A0A087Y5K3_POEFO Loading...

Cell division cycle associated 7a

AlphaFold DB , UniProt , Accession A0A087Y5K3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 401 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M44.7Very low44.1Very low229 Ų229154.9 Ų154.9100%1.12883%0.833SS**  0141.20-69.3-71.9175.700107.3
2P54.4Low43.8Very low109 Ų109158.2 Ų158.271%0.70884%0.839SS**  cis-132.8146-0.736.8-16.5000113.1
3L42.3Very low43.8Very low142 Ų142154.8 Ų154.874%0.74384%0.836SS**  81125.297.6-71.5164.4000118.5
4T46.6Very low44.2Very low126 Ų126152.4 Ų152.477%0.77383%0.833SS**  trans80147.9137.163.20000118
5R43.6Very low44.1Very low225 Ų225149.8 Ų149.885%0.84983%0.826SS**  cis-177.3150.11.6153.6-177.1-178.8-173.12.3110
6S45.4Very low43.9Very low97 Ų97148.9 Ų148.968%0.67883%0.827SS**  trans58132.8153.4-65.80000122.6
7K45.8Very low43.8Very low217 Ų217153.6 Ų153.694%0.94383%0.829SS**  -160.7155.4117.6-107.8169.3-175.5178.70112.7
8K42.8Very low43.3Very low193 Ų193155.3 Ų155.384%0.83983%0.833SS**  trans-121.7135.1-155.2-176.8-171.8-170.5-173.60107.8
9L43Very low43.2Very low173 Ų173153.1 Ų153.191%0.90683%0.831SS**  trans-147.699.2164.5-69.3174.8000106.5
10A38.3Very low43.4Very low87 Ų87153.5 Ų153.572%0.71983%0.831SS**  68.199.37700000112.7
11A38.7Very low43.5Very low106 Ų106157.4 Ų157.488%0.87683%0.834SS**  trans-68.5144.1174.200000111.7
12Q39.7Very low43.2Very low194 Ų194152.1 Ų152.191%0.90782%0.82SS**  trans-110.6128.4170.6-66.6-177.59.100109.6
13S44.4Very low42.5Very low115 Ų115156.3 Ų156.380%0.80483%0.827SS**  trans-90.7153.9165.852.20000110.9
14P48.5Very low42.4Very low121 Ų121161 Ų16179%0.78684%0.835SS**  trans-121.4166.3148.333-20.1000113.9
15P44.1Very low42.1Very low113 Ų113160.3 Ų160.373%0.73484%0.835SS**  trans-114.3155.3-147.638.3-26.5000116.4
16T40.6Very low42.2Very low136 Ų136155.9 Ų155.983%0.83483%0.833SS**  trans27.7131.5139.6-21.70000122.4
17R41.2Very low42Very low229 Ų229156.6 Ų156.686%0.86484%0.835SS**  trans108.3103.7132.7-156.5-173.8-168.2-1784.1118
18M35.9Very low41.6Very low184 Ų184154.7 Ų154.791%0.90683%0.834SS**  trans-156.5101.9137.4-66.9-152.783.800108
19S41Very low41.4Very low112 Ų112151.7 Ų151.778%0.78383%0.832SS**  65.6114.495.3-168.20000115.7
20L46.7Very low41.2Very low162 Ų162149 Ų14985%0.84883%0.825SS**  trans-63.6162.6170.5-65.9161.2000113.1
21R45.7Very low41Very low236 Ų236153 Ų15389%0.89183%0.83SS**  trans107.5100.2162-62.9178.4175.8176.6-1.2115.9
22S39.4Very low41.1Very low117 Ų117156.6 Ų156.682%0.81883%0.829SS**  -159.887.7127.354.60000110.2R24S22-R24 PolarHBondContact O-N 3.49Å
23F38.8Very low41.1Very low198 Ų198152.8 Ų152.887%0.86882%0.82SS**  trans-63.5123.2158.6-74.4-92.3000107.9S25F23-S25 PolarHBondContact O-N 2.91Å
24R41.1Very low40.5Very low241 Ų241153.1 Ų153.191%0.90982%0.822SS**  trans-86.991159.9-85.1-171.4169.6-167.3-2.4108.2S22S22-R24 PolarHBondContact O-N 3.49Å
25S39.8Very low39.8Very low110 Ų110153.1 Ų153.177%0.76982%0.824SS**PPolyproline II helixtrans-60.4121.315740.90000109.8F23F23-S25 PolarHBondContact O-N 2.91Å
26V44.9Very low39.3Very low132 Ų132152.7 Ų152.780%0.883%0.825SS**PPolyproline II helixtrans-100.1132.4164.2177.10000107
27P42.3Very low39.2Very low113 Ų113150.7 Ų150.773%0.73482%0.816SS**PPolyproline II helixtrans-75.1146.7-168.128.3-34000113.8
28L37.3Very low38.9Very low176 Ų176147.4 Ų147.492%0.92182%0.816SS**PPolyproline II helixtrans-58.5135.5167.9-64.2159.8000110.5
29V38.5Very low39Very low131 Ų131146.6 Ų146.679%0.79482%0.815SS**  trans-111.2137.6165.5-179.70000107.7
30P38.9Very low39.1Very low117 Ų117146.2 Ų146.276%0.7681%0.812SS**  trans-74.7148.1-169.4-8.425.8000112.5
31M33.2Very low39.2Very low169 Ų169144.4 Ų144.483%0.83381%0.812SS**  trans-93.7120.2174.9-157.9170.784.200108
32E41.5Very low38.8Very low183 Ų183139.8 Ų139.886%0.85581%0.805SS**  trans-119.8130.4163.8-75.5-81.4124.300107.8
33T38.8Very low39.1Very low114 Ų114138.9 Ų138.970%0.69980%0.798SS**  trans-80.8139.4-171.746.90000112.2
34S31.5Very low38.9Very low122 Ų122140.2 Ų140.285%0.85380%0.804SS**  trans-167.297.4145.6-79.80000112
35S35.5Very low38.7Very low120 Ų120132.1 Ų132.184%0.83980%0.796SS**  trans27.7115.3131.5-168.70000121.5
36S33.3Very low38.9Very low105 Ų105132.7 Ų132.773%0.73480%0.8SS**  174.2102.6127.858.60000109.6
37S37.8Very low38.6Very low94 Ų94134.2 Ų134.266%0.65780%0.804SS**  75.5104.896.974.40000115.4
38D34Very low38.5Very low160 Ų160132 Ų13286%0.85680%0.801SS**  trans75.291.3139.8-39.7-37.3000120.8
39D39.1Very low38.4Very low167 Ų167127 Ų12789%0.89379%0.791SS**  trans-130.4101.5154.2-146.5-51.9000109.8
40S42.9Very low38.3Very low104 Ų104130.7 Ų130.773%0.72780%0.797SS**  trans-87.3109.8-176171.50000110.3
41C48.8Very low38.2Very low123 Ų123129.4 Ų129.483%0.83180%0.797SS**  trans-89.2111.7166.8-170.90000110.3
42D38.1Very low38.2Very low140 Ų140128.9 Ų128.975%0.74980%0.797SS**  trans-161.5139164.3-99.7-36.4000106.9
43S45.7Very low38.2Very low98 Ų98126.5 Ų126.569%0.68580%0.795SS**  cis-169.2122.81.9-117.40000104.4G45S43-G45 VanDerWaalsContact C-N 3.3Å; S43-G45 PolarHBondContact O-N 2.96Å
44F34.8Very low38.1Very low226 Ų226132.6 Ų132.699%0.99181%0.806SS**  trans-76.986172.1-89-84000109.6
45G35.8Very low38.3Very low71 Ų71138.7 Ų138.773%0.73281%0.81SS**  trans-70.1138.6166.800000111.7S43S43-G45 VanDerWaalsContact C-N 3.3Å; S43-G45 PolarHBondContact O-N 2.96Å
46S45Very low38.2Very low122 Ų122138.3 Ų138.385%0.85381%0.807SS**  trans-66.5140.9179.6-610000112.7
47D37.6Very low38.2Very low164 Ų164140.8 Ų140.888%0.87781%0.811SS**  trans-149.3108134.5-140-6.8000111.7G49D47-G49 PolarHBondContact O-N 3.2Å; D47-G49 VanDerWaalsContact O-N 3.17Å
48G40.5Very low38.1Very low65 Ų65148 Ų14867%0.6782%0.824SS**  trans-79.788173.300000109.8F50G48-F50 PolarHBondContact O-N 3.5Å
49G34.7Very low38.1Very low71 Ų71148.7 Ų148.773%0.73282%0.822SS**  trans-69.1108.6170.200000111.8D47 A51D47-G49 PolarHBondContact O-N 3.2Å; D47-G49 VanDerWaalsContact O-N 3.17Å; G49-A51 PolarHBondContact O-N 3.14Å
50F36.4Very low37.6Very low209 Ų209147.3 Ų147.392%0.91782%0.82SS**  trans-59.1102.3168.4-90.8-101.4000110.9G48 N52G48-F50 PolarHBondContact O-N 3.5Å; F50-N52 PolarHBondContact O-N 3.36Å
51A37.8Very low37.1Very low90 Ų90153.6 Ų153.674%0.74483%0.828SS**  trans-75100.6166.800000109.9G49 T53G49-A51 PolarHBondContact O-N 3.14Å; A51-T53 PolarHBondContact O-N 3.3Å
52N32.6Very low36.3Very low159 Ų159154.3 Ų154.385%0.8583%0.829SS**  trans-80.290.6169.9-140.71.3000108F50 R54F50-N52 PolarHBondContact O-N 3.36Å; N52-R54 PolarHBondContact O-N 3.09Å
53T41.4Very low36Very low132 Ų132152.4 Ų152.481%0.8183%0.832SS**  trans-72.7109.2174.344.50000109.8A51 R55A51-T53 PolarHBondContact O-N 3.3Å; T53-R55 PolarHBondContact O-N 3.26Å
54R36.3Very low35.3Very low243 Ų243156.9 Ų156.992%0.91784%0.842SS**  trans-66.2126.6170.1-73.8-174.7171.4-174.4-1.3109.9N52 S56N52-R54 PolarHBondContact O-N 3.09Å; R54-S56 PolarHBondContact O-N 2.67Å
55R36.7Very low35.4Very low250 Ų250155.7 Ų155.794%0.94384%0.836SS**  trans-58.8111.3163.9-167.3178.2-175-1711.8108.9T53T53-R55 PolarHBondContact O-N 3.26Å
56S33Very low35.4Very low111 Ų111158.4 Ų158.478%0.77684%0.841SS**PPolyproline II helixtrans-92.1128.6169.7-1740000110.3R54R54-S56 PolarHBondContact O-N 2.67Å
57L33.6Very low34.6Very low157 Ų157160.9 Ų160.982%0.82284%0.837SS**PPolyproline II helixtrans-52.2125.4173.1-133.981.4000110.5Q59L57-Q59 PolarHBondContact O-N 3.29Å
58R34.6Very low34.2Very low247 Ų247159.9 Ų159.993%0.93284%0.836SS**PPolyproline II helixtrans-76.3118.1163.9-80.9-174.4180-177.6-0.1108.7
59Q34.9Very low33.5Very low174 Ų174165.2 Ų165.281%0.81384%0.841SS**PPolyproline II helixtrans-71.1133.7168.9-74.8174.1-14.200110.2L57L57-Q59 PolarHBondContact O-N 3.29Å
60T29.5Very low33.2Very low138 Ų138170 Ų17085%0.84784%0.844SS**PPolyproline II helixtrans-57.5129.1163.440.40000111.2
61R32.4Very low32.9Very low235 Ų235163.9 Ų163.989%0.88783%0.833SS**  trans-136140.8159-72.5-17369.6159.2-1.1110.5
62T31.3Very low32.3Very low139 Ų139165.4 Ų165.485%0.85383%0.833SS**  trans-72.4159-167.243.90000114.8
63A31Very low32.3Very low99 Ų99162.8 Ų162.882%0.81883%0.827SS**  trans-66.3146.6-177.800000114.9
64Q31.8Very low31.9Very low193 Ų193163.8 Ų163.890%0.90282%0.823SS**  trans-135.3136.2155.2-74.6-170.8-300109.6
65K36.8Very low31.8Very low200 Ų200159.8 Ų159.887%0.8781%0.814SS**  trans-73.4166.3178-72.5177.3172.3179.80111.9
66P35.6Very low31.5Very low128 Ų128154.7 Ų154.783%0.83181%0.806SS**  trans-121.5157.413234-23.9000112.9
67K29Very low31.4Very low174 Ų174155 Ų15576%0.75780%0.803SS**  trans-107.5133-176176.1-179.6-177178.40107.7
68V28.2Very low31.3Very low144 Ų144153 Ų15387%0.87380%0.801SS**  trans-140.2147159-179.90000108.7
69F26.8Very low31.2Very low176 Ų176146.9 Ų146.977%0.77280%0.796SS**  trans-77.5173.4-160.5-103.3-104.1000116.4
70E27.7Very low31Very low171 Ų171142 Ų14280%0.79979%0.793SS**  trans-102.1152.8-164173.1177.3-168.100113.5
71A29.4Very low31Very low81 Ų81144.1 Ų144.167%0.66979%0.791SS**  trans160.2108.9136.500000110.4
72T26.3Very low31.1Very low123 Ų123140.7 Ų140.776%0.75579%0.785SS**  100.4121.888.156.90000114.9
73S31.2Very low31.4Very low104 Ų104142.5 Ų142.573%0.72778%0.783SS**  trans60.1146.3141.467.70000120.2
74E33.8Very low31.7Very low152 Ų152144.8 Ų144.871%0.7178%0.782SS**  cis-160.9160.52050.9-144.8153.700112.4
75E33.8Very low32Very low160 Ų160142.2 Ų142.275%0.74878%0.779SS**  trans43.7146.8152.376-152-178.800122
76D31.3Very low32.2Very low142 Ų142140.1 Ų140.176%0.75978%0.776SS**  cis-168.6163.518.5-140-15.4000111.8
77T31.2Very low32.4Very low118 Ų118139.8 Ų139.872%0.72478%0.777SS**  trans84.694.1150.2-46.70000123.7
78C30.1Very low33.1Very low116 Ų116141.2 Ų141.278%0.78478%0.783SS**  68116.8116.5-151.70000125.5
79S33.1Very low33.7Very low117 Ų117143.4 Ų143.482%0.81878%0.783SS**  144.2132.512766.10000110.3
80G31.1Very low34.1Very low73 Ų73143.3 Ų143.375%0.75379%0.789SS**  cis124.485.74.800000111.3
81F28.4Very low34.3Very low181 Ų181145.3 Ų145.379%0.79480%0.795SS**  trans-174.2115.7140.2-134.2-108.6000115
82E35.9Very low34.5Very low164 Ų164145.9 Ų145.977%0.76680%0.8SS**  trans47.3116.7142.1-55-166.5171.300124.3
83E36.9Very low34.8Very low176 Ų176149.5 Ų149.582%0.82281%0.811SS**  trans-118.6134.6160.3-166.9178.7-151.600107.1
84N37.1Very low34.9Very low148 Ų148154 Ų15479%0.79182%0.818SS**  trans140.581.3152-73.2-34.3000115.2
85V38.9Very low34.9Very low139 Ų139153.7 Ų153.784%0.84283%0.825SS**  trans-146.4145.2147.3-169.90000108
86I39.9Very low34.8Very low155 Ų155149.1 Ų149.180%0.79582%0.821SS**  trans8851.2177.2-34164.5000114.9
87S39.6Very low34.9Very low122 Ų122148 Ų14885%0.85382%0.824SS**  trans-136.466.8149.9-82.40000109.5
88K45.3Very low34.8Very low203 Ų203151.7 Ų151.788%0.88383%0.834SS**SBendtrans-170.3120.9165.3-103.5157.1-172.3-178.80106.8
89Q39.7Very low35Very low190 Ų190150.5 Ų150.589%0.88883%0.832SS**  trans121.559.9164.9-160.3172.416.300115.3
90I35.6Very low35.2Very low174 Ų174150.5 Ų150.589%0.89283%0.829SS**  trans-147.778.1135.4-43.2177000109
91K32.1Very low35.4Very low213 Ų213156.1 Ų156.193%0.92683%0.833SS**  trans-14792.6161.9-94.3-171.5-178.7175.70109.5
92A33.4Very low35.7Very low94 Ų94155.4 Ų155.478%0.77784%0.837SS**  trans179.8117.3154.600000103.5
93M32.1Very low35.8Very low198 Ų198151.4 Ų151.498%0.97584%0.839SS**  -154.4162.462-64.8170.482.800110.6
94K33.5Very low35.8Very low200 Ų200153.9 Ų153.987%0.8784%0.841SS**  trans-125.7129.5-171.4171.4-172.3-179.1-173.70109.7
95V33.8Very low36.1Very low144 Ų144157.7 Ų157.787%0.87384%0.844SS**  trans-158.7112.3149.9-179.20000106.3
96G30.8Very low36.4Very low64 Ų64156.4 Ų156.466%0.6684%0.841SS**  74.512595.700000111.8
97S33.8Very low36.5Very low118 Ų118155.6 Ų155.683%0.82584%0.839SS**  cis-169153.520-48.40000110.7
98E29.3Very low36.7Very low197 Ų197155.3 Ų155.392%0.92183%0.832SS**  trans72.8136156.4-53-152.5152.400123.7
99A34.6Very low36.9Very low91 Ų91153.8 Ų153.875%0.75283%0.832SS**  trans-97.2164.4179.600000111.6
100P37Very low37.3Very low116 Ų116153.8 Ų153.875%0.75383%0.829SS**  -152.5147.591.235.4-15.5000117.6
101K36.3Very low38Very low191 Ų191151.6 Ų151.683%0.8382%0.823SS**  trans46.1144.3137.3-57.9-177.4179.5174.20123.3
102L33.3Very low38.5Very low167 Ų167145.9 Ų145.987%0.87482%0.816SS**  trans91.4118.7143.7-85.8142.3000118.6
103G37.9Very low39Very low79 Ų79148.4 Ų148.481%0.81481%0.814SS**  trans-69.4154.7-174.800000115.1
104R37.9Very low39.7Very low228 Ų228143.7 Ų143.786%0.8681%0.806SS**  trans-114.5114.6-179.6-151.8173.8-165.7-140.84.4110.4
105R43.1Very low40.1Very low228 Ų228142.5 Ų142.586%0.8680%0.801SS**  trans-77153.7172.2-73.5178.7165.9177.7-3.9110.8
106S45.1Very low40.8Very low112 Ų112141.5 Ų141.578%0.78380%0.798SS**  trans-55.6129.3175.153.80000113.1V108S106-V108 PolarHBondContact O-N 2.91Å
107N42.5Very low41.5Very low138 Ų138144.9 Ų144.974%0.73881%0.806SS**  trans-74.9111.6175.8-67.3-29.1000110.6
108V43.4Very low41.8Very low117 Ų117149 Ų14971%0.70981%0.809SS**  trans-100114.4161.6177.80000107.1S106 K110S106-V108 PolarHBondContact O-N 2.91Å; V108-K110 PolarHBondContact O-N 3.18Å
109L48.8Very low42.4Very low170 Ų170149.5 Ų149.589%0.8981%0.808SS**  trans-64.9114.2172.9-72.3163.5000109.1
110K48.3Very low42.7Very low191 Ų191151.9 Ų151.983%0.8381%0.814SS**  trans-100.5111.4170.5-72.8178.3179.6172.30108.5V108 A112V108-K110 PolarHBondContact O-N 3.18Å; K110-A112 PolarHBondContact O-N 2.95Å
111V50.1Low42.9Very low127 Ų127149.9 Ų149.977%0.7781%0.814SS**  trans-75.8114.4168.7179.30000107.7M113V111-M113 HydrophobicContact CG1-SD 4.39Å
112A43.5Very low43.1Very low94 Ų94151 Ų15178%0.77782%0.819SS**  trans-87.4119.3171.900000109K110K110-A112 PolarHBondContact O-N 2.95Å
113M43.2Very low43.1Very low147 Ų147153 Ų15372%0.72482%0.821SS**  trans-87106.7168.2-61.1-67.4-84.800107.6V111 F115V111-M113 HydrophobicContact CG1-SD 4.39Å; M113-F115 HydrophobicContact CB-CE2 4.3Å
114A46.7Very low42.9Very low99 Ų99160.7 Ų160.782%0.81883%0.825SS**PPolyproline II helixtrans-86118.1170.600000109.1
115F42Very low43Very low174 Ų174156.1 Ų156.176%0.76383%0.825SS**PPolyproline II helixtrans-89.8131171.3-67-85000109.3M113 T117M113-F115 HydrophobicContact CB-CE2 4.3Å; F115-T117 PolarHBondContact O-N 3.06Å
116P48.4Very low42.4Very low124 Ų124150.2 Ų150.281%0.80583%0.825SS**PPolyproline II helixtrans-69128.217725.4-30.7000111.1
117T45.5Very low42.1Very low135 Ų135150.7 Ų150.783%0.82883%0.828SS**PPolyproline II helixtrans-77.2121.6175.346.90000110.1F115F115-T117 PolarHBondContact O-N 3.06Å
118K39.9Very low42Very low204 Ų204152.9 Ų152.989%0.88783%0.834SS**PPolyproline II helixtrans-73.5127.2172.7-74.2-174.7175.5-177.40109.7
119K43.4Very low41.8Very low208 Ų208153.1 Ų153.190%0.90484%0.838SS**PPolyproline II helixtrans-67.2124.6175.4-65.3177.9178.9178.10110.2
120T40.5Very low41.1Very low141 Ų141153 Ų15387%0.86584%0.837SS**PPolyproline II helixtrans-79.2116.2171.347.60000110.1
121G40.1Very low40.7Very low74 Ų74149.4 Ų149.476%0.76383%0.833SS**PPolyproline II helixtrans-74.1153.4169.100000112.5
122K40.6Very low40.1Very low214 Ų214152.1 Ų152.193%0.9384%0.838SS**PPolyproline II helixtrans-59142.6-171.6-71.2170.5172.7177.50114.4
123K33.6Very low39.8Very low210 Ų210153.3 Ų153.391%0.91384%0.837SS**PPolyproline II helixtrans-74.2144.3167.6-64.2179.4177.5-1790111.2
124R33.5Very low39.6Very low240 Ų240156.3 Ų156.391%0.90685%0.846SS**  trans-109.2150.4158.5-84.1-176.1174178.3-2109.1
125P40.5Very low39Very low131 Ų131158 Ų15885%0.85185%0.846SS**  trans-82.1163.9-171.233.7-34.1000113.8
126A30.3Very low38.9Very low105 Ų105158.2 Ų158.287%0.86885%0.85SS**  trans-66.4150.7-167.800000115.4
127S40.1Very low38.5Very low121 Ų121160 Ų16085%0.84685%0.853SS**  trans-118.5143.7155.356.40000109.8
128E38.7Very low38.6Very low184 Ų184158 Ų15886%0.8684%0.844SS**  trans-45.5142.4-174.5-164.2168.2-177.200116.8
129P39.2Very low39.2Very low123 Ų123154.2 Ų154.280%0.79983%0.833SS**PPolyproline II helixtrans-93130.5176.128.4-18.3000112.6
130L35.2Very low39.6Very low166 Ų166147.8 Ų147.887%0.86982%0.819SS**PPolyproline II helixtrans-86.1155.1168.4-82.5167.4000111.5
131P39.4Very low40.2Very low116 Ų116148.1 Ų148.175%0.75381%0.811SS**PPolyproline II helixtrans-81.3146.8-151.529.8-34.3000115.4
132Q36.9Very low40.9Very low184 Ų184151.4 Ų151.486%0.8681%0.806SS**PPolyproline II helixtrans-75.3143.1173-64.2-171.5-35.400112.2
133P38.1Very low41.6Very low119 Ų119148.1 Ų148.177%0.77379%0.794SS**PPolyproline II helixtrans-78.8126.2160.331.1-26.8000109.4V135P133-V135 PolarHBondContact O-N 3.39Å
134K38.4Very low43Very low210 Ų210144.7 Ų144.791%0.91378%0.781SS**  trans-65115.8174.9-66.2173.8179176.60109.4
135V35.3Very low45.1Very low135 Ų135137.2 Ų137.282%0.81876%0.76SS**  trans-108125.5159-164.50000105.9P133 D137P133-V135 PolarHBondContact O-N 3.39Å; V135-D137 PolarHBondContact O-N 2.8Å
136Q39.1Very low47Very low178 Ų178137 Ų13783%0.83275%0.746SS**  trans-62.2123.9-175.4-74.6159.9-28.900110.3S138Q136-S138 PolarHBondContact O-N 2.94Å; Q136-S138 VanDerWaalsContact O-N 3.11Å
137D40.4Very low49.6Very low163 Ų163137.4 Ų137.487%0.87273%0.731SS**  trans-64.7102.9165.5-82.6-47000108.8V135V135-D137 PolarHBondContact O-N 2.8Å
138S47.9Very low51.9Low92 Ų92133.9 Ų133.964%0.64371%0.709SS**  trans-113.48.7167.3-70.30000113Q136Q136-S138 PolarHBondContact O-N 2.94Å; Q136-S138 VanDerWaalsContact O-N 3.11Å
139D51.8Low54.3Low124 Ų124130.6 Ų130.666%0.66369%0.692SS**SBendtrans-90.4-12.2-173.3-129.1-12.9000113.9
140A51.7Low56.8Low73 Ų73131.9 Ų131.960%0.60368%0.681SS**Hα-helixtrans-76.7-31.5-178.300000113.5E142 E144A140-E142 VanDerWaalsContact C-N 3.34Å; A140-E144 PolarHBondContact O-N 3.2Å
141E52.6Low59.6Low148 Ų148126.7 Ų126.769%0.69266%0.662SS**Hα-helixtrans-73.2-26.5-177.7-62.4-77.6158.700111.9N145E141-N145 WeakPolarHBondContact O-CB 3.37Å; E141-N145 PolarHBondContact O-N 3.16Å
142E54.7Low62.2Low144 Ų144125.8 Ų125.867%0.67365%0.65SS**Hα-helixtrans-77.6-35.4179-66.7-161.7168.400112.7A140 N145 F146A140-E142 VanDerWaalsContact C-N 3.34Å; E142-N145 PolarHBondContact O-N 3.11Å; E142-F146 PolarHBondContact O-N 3.3Å; E142-F146 VanDerWaalsContact O-N 3.16Å
143E56.4Low64.9Low145 Ų145121.1 Ų121.168%0.67863%0.631SS**Hα-helixtrans-70.8-37.8177.6-163.7173.9-168.300111.9N145 F146 M147E143-N145 VanDerWaalsContact C-N 3.32Å; E143-N145 PolarHBondContact O-N 3.29Å; E143-F146 PolarHBondContact O-N 3.15Å; E143-M147 WeakPolarHBondContact O-CG 3.39Å; E143-M147 PolarHBondContact O-N 3.35Å; E143-M147 VanDerWaalsContact O-N 3.09Å
144E63.6Low67.7Low137 Ų137119.1 Ų119.164%0.6461%0.613SS**Hα-helixtrans-64.5-37.5174.7-165.2167.8-166.500111.5A140 M147 A148A140-E144 PolarHBondContact O-N 3.2Å; E144-M147 PolarHBondContact O-N 3.25Å; E144-A148 WeakPolarHBondContact O-CB 3.47Å; E144-A148 PolarHBondContact O-N 3.41Å
145N76.9Confident70.4Confident84 Ų84115 Ų11545%0.44960%0.595SS.*Hα-helixtrans-68.6-34.9177-160.812.2000112.7E141 E142 E143 K149E141-N145 WeakPolarHBondContact O-CB 3.37Å; E141-N145 PolarHBondContact O-N 3.16Å; E142-N145 PolarHBondContact O-N 3.11Å; E143-N145 VanDerWaalsContact C-N 3.32Å; E143-N145 PolarHBondContact O-N 3.29Å; N145-K149 WeakPolarHBondContact O-CB 3.09Å; N145-K149 VanDerWaalsContact O-CG 3.24Å; N145-K149 WeakPolarHBondContact O-CG 3.35Å; N145-K149 PolarHBondContact O-N 2.55Å
146F80.5Confident73.3Confident127 Ų127113.8 Ų113.856%0.55758%0.581SS**Hα-helixtrans-67.4-44.1173.2178.2-99.4000112E142 E143 A148 K149 R150E142-F146 PolarHBondContact O-N 3.3Å; E142-F146 VanDerWaalsContact O-N 3.16Å; E143-F146 PolarHBondContact O-N 3.15Å; F146-A148 VanDerWaalsContact C-N 3.33Å; F146-A148 PolarHBondContact O-N 3.04Å; F146-K149 PolarHBondContact O-N 3.45Å; F146-R150 WeakPolarHBondContact O-CB 3.35Å; F146-R150 PolarHBondContact O-N 3.24Å
147M84.1Confident75.9Confident113 Ų113109.6 Ų109.656%0.55756%0.564SS**Hα-helixtrans-66-36.9177.9-69.6-64.7-8100111.7E143 E144 R150 A151E143-M147 WeakPolarHBondContact O-CG 3.39Å; E143-M147 PolarHBondContact O-N 3.35Å; E143-M147 VanDerWaalsContact O-N 3.09Å; E144-M147 PolarHBondContact O-N 3.25Å; M147-R150 PolarHBondContact O-N 2.97Å; M147-A151 WeakPolarHBondContact O-CB 3.3Å; M147-A151 PolarHBondContact O-N 3.32Å
148A89.6Confident78.6Confident47 Ų47108.5 Ų108.539%0.38855%0.551SS.*Hα-helixtrans-63.8-47.9172.400000112E144 F146 R150 A151 L152E144-A148 WeakPolarHBondContact O-CB 3.47Å; E144-A148 PolarHBondContact O-N 3.41Å; F146-A148 VanDerWaalsContact C-N 3.33Å; F146-A148 PolarHBondContact O-N 3.04Å; A148-R150 VanDerWaalsContact C-N 3.32Å; A148-R150 PolarHBondContact O-N 3.33Å; A148-A151 PolarHBondContact O-N 3.14Å; A148-A151 VanDerWaalsContact O-N 3.16Å; A148-L152 WeakPolarHBondContact O-CG 3.33Å; A148-L152 PolarHBondContact O-N 2.71Å
149K89.4Confident80.8Confident114 Ų114108.5 Ų108.550%0.49654%0.541SS..Hα-helixtrans-59.8-40.8175.4-74.6169.6-174.6172.40112.1N145 F146 L152 N153N145-K149 WeakPolarHBondContact O-CB 3.09Å; N145-K149 VanDerWaalsContact O-CG 3.24Å; N145-K149 WeakPolarHBondContact O-CG 3.35Å; N145-K149 PolarHBondContact O-N 2.55Å; F146-K149 PolarHBondContact O-N 3.45Å; K149-L152 PolarHBondContact O-N 2.72Å; K149-N153 PolarHBondContact O-N 3.49Å; K149-N153 PolarHBondContact O-ND2 3.47Å
150R90.9Very high82.8Confident150 Ų150107.4 Ų107.457%0.56653%0.533SS*.Hα-helixtrans-64.2-41.8175.5-173.7176-175.4159.43.8111.6F146 M147 A148 N153 I154F146-R150 WeakPolarHBondContact O-CB 3.35Å; F146-R150 PolarHBondContact O-N 3.24Å; M147-R150 PolarHBondContact O-N 2.97Å; A148-R150 VanDerWaalsContact C-N 3.32Å; A148-R150 PolarHBondContact O-N 3.33Å; R150-N153 PolarHBondContact O-N 3.18Å; R150-I154 HydrophobicContact CG-CD1 3.96Å; R150-I154 WeakPolarHBondContact O-CB 3.38Å; R150-I154 WeakPolarHBondContact O-CD1 3.23Å; R150-I154 WeakPolarHBondContact O-CG1 3.38Å; R150-I154 PolarHBondContact O-N 2.66Å
151A94Very high84.9Confident57 Ų57108.6 Ų108.647%0.47153%0.529SS..Hα-helixtrans-64.6-40.8177.400000112.2M147 A148 I154 K155M147-A151 WeakPolarHBondContact O-CB 3.3Å; M147-A151 PolarHBondContact O-N 3.32Å; A148-A151 PolarHBondContact O-N 3.14Å; A148-A151 VanDerWaalsContact O-N 3.16Å; A151-I154 PolarHBondContact O-N 2.98Å; A151-K155 WeakPolarHBondContact O-CB 3.24Å; A151-K155 PolarHBondContact O-N 3.47Å
152L93.9Very high86.9Confident97 Ų97104.3 Ų104.351%0.50852%0.519SS..Hα-helixtrans-62.6-49174.8-69.6174.9000111.6A148 K149 I154 K155 E156A148-L152 WeakPolarHBondContact O-CG 3.33Å; A148-L152 PolarHBondContact O-N 2.71Å; K149-L152 PolarHBondContact O-N 2.72Å; L152-I154 VanDerWaalsContact C-N 3.31Å; L152-I154 PolarHBondContact O-N 3.1Å; L152-K155 WeakPolarHBondContact O-CA 3.5Å; L152-K155 WeakPolarHBondContact O-CB 3.39Å; L152-K155 PolarHBondContact O-N 3.39Å; L152-E156 WeakPolarHBondContact O-CG 3.31Å; L152-E156 PolarHBondContact O-N 3.43Å
153N94.3Very high88.7Confident86 Ų86104 Ų10446%0.4652%0.515SS..Hα-helixtrans-58.6-41.3176-84.4-81.9000112.5K149 R150 K155 N157K149-N153 PolarHBondContact O-N 3.49Å; K149-N153 PolarHBondContact O-ND2 3.47Å; R150-N153 PolarHBondContact O-N 3.18Å; N153-K155 VanDerWaalsContact C-N 3.31Å; N153-K155 PolarHBondContact O-N 3.3Å; N153-N157 WeakPolarHBondContact O-CB 3.36Å; N153-N157 VanDerWaalsContact O-CG 3.26Å; N153-N157 PolarHBondContact O-N 3.48Å; N153-N157 PolarHBondContact O-ND2 2.69Å
154I95.6Very high90.4Very high77 Ų77101.2 Ų101.240%0.39550%0.504SS..Hα-helixtrans-64.3-38.9176.1-70.2166.2000110.8R150 A151 L152 K158R150-I154 HydrophobicContact CG-CD1 3.96Å; R150-I154 WeakPolarHBondContact O-CB 3.38Å; R150-I154 WeakPolarHBondContact O-CD1 3.23Å; R150-I154 WeakPolarHBondContact O-CG1 3.38Å; R150-I154 PolarHBondContact O-N 2.66Å; A151-I154 PolarHBondContact O-N 2.98Å; L152-I154 VanDerWaalsContact C-N 3.31Å; L152-I154 PolarHBondContact O-N 3.1Å; I154-K158 HydrophobicContact CG2-CD 4.07Å; I154-K158 WeakPolarHBondContact O-CB 3.42Å; I154-K158 WeakPolarHBondContact O-CG 3.42Å; I154-K158 PolarHBondContact O-N 2.75Å
155K95.9Very high91.7Very high123 Ų12399.1 Ų99.154%0.53550%0.497SS..Hα-helixtrans-67.5-47.2178.7-172.8-179.9175.2-172.60111.1A151 L152 N153 N157 K158 E159A151-K155 WeakPolarHBondContact O-CB 3.24Å; A151-K155 PolarHBondContact O-N 3.47Å; L152-K155 WeakPolarHBondContact O-CA 3.5Å; L152-K155 WeakPolarHBondContact O-CB 3.39Å; L152-K155 PolarHBondContact O-N 3.39Å; N153-K155 VanDerWaalsContact C-N 3.31Å; N153-K155 PolarHBondContact O-N 3.3Å; K155-N157 PolarHBondContact O-N 3.05Å; K155-K158 WeakPolarHBondContact O-CB 3Å; K155-K158 PolarHBondContact O-N 3.31Å; K155-E159 WeakPolarHBondContact CE-OE1 3.31Å; K155-E159 WeakPolarHBondContact CG-OE1 3.23Å; K155-E159 WeakPolarHBondContact O-CG 3.32Å; K155-E159 PolarHBondContact O-N 3.37Å
156E95.4Very high92.3Very high111 Ų11197.1 Ų97.152%0.51949%0.493SS..Hα-helixtrans-60.6-45.3177.5-71.3169.8-174.300111.8L152 K158 E159 M160L152-E156 WeakPolarHBondContact O-CG 3.31Å; L152-E156 PolarHBondContact O-N 3.43Å; E156-K158 VanDerWaalsContact C-N 3.33Å; E156-K158 PolarHBondContact O-N 3.06Å; E156-E159 PolarHBondContact O-N 2.67Å; E156-M160 WeakPolarHBondContact O-CB 3.27Å; E156-M160 PolarHBondContact O-N 3.22Å
157N94.5Very high92.7Very high90 Ų9096.2 Ų96.248%0.48149%0.49SS..Hα-helixtrans-62.5-39.4175.7-75.8-22000112.4N153 K155 L161N153-N157 WeakPolarHBondContact O-CB 3.36Å; N153-N157 VanDerWaalsContact O-CG 3.26Å; N153-N157 PolarHBondContact O-N 3.48Å; N153-N157 PolarHBondContact O-ND2 2.69Å; K155-N157 PolarHBondContact O-N 3.05Å; N157-L161 VanDerWaalsContact O-CB 3.28Å; N157-L161 WeakPolarHBondContact O-CB 3.34Å; N157-L161 PolarHBondContact O-N 2.73Å
158K96.3Very high92.5Very high139 Ų13995.2 Ų95.260%0.60449%0.486SS*.Hα-helixtrans-65.9-40.7175.6-78173.3179.4178.60111.8I154 K155 E156 A162I154-K158 HydrophobicContact CG2-CD 4.07Å; I154-K158 WeakPolarHBondContact O-CB 3.42Å; I154-K158 WeakPolarHBondContact O-CG 3.42Å; I154-K158 PolarHBondContact O-N 2.75Å; K155-K158 WeakPolarHBondContact O-CB 3Å; K155-K158 PolarHBondContact O-N 3.31Å; E156-K158 VanDerWaalsContact C-N 3.33Å; E156-K158 PolarHBondContact O-N 3.06Å; K158-A162 WeakPolarHBondContact O-CB 3.41Å; K158-A162 PolarHBondContact O-N 2.91Å
159E94.9Very high91.9Very high92 Ų9298.8 Ų98.843%0.4350%0.499SS..Hα-helixtrans-69.3-42.6178.8-73.2176.3-169.500111.7K155 E156 A162 K163K155-E159 WeakPolarHBondContact CE-OE1 3.31Å; K155-E159 WeakPolarHBondContact CG-OE1 3.23Å; K155-E159 WeakPolarHBondContact O-CG 3.32Å; K155-E159 PolarHBondContact O-N 3.37Å; E156-E159 PolarHBondContact O-N 2.67Å; E159-A162 PolarHBondContact O-N 3.07Å; E159-K163 WeakPolarHBondContact O-CG 3.35Å; E159-K163 PolarHBondContact O-N 3.23Å
160M94.4Very high91.4Very high101 Ų101100.8 Ų100.850%0.49851%0.508SS..Hα-helixtrans-59.6-47.3172.7180-126.7-66.400111.1E156 A162 K163 L164E156-M160 WeakPolarHBondContact O-CB 3.27Å; E156-M160 PolarHBondContact O-N 3.22Å; M160-A162 VanDerWaalsContact C-N 3.31Å; M160-A162 PolarHBondContact O-N 2.73Å; M160-K163 WeakPolarHBondContact O-CB 2.91Å; M160-K163 PolarHBondContact O-N 2.97Å; M160-K163 VanDerWaalsContact O-N 3.17Å; M160-L164 HydrophobicContact CG-CD1 4.37Å; M160-L164 WeakPolarHBondContact O-CG 3.35Å; M160-L164 PolarHBondContact O-N 2.91Å; M160-L164 HydrophobicContact SD-CD1 4.09Å
161L94.6Very high90.5Very high99 Ų9997.1 Ų97.152%0.51850%0.502SS..Hα-helixtrans-59.4-42.6175.6-179.764.2000111.7N157 K163 L164 L165N157-L161 VanDerWaalsContact O-CB 3.28Å; N157-L161 WeakPolarHBondContact O-CB 3.34Å; N157-L161 PolarHBondContact O-N 2.73Å; L161-K163 VanDerWaalsContact C-N 3.34Å; L161-K163 PolarHBondContact O-N 2.87Å; L161-L164 PolarHBondContact O-N 3.28Å; L161-L165 HydrophobicContact CD1-CD1 4.4Å; L161-L165 HydrophobicContact CD1-CG 4.38Å; L161-L165 HydrophobicContact CG-CD1 4.1Å; L161-L165 HydrophobicContact CG-CG 4.49Å; L161-L165 WeakPolarHBondContact O-CB 3.34Å; L161-L165 VanDerWaalsContact O-CG 3.27Å; L161-L165 WeakPolarHBondContact O-CG 3.25Å; L161-L165 PolarHBondContact O-N 3.12Å
162A94.4Very high89Confident57 Ų57100.4 Ų100.447%0.47152%0.519SS..Hα-helixtrans-63.6-39.217700000112.1K158 E159 M160 L165 A166K158-A162 WeakPolarHBondContact O-CB 3.41Å; K158-A162 PolarHBondContact O-N 2.91Å; E159-A162 PolarHBondContact O-N 3.07Å; M160-A162 VanDerWaalsContact C-N 3.31Å; M160-A162 PolarHBondContact O-N 2.73Å; A162-L165 PolarHBondContact O-N 2.92Å; A162-A166 WeakPolarHBondContact O-CB 3.18Å; A162-A166 PolarHBondContact O-N 3Å
163K93.2Very high87.4Confident139 Ų13999.5 Ų99.560%0.60453%0.532SS*.Hα-helixtrans-62.9-47.7174.2-73.2174.2-177.9176.20111.5E159 M160 L161 L165 A166 E167E159-K163 WeakPolarHBondContact O-CG 3.35Å; E159-K163 PolarHBondContact O-N 3.23Å; M160-K163 WeakPolarHBondContact O-CB 2.91Å; M160-K163 PolarHBondContact O-N 2.97Å; M160-K163 VanDerWaalsContact O-N 3.17Å; L161-K163 VanDerWaalsContact C-N 3.34Å; L161-K163 PolarHBondContact O-N 2.87Å; K163-L165 PolarHBondContact O-N 3.46Å; K163-A166 CarbonylContact O-C 3.52Å; K163-A166 WeakPolarHBondContact O-CB 3.31Å; K163-A166 PolarHBondContact O-N 2.99Å; K163-A166 VanDerWaalsContact O-N 3.13Å; K163-E167 WeakPolarHBondContact O-CG 3.49Å; K163-E167 PolarHBondContact O-N 3.14Å
164L92.8Very high85.8Confident85 Ų85101.1 Ų101.145%0.44554%0.54SS..Hα-helixtrans-61.5-42.8177.1-68.3174000112M160 L161 A166 E167 L168M160-L164 HydrophobicContact CG-CD1 4.37Å; M160-L164 WeakPolarHBondContact O-CG 3.35Å; M160-L164 PolarHBondContact O-N 2.91Å; M160-L164 HydrophobicContact SD-CD1 4.09Å; L161-L164 PolarHBondContact O-N 3.28Å; L164-A166 VanDerWaalsContact C-N 3.31Å; L164-A166 PolarHBondContact O-N 3.45Å; L164-E167 PolarHBondContact O-N 3.13Å; L164-L168 WeakPolarHBondContact O-CG 3.16Å; L164-L168 PolarHBondContact O-N 3.13Å
165L90.4Very high83.8Confident93 Ų93103.2 Ų103.249%0.48755%0.552SS.*Hα-helixtrans-63.6-37.4174.7-72.1173.4000111.9L161 A162 K163 N169L161-L165 HydrophobicContact CD1-CD1 4.4Å; L161-L165 HydrophobicContact CD1-CG 4.38Å; L161-L165 HydrophobicContact CG-CD1 4.1Å; L161-L165 HydrophobicContact CG-CG 4.49Å; L161-L165 WeakPolarHBondContact O-CB 3.34Å; L161-L165 VanDerWaalsContact O-CG 3.27Å; L161-L165 WeakPolarHBondContact O-CG 3.25Å; L161-L165 PolarHBondContact O-N 3.12Å; A162-L165 PolarHBondContact O-N 2.92Å; K163-L165 PolarHBondContact O-N 3.46Å; L165-N169 PolarHBondContact O-N 2.85Å; L165-N169 PolarHBondContact O-ND2 3.08Å
166A88.8Confident81.4Confident43 Ų43103.6 Ų103.636%0.35557%0.567SS.*Hα-helixtrans-68.9-36.9175.200000112.2A162 K163 L164 N169 K170A162-A166 WeakPolarHBondContact O-CB 3.18Å; A162-A166 PolarHBondContact O-N 3Å; K163-A166 CarbonylContact O-C 3.52Å; K163-A166 WeakPolarHBondContact O-CB 3.31Å; K163-A166 PolarHBondContact O-N 2.99Å; K163-A166 VanDerWaalsContact O-N 3.13Å; L164-A166 VanDerWaalsContact C-N 3.31Å; L164-A166 PolarHBondContact O-N 3.45Å; A166-N169 PolarHBondContact O-N 3.35Å; A166-K170 WeakPolarHBondContact O-CG 3.2Å; A166-K170 PolarHBondContact O-N 3.25Å
167E88.6Confident79.2Confident107 Ų107101.7 Ų101.750%0.558%0.577SS.*Hα-helixtrans-68.5-40.7174.9-74.9176.6-17700112.3K163 L164 N169 K170 V171K163-E167 WeakPolarHBondContact O-CG 3.49Å; K163-E167 PolarHBondContact O-N 3.14Å; L164-E167 PolarHBondContact O-N 3.13Å; E167-N169 PolarHBondContact O-N 3.43Å; E167-K170 WeakPolarHBondContact O-CA 3.48Å; E167-K170 WeakPolarHBondContact O-CB 3.45Å; E167-K170 PolarHBondContact O-N 2.85Å; E167-V171 PolarHBondContact O-N 3.33Å
168L81.4Confident76.9Confident92 Ų92106.6 Ų106.648%0.48259%0.594SS.*Hα-helixtrans-60.5-34.5172.7-74.2175.1000112.2L164 K170L164-L168 WeakPolarHBondContact O-CG 3.16Å; L164-L168 PolarHBondContact O-N 3.13Å; L168-K170 VanDerWaalsContact C-N 3.27Å; L168-K170 PolarHBondContact O-N 3.36Å
169N75.4Confident74.2Confident122 Ų122111.5 Ų111.565%0.65261%0.609SS**Hα-helixtrans-72-17.9173.7-71.8-45.4000113.5L165 A166 E167L165-N169 PolarHBondContact O-N 2.85Å; L165-N169 PolarHBondContact O-ND2 3.08Å; A166-N169 PolarHBondContact O-N 3.35Å; E167-N169 PolarHBondContact O-N 3.43Å
170K79.9Confident71.6Confident156 Ų156114.9 Ų114.968%0.67863%0.626SS**Hα-helixtrans-85.9-15.7177.9-69.3168.2-168.3178.40113.2A166 E167 L168 P172A166-K170 WeakPolarHBondContact O-CG 3.2Å; A166-K170 PolarHBondContact O-N 3.25Å; E167-K170 WeakPolarHBondContact O-CA 3.48Å; E167-K170 WeakPolarHBondContact O-CB 3.45Å; E167-K170 PolarHBondContact O-N 2.85Å; L168-K170 VanDerWaalsContact C-N 3.27Å; L168-K170 PolarHBondContact O-N 3.36Å; K170-P172 WeakPolarHBondContact O-CD 3.32Å
171V73Confident68.9Low74 Ų74114.5 Ų114.545%0.44864%0.639SS.*SBendtrans-88.6104.6175.1-172.80000108.6E167 G173 L174E167-V171 PolarHBondContact O-N 3.33Å; V171-G173 PolarHBondContact O-N 3.2Å; V171-L174 HydrophobicContact CB-CD1 4.35Å; V171-L174 HydrophobicContact CG1-CD1 3.58Å
172P62Low66.3Low126 Ų126119.5 Ų119.582%0.81866%0.657SS**THydrogen-bonded Turntrans-69.6121.1179.2-10.528.7000108.5K170K170-P172 WeakPolarHBondContact O-CD 3.32Å
173G60.5Low63.6Low77 Ų77122 Ų12279%0.79467%0.67SS**THydrogen-bonded Turntrans120.3-5.9169.300000117.4V171V171-G173 PolarHBondContact O-N 3.2Å
174L60.2Low60.9Low120 Ų120119.3 Ų119.363%0.62867%0.674SS**SBendtrans-88.9-9.4178.6-96.7102.1000115.5V171V171-L174 HydrophobicContact CB-CD1 4.35Å; V171-L174 HydrophobicContact CG1-CD1 3.58Å
175L53.3Low58.5Low122 Ų122123.6 Ų123.664%0.63970%0.697SS**SBendtrans-121.3117.5179-60.5177.8000110.7G177L175-G177 PolarHBondContact O-N 3.47Å
176P46Very low56Low131 Ų131124.7 Ų124.785%0.85171%0.707SS**  trans-64.8106.8173-17.529.8000110.5
177G47.8Very low53.8Low71 Ų71128.5 Ų128.573%0.73273%0.726SS**  trans37.792.2152.800000118.3L175L175-G177 PolarHBondContact O-N 3.47Å
178K46.4Very low51.5Low192 Ų192131.5 Ų131.584%0.83575%0.745SS**  trans-99100.3148.8-76.6-171.7177.6-179.20109.3M180K178-M180 PolarHBondContact O-N 3.41Å
179R40.4Very low49.4Very low243 Ų243138.5 Ų138.592%0.91777%0.765SS**  trans-56.6118.8164-60.4179.3-159.6176.24.9107.7A181R179-A181 PolarHBondContact O-N 3.27Å
180M39.8Very low47.8Very low163 Ų163141.4 Ų141.480%0.80378%0.775SS**  trans-68.6107.6170.1-72.9-82.9108.900108.6K178K178-M180 PolarHBondContact O-N 3.41Å
181A38.5Very low45.7Very low92 Ų92138.3 Ų138.376%0.7678%0.778SS**  trans-81.4110.4158.200000107.4R179R179-A181 PolarHBondContact O-N 3.27Å
182K39.9Very low44.1Very low204 Ų204140.3 Ų140.389%0.88779%0.793SS**  trans-74.8120.3166-67.7177179.5175.50107.7
183S37.8Very low43Very low109 Ų109143.7 Ų143.776%0.76280%0.798SS**  trans-152.1107.5158.326.60000111.7
184A35.6Very low41.8Very low83 Ų83151.4 Ų151.469%0.68680%0.803SS**  trans54.6105.413900000119.4T186A184-T186 PolarHBondContact O-N 3.01Å
185L43.7Very low41.1Very low176 Ų176150.4 Ų150.492%0.92181%0.806SS**  trans-48.3112.8145.3177.570.2000110.1
186T37.9Very low40.6Very low115 Ų115150.9 Ų150.971%0.70682%0.816SS**  trans-144.9114.1159.740.30000110.5A184A184-T186 PolarHBondContact O-N 3.01Å
187T41.3Very low40.3Very low123 Ų123156.1 Ų156.176%0.75582%0.819SS**  trans50.4108148.323.90000120R189T187-R189 PolarHBondContact O-N 3.46Å
188L41.3Very low40.1Very low171 Ų171161.2 Ų161.290%0.89582%0.821SS**  trans-32.1117148.1-99.7127.9000111.7
189R36.1Very low39.8Very low238 Ų238158.3 Ų158.390%0.89882%0.822SS**  trans-112.9110.7158.3-78.2-168.1166.5-148.1-2.9108.4T187 A191T187-R189 PolarHBondContact O-N 3.46Å; R189-A191 PolarHBondContact O-N 3.06Å
190Q43Very low39.7Very low183 Ų183158.5 Ų158.586%0.85582%0.823SS**PPolyproline II helixtrans-52.4131.5171.3-69.5172.9-12.600110.1
191A34.3Very low39.8Very low91 Ų91154.2 Ų154.275%0.75282%0.82SS**PPolyproline II helixtrans-73.5140.2167.600000109R189 E193R189-A191 PolarHBondContact O-N 3.06Å; A191-E193 PolarHBondContact O-N 3.27Å
192P40.2Very low39.9Very low116 Ų116156 Ų15675%0.75382%0.821SS**PPolyproline II helixtrans-71.1127.5-178.227.8-30.9000110.3R194P192-R194 PolarHBondContact O-N 2.92Å
193E38.4Very low40.2Very low198 Ų198157.9 Ų157.993%0.92582%0.823SS**PPolyproline II helixtrans-51.9125.1166-87-165.113500109.9A191A191-E193 PolarHBondContact O-N 3.27Å
194R36.5Very low40.6Very low238 Ų238163.5 Ų163.590%0.89883%0.827SS**PPolyproline II helixtrans-101.3124.9166-78.5-176.4171.9172.4-0.3108.5P192P192-R194 PolarHBondContact O-N 2.92Å
195S45.8Very low41Very low100 Ų100163.5 Ų163.570%0.69983%0.827SS**PPolyproline II helixtrans-49.5153.5177.756.40000114.4R197S195-R197 PolarHBondContact O-N 3.41Å; S195-R197 VanDerWaalsContact O-N 3.16Å
196P41.4Very low41.3Very low131 Ų131160.9 Ų160.985%0.85182%0.821SS**  trans-69.4115.1-177.527-31.4000110.2
197R40.1Very low41.8Very low241 Ų241163.5 Ų163.591%0.90983%0.825SS**  trans-74.4134.3167.7-79.5-175.4174.7-144-2109.5S195S195-R197 PolarHBondContact O-N 3.41Å; S195-R197 VanDerWaalsContact O-N 3.16Å
198K44.8Very low42Very low179 Ų179167.5 Ų167.578%0.77883%0.826SS**  trans-49.8145.7174.7-61.4-177.2178.8-170.60111.8W200K198-W200 PolarHBondContact O-N 3.44Å; K198-W200 VanDerWaalsContact O-N 3.13Å
199P38.8Very low42.7Very low131 Ų131166.1 Ų166.185%0.85182%0.819SS**  trans-73.1108.9-175.923.9-22.8000110
200W37.9Very low43.4Very low247 Ų247161.2 Ų161.294%0.93681%0.81SS**  trans-82.1131.1166.8-79.648.1000108.3K198 V202K198-W200 PolarHBondContact O-N 3.44Å; K198-W200 VanDerWaalsContact O-N 3.13Å; W200-V202 PolarHBondContact O-N 2.66Å
201G43.5Very low44.1Very low72 Ų72157.7 Ų157.774%0.74280%0.803SS**  trans-45.8128.5-164.200000115.6R203G201-R203 PolarHBondContact O-N 3.23Å; G201-R203 VanDerWaalsContact O-N 3.15Å
202V39.9Very low44.8Very low130 Ų130158.3 Ų158.379%0.78880%0.799SS**  trans-48.9114.9160.9177.70000108.1W200 R204W200-V202 PolarHBondContact O-N 2.66Å; V202-R204 VanDerWaalsContact C-N 3.3Å; V202-R204 HydrophobicContact CG1-CG 4.39Å; V202-R204 PolarHBondContact O-N 3.11Å
203R46.2Very low45.2Very low244 Ų244162.8 Ų162.892%0.92180%0.801SS**  trans-67101.2158-66.7-164.3-143.2-149.87105.6G201 A205G201-R203 PolarHBondContact O-N 3.23Å; G201-R203 VanDerWaalsContact O-N 3.15Å; R203-A205 PolarHBondContact O-N 2.95Å; R203-A205 VanDerWaalsContact O-N 3.15Å
204R45.9Very low45.8Very low227 Ų227157.8 Ų157.886%0.85778%0.784SS**PPolyproline II helixtrans-59.9117.5169.2-64.3-175.7-161-1622.9106.7V202V202-R204 VanDerWaalsContact C-N 3.3Å; V202-R204 HydrophobicContact CG1-CG 4.39Å; V202-R204 PolarHBondContact O-N 3.11Å
205A45.2Very low46.6Very low82 Ų82158.4 Ų158.468%0.67879%0.787SS**PPolyproline II helixtrans-57.9134.7157.100000106.4R203 E207R203-A205 PolarHBondContact O-N 2.95Å; R203-A205 VanDerWaalsContact O-N 3.15Å; A205-E207 PolarHBondContact O-N 3.42Å; A205-E207 VanDerWaalsContact O-N 3.13Å
206P49Very low46.7Very low121 Ų121158.4 Ų158.479%0.78679%0.787SS**PPolyproline II helixtrans-59123.5170.524.1-28.8000106.8R208P206-R208 PolarHBondContact O-N 3.27Å
207E47.5Very low47Very low170 Ų170161.8 Ų161.879%0.79478%0.782SS**  trans-58.691.7168.9-83.7178.8156.900107.6A205 L209A205-E207 PolarHBondContact O-N 3.42Å; A205-E207 VanDerWaalsContact O-N 3.13Å; E207-L209 HydrophobicContact CB-CD2 4.22Å; E207-L209 HydrophobicContact CB-CG 4.33Å; E207-L209 PolarHBondContact O-N 2.96Å; E207-L209 VanDerWaalsContact O-N 3.07Å
208R46.5Very low47.4Very low207 Ų207154.2 Ų154.278%0.78177%0.766SS**  trans-76.691.4163.8-172.7-177.9-89.2156.3-7.9104.6P206 L210P206-R208 PolarHBondContact O-N 3.27Å; R208-L210 WeakPolarHBondContact CG-O 3.27Å; R208-L210 PolarHBondContact O-N 3.14Å
209L55Low47.7Very low143 Ų143154.4 Ų154.475%0.74977%0.77SS**  trans-63.47.3-177-69.5174.2000114.4E207E207-L209 HydrophobicContact CB-CD2 4.22Å; E207-L209 HydrophobicContact CB-CG 4.33Å; E207-L209 PolarHBondContact O-N 2.96Å; E207-L209 VanDerWaalsContact O-N 3.07Å
210L51.1Low47.9Very low134 Ų134153.3 Ų153.370%0.70276%0.761SS**SBendtrans-146.1133.3171.7-65.6174.2000111.4R208R208-L210 WeakPolarHBondContact CG-O 3.27Å; R208-L210 PolarHBondContact O-N 3.14Å
211P58.5Low48.5Very low110 Ų110149.4 Ų149.471%0.71476%0.758SS**  trans-54.9153.5165.6-21.231.7000111.3R213P211-R213 PolarHBondContact O-N 3.35Å; P211-R213 VanDerWaalsContact O-N 3.09Å
212P49.5Very low49Very low104 Ų104149 Ų14968%0.67575%0.748SS**  trans-52.6121.3168.2-20.231.3000109T214P212-T214 PolarHBondContact O-N 3.4Å
213R47.3Very low49.5Very low210 Ų210148.3 Ų148.379%0.79275%0.746SS**  trans-61.4101.7-178.8-173168.3177.1147.80108.6P211 R217P211-R213 PolarHBondContact O-N 3.35Å; P211-R213 VanDerWaalsContact O-N 3.09Å; R213-R217 PolarHBondContact NH2-O 2.78Å
214T51Low49.6Very low93 Ų93142.6 Ų142.657%0.57174%0.741SS**  trans-68.8147171.154.70000108.8P212 S216 R217P212-T214 PolarHBondContact O-N 3.4Å; T214-S216 PolarHBondContact O-N 2.84Å; T214-S216 PolarHBondContact OG1-OG 3.21Å; T214-R217 PolarHBondContact O-N 3.33Å
215R54.6Low49.9Very low250 Ų250136.4 Ų136.494%0.94373%0.732SS**THydrogen-bonded Turntrans-54.6-10.3-176.7-164.3178.7-178.4-154.51.7114.7
216S47.1Very low50.2Low100 Ų100137.8 Ų137.870%0.69973%0.734SS**THydrogen-bonded Turntrans-86.53.8-175.353.40000116T214T214-S216 PolarHBondContact O-N 2.84Å; T214-S216 PolarHBondContact OG1-OG 3.21Å
217R47Very low50Low202 Ų202137.2 Ų137.276%0.76273%0.73SS**  trans-118.850.1178.8-71.8-163.9137.8-167.6-4.2114.6R213 T214R213-R217 PolarHBondContact NH2-O 2.78Å; T214-R217 PolarHBondContact O-N 3.33Å
218S48.7Very low50.2Low82 Ų82134.6 Ų134.657%0.57373%0.728SS**  trans-99.882.915456.50000108.2V220S218-V220 PolarHBondContact O-N 3.39Å
219Q51.5Low50.2Low183 Ų183133 Ų13386%0.85573%0.729SS**  trans-76.286.6158.4-163.717116.300105.7
220V44.3Very low49.8Very low108 Ų108135.4 Ų135.466%0.65574%0.737SS**  trans-112.9114.9163.9-77.50000105S218 A222S218-V220 PolarHBondContact O-N 3.39Å; V220-A222 PolarHBondContact O-N 3.48Å
221D49.1Very low49.4Very low165 Ų165135.8 Ų135.888%0.88274%0.74SS**  trans-69.462.5172.6-73.8-54.6000110.1
222A54.1Low49.1Very low65 Ų65136.7 Ų136.754%0.53774%0.744SS.*  trans-106.5139.1169.900000108.2V220V220-A222 PolarHBondContact O-N 3.48Å
223P50.7Low49.7Very low114 Ų114140.7 Ų140.774%0.7475%0.753SS**  trans-50.4141.3167.8-18.529.2000108.2S225P223-S225 PolarHBondContact O-N 2.77Å
224P47.7Very low51.1Low124 Ų124133.5 Ų133.581%0.80573%0.73SS**  trans-55.5109.7173.823.6-30.9000106.6
225S51.8Low52.4Low98 Ų98134.4 Ų134.469%0.68573%0.726SS**PPolyproline II helixtrans-48.2133161.2420000105.6P223P223-S225 PolarHBondContact O-N 2.77Å
226P52.9Low53.8Low110 Ų110122.9 Ų122.971%0.71468%0.683SS**PPolyproline II helixtrans-47.7136.7177.320.6-31.2000107.2P228P226-P228 VanDerWaalsContact O-N 3.16Å
227P43.6Very low55.5Low109 Ų109120.4 Ų120.471%0.70867%0.666SS**PPolyproline II helixtrans-47.3133.3172.722.6-31.7000106E229P227-E229 PolarHBondContact O-N 3.33Å
228P52Low57.2Low115 Ų115112.4 Ų112.475%0.74764%0.638SS**PPolyproline II helixtrans-47.6122.8170.121-29.1000104.8P226 E230P226-P228 VanDerWaalsContact O-N 3.16Å; P228-E230 PolarHBondContact O-N 3.44Å
229E46.2Very low58.8Low173 Ų173109 Ų10981%0.80861%0.614SS**  trans-38.8129.9-175.8-62.3-170.5159.600107.1P227 D231P227-E229 PolarHBondContact O-N 3.33Å; E229-D231 PolarHBondContact O-N 2.89Å
230E47.9Very low60.2Low194 Ų194105.7 Ų105.791%0.90759%0.594SS**  trans-44.497.6177.9-84.2-178.2131.400107.8P228 T232P228-E230 PolarHBondContact O-N 3.44Å; E230-T232 PolarHBondContact O-N 3.42Å
231D42Very low61.9Low143 Ų143106.6 Ų106.677%0.76559%0.589SS**  trans-58.9103.8173.3-91.2-38.5000102E229 E233E229-D231 PolarHBondContact O-N 2.89Å; D231-E233 WeakPolarHBondContact O-CA 3.47Å; D231-E233 PolarHBondContact O-N 3.16Å
232T53.1Low62.9Low129 Ų129101.1 Ų101.179%0.79156%0.559SS**  trans-37.1108.9172.447.90000106.2E230 D234E230-T232 PolarHBondContact O-N 3.42Å; T232-D234 WeakPolarHBondContact O-CA 3.48Å; T232-D234 PolarHBondContact O-N 3.22Å
233E60.6Low63.2Low187 Ų187102.9 Ų102.987%0.87457%0.565SS**  trans-36.6109.6-164.3-64.5178.8163.800109D231 K235D231-E233 WeakPolarHBondContact O-CA 3.47Å; D231-E233 PolarHBondContact O-N 3.16Å; E233-K235 WeakPolarHBondContact O-CA 3.28Å; E233-K235 PolarHBondContact O-N 3.1Å
234D76.7Confident63.5Low59 Ų59103.3 Ų103.332%0.31656%0.561SS.*  trans-51.7107.2-168.7170.88.9000107.8T232 F236 S237 R240T232-D234 WeakPolarHBondContact O-CA 3.48Å; T232-D234 PolarHBondContact O-N 3.22Å; D234-F236 PolarHBondContact O-N 3.18Å; D234-F236 PolarHBondContact OD1-N 3.32Å; D234-S237 WeakPolarHBondContact O-CB 3.35Å; D234-S237 PolarHBondContact O-N 2.88Å; D234-S237 PolarHBondContact O-OG 3.44Å; D234-R240 IonicContact OD1-CZ 3.9Å; D234-R240 IonicContact OD1-NH1 3.03Å; D234-R240 PolarHBondContact OD1-NH1 3.19Å; D234-R240 WeakPolarHBondContact OD2-CD 3.39Å; D234-R240 IonicContact OD2-CZ 3.94Å; D234-R240 IonicContact OD2-NE 2.7Å; D234-R240 IonicContact OD2-NH1 3.83Å; D234-R240 PolarHBondContact OD2-NH1 3.21Å
235K79.6Confident63.7Low112 Ų112105 Ų10549%0.48755%0.553SS.*THydrogen-bonded Turntrans-54.9-25.6-171.6-179.3-176.5168.5-158.50110.4E233 E394E233-K235 WeakPolarHBondContact O-CA 3.28Å; E233-K235 PolarHBondContact O-N 3.1Å; K235-E394 WeakPolarHBondContact CE-OE2 3.4Å; K235-E394 IonicContact NZ-OE2 2.78Å; K235-E394 PolarHBondContact NZ-OE2 2.94Å
236F82.8Confident63.6Low8 Ų8107 Ų1074%0.03555%0.552CS.*THydrogen-bonded Turntrans-107.18.7-177.9-52.9-73.8000114.5D234 L238 V239 R240 L391 E394 L395 E398D234-F236 PolarHBondContact O-N 3.18Å; D234-F236 PolarHBondContact OD1-N 3.32Å; F236-L238 PolarHBondContact O-N 2.82Å; F236-L238 VanDerWaalsContact O-N 3.14Å; F236-V239 WeakPolarHBondContact O-CA 3.43Å; F236-V239 PolarHBondContact O-N 3.06Å; F236-R240 HydrophobicContact CB-CG 4.31Å; F236-R240 WeakPolarHBondContact O-CG 3.38Å; F236-R240 PolarHBondContact O-N 3.31Å; F236-L391 WeakPolarHBondContact CD1-O 3.38Å; F236-L391 WeakPolarHBondContact CE1-O 3.41Å; F236-E394 HydrophobicContact CE1-CB 3.69Å; F236-E394 HydrophobicContact CZ-CB 4.08Å; F236-L395 HydrophobicContact CB-CB 4.48Å; F236-L395 HydrophobicContact CB-CD1 3.48Å; F236-L395 VanDerWaalsContact CB-CD1 3.48Å; F236-L395 HydrophobicContact CD1-CB 3.71Å; F236-L395 HydrophobicContact CD1-CD1 4.3Å; F236-L395 HydrophobicContact CE1-CB 4.05Å; F236-L395 HydrophobicContact CG-CB 4.04Å; F236-L395 HydrophobicContact CG-CD1 3.87Å; F236-L395 HydrophobicContact CG-CG 4.43Å; F236-E398 WeakPolarHBondContact CE2-OE2 3.5Å; F236-E398 VanDerWaalsContact CZ-OE1 3.31Å; F236-E398 WeakPolarHBondContact CZ-OE1 3.11Å; F236-E398 WeakPolarHBondContact CZ-OE2 3.24Å
237S83.4Confident63.4Low49 Ų49110.2 Ų110.234%0.34356%0.557SS.*THydrogen-bonded Turntrans-52.8-34.4174.357.80000112.9D234 V239D234-S237 WeakPolarHBondContact O-CB 3.35Å; D234-S237 PolarHBondContact O-N 2.88Å; D234-S237 PolarHBondContact O-OG 3.44Å; S237-V239 PolarHBondContact O-N 3.3Å
238L82.4Confident63.4Low34 Ų34111 Ų11118%0.17856%0.555CS.*THydrogen-bonded Turntrans-72.3-6175.7-69.2176.5000114.2F236 R361 L372 L388F236-L238 PolarHBondContact O-N 2.82Å; F236-L238 VanDerWaalsContact O-N 3.14Å; L238-R361 PolarHBondContact O-NH1 2.9Å; L238-R361 PolarHBondContact O-NH2 2.94Å; L238-L372 HydrophobicContact CD1-CD1 3.93Å; L238-L372 HydrophobicContact CD1-CD2 3.76Å; L238-L372 HydrophobicContact CD1-CG 4.27Å; L238-L372 HydrophobicContact CD2-CD1 4.39Å; L238-L388 HydrophobicContact CB-CD2 4.13Å
239V82.6Confident63.3Low9 Ų9113.8 Ų113.86%0.05556%0.564CS.*THydrogen-bonded Turntrans-118.6-40.8-178.1169.40000111.4F236 S237 R366 L391 K392F236-V239 WeakPolarHBondContact O-CA 3.43Å; F236-V239 PolarHBondContact O-N 3.06Å; S237-V239 PolarHBondContact O-N 3.3Å; V239-R366 PolarHBondContact O-NH1 3.15Å; V239-L391 HydrophobicContact CG2-CB 3.6Å; V239-L391 HydrophobicContact CG2-CD1 4.39Å; V239-K392 HydrophobicContact CB-CG 4.2Å; V239-K392 HydrophobicContact CG1-CB 4.19Å; V239-K392 HydrophobicContact CG1-CD 4.33Å; V239-K392 HydrophobicContact CG1-CG 3.23Å; V239-K392 HydrophobicContact CG2-CG 3.9Å
240R82.1Confident63.6Low115 Ų115111 Ų11143%0.43455%0.551SS.*SBendtrans-59.5150.2179-72.1176.9177.4174.4-2.9111.3D234 F236 L395D234-R240 IonicContact OD1-CZ 3.9Å; D234-R240 IonicContact OD1-NH1 3.03Å; D234-R240 PolarHBondContact OD1-NH1 3.19Å; D234-R240 WeakPolarHBondContact OD2-CD 3.39Å; D234-R240 IonicContact OD2-CZ 3.94Å; D234-R240 IonicContact OD2-NE 2.7Å; D234-R240 IonicContact OD2-NH1 3.83Å; D234-R240 PolarHBondContact OD2-NH1 3.21Å; F236-R240 HydrophobicContact CB-CG 4.31Å; F236-R240 WeakPolarHBondContact O-CG 3.38Å; F236-R240 PolarHBondContact O-N 3.31Å; R240-L395 HydrophobicContact CG-CD1 3.58Å
241K80Confident63.6Low127 Ų127106.5 Ų106.555%0.55254%0.538SS*.BIsolated β-bridgetrans-71.7145.7164.7-75.3-178.9176.4179.40107.9P243 G365K241-P243 WeakPolarHBondContact O-CD 3.4Å; K241-G365 CarbonylContact C-O 3.59Å; K241-G365 VanDerWaalsContact CA-O 3.31Å; K241-G365 WeakPolarHBondContact CA-O 3.27Å
242N68.5Low64.2Low49 Ų49105.4 Ų105.426%0.26254%0.539SS..PPolyproline II helixtrans-73.4121.9-177.5-149.121.9000108.7D244 Y245 G365N242-D244 VanDerWaalsContact C-N 3.26Å; N242-D244 PolarHBondContact O-N 3.19Å; N242-Y245 HydrophobicContact CB-CD2 4.03Å; N242-Y245 PolarHBondContact O-N 3.43Å; N242-Y245 VanDerWaalsContact O-N 3.17Å; N242-G365 PolarHBondContact N-O 2.91Å
243P60.6Low64Low102 Ų102108.4 Ų108.466%0.66254%0.536SS*.G310 helixtrans-59.2-35.9-177.1-24.834.4000113.3K241 Y245 E246K241-P243 WeakPolarHBondContact O-CD 3.4Å; P243-Y245 PolarHBondContact O-N 3.08Å; P243-E246 PolarHBondContact O-N 3.02Å
244D56.5Low63.3Low124 Ų124110.7 Ų110.766%0.66354%0.537SS*.G310 helixtrans-60.1-13.9178.5-72.3-32.5000114.6N242N242-D244 VanDerWaalsContact C-N 3.26Å; N242-D244 PolarHBondContact O-N 3.19Å
245Y51.8Low61.8Low159 Ų159116.2 Ų116.262%0.62456%0.558SS**G310 helixtrans-95.7-5.2177.1-85-93.7000113.5N242 P243N242-Y245 HydrophobicContact CB-CD2 4.03Å; N242-Y245 PolarHBondContact O-N 3.43Å; N242-Y245 VanDerWaalsContact O-N 3.17Å; P243-Y245 PolarHBondContact O-N 3.08Å
246E51.4Low60Low141 Ų141115.6 Ų115.666%0.65957%0.566SS**THydrogen-bonded Turntrans-91.9-13.9178.4-63.9-110.7150.800112.6P243P243-E246 PolarHBondContact O-N 3.02Å
247E48.4Very low58.3Low176 Ų176118 Ų11882%0.82258%0.583SS**SBendtrans-85.6-19.2-176.3-159.6170.3-163.700113.8
248D43.4Very low56.6Low127 Ų127119.9 Ų119.968%0.67959%0.59SS**  trans-102.1102.1170.8-80.2-47000109.7E250D248-E250 HydrophobicContact CB-CB 4.32Å; D248-E250 PolarHBondContact O-N 2.75Å
249D49.3Very low55.1Low172 Ų172125.6 Ų125.692%0.9261%0.609SS**  trans-60.533.2158.3-91.1-50.5000111.8P251D249-P251 VanDerWaalsContact O-CD 3.3Å; D249-P251 WeakPolarHBondContact O-CD 2.98Å
250E52.9Low53.9Low115 Ų115134 Ų13454%0.53765%0.647SS.*  trans-76112171.2-156.4179.3-145.400106.6D248 R253D248-E250 HydrophobicContact CB-CB 4.32Å; D248-E250 PolarHBondContact O-N 2.75Å; E250-R253 IonicContact OE1-NH2 3.44Å; E250-R253 PolarHBondContact OE1-NH2 3.03Å; E250-R253 IonicContact OE2-CZ 3.58Å; E250-R253 IonicContact OE2-NE 3.39Å; E250-R253 PolarHBondContact OE2-NE 2.89Å; E250-R253 IonicContact OE2-NH2 2.89Å; E250-R253 PolarHBondContact OE2-NH2 2.45Å
251P48.5Very low52.6Low100 Ų100138.7 Ų138.765%0.64967%0.665SS**  trans-53.3134.4-178.621.7-32.8000108D249 R253D249-P251 VanDerWaalsContact O-CD 3.3Å; D249-P251 WeakPolarHBondContact O-CD 2.98Å; P251-R253 PolarHBondContact O-N 3.05Å
252P53.1Low52Low120 Ų120135.2 Ų135.278%0.77966%0.655SS**  trans-50.9112.4-174.617-29.3000106.7R254P252-R254 PolarHBondContact O-N 3.28Å
253R48.7Very low51.9Low192 Ų192139.7 Ų139.773%0.72568%0.677SS**  trans-45.3112.1-174.2-70.5-179.8-163.6-140.7-5.8105.1E250 P251 F255E250-R253 IonicContact OE1-NH2 3.44Å; E250-R253 PolarHBondContact OE1-NH2 3.03Å; E250-R253 IonicContact OE2-CZ 3.58Å; E250-R253 IonicContact OE2-NE 3.39Å; E250-R253 PolarHBondContact OE2-NE 2.89Å; E250-R253 IonicContact OE2-NH2 2.89Å; E250-R253 PolarHBondContact OE2-NH2 2.45Å; P251-R253 PolarHBondContact O-N 3.05Å; R253-F255 PolarHBondContact O-N 3.1Å
254R46.8Very low52.5Low235 Ų235139.8 Ų139.889%0.88768%0.678SS**  trans-5798.3180-80.6-176.2-178.8178.11.2104.2P252 C256P252-R254 PolarHBondContact O-N 3.28Å; R254-C256 PolarHBondContact O-N 3.42Å
255F46.3Very low53.7Low175 Ų175135.5 Ų135.577%0.76865%0.654SS**  trans-75.983.3173.3-154.6-89.7000102.3R253 C257R253-F255 PolarHBondContact O-N 3.1Å; F255-C257 HydrophobicContact CD1-CB 3.66Å; F255-C257 HydrophobicContact CE1-CB 3.85Å; F255-C257 PolarHBondContact O-N 3.32Å; F255-C257 PolarHBondContact O-SG 3.01Å
256C40.3Very low55.2Low98 Ų98133.1 Ų133.166%0.66266%0.655SS**  trans-60.772.2150.2-66.10000105R254 N258R254-C256 PolarHBondContact O-N 3.42Å; C256-N258 VanDerWaalsContact C-N 3.28Å; C256-N258 PolarHBondContact O-N 3.31Å
257C47.1Very low56.8Low58 Ų58129.1 Ų129.139%0.39264%0.641SS.*  trans-50.8113.6147.537.90000102.5F255 R259F255-C257 HydrophobicContact CD1-CB 3.66Å; F255-C257 HydrophobicContact CE1-CB 3.85Å; F255-C257 PolarHBondContact O-N 3.32Å; F255-C257 PolarHBondContact O-SG 3.01Å; C257-R259 PolarHBondContact O-N 3.35Å
258N47.9Very low58.6Low89 Ų89124.2 Ų124.248%0.47662%0.615SS.*  trans-54.991.1170.9-81.71.7000106C256 Q260 R261C256-N258 VanDerWaalsContact C-N 3.28Å; C256-N258 PolarHBondContact O-N 3.31Å; N258-Q260 PolarHBondContact O-N 3.29Å; N258-R261 HydrophobicContact CB-CB 4.31Å; N258-R261 HydrophobicContact CB-CG 3.95Å; N258-R261 PolarHBondContact O-N 3.28Å
259R51.8Low60.7Low155 Ų155120.5 Ų120.559%0.58560%0.598SS**G310 helixtrans-57.9-24.1178.5-158.4176.2-167.9-1263.6109.3C257 R261 T262 E316C257-R259 PolarHBondContact O-N 3.35Å; R259-R261 VanDerWaalsContact C-N 3.25Å; R259-R261 PolarHBondContact O-N 3.32Å; R259-T262 PolarHBondContact O-N 3.35Å; R259-T262 PolarHBondContact O-OG1 3.46Å; R259-E316 PolarHBondContact NH2-O 3.45Å
260Q56.4Low62.7Low184 Ų184113.5 Ų113.586%0.8656%0.561SS**G310 helixtrans-62.5-17.6170.4-63.5172.3-1800115N258N258-Q260 PolarHBondContact O-N 3.29Å
261R55.8Low64.4Low214 Ų214115.8 Ų115.881%0.80857%0.572SS**G310 helixtrans-108.6-4.9179.3-62.8-173.772.51713.6113.7N258 R259N258-R261 HydrophobicContact CB-CB 4.31Å; N258-R261 HydrophobicContact CB-CG 3.95Å; N258-R261 PolarHBondContact O-N 3.28Å; R259-R261 VanDerWaalsContact C-N 3.25Å; R259-R261 PolarHBondContact O-N 3.32Å
262T66.4Low66.4Low55 Ų55116.3 Ų116.334%0.33757%0.565SS.*SBendtrans-89.8132.917547.40000109.4R259R259-T262 PolarHBondContact O-N 3.35Å; R259-T262 PolarHBondContact O-OG1 3.46Å
263I67.1Low68.2Low142 Ų142111.7 Ų111.773%0.72853%0.534SS*.PPolyproline II helixtrans-53.1126.5174.5-60.7168.3000107.8H265I263-H265 PolarHBondContact O-N 2.75Å
264P72.1Confident70.4Confident104 Ų104105.6 Ų105.668%0.67552%0.518SS*.BIsolated β-bridgetrans-58.8135.7178.922.8-31.1000109.2V266P264-V266 PolarHBondContact O-N 3.26Å
265H82.5Confident72.6Confident35 Ų3599 Ų9916%0.16250%0.497CS..PPolyproline II helixtrans-70.1117.9176.2177.663.8000108.7I263 C312 N314 C317I263-H265 PolarHBondContact O-N 2.75Å; H265-C312 PolarHBondContact CE1-O 2.98Å; H265-C312 VanDerWaalsContact CE1-O 3.23Å; H265-C312 PolarHBondContact NE2-O 3.43Å; H265-N314 PolarHBondContact CD2-O 3.14Å; H265-C317 WeakPolarHBondContact CB-O 3.42Å
266V82.8Confident74.8Confident108 Ų10895.9 Ų95.966%0.65549%0.488SS*.  trans-94.6113.3173.9-176.70000107.1P264 R268 N311P264-V266 PolarHBondContact O-N 3.26Å; V266-R268 PolarHBondContact O-N 2.89Å; V266-N311 PolarHBondContact O-ND2 3.19Å
267V86Confident77.3Confident58 Ų5892.9 Ų92.935%0.35246%0.464SS..  trans-72.2110.1171.3179.80000106.9
268R86.1Confident79.5Confident73 Ų7390.8 Ų90.828%0.27545%0.449SS..  trans-92.2122.7-179.9176.7-178.8174.1-171.2-2.8108.7V266 E272 E277 N311 R313V266-R268 PolarHBondContact O-N 2.89Å; R268-E272 HydrophobicContact CG-CB 4.16Å; R268-E272 VanDerWaalsContact CG-OE2 3.31Å; R268-E272 WeakPolarHBondContact CG-OE2 3.29Å; R268-E272 IonicContact NE-OE2 3.68Å; R268-E272 PolarHBondContact NH2-O 3.35Å; R268-E277 IonicContact CZ-OE1 3.67Å; R268-E277 IonicContact CZ-OE2 3.41Å; R268-E277 VanDerWaalsContact NH1-CD 3.35Å; R268-E277 IonicContact NH1-OE1 2.71Å; R268-E277 PolarHBondContact NH1-OE1 3.44Å; R268-E277 IonicContact NH1-OE2 2.72Å; R268-E277 PolarHBondContact NH1-OE2 3.48Å; R268-E277 VanDerWaalsContact NH2-CD 3.31Å; R268-E277 IonicContact NH2-OE1 3.42Å; R268-E277 PolarHBondContact NH2-OE1 3.09Å; R268-E277 VanDerWaalsContact NH2-OE1 3.14Å; R268-E277 IonicContact NH2-OE2 3.14Å; R268-E277 PolarHBondContact NH2-OE2 3.41Å; R268-N311 PolarHBondContact N-OD1 3.42Å; R268-R313 PolarHBondContact O-NH1 3.22Å; R268-R313 PolarHBondContact O-NH2 3.37Å; R268-R313 VanDerWaalsContact O-NH2 3.16Å
269P87.8Confident81.7Confident49 Ų4992.7 Ų92.732%0.31846%0.455SS..  trans-59.5166-176.826.3-35.4000113.8E271 E272 R313P269-E271 WeakPolarHBondContact CB-OE2 3.42Å; P269-E272 WeakPolarHBondContact CD-OE1 3.44Å; P269-E272 HydrophobicContact CG-CB 4.23Å; P269-E272 HydrophobicContact CG-CG 3.72Å; P269-E272 WeakPolarHBondContact CG-OE1 3.47Å; P269-R313 PolarHBondContact O-NH2 3.37Å
270V90.7Very high83.8Confident25 Ų2591.9 Ų91.915%0.15245%0.452CS..SBendtrans-73.6-35.5-175175.50000110.7E272 I273 L342 P344V270-E272 PolarHBondContact O-N 2.92Å; V270-I273 WeakPolarHBondContact O-CB 3.25Å; V270-I273 WeakPolarHBondContact O-CG1 3.48Å; V270-I273 PolarHBondContact O-N 3.42Å; V270-I273 VanDerWaalsContact O-N 3.09Å; V270-L342 HydrophobicContact CG1-CD2 4.46Å; V270-L342 WeakPolarHBondContact CG1-O 3.49Å; V270-P344 HydrophobicContact CG2-CB 3.85Å
271E87.9Confident85.6Confident163 Ų16383.9 Ų83.976%0.76242%0.415SS*.THydrogen-bonded Turntrans-66.3-27.1-176.4-58.772.7-159.100112.2P269 I273P269-E271 WeakPolarHBondContact CB-OE2 3.42Å; E271-I273 PolarHBondContact O-N 2.84Å
272E89.9Confident87.5Confident111 Ų11173.9 Ų73.952%0.51938%0.378SS..THydrogen-bonded Turntrans-73.2-13.9177-79.1177.3-151.300112.9R268 P269 V270 T274R268-E272 HydrophobicContact CG-CB 4.16Å; R268-E272 VanDerWaalsContact CG-OE2 3.31Å; R268-E272 WeakPolarHBondContact CG-OE2 3.29Å; R268-E272 IonicContact NE-OE2 3.68Å; R268-E272 PolarHBondContact NH2-O 3.35Å; P269-E272 WeakPolarHBondContact CD-OE1 3.44Å; P269-E272 HydrophobicContact CG-CB 4.23Å; P269-E272 HydrophobicContact CG-CG 3.72Å; P269-E272 WeakPolarHBondContact CG-OE1 3.47Å; V270-E272 PolarHBondContact O-N 2.92Å; E272-T274 PolarHBondContact O-N 2.96Å
273I92.5Very high88.7Confident23 Ų2375 Ų7512%0.11838%0.382CS..  trans-75.3115.8-173.5-57.7176.4000109.2V270 E271 L278 L341V270-I273 WeakPolarHBondContact O-CB 3.25Å; V270-I273 WeakPolarHBondContact O-CG1 3.48Å; V270-I273 PolarHBondContact O-N 3.42Å; V270-I273 VanDerWaalsContact O-N 3.09Å; E271-I273 PolarHBondContact O-N 2.84Å; I273-L278 HydrophobicContact CG2-CD2 3.8Å; I273-L278 HydrophobicContact CG2-CG 4.11Å; I273-L341 HydrophobicContact CD1-CB 3.79Å; I273-L341 HydrophobicContact CD1-CD2 4.04Å; I273-L341 HydrophobicContact CD1-CG 4.44Å; I273-L341 WeakPolarHBondContact CD1-O 3.48Å
274T93.9Very high90Very high64 Ų6471.8 Ų71.839%0.39337%0.366SS..  trans-82.3148.2-177.860.80000110.8E272 L276 E277 L278E272-T274 PolarHBondContact O-N 2.96Å; T274-L276 PolarHBondContact O-N 2.99Å; T274-E277 PolarHBondContact N-OE2 3.3Å; T274-E277 WeakPolarHBondContact O-CB 3.29Å; T274-E277 PolarHBondContact O-N 3.49Å; T274-E277 VanDerWaalsContact OG1-CG 3.24Å; T274-E277 WeakPolarHBondContact OG1-CG 3.46Å; T274-E277 PolarHBondContact OG1-N 3.48Å; T274-E277 PolarHBondContact OG1-OE2 3.4Å; T274-E277 VanDerWaalsContact OG1-OE2 3.06Å; T274-L278 PolarHBondContact O-N 3.31Å
275E93.9Very high90.9Very high96 Ų9670.9 Ų70.945%0.44936%0.358SS..Hα-helixtrans-57.9-33174.7-173.856.7-139.300111.8E277 L278 Q279 R338E275-E277 PolarHBondContact O-N 3.44Å; E275-L278 WeakPolarHBondContact O-CB 3.21Å; E275-L278 PolarHBondContact O-N 3.06Å; E275-L278 VanDerWaalsContact O-N 3.11Å; E275-Q279 WeakPolarHBondContact O-CG 3.49Å; E275-Q279 PolarHBondContact O-N 2.9Å; E275-R338 IonicContact OE1-CZ 3.96Å; E275-R338 IonicContact OE1-NH2 2.8Å; E275-R338 PolarHBondContact OE1-NH2 3.34Å
276L92.6Very high91.4Very high110 Ų11081.1 Ų81.158%0.57640%0.396SS*.Hα-helixtrans-62.9-28.1174.7-64.8176.7000113.2T274 R280T274-L276 PolarHBondContact O-N 2.99Å; L276-R280 WeakPolarHBondContact O-CB 3.25Å; L276-R280 VanDerWaalsContact O-CG 3.31Å; L276-R280 WeakPolarHBondContact O-CG 3.06Å; L276-R280 PolarHBondContact O-N 3.24Å; L276-R280 PolarHBondContact O-NE 3.1Å
277E92.1Very high91.8Very high34 Ų3480.6 Ų80.616%0.15939%0.386CS..Hα-helixtrans-75.7-38.4173.2-74.1167.3142.600111.3R268 T274 E275 Q279 R280 T308R268-E277 IonicContact CZ-OE1 3.67Å; R268-E277 IonicContact CZ-OE2 3.41Å; R268-E277 VanDerWaalsContact NH1-CD 3.35Å; R268-E277 IonicContact NH1-OE1 2.71Å; R268-E277 PolarHBondContact NH1-OE1 3.44Å; R268-E277 IonicContact NH1-OE2 2.72Å; R268-E277 PolarHBondContact NH1-OE2 3.48Å; R268-E277 VanDerWaalsContact NH2-CD 3.31Å; R268-E277 IonicContact NH2-OE1 3.42Å; R268-E277 PolarHBondContact NH2-OE1 3.09Å; R268-E277 VanDerWaalsContact NH2-OE1 3.14Å; R268-E277 IonicContact NH2-OE2 3.14Å; R268-E277 PolarHBondContact NH2-OE2 3.41Å; T274-E277 PolarHBondContact N-OE2 3.3Å; T274-E277 WeakPolarHBondContact O-CB 3.29Å; T274-E277 PolarHBondContact O-N 3.49Å; T274-E277 VanDerWaalsContact OG1-CG 3.24Å; T274-E277 WeakPolarHBondContact OG1-CG 3.46Å; T274-E277 PolarHBondContact OG1-N 3.48Å; T274-E277 PolarHBondContact OG1-OE2 3.4Å; T274-E277 VanDerWaalsContact OG1-OE2 3.06Å; E275-E277 PolarHBondContact O-N 3.44Å; E277-Q279 VanDerWaalsContact C-N 3.31Å; E277-Q279 PolarHBondContact O-N 3.07Å; E277-R280 PolarHBondContact O-N 3.5Å; E277-T308 HydrophobicContact CB-CG2 3.99Å; E277-T308 WeakPolarHBondContact O-CB 3.15Å; E277-T308 PolarHBondContact O-OG1 3.31Å
278L94.2Very high92.1Very high14 Ų1478.6 Ų78.67%0.07337%0.373CS..Hα-helixtrans-64.4-36.8175.2-59.5-178.3000111.7I273 T274 E275 R280 I281 R338 L341 L342I273-L278 HydrophobicContact CG2-CD2 3.8Å; I273-L278 HydrophobicContact CG2-CG 4.11Å; T274-L278 PolarHBondContact O-N 3.31Å; E275-L278 WeakPolarHBondContact O-CB 3.21Å; E275-L278 PolarHBondContact O-N 3.06Å; E275-L278 VanDerWaalsContact O-N 3.11Å; L278-R280 VanDerWaalsContact C-N 3.32Å; L278-R280 PolarHBondContact O-N 3.2Å; L278-I281 HydrophobicContact CB-CD1 4.48Å; L278-I281 HydrophobicContact CD2-CD1 4.15Å; L278-I281 WeakPolarHBondContact O-CB 3.4Å; L278-I281 WeakPolarHBondContact O-CD1 3.47Å; L278-I281 VanDerWaalsContact O-CG1 3.25Å; L278-I281 WeakPolarHBondContact O-CG1 3.38Å; L278-I281 PolarHBondContact O-N 3.03Å; L278-R338 HydrophobicContact CB-CG 4.18Å; L278-R338 HydrophobicContact CD1-CG 4.34Å; L278-R338 HydrophobicContact CD2-CG 3.87Å; L278-R338 HydrophobicContact CG-CG 4.35Å; L278-L341 HydrophobicContact CD2-CB 4.22Å; L278-L341 HydrophobicContact CD2-CD1 3.88Å; L278-L342 HydrophobicContact CD1-CD2 4.32Å
279Q94.1Very high92.5Very high130 Ų13079.4 Ų79.461%0.60739%0.386SS*.Hα-helixtrans-70.3-26.1174.5-69.1174.44.800113.4E275 E277 I281E275-Q279 WeakPolarHBondContact O-CG 3.49Å; E275-Q279 PolarHBondContact O-N 2.9Å; E277-Q279 VanDerWaalsContact C-N 3.31Å; E277-Q279 PolarHBondContact O-N 3.07Å; Q279-I281 PolarHBondContact O-N 3.29Å
280R94.4Very high92.9Very high138 Ų13883.2 Ų83.252%0.52140%0.395SS..THydrogen-bonded Turntrans-835.1176.9-79.4-177.5-74.8164.2-5.5113.8L276 E277 L278 C282 D307 T308L276-R280 WeakPolarHBondContact O-CB 3.25Å; L276-R280 VanDerWaalsContact O-CG 3.31Å; L276-R280 WeakPolarHBondContact O-CG 3.06Å; L276-R280 PolarHBondContact O-N 3.24Å; L276-R280 PolarHBondContact O-NE 3.1Å; E277-R280 PolarHBondContact O-N 3.5Å; L278-R280 VanDerWaalsContact C-N 3.32Å; L278-R280 PolarHBondContact O-N 3.2Å; R280-C282 PolarHBondContact O-N 3.22Å; R280-D307 WeakPolarHBondContact O-CA 3.41Å; R280-T308 WeakPolarHBondContact CB-OG1 3.37Å; R280-T308 PolarHBondContact O-N 2.81Å; R280-T308 VanDerWaalsContact O-N 3.13Å
281I95.5Very high93Very high15 Ų1584.5 Ų84.58%0.07740%0.401CS..  trans-68.5127.7173.1-64.2170.7000108.6L278 Q279 V337 R338 L341L278-I281 HydrophobicContact CB-CD1 4.48Å; L278-I281 HydrophobicContact CD2-CD1 4.15Å; L278-I281 WeakPolarHBondContact O-CB 3.4Å; L278-I281 WeakPolarHBondContact O-CD1 3.47Å; L278-I281 VanDerWaalsContact O-CG1 3.25Å; L278-I281 WeakPolarHBondContact O-CG1 3.38Å; L278-I281 PolarHBondContact O-N 3.03Å; Q279-I281 PolarHBondContact O-N 3.29Å; I281-V337 HydrophobicContact CD1-CB 4.16Å; I281-V337 HydrophobicContact CD1-CG1 3.83Å; I281-V337 HydrophobicContact CG1-CG1 3.97Å; I281-V337 HydrophobicContact CG2-CB 3.94Å; I281-V337 HydrophobicContact CG2-CG1 4.2Å; I281-R338 HydrophobicContact CD1-CB 3.96Å; I281-R338 HydrophobicContact CD1-CG 3.9Å; I281-L341 HydrophobicContact CD1-CD1 4.24Å
282C94.6Very high93.3Very high5 Ų581.3 Ų81.33%0.03440%0.397CS..  trans-77.2129.8171.6670000110R280 K288 D307 G326 P327R280-C282 PolarHBondContact O-N 3.22Å; C282-K288 HydrophobicContact CB-CG 4.17Å; C282-D307 HydrophobicContact CB-CB 3.91Å; C282-D307 PolarHBondContact SG-OD2 3.32Å; C282-G326 WeakPolarHBondContact O-CA 3.39Å; C282-P327 WeakPolarHBondContact O-CD 3.44Å; C282-P327 WeakPolarHBondContact SG-CD 3.39Å
283N92.8Very high93.4Very high77 Ų7780.9 Ų80.941%0.41241%0.406SS..  trans-97-30.8175.8-68.6-36.3000110.9E287 R330N283-E287 PolarHBondContact N-OE2 3.37Å; N283-R330 PolarHBondContact O-NH2 2.92Å
284N92.8Very high93.3Very high75 Ų7584.9 Ų84.940%0.40143%0.431SS..SBendtrans-121156.3180-62.5-50.3000112.3R286 E287N284-R286 PolarHBondContact O-N 2.7Å; N284-E287 HydrophobicContact CB-CG 4.3Å; N284-E287 PolarHBondContact N-OE2 3.4Å; N284-E287 VanDerWaalsContact N-OE2 3.08Å; N284-E287 PolarHBondContact ND2-OE1 3.44Å; N284-E287 PolarHBondContact O-N 2.94Å
285V91.6Very high93.2Very high85 Ų8582.4 Ų82.452%0.51542%0.418SS..G310 helixtrans-64.9-30.6177.5-177.50000111.4E287 K288 P327V285-E287 VanDerWaalsContact C-N 3.31Å; V285-E287 PolarHBondContact O-N 2.86Å; V285-K288 HydrophobicContact CG1-CD 4.49Å; V285-K288 WeakPolarHBondContact O-CB 3.37Å; V285-K288 PolarHBondContact O-N 3.33Å; V285-P327 HydrophobicContact CG2-CB 4Å; V285-P327 HydrophobicContact CG2-CG 4.32Å
286R92.7Very high93.2Very high250 Ų25079.7 Ų79.794%0.94341%0.41SS*.G310 helixtrans-69.4-26.1179.8-65.4-177.5179.2178.1-0.7113.6N284 K288N284-R286 PolarHBondContact O-N 2.7Å; R286-K288 PolarHBondContact O-N 2.9Å
287E91.3Very high93.3Very high98 Ų9875.9 Ų75.946%0.45839%0.392SS..G310 helixtrans-81-6.2179.9-67.3156.4-160.100112.4N283 N284 V285 V289N283-E287 PolarHBondContact N-OE2 3.37Å; N284-E287 HydrophobicContact CB-CG 4.3Å; N284-E287 PolarHBondContact N-OE2 3.4Å; N284-E287 VanDerWaalsContact N-OE2 3.08Å; N284-E287 PolarHBondContact ND2-OE1 3.44Å; N284-E287 PolarHBondContact O-N 2.94Å; V285-E287 VanDerWaalsContact C-N 3.31Å; V285-E287 PolarHBondContact O-N 2.86Å; E287-V289 PolarHBondContact O-N 3.44Å
288K93Very high93.4Very high15 Ų1574.4 Ų74.47%0.06539%0.385CS..PPolyproline II helixtrans-73117.9-177.7-70.8-177.6171-175.80111.3C282 V285 R286 Y290 T305 C325C282-K288 HydrophobicContact CB-CG 4.17Å; V285-K288 HydrophobicContact CG1-CD 4.49Å; V285-K288 WeakPolarHBondContact O-CB 3.37Å; V285-K288 PolarHBondContact O-N 3.33Å; R286-K288 PolarHBondContact O-N 2.9Å; K288-Y290 HydrophobicContact CB-CE2 4.48Å; K288-T305 HydrophobicContact CB-CG2 4.1Å; K288-T305 HydrophobicContact CD-CG2 4.49Å; K288-C325 PolarHBondContact NZ-SG 2.82Å
289V94.8Very high93.3Very high91 Ų9174.6 Ų74.655%0.55239%0.385SS*.PPolyproline II helixtrans-94.7118.8170.3-178.20000109.4E287 T305 T306E287-V289 PolarHBondContact O-N 3.44Å; V289-T305 WeakPolarHBondContact O-CA 3.25Å; V289-T305 WeakPolarHBondContact O-CB 3.36Å; V289-T306 PolarHBondContact O-N 3.07Å
290Y95.3Very high93.2Very high129 Ų12969.6 Ų69.651%0.50636%0.362SS..BIsolated β-bridgetrans-82.1133-179.5-64.8-89000111.1K288 Q303 K304 T305K288-Y290 HydrophobicContact CB-CE2 4.48Å; Y290-Q303 HydrophobicContact CD1-CB 4.42Å; Y290-Q303 HydrophobicContact CE1-CB 3.83Å; Y290-Q303 HydrophobicContact CE1-CG 3.79Å; Y290-Q303 PolarHBondContact OH-NE2 2.98Å; Y290-Q303 PolarHBondContact OH-OE1 2.99Å; Y290-K304 WeakPolarHBondContact CA-O 3.2Å; Y290-T305 HydrophobicContact CD1-CG2 3.66Å; Y290-T305 HydrophobicContact CE1-CG2 3.88Å; Y290-T305 HydrophobicContact CG-CG2 4.15Å
291N93.4Very high93.2Very high51 Ų5165 Ų6527%0.27335%0.35SS..  trans-147.6118.2174-170-44.8000109.7S293 T294 G295 K304 T306N291-S293 PolarHBondContact OD1-N 2.95Å; N291-S293 PolarHBondContact OD1-OG 3.08Å; N291-T294 PolarHBondContact ND2-OG1 3.13Å; N291-T294 VanDerWaalsContact ND2-OG1 3.1Å; N291-T294 PolarHBondContact OD1-N 3.1Å; N291-T294 PolarHBondContact OD1-OG1 3Å; N291-G295 VanDerWaalsContact O-CA 3.25Å; N291-G295 WeakPolarHBondContact O-CA 3.23Å; N291-G295 PolarHBondContact O-N 3.12Å; N291-K304 PolarHBondContact N-O 2.91Å; N291-K304 VanDerWaalsContact N-O 3.1Å; N291-K304 WeakPolarHBondContact O-CB 3.36Å; N291-T306 HydrophobicContact CB-CG2 3.58Å
292S93.2Very high93Very high97 Ų9770.7 Ų70.768%0.67837%0.371SS*.THydrogen-bonded Turntrans-78.3-25.1-175.757.50000113.9K304S292-K304 PolarHBondContact O-NZ 3.31Å
293S92.6Very high93Very high101 Ų10173.4 Ų73.471%0.70638%0.383SS*.THydrogen-bonded Turntrans-92.7-48-174.959.30000112.6N291N291-S293 PolarHBondContact OD1-N 2.95Å; N291-S293 PolarHBondContact OD1-OG 3.08Å
294T90.9Very high93.1Very high107 Ų10774.4 Ų74.466%0.65638%0.384SS*.THydrogen-bonded Turntrans-104.5-14.1-177.362.10000113.7N291N291-T294 PolarHBondContact ND2-OG1 3.13Å; N291-T294 VanDerWaalsContact ND2-OG1 3.1Å; N291-T294 PolarHBondContact OD1-N 3.1Å; N291-T294 PolarHBondContact OD1-OG1 3Å
295G92Very high93.2Very high12 Ų1270.9 Ų70.912%0.12437%0.365CS..PPolyproline II helixtrans-71.6141.4-177.800000113.1N291 T305N291-G295 VanDerWaalsContact O-CA 3.25Å; N291-G295 WeakPolarHBondContact O-CA 3.23Å; N291-G295 PolarHBondContact O-N 3.12Å; G295-T305 VanDerWaalsContact CA-O 3.3Å; G295-T305 WeakPolarHBondContact CA-O 3.38Å
296S92.8Very high93.4Very high39 Ų3970 Ų7027%0.27336%0.359SS..EExtended strand (participates in β ladder)trans-84.7148.9171.156.10000110.5K304 T305 K309S296-K304 WeakPolarHBondContact O-CA 3.38Å; S296-T305 PolarHBondContact N-O 3.31Å; S296-T305 PolarHBondContact O-N 3.05Å; S296-T305 VanDerWaalsContact O-N 3.1Å; S296-K309 WeakPolarHBondContact O-CE 3.35Å; S296-K309 PolarHBondContact O-NZ 3.35Å; S296-K309 WeakPolarHBondContact OG-CD 3.45Å; S296-K309 PolarHBondContact OG-NZ 3.32Å
297T94.3Very high93.5Very high31 Ų3158.6 Ų58.619%0.1932%0.317CS..EExtended strand (participates in β ladder)trans-90.4133.3-178.650.60000111.5Q303 K304 V320 Q323T297-Q303 WeakPolarHBondContact CA-O 3.19Å; T297-K304 HydrophobicContact CG2-CD 4.09Å; T297-K304 HydrophobicContact CG2-CG 3.37Å; T297-V320 WeakPolarHBondContact OG1-CB 3.5Å; T297-V320 WeakPolarHBondContact OG1-CG1 3.13Å; T297-Q323 WeakPolarHBondContact O-CB 3.33Å; T297-Q323 PolarHBondContact O-OE1 3.32Å
298C94.4Very high93.7Very high2 Ų254.9 Ų54.91%0.01430%0.301CS..PPolyproline II helixtrans-78.6136167.3176.80000111.2Q300 C301 R302 Q303 K309 Q323 C325C298-Q300 VanDerWaalsContact C-N 3.27Å; C298-Q300 PolarHBondContact O-N 3.46Å; C298-Q300 PolarHBondContact SG-N 2.95Å; C298-Q300 VanDerWaalsContact SG-N 3.44Å; C298-C301 VanDerWaalsContact CB-SG 3.51Å; C298-R302 WeakPolarHBondContact O-CA 2.97Å; C298-R302 PolarHBondContact O-N 3.1Å; C298-Q303 PolarHBondContact N-O 3.29Å; C298-Q303 VanDerWaalsContact N-O 3.08Å; C298-K309 HydrophobicContact CB-CD 4.36Å; C298-Q323 CarbonylContact C-O 3.28Å; C298-C325 HydrophobicContact CB-CB 4.36Å
299H93.3Very high93.8Very high19 Ų1954.9 Ų54.99%0.08830%0.301CS..THydrogen-bonded Turntrans-57.3-40.8175.5-178.566.6000112.5V320 Q323 F324 C357H299-V320 WeakPolarHBondContact CB-O 3.3Å; H299-Q323 WeakPolarHBondContact CB-O 3.49Å; H299-Q323 PolarHBondContact N-O 2.92Å; H299-F324 HydrophobicContact CB-CE1 4.03Å; H299-F324 HydrophobicContact CB-CE2 4.1Å; H299-F324 HydrophobicContact CB-CZ 3.8Å; H299-F324 AromaticContact CD2-CE1 3.94Å; H299-F324 AromaticContact CD2-CZ 3.54Å; H299-F324 AromaticContact CG-CZ 3.94Å; H299-C357 PolarHBondContact NE2-SG 3.35Å; H299-C357 VanDerWaalsContact NE2-SG 3.4Å
300Q92.5Very high93.8Very high25 Ų2550.6 Ų50.612%0.11728%0.276CS..THydrogen-bonded Turntrans-80.9-58.3-171.8-174.47051.700113C298 F324 C328 R332 Y333C298-Q300 VanDerWaalsContact C-N 3.27Å; C298-Q300 PolarHBondContact O-N 3.46Å; C298-Q300 PolarHBondContact SG-N 2.95Å; C298-Q300 VanDerWaalsContact SG-N 3.44Å; Q300-F324 HydrophobicContact CB-CD1 4.16Å; Q300-F324 HydrophobicContact CB-CE1 4.08Å; Q300-C328 HydrophobicContact CB-CB 3.88Å; Q300-C328 HydrophobicContact CG-CB 4.13Å; Q300-R332 VanDerWaalsContact CD-NE 3.27Å; Q300-R332 VanDerWaalsContact CG-CD 3.47Å; Q300-R332 VanDerWaalsContact NE2-NE 3.19Å; Q300-Y333 PolarHBondContact OE1-OH 3.02Å
301C92.7Very high93.7Very high40 Ų4046 Ų4627%0.2726%0.26SS..THydrogen-bonded Turntrans-90-8.3-177.266.50000113.1C298 Q303C298-C301 VanDerWaalsContact CB-SG 3.51Å; C301-Q303 HydrophobicContact CB-CG 4.25Å; C301-Q303 PolarHBondContact O-N 3.18Å; C301-Q303 PolarHBondContact SG-OE1 2.94Å; C301-Q303 VanDerWaalsContact SG-OE1 3.35Å
302R92.6Very high93.8Very high136 Ų13643.6 Ų43.651%0.51325%0.247SC..  trans59.311.1177.9-56.1176.5170.2-137.1-16.6114.7C298C298-R302 WeakPolarHBondContact O-CA 2.97Å; C298-R302 PolarHBondContact O-N 3.1Å
303Q93.6Very high93.7Very high61 Ų6140.1 Ų40.129%0.28522%0.219SC..  trans-78.6139.3177.5-68.1168.4-15.800110.1Y290 T297 C298 C301 T305Y290-Q303 HydrophobicContact CD1-CB 4.42Å; Y290-Q303 HydrophobicContact CE1-CB 3.83Å; Y290-Q303 HydrophobicContact CE1-CG 3.79Å; Y290-Q303 PolarHBondContact OH-NE2 2.98Å; Y290-Q303 PolarHBondContact OH-OE1 2.99Å; T297-Q303 WeakPolarHBondContact CA-O 3.19Å; C298-Q303 PolarHBondContact N-O 3.29Å; C298-Q303 VanDerWaalsContact N-O 3.08Å; C301-Q303 HydrophobicContact CB-CG 4.25Å; C301-Q303 PolarHBondContact O-N 3.18Å; C301-Q303 PolarHBondContact SG-OE1 2.94Å; C301-Q303 VanDerWaalsContact SG-OE1 3.35Å; Q303-T305 HydrophobicContact CB-CG2 4.35Å
304K95.2Very high93.7Very high99 Ų9936.4 Ų36.443%0.4319%0.191SC..EExtended strand (participates in β ladder)trans-94114.2171.4-70.6-171.8178.4-157.80110.1Y290 N291 S292 S296 T297Y290-K304 WeakPolarHBondContact CA-O 3.2Å; N291-K304 PolarHBondContact N-O 2.91Å; N291-K304 VanDerWaalsContact N-O 3.1Å; N291-K304 WeakPolarHBondContact O-CB 3.36Å; S292-K304 PolarHBondContact O-NZ 3.31Å; S296-K304 WeakPolarHBondContact O-CA 3.38Å; T297-K304 HydrophobicContact CG2-CD 4.09Å; T297-K304 HydrophobicContact CG2-CG 3.37Å
305T95.8Very high93.6Very high0 Ų036.4 Ų36.40%019%0.193CC..EExtended strand (participates in β ladder)trans-141.2155-172.145.10000110K288 V289 Y290 G295 S296 Q303 D307 K309K288-T305 HydrophobicContact CB-CG2 4.1Å; K288-T305 HydrophobicContact CD-CG2 4.49Å; V289-T305 WeakPolarHBondContact O-CA 3.25Å; V289-T305 WeakPolarHBondContact O-CB 3.36Å; Y290-T305 HydrophobicContact CD1-CG2 3.66Å; Y290-T305 HydrophobicContact CE1-CG2 3.88Å; Y290-T305 HydrophobicContact CG-CG2 4.15Å; G295-T305 VanDerWaalsContact CA-O 3.3Å; G295-T305 WeakPolarHBondContact CA-O 3.38Å; S296-T305 PolarHBondContact N-O 3.31Å; S296-T305 PolarHBondContact O-N 3.05Å; S296-T305 VanDerWaalsContact O-N 3.1Å; Q303-T305 HydrophobicContact CB-CG2 4.35Å; T305-D307 VanDerWaalsContact C-N 3.3Å; T305-D307 WeakPolarHBondContact CB-OD1 3.48Å; T305-D307 PolarHBondContact OG1-OD1 3.41Å; T305-K309 PolarHBondContact O-NZ 3.24Å; T305-K309 WeakPolarHBondContact OG1-CE 3.5Å; T305-K309 PolarHBondContact OG1-NZ 2.9Å
306T95.8Very high93.4Very high66 Ų6642.3 Ų42.341%0.40522%0.217SC..SBendtrans-82-7.2-176.254.10000114V289 N291V289-T306 PolarHBondContact O-N 3.07Å; N291-T306 HydrophobicContact CB-CG2 3.58Å
307D94.9Very high93.2Very high11 Ų1140.7 Ų40.76%0.05921%0.206CC..SBendtrans-62.4148.8176.764.4-49.7000112.2R280 C282 T305 K309 C325R280-D307 WeakPolarHBondContact O-CA 3.41Å; C282-D307 HydrophobicContact CB-CB 3.91Å; C282-D307 PolarHBondContact SG-OD2 3.32Å; T305-D307 VanDerWaalsContact C-N 3.3Å; T305-D307 WeakPolarHBondContact CB-OD1 3.48Å; T305-D307 PolarHBondContact OG1-OD1 3.41Å; D307-K309 PolarHBondContact O-N 2.9Å; D307-K309 PolarHBondContact O-NZ 2.61Å; D307-K309 VanDerWaalsContact O-NZ 3.13Å; D307-K309 IonicContact OD1-NZ 2.69Å; D307-K309 PolarHBondContact OD1-NZ 3.01Å; D307-K309 IonicContact OD2-NZ 3.2Å; D307-C325 WeakPolarHBondContact OD2-CB 3.09Å
308T95Very high92.9Very high20 Ų2042 Ų4212%0.12321%0.209CC..  trans-65.9130.1171.6-51.60000109.5E277 R280 L341E277-T308 HydrophobicContact CB-CG2 3.99Å; E277-T308 WeakPolarHBondContact O-CB 3.15Å; E277-T308 PolarHBondContact O-OG1 3.31Å; R280-T308 WeakPolarHBondContact CB-OG1 3.37Å; R280-T308 PolarHBondContact O-N 2.81Å; R280-T308 VanDerWaalsContact O-N 3.13Å; T308-L341 HydrophobicContact CG2-CD1 3.87Å
309K95.2Very high92.4Very high15 Ų1543.1 Ų43.17%0.06522%0.221CC..  trans-116162.7178.2-63179-173.461.40109.4S296 C298 T305 D307 Q323 F324 C325S296-K309 WeakPolarHBondContact O-CE 3.35Å; S296-K309 PolarHBondContact O-NZ 3.35Å; S296-K309 WeakPolarHBondContact OG-CD 3.45Å; S296-K309 PolarHBondContact OG-NZ 3.32Å; C298-K309 HydrophobicContact CB-CD 4.36Å; T305-K309 PolarHBondContact O-NZ 3.24Å; T305-K309 WeakPolarHBondContact OG1-CE 3.5Å; T305-K309 PolarHBondContact OG1-NZ 2.9Å; D307-K309 PolarHBondContact O-N 2.9Å; D307-K309 PolarHBondContact O-NZ 2.61Å; D307-K309 VanDerWaalsContact O-NZ 3.13Å; D307-K309 IonicContact OD1-NZ 2.69Å; D307-K309 PolarHBondContact OD1-NZ 3.01Å; D307-K309 IonicContact OD2-NZ 3.2Å; K309-Q323 HydrophobicContact CB-CB 4.27Å; K309-Q323 HydrophobicContact CD-CB 4.42Å; K309-F324 VanDerWaalsContact CA-O 3.28Å; K309-F324 WeakPolarHBondContact CA-O 3.38Å; K309-F324 WeakPolarHBondContact CB-O 3.36Å; K309-C325 HydrophobicContact CG-CB 4.44Å
310T95.1Very high92.1Very high2 Ų245.7 Ų45.71%0.01224%0.238CC..  trans-62.6155.7176.151.40000113.2G322 Q323 F324 L329 V337 A340 W346T310-G322 CarbonylContact C-O 3.48Å; T310-G322 PolarHBondContact OG1-O 2.99Å; T310-Q323 WeakPolarHBondContact O-CA 3.47Å; T310-F324 PolarHBondContact N-O 3.03Å; T310-F324 VanDerWaalsContact N-O 3.07Å; T310-F324 PolarHBondContact OG1-N 3.43Å; T310-L329 HydrophobicContact CG2-CD2 3.78Å; T310-V337 HydrophobicContact CG2-CB 4.14Å; T310-V337 HydrophobicContact CG2-CG1 3.81Å; T310-V337 HydrophobicContact CG2-CG2 3.93Å; T310-A340 HydrophobicContact CG2-CB 3.66Å; T310-W346 HydrophobicContact CG2-CH2 3.92Å; T310-W346 HydrophobicContact CG2-CZ2 4.21Å; T310-W346 HydrophobicContact CG2-CZ3 4.32Å; T310-W346 WeakPolarHBondContact OG1-CH2 3.47Å
311N92.9Very high91.9Very high32 Ų3246.6 Ų46.617%0.17124%0.24CC..  trans-122.5124.1169.6-178.5-82.7000108.2V266 R268V266-N311 PolarHBondContact O-ND2 3.19Å; R268-N311 PolarHBondContact N-OD1 3.42Å
312C94.6Very high91.9Very high0 Ų044.8 Ų44.80%023%0.228CC..  trans-72.6142.2179.1-173.90000110.9H265 N314 C317 W346 C348H265-C312 PolarHBondContact CE1-O 2.98Å; H265-C312 VanDerWaalsContact CE1-O 3.23Å; H265-C312 PolarHBondContact NE2-O 3.43Å; C312-N314 PolarHBondContact SG-N 3.41Å; C312-C317 HydrophobicContact CB-CB 4.02Å; C312-W346 HydrophobicContact CB-CZ3 4.4Å; C312-C348 HydrophobicContact CB-CB 3.95Å; C312-C348 PolarHBondContact SG-N 2.99Å
313R92.5Very high92Very high24 Ų2441 Ų419%0.09122%0.216CC..  trans-90.2-10.6178.9-53.9-60.6-173.6152-16.3114.2R268 P269 L341 P344 W346R268-R313 PolarHBondContact O-NH1 3.22Å; R268-R313 PolarHBondContact O-NH2 3.37Å; R268-R313 VanDerWaalsContact O-NH2 3.16Å; P269-R313 PolarHBondContact O-NH2 3.37Å; R313-L341 PolarHBondContact NH2-O 3.22Å; R313-P344 WeakPolarHBondContact CB-O 3.36Å; R313-P344 VanDerWaalsContact CG-O 3.23Å; R313-P344 WeakPolarHBondContact CG-O 3.47Å; R313-W346 VanDerWaalsContact CB-O 3.31Å; R313-W346 WeakPolarHBondContact CB-O 3.49Å; R313-W346 VanDerWaalsContact CG-O 3.23Å; R313-W346 WeakPolarHBondContact CG-O 3.41Å; R313-W346 PolarHBondContact N-O 3.25Å
314N91.4Very high92.1Very high24 Ų2438.1 Ų38.113%0.12820%0.203CC..  trans-70.8122.3177.4-177.4-11000110.6H265 C312 E316 C317 W347 C351H265-N314 PolarHBondContact CD2-O 3.14Å; C312-N314 PolarHBondContact SG-N 3.41Å; N314-E316 PolarHBondContact O-N 2.63Å; N314-E316 WeakPolarHBondContact OD1-CB 3.36Å; N314-E316 PolarHBondContact OD1-N 2.82Å; N314-C317 HydrophobicContact CB-CB 4.4Å; N314-C317 WeakPolarHBondContact O-CB 3.42Å; N314-C317 PolarHBondContact O-N 2.83Å; N314-C317 VanDerWaalsContact O-N 3.1Å; N314-W347 HydrophobicContact CB-CG 4.36Å; N314-C351 HydrophobicContact CB-CB 4.42Å
315P87.9Confident92.1Very high106 Ų10633.4 Ų33.469%0.68818%0.182SC*.THydrogen-bonded Turntrans-64.1-22.817827.4-36.5000113.4C317P315-C317 VanDerWaalsContact C-N 3.31Å
316E88.1Confident92.1Very high137 Ų13733.4 Ų33.464%0.6418%0.183SC*.THydrogen-bonded Turntrans-84.2-7.9177.8-57.5-169.816200113.5R259 N314R259-E316 PolarHBondContact NH2-O 3.45Å; N314-E316 PolarHBondContact O-N 2.63Å; N314-E316 WeakPolarHBondContact OD1-CB 3.36Å; N314-E316 PolarHBondContact OD1-N 2.82Å
317C89.9Confident92.1Very high5 Ų530.5 Ų30.53%0.03417%0.165CC..  trans-58.8152.2172.8-173.50000109.9H265 C312 N314 P315H265-C317 WeakPolarHBondContact CB-O 3.42Å; C312-C317 HydrophobicContact CB-CB 4.02Å; N314-C317 HydrophobicContact CB-CB 4.4Å; N314-C317 WeakPolarHBondContact O-CB 3.42Å; N314-C317 PolarHBondContact O-N 2.83Å; N314-C317 VanDerWaalsContact O-N 3.1Å; P315-C317 VanDerWaalsContact C-N 3.31Å
318F86.5Confident92.1Very high58 Ų5830.8 Ų30.825%0.25417%0.168SC..BIsolated β-bridgetrans-145142.2-176.456.7-89.8000112.6V320 R321F318-V320 PolarHBondContact O-N 2.99Å; F318-R321 HydrophobicContact CE2-CG 4.4Å; F318-R321 WeakPolarHBondContact O-CG 3.5Å; F318-R321 PolarHBondContact O-N 2.75Å
319G85.1Confident92.2Very high26 Ų2629.9 Ų29.927%0.26816%0.162SC..G310 helixtrans52.1-132.2178.500000112.8R321G319-R321 VanDerWaalsContact C-N 3.34Å; G319-R321 PolarHBondContact O-N 3.26Å
320V86.2Confident92.2Very high72 Ų7232.7 Ų32.744%0.43617%0.172SC..G310 helixtrans-908.4-171.3-57.30000113.7T297 H299 F318 G322 Q323T297-V320 WeakPolarHBondContact OG1-CB 3.5Å; T297-V320 WeakPolarHBondContact OG1-CG1 3.13Å; H299-V320 WeakPolarHBondContact CB-O 3.3Å; F318-V320 PolarHBondContact O-N 2.99Å; V320-G322 VanDerWaalsContact C-N 3.28Å; V320-G322 PolarHBondContact O-N 3.24Å; V320-Q323 PolarHBondContact O-N 2.86Å
321R89Confident92.2Very high44 Ų4434.3 Ų34.317%0.16618%0.181CC..G310 helixtrans-67.8-29.8-177.8-62.4-169.681.1169.93.3112.7F318 G319 Q323 F324 P350 C360F318-R321 HydrophobicContact CE2-CG 4.4Å; F318-R321 WeakPolarHBondContact O-CG 3.5Å; F318-R321 PolarHBondContact O-N 2.75Å; G319-R321 VanDerWaalsContact C-N 3.34Å; G319-R321 PolarHBondContact O-N 3.26Å; R321-Q323 VanDerWaalsContact C-N 3.35Å; R321-F324 VanDerWaalsContact O-CE2 3.29Å; R321-F324 WeakPolarHBondContact O-CE2 3.4Å; R321-P350 HydrophobicContact CB-CB 4.32Å; R321-P350 HydrophobicContact CB-CG 4.39Å; R321-P350 WeakPolarHBondContact O-CG 3.4Å; R321-C360 PolarHBondContact NH2-SG 3.18Å
322G91.9Very high92.3Very high2 Ų234.1 Ų34.12%0.02118%0.178CC..G310 helixtrans-80.6-8.9179.700000115.4T310 V320T310-G322 CarbonylContact C-O 3.48Å; T310-G322 PolarHBondContact OG1-O 2.99Å; V320-G322 VanDerWaalsContact C-N 3.28Å; V320-G322 PolarHBondContact O-N 3.24Å
323Q94.3Very high92.3Very high57 Ų5734.6 Ų34.627%0.26618%0.18SC..  trans-99.7114.9-169.4-65.9-175.1-24.600112.1T297 C298 H299 K309 T310 V320 R321T297-Q323 WeakPolarHBondContact O-CB 3.33Å; T297-Q323 PolarHBondContact O-OE1 3.32Å; C298-Q323 CarbonylContact C-O 3.28Å; H299-Q323 WeakPolarHBondContact CB-O 3.49Å; H299-Q323 PolarHBondContact N-O 2.92Å; K309-Q323 HydrophobicContact CB-CB 4.27Å; K309-Q323 HydrophobicContact CD-CB 4.42Å; T310-Q323 WeakPolarHBondContact O-CA 3.47Å; V320-Q323 PolarHBondContact O-N 2.86Å; R321-Q323 VanDerWaalsContact C-N 3.35Å
324F96.2Very high92.4Very high0 Ų035.5 Ų35.50%020%0.196CC..  trans-125.3137.1174.4-67.9-98000110.7H299 Q300 K309 T310 R321 L329 Y333 C348 P349 P350H299-F324 HydrophobicContact CB-CE1 4.03Å; H299-F324 HydrophobicContact CB-CE2 4.1Å; H299-F324 HydrophobicContact CB-CZ 3.8Å; H299-F324 AromaticContact CD2-CE1 3.94Å; H299-F324 AromaticContact CD2-CZ 3.54Å; H299-F324 AromaticContact CG-CZ 3.94Å; Q300-F324 HydrophobicContact CB-CD1 4.16Å; Q300-F324 HydrophobicContact CB-CE1 4.08Å; K309-F324 VanDerWaalsContact CA-O 3.28Å; K309-F324 WeakPolarHBondContact CA-O 3.38Å; K309-F324 WeakPolarHBondContact CB-O 3.36Å; T310-F324 PolarHBondContact N-O 3.03Å; T310-F324 VanDerWaalsContact N-O 3.07Å; T310-F324 PolarHBondContact OG1-N 3.43Å; R321-F324 VanDerWaalsContact O-CE2 3.29Å; R321-F324 WeakPolarHBondContact O-CE2 3.4Å; F324-L329 HydrophobicContact CB-CB 4.12Å; F324-L329 HydrophobicContact CB-CD1 4.24Å; F324-L329 HydrophobicContact CG-CD1 4.28Å; F324-Y333 HydrophobicContact CD1-CE2 4.4Å; F324-Y333 AromaticContact CE1-CE2 3.91Å; F324-Y333 HydrophobicContact CE1-CE2 3.91Å; F324-C348 HydrophobicContact CE2-CB 4.14Å; F324-P349 HydrophobicContact CE2-CG 4.27Å; F324-P349 HydrophobicContact CZ-CB 4.4Å; F324-P349 HydrophobicContact CZ-CG 4.11Å; F324-P350 HydrophobicContact CE2-CG 4.32Å; F324-P350 HydrophobicContact CZ-CG 4.04Å
325C95.9Very high92.6Very high0 Ų036.4 Ų36.40%020%0.2CC..  trans-80.8155.9167.963.70000110.8K288 C298 D307 K309 C328 L329K288-C325 PolarHBondContact NZ-SG 2.82Å; C298-C325 HydrophobicContact CB-CB 4.36Å; D307-C325 WeakPolarHBondContact OD2-CB 3.09Å; K309-C325 HydrophobicContact CG-CB 4.44Å; C325-C328 PolarHBondContact O-N 2.74Å; C325-C328 VanDerWaalsContact O-N 3.08Å; C325-C328 PolarHBondContact SG-SG 3.45Å; C325-L329 PolarHBondContact O-N 2.73Å; C325-L329 VanDerWaalsContact O-N 3.1Å
326G95.8Very high93Very high1 Ų134.4 Ų34.41%0.0118%0.181CC..Hα-helixtrans-46.2-57.1-177.200000115C282 C328 L329 R330 V337C282-G326 WeakPolarHBondContact O-CA 3.39Å; G326-C328 PolarHBondContact O-N 3.33Å; G326-C328 VanDerWaalsContact O-N 3.14Å; G326-L329 PolarHBondContact O-N 3.5Å; G326-R330 WeakPolarHBondContact O-CB 3.45Å; G326-R330 PolarHBondContact O-N 2.8Å; G326-V337 VanDerWaalsContact CA-CG2 3.46Å
327P95.5Very high93.4Very high5 Ų527.9 Ų27.93%0.03215%0.151CC..Hα-helixtrans-63.5-29.4-175.4-24.334.7000113.4C282 V285 N331C282-P327 WeakPolarHBondContact O-CD 3.44Å; C282-P327 WeakPolarHBondContact SG-CD 3.39Å; V285-P327 HydrophobicContact CG2-CB 4Å; V285-P327 HydrophobicContact CG2-CG 4.32Å; P327-N331 VanDerWaalsContact O-CB 3.23Å; P327-N331 WeakPolarHBondContact O-CB 3.34Å; P327-N331 VanDerWaalsContact O-CG 3.22Å; P327-N331 PolarHBondContact O-N 3.16Å; P327-N331 PolarHBondContact O-ND2 2.62Å
328C95.3Very high93.6Very high17 Ų1733.3 Ų33.312%0.11517%0.17CC..Hα-helixtrans-77.6-40.9179-72.30000111.7Q300 C325 G326 R332Q300-C328 HydrophobicContact CB-CB 3.88Å; Q300-C328 HydrophobicContact CG-CB 4.13Å; C325-C328 PolarHBondContact O-N 2.74Å; C325-C328 VanDerWaalsContact O-N 3.08Å; C325-C328 PolarHBondContact SG-SG 3.45Å; G326-C328 PolarHBondContact O-N 3.33Å; G326-C328 VanDerWaalsContact O-N 3.14Å; C328-R332 VanDerWaalsContact O-CB 3.25Å; C328-R332 WeakPolarHBondContact O-CB 3.45Å; C328-R332 PolarHBondContact O-N 3.14Å
329L96Very high94.1Very high0 Ų034.9 Ų34.90%018%0.182CC..Hα-helixtrans-67.5-48.3179.6-168.564.8000110.4T310 F324 C325 G326 Y333 G334 E335 V337 A340 W346 P349T310-L329 HydrophobicContact CG2-CD2 3.78Å; F324-L329 HydrophobicContact CB-CB 4.12Å; F324-L329 HydrophobicContact CB-CD1 4.24Å; F324-L329 HydrophobicContact CG-CD1 4.28Å; C325-L329 PolarHBondContact O-N 2.73Å; C325-L329 VanDerWaalsContact O-N 3.1Å; G326-L329 PolarHBondContact O-N 3.5Å; L329-Y333 HydrophobicContact CD1-CD2 4.07Å; L329-Y333 WeakPolarHBondContact O-CA 3.5Å; L329-Y333 WeakPolarHBondContact O-CB 3.43Å; L329-Y333 PolarHBondContact O-N 2.95Å; L329-G334 PolarHBondContact O-N 2.72Å; L329-E335 CarbonylContact C-O 3.59Å; L329-E335 VanDerWaalsContact C-O 3.28Å; L329-E335 HydrophobicContact CD1-CB 4.19Å; L329-E335 HydrophobicContact CD2-CB 4.03Å; L329-E335 HydrophobicContact CG-CB 3.79Å; L329-E335 VanDerWaalsContact CG-O 3.27Å; L329-E335 WeakPolarHBondContact CG-O 3.49Å; L329-V337 HydrophobicContact CB-CG2 4.23Å; L329-V337 HydrophobicContact CD2-CG2 3.85Å; L329-A340 HydrophobicContact CD2-CB 4.2Å; L329-W346 HydrophobicContact CD1-CZ2 4.24Å; L329-W346 HydrophobicContact CD2-CZ2 4.35Å; L329-P349 HydrophobicContact CD1-CG 4.26Å
330R95.7Very high94.5Very high74 Ų7433.8 Ų33.828%0.27917%0.17SC..Hα-helixtrans-60.4-58.1178.8-17417774.7-163.2-2.5112.7N283 G326 R332 G334 E335 E336N283-R330 PolarHBondContact O-NH2 2.92Å; G326-R330 WeakPolarHBondContact O-CB 3.45Å; G326-R330 PolarHBondContact O-N 2.8Å; R330-R332 VanDerWaalsContact C-N 3.32Å; R330-R332 PolarHBondContact O-N 3.31Å; R330-G334 WeakPolarHBondContact O-CA 3.41Å; R330-G334 PolarHBondContact O-N 2.87Å; R330-E335 WeakPolarHBondContact CA-O 3.49Å; R330-E335 PolarHBondContact N-O 2.78Å; R330-E335 VanDerWaalsContact N-O 3.12Å; R330-E336 WeakPolarHBondContact CD-OE1 3.49Å; R330-E336 WeakPolarHBondContact CG-OE1 3.35Å
331N95.1Very high94.9Very high37 Ų3730.8 Ų30.820%0.19815%0.151CC..Hα-helixtrans-71.5-25.9-172.7-63.4-18.9000113.2P327 V373 N383 V384P327-N331 VanDerWaalsContact O-CB 3.23Å; P327-N331 WeakPolarHBondContact O-CB 3.34Å; P327-N331 VanDerWaalsContact O-CG 3.22Å; P327-N331 PolarHBondContact O-N 3.16Å; P327-N331 PolarHBondContact O-ND2 2.62Å; N331-V373 HydrophobicContact CB-CG1 3.98Å; N331-V373 HydrophobicContact CB-CG2 4.13Å; N331-N383 WeakPolarHBondContact O-CA 3.36Å; N331-V384 PolarHBondContact O-N 3.47Å; N331-V384 VanDerWaalsContact O-N 3.16Å
332R94.8Very high95.2Very high27 Ų2732.7 Ų32.710%0.10216%0.164CC..Hα-helixtrans-96.8-31-178.3-71-171.6167.9-107.4-5.4114.7Q300 C328 R330 N356 T369 G370 V384 H385Q300-R332 VanDerWaalsContact CD-NE 3.27Å; Q300-R332 VanDerWaalsContact CG-CD 3.47Å; Q300-R332 VanDerWaalsContact NE2-NE 3.19Å; C328-R332 VanDerWaalsContact O-CB 3.25Å; C328-R332 WeakPolarHBondContact O-CB 3.45Å; C328-R332 PolarHBondContact O-N 3.14Å; R330-R332 VanDerWaalsContact C-N 3.32Å; R330-R332 PolarHBondContact O-N 3.31Å; R332-N356 WeakPolarHBondContact CD-OD1 3.3Å; R332-N356 PolarHBondContact NH1-O 2.89Å; R332-N356 PolarHBondContact NH1-OD1 3.37Å; R332-N356 PolarHBondContact O-ND2 2.92Å; R332-T369 PolarHBondContact NH1-OG1 3.2Å; R332-G370 PolarHBondContact NH2-O 2.78Å; R332-V384 HydrophobicContact CG-CG2 4.36Å; R332-H385 VanDerWaalsContact O-CB 3.25Å; R332-H385 WeakPolarHBondContact O-CB 3.32Å; R332-H385 PolarHBondContact O-N 3.2Å
333Y95.5Very high95.3Very high11 Ų1136.5 Ų36.54%0.04318%0.184CC..Hα-helixtrans-124.1-12.4-174-55.4-80.2000112.9Q300 F324 L329 E335 P349 I354 C355 N356 H385Q300-Y333 PolarHBondContact OE1-OH 3.02Å; F324-Y333 HydrophobicContact CD1-CE2 4.4Å; F324-Y333 AromaticContact CE1-CE2 3.91Å; F324-Y333 HydrophobicContact CE1-CE2 3.91Å; L329-Y333 HydrophobicContact CD1-CD2 4.07Å; L329-Y333 WeakPolarHBondContact O-CA 3.5Å; L329-Y333 WeakPolarHBondContact O-CB 3.43Å; L329-Y333 PolarHBondContact O-N 2.95Å; Y333-E335 VanDerWaalsContact C-N 3.29Å; Y333-P349 HydrophobicContact CD1-CB 3.9Å; Y333-P349 HydrophobicContact CD1-CG 3.91Å; Y333-P349 HydrophobicContact CD2-CB 4.48Å; Y333-P349 HydrophobicContact CD2-CG 3.86Å; Y333-P349 HydrophobicContact CE1-CB 3.49Å; Y333-P349 VanDerWaalsContact CE1-CB 3.49Å; Y333-P349 HydrophobicContact CE1-CG 3.91Å; Y333-P349 HydrophobicContact CE2-CB 4.13Å; Y333-P349 HydrophobicContact CE2-CG 3.86Å; Y333-P349 HydrophobicContact CG-CB 4.38Å; Y333-P349 HydrophobicContact CG-CG 3.89Å; Y333-I354 HydrophobicContact CD1-CD1 4.48Å; Y333-C355 WeakPolarHBondContact OH-CA 3.17Å; Y333-C355 PolarHBondContact OH-SG 3.27Å; Y333-N356 PolarHBondContact OH-N 3.45Å; Y333-N356 PolarHBondContact OH-OD1 2.84Å; Y333-H385 HydrophobicContact CD1-CB 4.25Å
334G94.6Very high95.2Very high43 Ų4338 Ų3844%0.44320%0.199SC..SBendtrans75.817-177.900000113.7L329 R330L329-G334 PolarHBondContact O-N 2.72Å; R330-G334 WeakPolarHBondContact O-CA 3.41Å; R330-G334 PolarHBondContact O-N 2.87Å
335E95.6Very high95.1Very high42 Ų4246.1 Ų46.120%0.19624%0.237CC..  trans-107.7143.8-179.7-68.6175.6-141.600110.5L329 R330 Y333 W346 R352L329-E335 CarbonylContact C-O 3.59Å; L329-E335 VanDerWaalsContact C-O 3.28Å; L329-E335 HydrophobicContact CD1-CB 4.19Å; L329-E335 HydrophobicContact CD2-CB 4.03Å; L329-E335 HydrophobicContact CG-CB 3.79Å; L329-E335 VanDerWaalsContact CG-O 3.27Å; L329-E335 WeakPolarHBondContact CG-O 3.49Å; R330-E335 WeakPolarHBondContact CA-O 3.49Å; R330-E335 PolarHBondContact N-O 2.78Å; R330-E335 VanDerWaalsContact N-O 3.12Å; Y333-E335 VanDerWaalsContact C-N 3.29Å; E335-W346 PolarHBondContact OE2-NE1 3.42Å; E335-R352 IonicContact OE1-CZ 3.79Å; E335-R352 IonicContact OE1-NH1 3.63Å; E335-R352 PolarHBondContact OE1-NH1 3.17Å; E335-R352 IonicContact OE1-NH2 3.05Å; E335-R352 IonicContact OE2-CZ 3.33Å; E335-R352 IonicContact OE2-NH1 3.56Å; E335-R352 IonicContact OE2-NH2 3.55Å; E335-R352 PolarHBondContact OE2-NH2 2.95Å
336E95.5Very high95.1Very high64 Ų6446.7 Ų46.730%0.29924%0.239SC..  trans-94.3145174.8-68.6-62.7163.200111.6R330 R338 A340R330-E336 WeakPolarHBondContact CD-OE1 3.49Å; R330-E336 WeakPolarHBondContact CG-OE1 3.35Å; E336-R338 VanDerWaalsContact C-N 3.3Å; E336-R338 PolarHBondContact O-N 3.23Å; E336-A340 WeakPolarHBondContact O-CB 3.47Å; E336-A340 PolarHBondContact O-N 2.79Å
337V96.1Very high95.1Very high0 Ų053 Ų530%026%0.263CS..Hα-helixtrans-69-34-178.9173.30000111.1I281 T310 G326 L329 A340 L341I281-V337 HydrophobicContact CD1-CB 4.16Å; I281-V337 HydrophobicContact CD1-CG1 3.83Å; I281-V337 HydrophobicContact CG1-CG1 3.97Å; I281-V337 HydrophobicContact CG2-CB 3.94Å; I281-V337 HydrophobicContact CG2-CG1 4.2Å; T310-V337 HydrophobicContact CG2-CB 4.14Å; T310-V337 HydrophobicContact CG2-CG1 3.81Å; T310-V337 HydrophobicContact CG2-CG2 3.93Å; G326-V337 VanDerWaalsContact CA-CG2 3.46Å; L329-V337 HydrophobicContact CB-CG2 4.23Å; L329-V337 HydrophobicContact CD2-CG2 3.85Å; V337-A340 PolarHBondContact O-N 2.76Å; V337-L341 HydrophobicContact CG1-CD1 3.88Å; V337-L341 HydrophobicContact CG1-CG 4.23Å; V337-L341 WeakPolarHBondContact O-CB 3.43Å; V337-L341 VanDerWaalsContact O-CG 3.27Å; V337-L341 WeakPolarHBondContact O-CG 3.03Å; V337-L341 PolarHBondContact O-N 2.99Å
338R95.7Very high95.1Very high119 Ų11952.7 Ų52.745%0.44926%0.261SS..Hα-helixtrans-60.7-49.3179.3-139.2178.7-171.4-1752110.1E275 L278 I281 E336 L341 L342E275-R338 IonicContact OE1-CZ 3.96Å; E275-R338 IonicContact OE1-NH2 2.8Å; E275-R338 PolarHBondContact OE1-NH2 3.34Å; L278-R338 HydrophobicContact CB-CG 4.18Å; L278-R338 HydrophobicContact CD1-CG 4.34Å; L278-R338 HydrophobicContact CD2-CG 3.87Å; L278-R338 HydrophobicContact CG-CG 4.35Å; I281-R338 HydrophobicContact CD1-CB 3.96Å; I281-R338 HydrophobicContact CD1-CG 3.9Å; E336-R338 VanDerWaalsContact C-N 3.3Å; E336-R338 PolarHBondContact O-N 3.23Å; R338-L341 PolarHBondContact O-N 3Å; R338-L342 WeakPolarHBondContact O-CG 3.31Å; R338-L342 PolarHBondContact O-N 3.3Å; R338-L342 VanDerWaalsContact O-N 3.14Å
339D95.4Very high95.1Very high92 Ų9251.9 Ų51.949%0.49226%0.255SS..Hα-helixtrans-66.6-43.9178.6-55.5-15.5000111.2L341 L342 N343D339-L341 PolarHBondContact O-N 3.17Å; D339-L342 PolarHBondContact O-N 2.77Å; D339-N343 VanDerWaalsContact O-CB 3.3Å; D339-N343 WeakPolarHBondContact O-CB 3.28Å; D339-N343 PolarHBondContact O-N 2.81Å; D339-N343 PolarHBondContact O-ND2 3.24Å
340A95.3Very high95Very high2 Ų252.7 Ų52.72%0.01726%0.261CS..Hα-helixtrans-58.6-34.517700000113.5T310 L329 E336 V337 W346T310-A340 HydrophobicContact CG2-CB 3.66Å; L329-A340 HydrophobicContact CD2-CB 4.2Å; E336-A340 WeakPolarHBondContact O-CB 3.47Å; E336-A340 PolarHBondContact O-N 2.79Å; V337-A340 PolarHBondContact O-N 2.76Å; A340-W346 HydrophobicContact CB-CD2 3.66Å; A340-W346 VanDerWaalsContact CB-CE2 3.45Å; A340-W346 HydrophobicContact CB-CE3 4.31Å; A340-W346 HydrophobicContact CB-CG 3.86Å; A340-W346 HydrophobicContact CB-CZ2 3.97Å; A340-W346 WeakPolarHBondContact O-CB 3.42Å
341L94.7Very high94.8Very high9 Ų951.1 Ų51.15%0.04726%0.261CS..Hα-helixtrans-73-42.3177.4-80.1176.5000111.8I273 L278 I281 T308 R313 V337 R338 D339 N343I273-L341 HydrophobicContact CD1-CB 3.79Å; I273-L341 HydrophobicContact CD1-CD2 4.04Å; I273-L341 HydrophobicContact CD1-CG 4.44Å; I273-L341 WeakPolarHBondContact CD1-O 3.48Å; L278-L341 HydrophobicContact CD2-CB 4.22Å; L278-L341 HydrophobicContact CD2-CD1 3.88Å; I281-L341 HydrophobicContact CD1-CD1 4.24Å; T308-L341 HydrophobicContact CG2-CD1 3.87Å; R313-L341 PolarHBondContact NH2-O 3.22Å; V337-L341 HydrophobicContact CG1-CD1 3.88Å; V337-L341 HydrophobicContact CG1-CG 4.23Å; V337-L341 WeakPolarHBondContact O-CB 3.43Å; V337-L341 VanDerWaalsContact O-CG 3.27Å; V337-L341 WeakPolarHBondContact O-CG 3.03Å; V337-L341 PolarHBondContact O-N 2.99Å; R338-L341 PolarHBondContact O-N 3Å; D339-L341 PolarHBondContact O-N 3.17Å; L341-N343 VanDerWaalsContact C-N 3.32Å; L341-N343 PolarHBondContact O-N 3.04Å
342L94.4Very high94.7Very high84 Ų8454 Ų5444%0.4427%0.268SS..Hα-helixtrans-75.6-16.5-179.4-66.8173.5000113.9V270 L278 R338 D339 P344V270-L342 HydrophobicContact CG1-CD2 4.46Å; V270-L342 WeakPolarHBondContact CG1-O 3.49Å; L278-L342 HydrophobicContact CD1-CD2 4.32Å; R338-L342 WeakPolarHBondContact O-CG 3.31Å; R338-L342 PolarHBondContact O-N 3.3Å; R338-L342 VanDerWaalsContact O-N 3.14Å; D339-L342 PolarHBondContact O-N 2.77Å; L342-P344 WeakPolarHBondContact O-CD 3.31Å
343N93.8Very high94.6Very high82 Ų8255 Ų5544%0.43929%0.288SS..  trans-89.4116.9-179.7-73.4-32.9000111.7D339 L341 E345 W346D339-N343 VanDerWaalsContact O-CB 3.3Å; D339-N343 WeakPolarHBondContact O-CB 3.28Å; D339-N343 PolarHBondContact O-N 2.81Å; D339-N343 PolarHBondContact O-ND2 3.24Å; L341-N343 VanDerWaalsContact C-N 3.32Å; L341-N343 PolarHBondContact O-N 3.04Å; N343-E345 VanDerWaalsContact C-N 3.27Å; N343-E345 PolarHBondContact O-N 3.18Å; N343-W346 HydrophobicContact CB-CB 3.9Å; N343-W346 WeakPolarHBondContact O-CB 3.26Å; N343-W346 PolarHBondContact O-N 3.45Å
344P92.9Very high94.4Very high89 Ų8957 Ų5758%0.57830%0.298SS*.THydrogen-bonded Turntrans-71-22.2-177.927.8-34.3000113.5V270 R313 L342V270-P344 HydrophobicContact CG2-CB 3.85Å; R313-P344 WeakPolarHBondContact CB-O 3.36Å; R313-P344 VanDerWaalsContact CG-O 3.23Å; R313-P344 WeakPolarHBondContact CG-O 3.47Å; L342-P344 WeakPolarHBondContact O-CD 3.31Å
345E94.3Very high94.4Very high170 Ų17055.1 Ų55.179%0.79428%0.278SS*.THydrogen-bonded Turntrans-96.45.9179.7-61.7-175.5166.500112.7N343 W347N343-E345 VanDerWaalsContact C-N 3.27Å; N343-E345 PolarHBondContact O-N 3.18Å; E345-W347 PolarHBondContact O-N 3.18Å; E345-W347 VanDerWaalsContact O-N 3.15Å
346W95.1Very high94.3Very high13 Ų1353.3 Ų53.35%0.04927%0.27CS..PPolyproline II helixtrans-68.9116.9-174.7-175.486.5000112.5T310 C312 R313 L329 E335 A340 N343 C348T310-W346 HydrophobicContact CG2-CH2 3.92Å; T310-W346 HydrophobicContact CG2-CZ2 4.21Å; T310-W346 HydrophobicContact CG2-CZ3 4.32Å; T310-W346 WeakPolarHBondContact OG1-CH2 3.47Å; C312-W346 HydrophobicContact CB-CZ3 4.4Å; R313-W346 VanDerWaalsContact CB-O 3.31Å; R313-W346 WeakPolarHBondContact CB-O 3.49Å; R313-W346 VanDerWaalsContact CG-O 3.23Å; R313-W346 WeakPolarHBondContact CG-O 3.41Å; R313-W346 PolarHBondContact N-O 3.25Å; L329-W346 HydrophobicContact CD1-CZ2 4.24Å; L329-W346 HydrophobicContact CD2-CZ2 4.35Å; E335-W346 PolarHBondContact OE2-NE1 3.42Å; A340-W346 HydrophobicContact CB-CD2 3.66Å; A340-W346 VanDerWaalsContact CB-CE2 3.45Å; A340-W346 HydrophobicContact CB-CE3 4.31Å; A340-W346 HydrophobicContact CB-CG 3.86Å; A340-W346 HydrophobicContact CB-CZ2 3.97Å; A340-W346 WeakPolarHBondContact O-CB 3.42Å; N343-W346 HydrophobicContact CB-CB 3.9Å; N343-W346 WeakPolarHBondContact O-CB 3.26Å; N343-W346 PolarHBondContact O-N 3.45Å; W346-C348 HydrophobicContact CH2-CB 3.64Å; W346-C348 HydrophobicContact CZ2-CB 4.43Å; W346-C348 HydrophobicContact CZ3-CB 3.88Å
347W95.4Very high94.1Very high132 Ų13250.5 Ų50.550%0.526%0.257SS..PPolyproline II helixtrans-100.7142.9172.1-65.8-2.8000110.9N314 E345 C351 R352N314-W347 HydrophobicContact CB-CG 4.36Å; E345-W347 PolarHBondContact O-N 3.18Å; E345-W347 VanDerWaalsContact O-N 3.15Å; W347-C351 HydrophobicContact CB-CB 4.39Å; W347-R352 HydrophobicContact CB-CG 3.86Å; W347-R352 PolarHBondContact O-NE 3.24Å; W347-R352 PolarHBondContact O-NH2 3.22Å
348C95Very high93.7Very high0 Ų052.8 Ų52.80%027%0.274CS..PPolyproline II helixtrans-73.2156.4179.868.40000112.2C312 F324 W346 P350 C351 R352C312-C348 HydrophobicContact CB-CB 3.95Å; C312-C348 PolarHBondContact SG-N 2.99Å; F324-C348 HydrophobicContact CE2-CB 4.14Å; W346-C348 HydrophobicContact CH2-CB 3.64Å; W346-C348 HydrophobicContact CZ2-CB 4.43Å; W346-C348 HydrophobicContact CZ3-CB 3.88Å; C348-P350 VanDerWaalsContact C-CD 3.45Å; C348-P350 VanDerWaalsContact C-N 3.28Å; C348-P350 VanDerWaalsContact O-N 3.14Å; C348-C351 PolarHBondContact O-N 3.43Å; C348-C351 PolarHBondContact SG-SG 3.44Å; C348-R352 PolarHBondContact O-N 2.89Å
349P95.6Very high93.4Very high0 Ų052.3 Ų52.30%028%0.275CS..THydrogen-bonded Turntrans-51.4-36.8178.6-25.931.7000115F324 L329 Y333 R352 G353 I354 C355F324-P349 HydrophobicContact CE2-CG 4.27Å; F324-P349 HydrophobicContact CZ-CB 4.4Å; F324-P349 HydrophobicContact CZ-CG 4.11Å; L329-P349 HydrophobicContact CD1-CG 4.26Å; Y333-P349 HydrophobicContact CD1-CB 3.9Å; Y333-P349 HydrophobicContact CD1-CG 3.91Å; Y333-P349 HydrophobicContact CD2-CB 4.48Å; Y333-P349 HydrophobicContact CD2-CG 3.86Å; Y333-P349 HydrophobicContact CE1-CB 3.49Å; Y333-P349 VanDerWaalsContact CE1-CB 3.49Å; Y333-P349 HydrophobicContact CE1-CG 3.91Å; Y333-P349 HydrophobicContact CE2-CB 4.13Å; Y333-P349 HydrophobicContact CE2-CG 3.86Å; Y333-P349 HydrophobicContact CG-CB 4.38Å; Y333-P349 HydrophobicContact CG-CG 3.89Å; P349-R352 PolarHBondContact O-N 3.39Å; P349-G353 PolarHBondContact O-N 3.22Å; P349-I354 HydrophobicContact CB-CD1 4.46Å; P349-I354 HydrophobicContact CB-CG1 3.9Å; P349-I354 PolarHBondContact O-N 2.92Å; P349-C355 HydrophobicContact CB-CB 4.34Å; P349-C355 PolarHBondContact O-N 2.75Å
350P93.8Very high93.1Very high17 Ų1748.3 Ų48.311%0.1125%0.254CS..THydrogen-bonded Turntrans-64.5-38.7172.5-26.936.7000114.8R321 F324 C348 R352 G353 C355R321-P350 HydrophobicContact CB-CB 4.32Å; R321-P350 HydrophobicContact CB-CG 4.39Å; R321-P350 WeakPolarHBondContact O-CG 3.4Å; F324-P350 HydrophobicContact CE2-CG 4.32Å; F324-P350 HydrophobicContact CZ-CG 4.04Å; C348-P350 VanDerWaalsContact C-CD 3.45Å; C348-P350 VanDerWaalsContact C-N 3.28Å; C348-P350 VanDerWaalsContact O-N 3.14Å; P350-R352 VanDerWaalsContact C-N 3.33Å; P350-G353 PolarHBondContact O-N 3.23Å; P350-C355 HydrophobicContact CB-CB 4.32Å; P350-C355 HydrophobicContact CG-CB 3.95Å
351C92.7Very high92.8Very high41 Ų4148.6 Ų48.628%0.27726%0.255SS..THydrogen-bonded Turntrans-71.3-30.7177.6-75.20000111.9N314 W347 C348 G353N314-C351 HydrophobicContact CB-CB 4.42Å; W347-C351 HydrophobicContact CB-CB 4.39Å; C348-C351 PolarHBondContact O-N 3.43Å; C348-C351 PolarHBondContact SG-SG 3.44Å; C351-G353 VanDerWaalsContact C-N 3.29Å
352R93.4Very high92.5Very high96 Ų9650.7 Ų50.736%0.36227%0.273SS..THydrogen-bonded Turntrans-80.1-5.9173.9-57.7-174.3-155.9156.310.9113.8E335 W347 C348 P349 P350 I354E335-R352 IonicContact OE1-CZ 3.79Å; E335-R352 IonicContact OE1-NH1 3.63Å; E335-R352 PolarHBondContact OE1-NH1 3.17Å; E335-R352 IonicContact OE1-NH2 3.05Å; E335-R352 IonicContact OE2-CZ 3.33Å; E335-R352 IonicContact OE2-NH1 3.56Å; E335-R352 IonicContact OE2-NH2 3.55Å; E335-R352 PolarHBondContact OE2-NH2 2.95Å; W347-R352 HydrophobicContact CB-CG 3.86Å; W347-R352 PolarHBondContact O-NE 3.24Å; W347-R352 PolarHBondContact O-NH2 3.22Å; C348-R352 PolarHBondContact O-N 2.89Å; P349-R352 PolarHBondContact O-N 3.39Å; P350-R352 VanDerWaalsContact C-N 3.33Å; R352-I354 VanDerWaalsContact C-N 3.27Å; R352-I354 HydrophobicContact CB-CD1 4.39Å; R352-I354 HydrophobicContact CB-CG1 4.11Å; R352-I354 HydrophobicContact CB-CG2 4.47Å; R352-I354 PolarHBondContact O-N 2.61Å
353G91.2Very high92Very high49 Ų4954.9 Ų54.951%0.50528%0.283SS..THydrogen-bonded Turntrans69.718.9-176.600000114.8P349 P350 C351P349-G353 PolarHBondContact O-N 3.22Å; P350-G353 PolarHBondContact O-N 3.23Å; C351-G353 VanDerWaalsContact C-N 3.29Å
354I92.9Very high91.6Very high52 Ų5254.5 Ų54.527%0.26728%0.279SS..  trans-107.15.5-179.267.4175.1000113.1Y333 P349 R352 N356Y333-I354 HydrophobicContact CD1-CD1 4.48Å; P349-I354 HydrophobicContact CB-CD1 4.46Å; P349-I354 HydrophobicContact CB-CG1 3.9Å; P349-I354 PolarHBondContact O-N 2.92Å; R352-I354 VanDerWaalsContact C-N 3.27Å; R352-I354 HydrophobicContact CB-CD1 4.39Å; R352-I354 HydrophobicContact CB-CG1 4.11Å; R352-I354 HydrophobicContact CB-CG2 4.47Å; R352-I354 PolarHBondContact O-N 2.61Å; I354-N356 PolarHBondContact O-N 3.19Å
355C93.6Very high91.2Very high4 Ų451 Ų513%0.02726%0.259CS..  trans-65.6121-173.4-1730000111.9Y333 P349 P350 C357 C360Y333-C355 WeakPolarHBondContact OH-CA 3.17Å; Y333-C355 PolarHBondContact OH-SG 3.27Å; P349-C355 HydrophobicContact CB-CB 4.34Å; P349-C355 PolarHBondContact O-N 2.75Å; P350-C355 HydrophobicContact CB-CB 4.32Å; P350-C355 HydrophobicContact CG-CB 3.95Å; C355-C357 PolarHBondContact O-N 3.31Å; C355-C357 VanDerWaalsContact SG-SG 3.64Å; C355-C360 HydrophobicContact CB-CB 4Å
356N92.8Very high90.8Very high5 Ų545.7 Ų45.73%0.02723%0.231CC..  trans-96.121.2-178.566.623.1000113.3R332 Y333 I354 T369 L388R332-N356 WeakPolarHBondContact CD-OD1 3.3Å; R332-N356 PolarHBondContact NH1-O 2.89Å; R332-N356 PolarHBondContact NH1-OD1 3.37Å; R332-N356 PolarHBondContact O-ND2 2.92Å; Y333-N356 PolarHBondContact OH-N 3.45Å; Y333-N356 PolarHBondContact OH-OD1 2.84Å; I354-N356 PolarHBondContact O-N 3.19Å; N356-T369 HydrophobicContact CB-CG2 4.36Å; N356-T369 PolarHBondContact O-OG1 3.17Å; N356-L388 HydrophobicContact CB-CD1 3.85Å
357C91.1Very high90.2Very high4 Ų446.8 Ų46.83%0.02724%0.241CC..SBendtrans-75.9152.7174.683.90000111.1H299 C355 F359 C360 R361H299-C357 PolarHBondContact NE2-SG 3.35Å; H299-C357 VanDerWaalsContact NE2-SG 3.4Å; C355-C357 PolarHBondContact O-N 3.31Å; C355-C357 VanDerWaalsContact SG-SG 3.64Å; C357-F359 PolarHBondContact O-N 2.9Å; C357-C360 PolarHBondContact O-N 3.44Å; C357-C360 PolarHBondContact SG-N 2.93Å; C357-C360 VanDerWaalsContact SG-N 3.37Å; C357-C360 PolarHBondContact SG-SG 3.43Å; C357-R361 WeakPolarHBondContact O-CB 3.21Å; C357-R361 WeakPolarHBondContact O-CG 3.36Å; C357-R361 PolarHBondContact O-N 3.22Å
358S88.5Confident89.8Confident49 Ų4943.4 Ų43.434%0.34324%0.241SC..Hα-helixtrans-55.1-38.6-17750.50000113A362S358-A362 VanDerWaalsContact O-CB 3.26Å; S358-A362 WeakPolarHBondContact O-CB 3.39Å; S358-A362 PolarHBondContact O-N 3.39Å
359F88.7Confident89.2Confident108 Ų10843.9 Ų43.947%0.47424%0.244SC..Hα-helixtrans-75.3-34.9-177.7-66-96.2000113.8C357 R363C357-F359 PolarHBondContact O-N 2.9Å; F359-R363 PolarHBondContact O-N 3.38Å
360C89Confident88.7Confident8 Ų846.1 Ų46.15%0.05427%0.267CS..Hα-helixtrans-73.3-39.6174.5-68.60000110.3R321 C355 C357 R363 E364R321-C360 PolarHBondContact NH2-SG 3.18Å; C355-C360 HydrophobicContact CB-CB 4Å; C357-C360 PolarHBondContact O-N 3.44Å; C357-C360 PolarHBondContact SG-N 2.93Å; C357-C360 VanDerWaalsContact SG-N 3.37Å; C357-C360 PolarHBondContact SG-SG 3.43Å; C360-R363 WeakPolarHBondContact O-CB 3.49Å; C360-R363 PolarHBondContact O-N 3.28Å; C360-E364 PolarHBondContact O-N 2.93Å
361R89.8Confident88.4Confident9 Ų950.5 Ų50.53%0.03429%0.293CS..Hα-helixtrans-68.2-41.2178.5-71.6-175.355.8110.98.5113.7L238 C357 R363 E364 G365 R366 C367 T369L238-R361 PolarHBondContact O-NH1 2.9Å; L238-R361 PolarHBondContact O-NH2 2.94Å; C357-R361 WeakPolarHBondContact O-CB 3.21Å; C357-R361 WeakPolarHBondContact O-CG 3.36Å; C357-R361 PolarHBondContact O-N 3.22Å; R361-R363 PolarHBondContact O-N 3.38Å; R361-E364 CarbonylContact O-C 3.42Å; R361-E364 WeakPolarHBondContact O-CA 3.28Å; R361-E364 WeakPolarHBondContact O-CB 3.43Å; R361-E364 PolarHBondContact O-N 3.27Å; R361-G365 PolarHBondContact O-N 3.13Å; R361-G365 VanDerWaalsContact O-N 3.16Å; R361-R366 CarbonylContact C-O 3.59Å; R361-R366 HydrophobicContact CB-CB 4.36Å; R361-R366 PolarHBondContact O-N 3.49Å; R361-C367 PolarHBondContact NE-O 3.49Å; R361-C367 PolarHBondContact NH2-O 3.17Å; R361-T369 VanDerWaalsContact CD-CG2 3.43Å
362A88Confident88.3Confident52 Ų5248.6 Ų48.643%0.4328%0.28SS..Hα-helixtrans-59.3-35.6172.700000111.8S358 E364 G365S358-A362 VanDerWaalsContact O-CB 3.26Å; S358-A362 WeakPolarHBondContact O-CB 3.39Å; S358-A362 PolarHBondContact O-N 3.39Å; A362-E364 VanDerWaalsContact C-N 3.28Å; A362-E364 PolarHBondContact O-N 2.85Å; A362-G365 PolarHBondContact O-N 3.45Å; A362-G365 VanDerWaalsContact O-N 3.14Å
363R85.3Confident88.2Confident172 Ų17245.2 Ų45.265%0.64927%0.27SS*.Hα-helixtrans-67.5-28.5174.5-171.4-177.1-58176.21.7113F359 C360 R361 G365F359-R363 PolarHBondContact O-N 3.38Å; C360-R363 WeakPolarHBondContact O-CB 3.49Å; C360-R363 PolarHBondContact O-N 3.28Å; R361-R363 PolarHBondContact O-N 3.38Å; R363-G365 VanDerWaalsContact C-N 3.28Å
364E84.9Confident88.2Confident74 Ų7451.3 Ų51.335%0.34628%0.279SS..THydrogen-bonded Turntrans-86.21.8174.6-67.2173.2-154.600112.9C360 R361 A362 R366C360-E364 PolarHBondContact O-N 2.93Å; R361-E364 CarbonylContact O-C 3.42Å; R361-E364 WeakPolarHBondContact O-CA 3.28Å; R361-E364 WeakPolarHBondContact O-CB 3.43Å; R361-E364 PolarHBondContact O-N 3.27Å; A362-E364 VanDerWaalsContact C-N 3.28Å; A362-E364 PolarHBondContact O-N 2.85Å; E364-R366 VanDerWaalsContact C-N 3.33Å; E364-R366 HydrophobicContact CB-CG 4.18Å; E364-R366 IonicContact OE2-CZ 2.66Å; E364-R366 IonicContact OE2-NE 2.75Å; E364-R366 PolarHBondContact OE2-NE 3.09Å; E364-R366 IonicContact OE2-NH2 3.84Å
365G85Confident88.1Confident15 Ų1553.1 Ų53.116%0.15529%0.289CS..THydrogen-bonded Turntrans71.523.5-176.100000113.8K241 N242 R361 A362 R363K241-G365 CarbonylContact C-O 3.59Å; K241-G365 VanDerWaalsContact CA-O 3.31Å; K241-G365 WeakPolarHBondContact CA-O 3.27Å; N242-G365 PolarHBondContact N-O 2.91Å; R361-G365 PolarHBondContact O-N 3.13Å; R361-G365 VanDerWaalsContact O-N 3.16Å; A362-G365 PolarHBondContact O-N 3.45Å; A362-G365 VanDerWaalsContact O-N 3.14Å; R363-G365 VanDerWaalsContact C-N 3.28Å
366R84.8Confident88.1Confident59 Ų5953 Ų5322%0.22329%0.288CS..BIsolated β-bridgetrans-108.1151.7178.8-51.1-179.8-166-107.6-3.3111.8V239 R361 E364V239-R366 PolarHBondContact O-NH1 3.15Å; R361-R366 CarbonylContact C-O 3.59Å; R361-R366 HydrophobicContact CB-CB 4.36Å; R361-R366 PolarHBondContact O-N 3.49Å; E364-R366 VanDerWaalsContact C-N 3.33Å; E364-R366 HydrophobicContact CB-CG 4.18Å; E364-R366 IonicContact OE2-CZ 2.66Å; E364-R366 IonicContact OE2-NE 2.75Å; E364-R366 PolarHBondContact OE2-NE 3.09Å; E364-R366 IonicContact OE2-NH2 3.84Å
367C83.8Confident88.1Confident37 Ų3758.3 Ų58.325%0.2531%0.311CS..  trans-55.9142.7174.9-65.70000112.2R361R361-C367 PolarHBondContact NE-O 3.49Å; R361-C367 PolarHBondContact NH2-O 3.17Å
368A86.6Confident88.2Confident60 Ų6067.4 Ų67.450%0.49635%0.346SS..  trans-69134.7177.200000110.6G370A368-G370 VanDerWaalsContact C-N 3.31Å; A368-G370 PolarHBondContact O-N 2.79Å
369T81.9Confident88.4Confident11 Ų1169.6 Ų69.67%0.06735%0.35CS..  trans-73-16.3-176.252.80000115.4R332 N356 R361 L372 L388R332-T369 PolarHBondContact NH1-OG1 3.2Å; N356-T369 HydrophobicContact CB-CG2 4.36Å; N356-T369 PolarHBondContact O-OG1 3.17Å; R361-T369 VanDerWaalsContact CD-CG2 3.43Å; T369-L372 VanDerWaalsContact CB-CD1 3.42Å; T369-L372 HydrophobicContact CG2-CD1 3.52Å; T369-L372 VanDerWaalsContact O-CG 3.28Å; T369-L372 WeakPolarHBondContact O-CG 3.42Å; T369-L388 HydrophobicContact CG2-CD1 3.98Å
370G84.8Confident88.6Confident47 Ų4767.6 Ų67.649%0.48536%0.36SS..  trans52.9-142.9-170.800000114R332 A368 L372R332-G370 PolarHBondContact NH2-O 2.78Å; A368-G370 VanDerWaalsContact C-N 3.31Å; A368-G370 PolarHBondContact O-N 2.79Å; G370-L372 PolarHBondContact O-N 3.44Å
371V88.3Confident88.9Confident108 Ų10870 Ų7066%0.65537%0.37SS*.SBendtrans-91.670.5179.2-171.10000110.5V373 Y374V371-V373 VanDerWaalsContact C-N 3.27Å; V371-V373 PolarHBondContact O-N 2.9Å; V371-Y374 HydrophobicContact CG1-CD2 4.01Å; V371-Y374 HydrophobicContact CG1-CE2 3.96Å
372L89.4Confident89Confident2 Ų276.3 Ų76.31%0.0141%0.405CS..THydrogen-bonded Turntrans-74.5-6.5-176.7-102.1173.6000116.1L238 T369 G370 Y374 L375 A376 V384 Y387 L388L238-L372 HydrophobicContact CD1-CD1 3.93Å; L238-L372 HydrophobicContact CD1-CD2 3.76Å; L238-L372 HydrophobicContact CD1-CG 4.27Å; L238-L372 HydrophobicContact CD2-CD1 4.39Å; T369-L372 VanDerWaalsContact CB-CD1 3.42Å; T369-L372 HydrophobicContact CG2-CD1 3.52Å; T369-L372 VanDerWaalsContact O-CG 3.28Å; T369-L372 WeakPolarHBondContact O-CG 3.42Å; G370-L372 PolarHBondContact O-N 3.44Å; L372-Y374 VanDerWaalsContact C-N 3.3Å; L372-Y374 PolarHBondContact O-N 2.84Å; L372-L375 HydrophobicContact CD2-CB 3.93Å; L372-L375 HydrophobicContact CD2-CD1 3.82Å; L372-L375 PolarHBondContact O-N 3.18Å; L372-A376 WeakPolarHBondContact O-CB 3.45Å; L372-A376 PolarHBondContact O-N 3.06Å; L372-V384 HydrophobicContact CB-CB 4.47Å; L372-V384 HydrophobicContact CB-CG1 3.61Å; L372-V384 HydrophobicContact CB-CG2 3.96Å; L372-V384 HydrophobicContact CD1-CG1 3.84Å; L372-V384 HydrophobicContact CG-CG1 4.34Å; L372-Y387 HydrophobicContact CD2-CD1 4.08Å; L372-Y387 HydrophobicContact CD2-CE1 3.79Å; L372-L388 HydrophobicContact CD1-CD1 4.47Å; L372-L388 HydrophobicContact CD1-CD2 3.92Å; L372-L388 HydrophobicContact CD1-CG 4.36Å
373V91.3Very high89.3Confident24 Ų2475.1 Ų75.115%0.14539%0.391CS..Hα-helixtrans-62.4-38.1-171.1177.60000111.8N331 V371 K377 V384N331-V373 HydrophobicContact CB-CG1 3.98Å; N331-V373 HydrophobicContact CB-CG2 4.13Å; V371-V373 VanDerWaalsContact C-N 3.27Å; V371-V373 PolarHBondContact O-N 2.9Å; V373-K377 WeakPolarHBondContact O-CG 3.47Å; V373-K377 PolarHBondContact O-N 2.94Å; V373-V384 HydrophobicContact CB-CG2 4.39Å; V373-V384 HydrophobicContact CG2-CG2 3.87Å
374Y91.2Very high89.7Confident177 Ų17766.9 Ų66.969%0.69436%0.36SS*.Hα-helixtrans-73.2-41-179.4-60.8-70.2000112.2V371 L372 K377 Y378V371-Y374 HydrophobicContact CG1-CD2 4.01Å; V371-Y374 HydrophobicContact CG1-CE2 3.96Å; L372-Y374 VanDerWaalsContact C-N 3.3Å; L372-Y374 PolarHBondContact O-N 2.84Å; Y374-K377 PolarHBondContact O-N 3.48Å; Y374-Y378 PolarHBondContact O-N 2.84Å
375L91.3Very high90.2Very high90 Ų9066 Ų6647%0.47136%0.355SS..Hα-helixtrans-63-45.9176.3-70.6171.5000111.5L372 K377 Y378 H379L372-L375 HydrophobicContact CD2-CB 3.93Å; L372-L375 HydrophobicContact CD2-CD1 3.82Å; L372-L375 PolarHBondContact O-N 3.18Å; L375-K377 VanDerWaalsContact C-N 3.28Å; L375-K377 PolarHBondContact O-N 3.49Å; L375-Y378 WeakPolarHBondContact O-CB 3.48Å; L375-Y378 PolarHBondContact O-N 3.21Å; L375-Y378 VanDerWaalsContact O-N 3.12Å; L375-H379 PolarHBondContact O-CD2 2.91Å; L375-H379 PolarHBondContact O-N 3.31Å
376A93.6Very high90.6Very high1 Ų166.8 Ų66.81%0.00836%0.361CS..Hα-helixtrans-56.4-44.5176.300000111.7L372 H379 G380 F381 V384 Y387L372-A376 WeakPolarHBondContact O-CB 3.45Å; L372-A376 PolarHBondContact O-N 3.06Å; A376-H379 CarbonylContact O-C 3.53Å; A376-H379 PolarHBondContact O-N 3.19Å; A376-G380 PolarHBondContact O-N 3.42Å; A376-F381 CarbonylContact C-O 3.58Å; A376-F381 HydrophobicContact CB-CB 4.36Å; A376-F381 WeakPolarHBondContact O-CB 3.34Å; A376-F381 PolarHBondContact O-N 3.13Å; A376-V384 HydrophobicContact CB-CG2 4.23Å; A376-Y387 HydrophobicContact CB-CD1 4.3Å; A376-Y387 HydrophobicContact CB-CG 4.14Å
377K92.7Very high91.1Very high118 Ų11865 Ų6551%0.51335%0.354SS..Hα-helixtrans-65.7-38.6176.6-73.5-177.9176.8-165.40113.2V373 Y374 L375 H379 G380V373-K377 WeakPolarHBondContact O-CG 3.47Å; V373-K377 PolarHBondContact O-N 2.94Å; Y374-K377 PolarHBondContact O-N 3.48Å; L375-K377 VanDerWaalsContact C-N 3.28Å; L375-K377 PolarHBondContact O-N 3.49Å; K377-H379 VanDerWaalsContact C-N 3.26Å; K377-H379 PolarHBondContact O-N 2.97Å; K377-G380 PolarHBondContact O-N 3.24Å
378Y93.4Very high91.5Very high194 Ų19463.6 Ų63.676%0.76134%0.344SS*.Hα-helixtrans-60.1-39.2175.7178.7-98000111.5Y374 L375 G380Y374-Y378 PolarHBondContact O-N 2.84Å; L375-Y378 WeakPolarHBondContact O-CB 3.48Å; L375-Y378 PolarHBondContact O-N 3.21Å; L375-Y378 VanDerWaalsContact O-N 3.12Å; Y378-G380 PolarHBondContact O-N 3.07Å
379H91.9Very high91.9Very high95 Ų9567.7 Ų67.744%0.4435%0.351SS..THydrogen-bonded Turntrans-80.17.2174.2-66.8-69.4000114.3L375 A376 K377 F381 Y387L375-H379 PolarHBondContact O-CD2 2.91Å; L375-H379 PolarHBondContact O-N 3.31Å; A376-H379 CarbonylContact O-C 3.53Å; A376-H379 PolarHBondContact O-N 3.19Å; K377-H379 VanDerWaalsContact C-N 3.26Å; K377-H379 PolarHBondContact O-N 2.97Å; H379-F381 HydrophobicContact CB-CD2 3.73Å; H379-F381 HydrophobicContact CB-CE2 3.85Å; H379-F381 WeakPolarHBondContact O-CD2 3.35Å; H379-Y387 HydrophobicContact CB-CD2 4.23Å; H379-Y387 HydrophobicContact CB-CE2 4.02Å; H379-Y387 AromaticContact CD2-CE2 3.5Å; H379-Y387 AromaticContact CD2-CZ 3.66Å; H379-Y387 AromaticContact CG-CE2 3.83Å
380G94.4Very high92.5Very high66 Ų6668.3 Ų68.368%0.6836%0.355SS*.THydrogen-bonded Turntrans80.315.2176.600000115.2A376 K377 Y378A376-G380 PolarHBondContact O-N 3.42Å; K377-G380 PolarHBondContact O-N 3.24Å; Y378-G380 PolarHBondContact O-N 3.07Å
381F94.4Very high92.8Very high58 Ų5866.2 Ų66.225%0.25433%0.333SS..  trans-93.6137.4174.7-62.7-88.7000111.5A376 H379 N383 A386 Y387 S390A376-F381 CarbonylContact C-O 3.58Å; A376-F381 HydrophobicContact CB-CB 4.36Å; A376-F381 WeakPolarHBondContact O-CB 3.34Å; A376-F381 PolarHBondContact O-N 3.13Å; H379-F381 HydrophobicContact CB-CD2 3.73Å; H379-F381 HydrophobicContact CB-CE2 3.85Å; H379-F381 WeakPolarHBondContact O-CD2 3.35Å; F381-N383 VanDerWaalsContact C-N 3.3Å; F381-N383 PolarHBondContact O-N 2.99Å; F381-A386 HydrophobicContact CD1-CB 4Å; F381-Y387 AromaticContact CD2-CD2 3.54Å; F381-Y387 HydrophobicContact CD2-CD2 3.54Å; F381-Y387 HydrophobicContact CD2-CE2 4.5Å; F381-Y387 HydrophobicContact CD2-CG 4.17Å; F381-Y387 AromaticContact CE2-CD2 3.58Å; F381-Y387 HydrophobicContact CE2-CD2 3.58Å; F381-Y387 HydrophobicContact CE2-CE2 4.33Å; F381-Y387 HydrophobicContact CG-CD2 4.36Å; F381-Y387 HydrophobicContact CZ-CD2 4.42Å; F381-S390 WeakPolarHBondContact CZ-OG 3.37Å
382D91.4Very high92.9Very high143 Ų14364.4 Ų64.477%0.76532%0.316SS*.SBendtrans-69.2-30.5177.2-61.8-41.1000112.7
383N94.1Very high93.1Very high26 Ų2670.1 Ų70.114%0.13934%0.341CS..SBendtrans-141.3155.3-175.566.971.3000113.3N331 F381 H385 A386 Y387N331-N383 WeakPolarHBondContact O-CA 3.36Å; F381-N383 VanDerWaalsContact C-N 3.3Å; F381-N383 PolarHBondContact O-N 2.99Å; N383-H385 VanDerWaalsContact C-N 3.34Å; N383-H385 PolarHBondContact O-N 3.15Å; N383-H385 PolarHBondContact OD1-N 2.88Å; N383-A386 PolarHBondContact O-N 3.13Å; N383-A386 WeakPolarHBondContact OD1-CB 3.21Å; N383-A386 PolarHBondContact OD1-N 2.81Å; N383-Y387 PolarHBondContact O-N 3.07Å
384V94.7Very high93.1Very high0 Ų072 Ų720%035%0.348CS..Hα-helixtrans-65.9-34.9-177.6177.80000112.5N331 R332 L372 V373 A376 Y387 L388N331-V384 PolarHBondContact O-N 3.47Å; N331-V384 VanDerWaalsContact O-N 3.16Å; R332-V384 HydrophobicContact CG-CG2 4.36Å; L372-V384 HydrophobicContact CB-CB 4.47Å; L372-V384 HydrophobicContact CB-CG1 3.61Å; L372-V384 HydrophobicContact CB-CG2 3.96Å; L372-V384 HydrophobicContact CD1-CG1 3.84Å; L372-V384 HydrophobicContact CG-CG1 4.34Å; V373-V384 HydrophobicContact CB-CG2 4.39Å; V373-V384 HydrophobicContact CG2-CG2 3.87Å; A376-V384 HydrophobicContact CB-CG2 4.23Å; V384-Y387 PolarHBondContact O-N 3.16Å; V384-L388 HydrophobicContact CG1-CD1 3.98Å; V384-L388 HydrophobicContact CG1-CG 4.21Å; V384-L388 WeakPolarHBondContact O-CG 3.41Å; V384-L388 PolarHBondContact O-N 3.29Å
385H94.8Very high93.1Very high54 Ų5465.3 Ų65.325%0.2532%0.324CS..Hα-helixtrans-65.4-41.4-179-17668.6000112R332 Y333 N383 L388 K389R332-H385 VanDerWaalsContact O-CB 3.25Å; R332-H385 WeakPolarHBondContact O-CB 3.32Å; R332-H385 PolarHBondContact O-N 3.2Å; Y333-H385 HydrophobicContact CD1-CB 4.25Å; N383-H385 VanDerWaalsContact C-N 3.34Å; N383-H385 PolarHBondContact O-N 3.15Å; N383-H385 PolarHBondContact OD1-N 2.88Å; H385-L388 PolarHBondContact O-N 2.76Å; H385-K389 WeakPolarHBondContact O-CB 3.49Å; H385-K389 PolarHBondContact O-N 3.39Å
386A94.9Very high93.1Very high32 Ų3266.6 Ų66.626%0.26433%0.328SS..Hα-helixtrans-61.7-44.6174.600000111.4F381 N383 K389 S390F381-A386 HydrophobicContact CD1-CB 4Å; N383-A386 PolarHBondContact O-N 3.13Å; N383-A386 WeakPolarHBondContact OD1-CB 3.21Å; N383-A386 PolarHBondContact OD1-N 2.81Å; A386-K389 WeakPolarHBondContact O-CB 3.35Å; A386-K389 PolarHBondContact O-N 2.99Å; A386-K389 VanDerWaalsContact O-N 3.14Å; A386-S390 PolarHBondContact O-N 3.48Å
387Y94.6Very high93Very high22 Ų2271 Ų719%0.08635%0.348CS..Hα-helixtrans-59.9-46.7174.4176.9-119.3000112.5L372 A376 H379 F381 N383 V384 K389 S390 L391L372-Y387 HydrophobicContact CD2-CD1 4.08Å; L372-Y387 HydrophobicContact CD2-CE1 3.79Å; A376-Y387 HydrophobicContact CB-CD1 4.3Å; A376-Y387 HydrophobicContact CB-CG 4.14Å; H379-Y387 HydrophobicContact CB-CD2 4.23Å; H379-Y387 HydrophobicContact CB-CE2 4.02Å; H379-Y387 AromaticContact CD2-CE2 3.5Å; H379-Y387 AromaticContact CD2-CZ 3.66Å; H379-Y387 AromaticContact CG-CE2 3.83Å; F381-Y387 AromaticContact CD2-CD2 3.54Å; F381-Y387 HydrophobicContact CD2-CD2 3.54Å; F381-Y387 HydrophobicContact CD2-CE2 4.5Å; F381-Y387 HydrophobicContact CD2-CG 4.17Å; F381-Y387 AromaticContact CE2-CD2 3.58Å; F381-Y387 HydrophobicContact CE2-CD2 3.58Å; F381-Y387 HydrophobicContact CE2-CE2 4.33Å; F381-Y387 HydrophobicContact CG-CD2 4.36Å; F381-Y387 HydrophobicContact CZ-CD2 4.42Å; N383-Y387 PolarHBondContact O-N 3.07Å; V384-Y387 PolarHBondContact O-N 3.16Å; Y387-K389 PolarHBondContact O-N 3.32Å; Y387-S390 PolarHBondContact O-N 3.01Å; Y387-S390 PolarHBondContact O-OG 2.85Å; Y387-L391 HydrophobicContact CD1-CD1 4.24Å; Y387-L391 HydrophobicContact CD2-CG 4.48Å; Y387-L391 HydrophobicContact CE1-CD1 3.66Å; Y387-L391 HydrophobicContact CE1-CG 4.41Å; Y387-L391 HydrophobicContact CE2-CD1 4.17Å; Y387-L391 HydrophobicContact CE2-CD2 4.2Å; Y387-L391 HydrophobicContact CE2-CG 4.06Å; Y387-L391 WeakPolarHBondContact O-CG 3.47Å; Y387-L391 PolarHBondContact O-N 3.02Å; Y387-L391 VanDerWaalsContact O-N 3.07Å
388L92.8Very high92.8Very high8 Ų870 Ų704%0.04235%0.345CS..Hα-helixtrans-65.1-27.6176.7-70.1174.9000112.7L238 N356 T369 L372 V384 H385 L391 K392L238-L388 HydrophobicContact CB-CD2 4.13Å; N356-L388 HydrophobicContact CB-CD1 3.85Å; T369-L388 HydrophobicContact CG2-CD1 3.98Å; L372-L388 HydrophobicContact CD1-CD1 4.47Å; L372-L388 HydrophobicContact CD1-CD2 3.92Å; L372-L388 HydrophobicContact CD1-CG 4.36Å; V384-L388 HydrophobicContact CG1-CD1 3.98Å; V384-L388 HydrophobicContact CG1-CG 4.21Å; V384-L388 WeakPolarHBondContact O-CG 3.41Å; V384-L388 PolarHBondContact O-N 3.29Å; H385-L388 PolarHBondContact O-N 2.76Å; L388-L391 HydrophobicContact CD2-CD1 4.49Å; L388-K392 WeakPolarHBondContact O-CG 3.21Å; L388-K392 PolarHBondContact O-N 2.9Å
389K93.6Very high92.4Very high146 Ų14664.9 Ų64.964%0.63534%0.338SS*.Hα-helixtrans-74.7-37.7175.9-169.2179.2179.9-177.80111.6H385 A386 Y387 K392 K393H385-K389 WeakPolarHBondContact O-CB 3.49Å; H385-K389 PolarHBondContact O-N 3.39Å; A386-K389 WeakPolarHBondContact O-CB 3.35Å; A386-K389 PolarHBondContact O-N 2.99Å; A386-K389 VanDerWaalsContact O-N 3.14Å; Y387-K389 PolarHBondContact O-N 3.32Å; K389-K392 PolarHBondContact O-N 3.4Å; K389-K393 PolarHBondContact O-N 2.84Å; K389-K393 VanDerWaalsContact O-N 3.11Å
390S94.1Very high92Very high23 Ų2365.3 Ų65.316%0.16135%0.352CS..Hα-helixtrans-65.5-44.8174.1700000111.2F381 A386 Y387 K392 K393 E394F381-S390 WeakPolarHBondContact CZ-OG 3.37Å; A386-S390 PolarHBondContact O-N 3.48Å; Y387-S390 PolarHBondContact O-N 3.01Å; Y387-S390 PolarHBondContact O-OG 2.85Å; S390-K392 VanDerWaalsContact C-N 3.28Å; S390-K392 PolarHBondContact O-N 2.96Å; S390-K393 WeakPolarHBondContact O-CB 3.49Å; S390-K393 PolarHBondContact O-N 3.47Å; S390-K393 VanDerWaalsContact O-N 3.1Å; S390-E394 WeakPolarHBondContact O-CG 3.38Å; S390-E394 PolarHBondContact O-N 3.45Å
391L91.6Very high90.7Very high3 Ų373 Ų732%0.01637%0.367CS..Hα-helixtrans-59.3-38.4175.9-69.5180000112.6F236 V239 Y387 L388 L395F236-L391 WeakPolarHBondContact CD1-O 3.38Å; F236-L391 WeakPolarHBondContact CE1-O 3.41Å; V239-L391 HydrophobicContact CG2-CB 3.6Å; V239-L391 HydrophobicContact CG2-CD1 4.39Å; Y387-L391 HydrophobicContact CD1-CD1 4.24Å; Y387-L391 HydrophobicContact CD2-CG 4.48Å; Y387-L391 HydrophobicContact CE1-CD1 3.66Å; Y387-L391 HydrophobicContact CE1-CG 4.41Å; Y387-L391 HydrophobicContact CE2-CD1 4.17Å; Y387-L391 HydrophobicContact CE2-CD2 4.2Å; Y387-L391 HydrophobicContact CE2-CG 4.06Å; Y387-L391 WeakPolarHBondContact O-CG 3.47Å; Y387-L391 PolarHBondContact O-N 3.02Å; Y387-L391 VanDerWaalsContact O-N 3.07Å; L388-L391 HydrophobicContact CD2-CD1 4.49Å; L391-L395 WeakPolarHBondContact O-CB 3.48Å; L391-L395 PolarHBondContact O-N 3.38Å
392K90.9Very high90.6Very high71 Ų7173.8 Ų73.831%0.30937%0.372SS..Hα-helixtrans-61-47.6173.4-82.3172.8179.9-1690112.2V239 L388 K389 S390 L395 E396V239-K392 HydrophobicContact CB-CG 4.2Å; V239-K392 HydrophobicContact CG1-CB 4.19Å; V239-K392 HydrophobicContact CG1-CD 4.33Å; V239-K392 HydrophobicContact CG1-CG 3.23Å; V239-K392 HydrophobicContact CG2-CG 3.9Å; L388-K392 WeakPolarHBondContact O-CG 3.21Å; L388-K392 PolarHBondContact O-N 2.9Å; K389-K392 PolarHBondContact O-N 3.4Å; S390-K392 VanDerWaalsContact C-N 3.28Å; S390-K392 PolarHBondContact O-N 2.96Å; K392-L395 PolarHBondContact O-N 3.48Å; K392-E396 WeakPolarHBondContact O-CG 3.35Å; K392-E396 PolarHBondContact O-N 2.9Å
393K93.1Very high90.5Very high121 Ų12170.2 Ų70.253%0.52635%0.352SS..Hα-helixtrans-63.2-44.1-179.5-173.3174.9-174.8-770111.6K389 S390 L395 E396 E397K389-K393 PolarHBondContact O-N 2.84Å; K389-K393 VanDerWaalsContact O-N 3.11Å; S390-K393 WeakPolarHBondContact O-CB 3.49Å; S390-K393 PolarHBondContact O-N 3.47Å; S390-K393 VanDerWaalsContact O-N 3.1Å; K393-L395 PolarHBondContact O-N 2.89Å; K393-E396 PolarHBondContact O-N 3.34Å; K393-E397 WeakPolarHBondContact CG-OE1 3.39Å; K393-E397 IonicContact NZ-OE1 3.62Å; K393-E397 PolarHBondContact NZ-OE1 3.43Å; K393-E397 WeakPolarHBondContact O-CB 3.46Å; K393-E397 VanDerWaalsContact O-CG 3.29Å; K393-E397 WeakPolarHBondContact O-CG 3.4Å; K393-E397 PolarHBondContact O-N 2.93Å
394E92.2Very high90.3Very high63 Ų6372.6 Ų72.629%0.29436%0.364SS..Hα-helixtrans-60.6-43.1175.5-74.8173.3-142.200111.8K235 F236 S390 E397 E398K235-E394 WeakPolarHBondContact CE-OE2 3.4Å; K235-E394 IonicContact NZ-OE2 2.78Å; K235-E394 PolarHBondContact NZ-OE2 2.94Å; F236-E394 HydrophobicContact CE1-CB 3.69Å; F236-E394 HydrophobicContact CZ-CB 4.08Å; S390-E394 WeakPolarHBondContact O-CG 3.38Å; S390-E394 PolarHBondContact O-N 3.45Å; E394-E397 PolarHBondContact O-N 3.16Å; E394-E398 WeakPolarHBondContact O-CG 3.42Å; E394-E398 PolarHBondContact O-N 3.16Å
395L90.2Very high90.1Very high38 Ų3876.9 Ų76.920%0.19939%0.385CS..Hα-helixtrans-63.1-42.7175.5178.6145.6000112.5F236 R240 L391 K392 K393 E397 E398 S399F236-L395 HydrophobicContact CB-CB 4.48Å; F236-L395 HydrophobicContact CB-CD1 3.48Å; F236-L395 VanDerWaalsContact CB-CD1 3.48Å; F236-L395 HydrophobicContact CD1-CB 3.71Å; F236-L395 HydrophobicContact CD1-CD1 4.3Å; F236-L395 HydrophobicContact CE1-CB 4.05Å; F236-L395 HydrophobicContact CG-CB 4.04Å; F236-L395 HydrophobicContact CG-CD1 3.87Å; F236-L395 HydrophobicContact CG-CG 4.43Å; R240-L395 HydrophobicContact CG-CD1 3.58Å; L391-L395 WeakPolarHBondContact O-CB 3.48Å; L391-L395 PolarHBondContact O-N 3.38Å; K392-L395 PolarHBondContact O-N 3.48Å; K393-L395 PolarHBondContact O-N 2.89Å; L395-E397 VanDerWaalsContact C-N 3.33Å; L395-E398 PolarHBondContact O-N 3.44Å; L395-S399 WeakPolarHBondContact O-CB 3.43Å; L395-S399 PolarHBondContact O-N 3.46Å; L395-S399 PolarHBondContact O-OG 3.09Å
396E90.9Very high89.8Confident117 Ų11778.3 Ų78.355%0.54739%0.393SS..Hα-helixtrans-63.3-41177.9-73.5167.7-167.900111K392 K393 S399 S400K392-E396 WeakPolarHBondContact O-CG 3.35Å; K392-E396 PolarHBondContact O-N 2.9Å; K393-E396 PolarHBondContact O-N 3.34Å; E396-S399 WeakPolarHBondContact CA-OG 3.46Å; E396-S399 PolarHBondContact O-N 3.39Å; E396-S399 PolarHBondContact O-OG 3.43Å; E396-S400 WeakPolarHBondContact O-CB 3.32Å; E396-S400 PolarHBondContact O-N 3.32Å; E396-S400 VanDerWaalsContact O-N 3.09Å; E396-S400 PolarHBondContact O-OG 3.4Å
397E92.5Very high89.4Confident93 Ų9381.4 Ų81.444%0.43540%0.402SS..Hα-helixtrans-66.3-38.5175.7-72.7172.2-169.900112.8K393 E394 L395 S400 K401K393-E397 WeakPolarHBondContact CG-OE1 3.39Å; K393-E397 IonicContact NZ-OE1 3.62Å; K393-E397 PolarHBondContact NZ-OE1 3.43Å; K393-E397 WeakPolarHBondContact O-CB 3.46Å; K393-E397 VanDerWaalsContact O-CG 3.29Å; K393-E397 WeakPolarHBondContact O-CG 3.4Å; K393-E397 PolarHBondContact O-N 2.93Å; E394-E397 PolarHBondContact O-N 3.16Å; L395-E397 VanDerWaalsContact C-N 3.33Å; E397-S400 PolarHBondContact O-N 2.97Å; E397-K401 PolarHBondContact O-N 3.11Å
398E88.8Confident89Confident96 Ų9685.6 Ų85.645%0.44943%0.425SS..Hα-helixtrans-70.3-37.3174.6-75178.4-165.300112.4F236 E394 L395 S400 K401F236-E398 WeakPolarHBondContact CE2-OE2 3.5Å; F236-E398 VanDerWaalsContact CZ-OE1 3.31Å; F236-E398 WeakPolarHBondContact CZ-OE1 3.11Å; F236-E398 WeakPolarHBondContact CZ-OE2 3.24Å; E394-E398 WeakPolarHBondContact O-CG 3.42Å; E394-E398 PolarHBondContact O-N 3.16Å; L395-E398 PolarHBondContact O-N 3.44Å; E398-S400 PolarHBondContact O-N 3.37Å; E398-K401 PolarHBondContact O-N 3.3Å
399S85.4Confident88.8Confident87 Ų8791.6 Ų91.661%0.60845%0.454SS*.Hα-helixtrans-72.3-18.3176.268.60000114.1L395 E396L395-S399 WeakPolarHBondContact O-CB 3.43Å; L395-S399 PolarHBondContact O-N 3.46Å; L395-S399 PolarHBondContact O-OG 3.09Å; E396-S399 WeakPolarHBondContact CA-OG 3.46Å; E396-S399 PolarHBondContact O-N 3.39Å; E396-S399 PolarHBondContact O-OG 3.43Å
400S81.8Confident88.4Confident105 Ų10587.1 Ų87.173%0.73444%0.439SS*.THydrogen-bonded Turntrans-92.1-8.3178.6-57.30000113.1E396 E397 E398E396-S400 WeakPolarHBondContact O-CB 3.32Å; E396-S400 PolarHBondContact O-N 3.32Å; E396-S400 VanDerWaalsContact O-N 3.09Å; E396-S400 PolarHBondContact O-OG 3.4Å; E397-S400 PolarHBondContact O-N 2.97Å; E398-S400 PolarHBondContact O-N 3.37Å
401K68.9Low87.8Confident228 Ų22892.9 Ų92.999%0.99146%0.464SS*.  trans-90.40170.8-78.6174.6179.8170.30109.6E397 E398E397-K401 PolarHBondContact O-N 3.11Å; E398-K401 PolarHBondContact O-N 3.3Å

Retrieved 401 of 401 residues in 420.2 ms (Link to these results)