakPolarHBondContact O-CB 3.29Å; I759-Q762 PolarHBondContact O-N 3.11Å; I759-I763 HydrophobicContact CG2-CD1 3.88Å; I759-I763 HydrophobicContact CG2-CG1 4.44Å; I759-I763 WeakPolarHBondContact O-CG1 3.32Å; I759-I763 PolarHBondContact O-N 3.37Å
760L84.4Confident83.2Confident107 Ų107100.2 Ų100.256%0.5650%0.504SS*.Hα-helixtrans-61.8-42.5177.2-151.587.7000111.6E756 Q757 S758 I763 Q764E756-L760 WeakPolarHBondContact O-CB 3.19Å; E756-L760 PolarHBondContact O-N 3.3Å; Q757-L760 PolarHBondContact O-N 3.43Å; S758-L760 VanDerWaalsContact C-N 3.34Å; S758-L760 PolarHBondContact O-N 2.94Å; L760-I763 PolarHBondContact O-N 2.89Å; L760-Q764 WeakPolarHBondContact O-CG 3.3Å; L760-Q764 PolarHBondContact O-N 3.02Å
761K85.4Confident83.3Confident126 Ų126100.2 Ų100.255%0.54851%0.505SS..Hα-helixtrans-64-40.5173.6-76.4176.1-177.9173.10111.9Q757 S758 I759 Q764 L765Q757-K761 WeakPolarHBondContact O-CG 3.42Å; Q757-K761 PolarHBondContact O-N 3.38Å; S758-K761 PolarHBondContact O-N 2.95Å; I759-K761 VanDerWaalsContact C-N 3.34Å; I759-K761 PolarHBondContact O-N 3.32Å; K761-Q764 PolarHBondContact O-N 3.43Å; K761-L765 WeakPolarHBondContact O-CB 3.28Å; K761-L765 WeakPolarHBondContact O-CD1 3.4Å; K761-L765 PolarHBondContact O-N 3.35Å
762Q80Confident83.3Confident119 Ų11998.6 Ų98.656%0.55650%0.499SS*.Hα-helixtrans-62-46.3174.6-78.2-179.28.700111.3S758 I759 Q764 L765 T766S758-Q762 WeakPolarHBondContact O-CG 3.5Å; S758-Q762 PolarHBondContact O-N 2.9Å; I759-Q762 WeakPolarHBondContact O-CB 3.29Å; I759-Q762 PolarHBondContact O-N 3.11Å; Q762-Q764 VanDerWaalsContact C-N 3.31Å; Q762-Q764 PolarHBondContact O-N 2.85Å; Q762-L765 CarbonylContact O-C 3.55Å; Q762-L765 WeakPolarHBondContact O-CB 3.49Å; Q762-L765 PolarHBondContact O-N 2.81Å; Q762-L765 VanDerWaalsContact O-N 3.15Å; Q762-T766 PolarHBondContact O-N 2.8Å; Q762-T766 PolarHBondContact O-OG1 3.02Å
763I81.2Confident83.5Confident90 Ų9098.3 Ų98.346%0.46250%0.5SS..Hα-helixtrans-59-43.4175.7-68.1165.6000110.7I759 L760 T766 N767I759-I763 HydrophobicContact CG2-CD1 3.88Å; I759-I763 HydrophobicContact CG2-CG1 4.44Å; I759-I763 WeakPolarHBondContact O-CG1 3.32Å; I759-I763 PolarHBondContact O-N 3.37Å; L760-I763 PolarHBondContact O-N 2.89Å; I763-T766 PolarHBondContact O-N 3.35Å; I763-N767 WeakPolarHBondContact O-CB 3.48Å; I763-N767 VanDerWaalsContact O-CG 3.26Å; I763-N767 PolarHBondContact O-N 2.71Å
764Q82.7Confident83.5Confident106 Ų10697.7 Ų97.750%0.49550%0.499SS..Hα-helixtrans-61.7-44.1174.6-75.1176.8-11.300112.4L760 K761 Q762 N767 N768L760-Q764 WeakPolarHBondContact O-CG 3.3Å; L760-Q764 PolarHBondContact O-N 3.02Å; K761-Q764 PolarHBondContact O-N 3.43Å; Q762-Q764 VanDerWaalsContact C-N 3.31Å; Q762-Q764 PolarHBondContact O-N 2.85Å; Q764-N767 PolarHBondContact O-N 3.37Å; Q764-N768 VanDerWaalsContact O-CG 3.23Å; Q764-N768 PolarHBondContact O-N 3.3Å; Q764-N768 PolarHBondContact O-ND2 3.47Å
765L83.6Confident83.5Confident105 Ų10597.6 Ų97.655%0.5550%0.499SS..Hα-helixtrans-62.8-43.1175.3-97.4136000111.9K761 Q762 N767 N768 I769K761-L765 WeakPolarHBondContact O-CB 3.28Å; K761-L765 WeakPolarHBondContact O-CD1 3.4Å; K761-L765 PolarHBondContact O-N 3.35Å; Q762-L765 CarbonylContact O-C 3.55Å; Q762-L765 WeakPolarHBondContact O-CB 3.49Å; Q762-L765 PolarHBondContact O-N 2.81Å; Q762-L765 VanDerWaalsContact O-N 3.15Å; L765-N767 VanDerWaalsContact C-N 3.34Å; L765-N767 PolarHBondContact O-N 3.43Å; L765-N768 PolarHBondContact O-N 2.98Å; L765-I769 WeakPolarHBondContact O-CB 3.31Å; L765-I769 VanDerWaalsContact O-CG1 3.26Å; L765-I769 WeakPolarHBondContact O-CG1 3.41Å; L765-I769 PolarHBondContact O-N 2.85Å
766T84.3Confident83.5Confident73 Ų7396 Ų9645%0.44850%0.496SS..Hα-helixtrans-62.4-41.6175.7-57.50000111.3Q762 I763 I769 N770Q762-T766 PolarHBondContact O-N 2.8Å; Q762-T766 PolarHBondContact O-OG1 3.02Å; I763-T766 PolarHBondContact O-N 3.35Å; T766-I769 PolarHBondContact O-N 2.82Å; T766-N770 WeakPolarHBondContact O-CB 3.47Å; T766-N770 PolarHBondContact O-N 3.31Å
767N85.5Confident83.7Confident85 Ų8594.6 Ų94.646%0.45549%0.489SS..Hα-helixtrans-63.2-44.6174.3-71.8-14.9000111.5I763 Q764 L765 I769 N770 D771I763-N767 WeakPolarHBondContact O-CB 3.48Å; I763-N767 VanDerWaalsContact O-CG 3.26Å; I763-N767 PolarHBondContact O-N 2.71Å; Q764-N767 PolarHBondContact O-N 3.37Å; L765-N767 VanDerWaalsContact C-N 3.34Å; L765-N767 PolarHBondContact O-N 3.43Å; N767-I769 VanDerWaalsContact C-N 3.34Å; N767-I769 PolarHBondContact O-N 3Å; N767-N770 PolarHBondContact O-N 3.36Å; N767-D771 PolarHBondContact O-N 2.96Å
768N86.9Confident83.6Confident97 Ų9796.3 Ų96.352%0.51949%0.492SS..Hα-helixtrans-62.1-40.9175.6-69.3-16.5000112.1Q764 L765 D771 V772Q764-N768 VanDerWaalsContact O-CG 3.23Å; Q764-N768 PolarHBondContact O-N 3.3Å; Q764-N768 PolarHBondContact O-ND2 3.47Å; L765-N768 PolarHBondContact O-N 2.98Å; N768-D771 PolarHBondContact O-N 2.97Å; N768-V772 WeakPolarHBondContact O-CB 3.48Å; N768-V772 VanDerWaalsContact O-CG2 3.24Å; N768-V772 WeakPolarHBondContact O-CG2 3.5Å; N768-V772 PolarHBondContact O-N 2.78Å
769I83.2Confident83.7Confident99 Ų9996.5 Ų96.551%0.50849%0.493SS..Hα-helixtrans-63.4-43.7175.5-71.3165.8000110L765 T766 N767 V772 T773L765-I769 WeakPolarHBondContact O-CB 3.31Å; L765-I769 VanDerWaalsContact O-CG1 3.26Å; L765-I769 WeakPolarHBondContact O-CG1 3.41Å; L765-I769 PolarHBondContact O-N 2.85Å; T766-I769 PolarHBondContact O-N 2.82Å; N767-I769 VanDerWaalsContact C-N 3.34Å; N767-I769 PolarHBondContact O-N 3Å; I769-V772 PolarHBondContact O-N 3.43Å; I769-T773 VanDerWaalsContact O-CB 3.24Å; I769-T773 WeakPolarHBondContact O-CB 3.42Å; I769-T773 PolarHBondContact O-N 3.22Å; I769-T773 PolarHBondContact O-OG1 3.31Å
770N83.9Confident83.9Confident86 Ų86100.8 Ų100.846%0.4650%0.504SS..Hα-helixtrans-62.3-45176-80.4-11.2000111.6T766 N767 T773 I774T766-N770 WeakPolarHBondContact O-CB 3.47Å; T766-N770 PolarHBondContact O-N 3.31Å; N767-N770 PolarHBondContact O-N 3.36Å; N770-T773 WeakPolarHBondContact O-CB 3.33Å; N770-T773 PolarHBondContact O-N 3.46Å; N770-I774 WeakPolarHBondContact O-CB 3.33Å; N770-I774 VanDerWaalsContact O-CG1 3.27Å; N770-I774 WeakPolarHBondContact O-CG1 3.21Å; N770-I774 PolarHBondContact O-N 3.29Å
771D86.2Confident83.9Confident91 Ų91100.5 Ų100.549%0.48750%0.5SS..Hα-helixtrans-61.6-45.5176.9-77.9-12.1000111.6N767 N768 T773 I774 Q775N767-D771 PolarHBondContact O-N 2.96Å; N768-D771 PolarHBondContact O-N 2.97Å; D771-T773 VanDerWaalsContact C-N 3.31Å; D771-T773 PolarHBondContact O-N 2.95Å; D771-I774 PolarHBondContact O-N 3.07Å; D771-Q775 WeakPolarHBondContact O-CB 3.32Å; D771-Q775 VanDerWaalsContact O-CG 3.32Å; D771-Q775 WeakPolarHBondContact O-CG 3.49Å; D771-Q775 PolarHBondContact O-N 3.05Å
772V83.5Confident83.9Confident76 Ų7699.6 Ų99.646%0.46150%0.498SS..Hα-helixtrans-64-37.8175170.60000111.2N768 I769 Q775 L776N768-V772 WeakPolarHBondContact O-CB 3.48Å; N768-V772 VanDerWaalsContact O-CG2 3.24Å; N768-V772 WeakPolarHBondContact O-CG2 3.5Å; N768-V772 PolarHBondContact O-N 2.78Å; I769-V772 PolarHBondContact O-N 3.43Å; V772-Q775 PolarHBondContact O-N 3.07Å; V772-L776 HydrophobicContact CG1-CD1 3.95Å; V772-L776 HydrophobicContact CG1-CG 4.48Å; V772-L776 WeakPolarHBondContact O-CB 3.4Å; V772-L776 WeakPolarHBondContact O-CG 3.41Å; V772-L776 PolarHBondContact O-N 3.16Å
773T84.5Confident84.1Confident76 Ų7698.1 Ų98.147%0.46649%0.493SS..Hα-helixtrans-65.9-43177-59.20000110.9I769 N770 D771 L776 E777I769-T773 VanDerWaalsContact O-CB 3.24Å; I769-T773 WeakPolarHBondContact O-CB 3.42Å; I769-T773 PolarHBondContact O-N 3.22Å; I769-T773 PolarHBondContact O-OG1 3.31Å; N770-T773 WeakPolarHBondContact O-CB 3.33Å; N770-T773 PolarHBondContact O-N 3.46Å; D771-T773 VanDerWaalsContact C-N 3.31Å; D771-T773 PolarHBondContact O-N 2.95Å; T773-L776 PolarHBondContact O-N 3.39Å; T773-E777 WeakPolarHBondContact O-CB 3.27Å; T773-E777 PolarHBondContact O-N 3.46Å
774I83.6Confident84.3Confident89 Ų8995.4 Ų95.446%0.45649%0.487SS..Hα-helixtrans-62.1-45.8174.1-70165.6000110N770 D771 L776 E777 Y778N770-I774 WeakPolarHBondContact O-CB 3.33Å; N770-I774 VanDerWaalsContact O-CG1 3.27Å; N770-I774 WeakPolarHBondContact O-CG1 3.21Å; N770-I774 PolarHBondContact O-N 3.29Å; D771-I774 PolarHBondContact O-N 3.07Å; I774-L776 PolarHBondContact O-N 3.03Å; I774-E777 PolarHBondContact O-N 2.86Å; I774-Y778 HydrophobicContact CG2-CD2 3.64Å; I774-Y778 HydrophobicContact CG2-CE2 3.54Å; I774-Y778 VanDerWaalsContact O-CD2 3.24Å; I774-Y778 WeakPolarHBondContact O-CD2 3.44Å; I774-Y778 PolarHBondContact O-N 3.39Å
775Q83Confident84.4Confident125 Ų12595.3 Ų95.358%0.58449%0.487SS*.Hα-helixtrans-62.5-39.6176.4-73.3177.612.700112.7D771 V772 Y778 S779D771-Q775 WeakPolarHBondContact O-CB 3.32Å; D771-Q775 VanDerWaalsContact O-CG 3.32Å; D771-Q775 WeakPolarHBondContact O-CG 3.49Å; D771-Q775 PolarHBondContact O-N 3.05Å; V772-Q775 PolarHBondContact O-N 3.07Å; Q775-Y778 PolarHBondContact O-N 2.66Å; Q775-S779 WeakPolarHBondContact O-CB 3.47Å; Q775-S779 PolarHBondContact O-N 2.99Å; Q775-S779 PolarHBondContact O-OG 3.33Å
776L83.6Confident84.4Confident95 Ų9595.4 Ų95.450%0.49748%0.484SS..Hα-helixtrans-65.1-39.6174.5-84.8165.5000111.5V772 T773 I774 S779 R780V772-L776 HydrophobicContact CG1-CD1 3.95Å; V772-L776 HydrophobicContact CG1-CG 4.48Å; V772-L776 WeakPolarHBondContact O-CB 3.4Å; V772-L776 WeakPolarHBondContact O-CG 3.41Å; V772-L776 PolarHBondContact O-N 3.16Å; T773-L776 PolarHBondContact O-N 3.39Å; I774-L776 PolarHBondContact O-N 3.03Å; L776-S779 PolarHBondContact O-N 3.32Å; L776-R780 WeakPolarHBondContact O-CB 3.29Å; L776-R780 VanDerWaalsContact O-CG 3.29Å; L776-R780 WeakPolarHBondContact O-CG 3.45Å; L776-R780 PolarHBondContact O-N 2.89Å
777E85.1Confident84.4Confident88 Ų8898.5 Ų98.541%0.41149%0.492SS..Hα-helixtrans-67.1-44.1176.7-17056.1-147.300111.3T773 I774 S779 R780 Q781T773-E777 WeakPolarHBondContact O-CB 3.27Å; T773-E777 PolarHBondContact O-N 3.46Å; I774-E777 PolarHBondContact O-N 2.86Å; E777-S779 VanDerWaalsContact C-N 3.33Å; E777-S779 PolarHBondContact O-N 3.01Å; E777-R780 PolarHBondContact O-N 2.94Å; E777-Q781 WeakPolarHBondContact O-CG 3.47Å; E777-Q781 PolarHBondContact O-N 3.43Å
778Y84.1Confident84.3Confident154 Ų154100.4 Ų100.460%0.60450%0.501SS*.Hα-helixtrans-58.2-44.9170.4-85-69.1000111.7I774 Q775 R780 Q781 E782I774-Y778 HydrophobicContact CG2-CD2 3.64Å; I774-Y778 HydrophobicContact CG2-CE2 3.54Å; I774-Y778 VanDerWaalsContact O-CD2 3.24Å; I774-Y778 WeakPolarHBondContact O-CD2 3.44Å; I774-Y778 PolarHBondContact O-N 3.39Å; Q775-Y778 PolarHBondContact O-N 2.66Å; Y778-R780 VanDerWaalsContact C-N 3.34Å; Y778-R780 PolarHBondContact O-N 3.3Å; Y778-Q781 PolarHBondContact O-N 3.11Å; Y778-E782 WeakPolarHBondContact O-CB 3.33Å; Y778-E782 PolarHBondContact O-N 3.03Å
779S83.2Confident84.3Confident62 Ų62102.9 Ų102.943%0.43450%0.503SS..Hα-helixtrans-63.9-38.3178-58.90000112.1Q775 L776 E777 E782 I783Q775-S779 WeakPolarHBondContact O-CB 3.47Å; Q775-S779 PolarHBondContact O-N 2.99Å; Q775-S779 PolarHBondContact O-OG 3.33Å; L776-S779 PolarHBondContact O-N 3.32Å; E777-S779 VanDerWaalsContact C-N 3.33Å; E777-S779 PolarHBondContact O-N 3.01Å; S779-E782 PolarHBondContact O-N 3.42Å; S779-I783 WeakPolarHBondContact O-CB 3.47Å; S779-I783 WeakPolarHBondContact O-CG1 3.24Å; S779-I783 PolarHBondContact O-N 3.43Å
780R84.1Confident84.3Confident167 Ų167103.8 Ų103.863%0.6351%0.505SS*.Hα-helixtrans-65-43.8174.4-79.3173.7174.4-175.7-1.9111.7L776 E777 Y778 I783 G784L776-R780 WeakPolarHBondContact O-CB 3.29Å; L776-R780 VanDerWaalsContact O-CG 3.29Å; L776-R780 WeakPolarHBondContact O-CG 3.45Å; L776-R780 PolarHBondContact O-N 2.89Å; E777-R780 PolarHBondContact O-N 2.94Å; Y778-R780 VanDerWaalsContact C-N 3.34Å; Y778-R780 PolarHBondContact O-N 3.3Å; R780-I783 PolarHBondContact O-N 3.16Å; R780-G784 PolarHBondContact O-N 3.48Å
781Q84.8Confident84.5Confident101 Ų101105.4 Ų105.447%0.47251%0.508SS..Hα-helixtrans-63.3-42.2175.3-71.7179.311.900111.3E777 Y778 G784 Q785E777-Q781 WeakPolarHBondContact O-CG 3.47Å; E777-Q781 PolarHBondContact O-N 3.43Å; Y778-Q781 PolarHBondContact O-N 3.11Å; Q781-G784 PolarHBondContact O-N 3.38Å; Q781-Q785 WeakPolarHBondContact O-CG 3.25Å; Q781-Q785 PolarHBondContact O-N 2.78Å
782E85.3Confident84.5Confident107 Ų107106.4 Ų106.450%0.551%0.513SS..Hα-helixtrans-63.3-45.7176.1-171.2113.2-145.300111.8Y778 S779 G784 Q785 Q786Y778-E782 WeakPolarHBondContact O-CB 3.33Å; Y778-E782 PolarHBondContact O-N 3.03Å; S779-E782 PolarHBondContact O-N 3.42Å; E782-G784 VanDerWaalsContact C-N 3.3Å; E782-G784 PolarHBondContact O-N 3Å; E782-Q785 PolarHBondContact O-N 2.84Å; E782-Q786 WeakPolarHBondContact O-CG 3.44Å; E782-Q786 PolarHBondContact O-N 3.34Å
783I83.3Confident84.6Confident89 Ų89107 Ų10746%0.45651%0.513SS..Hα-helixtrans-60.9-40.8173.4-70.4165.6000110.6S779 R780 Q786 K787S779-I783 WeakPolarHBondContact O-CB 3.47Å; S779-I783 WeakPolarHBondContact O-CG1 3.24Å; S779-I783 PolarHBondContact O-N 3.43Å; R780-I783 PolarHBondContact O-N 3.16Å; I783-Q786 PolarHBondContact O-N 3.02Å; I783-K787 HydrophobicContact CG2-CD 4.44Å; I783-K787 WeakPolarHBondContact O-CB 3.48Å; I783-K787 WeakPolarHBondContact O-CG 3.43Å; I783-K787 PolarHBondContact O-N 3.47Å
784G85.4Confident84.7Confident33 Ų33109 Ų10934%0.3452%0.517SS..Hα-helixtrans-60.2-44.6174.700000112.3R780 Q781 E782 K787 L788R780-G784 PolarHBondContact O-N 3.48Å; Q781-G784 PolarHBondContact O-N 3.38Å; E782-G784 VanDerWaalsContact C-N 3.3Å; E782-G784 PolarHBondContact O-N 3Å; G784-K787 PolarHBondContact O-N 3.19Å; G784-L788 PolarHBondContact O-N 3.5Å
785Q85Confident84.8Confident103 Ų103108.5 Ų108.548%0.48151%0.512SS..Hα-helixtrans-65.6-40.4174.6-71.7-174.214.800112.2Q781 E782 L788 R789Q781-Q785 WeakPolarHBondContact O-CG 3.25Å; Q781-Q785 PolarHBondContact O-N 2.78Å; E782-Q785 PolarHBondContact O-N 2.84Å; Q785-L788 WeakPolarHBondContact O-CB 3.32Å; Q785-L788 PolarHBondContact O-N 2.99Å; Q785-R789 WeakPolarHBondContact O-CG 3.48Å; Q785-R789 PolarHBondContact O-N 3.24Å
786Q83.8Confident85Confident108 Ų108107.6 Ų107.651%0.50551%0.508SS..Hα-helixtrans-63.3-44.8175.3-75.9-177.30.800111.4E782 I783 L788 R789 E790E782-Q786 WeakPolarHBondContact O-CG 3.44Å; E782-Q786 PolarHBondContact O-N 3.34Å; I783-Q786 PolarHBondContact O-N 3.02Å; Q786-L788 VanDerWaalsContact C-N 3.3Å; Q786-L788 PolarHBondContact O-N 3.41Å; Q786-R789 CarbonylContact O-C 3.59Å; Q786-R789 WeakPolarHBondContact O-CB 3.46Å; Q786-R789 PolarHBondContact O-N 3.45Å; Q786-R789 VanDerWaalsContact O-N 3.13Å; Q786-E790 VanDerWaalsContact O-CB 3.29Å; Q786-E790 WeakPolarHBondContact O-CB 3.31Å; Q786-E790 PolarHBondContact O-N 3.02Å
787K84.3Confident85.2Confident138 Ų138107.4 Ų107.460%0.651%0.508SS*.Hα-helixtrans-59.4-39174.1-77.7-176.1177.2-1760112.5I783 G784 E790 K791I783-K787 HydrophobicContact CG2-CD 4.44Å; I783-K787 WeakPolarHBondContact O-CB 3.48Å; I783-K787 WeakPolarHBondContact O-CG 3.43Å; I783-K787 PolarHBondContact O-N 3.47Å; G784-K787 PolarHBondContact O-N 3.19Å; K787-E790 PolarHBondContact O-N 3.48Å; K787-K791 VanDerWaalsContact O-CB 3.29Å; K787-K791 WeakPolarHBondContact O-CB 3.45Å; K787-K791 PolarHBondContact O-N 3.35Å
788L84.4Confident85.3Confident124 Ų124109.1 Ų109.165%0.64952%0.516SS*.Hα-helixtrans-64-44.5173.5-91.4155.8000111.9G784 Q785 Q786 K791 L792G784-L788 PolarHBondContact O-N 3.5Å; Q785-L788 WeakPolarHBondContact O-CB 3.32Å; Q785-L788 PolarHBondContact O-N 2.99Å; Q786-L788 VanDerWaalsContact C-N 3.3Å; Q786-L788 PolarHBondContact O-N 3.41Å; L788-K791 PolarHBondContact O-N 3.47Å; L788-L792 WeakPolarHBondContact O-CB 3.32Å; L788-L792 PolarHBondContact O-N 2.91Å
789R85.8Confident85.5Confident150 Ų150110.2 Ų110.257%0.56652%0.519SS*.Hα-helixtrans-63.3-42.9174.9-70.1177.7-167.4173.78.5111.6Q785 Q786 L792 I793Q785-R789 WeakPolarHBondContact O-CG 3.48Å; Q785-R789 PolarHBondContact O-N 3.24Å; Q786-R789 CarbonylContact O-C 3.59Å; Q786-R789 WeakPolarHBondContact O-CB 3.46Å; Q786-R789 PolarHBondContact O-N 3.45Å; Q786-R789 VanDerWaalsContact O-N 3.13Å; R789-L792 WeakPolarHBondContact O-CB 3.39Å; R789-L792 PolarHBondContact O-N 3.49Å; R789-I793 VanDerWaalsContact O-CG1 3.3Å; R789-I793 WeakPolarHBondContact O-CG1 3.48Å; R789-I793 PolarHBondContact O-N 2.91Å
790E83.7Confident85.6Confident117 Ų117111.3 Ų111.355%0.54752%0.519SS..Hα-helixtrans-65.3-41.9179.3-163.8173.1-15000110.8Q786 K787 I793 Q794Q786-E790 VanDerWaalsContact O-CB 3.29Å; Q786-E790 WeakPolarHBondContact O-CB 3.31Å; Q786-E790 PolarHBondContact O-N 3.02Å; K787-E790 PolarHBondContact O-N 3.48Å; E790-I793 PolarHBondContact O-N 3.39Å; E790-Q794 WeakPolarHBondContact O-CB 3.43Å; E790-Q794 VanDerWaalsContact O-CG 3.32Å; E790-Q794 WeakPolarHBondContact O-CG 3.19Å; E790-Q794 PolarHBondContact O-N 2.92Å
791K87Confident85.8Confident120 Ų120107.7 Ų107.752%0.52251%0.509SS..Hα-helixtrans-62.2-42.6171.8-169.2-177.5179.9-169.90111.9K787 L788 I793 Q794 E795K787-K791 VanDerWaalsContact O-CB 3.29Å; K787-K791 WeakPolarHBondContact O-CB 3.45Å; K787-K791 PolarHBondContact O-N 3.35Å; L788-K791 PolarHBondContact O-N 3.47Å; K791-I793 VanDerWaalsContact C-N 3.35Å; K791-I793 PolarHBondContact O-N 2.89Å; K791-Q794 PolarHBondContact O-N 3.07Å; K791-E795 VanDerWaalsContact CE-OE1 3.32Å; K791-E795 WeakPolarHBondContact CE-OE1 3.24Å; K791-E795 WeakPolarHBondContact O-CB 3.37Å; K791-E795 WeakPolarHBondContact O-CG 3.33Å; K791-E795 PolarHBondContact O-N 2.81Å
792L86.8Confident86Confident113 Ų113107 Ų10759%0.59251%0.509SS*.Hα-helixtrans-62.5-42176.3-158.696.3000111.5L788 R789 E795 Q796L788-L792 WeakPolarHBondContact O-CB 3.32Å; L788-L792 PolarHBondContact O-N 2.91Å; R789-L792 WeakPolarHBondContact O-CB 3.39Å; R789-L792 PolarHBondContact O-N 3.49Å; L792-E795 PolarHBondContact O-N 3.15Å; L792-Q796 VanDerWaalsContact O-CB 3.31Å; L792-Q796 WeakPolarHBondContact O-CB 3.49Å; L792-Q796 PolarHBondContact O-N 3.37Å
793I85.9Confident86.1Confident89 Ų89107.1 Ų107.146%0.45651%0.51SS..Hα-helixtrans-67.5-40.6175.6-69.1166.5000110.8R789 E790 K791 Q796 N797R789-I793 VanDerWaalsContact O-CG1 3.3Å; R789-I793 WeakPolarHBondContact O-CG1 3.48Å; R789-I793 PolarHBondContact O-N 2.91Å; E790-I793 PolarHBondContact O-N 3.39Å; K791-I793 VanDerWaalsContact C-N 3.35Å; K791-I793 PolarHBondContact O-N 2.89Å; I793-Q796 PolarHBondContact O-N 3.32Å; I793-N797 WeakPolarHBondContact O-CB 3.4Å; I793-N797 VanDerWaalsContact O-CG 3.25Å; I793-N797 PolarHBondContact O-N 3.13Å
794Q87Confident86.3Confident117 Ų117108.1 Ų108.155%0.54751%0.511SS..Hα-helixtrans-62.8-45.7175-78.6177.5-2.100111.3E790 K791 Q796 N797 Q798E790-Q794 WeakPolarHBondContact O-CB 3.43Å; E790-Q794 VanDerWaalsContact O-CG 3.32Å; E790-Q794 WeakPolarHBondContact O-CG 3.19Å; E790-Q794 PolarHBondContact O-N 2.92Å; K791-Q794 PolarHBondContact O-N 3.07Å; Q794-Q796 VanDerWaalsContact C-N 3.31Å; Q794-Q796 PolarHBondContact O-N 3.01Å; Q794-N797 PolarHBondContact O-N 3.24Å; Q794-Q798 WeakPolarHBondContact O-CB 3.43Å; Q794-Q798 PolarHBondContact O-N 3.32Å
795E84.7Confident86.3Confident78 Ų78109.5 Ų109.536%0.36451%0.512SS..Hα-helixtrans-61.4-40.3173.9-75.5177.7-165.300111.2K791 L792 Q798 R799K791-E795 VanDerWaalsContact CE-OE1 3.32Å; K791-E795 WeakPolarHBondContact CE-OE1 3.24Å; K791-E795 WeakPolarHBondContact O-CB 3.37Å; K791-E795 WeakPolarHBondContact O-CG 3.33Å; K791-E795 PolarHBondContact O-N 2.81Å; L792-E795 PolarHBondContact O-N 3.15Å; E795-Q798 PolarHBondContact O-N 3.13Å; E795-R799 VanDerWaalsContact O-CG 3.28Å; E795-R799 WeakPolarHBondContact O-CG 3.4Å; E795-R799 PolarHBondContact O-N 3.06Å
796Q88.3Confident86.4Confident107 Ų107110.2 Ų110.250%0.552%0.516SS..Hα-helixtrans-66.4-43.1175.6-172.8175.62.200112.2L792 I793 Q794 Q798 R799 L800L792-Q796 VanDerWaalsContact O-CB 3.31Å; L792-Q796 WeakPolarHBondContact O-CB 3.49Å; L792-Q796 PolarHBondContact O-N 3.37Å; I793-Q796 PolarHBondContact O-N 3.32Å; Q794-Q796 VanDerWaalsContact C-N 3.31Å; Q794-Q796 PolarHBondContact O-N 3.01Å; Q796-Q798 VanDerWaalsContact C-N 3.32Å; Q796-Q798 PolarHBondContact O-N 3.12Å; Q796-R799 WeakPolarHBondContact O-CB 3.25Å; Q796-R799 PolarHBondContact O-N 3.4Å; Q796-L800 HydrophobicContact CG-CD1 4.28Å; Q796-L800 WeakPolarHBondContact O-CB 3.25Å; Q796-L800 WeakPolarHBondContact O-CG 3.47Å; Q796-L800 PolarHBondContact O-N 3.37Å
797N87.5Confident86.6Confident90 Ų90109.5 Ų109.548%0.48152%0.515SS..Hα-helixtrans-64-38.8175.2-76.4-15.4000111.2I793 Q794 L800 E801I793-N797 WeakPolarHBondContact O-CB 3.4Å; I793-N797 VanDerWaalsContact O-CG 3.25Å; I793-N797 PolarHBondContact O-N 3.13Å; Q794-N797 PolarHBondContact O-N 3.24Å; N797-L800 PolarHBondContact O-N 3.48Å; N797-E801 WeakPolarHBondContact O-CB 3.46Å; N797-E801 PolarHBondContact O-N 3.1Å
798Q88.1Confident86.8Confident124 Ų124107.8 Ų107.858%0.57951%0.509SS*.Hα-helixtrans-66.8-40.5175-170.2169.714.200111.2Q794 E795 Q796 E801 N802Q794-Q798 WeakPolarHBondContact O-CB 3.43Å; Q794-Q798 PolarHBondContact O-N 3.32Å; E795-Q798 PolarHBondContact O-N 3.13Å; Q796-Q798 VanDerWaalsContact C-N 3.32Å; Q796-Q798 PolarHBondContact O-N 3.12Å; Q798-E801 PolarHBondContact O-N 3.33Å; Q798-N802 VanDerWaalsContact O-CB 3.3Å; Q798-N802 WeakPolarHBondContact O-CB 3.28Å; Q798-N802 PolarHBondContact O-N 3.45Å; Q798-N802 PolarHBondContact O-ND2 2.94Å; Q798-N802 PolarHBondContact O-OD1 2.83Å
799R86.4Confident86.9Confident177 Ų177108.9 Ų108.967%0.66851%0.509SS*.Hα-helixtrans-61.2-43.6171.2-72.6176.5-165.9-161.46111.7E795 Q796 N802 E803E795-R799 VanDerWaalsContact O-CG 3.28Å; E795-R799 WeakPolarHBondContact O-CG 3.4Å; E795-R799 PolarHBondContact O-N 3.06Å; Q796-R799 WeakPolarHBondContact O-CB 3.25Å; Q796-R799 PolarHBondContact O-N 3.4Å; R799-N802 PolarHBondContact O-N 3.42Å; R799-E803 VanDerWaalsContact O-CB 3.32Å; R799-E803 WeakPolarHBondContact O-CB 3.38Å; R799-E803 PolarHBondContact O-N 3.2Å
800L87.2Confident86.8Confident85 Ų85109.3 Ų109.345%0.44551%0.51SS..Hα-helixtrans-68.2-37.3178.1-76169.8000112.7Q796 N797 E803 K804Q796-L800 HydrophobicContact CG-CD1 4.28Å; Q796-L800 WeakPolarHBondContact O-CB 3.25Å; Q796-L800 WeakPolarHBondContact O-CG 3.47Å; Q796-L800 PolarHBondContact O-N 3.37Å; N797-L800 PolarHBondContact O-N 3.48Å; L800-E803 PolarHBondContact O-N 3.28Å; L800-K804 WeakPolarHBondContact O-CB 3.5Å; L800-K804 PolarHBondContact O-N 3.48Å
801E87.4Confident87Confident91 Ų91108.7 Ų108.743%0.42551%0.511SS..Hα-helixtrans-69.8-38.5172.6-88.9-64165.500111.5N797 Q798 E803 K804 T805N797-E801 WeakPolarHBondContact O-CB 3.46Å; N797-E801 PolarHBondContact O-N 3.1Å; Q798-E801 PolarHBondContact O-N 3.33Å; E801-E803 VanDerWaalsContact C-N 3.34Å; E801-K804 PolarHBondContact O-N 2.91Å; E801-K804 IonicContact OE1-NZ 3.78Å; E801-K804 PolarHBondContact OE1-NZ 3.04Å; E801-K804 IonicContact OE2-NZ 2.66Å; E801-K804 PolarHBondContact OE2-NZ 3.47Å; E801-T805 WeakPolarHBondContact O-CB 3.36Å; E801-T805 VanDerWaalsContact O-CG2 3.29Å; E801-T805 WeakPolarHBondContact O-CG2 3.47Å; E801-T805 PolarHBondContact O-N 3.17Å; E801-T805 PolarHBondContact O-OG1 3.04Å
802N88Confident86.9Confident88 Ų88107.4 Ų107.447%0.47151%0.507SS..Hα-helixtrans-62-43.9171.4-70.2-6000110.8Q798 R799 T805 E806Q798-N802 VanDerWaalsContact O-CB 3.3Å; Q798-N802 WeakPolarHBondContact O-CB 3.28Å; Q798-N802 PolarHBondContact O-N 3.45Å; Q798-N802 PolarHBondContact O-ND2 2.94Å; Q798-N802 PolarHBondContact O-OD1 2.83Å; R799-N802 PolarHBondContact O-N 3.42Å; N802-T805 WeakPolarHBondContact CA-OG1 3.3Å; N802-T805 PolarHBondContact O-N 3.28Å; N802-T805 PolarHBondContact O-OG1 3.26Å; N802-E806 WeakPolarHBondContact O-CB 3.49Å; N802-E806 WeakPolarHBondContact O-CG 3.42Å; N802-E806 PolarHBondContact O-N 3.33Å
803E87.8Confident86.8Confident108 Ų108104.7 Ų104.751%0.50550%0.497SS..Hα-helixtrans-66-40176.5-171.3175.5-169.200111.7R799 L800 E801 E806 L807R799-E803 VanDerWaalsContact O-CB 3.32Å; R799-E803 WeakPolarHBondContact O-CB 3.38Å; R799-E803 PolarHBondContact O-N 3.2Å; L800-E803 PolarHBondContact O-N 3.28Å; E801-E803 VanDerWaalsContact C-N 3.34Å; E803-E806 PolarHBondContact O-N 2.98Å; E803-L807 HydrophobicContact CG-CD1 4.3Å; E803-L807 VanDerWaalsContact O-CB 3.25Å; E803-L807 WeakPolarHBondContact O-CB 3.4Å; E803-L807 VanDerWaalsContact O-CG 3.25Å; E803-L807 WeakPolarHBondContact O-CG 3.24Å; E803-L807 PolarHBondContact O-N 3.2Å
804K87.8Confident86.7Confident110 Ų110104 Ų10448%0.47849%0.493SS..Hα-helixtrans-64.5-43.4174.5175.7-179.3153.8-150.60111.8L800 E801 L807 Q808L800-K804 WeakPolarHBondContact O-CB 3.5Å; L800-K804 PolarHBondContact O-N 3.48Å; E801-K804 PolarHBondContact O-N 2.91Å; E801-K804 IonicContact OE1-NZ 3.78Å; E801-K804 PolarHBondContact OE1-NZ 3.04Å; E801-K804 IonicContact OE2-NZ 2.66Å; E801-K804 PolarHBondContact OE2-NZ 3.47Å; K804-L807 PolarHBondContact O-N 2.78Å; K804-Q808 VanDerWaalsContact O-CB 3.25Å; K804-Q808 WeakPolarHBondContact O-CB 3.27Å; K804-Q808 PolarHBondContact O-N 3.44Å
805T86.8Confident86.7Confident62 Ų62101.9 Ų101.938%0.3849%0.489SS..Hα-helixtrans-69.3-36.7176.652.60000111.6E801 N802 Q808 K809E801-T805 WeakPolarHBondContact O-CB 3.36Å; E801-T805 VanDerWaalsContact O-CG2 3.29Å; E801-T805 WeakPolarHBondContact O-CG2 3.47Å; E801-T805 PolarHBondContact O-N 3.17Å; E801-T805 PolarHBondContact O-OG1 3.04Å; N802-T805 WeakPolarHBondContact CA-OG1 3.3Å; N802-T805 PolarHBondContact O-N 3.28Å; N802-T805 PolarHBondContact O-OG1 3.26Å; T805-Q808 PolarHBondContact O-N 3.41Å; T805-K809 WeakPolarHBondContact O-CB 3.49Å; T805-K809 WeakPolarHBondContact O-CG 3.19Å; T805-K809 PolarHBondContact O-N 3.32Å
806E86.5Confident86.6Confident119 Ų119103.2 Ų103.256%0.55650%0.498SS*.Hα-helixtrans-65.4-43.3170.3-81.5-169.617500112.2N802 E803 Q808 K809 R810N802-E806 WeakPolarHBondContact O-CB 3.49Å; N802-E806 WeakPolarHBondContact O-CG 3.42Å; N802-E806 PolarHBondContact O-N 3.33Å; E803-E806 PolarHBondContact O-N 2.98Å; E806-Q808 VanDerWaalsContact C-N 3.3Å; E806-Q808 PolarHBondContact O-N 3.39Å; E806-K809 PolarHBondContact O-N 3.21Å; E806-R810 WeakPolarHBondContact O-CB 3.38Å; E806-R810 PolarHBondContact O-N 3.44Å
807L86.6Confident86.3Confident93 Ų93103.3 Ų103.349%0.48750%0.499SS..Hα-helixtrans-64.2-36.5174.2-79.7173.4000111.3E803 K804 R810 N811E803-L807 HydrophobicContact CG-CD1 4.3Å; E803-L807 VanDerWaalsContact O-CB 3.25Å; E803-L807 WeakPolarHBondContact O-CB 3.4Å; E803-L807 VanDerWaalsContact O-CG 3.25Å; E803-L807 WeakPolarHBondContact O-CG 3.24Å; E803-L807 PolarHBondContact O-N 3.2Å; K804-L807 PolarHBondContact O-N 2.78Å; L807-R810 CarbonylContact O-C 3.54Å; L807-R810 PolarHBondContact O-N 2.93Å; L807-N811 WeakPolarHBondContact O-CB 3.41Å; L807-N811 PolarHBondContact O-N 2.96Å
808Q88.4Confident86.1Confident101 Ų101104 Ų10447%0.47250%0.502SS..Hα-helixtrans-69.4-45.5175.5-174.3171.9-23.200110.9K804 T805 E806 R810 N811 E812K804-Q808 VanDerWaalsContact O-CB 3.25Å; K804-Q808 WeakPolarHBondContact O-CB 3.27Å; K804-Q808 PolarHBondContact O-N 3.44Å; T805-Q808 PolarHBondContact O-N 3.41Å; E806-Q808 VanDerWaalsContact C-N 3.3Å; E806-Q808 PolarHBondContact O-N 3.39Å; Q808-R810 VanDerWaalsContact C-N 3.28Å; Q808-R810 PolarHBondContact O-N 3.05Å; Q808-N811 CarbonylContact O-C 3.59Å; Q808-N811 PolarHBondContact O-N 3.28Å; Q808-N811 VanDerWaalsContact O-N 3.1Å; Q808-E812 HydrophobicContact CG-CG 4.48Å; Q808-E812 WeakPolarHBondContact CG-OE1 3.25Å; Q808-E812 PolarHBondContact NE2-OE1 3.1Å; Q808-E812 WeakPolarHBondContact O-CB 3.26Å; Q808-E812 WeakPolarHBondContact O-CG 3.28Å; Q808-E812 PolarHBondContact O-N 3.05Å
809K86.7Confident85.9Confident147 Ų147103.2 Ų103.264%0.63950%0.501SS*.Hα-helixtrans-60.2-39.1171.7-77.8179.7179.9178.80111.8T805 E806 S813T805-K809 WeakPolarHBondContact O-CB 3.49Å; T805-K809 WeakPolarHBondContact O-CG 3.19Å; T805-K809 PolarHBondContact O-N 3.32Å; E806-K809 PolarHBondContact O-N 3.21Å; K809-S813 WeakPolarHBondContact O-CB 3.38Å; K809-S813 PolarHBondContact O-N 3.33Å
810R85.3Confident85.5Confident159 Ų15997 Ų9760%0.649%0.485SS*.Hα-helixtrans-63.4-45172-106.8-170.2178.799.40.3110.9E806 L807 Q808 S813 I814E806-R810 WeakPolarHBondContact O-CB 3.38Å; E806-R810 PolarHBondContact O-N 3.44Å; L807-R810 CarbonylContact O-C 3.54Å; L807-R810 PolarHBondContact O-N 2.93Å; Q808-R810 VanDerWaalsContact C-N 3.28Å; Q808-R810 PolarHBondContact O-N 3.05Å; R810-S813 CarbonylContact O-C 3.59Å; R810-S813 PolarHBondContact O-N 3.38Å; R810-I814 VanDerWaalsContact O-CB 3.24Å; R810-I814 WeakPolarHBondContact O-CB 3.4Å; R810-I814 WeakPolarHBondContact O-CD1 3.42Å; R810-I814 WeakPolarHBondContact O-CG1 3.39Å; R810-I814 PolarHBondContact O-N 3.12Å
811N86.6Confident85.1Confident104 Ų10496.3 Ų96.356%0.55648%0.481SS*.Hα-helixtrans-63.9-44.4177.6-94.4-3.5000111L807 Q808 I814 T815L807-N811 WeakPolarHBondContact O-CB 3.41Å; L807-N811 PolarHBondContact O-N 2.96Å; Q808-N811 CarbonylContact O-C 3.59Å; Q808-N811 PolarHBondContact O-N 3.28Å; Q808-N811 VanDerWaalsContact O-N 3.1Å; N811-I814 CarbonylContact O-C 3.59Å; N811-I814 PolarHBondContact O-N 3.22Å; N811-T815 PolarHBondContact O-N 3.17Å; N811-T815 PolarHBondContact O-OG1 3.43Å
812E86Confident84.8Confident94 Ų9498.9 Ų98.944%0.43949%0.491SS..Hα-helixtrans-59-51174.8-76168.7-168.300110.1Q808 I814 T815 D816Q808-E812 HydrophobicContact CG-CG 4.48Å; Q808-E812 WeakPolarHBondContact CG-OE1 3.25Å; Q808-E812 PolarHBondContact NE2-OE1 3.1Å; Q808-E812 WeakPolarHBondContact O-CB 3.26Å; Q808-E812 WeakPolarHBondContact O-CG 3.28Å; Q808-E812 PolarHBondContact O-N 3.05Å; E812-I814 VanDerWaalsContact C-N 3.31Å; E812-I814 PolarHBondContact O-N 3.04Å; E812-T815 WeakPolarHBondContact CA-OG1 3.32Å; E812-T815 CarbonylContact O-C 3.6Å; E812-T815 PolarHBondContact O-N 3.05Å; E812-T815 VanDerWaalsContact O-N 3.09Å; E812-T815 PolarHBondContact O-OG1 3.33Å; E812-D816 WeakPolarHBondContact O-CB 3.24Å; E812-D816 PolarHBondContact O-N 3.1Å
813S84.8Confident84.4Confident55 Ų55100.8 Ų100.839%0.38550%0.497SS..Hα-helixtrans-59-39.4173.5-172.90000112.2K809 R810 E817K809-S813 WeakPolarHBondContact O-CB 3.38Å; K809-S813 PolarHBondContact O-N 3.33Å; R810-S813 CarbonylContact O-C 3.59Å; R810-S813 PolarHBondContact O-N 3.38Å; S813-E817 WeakPolarHBondContact O-CA 3.34Å; S813-E817 WeakPolarHBondContact O-CB 3.49Å; S813-E817 WeakPolarHBondContact O-CG 3.45Å; S813-E817 PolarHBondContact O-N 3.47Å
814I82.6Confident83.8Confident75 Ų75100.8 Ų100.839%0.38549%0.492SS..Hα-helixtrans-69.8-38.3175.7-73.1163000109.9R810 N811 E812 E817 L818R810-I814 VanDerWaalsContact O-CB 3.24Å; R810-I814 WeakPolarHBondContact O-CB 3.4Å; R810-I814 WeakPolarHBondContact O-CD1 3.42Å; R810-I814 WeakPolarHBondContact O-CG1 3.39Å; R810-I814 PolarHBondContact O-N 3.12Å; N811-I814 CarbonylContact O-C 3.59Å; N811-I814 PolarHBondContact O-N 3.22Å; E812-I814 VanDerWaalsContact C-N 3.31Å; E812-I814 PolarHBondContact O-N 3.04Å; I814-E817 CarbonylContact O-C 3.35Å; I814-L818 HydrophobicContact CG2-CD1 3.85Å; I814-L818 HydrophobicContact CG2-CG 4.17Å; I814-L818 WeakPolarHBondContact O-CA 3.3Å; I814-L818 WeakPolarHBondContact O-CB 3.28Å; I814-L818 WeakPolarHBondContact O-CG 3.46Å; I814-L818 PolarHBondContact O-N 3.12Å
815T86.6Confident83.3Confident73 Ų73100.4 Ų100.445%0.44850%0.495SS..Hα-helixtrans-68.8-39.2175.127.90000111.7N811 E812 L818 L819N811-T815 PolarHBondContact O-N 3.17Å; N811-T815 PolarHBondContact O-OG1 3.43Å; E812-T815 WeakPolarHBondContact CA-OG1 3.32Å; E812-T815 CarbonylContact O-C 3.6Å; E812-T815 PolarHBondContact O-N 3.05Å; E812-T815 VanDerWaalsContact O-N 3.09Å; E812-T815 PolarHBondContact O-OG1 3.33Å; T815-L818 CarbonylContact O-C 3.55Å; T815-L818 PolarHBondContact O-N 3.17Å; T815-L819 WeakPolarHBondContact O-CB 3.4Å; T815-L819 WeakPolarHBondContact O-CG 3.4Å; T815-L819 PolarHBondContact O-N 3.2Å
816D83.7Confident82.8Confident105 Ų105102.5 Ų102.556%0.56150%0.504SS*.Hα-helixtrans-68.7-41.3175.2-73.4-15.2000110.5E812 L818 L819 S820E812-D816 WeakPolarHBondContact O-CB 3.24Å; E812-D816 PolarHBondContact O-N 3.1Å; D816-L818 VanDerWaalsContact C-N 3.34Å; D816-L819 PolarHBondContact O-N 3.45Å; D816-S820 WeakPolarHBondContact O-CB 3.43Å; D816-S820 PolarHBondContact O-N 2.69Å
817E81.4Confident82Confident109 Ų109102.2 Ų102.251%0.50950%0.502SS..Hα-helixtrans-63.9-38.8170-82-180-168.200111.2S813 I814 S820 L821S813-E817 WeakPolarHBondContact O-CA 3.34Å; S813-E817 WeakPolarHBondContact O-CB 3.49Å; S813-E817 WeakPolarHBondContact O-CG 3.45Å; S813-E817 PolarHBondContact O-N 3.47Å; I814-E817 CarbonylContact O-C 3.35Å; E817-S820 CarbonylContact O-C 3.49Å; E817-L821 WeakPolarHBondContact O-CA 3.33Å; E817-L821 WeakPolarHBondContact O-CB 3.44Å; E817-L821 WeakPolarHBondContact O-CD1 3.38Å; E817-L821 WeakPolarHBondContact O-CG 3.36Å; E817-L821 PolarHBondContact O-N 2.83Å
818L83.6Confident80.9Confident104 Ų104100.8 Ų100.855%0.54549%0.494SS..Hα-helixtrans-71.1-32.6176.5-81.3171.8000111.3I814 T815 D816 K822I814-L818 HydrophobicContact CG2-CD1 3.85Å; I814-L818 HydrophobicContact CG2-CG 4.17Å; I814-L818 WeakPolarHBondContact O-CA 3.3Å; I814-L818 WeakPolarHBondContact O-CB 3.28Å; I814-L818 WeakPolarHBondContact O-CG 3.46Å; I814-L818 PolarHBondContact O-N 3.12Å; T815-L818 CarbonylContact O-C 3.55Å; T815-L818 PolarHBondContact O-N 3.17Å; D816-L818 VanDerWaalsContact C-N 3.34Å; L818-K822 WeakPolarHBondContact O-CA 3.25Å; L818-K822 WeakPolarHBondContact O-CB 3.35Å; L818-K822 PolarHBondContact O-N 3.06Å
819L83.1Confident79.8Confident108 Ų10898.5 Ų98.557%0.56549%0.491SS*.Hα-helixtrans-70.7-48.4172.5-81.9163.5000110T815 D816 L821 K822 E823T815-L819 WeakPolarHBondContact O-CB 3.4Å; T815-L819 WeakPolarHBondContact O-CG 3.4Å; T815-L819 PolarHBondContact O-N 3.2Å; D816-L819 PolarHBondContact O-N 3.45Å; L819-L821 VanDerWaalsContact C-N 3.33Å; L819-L821 PolarHBondContact O-N 2.93Å; L819-K822 PolarHBondContact O-N 3.24Å; L819-E823 WeakPolarHBondContact O-CB 3.24Å; L819-E823 PolarHBondContact O-N 3.11Å
820S79.6Confident78.7Confident47 Ų4797.3 Ų97.333%0.32949%0.492SS..Hα-helixtrans-63.1-38.9175.2-1780000111.6D816 E817 R824D816-S820 WeakPolarHBondContact O-CB 3.43Å; D816-S820 PolarHBondContact O-N 2.69Å; E817-S820 CarbonylContact O-C 3.49Å; S820-R824 WeakPolarHBondContact O-CA 3.28Å; S820-R824 WeakPolarHBondContact O-CB 3.43Å; S820-R824 PolarHBondContact O-N 3.41Å; S820-R824 PolarHBondContact OG-NH2 3.31Å; S820-R824 VanDerWaalsContact OG-NH2 3.13Å
821L78.8Confident77.4Confident70 Ų7094.5 Ų94.537%0.36649%0.486SS..Hα-helixtrans-72.4-38.6173.1-81.8162.6000109.9E817 L819 E823 R824 L825E817-L821 WeakPolarHBondContact O-CA 3.33Å; E817-L821 WeakPolarHBondContact O-CB 3.44Å; E817-L821 WeakPolarHBondContact O-CD1 3.38Å; E817-L821 WeakPolarHBondContact O-CG 3.36Å; E817-L821 PolarHBondContact O-N 2.83Å; L819-L821 VanDerWaalsContact C-N 3.33Å; L819-L821 PolarHBondContact O-N 2.93Å; L821-E823 PolarHBondContact O-N 3.13Å; L821-R824 CarbonylContact O-C 3.58Å; L821-R824 PolarHBondContact O-N 3.42Å; L821-L825 VanDerWaalsContact O-CA 3.28Å; L821-L825 WeakPolarHBondContact O-CA 3.47Å; L821-L825 WeakPolarHBondContact O-CB 3.24Å; L821-L825 PolarHBondContact O-N 3.48Å
822K79.5Confident75.9Confident145 Ų14592.4 Ų92.463%0.6347%0.474SS*.Hα-helixtrans-63.6-37.5174.5-179.4179.6179.9-175.60110.7L818 L819 N826L818-K822 WeakPolarHBondContact O-CA 3.25Å; L818-K822 WeakPolarHBondContact O-CB 3.35Å; L818-K822 PolarHBondContact O-N 3.06Å; L819-K822 PolarHBondContact O-N 3.24Å; K822-N826 WeakPolarHBondContact O-CB 3.43Å; K822-N826 VanDerWaalsContact O-CG 3.28Å; K822-N826 PolarHBondContact O-N 3.38Å
823E79.3Confident74.4Confident128 Ų12896.7 Ų96.760%0.59849%0.491SS*.Hα-helixtrans-72.1-44.1175.2-169.6154.5-151.200111.5L819 L821 L825 N826 Q827L819-E823 WeakPolarHBondContact O-CB 3.24Å; L819-E823 PolarHBondContact O-N 3.11Å; L821-E823 PolarHBondContact O-N 3.13Å; E823-L825 VanDerWaalsContact C-N 3.35Å; E823-L825 PolarHBondContact O-N 3.29Å; E823-N826 WeakPolarHBondContact O-CB 3.28Å; E823-N826 PolarHBondContact O-N 3.36Å; E823-Q827 WeakPolarHBondContact O-CG 3.31Å; E823-Q827 PolarHBondContact O-N 3.44Å
824R77.1Confident73Confident108 Ų108100.4 Ų100.441%0.40850%0.502SS..Hα-helixtrans-70.5-28.2175.9-167.5-175.4-59.7121.36.5112.2S820 L821 Q827 Q828S820-R824 WeakPolarHBondContact O-CA 3.28Å; S820-R824 WeakPolarHBondContact O-CB 3.43Å; S820-R824 PolarHBondContact O-N 3.41Å; S820-R824 PolarHBondContact OG-NH2 3.31Å; S820-R824 VanDerWaalsContact OG-NH2 3.13Å; L821-R824 CarbonylContact O-C 3.58Å; L821-R824 PolarHBondContact O-N 3.42Å; R824-Q827 CarbonylContact O-C 3.2Å; R824-Q827 WeakPolarHBondContact O-CB 3.37Å; R824-Q827 PolarHBondContact O-N 3.28Å; R824-Q828 HydrophobicContact CG-CG 4.19Å; R824-Q828 VanDerWaalsContact O-CA 3.29Å; R824-Q828 WeakPolarHBondContact O-CA 3.26Å; R824-Q828 WeakPolarHBondContact O-CB 3.36Å; R824-Q828 WeakPolarHBondContact O-CG 3.42Å; R824-Q828 PolarHBondContact O-N 3.02Å
825L76.8Confident71.4Confident102 Ų102101.8 Ų101.853%0.53451%0.506SS..Hα-helixtrans-90.1-16.8177.5-154.9164.6000109.8L821 E823 A829L821-L825 VanDerWaalsContact O-CA 3.28Å; L821-L825 WeakPolarHBondContact O-CA 3.47Å; L821-L825 WeakPolarHBondContact O-CB 3.24Å; L821-L825 PolarHBondContact O-N 3.48Å; E823-L825 VanDerWaalsContact C-N 3.35Å; E823-L825 PolarHBondContact O-N 3.29Å; L825-A829 WeakPolarHBondContact O-CA 3.21Å; L825-A829 WeakPolarHBondContact O-CB 3.46Å; L825-A829 PolarHBondContact O-N 3.4Å
826N75.6Confident69.7Low106 Ų106105.1 Ų105.157%0.56752%0.516SS*.Hα-helixtrans-67.1-50.4153.6-79.9-13000109.4K822 E823 Q828 A829 D830K822-N826 WeakPolarHBondContact O-CB 3.43Å; K822-N826 VanDerWaalsContact O-CG 3.28Å; K822-N826 PolarHBondContact O-N 3.38Å; E823-N826 WeakPolarHBondContact O-CB 3.28Å; E823-N826 PolarHBondContact O-N 3.36Å; N826-Q828 VanDerWaalsContact C-N 3.3Å; N826-Q828 PolarHBondContact O-N 3.18Å; N826-A829 PolarHBondContact O-N 3.46Å; N826-D830 VanDerWaalsContact O-CG 3.29Å; N826-D830 PolarHBondContact O-N 3.24Å; N826-D830 VanDerWaalsContact O-N 3.16Å
827Q70.4Confident68.1Low113 Ų113106.7 Ų106.753%0.52853%0.525SS..Hα-helixtrans-65.1-29.6176.7-67.6168.77.400113.7E823 R824 D830 E831E823-Q827 WeakPolarHBondContact O-CG 3.31Å; E823-Q827 PolarHBondContact O-N 3.44Å; R824-Q827 CarbonylContact O-C 3.2Å; R824-Q827 WeakPolarHBondContact O-CB 3.37Å; R824-Q827 PolarHBondContact O-N 3.28Å; Q827-D830 CarbonylContact O-C 3.5Å; Q827-D830 VanDerWaalsContact O-CB 3.3Å; Q827-D830 WeakPolarHBondContact O-CB 3.33Å; Q827-D830 PolarHBondContact O-N 3.33Å; Q827-E831 WeakPolarHBondContact O-CG 3.23Å; Q827-E831 PolarHBondContact O-N 3.03Å
828Q63Low66.5Low64 Ų64106.2 Ų106.230%0.29952%0.522SS..Hα-helixtrans-98.5-15.3179.5-81.3-172.6-28.300111.4R824 N826 D830 E831 I832R824-Q828 HydrophobicContact CG-CG 4.19Å; R824-Q828 VanDerWaalsContact O-CA 3.29Å; R824-Q828 WeakPolarHBondContact O-CA 3.26Å; R824-Q828 WeakPolarHBondContact O-CB 3.36Å; R824-Q828 WeakPolarHBondContact O-CG 3.42Å; R824-Q828 PolarHBondContact O-N 3.02Å; N826-Q828 VanDerWaalsContact C-N 3.3Å; N826-Q828 PolarHBondContact O-N 3.18Å; Q828-D830 PolarHBondContact O-N 3.02Å; Q828-E831 HydrophobicContact CG-CB 4.28Å; Q828-E831 PolarHBondContact O-N 3.49Å; Q828-I832 HydrophobicContact CB-CD1 3.92Å; Q828-I832 HydrophobicContact CB-CG1 3.96Å; Q828-I832 HydrophobicContact CG-CG1 4.42Å; Q828-I832 VanDerWaalsContact O-CA 3.26Å; Q828-I832 WeakPolarHBondContact O-CA 3.44Å; Q828-I832 WeakPolarHBondContact O-CB 3.4Å; Q828-I832 WeakPolarHBondContact O-CG1 3.47Å; Q828-I832 PolarHBondContact O-N 3.15Å
829A65.5Low64.7Low52 Ų52105.8 Ų105.843%0.4352%0.524SS..Hα-helixtrans-63.2-34.5156.100000107.9L825 N826 K833L825-A829 WeakPolarHBondContact O-CA 3.21Å; L825-A829 WeakPolarHBondContact O-CB 3.46Å; L825-A829 PolarHBondContact O-N 3.4Å; N826-A829 PolarHBondContact O-N 3.46Å; A829-K833 WeakPolarHBondContact O-CB 3.49Å; A829-K833 PolarHBondContact O-N 2.89Å
830D63Low63.2Low122 Ų122109.3 Ų109.365%0.65254%0.537SS*.Hα-helixtrans-71.6-40.3171.2-57.5-30.5000112.4N826 Q827 Q828N826-D830 VanDerWaalsContact O-CG 3.29Å; N826-D830 PolarHBondContact O-N 3.24Å; N826-D830 VanDerWaalsContact O-N 3.16Å; Q827-D830 CarbonylContact O-C 3.5Å; Q827-D830 VanDerWaalsContact O-CB 3.3Å; Q827-D830 WeakPolarHBondContact O-CB 3.33Å; Q827-D830 PolarHBondContact O-N 3.33Å; Q828-D830 PolarHBondContact O-N 3.02Å
831E57.7Low61.8Low100 Ų100110.7 Ų110.747%0.46755%0.547SS..Hα-helixtrans-92.8-26.6-179.7-71.2-178.8161.300117.3Q827 Q828 K833 Q834 K835Q827-E831 WeakPolarHBondContact O-CG 3.23Å; Q827-E831 PolarHBondContact O-N 3.03Å; Q828-E831 HydrophobicContact CG-CB 4.28Å; Q828-E831 PolarHBondContact O-N 3.49Å; E831-K833 VanDerWaalsContact C-N 3.34Å; E831-Q834 VanDerWaalsContact C-N 3.29Å; E831-Q834 CarbonylContact O-C 3.57Å; E831-Q834 WeakPolarHBondContact O-CA 3.39Å; E831-Q834 WeakPolarHBondContact O-CB 3.39Å; E831-Q834 PolarHBondContact O-N 2.77Å; E831-K835 WeakPolarHBondContact O-CB 3.42Å; E831-K835 PolarHBondContact O-N 3.49Å
832I56.1Low60Low61 Ų61112.5 Ų112.531%0.31356%0.557SS.*Hα-helixtrans-76.6-27.7172.5-69.5170.1000109.3Q828 Q834 K835 Q836Q828-I832 HydrophobicContact CB-CD1 3.92Å; Q828-I832 HydrophobicContact CB-CG1 3.96Å; Q828-I832 HydrophobicContact CG-CG1 4.42Å; Q828-I832 VanDerWaalsContact O-CA 3.26Å; Q828-I832 WeakPolarHBondContact O-CA 3.44Å; Q828-I832 WeakPolarHBondContact O-CB 3.4Å; Q828-I832 WeakPolarHBondContact O-CG1 3.47Å; Q828-I832 PolarHBondContact O-N 3.15Å; I832-Q834 PolarHBondContact O-N 3.11Å; I832-K835 PolarHBondContact O-N 3.41Å; I832-Q836 HydrophobicContact CG2-CB 4.04Å; I832-Q836 VanDerWaalsContact O-CB 3.22Å; I832-Q836 WeakPolarHBondContact O-CB 3.38Å; I832-Q836 PolarHBondContact O-N 3.46Å
833K54.5Low58.4Low183 Ų183113.9 Ų113.980%0.79656%0.563SS**Hα-helixtrans-54.3-17.6156.1-169.7178.7179.8-174.20112.3A829 E831A829-K833 WeakPolarHBondContact O-CB 3.49Å; A829-K833 PolarHBondContact O-N 2.89Å; E831-K833 VanDerWaalsContact C-N 3.34Å
834Q54.7Low56.9Low133 Ų133115.6 Ų115.662%0.62157%0.571SS**Hα-helixtrans-106.6-26.2177.4-128.5177.211.900114.3E831 I832E831-Q834 VanDerWaalsContact C-N 3.29Å; E831-Q834 CarbonylContact O-C 3.57Å; E831-Q834 WeakPolarHBondContact O-CA 3.39Å; E831-Q834 WeakPolarHBondContact O-CB 3.39Å; E831-Q834 PolarHBondContact O-N 2.77Å; I832-Q834 PolarHBondContact O-N 3.11Å
835K49.8Very low55.6Low105 Ų105115.9 Ų115.946%0.45758%0.579SS.*Hα-helixtrans-118.1-8.8-170.2-72.6-114.8172.2-162.90115.1E831 I832 D837 E838 V839E831-K835 WeakPolarHBondContact O-CB 3.42Å; E831-K835 PolarHBondContact O-N 3.49Å; I832-K835 PolarHBondContact O-N 3.41Å; K835-D837 PolarHBondContact O-N 3.32Å; K835-E838 VanDerWaalsContact CD-OE2 3.27Å; K835-E838 WeakPolarHBondContact CD-OE2 3.46Å; K835-E838 VanDerWaalsContact CE-OE2 3.26Å; K835-E838 WeakPolarHBondContact CE-OE2 3.41Å; K835-E838 IonicContact NZ-OE1 3.72Å; K835-E838 IonicContact NZ-OE2 3.94Å; K835-E838 PolarHBondContact NZ-OE2 3.23Å; K835-E838 PolarHBondContact O-N 3.25Å; K835-V839 PolarHBondContact O-N 3.16Å
836Q51Low54Low142 Ų142117.1 Ų117.166%0.66459%0.585SS**Hα-helixtrans-55.1-27.4161.8-158.1117.1-2.100110.3I832 E838I832-Q836 HydrophobicContact CG2-CB 4.04Å; I832-Q836 VanDerWaalsContact O-CB 3.22Å; I832-Q836 WeakPolarHBondContact O-CB 3.38Å; I832-Q836 PolarHBondContact O-N 3.46Å; Q836-E838 VanDerWaalsContact C-N 3.25Å; Q836-E838 PolarHBondContact O-N 3.15Å
837D49.2Very low52.4Low139 Ų139118.7 Ų118.774%0.74359%0.593SS**Hα-helixtrans-68.8-13.5173.4-62.1-17000114.2K835K835-D837 PolarHBondContact O-N 3.32Å
838E49.3Very low51.5Low98 Ų98120.9 Ų120.946%0.45861%0.608SS.*Hα-helixtrans-112.2-33.6-172.9-73.6-174.2-17700115.5K835 Q836 E840 S841K835-E838 VanDerWaalsContact CD-OE2 3.27Å; K835-E838 WeakPolarHBondContact CD-OE2 3.46Å; K835-E838 VanDerWaalsContact CE-OE2 3.26Å; K835-E838 WeakPolarHBondContact CE-OE2 3.41Å; K835-E838 IonicContact NZ-OE1 3.72Å; K835-E838 IonicContact NZ-OE2 3.94Å; K835-E838 PolarHBondContact NZ-OE2 3.23Å; K835-E838 PolarHBondContact O-N 3.25Å; Q836-E838 VanDerWaalsContact C-N 3.25Å; Q836-E838 PolarHBondContact O-N 3.15Å; E838-E840 PolarHBondContact O-N 3.41Å; E838-S841 PolarHBondContact O-N 3.21Å; E838-S841 PolarHBondContact O-OG 3.12Å
839V45.5Very low50.5Low95 Ų95126.8 Ų126.858%0.57663%0.633SS**Hα-helixtrans-81.9-11.2-170.3172.70000114.2K835 S841K835-V839 PolarHBondContact O-N 3.16Å; V839-S841 PolarHBondContact O-N 3.09Å
840E50.5Low49.4Very low182 Ų182131.1 Ų131.185%0.8565%0.648SS**THydrogen-bonded Turntrans-60.8-22.4165.8-157.2141.2-146.800111.6E838E838-E840 PolarHBondContact O-N 3.41Å
841S49.7Very low48.5Very low77 Ų77132.7 Ų132.754%0.53866%0.656SS.*THydrogen-bonded Turntrans-85.3-20.5-176.279.70000116.3E838 V839E838-S841 PolarHBondContact O-N 3.21Å; E838-S841 PolarHBondContact O-OG 3.12Å; V839-S841 PolarHBondContact O-N 3.09Å
842L42.8Very low47.8Very low108 Ų108137.3 Ų137.357%0.56568%0.677SS**THydrogen-bonded Turntrans-104.9-12.1-170.3-69.3174.5000114.9E844 I845L842-E844 PolarHBondContact O-N 3.33Å; L842-I845 HydrophobicContact CD2-CD1 3.86Å; L842-I845 PolarHBondContact O-N 3.38Å
843K45.3Very low47Very low173 Ų173139.7 Ų139.775%0.75270%0.699SS**THydrogen-bonded Turntrans-66.1-14.9173.8-105.6178.7177.4178.50113.6I845K843-I845 VanDerWaalsContact C-N 3.33Å; K843-I845 PolarHBondContact O-N 3.32Å
844E48Very low46.3Very low164 Ų164136 Ų13677%0.76670%0.697SS**THydrogen-bonded Turntrans-76.4-16.6178.9-148.6170.7-159.800113.4L842L842-E844 PolarHBondContact O-N 3.33Å
845I49.4Very low45.9Very low114 Ų114139.8 Ų139.859%0.58571%0.711SS**SBendtrans-90.7-23-170.4-61.7178.3000113.4L842 K843L842-I845 HydrophobicContact CD2-CD1 3.86Å; L842-I845 PolarHBondContact O-N 3.38Å; K843-I845 VanDerWaalsContact C-N 3.33Å; K843-I845 PolarHBondContact O-N 3.32Å
846I43.1Very low45.8Very low129 Ų129140 Ų14066%0.66273%0.726SS**G310 helixtrans-83.2-18-170.7-68.4177000113.4L848I846-L848 VanDerWaalsContact C-N 3.27Å; I846-L848 PolarHBondContact O-N 3.03Å
847D42.4Very low45.7Very low138 Ų138137 Ų13774%0.73872%0.721SS**G310 helixtrans-72.7-13.1179.3-77.1-22.4000114.4
848L50.2Low45.8Very low160 Ų160140.9 Ų140.984%0.83873%0.725SS**G310 helixtrans-88.4-8.5-173.2-77.4169.2000116I846I846-L848 VanDerWaalsContact C-N 3.27Å; I846-L848 PolarHBondContact O-N 3.03Å
849K43.7Very low45.8Very low188 Ų188145.6 Ų145.682%0.81774%0.744SS**SBendtrans-109.7-3.4-166.1-132.1179.3-177.5179.90117.9
850N41.3Very low46.4Very low142 Ų142146 Ų14676%0.75975%0.746SS**SBendtrans-107.96.5-168.2-83.5-24.6000117.1
851I44.3Very low46.6Very low156 Ų156142.3 Ų142.380%0.873%0.732SS**SBendtrans-99-7.9-174.8-63177.9000114
852E43.3Very low47.1Very low196 Ų196146.9 Ų146.992%0.91674%0.743SS**SBendtrans-961-164.7-117.8169.4-175.900118.6
853S39.2Very low48.2Very low112 Ų112150 Ų15078%0.78375%0.752SS**  trans-116.39.6-165.972.10000119.5
854S40.2Very low49.2Very low106 Ų106147.3 Ų147.374%0.74174%0.744SS**  trans-107.521.5-162.252.40000119.5
855K46.1Very low50.4Low211 Ų211144.2 Ų144.292%0.91773%0.733SS**SBendtrans-120.44-176.8-81.3-178.3-178.8171.90119.5
856S46.6Very low51.5Low110 Ų110145.9 Ų145.977%0.76974%0.739SS**SBendtrans-97-9.1-177.961.90000116.8
857S50.2Low52.9Low80 Ų80142.7 Ų142.756%0.55973%0.728SS**G310 helixtrans-77.8-27.1-171.270.60000116K859S857-K859 PolarHBondContact O-N 2.92Å
858R51.3Low54.5Low220 Ų220142.2 Ų142.283%0.8372%0.723SS**G310 helixtrans-77.9-5.7-167-70.1-176.4-175.4167.82117
859K49.2Very low55.9Low197 Ų197139.7 Ų139.786%0.85771%0.71SS**G310 helixtrans-90-19.2178.5-102.3-179.6178.7177.30113.9S857S857-K859 PolarHBondContact O-N 2.92Å
860V57.3Low57.6Low103 Ų103136.5 Ų136.562%0.62470%0.701SS**Hα-helixtrans-79.2-33.4-179.3178.80000111.2K862V860-K862 PolarHBondContact O-N 3.27Å
861D55.6Low59.3Low104 Ų104134 Ų13456%0.55669%0.687SS**Hα-helixtrans-66.7-30.7-174.6-65.1-33.2000114.6
862K59.9Low61Low174 Ų174131 Ų13176%0.75767%0.67SS**Hα-helixtrans-72.4-36-177.8-93.7-173.4175-175.60114V860 L864 N865V860-K862 PolarHBondContact O-N 3.27Å; K862-L864 VanDerWaalsContact C-N 3.33Å; K862-N865 PolarHBondContact O-N 3.1Å
863K64.9Low62.8Low174 Ų174128.5 Ų128.576%0.75766%0.656SS**Hα-helixtrans-72.8-26.8178.1-81.3-169.9174.8-174.60112.8N865K863-N865 VanDerWaalsContact C-N 3.28Å; K863-N865 PolarHBondContact O-N 3.05Å
864L66.7Low64.8Low115 Ų115128 Ų12860%0.60264%0.644SS**Hα-helixtrans-68.3-30.5176.9-153.186.6000111.8K862 S867K862-L864 VanDerWaalsContact C-N 3.33Å; L864-S867 PolarHBondContact O-OG 3.32Å; L864-S867 VanDerWaalsContact O-OG 3.05Å
865N74.7Confident66.7Low100 Ų100130 Ų13054%0.53564%0.635SS.*Hα-helixtrans-78.5-34.3-174.4-159.656.3000113.5K862 K863K862-N865 PolarHBondContact O-N 3.1Å; K863-N865 VanDerWaalsContact C-N 3.28Å; K863-N865 PolarHBondContact O-N 3.05Å
866E72.5Confident68.4Low148 Ų148124.7 Ų124.769%0.69261%0.613SS**Hα-helixtrans-72.2-37.5179.6-73175179.900112.8M868 N869 L870E866-M868 VanDerWaalsContact C-N 3.29Å; E866-M868 PolarHBondContact O-N 3.37Å; E866-N869 PolarHBondContact O-N 3.31Å; E866-L870 PolarHBondContact O-N 3.17Å
867S72.4Confident70.1Confident63 Ų63124.8 Ų124.844%0.44160%0.602SS.*Hα-helixtrans-66-33.6176.357.60000112.1L864 L870 I871L864-S867 PolarHBondContact O-OG 3.32Å; L864-S867 VanDerWaalsContact O-OG 3.05Å; S867-L870 PolarHBondContact O-N 3.45Å; S867-I871 WeakPolarHBondContact O-CG1 3.5Å; S867-I871 PolarHBondContact O-N 3.36Å
868M74.8Confident71.6Confident127 Ų127125.6 Ų125.663%0.62660%0.604SS**Hα-helixtrans-65.5-39.1178.8-141163.2-171.700112.2E866 I871 Q872E866-M868 VanDerWaalsContact C-N 3.29Å; E866-M868 PolarHBondContact O-N 3.37Å; M868-I871 PolarHBondContact O-N 3.21Å; M868-Q872 PolarHBondContact O-N 3.41Å
869N79.5Confident73.1Confident108 Ų108119.7 Ų119.758%0.57858%0.584SS**Hα-helixtrans-67.6-37.1178.2-74.1-26.9000113.1E866 Q872 K873E866-N869 PolarHBondContact O-N 3.31Å; N869-Q872 PolarHBondContact O-N 3.48Å; N869-K873 PolarHBondContact O-N 3.23Å
870L80Confident74.7Confident120 Ų120116.6 Ų116.663%0.62857%0.572SS**Hα-helixtrans-68.6-39.8177.7-167.272.9000111.8E866 S867 Q872 K873 L874E866-L870 PolarHBondContact O-N 3.17Å; S867-L870 PolarHBondContact O-N 3.45Å; L870-Q872 VanDerWaalsContact C-N 3.26Å; L870-Q872 PolarHBondContact O-N 3.06Å; L870-K873 PolarHBondContact O-N 3.19Å; L870-L874 PolarHBondContact O-N 3.45Å
871I76.8Confident75.8Confident90 Ų90117.3 Ų117.346%0.46257%0.572SS.*Hα-helixtrans-60.9-38.1175.5-69.5168.9000110.8S867 M868 R875S867-I871 WeakPolarHBondContact O-CG1 3.5Å; S867-I871 PolarHBondContact O-N 3.36Å; M868-I871 PolarHBondContact O-N 3.21Å; I871-R875 WeakPolarHBondContact O-CG 3.3Å; I871-R875 PolarHBondContact O-N 3.35Å
872Q79.4Confident77.1Confident94 Ų94113.8 Ų113.844%0.43956%0.555SS.*Hα-helixtrans-63.8-43.6179-167.768.78.200112.1M868 N869 L870 L874 R875 E876M868-Q872 PolarHBondContact O-N 3.41Å; N869-Q872 PolarHBondContact O-N 3.48Å; L870-Q872 VanDerWaalsContact C-N 3.26Å; L870-Q872 PolarHBondContact O-N 3.06Å; Q872-L874 PolarHBondContact O-N 3.05Å; Q872-R875 WeakPolarHBondContact O-CB 3.37Å; Q872-R875 PolarHBondContact O-N 3.27Å; Q872-R875 VanDerWaalsContact O-N 3.16Å; Q872-E876 PolarHBondContact O-N 3.48Å
873K82.6Confident78.3Confident143 Ų143108.3 Ų108.362%0.62253%0.532SS*.Hα-helixtrans-65-36.1-178.2-150.7174.6-172.7178.50112.9N869 L870 E876 Q877N869-K873 PolarHBondContact O-N 3.23Å; L870-K873 PolarHBondContact O-N 3.19Å; K873-E876 PolarHBondContact O-N 3.27Å; K873-Q877 PolarHBondContact O-N 3.48Å
874L79.6Confident79.1Confident100 Ų100105.8 Ų105.852%0.52452%0.524SS..Hα-helixtrans-69.7-33.1175.1-71.6171.3000112.7L870 Q872 E876 T878L870-L874 PolarHBondContact O-N 3.45Å; Q872-L874 PolarHBondContact O-N 3.05Å; L874-E876 VanDerWaalsContact C-N 3.33Å; L874-T878 PolarHBondContact O-N 3.41Å; L874-T878 PolarHBondContact O-OG1 2.98Å
875R81.9Confident80Confident150 Ų150107.7 Ų107.757%0.56653%0.527SS*.Hα-helixtrans-65.5-37.1175.4-75.1178-178.4-174.1-2.2111.9I871 Q872 T878 K879I871-R875 WeakPolarHBondContact O-CG 3.3Å; I871-R875 PolarHBondContact O-N 3.35Å; Q872-R875 WeakPolarHBondContact O-CB 3.37Å; Q872-R875 PolarHBondContact O-N 3.27Å; Q872-R875 VanDerWaalsContact O-N 3.16Å; R875-T878 PolarHBondContact O-N 3.36Å; R875-K879 WeakPolarHBondContact O-CG 3.46Å; R875-K879 PolarHBondContact O-N 3.02Å
876E80.5Confident80.4Confident98 Ų98106 Ų10646%0.45852%0.515SS..Hα-helixtrans-66.4-47.8177.9-81.3159.8-176.600112Q872 K873 L874 T878 K879 E880Q872-E876 PolarHBondContact O-N 3.48Å; K873-E876 PolarHBondContact O-N 3.27Å; L874-E876 VanDerWaalsContact C-N 3.33Å; E876-T878 PolarHBondContact O-N 3.45Å; E876-K879 WeakPolarHBondContact O-CB 3.46Å; E876-K879 PolarHBondContact O-N 3.35Å; E876-E880 PolarHBondContact O-N 3.44Å; E876-E880 VanDerWaalsContact O-N 3.15Å
877Q82.4Confident81Confident113 Ų113103.3 Ų103.353%0.52850%0.502SS..Hα-helixtrans-59.2-35.3175.9-69.4-177.1-35.900112.9K873 K879 E880 L881K873-Q877 PolarHBondContact O-N 3.48Å; Q877-K879 VanDerWaalsContact C-N 3.32Å; Q877-K879 PolarHBondContact O-N 3.24Å; Q877-E880 PolarHBondContact O-N 3.36Å; Q877-L881 PolarHBondContact O-N 3.07Å
878T81.3Confident81.4Confident97 Ų97105.9 Ų105.960%0.59551%0.51SS*.Hα-helixtrans-67.5-33.5176.8-53.40000111.9L874 R875 E876 S882L874-T878 PolarHBondContact O-N 3.41Å; L874-T878 PolarHBondContact O-OG1 2.98Å; R875-T878 PolarHBondContact O-N 3.36Å; E876-T878 PolarHBondContact O-N 3.45Å; T878-S882 WeakPolarHBondContact O-CB 3.49Å; T878-S882 PolarHBondContact O-N 3.27Å
879K84.1Confident81.9Confident95 Ų95105.2 Ų105.241%0.41351%0.508SS..Hα-helixtrans-70.9-40.8176.9-73.1177.1-179.9-177.40111.9R875 E876 Q877 S882 Q883R875-K879 WeakPolarHBondContact O-CG 3.46Å; R875-K879 PolarHBondContact O-N 3.02Å; E876-K879 WeakPolarHBondContact O-CB 3.46Å; E876-K879 PolarHBondContact O-N 3.35Å; Q877-K879 VanDerWaalsContact C-N 3.32Å; Q877-K879 PolarHBondContact O-N 3.24Å; K879-S882 PolarHBondContact O-N 3.46Å; K879-Q883 PolarHBondContact O-N 2.8Å; K879-Q883 VanDerWaalsContact O-N 3.1Å
880E82.4Confident82.2Confident132 Ų132104 Ų10462%0.61750%0.498SS*.Hα-helixtrans-62.8-47.3177.9-70.5176.6175.300111.7E876 Q877 S882 Q883 E884E876-E880 PolarHBondContact O-N 3.44Å; E876-E880 VanDerWaalsContact O-N 3.15Å; Q877-E880 PolarHBondContact O-N 3.36Å; E880-S882 VanDerWaalsContact C-N 3.31Å; E880-S882 PolarHBondContact O-N 3.38Å; E880-Q883 VanDerWaalsContact O-CB 3.32Å; E880-Q883 WeakPolarHBondContact O-CB 3.5Å; E880-Q883 PolarHBondContact O-N 3.45Å; E880-Q883 VanDerWaalsContact O-N 3.12Å; E880-E884 PolarHBondContact O-N 3.39Å; E880-E884 VanDerWaalsContact O-N 3.11Å
881L80.9Confident82.4Confident119 Ų119104.8 Ų104.862%0.62350%0.496SS*.Hα-helixtrans-61.4-35.9175.6-88.7159.2000113.3Q877 Q883 K885Q877-L881 PolarHBondContact O-N 3.07Å; L881-Q883 VanDerWaalsContact C-N 3.33Å; L881-K885 PolarHBondContact O-N 3.26Å
882S82.8Confident82.6Confident29 Ų29106.4 Ų106.420%0.20350%0.502CS..Hα-helixtrans-66.1-37.4175.6-176.90000111.8T178 T878 K879 E880 K886T178-S882 PolarHBondContact OG1-OG 3.09Å; T878-S882 WeakPolarHBondContact O-CB 3.49Å; T878-S882 PolarHBondContact O-N 3.27Å; K879-S882 PolarHBondContact O-N 3.46Å; E880-S882 VanDerWaalsContact C-N 3.31Å; E880-S882 PolarHBondContact O-N 3.38Å; S882-K886 PolarHBondContact O-N 3.35Å
883Q84.8Confident82.9Confident59 Ų59107.1 Ų107.128%0.27651%0.506SS..Hα-helixtrans-64.8-50.8177.1-173.976.4-4.600111.6N175 K879 E880 L881 K885 K886 E887N175-Q883 VanDerWaalsContact CG-OE1 3.22Å; N175-Q883 PolarHBondContact ND2-NE2 3.46Å; N175-Q883 PolarHBondContact ND2-OE1 3.15Å; N175-Q883 VanDerWaalsContact ND2-OE1 3.08Å; K879-Q883 PolarHBondContact O-N 2.8Å; K879-Q883 VanDerWaalsContact O-N 3.1Å; E880-Q883 VanDerWaalsContact O-CB 3.32Å; E880-Q883 WeakPolarHBondContact O-CB 3.5Å; E880-Q883 PolarHBondContact O-N 3.45Å; E880-Q883 VanDerWaalsContact O-N 3.12Å; L881-Q883 VanDerWaalsContact C-N 3.33Å; Q883-K885 VanDerWaalsContact C-N 3.29Å; Q883-K885 PolarHBondContact O-N 3.42Å; Q883-K886 PolarHBondContact O-N 3.16Å; Q883-K886 VanDerWaalsContact O-N 3.08Å; Q883-E887 PolarHBondContact O-N 3.17Å; Q883-E887 VanDerWaalsContact O-N 3.1Å
884E81.6Confident83.2Confident122 Ų122104.9 Ų104.957%0.5750%0.5SS*.Hα-helixtrans-59.1-40.8179.6-73-173.5164.700111.7E880 K886 E887 I888E880-E884 PolarHBondContact O-N 3.39Å; E880-E884 VanDerWaalsContact O-N 3.11Å; E884-K886 VanDerWaalsContact C-N 3.33Å; E884-K886 PolarHBondContact O-N 3.2Å; E884-E887 PolarHBondContact O-N 3.03Å; E884-I888 WeakPolarHBondContact O-CG1 3.45Å; E884-I888 PolarHBondContact O-N 3.49Å
885K84.6Confident83.4Confident155 Ų155107.1 Ų107.167%0.67451%0.505SS*.Hα-helixtrans-59-41.9175.2-173.5179.3178.1-1790112.3L881 Q883 L889L881-K885 PolarHBondContact O-N 3.26Å; Q883-K885 VanDerWaalsContact C-N 3.29Å; Q883-K885 PolarHBondContact O-N 3.42Å; K885-L889 PolarHBondContact O-N 3.14Å; K885-L889 VanDerWaalsContact O-N 3.11Å
886K84.7Confident83.6Confident64 Ų64103.9 Ų103.928%0.27850%0.497SS..Hα-helixtrans-66.9-38.8178-73.3-175-175.6-177.60111.9N175 V176 S882 Q883 E884 L889 K890N175-K886 HydrophobicContact CB-CD 4.39Å; N175-K886 WeakPolarHBondContact OD1-CD 3.3Å; V176-K886 PolarHBondContact O-NZ 3.39Å; S882-K886 PolarHBondContact O-N 3.35Å; Q883-K886 PolarHBondContact O-N 3.16Å; Q883-K886 VanDerWaalsContact O-N 3.08Å; E884-K886 VanDerWaalsContact C-N 3.33Å; E884-K886 PolarHBondContact O-N 3.2Å; K886-L889 PolarHBondContact O-N 3.1Å; K886-K890 PolarHBondContact O-N 3.37Å; K886-K890 VanDerWaalsContact O-N 3.1Å
887E83.5Confident83.7Confident92 Ų92104.6 Ų104.643%0.4350%0.5SS..Hα-helixtrans-68.3-40.8177.9-70.3-168.3-175.900112.8Q883 E884 L889 K890 K891Q883-E887 PolarHBondContact O-N 3.17Å; Q883-E887 VanDerWaalsContact O-N 3.1Å; E884-E887 PolarHBondContact O-N 3.03Å; E887-L889 VanDerWaalsContact C-N 3.3Å; E887-L889 PolarHBondContact O-N 3.43Å; E887-K890 PolarHBondContact O-N 3.18Å; E887-K891 PolarHBondContact O-N 3.49Å
888I81.7Confident83.9Confident117 Ų117104.5 Ų104.560%0.650%0.499SS*.Hα-helixtrans-61.9-40.9174.6-68.4170.1000110.5E884 K891 H892E884-I888 WeakPolarHBondContact O-CG1 3.45Å; E884-I888 PolarHBondContact O-N 3.49Å; I888-K891 PolarHBondContact O-N 3.13Å; I888-H892 PolarHBondContact O-N 3.34Å
889L84.3Confident83.9Confident112 Ų112104.7 Ų104.759%0.58650%0.497SS*.Hα-helixtrans-62.9-43.2177.9-150.491.6000112.3K885 K886 E887 H892 M893K885-L889 PolarHBondContact O-N 3.14Å; K885-L889 VanDerWaalsContact O-N 3.11Å; K886-L889 PolarHBondContact O-N 3.1Å; E887-L889 VanDerWaalsContact C-N 3.3Å; E887-L889 PolarHBondContact O-N 3.43Å; L889-H892 PolarHBondContact O-N 3.5Å; L889-M893 PolarHBondContact O-N 3.5Å
890K86.3Confident84.1Confident83 Ų83105.5 Ų105.536%0.36150%0.5SS..Hα-helixtrans-61.2-45.6175.5-73.5-179.7-177.3177.20111.4A173 K886 E887 H892 M893 I894A173-K890 VanDerWaalsContact CB-NZ 3.34Å; A173-K890 PolarHBondContact O-NZ 3.47Å; K886-K890 PolarHBondContact O-N 3.37Å; K886-K890 VanDerWaalsContact O-N 3.1Å; E887-K890 PolarHBondContact O-N 3.18Å; K890-H892 VanDerWaalsContact C-N 3.31Å; K890-H892 PolarHBondContact O-N 3.43Å; K890-M893 PolarHBondContact O-N 3.45Å; K890-I894 WeakPolarHBondContact O-CG1 3.5Å; K890-I894 PolarHBondContact O-N 3.45Å; K890-I894 VanDerWaalsContact O-N 3.11Å
891K85Confident84.2Confident136 Ų136106.1 Ų106.159%0.59150%0.501SS*.Hα-helixtrans-61.8-38176.8-73.2178.5-178.8172.30112.2E887 I888 K895E887-K891 PolarHBondContact O-N 3.49Å; I888-K891 PolarHBondContact O-N 3.13Å; K891-K895 WeakPolarHBondContact O-CG 3.44Å; K891-K895 PolarHBondContact O-N 3.44Å
892H80.9Confident84.3Confident125 Ų125105.9 Ų105.958%0.57950%0.499SS*.Hα-helixtrans-65.7-45.2176-171.6-81.8000112I888 L889 K890 I894 K895 E896I888-H892 PolarHBondContact O-N 3.34Å; L889-H892 PolarHBondContact O-N 3.5Å; K890-H892 VanDerWaalsContact C-N 3.31Å; K890-H892 PolarHBondContact O-N 3.43Å; H892-I894 PolarHBondContact O-N 3.19Å; H892-K895 PolarHBondContact O-N 3.08Å; H892-E896 WeakPolarHBondContact O-CB 3.47Å; H892-E896 PolarHBondContact O-N 3.42Å
893M85.8Confident84.2Confident109 Ų109109.6 Ų109.654%0.53751%0.514SS..Hα-helixtrans-59.6-42.6176.9-89.4-174.461.600113.1L889 K890 E896 Q897L889-M893 PolarHBondContact O-N 3.5Å; K890-M893 PolarHBondContact O-N 3.45Å; M893-E896 PolarHBondContact O-N 3.42Å; M893-Q897 WeakPolarHBondContact O-CG 3.5Å; M893-Q897 PolarHBondContact O-N 3.1Å; M893-Q897 VanDerWaalsContact O-N 3.08Å
894I87.9Confident84.3Confident95 Ų95110.9 Ų110.949%0.48753%0.525SS..Hα-helixtrans-62.8-47.5178.4-66.6167.5000110.1K890 H892 E896 Q897 E898K890-I894 WeakPolarHBondContact O-CG1 3.5Å; K890-I894 PolarHBondContact O-N 3.45Å; K890-I894 VanDerWaalsContact O-N 3.11Å; H892-I894 PolarHBondContact O-N 3.19Å; I894-E896 VanDerWaalsContact C-N 3.32Å; I894-E896 PolarHBondContact O-N 3.47Å; I894-Q897 PolarHBondContact O-N 3.13Å; I894-E898 WeakPolarHBondContact O-CG 3.48Å; I894-E898 PolarHBondContact O-N 3.47Å
895K85Confident84.5Confident147 Ų147111.8 Ų111.864%0.63953%0.527SS*.Hα-helixtrans-61.5-38.6177.2-75.2-172.9175.4-1720112.8K891 H892 E898 L899K891-K895 WeakPolarHBondContact O-CG 3.44Å; K891-K895 PolarHBondContact O-N 3.44Å; H892-K895 PolarHBondContact O-N 3.08Å; K895-E898 PolarHBondContact O-N 3.45Å; K895-L899 WeakPolarHBondContact O-CB 3.5Å; K895-L899 PolarHBondContact O-N 3.27Å
896E84.6Confident84.4Confident83 Ų83107 Ų10739%0.38852%0.516SS..Hα-helixtrans-65.5-38.4177.5-164.2-170.4146.900112.1H892 M893 I894 L899 K900H892-E896 WeakPolarHBondContact O-CB 3.47Å; H892-E896 PolarHBondContact O-N 3.42Å; M893-E896 PolarHBondContact O-N 3.42Å; I894-E896 VanDerWaalsContact C-N 3.32Å; I894-E896 PolarHBondContact O-N 3.47Å; E896-L899 PolarHBondContact O-N 3.22Å; E896-K900 WeakPolarHBondContact O-CG 3.36Å; E896-K900 PolarHBondContact O-N 2.99Å; E896-K900 VanDerWaalsContact O-N 3.07Å; E896-K900 IonicContact OE1-NZ 4Å; E896-K900 PolarHBondContact OE1-NZ 3.36Å
897Q84.3Confident84.5Confident113 Ų113109 Ų10953%0.52853%0.529SS..Hα-helixtrans-68-38.1174.3-73.2-175.1-5.600112.5M893 I894 K901M893-Q897 WeakPolarHBondContact O-CG 3.5Å; M893-Q897 PolarHBondContact O-N 3.1Å; M893-Q897 VanDerWaalsContact O-N 3.08Å; I894-Q897 PolarHBondContact O-N 3.13Å; Q897-K901 WeakPolarHBondContact O-CG 3.45Å; Q897-K901 PolarHBondContact O-N 3.49Å; Q897-K901 VanDerWaalsContact O-N 3.1Å
898E85.8Confident84.7Confident110 Ų110108.7 Ų108.751%0.51453%0.53SS..Hα-helixtrans-63.7-41.2174-72.8175.5168.500111.7I894 K895 K901 L902I894-E898 WeakPolarHBondContact O-CG 3.48Å; I894-E898 PolarHBondContact O-N 3.47Å; K895-E898 PolarHBondContact O-N 3.45Å; E898-K901 PolarHBondContact O-N 3.47Å; E898-L902 WeakPolarHBondContact O-CG 3.42Å; E898-L902 PolarHBondContact O-N 3.28Å
899L82.2Confident84.7Confident102 Ų102109.1 Ų109.153%0.53453%0.53SS..Hα-helixtrans-63.7-44.8177.8-135.7152.3000111.5K895 E896 K901 L902 E903K895-L899 WeakPolarHBondContact O-CB 3.5Å; K895-L899 PolarHBondContact O-N 3.27Å; E896-L899 PolarHBondContact O-N 3.22Å; L899-K901 VanDerWaalsContact C-N 3.33Å; L899-K901 PolarHBondContact O-N 3.48Å; L899-L902 PolarHBondContact O-N 3.24Å; L899-L902 VanDerWaalsContact O-N 3.15Å; L899-E903 HydrophobicContact CD2-CG 4.37Å; L899-E903 PolarHBondContact O-N 3.22Å
900K86.8Confident84.7Confident112 Ų112109.1 Ų109.149%0.48753%0.527SS..Hα-helixtrans-60.7-38.4174-74.7174.7-174.5162.60112.7E896 L902 E903 V904E896-K900 WeakPolarHBondContact O-CG 3.36Å; E896-K900 PolarHBondContact O-N 2.99Å; E896-K900 VanDerWaalsContact O-N 3.07Å; E896-K900 IonicContact OE1-NZ 4Å; E896-K900 PolarHBondContact OE1-NZ 3.36Å; K900-L902 VanDerWaalsContact C-N 3.35Å; K900-E903 PolarHBondContact O-N 3.4Å; K900-V904 WeakPolarHBondContact O-CG2 3.46Å; K900-V904 PolarHBondContact O-N 3.39Å; K900-V904 VanDerWaalsContact O-N 3.12Å
901K85.7Confident84.8Confident144 Ų144111.1 Ų111.163%0.62654%0.535SS*.Hα-helixtrans-66.1-37.2175.6-75.4176.6-178.6176.80112.1Q897 E898 L899 K905Q897-K901 WeakPolarHBondContact O-CG 3.45Å; Q897-K901 PolarHBondContact O-N 3.49Å; Q897-K901 VanDerWaalsContact O-N 3.1Å; E898-K901 PolarHBondContact O-N 3.47Å; L899-K901 VanDerWaalsContact C-N 3.33Å; L899-K901 PolarHBondContact O-N 3.48Å; K901-K905 WeakPolarHBondContact O-CG 3.49Å; K901-K905 PolarHBondContact O-N 3.49Å
902L81.8Confident84.8Confident114 Ų114110.6 Ų110.660%0.59754%0.535SS*.Hα-helixtrans-70.8-39.1176.8-73.3173.1000112E898 L899 K900 K905 A906E898-L902 WeakPolarHBondContact O-CG 3.42Å; E898-L902 PolarHBondContact O-N 3.28Å; L899-L902 PolarHBondContact O-N 3.24Å; L899-L902 VanDerWaalsContact O-N 3.15Å; K900-L902 VanDerWaalsContact C-N 3.35Å; L902-K905 PolarHBondContact O-N 3.34Å; L902-A906 PolarHBondContact O-N 3.03Å
903E80.1Confident84.9Confident108 Ų108110.8 Ų110.851%0.50554%0.54SS..Hα-helixtrans-60.6-46174-76.2176.3168.200112L899 K900 K905 A906 I907L899-E903 HydrophobicContact CD2-CG 4.37Å; L899-E903 PolarHBondContact O-N 3.22Å; K900-E903 PolarHBondContact O-N 3.4Å; E903-K905 VanDerWaalsContact C-N 3.31Å; E903-K905 PolarHBondContact O-N 3.4Å; E903-A906 PolarHBondContact O-N 3.48Å; E903-I907 WeakPolarHBondContact O-CG1 3.33Å; E903-I907 PolarHBondContact O-N 3.22Å
904V88.5Confident84.9Confident85 Ų85112.7 Ų112.752%0.51554%0.541SS..Hα-helixtrans-62-39.7176.7173.40000111.5K900 I907 N908K900-V904 WeakPolarHBondContact O-CG2 3.46Å; K900-V904 PolarHBondContact O-N 3.39Å; K900-V904 VanDerWaalsContact O-N 3.12Å; V904-I907 PolarHBondContact O-N 3.03Å; V904-N908 PolarHBondContact O-N 3.23Å
905K85.7Confident85Confident141 Ų141112.6 Ų112.661%0.61354%0.539SS*.Hα-helixtrans-64.2-41.8175.2-79.2-175.1176.5-171.90112.3K901 L902 E903 N908 Q909K901-K905 WeakPolarHBondContact O-CG 3.49Å; K901-K905 PolarHBondContact O-N 3.49Å; L902-K905 PolarHBondContact O-N 3.34Å; E903-K905 VanDerWaalsContact C-N 3.31Å; E903-K905 PolarHBondContact O-N 3.4Å; K905-N908 PolarHBondContact O-N 3.42Å; K905-Q909 WeakPolarHBondContact O-CG 3.44Å; K905-Q909 PolarHBondContact O-N 3.25Å
906A80.8Confident84.9Confident54 Ų54108.4 Ų108.445%0.44653%0.531SS..Hα-helixtrans-64.2-42.2178.100000111.9L902 E903 Q909 E910L902-A906 PolarHBondContact O-N 3.03Å; E903-A906 PolarHBondContact O-N 3.48Å; A906-Q909 PolarHBondContact O-N 3.48Å; A906-E910 PolarHBondContact O-N 3.2Å
907I88.1Confident85.1Confident108 Ų108108.2 Ų108.255%0.55453%0.533SS*.Hα-helixtrans-63.2-43.1176.5-67.6166.7000111.2E903 V904 E910 K911E903-I907 WeakPolarHBondContact O-CG1 3.33Å; E903-I907 PolarHBondContact O-N 3.22Å; V904-I907 PolarHBondContact O-N 3.03Å; I907-E910 PolarHBondContact O-N 3.26Å; I907-K911 PolarHBondContact O-N 3.45Å
908N86.9Confident85.3Confident84 Ų84106.8 Ų106.845%0.44953%0.529SS..Hα-helixtrans-64.7-42.7178-74.4-6.5000112V904 K905 E910 K911 E912V904-N908 PolarHBondContact O-N 3.23Å; K905-N908 PolarHBondContact O-N 3.42Å; N908-E910 VanDerWaalsContact C-N 3.33Å; N908-E910 PolarHBondContact O-N 3.2Å; N908-K911 WeakPolarHBondContact O-CB 3.34Å; N908-K911 PolarHBondContact O-N 3.19Å; N908-E912 WeakPolarHBondContact O-CG 3.11Å; N908-E912 PolarHBondContact O-N 3.48Å
909Q82.6Confident85.4Confident127 Ų127106.4 Ų106.459%0.59353%0.527SS*.Hα-helixtrans-63.2-38175.2-76.7-176-34.600112.4K905 A906 K911 E912 L913K905-Q909 WeakPolarHBondContact O-CG 3.44Å; K905-Q909 PolarHBondContact O-N 3.25Å; A906-Q909 PolarHBondContact O-N 3.48Å; Q909-K911 VanDerWaalsContact C-N 3.32Å; Q909-E912 PolarHBondContact O-N 3.46Å; Q909-L913 WeakPolarHBondContact O-CB 3.44Å; Q909-L913 WeakPolarHBondContact O-CG 3.37Å; Q909-L913 PolarHBondContact O-N 3.45Å
910E84.2Confident85.4Confident112 Ų112106.9 Ų106.952%0.52353%0.525SS..Hα-helixtrans-64.9-37.6174.7-164.4-169.9149.500111.8A906 I907 N908 R914A906-E910 PolarHBondContact O-N 3.2Å; I907-E910 PolarHBondContact O-N 3.26Å; N908-E910 VanDerWaalsContact C-N 3.33Å; N908-E910 PolarHBondContact O-N 3.2Å; E910-R914 WeakPolarHBondContact O-CB 3.47Å; E910-R914 PolarHBondContact O-N 3.33Å; E910-R914 VanDerWaalsContact O-N 3.1Å; E910-R914 IonicContact OE1-NH2 2.65Å; E910-R914 PolarHBondContact OE1-NH2 3.32Å
911K88.8Confident85.3Confident124 Ų124107 Ų10754%0.53953%0.527SS..Hα-helixtrans-65.3-47.8175.9-167.3-174.2-179.5-111.50111.7I907 N908 Q909 L913 R914 E915I907-K911 PolarHBondContact O-N 3.45Å; N908-K911 WeakPolarHBondContact O-CB 3.34Å; N908-K911 PolarHBondContact O-N 3.19Å; Q909-K911 VanDerWaalsContact C-N 3.32Å; K911-L913 VanDerWaalsContact C-N 3.34Å; K911-L913 PolarHBondContact O-N 3.47Å; K911-R914 WeakPolarHBondContact O-CB 3.49Å; K911-R914 PolarHBondContact O-N 3.29Å; K911-R914 VanDerWaalsContact O-N 3.13Å; K911-E915 WeakPolarHBondContact CE-OE1 3.46Å; K911-E915 IonicContact NZ-OE1 3.17Å; K911-E915 PolarHBondContact NZ-OE1 3.31Å; K911-E915 WeakPolarHBondContact O-CG 3.43Å; K911-E915 PolarHBondContact O-N 3.42Å
912E83.8Confident85.4Confident126 Ų126105.6 Ų105.659%0.58952%0.518SS*.Hα-helixtrans-59.8-42.6177.2-74.1172.3-170.700111.8N908 Q909 R914 E915 A916N908-E912 WeakPolarHBondContact O-CG 3.11Å; N908-E912 PolarHBondContact O-N 3.48Å; Q909-E912 PolarHBondContact O-N 3.46Å; E912-R914 VanDerWaalsContact C-N 3.29Å; E912-R914 PolarHBondContact O-N 3.42Å; E912-E915 PolarHBondContact O-N 3.24Å; E912-A916 WeakPolarHBondContact O-CB 3.46Å; E912-A916 PolarHBondContact O-N 3.28Å
913L82.4Confident85.4Confident128 Ų128104.8 Ų104.867%0.6751%0.514SS*.Hα-helixtrans-64.6-32.9176-75.7171.9000112.8Q909 K911 N917Q909-L913 WeakPolarHBondContact O-CB 3.44Å; Q909-L913 WeakPolarHBondContact O-CG 3.37Å; Q909-L913 PolarHBondContact O-N 3.45Å; K911-L913 VanDerWaalsContact C-N 3.34Å; K911-L913 PolarHBondContact O-N 3.47Å; L913-N917 WeakPolarHBondContact O-CB 3.23Å; L913-N917 PolarHBondContact O-N 3.43Å; L913-N917 VanDerWaalsContact O-N 3.11Å
914R87.4Confident85.7Confident149 Ų149107.2 Ų107.256%0.56252%0.519SS*.Hα-helixtrans-70.9-47.1176.8-162.7179.7-60.9-1671.3111.1E910 K911 E912 A916 N917 D918E910-R914 WeakPolarHBondContact O-CB 3.47Å; E910-R914 PolarHBondContact O-N 3.33Å; E910-R914 VanDerWaalsContact O-N 3.1Å; E910-R914 IonicContact OE1-NH2 2.65Å; E910-R914 PolarHBondContact OE1-NH2 3.32Å; K911-R914 WeakPolarHBondContact O-CB 3.49Å; K911-R914 PolarHBondContact O-N 3.29Å; K911-R914 VanDerWaalsContact O-N 3.13Å; E912-R914 VanDerWaalsContact C-N 3.29Å; E912-R914 PolarHBondContact O-N 3.42Å; R914-A916 PolarHBondContact O-N 3.29Å; R914-N917 PolarHBondContact O-N 3.3Å; R914-D918 PolarHBondContact O-N 3.28Å
915E88.3Confident85.5Confident94 Ų94108.1 Ų108.144%0.43952%0.518SS..Hα-helixtrans-59.3-45.9176.1-71171.4-176.300111.2K911 E912 N917 D918 E919K911-E915 WeakPolarHBondContact CE-OE1 3.46Å; K911-E915 IonicContact NZ-OE1 3.17Å; K911-E915 PolarHBondContact NZ-OE1 3.31Å; K911-E915 WeakPolarHBondContact O-CG 3.43Å; K911-E915 PolarHBondContact O-N 3.42Å; E912-E915 PolarHBondContact O-N 3.24Å; E915-N917 VanDerWaalsContact C-N 3.31Å; E915-N917 PolarHBondContact O-N 3.47Å; E915-D918 PolarHBondContact O-N 3.1Å; E915-E919 PolarHBondContact O-N 3.16Å
916A84.5Confident85.6Confident58 Ų58106.4 Ų106.448%0.47951%0.512SS..Hα-helixtrans-62.8-34.8176.100000113.2E912 R914 K920E912-A916 WeakPolarHBondContact O-CB 3.46Å; E912-A916 PolarHBondContact O-N 3.28Å; R914-A916 PolarHBondContact O-N 3.29Å; A916-K920 WeakPolarHBondContact O-CB 3.46Å; A916-K920 PolarHBondContact O-N 3.28Å
917N87.2Confident85.6Confident79 Ų79108.2 Ų108.242%0.42251%0.514SS..Hα-helixtrans-73.1-37.8177.2-169.960.6000112.2L913 R914 E915 K920 Q921L913-N917 WeakPolarHBondContact O-CB 3.23Å; L913-N917 PolarHBondContact O-N 3.43Å; L913-N917 VanDerWaalsContact O-N 3.11Å; R914-N917 PolarHBondContact O-N 3.3Å; E915-N917 VanDerWaalsContact C-N 3.31Å; E915-N917 PolarHBondContact O-N 3.47Å; N917-K920 PolarHBondContact O-N 3.43Å; N917-Q921 PolarHBondContact O-N 3.23Å
918D89.7Confident85.6Confident84 Ų84110.8 Ų110.845%0.44952%0.521SS..Hα-helixtrans-65.1-40.1174.7-69.5-17.5000111.1R914 E915 Q921 R922R914-D918 PolarHBondContact O-N 3.28Å; E915-D918 PolarHBondContact O-N 3.1Å; D918-Q921 PolarHBondContact O-N 3.46Å; D918-R922 PolarHBondContact O-N 3.06Å
919E87Confident85.6Confident101 Ų101114.3 Ų114.347%0.47253%0.528SS..Hα-helixtrans-67.3-43175.2-174.2155.4-165.700112.5E915 Q921 R922 L923E915-E919 PolarHBondContact O-N 3.16Å; E919-Q921 PolarHBondContact O-N 3.48Å; E919-R922 PolarHBondContact O-N 3.38Å; E919-R922 VanDerWaalsContact O-N 3.15Å; E919-L923 HydrophobicContact CG-CD1 4.4Å; E919-L923 WeakPolarHBondContact O-CG 3.44Å; E919-L923 PolarHBondContact O-N 3.23Å
920K82.6Confident85.5Confident113 Ų113113.7 Ų113.749%0.49153%0.526SS..Hα-helixtrans-55-41.4172-165.6-174.379.3-179.60111A916 N917 L923 Y924A916-K920 WeakPolarHBondContact O-CB 3.46Å; A916-K920 PolarHBondContact O-N 3.28Å; N917-K920 PolarHBondContact O-N 3.43Å; K920-L923 PolarHBondContact O-N 3.29Å; K920-Y924 HydrophobicContact CD-CE2 3.98Å; K920-Y924 HydrophobicContact CG-CD2 3.97Å; K920-Y924 HydrophobicContact CG-CE2 3.75Å; K920-Y924 WeakPolarHBondContact O-CD2 3.38Å; K920-Y924 PolarHBondContact O-N 3.12Å
921Q85.7Confident85.4Confident113 Ų113114.9 Ų114.953%0.52853%0.53SS..Hα-helixtrans-69-40.6179.1-168.9156.1-19.100112.5N917 D918 E919 L923 Y924 E925N917-Q921 PolarHBondContact O-N 3.23Å; D918-Q921 PolarHBondContact O-N 3.46Å; E919-Q921 PolarHBondContact O-N 3.48Å; Q921-L923 PolarHBondContact O-N 3.41Å; Q921-Y924 PolarHBondContact O-N 3.49Å; Q921-E925 PolarHBondContact O-N 3.46Å; Q921-E925 VanDerWaalsContact O-N 3.15Å
922R86.5Confident85.3Confident116 Ų116114 Ų11444%0.43853%0.527SS..Hα-helixtrans-57.3-47.3171.6-76.2-167.1-96.3177.8-3.3111.6D918 E919 Y924 E925 E926 E1053D918-R922 PolarHBondContact O-N 3.06Å; E919-R922 PolarHBondContact O-N 3.38Å; E919-R922 VanDerWaalsContact O-N 3.15Å; R922-Y924 PolarHBondContact O-N 3.39Å; R922-E925 PolarHBondContact O-N 3.25Å; R922-E926 PolarHBondContact O-N 2.9Å; R922-E1053 IonicContact CZ-OE1 3.99Å; R922-E1053 IonicContact CZ-OE2 2.73Å; R922-E1053 IonicContact NH1-OE1 2.69Å; R922-E1053 IonicContact NH1-OE2 3.81Å; R922-E1053 PolarHBondContact NH1-OE2 3.18Å; R922-E1053 IonicContact NH2-OE1 3.77Å; R922-E1053 PolarHBondContact NH2-OE1 3.12Å; R922-E1053 IonicContact NH2-OE2 2.83Å
923L83.2Confident85.3Confident97 Ų97111.7 Ų111.751%0.50852%0.519SS..Hα-helixtrans-63-40.3178.6-70.3172.7000112.4E919 K920 Q921 E925 E926 L927E919-L923 HydrophobicContact CG-CD1 4.4Å; E919-L923 WeakPolarHBondContact O-CG 3.44Å; E919-L923 PolarHBondContact O-N 3.23Å; K920-L923 PolarHBondContact O-N 3.29Å; Q921-L923 PolarHBondContact O-N 3.41Å; L923-E925 VanDerWaalsContact C-N 3.33Å; L923-E925 PolarHBondContact O-N 3.47Å; L923-E926 PolarHBondContact O-N 3.41Å; L923-L927 WeakPolarHBondContact O-CB 3.5Å; L923-L927 PolarHBondContact O-N 3.38Å
924Y84.8Confident85.2Confident159 Ų159110.8 Ų110.862%0.62451%0.512SS*.Hα-helixtrans-61.7-38.7174.9-89.3-66000112.9K920 Q921 R922 K928K920-Y924 HydrophobicContact CD-CE2 3.98Å; K920-Y924 HydrophobicContact CG-CD2 3.97Å; K920-Y924 HydrophobicContact CG-CE2 3.75Å; K920-Y924 WeakPolarHBondContact O-CD2 3.38Å; K920-Y924 PolarHBondContact O-N 3.12Å; Q921-Y924 PolarHBondContact O-N 3.49Å; R922-Y924 PolarHBondContact O-N 3.39Å; Y924-K928 WeakPolarHBondContact O-CB 2.94Å; Y924-K928 PolarHBondContact O-N 3.32Å; Y924-K928 VanDerWaalsContact O-N 3.1Å
925E86.3Confident85.2Confident103 Ų103107.4 Ų107.448%0.48151%0.507SS..Hα-helixtrans-69.7-37.8176.3-71.9-174.8178.300112.5Q921 R922 L923 K928 R929Q921-E925 PolarHBondContact O-N 3.46Å; Q921-E925 VanDerWaalsContact O-N 3.15Å; R922-E925 PolarHBondContact O-N 3.25Å; L923-E925 VanDerWaalsContact C-N 3.33Å; L923-E925 PolarHBondContact O-N 3.47Å; E925-K928 PolarHBondContact O-N 3.22Å; E925-R929 PolarHBondContact O-N 3.21Å
926E87.7Confident84.9Confident105 Ų105107.6 Ų107.649%0.49151%0.508SS..Hα-helixtrans-66.6-43.5175.6-172.1166.5-162.300112.1R922 L923 K928 R929 M930R922-E926 PolarHBondContact O-N 2.9Å; L923-E926 PolarHBondContact O-N 3.41Å; E926-K928 VanDerWaalsContact C-N 3.26Å; E926-K928 PolarHBondContact O-N 3.4Å; E926-R929 PolarHBondContact O-N 3.31Å; E926-R929 VanDerWaalsContact O-N 3.11Å; E926-M930 HydrophobicContact CG-CE 4.49Å; E926-M930 PolarHBondContact O-N 3.04Å
927L80.5Confident84.8Confident92 Ų92113.2 Ų113.248%0.48252%0.517SS..Hα-helixtrans-61.6-36.1174.8-132.8155.4000111.5L923 K931L923-L927 WeakPolarHBondContact O-CB 3.5Å; L923-L927 PolarHBondContact O-N 3.38Å; L927-K931 WeakPolarHBondContact O-CG 3.32Å; L927-K931 PolarHBondContact O-N 3.13Å; L927-K931 VanDerWaalsContact O-N 3.1Å
928K87.9Confident84.4Confident163 Ų163114.5 Ų114.571%0.70952%0.521SS*.Hα-helixtrans-66.8-41.6173.3-171179.9179.5-176.60112.1Y924 E925 E926 K931 Q932Y924-K928 WeakPolarHBondContact O-CB 2.94Å; Y924-K928 PolarHBondContact O-N 3.32Å; Y924-K928 VanDerWaalsContact O-N 3.1Å; E925-K928 PolarHBondContact O-N 3.22Å; E926-K928 VanDerWaalsContact C-N 3.26Å; E926-K928 PolarHBondContact O-N 3.4Å; K928-K931 PolarHBondContact O-N 3.48Å; K928-Q932 PolarHBondContact O-N 3.37Å
929R86.6Confident84.2Confident157 Ų157114.4 Ų114.459%0.59252%0.523SS*.Hα-helixtrans-64.2-47175-80.4-173.3-87.1-142.4-5112.1E925 E926 K931 Q932 D933E925-R929 PolarHBondContact O-N 3.21Å; E926-R929 PolarHBondContact O-N 3.31Å; E926-R929 VanDerWaalsContact O-N 3.11Å; R929-K931 VanDerWaalsContact C-N 3.32Å; R929-K931 PolarHBondContact O-N 3.48Å; R929-Q932 WeakPolarHBondContact O-CB 3.26Å; R929-Q932 PolarHBondContact O-N 3.29Å; R929-Q932 VanDerWaalsContact O-N 3.09Å; R929-D933 PolarHBondContact O-N 3.15Å
930M80Confident84.1Confident115 Ų115113.6 Ų113.657%0.56753%0.525SS*.Hα-helixtrans-60-39.7176.5-85.9-164.2-7300112.9E926 Q932 D933 Q934E926-M930 HydrophobicContact CG-CE 4.49Å; E926-M930 PolarHBondContact O-N 3.04Å; M930-Q932 VanDerWaalsContact C-N 3.32Å; M930-Q932 PolarHBondContact O-N 3.33Å; M930-D933 PolarHBondContact O-N 3.5Å; M930-Q934 WeakPolarHBondContact O-CB 3.24Å; M930-Q934 PolarHBondContact O-N 3.16Å
931K82.1Confident83.9Confident136 Ų136113.2 Ų113.259%0.59153%0.528SS*.Hα-helixtrans-62.2-39.4174.5-80.7-175.8176.8-1760112.3L927 K928 R929 Q934 V935L927-K931 WeakPolarHBondContact O-CG 3.32Å; L927-K931 PolarHBondContact O-N 3.13Å; L927-K931 VanDerWaalsContact O-N 3.1Å; K928-K931 PolarHBondContact O-N 3.48Å; R929-K931 VanDerWaalsContact C-N 3.32Å; R929-K931 PolarHBondContact O-N 3.48Å; K931-Q934 PolarHBondContact O-N 3.32Å; K931-V935 WeakPolarHBondContact O-CG2 3.45Å; K931-V935 PolarHBondContact O-N 3.29Å; K931-V935 VanDerWaalsContact O-N 3.16Å
932Q86.3Confident83.8Confident105 Ų105110.7 Ų110.749%0.49153%0.526SS..Hα-helixtrans-64.9-47.3175.7-177.363.726.700111.3K928 R929 M930 Q934 V935 E936K928-Q932 PolarHBondContact O-N 3.37Å; R929-Q932 WeakPolarHBondContact O-CB 3.26Å; R929-Q932 PolarHBondContact O-N 3.29Å; R929-Q932 VanDerWaalsContact O-N 3.09Å; M930-Q932 VanDerWaalsContact C-N 3.32Å; M930-Q932 PolarHBondContact O-N 3.33Å; Q932-Q934 VanDerWaalsContact C-N 3.29Å; Q932-Q934 PolarHBondContact O-N 3.49Å; Q932-V935 PolarHBondContact O-N 3.1Å; Q932-E936 PolarHBondContact NE2-OE1 2.84Å; Q932-E936 PolarHBondContact O-N 3.35Å
933D84.6Confident83.7Confident78 Ų78110.3 Ų110.342%0.41753%0.529SS..Hα-helixtrans-61-37.1177.5-75.96.7000112.3R929 M930 E936 R937R929-D933 PolarHBondContact O-N 3.15Å; M930-D933 PolarHBondContact O-N 3.5Å; D933-E936 PolarHBondContact O-N 3.29Å; D933-R937 WeakPolarHBondContact O-CG 3.32Å; D933-R937 PolarHBondContact O-N 3.36Å
934Q81.3Confident83.7Confident109 Ų109109.5 Ų109.551%0.50953%0.526SS..Hα-helixtrans-63.2-46.5175.4-177.7177.1-6.800111.3M930 K931 Q932 E936 R937 E938M930-Q934 WeakPolarHBondContact O-CB 3.24Å; M930-Q934 PolarHBondContact O-N 3.16Å; K931-Q934 PolarHBondContact O-N 3.32Å; Q932-Q934 VanDerWaalsContact C-N 3.29Å; Q932-Q934 PolarHBondContact O-N 3.49Å; Q934-E936 VanDerWaalsContact C-N 3.3Å; Q934-E936 PolarHBondContact O-N 3.27Å; Q934-R937 PolarHBondContact O-N 3.36Å; Q934-E938 WeakPolarHBondContact CG-OE1 3.47Å; Q934-E938 PolarHBondContact NE2-OE1 3.46Å; Q934-E938 WeakPolarHBondContact O-CG 3.14Å; Q934-E938 PolarHBondContact O-N 3.37Å
935V85.6Confident83.6Confident78 Ų78106.4 Ų106.447%0.47352%0.52SS..Hα-helixtrans-61.2-39.9176.8171.90000111.1K931 Q932 E938 T939K931-V935 WeakPolarHBondContact O-CG2 3.45Å; K931-V935 PolarHBondContact O-N 3.29Å; K931-V935 VanDerWaalsContact O-N 3.16Å; Q932-V935 PolarHBondContact O-N 3.1Å; V935-E938 PolarHBondContact O-N 3.01Å; V935-T939 WeakPolarHBondContact O-CG2 3.48Å; V935-T939 PolarHBondContact O-N 3.34Å; V935-T939 PolarHBondContact O-OG1 3.5Å
936E83.7Confident83.6Confident99 Ų99108.1 Ų108.146%0.46352%0.522SS..Hα-helixtrans-65.7-40.7175.9-72.8177.4-163.300112.2Q932 D933 Q934 T939 V940Q932-E936 PolarHBondContact NE2-OE1 2.84Å; Q932-E936 PolarHBondContact O-N 3.35Å; D933-E936 PolarHBondContact O-N 3.29Å; Q934-E936 VanDerWaalsContact C-N 3.3Å; Q934-E936 PolarHBondContact O-N 3.27Å; E936-T939 WeakPolarHBondContact CA-OG1 3.44Å; E936-T939 PolarHBondContact O-N 3.21Å; E936-T939 PolarHBondContact O-OG1 2.87Å; E936-V940 WeakPolarHBondContact O-CG2 3.12Å; E936-V940 PolarHBondContact O-N 3.35Å
937R80.8Confident83.6Confident176 Ų176108.5 Ų108.566%0.66452%0.524SS*.Hα-helixtrans-65.9-39.7175.2-72.5176.3-172.8164.96.7112.5D933 Q934 V940 L941D933-R937 WeakPolarHBondContact O-CG 3.32Å; D933-R937 PolarHBondContact O-N 3.36Å; Q934-R937 PolarHBondContact O-N 3.36Å; R937-V940 PolarHBondContact O-N 3.24Å; R937-L941 WeakPolarHBondContact O-CB 3Å; R937-L941 PolarHBondContact O-N 3.48Å
938E80.5Confident83.6Confident106 Ų106108.3 Ų108.350%0.49552%0.523SS..Hα-helixtrans-64.7-39.8176.7-75.8174.4-168.500111.8Q934 V935 L941 A942Q934-E938 WeakPolarHBondContact CG-OE1 3.47Å; Q934-E938 PolarHBondContact NE2-OE1 3.46Å; Q934-E938 WeakPolarHBondContact O-CG 3.14Å; Q934-E938 PolarHBondContact O-N 3.37Å; V935-E938 PolarHBondContact O-N 3.01Å; E938-L941 PolarHBondContact O-N 3.43Å; E938-A942 WeakPolarHBondContact O-CB 3.4Å; E938-A942 PolarHBondContact O-N 3.18Å
939T84.7Confident83.4Confident82 Ų82106.1 Ų106.150%0.50352%0.518SS..Hα-helixtrans-66.3-41.9175.253.80000112.4V935 E936 L941 A942 E943V935-T939 WeakPolarHBondContact O-CG2 3.48Å; V935-T939 PolarHBondContact O-N 3.34Å; V935-T939 PolarHBondContact O-OG1 3.5Å; E936-T939 WeakPolarHBondContact CA-OG1 3.44Å; E936-T939 PolarHBondContact O-N 3.21Å; E936-T939 PolarHBondContact O-OG1 2.87Å; T939-L941 PolarHBondContact O-N 3.46Å; T939-A942 PolarHBondContact O-N 3.49Å; T939-E943 PolarHBondContact O-N 3.31Å
940V84.9Confident83.4Confident83 Ų83104.4 Ų104.450%0.50352%0.515SS..Hα-helixtrans-63.1-41174.4172.30000111.8E936 R937 E943 N944E936-V940 WeakPolarHBondContact O-CG2 3.12Å; E936-V940 PolarHBondContact O-N 3.35Å; R937-V940 PolarHBondContact O-N 3.24Å; V940-E943 PolarHBondContact O-N 3.32Å; V940-N944 WeakPolarHBondContact O-CB 3.34Å; V940-N944 PolarHBondContact O-N 3.47Å
941L77.9Confident83.5Confident106 Ų106103.6 Ų103.656%0.55551%0.512SS*.Hα-helixtrans-62.9-41.5174.8-90.8159000112.2R937 E938 T939 N945R937-L941 WeakPolarHBondContact O-CB 3Å; R937-L941 PolarHBondContact O-N 3.48Å; E938-L941 PolarHBondContact O-N 3.43Å; T939-L941 PolarHBondContact O-N 3.46Å; L941-N945 WeakPolarHBondContact O-CB 3.48Å; L941-N945 PolarHBondContact O-N 3.27Å; L941-N945 PolarHBondContact O-ND2 3.29Å
942A83.8Confident83.8Confident60 Ų60104.9 Ų104.950%0.49651%0.514SS..Hα-helixtrans-64.2-40.4176.300000112.1E938 T939 N945 R946E938-A942 WeakPolarHBondContact O-CB 3.4Å; E938-A942 PolarHBondContact O-N 3.18Å; T939-A942 PolarHBondContact O-N 3.49Å; A942-N945 PolarHBondContact O-N 3.11Å; A942-R946 PolarHBondContact O-N 3.44Å
943E85.4Confident83.8Confident107 Ų107102.7 Ų102.750%0.551%0.51SS..Hα-helixtrans-66.8-45.3176.8-173.4129-12800112.1T939 V940 N945 R946 E947T939-E943 PolarHBondContact O-N 3.31Å; V940-E943 PolarHBondContact O-N 3.32Å; E943-N945 VanDerWaalsContact C-N 3.31Å; E943-N945 PolarHBondContact O-N 3.2Å; E943-R946 WeakPolarHBondContact O-CB 3.49Å; E943-R946 PolarHBondContact O-N 3.05Å; E943-R946 VanDerWaalsContact O-N 3.08Å; E943-R946 IonicContact OE1-CZ 3.45Å; E943-R946 IonicContact OE1-NH2 2.82Å; E943-R946 PolarHBondContact OE1-NH2 3.41Å; E943-E947 PolarHBondContact O-N 3.15Å
944N82.8Confident83.9Confident81 Ų81103.7 Ų103.743%0.43351%0.514SS..Hα-helixtrans-59.6-40.4174.8-78.5-17.8000112.1V940 R946 E947 L948V940-N944 WeakPolarHBondContact O-CB 3.34Å; V940-N944 PolarHBondContact O-N 3.47Å; N944-R946 VanDerWaalsContact C-N 3.33Å; N944-R946 PolarHBondContact O-N 3.49Å; N944-E947 PolarHBondContact O-N 3.42Å; N944-L948 WeakPolarHBondContact O-CB 3.38Å; N944-L948 PolarHBondContact O-N 2.78Å
945N82.4Confident84Confident94 Ų94104.3 Ų104.350%0.50352%0.517SS..Hα-helixtrans-63.7-38.4174.8-81.1-29.7000112.1L941 A942 E943 L948 L949L941-N945 WeakPolarHBondContact O-CB 3.48Å; L941-N945 PolarHBondContact O-N 3.27Å; L941-N945 PolarHBondContact O-ND2 3.29Å; A942-N945 PolarHBondContact O-N 3.11Å; E943-N945 VanDerWaalsContact C-N 3.31Å; E943-N945 PolarHBondContact O-N 3.2Å; N945-L948 PolarHBondContact O-N 3.37Å; N945-L949 WeakPolarHBondContact O-CG 3.08Å; N945-L949 PolarHBondContact O-N 3.34Å; N945-L949 VanDerWaalsContact O-N 3.08Å
946R86.8Confident84Confident138 Ų138107.8 Ų107.852%0.52153%0.526SS..Hα-helixtrans-64.6-39.5174.7-170.1178.471.7160.1-3.9111.8A942 E943 N944 L949 K950A942-R946 PolarHBondContact O-N 3.44Å; E943-R946 WeakPolarHBondContact O-CB 3.49Å; E943-R946 PolarHBondContact O-N 3.05Å; E943-R946 VanDerWaalsContact O-N 3.08Å; E943-R946 IonicContact OE1-CZ 3.45Å; E943-R946 IonicContact OE1-NH2 2.82Å; E943-R946 PolarHBondContact OE1-NH2 3.41Å; N944-R946 VanDerWaalsContact C-N 3.33Å; N944-R946 PolarHBondContact O-N 3.49Å; R946-L949 PolarHBondContact O-N 3.2Å; R946-K950 PolarHBondContact O-N 2.87Å
947E86.6Confident84.1Confident113 Ų113108.6 Ų108.653%0.52853%0.529SS..Hα-helixtrans-70-41.4177.2-168.8167.7-165.100112.2E943 N944 L949 K950 L951E943-E947 PolarHBondContact O-N 3.15Å; N944-E947 PolarHBondContact O-N 3.42Å; E947-L949 VanDerWaalsContact C-N 3.3Å; E947-L949 PolarHBondContact O-N 3.22Å; E947-K950 WeakPolarHBondContact O-CB 3.42Å; E947-K950 PolarHBondContact O-N 3.25Å; E947-K950 VanDerWaalsContact O-N 3.11Å; E947-L951 WeakPolarHBondContact O-CG 3.34Å; E947-L951 PolarHBondContact O-N 3.31Å
948L80Confident84.2Confident89 Ų89106.6 Ų106.647%0.46652%0.523SS..Hα-helixtrans-57.4-40.8172.2-97158.3000112.5N944 N945 L951 R952N944-L948 WeakPolarHBondContact O-CB 3.38Å; N944-L948 PolarHBondContact O-N 2.78Å; N945-L948 PolarHBondContact O-N 3.37Å; L948-L951 PolarHBondContact O-N 3.38Å; L948-R952 WeakPolarHBondContact O-CG 3.24Å; L948-R952 PolarHBondContact O-N 3.24Å
949L84.8Confident84.4Confident116 Ų116106.3 Ų106.361%0.60752%0.522SS*.Hα-helixtrans-65.3-39.1175.2-75.4170.5000112.3N945 R946 E947 R952 S953N945-L949 WeakPolarHBondContact O-CG 3.08Å; N945-L949 PolarHBondContact O-N 3.34Å; N945-L949 VanDerWaalsContact O-N 3.08Å; R946-L949 PolarHBondContact O-N 3.2Å; E947-L949 VanDerWaalsContact C-N 3.3Å; E947-L949 PolarHBondContact O-N 3.22Å; L949-R952 PolarHBondContact O-N 3.14Å; L949-S953 PolarHBondContact O-N 3.31Å; L949-S953 VanDerWaalsContact O-N 3.09Å
950K86.4Confident84.3Confident122 Ų122108.5 Ų108.553%0.5353%0.526SS..Hα-helixtrans-63.2-45.8173.8-72178.4-179.3179.60111.6R946 E947 R952 S953 I954R946-K950 PolarHBondContact O-N 2.87Å; E947-K950 WeakPolarHBondContact O-CB 3.42Å; E947-K950 PolarHBondContact O-N 3.25Å; E947-K950 VanDerWaalsContact O-N 3.11Å; K950-R952 VanDerWaalsContact C-N 3.33Å; K950-R952 PolarHBondContact O-N 3.47Å; K950-S953 WeakPolarHBondContact O-CB 3.5Å; K950-S953 PolarHBondContact O-N 3.31Å; K950-S953 VanDerWaalsContact O-N 3.12Å; K950-I954 WeakPolarHBondContact O-CG1 3.27Å; K950-I954 PolarHBondContact O-N 3.21Å
951L82.7Confident84.2Confident98 Ų98109.9 Ų109.951%0.51353%0.526SS..Hα-helixtrans-62.2-39.8178-70.2173.4000111.9E947 L948 S953 I954 E955E947-L951 WeakPolarHBondContact O-CG 3.34Å; E947-L951 PolarHBondContact O-N 3.31Å; L948-L951 PolarHBondContact O-N 3.38Å; L951-S953 VanDerWaalsContact C-N 3.32Å; L951-S953 PolarHBondContact O-N 3.42Å; L951-I954 PolarHBondContact O-N 3.47Å; L951-E955 WeakPolarHBondContact O-CB 3.36Å; L951-E955 PolarHBondContact O-N 3.16Å
952R87.8Confident84.2Confident163 Ų163108 Ų10862%0.61551%0.514SS*.Hα-helixtrans-63.6-34.5173.2-76.5-175.6-173.4-179.93.8113.2L948 L949 K950 K956L948-R952 WeakPolarHBondContact O-CG 3.24Å; L948-R952 PolarHBondContact O-N 3.24Å; L949-R952 PolarHBondContact O-N 3.14Å; K950-R952 VanDerWaalsContact C-N 3.33Å; K950-R952 PolarHBondContact O-N 3.47Å; R952-K956 WeakPolarHBondContact O-CG 3.48Å; R952-K956 PolarHBondContact O-N 3.27Å; R952-K956 VanDerWaalsContact O-N 3.13Å
953S87Confident83.8Confident58 Ų58111.5 Ų111.541%0.40652%0.52SS..Hα-helixtrans-65.5-47.7173.9-165.40000110.9L949 K950 L951 E955 K956 E957L949-S953 PolarHBondContact O-N 3.31Å; L949-S953 VanDerWaalsContact O-N 3.09Å; K950-S953 WeakPolarHBondContact O-CB 3.5Å; K950-S953 PolarHBondContact O-N 3.31Å; K950-S953 VanDerWaalsContact O-N 3.12Å; L951-S953 VanDerWaalsContact C-N 3.32Å; L951-S953 PolarHBondContact O-N 3.42Å; S953-E955 VanDerWaalsContact C-N 3.31Å; S953-E955 PolarHBondContact O-N 2.92Å; S953-K956 WeakPolarHBondContact O-CB 3.43Å; S953-K956 PolarHBondContact O-N 2.93Å; S953-E957 WeakPolarHBondContact O-CG 3.37Å; S953-E957 PolarHBondContact O-N 3.12Å; S953-E957 PolarHBondContact OG-OE1 3.45Å
954I85.3Confident83.4Confident100 Ų100111.8 Ų111.851%0.51352%0.521SS..Hα-helixtrans-62.8-39.3179.2-65.7166.6000111K950 L951 E957 Y958K950-I954 WeakPolarHBondContact O-CG1 3.27Å; K950-I954 PolarHBondContact O-N 3.21Å; L951-I954 PolarHBondContact O-N 3.47Å; I954-E957 PolarHBondContact O-N 3.04Å; I954-Y958 WeakPolarHBondContact O-CB 3.44Å; I954-Y958 PolarHBondContact O-N 3.08Å
955E83.9Confident82.9Confident122 Ų122111.5 Ų111.557%0.5752%0.519SS*.Hα-helixtrans-66.2-39.2177.3-172.7161.5-143.300112.1L951 S953 Y958 Q959L951-E955 WeakPolarHBondContact O-CB 3.36Å; L951-E955 PolarHBondContact O-N 3.16Å; S953-E955 VanDerWaalsContact C-N 3.31Å; S953-E955 PolarHBondContact O-N 2.92Å; E955-Y958 PolarHBondContact O-N 3.09Å; E955-Q959 WeakPolarHBondContact O-CG 3.36Å; E955-Q959 PolarHBondContact O-N 3.2Å
956K85.9Confident82.4Confident150 Ų150115.2 Ų115.265%0.65253%0.527SS*.Hα-helixtrans-62.7-47.1171.4-78-176.2176.9-173.90111.8R952 S953 Y958 Q959 E960R952-K956 WeakPolarHBondContact O-CG 3.48Å; R952-K956 PolarHBondContact O-N 3.27Å; R952-K956 VanDerWaalsContact O-N 3.13Å; S953-K956 WeakPolarHBondContact O-CB 3.43Å; S953-K956 PolarHBondContact O-N 2.93Å; K956-Y958 VanDerWaalsContact C-N 3.28Å; K956-Y958 PolarHBondContact O-N 3.37Å; K956-Q959 PolarHBondContact O-N 3.05Å; K956-E960 WeakPolarHBondContact O-CB 3.37Å; K956-E960 PolarHBondContact O-N 3.49Å
957E85Confident81.6Confident116 Ų116112.7 Ų112.754%0.54254%0.535SS..Hα-helixtrans-58.8-39.9176.4-73.4168.3-149.100111.8S953 I954 E960 F961S953-E957 WeakPolarHBondContact O-CG 3.37Å; S953-E957 PolarHBondContact O-N 3.12Å; S953-E957 PolarHBondContact OG-OE1 3.45Å; I954-E957 PolarHBondContact O-N 3.04Å; E957-E960 PolarHBondContact O-N 2.76Å; E957-F961 WeakPolarHBondContact O-CB 3.45Å; E957-F961 PolarHBondContact O-N 3.35Å
958Y84.4Confident80.7Confident134 Ų134113.5 Ų113.553%0.52554%0.544SS..Hα-helixtrans-67.3-42.3176.7-178.2-103000112.7I954 E955 K956 E960 F961 Q962I954-Y958 WeakPolarHBondContact O-CB 3.44Å; I954-Y958 PolarHBondContact O-N 3.08Å; E955-Y958 PolarHBondContact O-N 3.09Å; K956-Y958 VanDerWaalsContact C-N 3.28Å; K956-Y958 PolarHBondContact O-N 3.37Å; Y958-E960 VanDerWaalsContact C-N 3.33Å; Y958-F961 PolarHBondContact O-N 3.05Å; Y958-Q962 HydrophobicContact CD1-CG 4.36Å; Y958-Q962 VanDerWaalsContact CE1-CD 3.47Å; Y958-Q962 HydrophobicContact CE1-CG 3.92Å; Y958-Q962 WeakPolarHBondContact O-CG 3.42Å; Y958-Q962 PolarHBondContact O-N 3.46Å; Y958-Q962 PolarHBondContact OH-NE2 3.05Å; Y958-Q962 VanDerWaalsContact OH-NE2 3.11Å
959Q84.2Confident79.4Confident101 Ų101112.1 Ų112.147%0.47254%0.541SS..Hα-helixtrans-62.7-42.2174.4-74.3-176.31.200111.2E955 K956 F961 Q962 H963E955-Q959 WeakPolarHBondContact O-CG 3.36Å; E955-Q959 PolarHBondContact O-N 3.2Å; K956-Q959 PolarHBondContact O-N 3.05Å; Q959-F961 VanDerWaalsContact C-N 3.34Å; Q959-F961 PolarHBondContact O-N 3.28Å; Q959-Q962 WeakPolarHBondContact O-CB 3.48Å; Q959-Q962 PolarHBondContact O-N 3.19Å; Q959-H963 PolarHBondContact O-CD2 3.09Å; Q959-H963 PolarHBondContact O-N 3.29Å
960E81.9Confident78Confident128 Ų128109.9 Ų109.960%0.59853%0.534SS*.Hα-helixtrans-65.8-38.7178.3-153.9141.5-148.400111.5K956 E957 Y958 H963 Q964K956-E960 WeakPolarHBondContact O-CB 3.37Å; K956-E960 PolarHBondContact O-N 3.49Å; E957-E960 PolarHBondContact O-N 2.76Å; Y958-E960 VanDerWaalsContact C-N 3.33Å; E960-H963 PolarHBondContact O-N 3.25Å; E960-Q964 WeakPolarHBondContact O-CG 3.46Å; E960-Q964 PolarHBondContact O-N 2.87Å
961F84.2Confident76.5Confident112 Ų112108.5 Ų108.549%0.49154%0.537SS..Hα-helixtrans-63.2-43.8170.9179.4-106.2000112.7E957 Y958 Q959 H963 Q964 I965E957-F961 WeakPolarHBondContact O-CB 3.45Å; E957-F961 PolarHBondContact O-N 3.35Å; Y958-F961 PolarHBondContact O-N 3.05Å; Q959-F961 VanDerWaalsContact C-N 3.34Å; Q959-F961 PolarHBondContact O-N 3.28Å; F961-H963 PolarHBondContact O-N 3.1Å; F961-Q964 PolarHBondContact O-N 3.4Å; F961-I965 HydrophobicContact CD1-CD1 4.06Å; F961-I965 HydrophobicContact CE1-CD1 3.37Å; F961-I965 HydrophobicContact CE1-CG1 4.19Å; F961-I965 HydrophobicContact CE2-CD1 4.29Å; F961-I965 HydrophobicContact CE2-CG1 4.43Å; F961-I965 HydrophobicContact CZ-CD1 3.52Å; F961-I965 HydrophobicContact CZ-CG1 4.13Å; F961-I965 PolarHBondContact O-N 3.28Å
962Q77.6Confident75Confident66 Ų66109.3 Ų109.331%0.30855%0.546SS..Hα-helixtrans-59.7-45.9173.9-78.2-169.8-26.600111.4Y958 Q959 Q964 I965 Y966Y958-Q962 HydrophobicContact CD1-CG 4.36Å; Y958-Q962 VanDerWaalsContact CE1-CD 3.47Å; Y958-Q962 HydrophobicContact CE1-CG 3.92Å; Y958-Q962 WeakPolarHBondContact O-CG 3.42Å; Y958-Q962 PolarHBondContact O-N 3.46Å; Y958-Q962 PolarHBondContact OH-NE2 3.05Å; Y958-Q962 VanDerWaalsContact OH-NE2 3.11Å; Q959-Q962 WeakPolarHBondContact O-CB 3.48Å; Q959-Q962 PolarHBondContact O-N 3.19Å; Q962-Q964 VanDerWaalsContact C-N 3.31Å; Q962-Q964 PolarHBondContact O-N 3.23Å; Q962-I965 PolarHBondContact O-N 3.41Å; Q962-Y966 HydrophobicContact CB-CD2 4.44Å; Q962-Y966 HydrophobicContact CB-CE2 4.26Å; Q962-Y966 WeakPolarHBondContact O-CD2 3.49Å; Q962-Y966 PolarHBondContact O-N 3.46Å
963H75.3Confident73.1Confident134 Ų134106.7 Ų106.762%0.6255%0.552SS**Hα-helixtrans-59.6-40.8176.2-78.9-63.9000112.1Q959 E960 F961 Y966 A967Q959-H963 PolarHBondContact O-CD2 3.09Å; Q959-H963 PolarHBondContact O-N 3.29Å; E960-H963 PolarHBondContact O-N 3.25Å; F961-H963 PolarHBondContact O-N 3.1Å; H963-Y966 PolarHBondContact O-N 3.47Å; H963-A967 VanDerWaalsContact O-CB 3.26Å; H963-A967 WeakPolarHBondContact O-CB 3.21Å; H963-A967 PolarHBondContact O-N 3.13Å
964Q76.4Confident71.3Confident113 Ų113108.7 Ų108.753%0.52856%0.563SS.*Hα-helixtrans-64.7-41.2174.4-74.9178.513.800112.8E960 F961 Q962 A967 N968E960-Q964 WeakPolarHBondContact O-CG 3.46Å; E960-Q964 PolarHBondContact O-N 2.87Å; F961-Q964 PolarHBondContact O-N 3.4Å; Q962-Q964 VanDerWaalsContact C-N 3.31Å; Q962-Q964 PolarHBondContact O-N 3.23Å; Q964-A967 PolarHBondContact O-N 3.19Å; Q964-N968 VanDerWaalsContact O-CB 3.3Å; Q964-N968 WeakPolarHBondContact O-CB 3.39Å; Q964-N968 PolarHBondContact O-N 3.43Å; Q964-N968 PolarHBondContact O-ND2 3.19Å; Q964-N968 VanDerWaalsContact O-ND2 3.15Å
965I73.1Confident69.7Low75 Ų75109.8 Ų109.839%0.38557%0.565SS.*Hα-helixtrans-61.3-47.4175.1-72.9-173.6000110.2F961 Q962 N968 S969F961-I965 HydrophobicContact CD1-CD1 4.06Å; F961-I965 HydrophobicContact CE1-CD1 3.37Å; F961-I965 HydrophobicContact CE1-CG1 4.19Å; F961-I965 HydrophobicContact CE2-CD1 4.29Å; F961-I965 HydrophobicContact CE2-CG1 4.43Å; F961-I965 HydrophobicContact CZ-CD1 3.52Å; F961-I965 HydrophobicContact CZ-CG1 4.13Å; F961-I965 PolarHBondContact O-N 3.28Å; Q962-I965 PolarHBondContact O-N 3.41Å; I965-N968 PolarHBondContact O-N 3.35Å; I965-S969 WeakPolarHBondContact O-CB 3.39Å; I965-S969 PolarHBondContact O-N 3.2Å; I965-S969 PolarHBondContact O-OG 3.44Å
966Y70.4Confident67.8Low171 Ų171108.3 Ų108.367%0.67156%0.561SS**Hα-helixtrans-68.1-35.8-178.6-70.3-56.7000112.8Q962 H963Q962-Y966 HydrophobicContact CB-CD2 4.44Å; Q962-Y966 HydrophobicContact CB-CE2 4.26Å; Q962-Y966 WeakPolarHBondContact O-CD2 3.49Å; Q962-Y966 PolarHBondContact O-N 3.46Å; H963-Y966 PolarHBondContact O-N 3.47Å
967A71.3Confident66.4Low85 Ų85104.6 Ų104.670%0.70255%0.552SS**Hα-helixtrans-71-35.7177.100000112.9H963 Q964H963-A967 VanDerWaalsContact O-CB 3.26Å; H963-A967 WeakPolarHBondContact O-CB 3.21Å; H963-A967 PolarHBondContact O-N 3.13Å; Q964-A967 PolarHBondContact O-N 3.19Å
968N68.3Low65Low131 Ų131107.7 Ų107.770%0.70156%0.564SS**Hα-helixtrans-92.7-8.7-178.3-66.3-36.8000114Q964 I965 P970Q964-N968 VanDerWaalsContact O-CB 3.3Å; Q964-N968 WeakPolarHBondContact O-CB 3.39Å; Q964-N968 PolarHBondContact O-N 3.43Å; Q964-N968 PolarHBondContact O-ND2 3.19Å; Q964-N968 VanDerWaalsContact O-ND2 3.15Å; I965-N968 PolarHBondContact O-N 3.35Å; N968-P970 WeakPolarHBondContact O-CD 3.34Å
969S52.4Low63.7Low59 Ų59107.9 Ų107.941%0.41357%0.57SS.*SBendtrans-86.4120.9179.6-66.50000110.7I965I965-S969 WeakPolarHBondContact O-CB 3.39Å; I965-S969 PolarHBondContact O-N 3.2Å; I965-S969 PolarHBondContact O-OG 3.44Å
970P54Low62Low69 Ų69107 Ų10745%0.44857%0.568SS.*PPolyproline II helixtrans-55144172.4-20.327.9000110.6N968 V972 Q975N968-P970 WeakPolarHBondContact O-CD 3.34Å; P970-V972 PolarHBondContact O-N 3.35Å; P970-Q975 HydrophobicContact CB-CG 4.48Å; P970-Q975 PolarHBondContact O-NE2 3.22Å
971P55.7Low60.5Low93 Ų93107.7 Ų107.760%0.60457%0.57SS**PPolyproline II helixtrans-49.3134.4-180-15.720.1000110.4S973 T974P971-S973 PolarHBondContact O-N 3.09Å; P971-T974 PolarHBondContact O-N 3.42Å; P971-T974 PolarHBondContact O-OG1 3.26Å
972V50.7Low59Low115 Ų115108.9 Ų108.970%0.69758%0.577SS**Hα-helixtrans-50.4-27.5-178174.20000112.3P970 T974 Q975 L976P970-V972 PolarHBondContact O-N 3.35Å; V972-T974 VanDerWaalsContact C-N 3.27Å; V972-T974 PolarHBondContact O-N 3Å; V972-Q975 PolarHBondContact O-N 3.05Å; V972-L976 HydrophobicContact CG1-CD1 4.41Å
973S48.9Very low57.7Low108 Ų108113.4 Ų113.476%0.75560%0.596SS**Hα-helixtrans-64.7-22.6176.6-146.90000114.9P971P971-S973 PolarHBondContact O-N 3.09Å
974T49.6Very low56.5Low101 Ų101112.1 Ų112.162%0.6260%0.597SS**Hα-helixtrans-94.2-7.9177.357.60000113.7P971 V972P971-T974 PolarHBondContact O-N 3.42Å; P971-T974 PolarHBondContact O-OG1 3.26Å; V972-T974 VanDerWaalsContact C-N 3.27Å; V972-T974 PolarHBondContact O-N 3Å
975Q51.3Low55Low122 Ų122112 Ų11257%0.5761%0.605SS**Hα-helixtrans-101-10.6-178.7-66.1-173.432.900114P970 V972 P977P970-Q975 HydrophobicContact CB-CG 4.48Å; P970-Q975 PolarHBondContact O-NE2 3.22Å; V972-Q975 PolarHBondContact O-N 3.05Å; Q975-P977 VanDerWaalsContact O-CD 3.32Å; Q975-P977 WeakPolarHBondContact O-CD 3.39Å
976L44.1Very low53.3Low92 Ų92116.3 Ų116.348%0.48262%0.623SS.*SBendtrans-80.4118.8177.1-75.3163.2000109.9V972 K978 I980V972-L976 HydrophobicContact CG1-CD1 4.41Å; L976-K978 PolarHBondContact O-N 3.46Å; L976-I980 HydrophobicContact CD2-CD1 4.19Å; L976-I980 HydrophobicContact CD2-CG2 4.45Å
977P55Low51.6Low72 Ų72113.7 Ų113.747%0.46863%0.625SS.*  trans-55.3137.7173.3-22.433.1000110.2Q975 E979 I980Q975-P977 VanDerWaalsContact O-CD 3.32Å; Q975-P977 WeakPolarHBondContact O-CD 3.39Å; P977-E979 PolarHBondContact O-N 3.07Å; P977-I980 PolarHBondContact O-N 3.35Å
978K57.3Low49.9Very low180 Ų180115.1 Ų115.178%0.78363%0.627SS**Hα-helixtrans-50-30.3-175.6-75.8-176.5175.9-179.30113.6L976 I980 H981 E982L976-K978 PolarHBondContact O-N 3.46Å; K978-I980 VanDerWaalsContact C-N 3.3Å; K978-I980 PolarHBondContact O-N 2.96Å; K978-H981 PolarHBondContact O-N 3.49Å; K978-H981 VanDerWaalsContact O-N 3.13Å; K978-E982 PolarHBondContact O-N 3.42Å
979E55.8Low48.4Very low139 Ų139118.2 Ų118.265%0.6563%0.634SS**Hα-helixtrans-63.1-29.3178.4-70.3156166.200114.1P977 K983P977-E979 PolarHBondContact O-N 3.07Å; E979-K983 WeakPolarHBondContact O-CB 3.35Å; E979-K983 WeakPolarHBondContact O-CG 3.47Å; E979-K983 PolarHBondContact O-N 3.49Å; E979-K983 VanDerWaalsContact O-N 3.14Å
980I49.8Very low47.6Very low83 Ų83119 Ų11943%0.42664%0.639SS.*Hα-helixtrans-76.4-37175.3-57.2-177.1000109.7L976 P977 K978 K983 V984L976-I980 HydrophobicContact CD2-CD1 4.19Å; L976-I980 HydrophobicContact CD2-CG2 4.45Å; P977-I980 PolarHBondContact O-N 3.35Å; K978-I980 VanDerWaalsContact C-N 3.3Å; K978-I980 PolarHBondContact O-N 2.96Å; I980-K983 PolarHBondContact O-N 3.24Å; I980-V984 HydrophobicContact CG2-CG2 4.23Å; I980-V984 WeakPolarHBondContact O-CB 3.36Å; I980-V984 VanDerWaalsContact O-CG2 3.25Å; I980-V984 WeakPolarHBondContact O-CG2 3.42Å; I980-V984 PolarHBondContact O-N 3.12Å
981H50.3Low47.2Very low142 Ų142120.2 Ų120.266%0.65765%0.647SS**Hα-helixtrans-65.4-42.3177.9-150.542.9000111.2K978 V984 T985K978-H981 PolarHBondContact O-N 3.49Å; K978-H981 VanDerWaalsContact O-N 3.13Å; H981-V984 PolarHBondContact O-N 3.12Å; H981-T985 PolarHBondContact O-N 3.04Å; H981-T985 PolarHBondContact O-OG1 3.33Å; H981-T985 VanDerWaalsContact O-OG1 3.05Å
982E52.4Low46.5Very low137 Ų137119.2 Ų119.264%0.6465%0.647SS**Hα-helixtrans-67.5-38.4176.1-77.5-179.7167.500113.1K978 T985 Q986K978-E982 PolarHBondContact O-N 3.42Å; E982-T985 PolarHBondContact O-N 3.46Å; E982-T985 PolarHBondContact O-OG1 3.4Å; E982-Q986 PolarHBondContact O-N 2.89Å
983K50.6Low46.2Very low161 Ų161118.2 Ų118.270%0.764%0.641SS**Hα-helixtrans-71.6-30.2178.5-77.8-176.8178.7178.20113.9E979 I980 T985 Q986E979-K983 WeakPolarHBondContact O-CB 3.35Å; E979-K983 WeakPolarHBondContact O-CG 3.47Å; E979-K983 PolarHBondContact O-N 3.49Å; E979-K983 VanDerWaalsContact O-N 3.14Å; I980-K983 PolarHBondContact O-N 3.24Å; K983-T985 VanDerWaalsContact C-N 3.31Å; K983-Q986 PolarHBondContact O-N 3.19Å
984V48.5Very low46Very low106 Ų106116.3 Ų116.364%0.64263%0.628SS**Hα-helixtrans-71.2-29.6175.41720000111.2I980 H981I980-V984 HydrophobicContact CG2-CG2 4.23Å; I980-V984 WeakPolarHBondContact O-CB 3.36Å; I980-V984 VanDerWaalsContact O-CG2 3.25Å; I980-V984 WeakPolarHBondContact O-CG2 3.42Å; I980-V984 PolarHBondContact O-N 3.12Å; H981-V984 PolarHBondContact O-N 3.12Å
985T44.8Very low45.7Very low112 Ų112116.8 Ų116.869%0.68763%0.626SS**Hα-helixtrans-81.1-9.1173.236.40000115.3H981 E982 K983H981-T985 PolarHBondContact O-N 3.04Å; H981-T985 PolarHBondContact O-OG1 3.33Å; H981-T985 VanDerWaalsContact O-OG1 3.05Å; E982-T985 PolarHBondContact O-N 3.46Å; E982-T985 PolarHBondContact O-OG1 3.4Å; K983-T985 VanDerWaalsContact C-N 3.31Å
986Q38.7Very low45.2Very low164 Ų164119.1 Ų119.177%0.76663%0.634SS**THydrogen-bonded Turntrans-125.941.1-178.7-67.2-16414.200114.3E982 K983 P988E982-Q986 PolarHBondContact O-N 2.89Å; K983-Q986 PolarHBondContact O-N 3.19Å; Q986-P988 VanDerWaalsContact O-CD 3.24Å; Q986-P988 WeakPolarHBondContact O-CD 3.47Å
987T33.1Very low45.1Very low117 Ų117120 Ų12072%0.71864%0.639SS**  trans-87.6108161-6.70000109.4K989T987-K989 PolarHBondContact O-N 2.72Å
988P36.5Very low44.5Very low114 Ų114122.2 Ų122.274%0.7465%0.647SS**  trans-67.2128.4-177.427-32.5000109.6Q986 S990Q986-P988 VanDerWaalsContact O-CD 3.24Å; Q986-P988 WeakPolarHBondContact O-CD 3.47Å; P988-S990 PolarHBondContact O-N 3.4Å
989K37.4Very low43.9Very low197 Ų197119.3 Ų119.386%0.85764%0.64SS**  trans-52.9106.2172.1-66.8177.4-179.9176.70108.2T987 P991T987-K989 PolarHBondContact O-N 2.72Å; K989-P991 WeakPolarHBondContact O-CD 3.42Å
990S34.4Very low42.9Very low74 Ų74119.2 Ų119.252%0.51764%0.643SS.*  trans-60.9121-179.847.90000109.4P988 A992 V993P988-S990 PolarHBondContact O-N 3.4Å; S990-A992 PolarHBondContact O-N 3.22Å; S990-V993 PolarHBondContact O-N 2.97Å
991P46.2Very low42.6Very low95 Ų95120.7 Ų120.762%0.61766%0.656SS**Hα-helixtrans-60.1-10.2-176.7-25.734.4000115.1K989 V993 L995K989-P991 WeakPolarHBondContact O-CD 3.42Å; P991-V993 VanDerWaalsContact C-N 3.29Å; P991-V993 PolarHBondContact O-N 3.39Å; P991-L995 PolarHBondContact O-N 3.01Å
992A41.4Very low41.9Very low73 Ų73117 Ų11760%0.60366%0.656SS**Hα-helixtrans-69.8-21.3-179.600000114S990S990-A992 PolarHBondContact O-N 3.22Å
993V43.7Very low41.1Very low93 Ų93121.3 Ų121.356%0.56467%0.667SS**Hα-helixtrans-90.4-34.7177.1-174.30000111.4S990 P991 K996 L997S990-V993 PolarHBondContact O-N 2.97Å; P991-V993 VanDerWaalsContact C-N 3.29Å; P991-V993 PolarHBondContact O-N 3.39Å; V993-K996 PolarHBondContact O-N 3.36Å; V993-L997 PolarHBondContact O-N 2.79Å
994S44.2Very low40.4Very low69 Ų69119.5 Ų119.548%0.48367%0.669SS.*Hα-helixtrans-69.1-39.1177.9-53.10000112.7K996 L997 D998S994-K996 VanDerWaalsContact C-N 3.27Å; S994-K996 PolarHBondContact O-N 3.08Å; S994-L997 PolarHBondContact O-N 3.18Å; S994-D998 PolarHBondContact O-N 3.36Å
995L43Very low39.5Very low110 Ų110124 Ų12458%0.57668%0.68SS**Hα-helixtrans-69.7-19.1178.1-84.5162.6000114.3P991 N999P991-L995 PolarHBondContact O-N 3.01Å; L995-N999 WeakPolarHBondContact O-CB 3.37Å; L995-N999 PolarHBondContact O-ND2 3.4Å
996K41.9Very low38.9Very low171 Ų171124.7 Ų124.774%0.74369%0.685SS**Hα-helixtrans-85.2-21.5173.6-94-176.3175.3178.80113.3V993 S994V993-K996 PolarHBondContact O-N 3.36Å; S994-K996 VanDerWaalsContact C-N 3.27Å; S994-K996 PolarHBondContact O-N 3.08Å
997L41.2Very low38.4Very low110 Ų110124.9 Ų124.958%0.57669%0.686SS**Hα-helixtrans-87.6-37.2174.8-86.9153.9000111.9V993 S994 L1000 V1001V993-L997 PolarHBondContact O-N 2.79Å; S994-L997 PolarHBondContact O-N 3.18Å; L997-L1000 PolarHBondContact O-N 3.26Å; L997-V1001 PolarHBondContact O-N 3.33Å
998D43.6Very low38.2Very low119 Ų119129.5 Ų129.564%0.63670%0.696SS**Hα-helixtrans-71.2-33.2177.7-76.4-20.6000113.1S994 L1000 V1001 G1002S994-D998 PolarHBondContact O-N 3.36Å; D998-L1000 PolarHBondContact O-N 3.16Å; D998-V1001 PolarHBondContact O-N 3.44Å; D998-G1002 PolarHBondContact O-N 3.35Å; D998-G1002 VanDerWaalsContact O-N 3.15Å
999N44.3Very low37.7Very low119 Ų119133.7 Ų133.764%0.63670%0.702SS**Hα-helixtrans-73.1-15174.6-78.5-46.2000113.9L995L995-N999 WeakPolarHBondContact O-CB 3.37Å; L995-N999 PolarHBondContact O-ND2 3.4Å
1000L35.8Very low37.4Very low137 Ų137130.2 Ų130.272%0.71770%0.698SS**Hα-helixtrans-93.7-18.1178-14379.4000113.1L997 D998L997-L1000 PolarHBondContact O-N 3.26Å; D998-L1000 PolarHBondContact O-N 3.16Å
1001V41.7Very low37.1Very low114 Ų114132.6 Ų132.669%0.69171%0.714SS**Hα-helixtrans-97.4-26.5175.8179.60000111.9L997 D998 R1003L997-V1001 PolarHBondContact O-N 3.33Å; D998-V1001 PolarHBondContact O-N 3.44Å; V1001-R1003 PolarHBondContact O-N 3.08Å
1002G37.1Very low36.6Very low65 Ų65133.2 Ų133.267%0.6772%0.719SS**THydrogen-bonded Turntrans-79-9.3-176.300000117.3D998D998-G1002 PolarHBondContact O-N 3.35Å; D998-G1002 VanDerWaalsContact O-N 3.15Å
1003R35.4Very low35.9Very low227 Ų227137.8 Ų137.886%0.85773%0.728SS**THydrogen-bonded Turntrans-119.27.2-171.8-116.9179.9-178.4169.11116.9V1001V1001-R1003 PolarHBondContact O-N 3.08Å
1004T35.2Very low35Very low124 Ų124140.2 Ų140.276%0.76174%0.737SS**SBendtrans-109.95.1178.5-31.30000113.6
1005F31Very low34.2Very low199 Ų199145.5 Ų145.587%0.87376%0.756SS**SBendtrans-111.66.4179.3-136.2-96.4000115.9
1006V30.6Very low33.6Very low128 Ų128146 Ų14678%0.77676%0.764SS**SBendtrans-132.1116.1172.6-174.10000109
1007Q29.3Very low32.9Very low168 Ų168147 Ų14779%0.78577%0.772SS**SBendtrans87.566160.2-151.617218.500118
1008F27.4Very low32.3Very low213 Ų213148 Ų14893%0.93478%0.783SS**  trans-148.360.4143.7-94.9-74.1000111.1
1009K26.5Very low31.7Very low202 Ų202148.1 Ų148.188%0.87879%0.79SS**  trans-99.698.7145.1-105.9-177.9176.8177.20104.9
1010T31.7Very low31Very low125 Ų125149 Ų14977%0.76780%0.8SS**SBendtrans158.3123.8143.745.70000111.2
1011S27.3Very low30.9Very low123 Ų123152 Ų15286%0.8681%0.807SS**  trans75116.2151.9-99.90000120.8
1012P36.3Very low30.3Very low109 Ų109152.9 Ų152.971%0.70881%0.813SS**  trans-90.5139.9169.735.7-28.4000111.3
1013Q25.9Very low29.9Very low169 Ų169154.2 Ų154.279%0.7981%0.809SS**  trans163.9130.6133.1-92.4167-0.900110.9
1014N26.6Very low29.8Very low143 Ų143153.7 Ų153.777%0.76581%0.814SS**  trans62103.4148.7-56.1-15.3000118.2
1015M27.1Very low29.6Very low180 Ų180152.3 Ų152.389%0.88781%0.809SS**  trans-154.799.6130.9-84.6-120.5-92.900110.1
1016T28.8Very low29.7Very low121 Ų121150 Ų15074%0.74280%0.804SS**  trans28.6108132.744.60000119
1017E27.5Very low29.7Very low192 Ų192150.7 Ų150.790%0.89780%0.803SS**  trans-1.2119.2142.7-60.3178.7162.600118
1018T29.8Very low29.8Very low131 Ų131152.7 Ų152.780%0.80481%0.809SS**  trans-126.2123.6141.834.30000108.4
1019P29.9Very low30.2Very low122 Ų122149.8 Ų149.879%0.79280%0.798SS**  trans-89.7112.9-172.432.8-31000111.2
1020T30.6Very low30.9Very low137 Ų137146.6 Ų146.684%0.8480%0.798SS**  trans-116.364.8165.439.20000109.8
1021K32.4Very low31Very low200 Ų200144.1 Ų144.187%0.8780%0.798SS**  trans-95.198.6160.5-77.4-174.91791760108.4P1023K1021-P1023 WeakPolarHBondContact O-CD 3.36Å
1022T29Very low31.4Very low132 Ų132143.5 Ų143.581%0.8179%0.793SS**  trans-67.8115.1162.9-19.80000107.6K1024T1022-K1024 PolarHBondContact O-N 3.02Å; T1022-K1024 VanDerWaalsContact O-N 3.14Å
1023P29.7Very low31.3Very low93 Ų93142.6 Ų142.660%0.60480%0.795SS**  trans-74.9106.9-172.328.8-32000110K1021 S1025K1021-P1023 WeakPolarHBondContact O-CD 3.36Å; P1023-S1025 PolarHBondContact O-N 2.98Å
1024K33.6Very low31.8Very low217 Ų217140.8 Ų140.894%0.94380%0.795SS**  trans-75.351.7167.4-72.9-175.6175.9178.40111.4T1022T1022-K1024 PolarHBondContact O-N 3.02Å; T1022-K1024 VanDerWaalsContact O-N 3.14Å
1025S30.8Very low32.3Very low95 Ų95143 Ų14366%0.66480%0.798SS**  trans-130.441.1176.271.30000112.2P1023P1023-S1025 PolarHBondContact O-N 2.98Å
1026I32.1Very low32.6Very low149 Ų149145.4 Ų145.476%0.76480%0.797SS**SBendtrans-14366.7164.6-48.1175.7000108.6
1027L31.8Very low32.9Very low143 Ų143150.6 Ų150.675%0.74980%0.803SS**  trans-17147.1146.8-131.880.1000111.7Q1029L1027-Q1029 HydrophobicContact CG-CG 4.18Å; L1027-Q1029 PolarHBondContact O-N 3.16Å
1028K32.1Very low33.4Very low210 Ų210151.8 Ų151.891%0.91380%0.8SS**  trans-82.984.6151.4-86.1-172.5175.9-178.80105.8P1030K1028-P1030 VanDerWaalsContact O-CD 3.24Å; K1028-P1030 WeakPolarHBondContact O-CD 3.21Å
1029Q35.6Very low33.7Very low152 Ų152150.6 Ų150.671%0.7179%0.792SS**  trans-60.5117.4167.9-70.6-159.5-31.100107.8L1027 G1031L1027-Q1029 HydrophobicContact CG-CG 4.18Å; L1027-Q1029 PolarHBondContact O-N 3.16Å; Q1029-G1031 VanDerWaalsContact C-N 3.29Å; Q1029-G1031 PolarHBondContact O-N 3.27Å
1030P40Very low33.9Very low136 Ų136153.8 Ų153.888%0.88379%0.794SS**SBendtrans-78.386.3174.631.3-27.3000107.1K1028K1028-P1030 VanDerWaalsContact O-CD 3.24Å; K1028-P1030 WeakPolarHBondContact O-CD 3.21Å
1031G34.3Very low34.1Very low73 Ų73155.9 Ų155.975%0.75379%0.791SS**  trans-156.1-3-173.100000118Q1029Q1029-G1031 VanDerWaalsContact C-N 3.29Å; Q1029-G1031 PolarHBondContact O-N 3.27Å
1032S35.5Very low34.2Very low110 Ų110151 Ų15177%0.76979%0.789SS**  trans-129.515.8-175.156.50000115.5T1034S1032-T1034 PolarHBondContact O-N 3.41Å
1033A34.5Very low34.4Very low89 Ų89149.7 Ų149.774%0.73678%0.784SS**SBendtrans-9088.6157.900000107.4K1035A1033-K1035 PolarHBondContact O-N 3.27Å
1034T35.4Very low34.8Very low131 Ų131150.4 Ų150.480%0.80479%0.789SS**  trans-5383.8170.3-55.10000109.3S1032 R1036S1032-T1034 PolarHBondContact O-N 3.41Å; T1034-R1036 VanDerWaalsContact C-N 3.29Å; T1034-R1036 PolarHBondContact O-N 2.94Å
1035K36.9Very low34.8Very low190 Ų190147.9 Ų147.983%0.82679%0.786SS**  trans-64.297.2166.7-81.6-178.2176.8179.30105.5A1033 R1037A1033-K1035 PolarHBondContact O-N 3.27Å; K1035-R1037 PolarHBondContact O-N 3.27Å
1036R33.8Very low35Very low231 Ų231154 Ų15487%0.87280%0.796SS**  trans-50.194.8159-72.7-179165.3-155.6-3.7106.5T1034 R1038T1034-R1036 VanDerWaalsContact C-N 3.29Å; T1034-R1036 PolarHBondContact O-N 2.94Å; R1036-R1038 VanDerWaalsContact C-N 3.34Å; R1036-R1038 PolarHBondContact O-N 3.45Å
1037R35.1Very low35Very low230 Ų230155.6 Ų155.687%0.86880%0.8SS**  trans-58.6104.9166.5-88.3-179.8168.5-177-3.8104.8K1035 V1039K1035-R1037 PolarHBondContact O-N 3.27Å; R1037-V1039 VanDerWaalsContact C-N 3.29Å; R1037-V1039 PolarHBondContact O-N 3.21Å
1038R37.9Very low35Very low217 Ų217153.8 Ų153.882%0.81980%0.8SS**  trans-62.1102.8162-71.5-175.7-174.2-169.10.9104.9R1036 F1040R1036-R1038 VanDerWaalsContact C-N 3.34Å; R1036-R1038 PolarHBondContact O-N 3.45Å; R1038-F1040 VanDerWaalsContact C-N 3.34Å; R1038-F1040 PolarHBondContact O-N 3.17Å
1039V37Very low34.9Very low105 Ų105152.1 Ų152.164%0.63680%0.797SS**  trans-66.2103.5166.9178.10000104.3R1037 F1041R1037-V1039 VanDerWaalsContact C-N 3.29Å; R1037-V1039 PolarHBondContact O-N 3.21Å; V1039-F1041 PolarHBondContact O-N 3Å; V1039-F1041 VanDerWaalsContact O-N 3.08Å
1040F34.3Very low34.7Very low190 Ų190150 Ų15083%0.83380%0.795SS**  trans-65.7105.2169.5-77.9-88.4000106.2R1038 A1042R1038-F1040 VanDerWaalsContact C-N 3.34Å; R1038-F1040 PolarHBondContact O-N 3.17Å; F1040-A1042 PolarHBondContact O-N 3.11Å
1041F34.1Very low34.4Very low180 Ų180149.3 Ų149.379%0.78978%0.784SS**  trans-66.8115.4163.1-70.4-80.9000106.3V1039 S1043V1039-F1041 PolarHBondContact O-N 3Å; V1039-F1041 VanDerWaalsContact O-N 3.08Å; F1041-S1043 PolarHBondContact O-N 3.25Å
1042A34.1Very low34.4Very low99 Ų99152.9 Ų152.982%0.81879%0.785SS**  trans-61.8107.4167.400000107.1F1040F1040-A1042 PolarHBondContact O-N 3.11Å
1043S32.9Very low34.5Very low103 Ų103153.4 Ų153.472%0.7278%0.776SS**  trans-66.8134.7168.2-61.30000108.2F1041F1041-S1043 PolarHBondContact O-N 3.25Å
1044P39Very low34.4Very low109 Ų109157.8 Ų157.871%0.70878%0.781SS**  trans-65.4137.7-175.8-14.227.9000111.1Y1046P1044-Y1046 PolarHBondContact O-N 3.42Å
1045D33.5Very low34.1Very low164 Ų164160.5 Ų160.588%0.87778%0.784SS**  trans-51.6107.1174.3-67.9-47.9000110.8
1046Y34.5Very low34Very low224 Ų224156.9 Ų156.988%0.87878%0.78SS**  trans-93.3111.6160.5-93.7-87.9000107.6P1044P1044-Y1046 PolarHBondContact O-N 3.42Å
1047E32.4Very low33.8Very low181 Ų181149.5 Ų149.585%0.84678%0.777SS**  trans-51143.2177.6-79.2173.1140.600112.6M1049E1047-M1049 PolarHBondContact O-N 2.92Å; E1047-M1049 VanDerWaalsContact O-N 3.17Å
1048S31.7Very low33.7Very low105 Ų105149.4 Ų149.473%0.73478%0.778SS**  trans-52109.217857.20000112.8
1049M31.1Very low33.5Very low176 Ų176148.3 Ų148.387%0.86778%0.782SS**  trans-90.799.2155-76.1-152137.200108.9E1047 N1051E1047-M1049 PolarHBondContact O-N 2.92Å; E1047-M1049 VanDerWaalsContact O-N 3.17Å; M1049-N1051 PolarHBondContact O-N 3.01Å
1050V31.7Very low33.3Very low108 Ų108153 Ų15366%0.65579%0.793SS**  trans-71.9102.2166.4178.40000107.1
1051N33.1Very low33.2Very low121 Ų121151.8 Ų151.865%0.64779%0.791SS**  trans-120103.3162.4-77.9-19.8000107.6M1049 E1053M1049-N1051 PolarHBondContact O-N 3.01Å; N1051-E1053 PolarHBondContact O-N 3.39Å
1052N33.6Very low32.9Very low148 Ų148152.1 Ų152.179%0.79179%0.794SS**  trans-75.7101.2164-64.3-45.4000106.9
1053E37.7Very low32.6Very low120 Ų120155.6 Ų155.656%0.56179%0.791SS**  trans-119.5106.1159.9-77.1177.5165.500105.5R922 N1051 E1055R922-E1053 IonicContact CZ-OE1 3.99Å; R922-E1053 IonicContact CZ-OE2 2.73Å; R922-E1053 IonicContact NH1-OE1 2.69Å; R922-E1053 IonicContact NH1-OE2 3.81Å; R922-E1053 PolarHBondContact NH1-OE2 3.18Å; R922-E1053 IonicContact NH2-OE1 3.77Å; R922-E1053 PolarHBondContact NH2-OE1 3.12Å; R922-E1053 IonicContact NH2-OE2 2.83Å; N1051-E1053 PolarHBondContact O-N 3.39Å; E1053-E1055 PolarHBondContact O-N 3.37Å
1054E31.9Very low32.4Very low182 Ų182160 Ų16085%0.8580%0.801SS**  trans-69.1113173.4-74.1174.5163.600108.2
1055E29.8Very low32Very low187 Ų187163.7 Ų163.787%0.87481%0.806SS**PPolyproline II helixtrans-70.5136.7173.5-81.8-163.9157.300111.3E1053 G1057E1053-E1055 PolarHBondContact O-N 3.37Å; E1055-G1057 PolarHBondContact O-N 3.38Å
1056P34.6Very low32.2Very low114 Ų114160.7 Ų160.774%0.7480%0.795SS**PPolyproline II helixtrans-77.6122.3-178.929.5-31.1000111.7Y1058P1056-Y1058 PolarHBondContact O-N 3.47Å
1057G29.4Very low32.3Very low77 Ų77158.3 Ų158.379%0.79480%0.797SS**PPolyproline II helixtrans-63.6125.6-17900000114.6E1055 Q1059E1055-G1057 PolarHBondContact O-N 3.38Å; G1057-Q1059 PolarHBondContact O-N 3.05Å
1058Y32.6Very low32.2Very low228 Ų228158.8 Ų158.889%0.89480%0.797SS**  trans-74.7110.5168.8-83.1-96000111P1056 K1060P1056-Y1058 PolarHBondContact O-N 3.47Å; Y1058-K1060 PolarHBondContact O-N 3.42Å
1059Q33.7Very low32.3Very low193 Ų193164.8 Ų164.890%0.90280%0.803SS**  trans-74.4108.5165.9-80.2178.3-12.600109.9G1057 Q1061G1057-Q1059 PolarHBondContact O-N 3.05Å; Q1059-Q1061 PolarHBondContact O-N 3.38Å
1060K33.1Very low32.3Very low203 Ų203166.4 Ų166.488%0.88381%0.805SS**  trans-65.3110169-76.4177.1176.11750109.7Y1058Y1058-K1060 PolarHBondContact O-N 3.42Å
1061Q32.9Very low32.3Very low166 Ų166167.3 Ų167.378%0.77681%0.811SS**  trans-89.7110.5166.6-162.1166.120.800108.6Q1059 F1063Q1059-Q1061 PolarHBondContact O-N 3.38Å; Q1061-F1063 PolarHBondContact O-N 2.96Å
1062E26.8Very low32.1Very low186 Ų186166.1 Ų166.187%0.86981%0.812SS**  trans-67.5111.3178.4-66.1177162.600110
1063F28.2Very low31.9Very low172 Ų172164.7 Ų164.775%0.75481%0.811SS**  trans-93.6112.7167.4-97.8-89.3000109.7Q1061 F1065Q1061-F1063 PolarHBondContact O-N 2.96Å; F1063-F1065 PolarHBondContact O-N 3.24Å
1064E29Very low31.6Very low195 Ų195168.3 Ų168.391%0.91183%0.825SS**  trans-71.8110.3169.6-119.4179.9171.200109.4
1065F30Very low31.6Very low187 Ų187165.5 Ų165.582%0.8282%0.82SS**  trans-73.6128.3175.5-84.1-90.6000111.1F1063 L1067F1063-F1065 PolarHBondContact O-N 3.24Å; F1065-L1067 PolarHBondContact O-N 2.98Å
1066P39Very low31.6Very low101 Ų101164.9 Ų164.966%0.65682%0.82SS**  trans-67.9129.2172.2-13.127.3000110.4F1068P1066-F1068 PolarHBondContact O-N 3.04Å
1067L34.9Very low31.5Very low174 Ų174166.8 Ų166.891%0.91182%0.824SS**  trans-49.593.7174.1-102.686000112F1065 R1069F1065-L1067 PolarHBondContact O-N 2.98Å; L1067-R1069 PolarHBondContact O-N 2.9Å; L1067-R1069 VanDerWaalsContact O-N 3.08Å
1068F32Very low31.5Very low191 Ų191169.3 Ų169.384%0.83882%0.824SS**  trans-74.598.6161.9-84.9-83.4000108.9P1066 K1070P1066-F1068 PolarHBondContact O-N 3.04Å; F1068-K1070 PolarHBondContact O-N 3.05Å
1069R32.5Very low31.5Very low232 Ų232163.4 Ų163.488%0.87581%0.813SS**  trans-55.2103.6167.5-134-177.9-158179.66.3107.9L1067 V1071L1067-R1069 PolarHBondContact O-N 2.9Å; L1067-R1069 VanDerWaalsContact O-N 3.08Å; R1069-V1071 PolarHBondContact O-N 3.36Å
1070K32.1Very low31.3Very low209 Ų209164 Ų16491%0.90981%0.813SS**  trans-59.699.1172.1-72.1-177.3177.6-178.40108.9F1068 S1072F1068-K1070 PolarHBondContact O-N 3.05Å; K1070-S1072 PolarHBondContact O-N 3.21Å
1071V30.9Very low31.1Very low127 Ų127161.2 Ų161.277%0.7781%0.806SS**  trans-76116.3168-1720000106.4R1069R1069-V1071 PolarHBondContact O-N 3.36Å
1072S28.9Very low31Very low97 Ų97160.9 Ų160.968%0.67881%0.805SS**  trans-57.3134.6179.4-168.10000110K1070 F1074K1070-S1072 PolarHBondContact O-N 3.21Å; S1072-F1074 PolarHBondContact O-N 2.98Å; S1072-F1074 VanDerWaalsContact O-N 3.08Å
1073P30.4Very low31.2Very low118 Ų118159.1 Ų159.177%0.76680%0.801SS**  trans-64.2115.5-174.5-13.827.3000109.5T1075P1073-T1075 PolarHBondContact O-N 3.27Å
1074F31Very low31.3Very low195 Ų195158.8 Ų158.886%0.85581%0.807SS**  trans-54.7119.6166.6-105.8-99.4000108.5S1072 M1076S1072-F1074 PolarHBondContact O-N 2.98Å; S1072-F1074 VanDerWaalsContact O-N 3.08Å; F1074-M1076 PolarHBondContact O-N 2.89Å
1075T31.7Very low31.5Very low123 Ų123158.5 Ų158.576%0.75581%0.805SS**  trans-61.198.4171.237.90000109P1073 N1077P1073-T1075 PolarHBondContact O-N 3.27Å; T1075-N1077 PolarHBondContact O-N 3.42Å; T1075-N1077 VanDerWaalsContact O-N 3.13Å
1076M30.7Very low31.7Very low175 Ų175156.1 Ų156.186%0.86281%0.806SS**  trans-61.5110.8167.5-91.3-87.2160.300108.2F1074 T1078F1074-M1076 PolarHBondContact O-N 2.89Å; M1076-T1078 PolarHBondContact O-N 3.45Å
1077N32.5Very low31.2Very low154 Ų154159.3 Ų159.382%0.82482%0.817SS**  trans-61.9102.3174.2-71.1-48.5000109.5T1075T1075-N1077 PolarHBondContact O-N 3.42Å; T1075-N1077 VanDerWaalsContact O-N 3.13Å
1078T28.7Very low31.1Very low130 Ų130158.2 Ų158.280%0.79881%0.812SS**  trans-63.6134.2173.7-33.50000109.8M1076M1076-T1078 PolarHBondContact O-N 3.45Å
1079P32.1Very low31.1Very low103 Ų103158.6 Ų158.667%0.66981%0.813SS**  trans-73.4137.8-166.6-10.226.5000111.9I1081P1079-I1081 PolarHBondContact O-N 3.04Å
1080K29.1Very low31Very low205 Ų205154.1 Ų154.189%0.89181%0.811SS**  trans-62.593.7169-88.1178.7174.2174.10110.1Q1082K1080-Q1082 PolarHBondContact O-N 3.13Å
1081I30.1Very low31.1Very low145 Ų145149.9 Ų149.974%0.74480%0.803SS**  trans-85.7100164.9-59.2176.4000106.9P1079P1079-I1081 PolarHBondContact O-N 3.04Å
1082Q30.1Very low31Very low160 Ų160152 Ų15275%0.74881%0.81SS**  trans-66.7141.6165.7-73.9175-16.200109.2K1080K1080-Q1082 PolarHBondContact O-N 3.13Å
1083N32Very low31Very low148 Ų148155.1 Ų155.179%0.79182%0.817SS**  trans67.379.3165.6-59.5-26.8000116.9
1084L29.7Very low31Very low166 Ų166160.7 Ų160.787%0.86982%0.823SS**  trans-122.5109.3136.3-87164.8000107.8T1086L1084-T1086 PolarHBondContact O-N 3.11Å
1085Q33Very low30.9Very low188 Ų188161.5 Ų161.588%0.87983%0.827SS**  trans-43.7122.9171.4-72.1164.8-41.900109.1L1087Q1085-L1087 PolarHBondContact O-N 3.33Å
1086T34.6Very low31Very low137 Ų137162.4 Ų162.484%0.8483%0.832SS**  trans-54.1104167.734.50000108.6L1084 D1088L1084-T1086 PolarHBondContact O-N 3.11Å; T1086-D1088 PolarHBondContact O-N 3.48Å
1087L27.9Very low31.3Very low168 Ų168159.3 Ų159.388%0.8883%0.825SS**  trans-62122.4169.2-157.480.3000108Q1085 K1089Q1085-L1087 PolarHBondContact O-N 3.33Å; L1087-K1089 PolarHBondContact O-N 3.36Å
1088D33.6Very low31.2Very low152 Ų152164.1 Ų164.181%0.81383%0.832SS**  trans-46.4110.1-179.4-68.9-56.3000112.9T1086 V1090T1086-D1088 PolarHBondContact O-N 3.48Å; D1088-V1090 PolarHBondContact O-N 3.05Å
1089K32.5Very low31.4Very low198 Ų198167.5 Ų167.586%0.86184%0.835SS**  trans-84.3100.9158.5-80.6-175178.6-179.60108.4L1087 T1091L1087-K1089 PolarHBondContact O-N 3.36Å; K1089-T1091 PolarHBondContact O-N 3.34Å
1090V28.7Very low31.4Very low138 Ų138169.9 Ų169.984%0.83685%0.848SS**  trans-27.999165.7-175.50000111.9D1088D1088-V1090 PolarHBondContact O-N 3.05Å
1091T34.5Very low31.3Very low121 Ų121163.8 Ų163.874%0.74284%0.843SS**  trans-79122172.942.20000110.1K1089 I1093K1089-T1091 PolarHBondContact O-N 3.34Å; T1091-I1093 PolarHBondContact O-N 2.87Å
1092N29.2Very low31.2Very low170 Ų170168.6 Ų168.691%0.90985%0.852SS**  trans-46.6120.5169.9-93.2-36.5000111.7R1094N1092-R1094 PolarHBondContact O-N 3.1Å
1093I30.1Very low31.2Very low163 Ų163169.9 Ų169.984%0.83686%0.858SS**SBendtrans-71.5100.9-177-58.6162.2000108.6T1091T1091-I1093 PolarHBondContact O-N 2.87Å
1094R30Very low31.1Very low236 Ų236170.1 Ų170.189%0.89186%0.858SS**  trans-168.841.6152.9-110.4171.9-162.2-138.76.2114.7N1092N1092-R1094 PolarHBondContact O-N 3.1Å
1095K29Very low31.1Very low212 Ų212168.7 Ų168.792%0.92286%0.856SS**  trans-144.5110.2154.6-71.1-163.8178179.80110.2
1096T33.7Very low31Very low141 Ų141168.4 Ų168.487%0.86586%0.855SS**  trans-91.7144.8177.6-31.60000109.3
1097P36Very low30.7Very low110 Ų110170.1 Ų170.171%0.71485%0.853SS**  trans-108147.2-143.434-22.8000113.3
1098R30.5Very low30.8Very low256 Ų256168 Ų16897%0.96685%0.851SS**PPolyproline II helixtrans-95.6127.3164-78.5-168.6176.1-162.30.5110.2
1099K33.5Very low30.6Very low201 Ų201171.3 Ų171.387%0.87485%0.854SS**PPolyproline II helixtrans-64.3140.7-172.3-69.2174.3173.3178.30112.5
1100T30.8Very low30.6Very low152 Ų152170.8 Ų170.893%0.93385%0.851SS**PPolyproline II helixtrans-49.2132.1156.317.90000112.2
1101G28.6Very low30.6Very low77 Ų77173.1 Ų173.179%0.79486%0.856SS**  trans179.796172.200000113.9
1102R28.4Very low30.5Very low247 Ų247174.3 Ų174.393%0.93286%0.857SS**  trans15.7134.6161.8-89.9-179.4171.4-161.9-3122.5
1103Q28.4Very low30.9Very low186 Ų186172.1 Ų172.187%0.86985%0.85SS**  trans-43.3129.4161.7-72.1161.6-35.200114.5
1104I31Very low31.1Very low154 Ų154173.4 Ų173.479%0.7985%0.853SS**  trans-131.4111.7144.4-61-179.3000106
1105T29.3Very low31.4Very low135 Ų135171.2 Ų171.283%0.82885%0.85SS**  trans-68113.6167.426.40000109.6
1106E30.7Very low31.8Very low182 Ų182165.3 Ų165.385%0.8584%0.835SS**  trans-129.6110.7154-87.5-176.4166.700108C1108E1106-C1108 PolarHBondContact O-N 3.24Å
1107E28.3Very low32.2Very low173 Ų173169.5 Ų169.581%0.80884%0.835SS**  trans-65.1113172.5-70.4169.3148.300109.2
1108C29.6Very low32.4Very low124 Ų124173.2 Ų173.284%0.83884%0.84SS**  trans-138.799.1159.3-94.50000108.9E1106 K1110E1106-C1108 PolarHBondContact O-N 3.24Å; C1108-K1110 PolarHBondContact O-N 3.48Å
1109Y28.9Very low33Very low222 Ų222168 Ų16887%0.87183%0.832SS**  trans-42.3117.6167.7-73.1-96.6000112
1110K32.4Very low33Very low186 Ų186162.7 Ų162.781%0.80982%0.819SS**  trans-130.7117.5152.6-75.8-170.1177.1-179.80108.1C1108 D1112C1108-K1110 PolarHBondContact O-N 3.48Å; K1110-D1112 PolarHBondContact O-N 3.21Å; K1110-D1112 VanDerWaalsContact O-N 3.16Å
1111M30.1Very low33.2Very low188 Ų188164.4 Ų164.493%0.92682%0.816SS**  trans-64.2103.6169.7-79.9-177.9154.200108.4T1113M1111-T1113 PolarHBondContact O-N 3.22Å
1112D32.3Very low33.8Very low146 Ų146169.7 Ų169.778%0.78182%0.82SS**  trans-81.5101.5167.2-76.6-31.7000108.6K1110 E1114K1110-D1112 PolarHBondContact O-N 3.21Å; K1110-D1112 VanDerWaalsContact O-N 3.16Å; D1112-E1114 VanDerWaalsContact C-N 3.34Å; D1112-E1114 PolarHBondContact O-N 3.26Å
1113T36.9Very low34.4Very low124 Ų124164.6 Ų164.676%0.76181%0.81SS**  trans-67.391.8163.443.30000108.9M1111 K1115M1111-T1113 PolarHBondContact O-N 3.22Å; T1113-K1115 VanDerWaalsContact C-N 3.31Å; T1113-K1115 PolarHBondContact O-N 3.32Å
1114E35.5Very low34.7Very low190 Ų190166 Ų16689%0.88881%0.814SS**  trans-67.387168.2-73.6-177.7159.500109.7D1112D1112-E1114 VanDerWaalsContact C-N 3.34Å; D1112-E1114 PolarHBondContact O-N 3.26Å
1115K36Very low34.7Very low190 Ų190161 Ų16183%0.82680%0.8SS**  trans-83123.3161.2-78.2-175.8176.8-178.10108.5T1113T1113-K1115 VanDerWaalsContact C-N 3.31Å; T1113-K1115 PolarHBondContact O-N 3.32Å
1116S37.7Very low35Very low87 Ų87166.3 Ų166.361%0.60881%0.807SS**  trans-53.9139.9-178.1-177.20000112.8F1118 D1119S1116-F1118 PolarHBondContact O-N 3.45Å; S1116-D1119 PolarHBondContact O-N 2.96Å
1117W42.4Very low35Very low230 Ų230161.5 Ų161.587%0.87181%0.806SS**G310 helixtrans-53.2-19.1-173.7-172.3-62.9000115.3D1119W1117-D1119 VanDerWaalsContact C-N 3.33Å; W1117-D1119 PolarHBondContact O-N 3.02Å
1118F38.4Very low35.4Very low187 Ų187157.9 Ų157.982%0.8281%0.805SS**G310 helixtrans-78.5-6.7-174.1-76.8-79000115.7S1116S1116-F1118 PolarHBondContact O-N 3.45Å
1119D43.5Very low35.6Very low147 Ų147161.1 Ų161.179%0.78681%0.808SS**G310 helixtrans-97.514.7179.6-72.8-21.3000114.4S1116 W1117S1116-D1119 PolarHBondContact O-N 2.96Å; W1117-D1119 VanDerWaalsContact C-N 3.33Å; W1117-D1119 PolarHBondContact O-N 3.02Å
1120C34.1Very low35.9Very low90 Ų90162.1 Ų162.161%0.60883%0.829SS**  trans-104.835.5-176.5-69.40000115.6Q1122C1120-Q1122 PolarHBondContact O-N 3.31Å; C1120-Q1122 VanDerWaalsContact O-N 3.14Å
1121E34.7Very low36.1Very low188 Ų188160.9 Ų160.988%0.87983%0.83SS**THydrogen-bonded Turntrans-81.831173.8-107.8-177.4-172.600114.6
1122Q41.1Very low36.4Very low187 Ų187159.5 Ų159.587%0.87483%0.825SS**THydrogen-bonded Turntrans-121.530.1170.9-94.6-172.92.500113.8C1120C1120-Q1122 PolarHBondContact O-N 3.31Å; C1120-Q1122 VanDerWaalsContact O-N 3.14Å
1123I41.6Very low36.6Very low141 Ų141160.2 Ų160.272%0.72383%0.827SS**  trans-112.431.7171.2-49.2174.1000111
1124F34Very low36.6Very low215 Ų215162.4 Ų162.494%0.94383%0.831SS**SBendtrans-12236.8165.2-78.8-68.4000112.5
1125G31.5Very low36.7Very low49 Ų49160.6 Ų160.651%0.50583%0.827SS.*SBendtrans-149.9122.7168.900000110.3
1126Y35.3Very low36.7Very low247 Ų247158.7 Ų158.797%0.96983%0.827SS**  trans90.587.2173.4-56-77.8000116.3
1127G31.4Very low36.7Very low81 Ų81163.8 Ų163.884%0.83584%0.843SS**  trans-174.561.5170.400000113.4
1128A37Very low36.2Very low96 Ų96158.7 Ų158.779%0.79384%0.841SS**  trans-149.494.6157.300000104
1129E33.3Very low36Very low192 Ų192156.3 Ų156.390%0.89784%0.843SS**  43.373.274-70.3-169.8-178.900112.3
1130D35Very low35.4Very low243 Ų243157.2 Ų157.2100%1.29985%0.848SS**  175.10118.6-99.3-20000111.3

Retrieved 1,130 of 1,130 residues in 1887.6 ms (Link to these results)