A0A087Y8E4_POEFO Loading...

RNA binding protein fox-1 homolog 2

AlphaFold DB , UniProt , Accession A0A087Y8E4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 456 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.8Very low44.1Very low235 Ų235144 Ų144100%1.15882%0.817SS**  0950-70.9166.2173.200105.5
2L41.4Very low43.6Very low148 Ų148144.1 Ų144.178%0.77581%0.813SS**  46119.450.2-71.9172000109
3M40.5Very low43.9Very low157 Ų157140.6 Ų140.677%0.77380%0.8SS**  cis-163.1138.929.2-93.1142.3159.600108.6
4S44.6Very low43.5Very low110 Ų110139.8 Ų139.877%0.76980%0.798SS**  51120.3109.4-67.10000118
5T56.3Low43.1Very low152 Ų152137.5 Ų137.593%0.93379%0.794SS**  -138.6118.712549.10000108.9
6D44.6Very low43.2Very low140 Ų140144.6 Ų144.675%0.74980%0.804SS**  trans-98.7141.3173.4-168.5-76.8000108
7V47Very low42.7Very low149 Ų149141.2 Ų141.290%0.90380%0.799SS**  trans-150.7120.7144.9117.50000110.2
8A41.3Very low42.8Very low74 Ų74142.2 Ų142.261%0.61280%0.801SS**  trans-77.1162.2-178.600000114.5
9S40.9Very low43.1Very low110 Ų110143.6 Ų143.677%0.76980%0.804SS**  trans154.2135.2139-77.30000109.8
10I47Very low43.3Very low148 Ų148144 Ų14476%0.75981%0.805SS**  cis-166.5115.25.7-86.5149.7000102.3
11M34.3Very low43.2Very low161 Ų161147 Ų14779%0.79380%0.803SS**  51.795.985.2-135.8-175.8-175.200117.7
12L38.2Very low42.9Very low145 Ų145143.8 Ų143.876%0.75979%0.791SS**  trans65175.4139.1-68.9169.5000119.3
13P48.1Very low42.9Very low99 Ų99146.3 Ų146.364%0.64379%0.79SS**  -138-160.3-54.239.7-21.7000112.3
14V37.6Very low42.9Very low129 Ų129145.6 Ų145.678%0.78279%0.785SS**  trans75.8144147.9158.20000115.7
15S38.7Very low42.6Very low105 Ų105147.9 Ų147.973%0.73479%0.788SS**  cis-168.9163.5-4.1-94.90000109.9
16R43.4Very low41.7Very low251 Ų251147.3 Ų147.395%0.94778%0.779SS**  trans-79.9124.1167.8-176.5176.1-174.6170.80.7110.4
17A35.1Very low41.2Very low88 Ų88146.5 Ų146.573%0.72778%0.779SS**  trans-172.9114.5156.300000108.5
18L45.1Very low40.7Very low159 Ų159148.5 Ų148.583%0.83278%0.781SS**  54.7114.397.9-89.1170.4000114
19I47.7Very low40.5Very low169 Ų169149.9 Ų149.987%0.86779%0.793SS**  trans-162.9120.3132.8-94.6139000109.3
20D47.3Very low40Very low151 Ų151148.2 Ų148.281%0.80779%0.792SS**  trans-90.4128.1162.7-165.4-67.9000106.5
21R41.2Very low39.4Very low207 Ų207147 Ų14778%0.78179%0.792SS**  trans142.7113.3161.4-89.3-169.1163.3114.9-1.3110.2
22D40.7Very low39.4Very low167 Ų167147.8 Ų147.889%0.89379%0.793SS**  -170.4147.6102.1-89.9-40.7000111.3
23R41.9Very low39.3Very low202 Ų202145.3 Ų145.376%0.76279%0.793SS**  trans-111.3139.3-166.2171.3-178.2-178.7174.41.9108.3
24E39.6Very low38.6Very low141 Ų141147.9 Ų147.966%0.65980%0.802SS**  trans68.7123.3158.3-74.4164.1-167.500118.7
25L39.3Very low39.2Very low159 Ų159146.8 Ų146.883%0.83280%0.797SS**  178154.9110.8-91159.4000112.8
26D36.8Very low38.9Very low140 Ų140147.3 Ų147.375%0.74980%0.801SS**  trans96.375.7165.7-61-52.7000121.2
27T35Very low38.3Very low122 Ų122139.2 Ų139.275%0.74880%0.796SS**  4.4127.5122.935.60000119.9
28M35.9Very low38.3Very low191 Ų191139.5 Ų139.594%0.94180%0.798SS**  175.4157.6106.2-111.9-175.8168.600115.2
29A36.1Very low38.8Very low104 Ų104138.2 Ų138.286%0.8680%0.799SS**  trans86.592.3178.400000114.6
30G32.1Very low38.1Very low74 Ų74133.6 Ų133.676%0.76379%0.794SS**  97.7135.865.700000107.7
31V34.6Very low37.5Very low124 Ų124131 Ų13175%0.75279%0.793SS**  cis-165.8137.317.2177.40000105.7
32H34.3Very low37.4Very low176 Ų176127.5 Ų127.582%0.81579%0.794SS**  trans156.4109.4131.6-96.2-87.4000114.4
33A34.3Very low37.2Very low93 Ų93130 Ų13077%0.76979%0.791SS**  trans48.1105.2139.500000121.9
34N34.7Very low36.8Very low153 Ų153123.5 Ų123.582%0.81879%0.787SS**  trans-60.4176.2145-127.8-6.8000110.6
35P49.4Very low36.6Very low106 Ų106124 Ų12469%0.68879%0.792SS**  cis-139.6164.421.734.7-11.2000114.8
36S33Very low36.6Very low117 Ų117125.4 Ų125.482%0.81879%0.791SS**  166.7144.190.146.40000110.5
37G30.1Very low36.7Very low81 Ų81129.7 Ų129.784%0.83580%0.796SS**  trans108.766.3154.400000117.7
38A35Very low36.6Very low93 Ų93127.4 Ų127.477%0.76980%0.797SS**  trans-89.5-179.2146.300000108.6
39P55.4Low36.7Very low132 Ų132125.5 Ų125.586%0.85779%0.791SS**  cis-132.1-179-35.825.9-4000111.3
40G33.2Very low37.6Very low73 Ų73126.6 Ų126.675%0.75379%0.789SS**  trans14491.5152.500000119
41A36.2Very low38.1Very low95 Ų95129.1 Ų129.179%0.78578%0.781SS**  45.4131.5115.300000123.1
42V37.7Very low39.1Very low134 Ų134129.1 Ų129.181%0.81278%0.783SS**  trans84.6124.1142.4-136.30000122.3
43R36Very low39.3Very low220 Ų220127.4 Ų127.483%0.8378%0.78SS**  106.4129.1126.9-139.3163.9-179.8171.5-1.4120M45R43-M45 HydrophobicContact CG-SD 4.08Å
44G33.8Very low39.5Very low66 Ų66126 Ų12668%0.6877%0.774SS**  trans141.282.5155.200000114.1
45M36.8Very low39.6Very low152 Ų152127.4 Ų127.475%0.74978%0.776SS**  63.7117.992.7-85.184.4-17900118R43R43-M45 HydrophobicContact CG-SD 4.08Å
46K39.4Very low38.9Very low187 Ų187128.2 Ų128.281%0.81378%0.779SS**  trans82.1132.8140.4-133.3140.6-178.2-178.50116.1
47R38.1Very low39.1Very low231 Ų231127.3 Ų127.387%0.87278%0.778SS**  cis-176.914333.7-148.7176.8-24.7-176.110.3109.8
48G33.6Very low39.3Very low73 Ų73127.7 Ų127.775%0.75377%0.774SS**  trans15080.7157.100000117.3
49D37.9Very low39.3Very low152 Ų152127.7 Ų127.781%0.81377%0.774SS**  trans-75.9167.7161.8-60.4-69.1000111.7
50P53.7Low38.4Very low127 Ų127128.6 Ų128.683%0.82577%0.771SS**  -138.2132.181.932.3-14.4000116.2
51E44.1Very low38.7Very low127 Ų127133.2 Ų133.259%0.59378%0.775SS**  trans0.3147.1136.8-82.9-91.8127.800120.1D53E51-D53 PolarHBondContact OE2-N 3.31Å
52P53.7Low38.5Very low124 Ų124135.4 Ų135.481%0.80577%0.773SS**  -133.6135.284.635-21.9000116.6
53D39.7Very low38.4Very low140 Ų140132.8 Ų132.875%0.74976%0.761SS**  trans-20.6139.3148.7-68.6-60.4000113.7E51E51-D53 PolarHBondContact OE2-N 3.31Å
54G37.8Very low38.2Very low62 Ų62129.2 Ų129.264%0.63976%0.763SS**  cis141.9156.716.500000108.7
55Q38.1Very low38.1Very low184 Ų184129.5 Ų129.586%0.8677%0.766SS**  trans88.8125.1164.1-50.8178.414.300116.8
56T34.7Very low38.1Very low123 Ų123127.2 Ų127.276%0.75577%0.772SS**  cis-169.9142-0.114.50000108.3
57A35.4Very low38.1Very low97 Ų97127.2 Ų127.280%0.80278%0.775SS**  trans55.6142137.100000120.2
58A35.1Very low37.9Very low89 Ų89122.8 Ų122.874%0.73678%0.778SS**  cis-177.4163.3-2.500000107.4
59A33.9Very low38.2Very low93 Ų93128.8 Ų128.877%0.76978%0.783SS**  trans68.9150.315200000117.8
60L37.4Very low38.3Very low152 Ų152133 Ų13380%0.79679%0.788SS**  cis175.2146.5-26.3-116.8160.1000102.5
61M39.1Very low38Very low169 Ų169132.5 Ų132.583%0.83378%0.784SS**  trans76.4115.4154.8-89.8157.415200121.3
62D31.8Very low37.7Very low142 Ų142136.5 Ų136.576%0.75979%0.794SS**  104.9119.1120.6-140.6-114000120.1
63S36.1Very low37Very low78 Ų78138 Ų13855%0.54579%0.793SS.*  trans69.5122.3139.7-67.70000123.6
64T31.6Very low37Very low145 Ų145137.4 Ų137.489%0.8979%0.79SS**  trans77.6138.2137.360.70000120.8
65G32Very low36.7Very low72 Ų72138.3 Ų138.374%0.74280%0.8SS**  trans115.895.1163.500000112.7
66A36.5Very low36.9Very low104 Ų104135.3 Ų135.386%0.8680%0.799SS**  77.6130.786.600000113.9
67E38.8Very low36.7Very low187 Ų187133.6 Ų133.687%0.87481%0.805SS**  trans-36.2146.8178.5-62.9164.872.600115.7
68C35.8Very low36.7Very low138 Ų138132.2 Ų132.293%0.93280%0.801SS**  trans-154.4121.4144.5-99.20000114
69K38.5Very low36.6Very low200 Ų200136.7 Ų136.787%0.8781%0.81SS**  trans-62.5155.5161.6-104.7154.6171.9162.20111.3
70R41.3Very low36.5Very low241 Ų241136.1 Ų136.191%0.90981%0.813SS**  trans-36.7140.8170.6-56.8176-179.3-171.2-1.9114.3
71P47.1Very low36.3Very low116 Ų116137.7 Ų137.775%0.75382%0.817SS**  trans-92.1123.6161.632.4-25.4000111.3
72R37.4Very low36.2Very low211 Ų211137.6 Ų137.680%0.79682%0.818SS**  trans-89.6131.3146.7177.5-173176.398.13.6105.3D74R72-D74 IonicContact CZ-OD2 3.85Å; R72-D74 IonicContact NE-OD2 3.17Å; R72-D74 PolarHBondContact NE-OD2 3.09Å; R72-D74 IonicContact NH2-OD2 3.61Å
73I39.9Very low36.3Very low154 Ų154133.9 Ų133.979%0.7981%0.813SS**  trans-119.3114.9171.4-84.1164.4000108.1
74D38Very low36.2Very low129 Ų129138.8 Ų138.869%0.6983%0.827SS**  trans-93143.1156.9-78.8-65.6000107R72R72-D74 IonicContact CZ-OD2 3.85Å; R72-D74 IonicContact NE-OD2 3.17Å; R72-D74 PolarHBondContact NE-OD2 3.09Å; R72-D74 IonicContact NH2-OD2 3.61Å
75G33.3Very low36.2Very low81 Ų81139.5 Ų139.584%0.83583%0.825SS**  trans-162.6105.5176.600000112.7
76S40.7Very low36.4Very low121 Ų121144 Ų14485%0.84683%0.832SS**  trans-105.5146.7-17651.20000113.1
77G31.9Very low36.5Very low86 Ų86146.1 Ų146.189%0.88783%0.829SS**  trans85.6131165.300000113.3
78G33.7Very low37Very low68 Ų68142.2 Ų142.270%0.70182%0.821SS**  cis134.6156.126.900000106.8
79I34.9Very low37Very low184 Ų184142.6 Ų142.694%0.94481%0.813SS**  trans76.6104.1168.133.2-179.9000122.4
80G31.7Very low36.9Very low80 Ų80138.6 Ų138.683%0.82581%0.805SS**  trans71.6145.213200000119.7
81E32.6Very low36.8Very low186 Ų186135.7 Ų135.787%0.86981%0.807SS**  cis-174.2-178-5.2-155.7-170.2118.400105.9
82I37.4Very low35.9Very low167 Ų167133.5 Ų133.586%0.85681%0.805SS**  trans92.292.7-177.6-45.1156.6000111.8
83G32.8Very low35.6Very low64 Ų64133.6 Ų133.666%0.6681%0.807SS**  107.7110.556.700000106.3
84Q34.9Very low35.5Very low180 Ų180133.6 Ų133.684%0.84180%0.803SS**  -168.7132.478.7-77.11645.100107.9
85N30.8Very low35.1Very low160 Ų160130.5 Ų130.586%0.85680%0.802SS**  -171127.8123.7-88.6-45.8000108.5
86N35.7Very low35.4Very low166 Ų166135.8 Ų135.889%0.88880%0.798SS**  trans-64.3131.4-170.2-70.2-74.9000113.3
87D38.5Very low35.8Very low149 Ų149135.7 Ų135.780%0.79780%0.795SS**  trans-63.5167.9152.6-84.4-47.8000110.7
88P50.9Low35.8Very low106 Ų106136.1 Ų136.169%0.68878%0.784SS**  cis-161.817344.549.9-27.9000121.5
89L35.5Very low35.9Very low146 Ų146141.5 Ų141.576%0.76479%0.79SS**  trans82.597149.8-54.8-166.3000121.6
90T36.1Very low35.9Very low116 Ų116137.4 Ų137.471%0.71278%0.778SS**  53.1126.9119.360.90000123.2
91L38.2Very low36Very low180 Ų180143 Ų14394%0.94278%0.783SS**  trans60.6119.5139.8-111.582.9000120
92G29.1Very low35.9Very low69 Ų69138.1 Ų138.171%0.71178%0.782SS**  trans144.3118.914900000116
93Y30.7Very low35.9Very low213 Ų213135.2 Ų135.284%0.83578%0.776SS**  49.2121.6123-102.9-105.8000121
94H38.7Very low36.1Very low154 Ų154140.2 Ų140.271%0.71378%0.783SS**  trans76137.8145.4-81.5-34.4000124.1
95G29.8Very low36.1Very low65 Ų65139.1 Ų139.167%0.6778%0.782SS**  trans137.488.3146.200000115.3
96Y38.7Very low36.5Very low192 Ų192137.3 Ų137.375%0.75378%0.782SS**  66.8155.284.4-77.2-72.6000115.6
97P49.8Very low36.5Very low119 Ų119134.3 Ų134.377%0.77378%0.781SS**  cis-140.8153.828.629.7-3.7000117.4
98S31.3Very low36.3Very low94 Ų94131.3 Ų131.366%0.65779%0.785SS**  70.7112.684.8-60.10000120.2
99H36.2Very low35.6Very low182 Ų182129.5 Ų129.584%0.84379%0.786SS**  -164.5107129.4-108.858.9000109.1
100S34.3Very low35.7Very low97 Ų97131.6 Ų131.668%0.67879%0.791SS**  69.8130.3102.2720000113.5
101Q34.9Very low35.6Very low199 Ų199134.9 Ų134.993%0.9380%0.799SS**  cis-179.4150.66.3-159.7-178.92100105.3
102G29.6Very low36Very low82 Ų82129.7 Ų129.785%0.84579%0.788SS**  trans141.511216100000114.3
103S37.5Very low36.8Very low106 Ų106134.4 Ų134.474%0.74180%0.796SS**  trans-119.4155-167.5-158.70000110.8
104Q38Very low37.9Very low170 Ų170130.1 Ų130.179%0.79479%0.792SS**  trans72.6136.8162.1-63.5176.4-200115
105D33.5Very low38.7Very low156 Ų156128 Ų12883%0.83479%0.792SS**  cis-148.7164.745.5-28-75.2000113.7
106S40.7Very low40.1Very low123 Ų123130.3 Ų130.386%0.8680%0.795SS**  trans-90.3145.5178.4-60.90000113.1
107A34.3Very low40.8Very low103 Ų103127 Ų12785%0.85180%0.797SS**  trans-172.9132.3136.900000110.6
108G35.4Very low40.7Very low86 Ų86131.2 Ų131.289%0.88780%0.804SS**  trans-87.4168.4167.700000112.2
109G34.5Very low41.4Very low68 Ų68132.2 Ų132.270%0.70181%0.811SS**  trans13091.2157.300000115.8
110Q37.8Very low42.2Very low189 Ų189128 Ų12888%0.88381%0.807SS**  trans64159.8143.7-52.8-147.9-12.800120.3
111E35.7Very low43.4Very low186 Ų186132.8 Ų132.887%0.86982%0.816SS**  trans81.9105.6161.386.3-161.6118.800120.8
112G45.9Very low45.1Very low70 Ų70128.5 Ų128.572%0.72281%0.805SS**  trans85.7118.5147.900000116.3
113L45.4Very low47.1Very low169 Ų169130.1 Ų130.189%0.88580%0.801SS**  trans165.8104.7131.7-84156.4000110.4
114V54.5Low48.7Very low122 Ų122130.6 Ų130.674%0.73980%0.802SS**  trans45.7118.7140.6-161.40000119
115P56Low50.5Low109 Ų109128.1 Ų128.171%0.70880%0.8SS**PPolyproline II helixtrans-66.2146.1169.229.2-33.4000111.1
116P57.5Low52.4Low115 Ų115126.1 Ų126.175%0.74780%0.796SS**PPolyproline II helixtrans-61.8142.6179.826.9-33.8000110.4F118P116-F118 PolarHBondContact O-N 2.87Å
117P53.3Low53.9Low121 Ų121125.9 Ų125.979%0.78679%0.791SS**PPolyproline II helixtrans-64.1129.9-179.126.4-32.8000109.7S119P117-S119 PolarHBondContact O-N 3.18Å; P117-S119 VanDerWaalsContact O-N 3.09Å
118F48.3Very low55.5Low209 Ų209126.3 Ų126.392%0.91779%0.785SS**PPolyproline II helixtrans-49.6116.5167.2-86.5-98.1000109P116 A120P116-F118 PolarHBondContact O-N 2.87Å; F118-A120 VanDerWaalsContact C-N 3.32Å; F118-A120 PolarHBondContact O-N 3.2Å
119S47Very low56.8Low115 Ų115128 Ų12880%0.80478%0.781SS**  trans-60.999.1165.4-59.90000108P117 F121P117-S119 PolarHBondContact O-N 3.18Å; P117-S119 VanDerWaalsContact O-N 3.09Å; S119-F121 PolarHBondContact O-N 3.3Å
120A51.8Low57.9Low93 Ų93133.8 Ų133.877%0.76979%0.79SS**PPolyproline II helixtrans-56.1118.8172.300000108.6F118F118-A120 VanDerWaalsContact C-N 3.32Å; F118-A120 PolarHBondContact O-N 3.2Å
121F59.3Low58.3Low197 Ų197132.8 Ų132.886%0.86479%0.79SS**PPolyproline II helixtrans-57.6133.5167.5-87.2-95.8000108.8S119S119-F121 PolarHBondContact O-N 3.3Å
122P70.9Confident59.1Low109 Ų109127.2 Ų127.271%0.70878%0.782SS**PPolyproline II helixtrans-64141.117526.4-32.5000109.8
123P71.8Confident58.9Low116 Ų116132 Ų13275%0.75379%0.791SS**PPolyproline II helixtrans-62.8151.1176.426.8-33.7000110.9
124P72.2Confident58.8Low116 Ų116130.6 Ų130.675%0.75379%0.789SS**PPolyproline II helixtrans-62.4149.1-179.926.7-34.3000111.6
125P75.1Confident58.2Low118 Ų118132.6 Ų132.677%0.76680%0.795SS**PPolyproline II helixtrans-65.4148.9-18027.1-34000111.9
126P73.3Confident58Low115 Ų115135 Ų13575%0.74780%0.802SS**PPolyproline II helixtrans-66152.2177.527.7-34000111.9
127P72.8Confident56.9Low117 Ų117139.8 Ų139.876%0.7681%0.807SS**PPolyproline II helixtrans-64.7150.7179.327.6-34.4000111.9
128P67.4Low56.2Low112 Ų112136.8 Ų136.873%0.72780%0.798SS**PPolyproline II helixtrans-65.9147.3-179.727.3-34.1000111.8Q130P128-Q130 PolarHBondContact O-N 3.24Å
129P62.1Low55.6Low121 Ų121132.5 Ų132.579%0.78679%0.794SS**PPolyproline II helixtrans-65.7120.8-179.926-32.5000110.5N131P129-N131 PolarHBondContact O-N 3.4Å
130Q57.4Low54.9Low191 Ų191132.4 Ų132.489%0.89379%0.793SS**PPolyproline II helixtrans-70.8121161.5-80.7-176.9-19.700108.1P128 G132P128-Q130 PolarHBondContact O-N 3.24Å; Q130-G132 PolarHBondContact O-N 3.47Å
131N46Very low54.2Low168 Ų168135 Ų13590%0.89879%0.794SS**SBendtrans-51.3121.1175.8-83-26.1000111.7P129P129-N131 PolarHBondContact O-N 3.4Å
132G52.9Low53.2Low68 Ų68136.6 Ų136.670%0.70180%0.795SS**  trans86.657.4135.600000117.7Q130Q130-G132 PolarHBondContact O-N 3.47Å
133L41Very low51.4Low171 Ų171135.4 Ų135.490%0.89580%0.795SS**  trans-141.5118.8146.6-72.1179.6000109.4L135L133-L135 PolarHBondContact O-N 3.28Å
134T43.9Very low49.4Very low140 Ų140135.3 Ų135.386%0.85980%0.803SS**  trans-71.5113.5172.984.30000107.4
135L43.2Very low47.5Very low164 Ų164133.2 Ų133.286%0.85980%0.803SS**  trans-128.994.6163.6-144.374.8000107.8L133 Y137L133-L135 PolarHBondContact O-N 3.28Å; L135-Y137 PolarHBondContact O-N 3.2Å
136D50.1Low45.4Very low159 Ų159132.1 Ų132.185%0.8580%0.804SS**  trans-56.9107.1162.8-170.4-92000108
137Y35.7Very low43.3Very low215 Ų215132.6 Ų132.684%0.84381%0.805SS**  trans-150.786.4165.1-157.2-101000111.2L135L135-Y137 PolarHBondContact O-N 3.2Å
138G38Very low41.5Very low58 Ų58136.3 Ų136.360%0.59881%0.812SS**  trans58.491.5130.600000118.5
139S35.2Very low39.8Very low120 Ų120134.3 Ų134.384%0.83981%0.812SS**  trans-163.8103.1136.5-92.70000111.2
140S32.9Very low39Very low113 Ų113134.4 Ų134.479%0.7981%0.812SS**  trans-172138.4135.4-88.70000111.5
141L37Very low37.8Very low148 Ų148131.5 Ų131.578%0.77581%0.808SS**  trans97.385.3154.5-60149000118.1A143L141-A143 HydrophobicContact CD2-CB 4.35Å
142Y38.5Very low37.2Very low230 Ų230131.7 Ų131.790%0.90280%0.803SS**  -67109.9124.337.6-90000108.5
143A32.9Very low36.1Very low84 Ų84135.7 Ų135.769%0.69481%0.813SS**  trans-169.5114.1151.900000108.3L141L141-A143 HydrophobicContact CD2-CB 4.35Å
144A31Very low35.7Very low113 Ų113131.3 Ų131.393%0.93481%0.809SS**  trans-71.3148.6175.900000111.8
145G30.2Very low35Very low73 Ų73128.4 Ų128.475%0.75381%0.807SS**  trans137127.1150.300000116.8
146A31.7Very low34.6Very low95 Ų95125.9 Ų125.979%0.78581%0.81SS**  trans75.9108.2159.200000117.3
147V30.2Very low33.6Very low125 Ų125122 Ų12276%0.75881%0.807SS**  94.3129.270.7161.50000112.6
148Q33.5Very low33.9Very low194 Ų194119.9 Ų119.991%0.90781%0.811SS**  trans75.7136174.4-65.8162.925.600115.6
149G31.8Very low33.7Very low71 Ų71122.9 Ų122.973%0.73282%0.823SS**  cis169.6162.39.400000106.8
150P46.2Very low33.8Very low122 Ų122122.4 Ų122.479%0.79283%0.826SS**  trans-98.7-166.4-14938.5-34.6000116
151V31.9Very low33.7Very low131 Ų131121 Ų12179%0.79483%0.829SS**  trans83.9133161.2-76.50000118.3
152E33Very low33.7Very low172 Ų172121.9 Ų121.980%0.80484%0.835SS**  cis-153.3139.27.9-58.1-157.8114.200109.3
153V31.1Very low33.5Very low151 Ų151115.6 Ų115.692%0.91583%0.83SS**  46.9123.593.4-174.20000118
154G31Very low33.4Very low79 Ų79114.8 Ų114.881%0.81483%0.83SS**  trans121.7128.6159.300000112.2
155G29.9Very low33.8Very low79 Ų79117.5 Ų117.581%0.81483%0.829SS**  cis149.5137.418.800000106.5
156A34.1Very low34Very low112 Ų112119.6 Ų119.693%0.92683%0.828SS**  trans-65.8162.6-171.800000115.4
157G30.7Very low34.1Very low76 Ų76122.8 Ų122.878%0.78483%0.83SS**  trans171105.8161.100000115.4
158N42Very low34.2Very low172 Ų172120.7 Ų120.792%0.9284%0.835SS**  trans-66.8145.3167-75.3-41.7000111.9
159S33.1Very low34.4Very low121 Ų121119.8 Ų119.885%0.84683%0.83SS**  trans-167128.7142.949.50000112.2
160A36.4Very low34.7Very low110 Ų110122.1 Ų122.191%0.90984%0.835SS**  trans-67.4148.7168.900000112
161G32.4Very low34.1Very low83 Ų83123.9 Ų123.986%0.85684%0.838SS**  trans-152127.1173.900000110.9
162N37.3Very low34.1Very low166 Ų166121.4 Ų121.489%0.88884%0.839SS**  trans-85.6157.4-170.3-179.725.3000113.5
163A33.4Very low34.3Very low98 Ų98119 Ų11981%0.8184%0.841SS**  trans139.2132.4152.400000109.6
164G31.7Very low34.6Very low68 Ų68118 Ų11870%0.70184%0.841SS**  cis151.4128.48.300000106.5
165N38.6Very low34.8Very low170 Ų170122.6 Ų122.691%0.90984%0.841SS**  trans-168.5147.5142.3-1182.8000113
166T34.2Very low35.2Very low117 Ų117125.3 Ų125.372%0.71884%0.836SS**  trans-103147.5-157.844.50000114.3
167L34.3Very low35.2Very low161 Ų161127.1 Ų127.184%0.84383%0.83SS**  trans36.9133.3139.8-81.879.7000122.7
168G32.8Very low35.3Very low82 Ų82126.5 Ų126.585%0.84582%0.824SS**  trans-166.392.2148.600000111.4
169Q37.3Very low34.9Very low174 Ų174127.6 Ų127.681%0.81382%0.823SS**  trans-86.1150.8170.4-82.2168.74.600110.9
170S36.5Very low35.2Very low120 Ų120126.7 Ų126.784%0.83982%0.817SS**  trans-167124.6131.154.10000112.2
171D34.9Very low35.2Very low159 Ų159128.2 Ų128.285%0.8582%0.815SS**  trans-69.8167.2170.9-73.6-57.7000114.6
172G31.2Very low35.5Very low79 Ų79131 Ų13181%0.81482%0.815SS**  trans177.588.3162.100000115.2
173S38.2Very low35.5Very low121 Ų121126.9 Ų126.985%0.84681%0.811SS**  trans-80.7152.7175.5-48.80000114
174S36.7Very low36Very low131 Ų131128.8 Ų128.892%0.91682%0.818SS**  trans-157.9146.6146.447.30000112.1
175Q35.9Very low36Very low176 Ų176129.1 Ų129.182%0.82282%0.822SS**  trans-123166.1-160.3-162.9-171-11.700110.3
176I37.4Very low36Very low135 Ų135125.2 Ų125.269%0.69282%0.822SS**  trans77.9142160.776.3148000118
177D34Very low36.1Very low150 Ų150123.7 Ų123.780%0.80283%0.83SS**  cis-166.716217.7-123.7-48.5000109.1
178G32.4Very low36.2Very low64 Ų64119.9 Ų119.966%0.6683%0.829SS**  trans125.683.3151.300000121.2
179Q34.8Very low36.6Very low194 Ų194120.4 Ų120.491%0.90784%0.835SS**  70.7128.6124-147.5152.7-1.100123.3
180S39Very low36.6Very low102 Ų102115.5 Ų115.571%0.71383%0.831SS**  trans-62141.2174.455.80000115.9
181V36.8Very low37.1Very low142 Ų142114 Ų11486%0.86184%0.835SS**  trans-149.8132139.7-162.30000110.5
182V37.8Very low37.2Very low143 Ų143109.6 Ų109.687%0.86783%0.827SS**  trans-66.5143169.7-74.20000111.9
183G37.5Very low38.8Very low78 Ų78112.4 Ų112.480%0.80483%0.831SS**  trans-168.585.7174.900000112.6
184S43.2Very low39.6Very low138 Ų138110 Ų11097%0.96583%0.825SS**  trans-62.3129.6166.6-61.80000110.9
185G33Very low39.9Very low75 Ų75109.8 Ų109.877%0.77381%0.813SS**  trans-170.7111.2168.800000109.3
186G37.9Very low40.8Very low89 Ų89109.6 Ų109.692%0.91882%0.818SS**  trans-78.5177-164.900000116.6
187G36.4Very low41.6Very low85 Ų85107.3 Ų107.388%0.87681%0.814SS**  trans144124.2162.800000113.5
188G37Very low42.4Very low80 Ų80106.9 Ų106.983%0.82581%0.811SS**  trans112.380.2155.100000116.3G190G188-G190 PolarHBondContact O-N 2.9Å
189G40.8Very low43.5Very low94 Ų94108.8 Ų108.897%0.96982%0.821SS**  trans-72.177.316000000110.4
190G37.9Very low44.7Very low70 Ų70108 Ų10872%0.72282%0.815SS**  trans-87.1110.5169.700000110G188 G192G188-G190 PolarHBondContact O-N 2.9Å; G190-G192 PolarHBondContact O-N 3.44Å; G190-G192 VanDerWaalsContact O-N 3.08Å
191G47.1Very low46.2Very low90 Ų90105.1 Ų105.193%0.92880%0.801SS**  trans-73.390.4166.500000109.8
192G36.1Very low48.6Very low66 Ų66102.5 Ų102.568%0.6879%0.786SS**  trans-89.6145.8167.500000111.1G190G190-G192 PolarHBondContact O-N 3.44Å; G190-G192 VanDerWaalsContact O-N 3.08Å
193P64.4Low51.2Low138 Ų13899.7 Ų99.790%0.89677%0.77SS**  trans-84.8136.8-176.934.3-30.7000110.9
194G55.1Low53.9Low70 Ų7097.6 Ų97.672%0.72274%0.739SS**  trans128.8105.7165.700000113.9
195D42.9Very low56.4Low127 Ų12792.8 Ų92.868%0.67970%0.7SS**  -162.5105.7126.9-139.5-76.3000109.8S197D195-S197 PolarHBondContact O-N 3.27Å; D195-S197 VanDerWaalsContact O-N 3.11Å; D195-S197 WeakPolarHBondContact OD1-CB 3.38Å; D195-S197 PolarHBondContact OD1-OG 3.43Å
196D55.6Low59.5Low172 Ų17289.2 Ų89.292%0.9266%0.663SS**THydrogen-bonded Turntrans-78.335.5177.5-91.6-80.1000112.6
197S53.7Low62.3Low87 Ų8787 Ų8761%0.60863%0.628SS**THydrogen-bonded Turntrans-119.9-1.5-170-48.10000116.4D195 A199D195-S197 PolarHBondContact O-N 3.27Å; D195-S197 VanDerWaalsContact O-N 3.11Å; D195-S197 WeakPolarHBondContact OD1-CB 3.38Å; D195-S197 PolarHBondContact OD1-OG 3.43Å; S197-A199 PolarHBondContact O-N 3.24Å
198D51Low65.2Low140 Ų14082.9 Ų82.975%0.74959%0.587SS**  trans-103.359.3174.2-77-62.9000112.1K200D198-K200 PolarHBondContact O-N 3.16Å
199A56.1Low68.1Low104 Ų10480 Ų8086%0.8655%0.553SS**  trans-66.123169.400000113.9S197 G201S197-A199 PolarHBondContact O-N 3.24Å; A199-G201 PolarHBondContact O-N 3.36Å
200K58.3Low70.7Confident178 Ų17878.2 Ų78.277%0.77452%0.522SS*.SBendtrans-86.575.8164.6-171.2129.2156.7-78.70106.7D198 T202D198-K200 PolarHBondContact O-N 3.16Å; K200-T202 PolarHBondContact O-N 3.1Å
201G70.9Confident73.5Confident42 Ų4274.9 Ų74.943%0.43349%0.488SS..  trans-34.397-17300000112.8A199 E251A199-G201 PolarHBondContact O-N 3.36Å; G201-E251 CarbonylContact C-O 3.54Å
202T87.2Confident75.8Confident87 Ų8770.9 Ų70.953%0.53445%0.445SS..  trans-80.3124.6173.447.50000106.7K200 K204 E251 S253K200-T202 PolarHBondContact O-N 3.1Å; T202-K204 PolarHBondContact O-N 3.42Å; T202-E251 CarbonylContact C-O 3.53Å; T202-S253 PolarHBondContact O-N 3.42Å; T202-S253 VanDerWaalsContact O-N 3.1Å
203P92.1Very high78.7Confident84 Ų8472.8 Ų72.855%0.54544%0.435SS..  trans-64.5127.7-179.425.9-33.5000109L231 T249 F250 E251P203-L231 HydrophobicContact CB-CD1 3.71Å; P203-T249 HydrophobicContact CB-CG2 4.34Å; P203-F250 CarbonylContact C-O 3.58Å; P203-F250 WeakPolarHBondContact CA-O 3.43Å; P203-F250 WeakPolarHBondContact CB-O 3.3Å; P203-E251 WeakPolarHBondContact CA-O 3.35Å
204K95.4Very high80.2Confident33 Ų3375.7 Ų75.714%0.14343%0.428CS..EExtended strand (participates in β ladder)trans-115.8131.1-176.9-173.5166.2-177176.10110.2T202 F250 A256 E257T202-K204 PolarHBondContact O-N 3.42Å; K204-F250 PolarHBondContact N-O 3.36Å; K204-F250 VanDerWaalsContact N-O 3.12Å; K204-F250 PolarHBondContact O-N 3.39Å; K204-A256 HydrophobicContact CB-CB 3.79Å; K204-A256 HydrophobicContact CD-CB 3.89Å; K204-A256 HydrophobicContact CG-CB 3.88Å; K204-E257 VanDerWaalsContact NZ-CD 3.35Å; K204-E257 IonicContact NZ-OE1 3.49Å; K204-E257 PolarHBondContact NZ-OE1 3.14Å
205R95.6Very high82.1Confident37 Ų3773.3 Ų73.314%0.1440%0.398CS..EExtended strand (participates in β ladder)trans-101.2130.1179.9-165.1178.4-159.7-133.81.8110.5E234 F247 V248 A278R205-E234 IonicContact CZ-OE2 3.78Å; R205-E234 IonicContact NH2-OE2 2.63Å; R205-E234 PolarHBondContact NH2-OE2 3.28Å; R205-F247 HydrophobicContact CG-CB 4.33Å; R205-V248 CarbonylContact C-O 3.49Å; R205-V248 WeakPolarHBondContact CA-O 3.41Å; R205-A278 HydrophobicContact CB-CB 3.86Å; R205-A278 HydrophobicContact CG-CB 3.66Å; R205-A278 VanDerWaalsContact O-CB 3.3Å; R205-A278 WeakPolarHBondContact O-CB 3.41Å; R205-A278 PolarHBondContact O-N 2.81Å
206L97.1Very high84.6Confident0 Ų071.7 Ų71.70%038%0.382CS..EExtended strand (participates in β ladder)trans-107.5145.3174.1-58.5-178.9000109.7F224 F247 V248 F250 A256 A259 R260 V275 N276L206-F224 HydrophobicContact CD1-CE1 4.33Å; L206-F247 CarbonylContact O-C 3.58Å; L206-F247 WeakPolarHBondContact O-CA 3.5Å; L206-V248 PolarHBondContact N-O 3.18Å; L206-V248 PolarHBondContact O-N 2.96Å; L206-F250 HydrophobicContact CD1-CD2 4.13Å; L206-F250 HydrophobicContact CD1-CE2 3.76Å; L206-F250 HydrophobicContact CG-CD2 4.46Å; L206-A256 HydrophobicContact CD1-CB 4.05Å; L206-A256 VanDerWaalsContact CD1-O 3.3Å; L206-A256 WeakPolarHBondContact CD1-O 3.43Å; L206-A256 HydrophobicContact CD2-CB 4.12Å; L206-A256 HydrophobicContact CG-CB 4.05Å; L206-A259 HydrophobicContact CD1-CB 4.38Å; L206-R260 HydrophobicContact CD1-CB 4.45Å; L206-V275 HydrophobicContact CB-CG1 4.11Å; L206-V275 HydrophobicContact CD1-CG1 3.84Å; L206-V275 HydrophobicContact CG-CG1 4.44Å; L206-N276 CarbonylContact C-O 3.58Å; L206-N276 WeakPolarHBondContact CA-O 3.17Å
207H97.6Very high86.5Confident42 Ų4266.9 Ų66.919%0.19436%0.356CS..EExtended strand (participates in β ladder)trans-99.3129167.8168.7-102.3000108.4S209 F245 F247 V275 N276 A278H207-S209 PolarHBondContact CE1-OG 2.84Å; H207-F245 AromaticContact CD2-CD2 3.95Å; H207-F245 AromaticContact NE2-CD2 3.58Å; H207-F245 AromaticContact NE2-CG 3.95Å; H207-F247 HydrophobicContact CB-CD1 4.05Å; H207-F247 HydrophobicContact CB-CE1 3.93Å; H207-F247 AromaticContact CD2-CE1 3.64Å; H207-F247 AromaticContact CD2-CZ 3.99Å; H207-V275 CarbonylContact O-C 3.52Å; H207-V275 WeakPolarHBondContact O-CA 3.46Å; H207-N276 PolarHBondContact N-O 2.87Å; H207-N276 PolarHBondContact O-N 2.71Å; H207-A278 HydrophobicContact CB-CB 4.28Å
208V97.3Very high88.6Confident0 Ų066.8 Ų66.80%035%0.354CS..EExtended strand (participates in β ladder)trans-118.8110.3-178.8-169.20000108.1I211 F224 F245 G246 V248 E274 V275V208-I211 HydrophobicContact CG1-CG2 3.55Å; V208-F224 HydrophobicContact CB-CE2 4.5Å; V208-F224 HydrophobicContact CB-CZ 4.3Å; V208-F224 HydrophobicContact CG1-CE2 4.01Å; V208-F224 HydrophobicContact CG1-CZ 3.88Å; V208-F224 HydrophobicContact CG2-CE1 4.16Å; V208-F224 HydrophobicContact CG2-CE2 3.74Å; V208-F224 HydrophobicContact CG2-CZ 3.38Å; V208-F245 CarbonylContact O-C 3.59Å; V208-F245 WeakPolarHBondContact O-CA 3.5Å; V208-F245 VanDerWaalsContact O-CB 3.29Å; V208-F245 WeakPolarHBondContact O-CB 3.35Å; V208-G246 PolarHBondContact N-O 3.22Å; V208-G246 PolarHBondContact O-N 2.94Å; V208-V248 HydrophobicContact CG2-CG2 4.16Å; V208-E274 CarbonylContact C-O 3.58Å; V208-E274 VanDerWaalsContact CA-O 3.31Å; V208-E274 WeakPolarHBondContact CA-O 3.3Å; V208-V275 HydrophobicContact CG1-CG2 4.34Å; V208-V275 HydrophobicContact CG2-CG1 4.49Å
209S97Very high90.7Very high18 Ų1862.8 Ų62.813%0.12633%0.332CS..EExtended strand (participates in β ladder)trans-104.1161.5179.132.50000113.3H207 I211 I273 E274H207-S209 PolarHBondContact CE1-OG 2.84Å; S209-I211 VanDerWaalsContact C-N 3.27Å; S209-I211 PolarHBondContact O-N 2.95Å; S209-I273 WeakPolarHBondContact O-CA 3.42Å; S209-E274 PolarHBondContact N-O 2.8Å; S209-E274 PolarHBondContact O-N 3.39Å; S209-E274 VanDerWaalsContact OG-CB 3.27Å; S209-E274 WeakPolarHBondContact OG-CB 3.43Å; S209-E274 PolarHBondContact OG-O 2.97Å; S209-E274 PolarHBondContact OG-OE2 2.79Å
210N96.9Very high92.6Very high57 Ų5757.8 Ų57.831%0.30529%0.291SS..SBendtrans60.429.9178.3-161.634.6000114.6G244 R271 K272N210-G244 WeakPolarHBondContact CA-O 3.29Å; N210-G244 PolarHBondContact N-O 3.44Å; N210-R271 PolarHBondContact OD1-NE 2.77Å; N210-R271 VanDerWaalsContact OD1-NE 3.17Å; N210-R271 PolarHBondContact OD1-NH2 3.43Å; N210-K272 WeakPolarHBondContact CB-O 3.44Å; N210-K272 PolarHBondContact ND2-O 3.29Å
211I96.8Very high94.4Very high1 Ų156.5 Ų56.51%0.00528%0.282CS..  trans-75.9152.1172.960.9172.8000110.8V208 S209 F215 L220 G244 I273V208-I211 HydrophobicContact CG1-CG2 3.55Å; S209-I211 VanDerWaalsContact C-N 3.27Å; S209-I211 PolarHBondContact O-N 2.95Å; I211-F215 HydrophobicContact CB-CD1 4.29Å; I211-F215 HydrophobicContact CB-CG 4.47Å; I211-F215 HydrophobicContact CD1-CB 4.08Å; I211-L220 HydrophobicContact CD1-CD1 4.23Å; I211-L220 HydrophobicContact CD1-CD2 4.21Å; I211-L220 HydrophobicContact CG2-CD2 4.38Å; I211-G244 VanDerWaalsContact CG1-C 3.48Å; I211-G244 WeakPolarHBondContact CG1-O 3.29Å; I211-G244 PolarHBondContact N-O 3.04Å; I211-G244 WeakPolarHBondContact O-CA 3.14Å; I211-I273 HydrophobicContact CG2-CB 4.49Å; I211-I273 HydrophobicContact CG2-CG2 3.98Å
212P95.4Very high95.6Very high6 Ų662 Ų624%0.03930%0.296CS..  trans-57.8144.8176.6-23.633.7000112.6R214 F215 V268 E269P212-R214 PolarHBondContact O-N 3.41Å; P212-R214 VanDerWaalsContact O-N 3.07Å; P212-F215 HydrophobicContact CB-CD2 3.74Å; P212-F215 HydrophobicContact CB-CE2 4.13Å; P212-F215 HydrophobicContact CG-CD2 3.74Å; P212-F215 HydrophobicContact CG-CE2 3.68Å; P212-F215 HydrophobicContact CG-CZ 4.43Å; P212-F215 WeakPolarHBondContact O-CB 3.45Å; P212-F215 PolarHBondContact O-N 3.05Å; P212-V268 HydrophobicContact CG-CG1 4.34Å; P212-E269 HydrophobicContact CB-CB 4.49Å; P212-E269 WeakPolarHBondContact CB-OE2 3.4Å; P212-E269 HydrophobicContact CG-CB 3.79Å; P212-E269 HydrophobicContact CG-CG 3.98Å; P212-E269 WeakPolarHBondContact CG-OE2 3.08Å
213F96Very high95.9Very high106 Ų10659.3 Ų59.347%0.46528%0.278SS..THydrogen-bonded Turntrans-66.1-18-175.6-61.8-57.5000113.7F215 R216 S242F213-F215 VanDerWaalsContact C-N 3.34Å; F213-R216 PolarHBondContact O-NH1 3.34Å; F213-S242 VanDerWaalsContact C-OG 3.23Å; F213-S242 WeakPolarHBondContact CA-OG 3.5Å; F213-S242 WeakPolarHBondContact CB-OG 3.37Å; F213-S242 VanDerWaalsContact CD1-O 3.23Å; F213-S242 WeakPolarHBondContact CD1-O 3.33Å; F213-S242 PolarHBondContact O-OG 2.75Å
214R95.3Very high96.1Very high199 Ų19955.3 Ų55.375%0.75125%0.252SS*.THydrogen-bonded Turntrans-78.7-17.6176.5-64.6-68.1128.1172.10.9113P212 R216P212-R214 PolarHBondContact O-N 3.41Å; P212-R214 VanDerWaalsContact O-N 3.07Å; R214-R216 PolarHBondContact O-NH1 2.89Å
215F95.6Very high96.1Very high20 Ų2055.4 Ų55.49%0.08826%0.262CS..  trans-59.4139.8-177.9-91.7-134.4000112I211 P212 F213 D219 L220 M223 I235 V268 E269I211-F215 HydrophobicContact CB-CD1 4.29Å; I211-F215 HydrophobicContact CB-CG 4.47Å; I211-F215 HydrophobicContact CD1-CB 4.08Å; P212-F215 HydrophobicContact CB-CD2 3.74Å; P212-F215 HydrophobicContact CB-CE2 4.13Å; P212-F215 HydrophobicContact CG-CD2 3.74Å; P212-F215 HydrophobicContact CG-CE2 3.68Å; P212-F215 HydrophobicContact CG-CZ 4.43Å; P212-F215 WeakPolarHBondContact O-CB 3.45Å; P212-F215 PolarHBondContact O-N 3.05Å; F213-F215 VanDerWaalsContact C-N 3.34Å; F215-D219 WeakPolarHBondContact CA-OD2 3.39Å; F215-D219 HydrophobicContact CD1-CB 3.8Å; F215-D219 HydrophobicContact CD2-CB 4.39Å; F215-D219 HydrophobicContact CE1-CB 3.95Å; F215-D219 HydrophobicContact CG-CB 4.02Å; F215-D219 HydrophobicContact CZ-CB 4.29Å; F215-L220 HydrophobicContact CD1-CD2 3.96Å; F215-L220 HydrophobicContact CD1-CG 4.34Å; F215-L220 HydrophobicContact CE1-CD2 4.47Å; F215-M223 HydrophobicContact CE1-SD 4.48Å; F215-I235 WeakPolarHBondContact O-CD1 3.47Å; F215-V268 HydrophobicContact CE1-CG1 4.07Å; F215-V268 HydrophobicContact CE2-CG1 3.96Å; F215-V268 HydrophobicContact CZ-CG1 3.33Å; F215-E269 HydrophobicContact CE2-CG 4.46Å
216R96Very high96.1Very high92 Ų9260.2 Ų60.235%0.34729%0.286SS..  trans-129174.6176.6-63.4-61.7178.8-96.30.1110.3F213 R214 P218 D219 L220F213-R216 PolarHBondContact O-NH1 3.34Å; R214-R216 PolarHBondContact O-NH1 2.89Å; R216-P218 VanDerWaalsContact C-CD 3.46Å; R216-P218 VanDerWaalsContact C-N 3.34Å; R216-P218 HydrophobicContact CB-CG 4.17Å; R216-D219 PolarHBondContact N-OD2 2.82Å; R216-D219 WeakPolarHBondContact O-CB 3.29Å; R216-D219 PolarHBondContact O-N 3.42Å; R216-L220 PolarHBondContact O-N 2.93Å
217D95.6Very high96Very high71 Ų7161.3 Ų61.338%0.3829%0.291SS..Hα-helixtrans-44.8-48.4175.3-59.9-111.1000114D219 R221 V233D217-D219 VanDerWaalsContact C-N 3.34Å; D217-D219 PolarHBondContact O-N 3.25Å; D217-R221 VanDerWaalsContact O-CB 3.29Å; D217-R221 WeakPolarHBondContact O-CB 3.48Å; D217-R221 PolarHBondContact O-N 3.4Å; D217-V233 HydrophobicContact CB-CG1 4.4Å
218P96.8Very high95.9Very high85 Ų8560.1 Ų60.155%0.55229%0.29SS*.Hα-helixtrans-62.7-36.3177.724-35.9000113.6R216 R221 Q222R216-P218 VanDerWaalsContact C-CD 3.46Å; R216-P218 VanDerWaalsContact C-N 3.34Å; R216-P218 HydrophobicContact CB-CG 4.17Å; P218-R221 PolarHBondContact O-N 3.4Å; P218-Q222 WeakPolarHBondContact O-CB 3.01Å; P218-Q222 PolarHBondContact O-N 3.1Å
219D95.8Very high95.8Very high56 Ų5665.9 Ų65.930%0.29932%0.315SS..Hα-helixtrans-67.9-45.1-177.7-52.9-50.8000110.9F215 R216 D217 R221 Q222 M223F215-D219 WeakPolarHBondContact CA-OD2 3.39Å; F215-D219 HydrophobicContact CD1-CB 3.8Å; F215-D219 HydrophobicContact CD2-CB 4.39Å; F215-D219 HydrophobicContact CE1-CB 3.95Å; F215-D219 HydrophobicContact CG-CB 4.02Å; F215-D219 HydrophobicContact CZ-CB 4.29Å; R216-D219 PolarHBondContact N-OD2 2.82Å; R216-D219 WeakPolarHBondContact O-CB 3.29Å; R216-D219 PolarHBondContact O-N 3.42Å; D217-D219 VanDerWaalsContact C-N 3.34Å; D217-D219 PolarHBondContact O-N 3.25Å; D219-R221 VanDerWaalsContact C-N 3.33Å; D219-Q222 PolarHBondContact O-N 3.48Å; D219-M223 WeakPolarHBondContact O-CB 3.14Å; D219-M223 PolarHBondContact O-N 3.37Å
220L96Very high95.8Very high0 Ų065.6 Ų65.60%031%0.312CS..Hα-helixtrans-64.6-40.6173.9-70.6-179.6000110.9I211 F215 R216 Q222 M223 F224 V233 I235 V248I211-L220 HydrophobicContact CD1-CD1 4.23Å; I211-L220 HydrophobicContact CD1-CD2 4.21Å; I211-L220 HydrophobicContact CG2-CD2 4.38Å; F215-L220 HydrophobicContact CD1-CD2 3.96Å; F215-L220 HydrophobicContact CD1-CG 4.34Å; F215-L220 HydrophobicContact CE1-CD2 4.47Å; R216-L220 PolarHBondContact O-N 2.93Å; L220-Q222 VanDerWaalsContact C-N 3.32Å; L220-Q222 PolarHBondContact O-N 3.43Å; L220-M223 HydrophobicContact CD2-CE 4.28Å; L220-M223 PolarHBondContact O-N 2.94Å; L220-F224 HydrophobicContact CD2-CD2 4.29Å; L220-F224 HydrophobicContact CD2-CE2 3.99Å; L220-F224 WeakPolarHBondContact O-CB 3.47Å; L220-F224 WeakPolarHBondContact O-CD2 3.39Å; L220-F224 PolarHBondContact O-N 2.87Å; L220-V233 HydrophobicContact CB-CG1 3.91Å; L220-V233 HydrophobicContact CD1-CG1 3.72Å; L220-V233 HydrophobicContact CG-CG1 4.44Å; L220-I235 HydrophobicContact CD1-CD1 3.89Å; L220-I235 HydrophobicContact CD1-CG1 3.7Å; L220-I235 HydrophobicContact CG-CD1 4.5Å; L220-V248 HydrophobicContact CB-CG2 4.32Å; L220-V248 HydrophobicContact CD1-CG2 4.34Å
221R96.1Very high95.8Very high151 Ų15167.3 Ų67.357%0.5732%0.321SS*.Hα-helixtrans-65-36.6178.5-162.3170.2-169-114.11.4112.4D217 P218 D219 G225 I230D217-R221 VanDerWaalsContact O-CB 3.29Å; D217-R221 WeakPolarHBondContact O-CB 3.48Å; D217-R221 PolarHBondContact O-N 3.4Å; P218-R221 PolarHBondContact O-N 3.4Å; D219-R221 VanDerWaalsContact C-N 3.33Å; R221-G225 WeakPolarHBondContact O-CA 2.98Å; R221-G225 PolarHBondContact O-N 3.3Å; R221-I230 HydrophobicContact CB-CD1 4.35Å; R221-I230 HydrophobicContact CG-CD1 3.91Å
222Q95.8Very high95.7Very high157 Ų15770.6 Ų70.673%0.73434%0.339SS*.Hα-helixtrans-67-46175-176.7174.65.400111.4P218 D219 L220P218-Q222 WeakPolarHBondContact O-CB 3.01Å; P218-Q222 PolarHBondContact O-N 3.1Å; D219-Q222 PolarHBondContact O-N 3.48Å; L220-Q222 VanDerWaalsContact C-N 3.32Å; L220-Q222 PolarHBondContact O-N 3.43Å
223M94.4Very high95.7Very high31 Ų3171.1 Ų71.115%0.15334%0.341CS..Hα-helixtrans-71.4-39.9-176.5-166.8175.169.700113F215 D219 L220 Q226 F227 L263 V268 I273F215-M223 HydrophobicContact CE1-SD 4.48Å; D219-M223 WeakPolarHBondContact O-CB 3.14Å; D219-M223 PolarHBondContact O-N 3.37Å; L220-M223 HydrophobicContact CD2-CE 4.28Å; L220-M223 PolarHBondContact O-N 2.94Å; M223-Q226 PolarHBondContact O-NE2 3.17Å; M223-F227 WeakPolarHBondContact O-CE2 3.2Å; M223-L263 HydrophobicContact CE-CD1 4.34Å; M223-L263 HydrophobicContact CG-CD1 4.18Å; M223-L263 HydrophobicContact CG-CD2 3.94Å; M223-L263 HydrophobicContact SD-CD2 4.38Å; M223-V268 HydrophobicContact SD-CG2 3.82Å; M223-I273 HydrophobicContact CE-CD1 3.51Å; M223-I273 HydrophobicContact SD-CD1 4.05Å
224F95.9Very high95.7Very high0 Ų068.5 Ų68.50%033%0.331CS..Hα-helixtrans-91.1-23.7-178.9-76.8-89.9000113.3L206 V208 L220 Q226 F227 I230 V248 F250 A259 L263 V275L206-F224 HydrophobicContact CD1-CE1 4.33Å; V208-F224 HydrophobicContact CB-CE2 4.5Å; V208-F224 HydrophobicContact CB-CZ 4.3Å; V208-F224 HydrophobicContact CG1-CE2 4.01Å; V208-F224 HydrophobicContact CG1-CZ 3.88Å; V208-F224 HydrophobicContact CG2-CE1 4.16Å; V208-F224 HydrophobicContact CG2-CE2 3.74Å; V208-F224 HydrophobicContact CG2-CZ 3.38Å; L220-F224 HydrophobicContact CD2-CD2 4.29Å; L220-F224 HydrophobicContact CD2-CE2 3.99Å; L220-F224 WeakPolarHBondContact O-CB 3.47Å; L220-F224 WeakPolarHBondContact O-CD2 3.39Å; L220-F224 PolarHBondContact O-N 2.87Å; F224-Q226 PolarHBondContact O-N 3.49Å; F224-F227 PolarHBondContact O-N 3.3Å; F224-F227 VanDerWaalsContact O-N 3.1Å; F224-I230 HydrophobicContact CB-CD1 3.73Å; F224-V248 HydrophobicContact CB-CG1 4.2Å; F224-V248 HydrophobicContact CD2-CG2 4.09Å; F224-V248 HydrophobicContact CE2-CG2 4.36Å; F224-V248 HydrophobicContact CG-CG1 4.36Å; F224-V248 HydrophobicContact CG-CG2 4.32Å; F224-F250 HydrophobicContact CB-CE2 4.39Å; F224-F250 HydrophobicContact CB-CZ 3.83Å; F224-F250 AromaticContact CD1-CE2 3.96Å; F224-F250 HydrophobicContact CD1-CE2 3.96Å; F224-F250 AromaticContact CD1-CZ 3.92Å; F224-F250 HydrophobicContact CD1-CZ 3.92Å; F224-F250 HydrophobicContact CG-CZ 4.36Å; F224-A259 HydrophobicContact CD1-CB 3.98Å; F224-A259 HydrophobicContact CE1-CB 4.38Å; F224-L263 HydrophobicContact CD1-CD1 3.47Å; F224-L263 VanDerWaalsContact CD1-CD1 3.47Å; F224-L263 HydrophobicContact CD2-CD1 4.04Å; F224-L263 HydrophobicContact CE1-CB 4.49Å; F224-L263 HydrophobicContact CE1-CD1 3.32Å; F224-L263 HydrophobicContact CE2-CD1 3.92Å; F224-L263 HydrophobicContact CG-CD1 3.82Å; F224-L263 HydrophobicContact CZ-CD1 3.55Å; F224-V275 HydrophobicContact CE1-CG1 4.11Å; F224-V275 HydrophobicContact CE1-CG2 4.16Å; F224-V275 HydrophobicContact CZ-CG1 4.38Å; F224-V275 HydrophobicContact CZ-CG2 3.83Å
225G95.6Very high95.8Very high35 Ų3559.7 Ų59.736%0.36130%0.298SS..Hα-helixtrans-68.7-19.1-173.800000114.3R221 F227R221-G225 WeakPolarHBondContact O-CA 2.98Å; R221-G225 PolarHBondContact O-N 3.3Å; G225-F227 PolarHBondContact O-N 2.74Å
226Q95.7Very high95.7Very high138 Ų13860.5 Ų60.565%0.64530%0.303SS*.THydrogen-bonded Turntrans-68.2-18.8172.765.9-177-7.500113.6M223 F224M223-Q226 PolarHBondContact O-NE2 3.17Å; F224-Q226 PolarHBondContact O-N 3.49Å
227F95.4Very high95.7Very high23 Ų2360.7 Ų60.710%0.10131%0.306CS..THydrogen-bonded Turntrans-93.5-26.1-178.5-59.4-64.4000113.3M223 F224 G225 F250 D255 A259 K262 L263M223-F227 WeakPolarHBondContact O-CE2 3.2Å; F224-F227 PolarHBondContact O-N 3.3Å; F224-F227 VanDerWaalsContact O-N 3.1Å; G225-F227 PolarHBondContact O-N 2.74Å; F227-F250 HydrophobicContact CB-CE1 4.4Å; F227-D255 WeakPolarHBondContact O-CB 3.34Å; F227-A259 HydrophobicContact CB-CB 3.72Å; F227-A259 HydrophobicContact CD2-CB 3.54Å; F227-A259 HydrophobicContact CE2-CB 4.36Å; F227-A259 HydrophobicContact CG-CB 3.7Å; F227-K262 HydrophobicContact CD1-CD 4.05Å; F227-K262 HydrophobicContact CE1-CB 4.02Å; F227-K262 HydrophobicContact CE1-CD 3.31Å; F227-K262 HydrophobicContact CE1-CG 4.3Å; F227-K262 HydrophobicContact CZ-CB 3.93Å; F227-K262 HydrophobicContact CZ-CD 4.05Å; F227-L263 HydrophobicContact CD2-CD1 4.09Å; F227-L263 HydrophobicContact CE2-CD1 3.49Å; F227-L263 VanDerWaalsContact CE2-CD1 3.49Å; F227-L263 HydrophobicContact CE2-CD2 4.05Å; F227-L263 HydrophobicContact CE2-CG 3.57Å; F227-L263 HydrophobicContact CZ-CD1 4.46Å; F227-L263 HydrophobicContact CZ-CD2 4.36Å; F227-L263 HydrophobicContact CZ-CG 4.08Å
228G94.8Very high95.7Very high17 Ų1761.8 Ų61.818%0.17531%0.313CS..SBendtrans174.6175.1-178.900000112.4I230G228-I230 PolarHBondContact O-N 3.42Å
229K96.1Very high95.5Very high120 Ų12067.1 Ų67.152%0.52233%0.33SS..  trans-73.1125.7-178.9-168.7-163.5-178.2-171.80110.8E251K229-E251 HydrophobicContact CB-CB 4.3Å; K229-E251 HydrophobicContact CD-CB 4.34Å; K229-E251 WeakPolarHBondContact CD-OE2 3.48Å; K229-E251 IonicContact NZ-OE1 2.7Å; K229-E251 PolarHBondContact NZ-OE1 3.41Å; K229-E251 IonicContact NZ-OE2 2.74Å; K229-E251 PolarHBondContact NZ-OE2 2.98Å; K229-E251 PolarHBondContact O-N 3.02Å
230I96.4Very high95.4Very high13 Ų1376.1 Ų76.17%0.06736%0.36CS..EExtended strand (participates in β ladder)trans-93.9127177.8-61.2166000109.4R221 F224 G228 V233 V248 F250R221-I230 HydrophobicContact CB-CD1 4.35Å; R221-I230 HydrophobicContact CG-CD1 3.91Å; F224-I230 HydrophobicContact CB-CD1 3.73Å; G228-I230 PolarHBondContact O-N 3.42Å; I230-V233 HydrophobicContact CG2-CG2 3.53Å; I230-V248 HydrophobicContact CD1-CG1 4.08Å; I230-V248 HydrophobicContact CG1-CG1 3.99Å; I230-V248 HydrophobicContact CG2-CG1 3.86Å; I230-F250 HydrophobicContact CG1-CD1 4.38Å; I230-F250 HydrophobicContact CG1-CE1 4.09Å; I230-F250 HydrophobicContact CG1-CZ 4.37Å
231L95.6Very high95.3Very high92 Ų9277.5 Ų77.548%0.48237%0.374SS..EExtended strand (participates in β ladder)trans-85.2-45175.8-64.7179.1000112.1P203 T249 E251P203-L231 HydrophobicContact CB-CD1 3.71Å; L231-T249 HydrophobicContact CB-CG2 4.43Å; L231-T249 HydrophobicContact CD1-CG2 4.43Å; L231-T249 PolarHBondContact N-O 3.18Å; L231-E251 HydrophobicContact CD1-CB 4.31Å; L231-E251 HydrophobicContact CD2-CB 4.03Å; L231-E251 HydrophobicContact CD2-CG 4.35Å; L231-E251 HydrophobicContact CG-CB 4.02Å
232D94.9Very high95.3Very high71 Ų7171 Ų7138%0.3835%0.352SS..EExtended strand (participates in β ladder)trans-148.7142.5-172.7-174.543.4000110.5T249D232-T249 PolarHBondContact N-O 3.19Å; D232-T249 PolarHBondContact O-N 2.97Å
233V96.4Very high95.3Very high16 Ų1668.7 Ų68.710%0.09734%0.339CS..EExtended strand (participates in β ladder)trans-128.7135.1173-1780000106.9D217 L220 I230 F247 V248D217-V233 HydrophobicContact CB-CG1 4.4Å; L220-V233 HydrophobicContact CB-CG1 3.91Å; L220-V233 HydrophobicContact CD1-CG1 3.72Å; L220-V233 HydrophobicContact CG-CG1 4.44Å; I230-V233 HydrophobicContact CG2-CG2 3.53Å; V233-F247 WeakPolarHBondContact CA-O 3.32Å; V233-V248 HydrophobicContact CG1-CG2 4.49Å
234E95.8Very high95.3Very high52 Ų5267.5 Ų67.524%0.24334%0.335CS..EExtended strand (participates in β ladder)trans-136.7126.1176.6-178.6-170.8-153.300109.4R205 I236 G246 F247 R281R205-E234 IonicContact CZ-OE2 3.78Å; R205-E234 IonicContact NH2-OE2 2.63Å; R205-E234 PolarHBondContact NH2-OE2 3.28Å; E234-I236 HydrophobicContact CG-CD1 3.92Å; E234-G246 CarbonylContact O-C 3.58Å; E234-G246 WeakPolarHBondContact O-CA 3.4Å; E234-F247 PolarHBondContact N-O 2.9Å; E234-F247 PolarHBondContact O-N 3.07Å; E234-R281 IonicContact OE1-CZ 3.86Å; E234-R281 IonicContact OE1-NH2 2.68Å; E234-R281 PolarHBondContact OE1-NH2 3.17Å; E234-R281 IonicContact OE2-CZ 3.2Å; E234-R281 IonicContact OE2-NE 3.64Å; E234-R281 IonicContact OE2-NH1 3.95Å; E234-R281 IonicContact OE2-NH2 2.6Å; E234-R281 PolarHBondContact OE2-NH2 2.92Å
235I96.3Very high95.4Very high13 Ų1369.5 Ų69.57%0.06734%0.344CS..EExtended strand (participates in β ladder)trans-106133171-66.2168.1000108.7F215 L220 F237F215-I235 WeakPolarHBondContact O-CD1 3.47Å; L220-I235 HydrophobicContact CD1-CD1 3.89Å; L220-I235 HydrophobicContact CD1-CG1 3.7Å; L220-I235 HydrophobicContact CG-CD1 4.5Å; I235-F237 HydrophobicContact CB-CD2 4.45Å; I235-F237 HydrophobicContact CB-CE2 3.69Å; I235-F237 HydrophobicContact CB-CZ 4.06Å; I235-F237 HydrophobicContact CG2-CD2 4.18Å; I235-F237 HydrophobicContact CG2-CE1 4.28Å; I235-F237 HydrophobicContact CG2-CE2 3.59Å; I235-F237 HydrophobicContact CG2-CZ 3.62Å; I235-F237 WeakPolarHBondContact O-CD2 3.45Å; I235-F237 WeakPolarHBondContact O-CE2 3.3Å
236I95.3Very high95.4Very high37 Ų3767.9 Ų67.919%0.1933%0.326CS..EExtended strand (participates in β ladder)trans-86.9121.4179.4-53.1-54.1000109.2E234 K243 F245 F247E234-I236 HydrophobicContact CG-CD1 3.92Å; I236-K243 HydrophobicContact CB-CD 4.41Å; I236-K243 HydrophobicContact CG2-CD 3.6Å; I236-K243 HydrophobicContact CG2-CG 4.32Å; I236-K243 WeakPolarHBondContact O-CB 3Å; I236-K243 PolarHBondContact O-N 3.44Å; I236-F245 HydrophobicContact CB-CD2 4.33Å; I236-F245 HydrophobicContact CB-CE1 4.25Å; I236-F245 HydrophobicContact CB-CE2 3.72Å; I236-F245 HydrophobicContact CB-CZ 3.66Å; I236-F245 HydrophobicContact CG1-CD2 4.02Å; I236-F245 HydrophobicContact CG1-CE2 3.36Å; I236-F245 HydrophobicContact CG1-CZ 3.79Å; I236-F245 HydrophobicContact CG2-CE1 4.44Å; I236-F245 HydrophobicContact CG2-CE2 4.31Å; I236-F245 HydrophobicContact CG2-CZ 3.82Å; I236-F245 PolarHBondContact N-O 2.95Å; I236-F247 HydrophobicContact CD1-CD2 4.2Å; I236-F247 HydrophobicContact CD1-CE2 3.97Å; I236-F247 HydrophobicContact CG1-CD2 4.23Å; I236-F247 HydrophobicContact CG1-CE2 3.8Å
237F95.1Very high95.5Very high96 Ų9662.6 Ų62.642%0.42130%0.301SS..EExtended strand (participates in β ladder)trans-103.7148.3174.3-63.5-92000110.6I235 S242I235-F237 HydrophobicContact CB-CD2 4.45Å; I235-F237 HydrophobicContact CB-CE2 3.69Å; I235-F237 HydrophobicContact CB-CZ 4.06Å; I235-F237 HydrophobicContact CG2-CD2 4.18Å; I235-F237 HydrophobicContact CG2-CE1 4.28Å; I235-F237 HydrophobicContact CG2-CE2 3.59Å; I235-F237 HydrophobicContact CG2-CZ 3.62Å; I235-F237 WeakPolarHBondContact O-CD2 3.45Å; I235-F237 WeakPolarHBondContact O-CE2 3.3Å; F237-S242 VanDerWaalsContact CD1-CA 3.46Å
238N95.1Very high95.6Very high95 Ų9561.5 Ų61.551%0.50830%0.297SS..EExtended strand (participates in β ladder)trans-110.4175.2163.8-163.87.2000108.1R240 G241 K243N238-R240 PolarHBondContact O-N 2.82Å; N238-G241 PolarHBondContact N-O 3.11Å; N238-G241 PolarHBondContact O-N 2.85Å; N238-G241 VanDerWaalsContact O-O 3.13Å; N238-K243 HydrophobicContact CB-CD 4.31Å; N238-K243 HydrophobicContact CB-CG 3.85Å
239E94.1Very high95.6Very high196 Ų19661.7 Ų61.792%0.91630%0.295SS*.THydrogen-bonded Turntrans-57.1-27.9179.5-59.5-177.1134.700113
240R93.5Very high95.7Very high245 Ų24556 Ų5693%0.92527%0.27SS*.THydrogen-bonded Turntrans-85.9-6.5178.2-56.4-174.578.1-1434.7114.2N238N238-R240 PolarHBondContact O-N 2.82Å
241G93.6Very high95.6Very high30 Ų3059.4 Ų59.431%0.30929%0.286SS..EExtended strand (participates in β ladder)trans124.8-162.9-174.400000113.4N238N238-G241 PolarHBondContact N-O 3.11Å; N238-G241 PolarHBondContact O-N 2.85Å; N238-G241 VanDerWaalsContact O-O 3.13Å
242S94.9Very high95.6Very high13 Ų1356.2 Ų56.29%0.09127%0.271CS..EExtended strand (participates in β ladder)trans-63.9143.3-175.464.20000111.4F213 F237 G244F213-S242 VanDerWaalsContact C-OG 3.23Å; F213-S242 WeakPolarHBondContact CA-OG 3.5Å; F213-S242 WeakPolarHBondContact CB-OG 3.37Å; F213-S242 VanDerWaalsContact CD1-O 3.23Å; F213-S242 WeakPolarHBondContact CD1-O 3.33Å; F213-S242 PolarHBondContact O-OG 2.75Å; F237-S242 VanDerWaalsContact CD1-CA 3.46Å; S242-G244 PolarHBondContact O-N 3.46Å
243K96.2Very high95.6Very high110 Ų11054.4 Ų54.448%0.47826%0.264SS..EExtended strand (participates in β ladder)trans-80.22.6176.7-65.8-17677.1-1700113I236 N238 F245I236-K243 HydrophobicContact CB-CD 4.41Å; I236-K243 HydrophobicContact CG2-CD 3.6Å; I236-K243 HydrophobicContact CG2-CG 4.32Å; I236-K243 WeakPolarHBondContact O-CB 3Å; I236-K243 PolarHBondContact O-N 3.44Å; N238-K243 HydrophobicContact CB-CD 4.31Å; N238-K243 HydrophobicContact CB-CG 3.85Å; K243-F245 VanDerWaalsContact C-N 3.28Å; K243-F245 HydrophobicContact CB-CD1 3.55Å; K243-F245 HydrophobicContact CB-CE1 3.36Å; K243-F245 HydrophobicContact CB-CZ 4.37Å; K243-F245 HydrophobicContact CD-CE1 3.67Å; K243-F245 HydrophobicContact CD-CZ 4.09Å; K243-F245 HydrophobicContact CG-CE1 4.13Å; K243-F245 PolarHBondContact O-N 3.26Å
244G95.6Very high95.5Very high5 Ų556.5 Ų56.55%0.05228%0.279CS..EExtended strand (participates in β ladder)trans71.223.3-177.400000113.5N210 I211 S242N210-G244 WeakPolarHBondContact CA-O 3.29Å; N210-G244 PolarHBondContact N-O 3.44Å; I211-G244 VanDerWaalsContact CG1-C 3.48Å; I211-G244 WeakPolarHBondContact CG1-O 3.29Å; I211-G244 PolarHBondContact N-O 3.04Å; I211-G244 WeakPolarHBondContact O-CA 3.14Å; S242-G244 PolarHBondContact O-N 3.46Å
245F96.8Very high95.5Very high43 Ų4355.8 Ų55.819%0.18928%0.277CS..EExtended strand (participates in β ladder)trans-146.7157.8170.373.9-89.4000111.2H207 V208 I236 K243 F247H207-F245 AromaticContact CD2-CD2 3.95Å; H207-F245 AromaticContact NE2-CD2 3.58Å; H207-F245 AromaticContact NE2-CG 3.95Å; V208-F245 CarbonylContact O-C 3.59Å; V208-F245 WeakPolarHBondContact O-CA 3.5Å; V208-F245 VanDerWaalsContact O-CB 3.29Å; V208-F245 WeakPolarHBondContact O-CB 3.35Å; I236-F245 HydrophobicContact CB-CD2 4.33Å; I236-F245 HydrophobicContact CB-CE1 4.25Å; I236-F245 HydrophobicContact CB-CE2 3.72Å; I236-F245 HydrophobicContact CB-CZ 3.66Å; I236-F245 HydrophobicContact CG1-CD2 4.02Å; I236-F245 HydrophobicContact CG1-CE2 3.36Å; I236-F245 HydrophobicContact CG1-CZ 3.79Å; I236-F245 HydrophobicContact CG2-CE1 4.44Å; I236-F245 HydrophobicContact CG2-CE2 4.31Å; I236-F245 HydrophobicContact CG2-CZ 3.82Å; I236-F245 PolarHBondContact N-O 2.95Å; K243-F245 VanDerWaalsContact C-N 3.28Å; K243-F245 HydrophobicContact CB-CD1 3.55Å; K243-F245 HydrophobicContact CB-CE1 3.36Å; K243-F245 HydrophobicContact CB-CZ 4.37Å; K243-F245 HydrophobicContact CD-CE1 3.67Å; K243-F245 HydrophobicContact CD-CZ 4.09Å; K243-F245 HydrophobicContact CG-CE1 4.13Å; K243-F245 PolarHBondContact O-N 3.26Å; F245-F247 HydrophobicContact CD2-CE2 4.41Å; F245-F247 HydrophobicContact CE2-CE2 4.07Å; F245-F247 HydrophobicContact CE2-CZ 4.25Å
246G96.4Very high95.5Very high0 Ų055.2 Ų55.20%027%0.274CS..EExtended strand (participates in β ladder)trans-153.8-176.117800000112V208 E234V208-G246 PolarHBondContact N-O 3.22Å; V208-G246 PolarHBondContact O-N 2.94Å; E234-G246 CarbonylContact O-C 3.58Å; E234-G246 WeakPolarHBondContact O-CA 3.4Å
247F97.1Very high95.5Very high27 Ų2757.2 Ų57.212%0.11828%0.283CS..EExtended strand (participates in β ladder)trans-129.5140.4179.2-59.4-82.5000109.9R205 L206 H207 V233 E234 I236 F245 A278R205-F247 HydrophobicContact CG-CB 4.33Å; L206-F247 CarbonylContact O-C 3.58Å; L206-F247 WeakPolarHBondContact O-CA 3.5Å; H207-F247 HydrophobicContact CB-CD1 4.05Å; H207-F247 HydrophobicContact CB-CE1 3.93Å; H207-F247 AromaticContact CD2-CE1 3.64Å; H207-F247 AromaticContact CD2-CZ 3.99Å; V233-F247 WeakPolarHBondContact CA-O 3.32Å; E234-F247 PolarHBondContact N-O 2.9Å; E234-F247 PolarHBondContact O-N 3.07Å; I236-F247 HydrophobicContact CD1-CD2 4.2Å; I236-F247 HydrophobicContact CD1-CE2 3.97Å; I236-F247 HydrophobicContact CG1-CD2 4.23Å; I236-F247 HydrophobicContact CG1-CE2 3.8Å; F245-F247 HydrophobicContact CD2-CE2 4.41Å; F245-F247 HydrophobicContact CE2-CE2 4.07Å; F245-F247 HydrophobicContact CE2-CZ 4.25Å; F247-A278 HydrophobicContact CD1-CB 3.85Å; F247-A278 HydrophobicContact CE1-CB 4.13Å
248V97.1Very high95.6Very high0 Ų058.6 Ų58.60%029%0.285CS..EExtended strand (participates in β ladder)trans-126.1124.7176-179.20000107.8R205 L206 V208 L220 F224 I230 V233 F250R205-V248 CarbonylContact C-O 3.49Å; R205-V248 WeakPolarHBondContact CA-O 3.41Å; L206-V248 PolarHBondContact N-O 3.18Å; L206-V248 PolarHBondContact O-N 2.96Å; V208-V248 HydrophobicContact CG2-CG2 4.16Å; L220-V248 HydrophobicContact CB-CG2 4.32Å; L220-V248 HydrophobicContact CD1-CG2 4.34Å; F224-V248 HydrophobicContact CB-CG1 4.2Å; F224-V248 HydrophobicContact CD2-CG2 4.09Å; F224-V248 HydrophobicContact CE2-CG2 4.36Å; F224-V248 HydrophobicContact CG-CG1 4.36Å; F224-V248 HydrophobicContact CG-CG2 4.32Å; I230-V248 HydrophobicContact CD1-CG1 4.08Å; I230-V248 HydrophobicContact CG1-CG1 3.99Å; I230-V248 HydrophobicContact CG2-CG1 3.86Å; V233-V248 HydrophobicContact CG1-CG2 4.49Å; V248-F250 HydrophobicContact CG1-CD2 4.11Å; V248-F250 HydrophobicContact CG1-CE2 3.75Å; V248-F250 HydrophobicContact CG1-CZ 4.36Å
249T95.9Very high95.7Very high22 Ų2254.1 Ų54.114%0.13526%0.261CS..EExtended strand (participates in β ladder)trans-104.6116.4177.6-48.80000109P203 L231 D232P203-T249 HydrophobicContact CB-CG2 4.34Å; L231-T249 HydrophobicContact CB-CG2 4.43Å; L231-T249 HydrophobicContact CD1-CG2 4.43Å; L231-T249 PolarHBondContact N-O 3.18Å; D232-T249 PolarHBondContact N-O 3.19Å; D232-T249 PolarHBondContact O-N 2.97Å
250F97.1Very high95.8Very high0 Ų048 Ų480%023%0.229CC..EExtended strand (participates in β ladder)trans-87.9154.1173.3-77.2-93.1000111.2P203 K204 L206 F224 F227 I230 V248 S252 D255 A256 A259P203-F250 CarbonylContact C-O 3.58Å; P203-F250 WeakPolarHBondContact CA-O 3.43Å; P203-F250 WeakPolarHBondContact CB-O 3.3Å; K204-F250 PolarHBondContact N-O 3.36Å; K204-F250 VanDerWaalsContact N-O 3.12Å; K204-F250 PolarHBondContact O-N 3.39Å; L206-F250 HydrophobicContact CD1-CD2 4.13Å; L206-F250 HydrophobicContact CD1-CE2 3.76Å; L206-F250 HydrophobicContact CG-CD2 4.46Å; F224-F250 HydrophobicContact CB-CE2 4.39Å; F224-F250 HydrophobicContact CB-CZ 3.83Å; F224-F250 AromaticContact CD1-CE2 3.96Å; F224-F250 HydrophobicContact CD1-CE2 3.96Å; F224-F250 AromaticContact CD1-CZ 3.92Å; F224-F250 HydrophobicContact CD1-CZ 3.92Å; F224-F250 HydrophobicContact CG-CZ 4.36Å; F227-F250 HydrophobicContact CB-CE1 4.4Å; I230-F250 HydrophobicContact CG1-CD1 4.38Å; I230-F250 HydrophobicContact CG1-CE1 4.09Å; I230-F250 HydrophobicContact CG1-CZ 4.37Å; V248-F250 HydrophobicContact CG1-CD2 4.11Å; V248-F250 HydrophobicContact CG1-CE2 3.75Å; V248-F250 HydrophobicContact CG1-CZ 4.36Å; F250-S252 WeakPolarHBondContact CB-O 3.37Å; F250-D255 HydrophobicContact CD1-CB 4.12Å; F250-A256 HydrophobicContact CB-CB 3.98Å; F250-A256 HydrophobicContact CD2-CB 3.69Å; F250-A256 HydrophobicContact CE2-CB 4.41Å; F250-A256 HydrophobicContact CG-CB 3.94Å; F250-A259 HydrophobicContact CE2-CB 4.12Å; F250-A259 HydrophobicContact CZ-CB 3.75Å
251E95.4Very high95.9Very high85 Ų8542.4 Ų42.440%0.39721%0.214SC..SBendtrans-69-38.6169.9-175.2172.8-115.800111.7G201 T202 P203 K229 L231G201-E251 CarbonylContact C-O 3.54Å; T202-E251 CarbonylContact C-O 3.53Å; P203-E251 WeakPolarHBondContact CA-O 3.35Å; K229-E251 HydrophobicContact CB-CB 4.3Å; K229-E251 HydrophobicContact CD-CB 4.34Å; K229-E251 WeakPolarHBondContact CD-OE2 3.48Å; K229-E251 IonicContact NZ-OE1 2.7Å; K229-E251 PolarHBondContact NZ-OE1 3.41Å; K229-E251 IonicContact NZ-OE2 2.74Å; K229-E251 PolarHBondContact NZ-OE2 2.98Å; K229-E251 PolarHBondContact O-N 3.02Å; L231-E251 HydrophobicContact CD1-CB 4.31Å; L231-E251 HydrophobicContact CD2-CB 4.03Å; L231-E251 HydrophobicContact CD2-CG 4.35Å; L231-E251 HydrophobicContact CG-CB 4.02Å
252S95.4Very high96Very high25 Ų2546.9 Ų46.918%0.17523%0.225CC..  trans-110.2138.6179.1-170.50000112.3F250 S254 D255 A256F250-S252 WeakPolarHBondContact CB-O 3.37Å; S252-S254 PolarHBondContact OG-OG 2.78Å; S252-D255 WeakPolarHBondContact CB-OD2 3.12Å; S252-A256 PolarHBondContact O-N 2.84Å
253S94.6Very high96.1Very high32 Ų3246.9 Ų46.922%0.22422%0.224CC..Hα-helixtrans-67.2-36.2174.554.60000112.9T202 A256 E257T202-S253 PolarHBondContact O-N 3.42Å; T202-S253 VanDerWaalsContact O-N 3.1Å; S253-A256 PolarHBondContact O-N 3.1Å; S253-E257 PolarHBondContact O-N 2.84Å
254S95.3Very high96.1Very high60 Ų6046 Ų4642%0.4222%0.221SC..Hα-helixtrans-64.9-43.8178.854.60000111.8S252 A256 E257 R258S252-S254 PolarHBondContact OG-OG 2.78Å; S254-A256 VanDerWaalsContact C-N 3.31Å; S254-A256 PolarHBondContact O-N 3.38Å; S254-E257 PolarHBondContact O-N 2.84Å; S254-R258 WeakPolarHBondContact O-CG 3.38Å; S254-R258 PolarHBondContact O-N 3.11Å; S254-R258 VanDerWaalsContact O-N 3.1Å
255D95.9Very high96.1Very high38 Ų3847.7 Ų47.720%0.20324%0.238CC..Hα-helixtrans-64.9-36.9178-67.3-28.1000112.1F227 F250 S252 E257 R258 A259F227-D255 WeakPolarHBondContact O-CB 3.34Å; F250-D255 HydrophobicContact CD1-CB 4.12Å; S252-D255 WeakPolarHBondContact CB-OD2 3.12Å; D255-E257 VanDerWaalsContact C-N 3.34Å; D255-E257 PolarHBondContact O-N 3.12Å; D255-R258 PolarHBondContact O-N 2.7Å; D255-R258 IonicContact OD1-NH1 3.63Å; D255-A259 WeakPolarHBondContact O-CB 3.49Å; D255-A259 PolarHBondContact O-N 3.49Å
256A95.8Very high96.1Very high0 Ų047.8 Ų47.80%024%0.242CC..Hα-helixtrans-63.7-37.8174.700000112.5K204 L206 F250 S252 S253 S254 R260K204-A256 HydrophobicContact CB-CB 3.79Å; K204-A256 HydrophobicContact CD-CB 3.89Å; K204-A256 HydrophobicContact CG-CB 3.88Å; L206-A256 HydrophobicContact CD1-CB 4.05Å; L206-A256 VanDerWaalsContact CD1-O 3.3Å; L206-A256 WeakPolarHBondContact CD1-O 3.43Å; L206-A256 HydrophobicContact CD2-CB 4.12Å; L206-A256 HydrophobicContact CG-CB 4.05Å; F250-A256 HydrophobicContact CB-CB 3.98Å; F250-A256 HydrophobicContact CD2-CB 3.69Å; F250-A256 HydrophobicContact CE2-CB 4.41Å; F250-A256 HydrophobicContact CG-CB 3.94Å; S252-A256 PolarHBondContact O-N 2.84Å; S253-A256 PolarHBondContact O-N 3.1Å; S254-A256 VanDerWaalsContact C-N 3.31Å; S254-A256 PolarHBondContact O-N 3.38Å; A256-R260 WeakPolarHBondContact O-CB 3.14Å; A256-R260 PolarHBondContact O-N 3.12Å
257E95.7Very high96.1Very high80 Ų8053.3 Ų53.337%0.37427%0.271SS..Hα-helixtrans-67.5-44176.1-70.6-175.817600111.9K204 S253 S254 D255 A259 R260 E261K204-E257 VanDerWaalsContact NZ-CD 3.35Å; K204-E257 IonicContact NZ-OE1 3.49Å; K204-E257 PolarHBondContact NZ-OE1 3.14Å; S253-E257 PolarHBondContact O-N 2.84Å; S254-E257 PolarHBondContact O-N 2.84Å; D255-E257 VanDerWaalsContact C-N 3.34Å; D255-E257 PolarHBondContact O-N 3.12Å; E257-A259 VanDerWaalsContact C-N 3.31Å; E257-A259 PolarHBondContact O-N 3.47Å; E257-R260 WeakPolarHBondContact O-CB 3.39Å; E257-R260 PolarHBondContact O-N 2.85Å; E257-E261 WeakPolarHBondContact O-CG 3.23Å; E257-E261 PolarHBondContact O-N 3.17Å
258R96.4Very high95.9Very high125 Ų12553.1 Ų53.147%0.47227%0.272SS..Hα-helixtrans-60.5-41.2175.5-65.9172.171.4-150.64.8112S254 D255 K262S254-R258 WeakPolarHBondContact O-CG 3.38Å; S254-R258 PolarHBondContact O-N 3.11Å; S254-R258 VanDerWaalsContact O-N 3.1Å; D255-R258 PolarHBondContact O-N 2.7Å; D255-R258 IonicContact OD1-NH1 3.63Å; R258-K262 WeakPolarHBondContact O-CG 3.35Å; R258-K262 PolarHBondContact O-N 3Å
259A96.5Very high95.7Very high0 Ų059.7 Ų59.70%030%0.303CS..Hα-helixtrans-64.9-44.3175.900000111.5L206 F224 F227 F250 D255 E257 K262 L263L206-A259 HydrophobicContact CD1-CB 4.38Å; F224-A259 HydrophobicContact CD1-CB 3.98Å; F224-A259 HydrophobicContact CE1-CB 4.38Å; F227-A259 HydrophobicContact CB-CB 3.72Å; F227-A259 HydrophobicContact CD2-CB 3.54Å; F227-A259 HydrophobicContact CE2-CB 4.36Å; F227-A259 HydrophobicContact CG-CB 3.7Å; F250-A259 HydrophobicContact CE2-CB 4.12Å; F250-A259 HydrophobicContact CZ-CB 3.75Å; D255-A259 WeakPolarHBondContact O-CB 3.49Å; D255-A259 PolarHBondContact O-N 3.49Å; E257-A259 VanDerWaalsContact C-N 3.31Å; E257-A259 PolarHBondContact O-N 3.47Å; A259-K262 PolarHBondContact O-N 3Å; A259-L263 VanDerWaalsContact O-CB 3.29Å; A259-L263 WeakPolarHBondContact O-CB 3.42Å; A259-L263 PolarHBondContact O-N 2.73Å
260R96.8Very high95.6Very high67 Ų6762 Ų6225%0.25333%0.331SS..Hα-helixtrans-57.3-51177179.5-169.967.9-177.91.9111L206 A256 E257 K262 H264 V275 N277L206-R260 HydrophobicContact CD1-CB 4.45Å; A256-R260 WeakPolarHBondContact O-CB 3.14Å; A256-R260 PolarHBondContact O-N 3.12Å; E257-R260 WeakPolarHBondContact O-CB 3.39Å; E257-R260 PolarHBondContact O-N 2.85Å; R260-K262 VanDerWaalsContact C-N 3.31Å; R260-K262 PolarHBondContact O-N 3.33Å; R260-H264 WeakPolarHBondContact O-CB 3.45Å; R260-H264 PolarHBondContact O-N 2.67Å; R260-V275 HydrophobicContact CB-CG1 4.04Å; R260-V275 HydrophobicContact CG-CB 4.27Å; R260-V275 HydrophobicContact CG-CG1 4.09Å; R260-V275 WeakPolarHBondContact CG-O 3.07Å; R260-N277 PolarHBondContact NH1-OD1 3.08Å
261E96Very high95.5Very high129 Ų12965.6 Ų65.660%0.60334%0.344SS*.Hα-helixtrans-63.4-36.6-176.6-72.9167-165.800113.1E257E257-E261 WeakPolarHBondContact O-CG 3.23Å; E257-E261 PolarHBondContact O-N 3.17Å
262K95.8Very high95.6Very high123 Ų12367.9 Ų67.954%0.53535%0.353SS..Hα-helixtrans-83.6-35.1-177.8-72.2177.9174.9-175.30114F227 R258 A259 R260 T266F227-K262 HydrophobicContact CD1-CD 4.05Å; F227-K262 HydrophobicContact CE1-CB 4.02Å; F227-K262 HydrophobicContact CE1-CD 3.31Å; F227-K262 HydrophobicContact CE1-CG 4.3Å; F227-K262 HydrophobicContact CZ-CB 3.93Å; F227-K262 HydrophobicContact CZ-CD 4.05Å; R258-K262 WeakPolarHBondContact O-CG 3.35Å; R258-K262 PolarHBondContact O-N 3Å; A259-K262 PolarHBondContact O-N 3Å; R260-K262 VanDerWaalsContact C-N 3.31Å; R260-K262 PolarHBondContact O-N 3.33Å; K262-T266 WeakPolarHBondContact O-CG2 3.41Å
263L95.8Very high95.7Very high13 Ų1366.7 Ų66.77%0.06835%0.345CS..Hα-helixtrans-94.4-22.8-175.1-70.3176.6000113.3M223 F224 F227 A259 G265 T266 I273 V275M223-L263 HydrophobicContact CE-CD1 4.34Å; M223-L263 HydrophobicContact CG-CD1 4.18Å; M223-L263 HydrophobicContact CG-CD2 3.94Å; M223-L263 HydrophobicContact SD-CD2 4.38Å; F224-L263 HydrophobicContact CD1-CD1 3.47Å; F224-L263 VanDerWaalsContact CD1-CD1 3.47Å; F224-L263 HydrophobicContact CD2-CD1 4.04Å; F224-L263 HydrophobicContact CE1-CB 4.49Å; F224-L263 HydrophobicContact CE1-CD1 3.32Å; F224-L263 HydrophobicContact CE2-CD1 3.92Å; F224-L263 HydrophobicContact CG-CD1 3.82Å; F224-L263 HydrophobicContact CZ-CD1 3.55Å; F227-L263 HydrophobicContact CD2-CD1 4.09Å; F227-L263 HydrophobicContact CE2-CD1 3.49Å; F227-L263 VanDerWaalsContact CE2-CD1 3.49Å; F227-L263 HydrophobicContact CE2-CD2 4.05Å; F227-L263 HydrophobicContact CE2-CG 3.57Å; F227-L263 HydrophobicContact CZ-CD1 4.46Å; F227-L263 HydrophobicContact CZ-CD2 4.36Å; F227-L263 HydrophobicContact CZ-CG 4.08Å; A259-L263 VanDerWaalsContact O-CB 3.29Å; A259-L263 WeakPolarHBondContact O-CB 3.42Å; A259-L263 PolarHBondContact O-N 2.73Å; L263-G265 PolarHBondContact O-N 2.98Å; L263-T266 WeakPolarHBondContact O-CB 3.47Å; L263-T266 WeakPolarHBondContact O-CG2 3.29Å; L263-T266 PolarHBondContact O-N 2.97Å; L263-T266 VanDerWaalsContact O-N 3.11Å; L263-T266 PolarHBondContact O-OG1 3.12Å; L263-I273 HydrophobicContact CB-CD1 4.19Å; L263-I273 VanDerWaalsContact O-CG1 3.3Å; L263-I273 WeakPolarHBondContact O-CG1 3.2Å; L263-V275 HydrophobicContact CB-CG2 3.94Å
264H96.9Very high95.8Very high93 Ų9369.6 Ų69.643%0.43136%0.355SS..THydrogen-bonded Turntrans-61.1125.9177-174.596.4000110.7R260 T266 V275R260-H264 WeakPolarHBondContact O-CB 3.45Å; R260-H264 PolarHBondContact O-N 2.67Å; H264-T266 VanDerWaalsContact C-N 3.3Å; H264-T266 PolarHBondContact O-N 2.91Å; H264-V275 HydrophobicContact CB-CB 4.24Å; H264-V275 PolarHBondContact ND1-N 2.96Å; H264-V275 VanDerWaalsContact ND1-N 3.12Å; H264-V275 PolarHBondContact ND1-O 3.04Å
265G95.7Very high95.9Very high40 Ų4066.8 Ų66.841%0.41234%0.335SS..THydrogen-bonded Turntrans82.1-1.1-178.900000115L263 I273L263-G265 PolarHBondContact O-N 2.98Å; G265-I273 WeakPolarHBondContact CA-O 3.41Å; G265-I273 PolarHBondContact N-O 2.89Å
266T95.9Very high95.9Very high44 Ų4468.4 Ų68.427%0.2734%0.343SS..  trans-70.6149178.460.20000112K262 L263 H264 K272 I273K262-T266 WeakPolarHBondContact O-CG2 3.41Å; L263-T266 WeakPolarHBondContact O-CB 3.47Å; L263-T266 WeakPolarHBondContact O-CG2 3.29Å; L263-T266 PolarHBondContact O-N 2.97Å; L263-T266 VanDerWaalsContact O-N 3.11Å; L263-T266 PolarHBondContact O-OG1 3.12Å; H264-T266 VanDerWaalsContact C-N 3.3Å; H264-T266 PolarHBondContact O-N 2.91Å; T266-K272 CarbonylContact O-C 3.57Å; T266-K272 WeakPolarHBondContact O-CA 3.41Å; T266-I273 PolarHBondContact O-N 2.83Å; T266-I273 WeakPolarHBondContact OG1-CD1 3.31Å; T266-I273 VanDerWaalsContact OG1-CG1 3.29Å; T266-I273 WeakPolarHBondContact OG1-CG1 3.13Å
267L96.1Very high95.9Very high116 Ų11672.2 Ų72.261%0.60736%0.364SS*.EExtended strand (participates in β ladder)trans-91.2116178.9-76.6159.2000110R271 K272L267-R271 CarbonylContact C-O 3.38Å; L267-R271 WeakPolarHBondContact CA-O 3.27Å; L267-K272 HydrophobicContact CD2-CB 4.46Å; L267-K272 HydrophobicContact CD2-CD 4.46Å; L267-K272 HydrophobicContact CD2-CG 3.41Å; L267-K272 VanDerWaalsContact CD2-CG 3.41Å; L267-K272 HydrophobicContact CG-CG 3.98Å
268V94.1Very high95.9Very high23 Ų2369.4 Ų69.414%0.13935%0.354CS..EExtended strand (participates in β ladder)trans-121.9118.9177.7-1770000108.5P212 F215 M223 G270 R271 I273P212-V268 HydrophobicContact CG-CG1 4.34Å; F215-V268 HydrophobicContact CE1-CG1 4.07Å; F215-V268 HydrophobicContact CE2-CG1 3.96Å; F215-V268 HydrophobicContact CZ-CG1 3.33Å; M223-V268 HydrophobicContact SD-CG2 3.82Å; V268-G270 PolarHBondContact O-N 2.86Å; V268-G270 VanDerWaalsContact O-N 3.14Å; V268-R271 PolarHBondContact N-O 2.79Å; V268-R271 PolarHBondContact O-N 2.72Å; V268-I273 HydrophobicContact CB-CG2 3.86Å; V268-I273 HydrophobicContact CG2-CD1 3.97Å; V268-I273 HydrophobicContact CG2-CG1 4.23Å; V268-I273 HydrophobicContact CG2-CG2 3.79Å
269E92.6Very high95.5Very high139 Ų13969.2 Ų69.265%0.6537%0.367SS*.THydrogen-bonded Turntrans49.237.5-173.3-55.3-169.3147.800113.4P212 F215 R271P212-E269 HydrophobicContact CB-CB 4.49Å; P212-E269 WeakPolarHBondContact CB-OE2 3.4Å; P212-E269 HydrophobicContact CG-CB 3.79Å; P212-E269 HydrophobicContact CG-CG 3.98Å; P212-E269 WeakPolarHBondContact CG-OE2 3.08Å; F215-E269 HydrophobicContact CE2-CG 4.46Å; E269-R271 VanDerWaalsContact C-N 3.3Å; E269-R271 PolarHBondContact O-N 3.5Å
270G94.1Very high94.7Very high69 Ų6973.5 Ų73.571%0.71140%0.403SS*.THydrogen-bonded Turntrans79.34.2-178.600000115.2V268V268-G270 PolarHBondContact O-N 2.86Å; V268-G270 VanDerWaalsContact O-N 3.14Å
271R95.5Very high93.9Very high77 Ų7776.2 Ų76.229%0.29141%0.413SS..EExtended strand (participates in β ladder)trans-109.1132.5176.4-56.6-17674.2155.91.1110.5N210 L267 V268 E269 I273N210-R271 PolarHBondContact OD1-NE 2.77Å; N210-R271 VanDerWaalsContact OD1-NE 3.17Å; N210-R271 PolarHBondContact OD1-NH2 3.43Å; L267-R271 CarbonylContact C-O 3.38Å; L267-R271 WeakPolarHBondContact CA-O 3.27Å; V268-R271 PolarHBondContact N-O 2.79Å; V268-R271 PolarHBondContact O-N 2.72Å; E269-R271 VanDerWaalsContact C-N 3.3Å; E269-R271 PolarHBondContact O-N 3.5Å; R271-I273 PolarHBondContact O-N 2.85Å
272K97.2Very high93.1Very high132 Ų13276.2 Ų76.257%0.57442%0.421SS*.EExtended strand (participates in β ladder)trans-76108.3173.9-68.8-173.6178.8-176.70109.5N210 T266 L267N210-K272 WeakPolarHBondContact CB-O 3.44Å; N210-K272 PolarHBondContact ND2-O 3.29Å; T266-K272 CarbonylContact O-C 3.57Å; T266-K272 WeakPolarHBondContact O-CA 3.41Å; L267-K272 HydrophobicContact CD2-CB 4.46Å; L267-K272 HydrophobicContact CD2-CD 4.46Å; L267-K272 HydrophobicContact CD2-CG 3.41Å; L267-K272 VanDerWaalsContact CD2-CG 3.41Å; L267-K272 HydrophobicContact CG-CG 3.98Å
273I97.2Very high91.6Very high0 Ų077.9 Ų77.90%043%0.433CS..  trans-76.7150.3177.968.4168.7000110.1S209 I211 M223 L263 G265 T266 V268 R271S209-I273 WeakPolarHBondContact O-CA 3.42Å; I211-I273 HydrophobicContact CG2-CB 4.49Å; I211-I273 HydrophobicContact CG2-CG2 3.98Å; M223-I273 HydrophobicContact CE-CD1 3.51Å; M223-I273 HydrophobicContact SD-CD1 4.05Å; L263-I273 HydrophobicContact CB-CD1 4.19Å; L263-I273 VanDerWaalsContact O-CG1 3.3Å; L263-I273 WeakPolarHBondContact O-CG1 3.2Å; G265-I273 WeakPolarHBondContact CA-O 3.41Å; G265-I273 PolarHBondContact N-O 2.89Å; T266-I273 PolarHBondContact O-N 2.83Å; T266-I273 WeakPolarHBondContact OG1-CD1 3.31Å; T266-I273 VanDerWaalsContact OG1-CG1 3.29Å; T266-I273 WeakPolarHBondContact OG1-CG1 3.13Å; V268-I273 HydrophobicContact CB-CG2 3.86Å; V268-I273 HydrophobicContact CG2-CD1 3.97Å; V268-I273 HydrophobicContact CG2-CG1 4.23Å; V268-I273 HydrophobicContact CG2-CG2 3.79Å; R271-I273 PolarHBondContact O-N 2.85Å
274E96.9Very high90Very high94 Ų9482.7 Ų82.744%0.43946%0.463SS..EExtended strand (participates in β ladder)trans-121.4129.3177.3-72.6174.1175.200108.6V208 S209V208-E274 CarbonylContact C-O 3.58Å; V208-E274 VanDerWaalsContact CA-O 3.31Å; V208-E274 WeakPolarHBondContact CA-O 3.3Å; S209-E274 PolarHBondContact N-O 2.8Å; S209-E274 PolarHBondContact O-N 3.39Å; S209-E274 VanDerWaalsContact OG-CB 3.27Å; S209-E274 WeakPolarHBondContact OG-CB 3.43Å; S209-E274 PolarHBondContact OG-O 2.97Å; S209-E274 PolarHBondContact OG-OE2 2.79Å
275V97.4Very high87.9Confident0 Ų084.9 Ų84.90%048%0.478CS..EExtended strand (participates in β ladder)trans-116121176.8-170.30000108.9L206 H207 V208 F224 R260 L263 H264L206-V275 HydrophobicContact CB-CG1 4.11Å; L206-V275 HydrophobicContact CD1-CG1 3.84Å; L206-V275 HydrophobicContact CG-CG1 4.44Å; H207-V275 CarbonylContact O-C 3.52Å; H207-V275 WeakPolarHBondContact O-CA 3.46Å; V208-V275 HydrophobicContact CG1-CG2 4.34Å; V208-V275 HydrophobicContact CG2-CG1 4.49Å; F224-V275 HydrophobicContact CE1-CG1 4.11Å; F224-V275 HydrophobicContact CE1-CG2 4.16Å; F224-V275 HydrophobicContact CZ-CG1 4.38Å; F224-V275 HydrophobicContact CZ-CG2 3.83Å; R260-V275 HydrophobicContact CB-CG1 4.04Å; R260-V275 HydrophobicContact CG-CB 4.27Å; R260-V275 HydrophobicContact CG-CG1 4.09Å; R260-V275 WeakPolarHBondContact CG-O 3.07Å; L263-V275 HydrophobicContact CB-CG2 3.94Å; H264-V275 HydrophobicContact CB-CB 4.24Å; H264-V275 PolarHBondContact ND1-N 2.96Å; H264-V275 VanDerWaalsContact ND1-N 3.12Å; H264-V275 PolarHBondContact ND1-O 3.04Å
276N96.6Very high85.9Confident72 Ų7291.8 Ų91.839%0.38550%0.497SS..EExtended strand (participates in β ladder)trans-127.8163.4-180-71.7-33.4000110.2L206 H207 A278L206-N276 CarbonylContact C-O 3.58Å; L206-N276 WeakPolarHBondContact CA-O 3.17Å; H207-N276 PolarHBondContact N-O 2.87Å; H207-N276 PolarHBondContact O-N 2.71Å; N276-A278 PolarHBondContact O-N 2.6Å
277N95.8Very high83.7Confident81 Ų8197.5 Ų97.543%0.43352%0.518SS..EExtended strand (participates in β ladder)trans-65.7133.9170.4-66.127.9000108.8R260R260-N277 PolarHBondContact NH1-OD1 3.08Å
278A93.9Very high81.7Confident20 Ų20100.1 Ų100.117%0.16553%0.529CS..PPolyproline II helixtrans-73.8141.617600000110.2R205 H207 F247 N276 A280R205-A278 HydrophobicContact CB-CB 3.86Å; R205-A278 HydrophobicContact CG-CB 3.66Å; R205-A278 VanDerWaalsContact O-CB 3.3Å; R205-A278 WeakPolarHBondContact O-CB 3.41Å; R205-A278 PolarHBondContact O-N 2.81Å; H207-A278 HydrophobicContact CB-CB 4.28Å; F247-A278 HydrophobicContact CD1-CB 3.85Å; F247-A278 HydrophobicContact CE1-CB 4.13Å; N276-A278 PolarHBondContact O-N 2.6Å; A278-A280 PolarHBondContact O-N 3.23Å
279T89.4Confident79.6Confident121 Ų121104.3 Ų104.374%0.74256%0.555SS**PPolyproline II helixtrans-63.7134.9161.536.10000108.9R281T279-R281 PolarHBondContact O-N 3.25Å
280A79.9Confident77.7Confident91 Ų91102 Ų10275%0.75255%0.55SS**PPolyproline II helixtrans-55.8135.2178.600000109.4A278 V282A278-A280 PolarHBondContact O-N 3.23Å; A280-V282 PolarHBondContact O-N 2.75Å
281R79.8Confident75.8Confident123 Ų123104.1 Ų104.146%0.46455%0.551SS.*PPolyproline II helixtrans-62.4122167.2-80.3172.8152.7-175.6-17.6106.7E234 T279 M283E234-R281 IonicContact OE1-CZ 3.86Å; E234-R281 IonicContact OE1-NH2 2.68Å; E234-R281 PolarHBondContact OE1-NH2 3.17Å; E234-R281 IonicContact OE2-CZ 3.2Å; E234-R281 IonicContact OE2-NE 3.64Å; E234-R281 IonicContact OE2-NH1 3.95Å; E234-R281 IonicContact OE2-NH2 2.6Å; E234-R281 PolarHBondContact OE2-NH2 2.92Å; T279-R281 PolarHBondContact O-N 3.25Å; R281-M283 HydrophobicContact CB-SD 3.96Å; R281-M283 PolarHBondContact O-N 3.34Å
282V78.1Confident73.7Confident129 Ų129110.5 Ų110.578%0.78258%0.577SS**  trans-68.189.3166.1-177.80000105.8A280 T284A280-V282 PolarHBondContact O-N 2.75Å; V282-T284 HydrophobicContact CG1-CG2 3.97Å; V282-T284 PolarHBondContact O-N 3.49Å
283M65.3Low71.5Confident159 Ų159107.9 Ų107.978%0.78358%0.58SS**  trans-66.890.7163-96.389.3123.400105.9R281 N285R281-M283 HydrophobicContact CB-SD 3.96Å; R281-M283 PolarHBondContact O-N 3.34Å; M283-N285 PolarHBondContact O-N 3.43Å
284T61.9Low69Low113 Ų113114.4 Ų114.469%0.69362%0.615SS**  trans-64.892.5154.2640000104V282 K286V282-T284 HydrophobicContact CG1-CG2 3.97Å; V282-T284 PolarHBondContact O-N 3.49Å; T284-K286 PolarHBondContact O-N 2.83Å
285N52.1Low67Low140 Ų140114.5 Ų114.575%0.74964%0.641SS**  trans-65.680.3174.6-164.9-5.5000106.1M283 K287M283-N285 PolarHBondContact O-N 3.43Å; N285-K287 PolarHBondContact O-N 3.22Å
286K53.7Low64.8Low185 Ų185123 Ų12380%0.80468%0.68SS**  trans-71.479.3165.7-167.3174.2175.4-179.80102.8T284 M288T284-K286 PolarHBondContact O-N 2.83Å; K286-M288 PolarHBondContact O-N 2.7Å
287K50.9Low62.4Low164 Ų164123.1 Ų123.171%0.71370%0.698SS**  trans-41.3105.9157.629.5175.7173.1174.50103.9N285 T289N285-K287 PolarHBondContact O-N 3.22Å; K287-T289 PolarHBondContact O-N 2.68Å
288M53.5Low60.1Low171 Ų171128 Ų12884%0.84272%0.724SS**  trans-65.888.3168.1-176.2155.8-82.500102.8K286 T290K286-M288 PolarHBondContact O-N 2.7Å; M288-T290 PolarHBondContact O-N 2.63Å
289T49.8Very low58Low110 Ų110131.7 Ų131.768%0.67575%0.754SS**  trans-61.597.4164.5-84.20000103.6K287 P291K287-T289 PolarHBondContact O-N 2.68Å; T289-P291 WeakPolarHBondContact O-CD 3.43Å
290T53.6Low56.2Low90 Ų90130.3 Ų130.355%0.55276%0.755SS**  trans-49.4122.9156.4-410000105.7M288 Y292M288-T290 PolarHBondContact O-N 2.63Å; T290-Y292 PolarHBondContact O-N 3.49Å
291P54.1Low54.6Low114 Ų114133.9 Ų133.974%0.7476%0.761SS**SBendtrans-66.79.8-176.522.6-30.3000114.6T289T289-P291 WeakPolarHBondContact O-CD 3.43Å
292Y51.1Low53.2Low212 Ų212133.8 Ų133.883%0.83178%0.776SS**  trans-136.159.9176.8-81.7-85.8000111.3T290T290-Y292 PolarHBondContact O-N 3.49Å
293A50.3Low51.8Low76 Ų76138.5 Ų138.563%0.62878%0.781SS**SBendtrans-80.8-15.1175.500000118.5
294N44.1Very low50.8Low138 Ų138135.1 Ų135.174%0.73878%0.778SS**  trans172.7126.6-17439.6-23.8000110.7E296N294-E296 PolarHBondContact O-N 2.85Å
295G54.8Low50.2Low95 Ų95132.8 Ų132.898%0.97978%0.777SS**SBendtrans-74.553.2-179.800000114.7
296E52.7Low49.6Very low179 Ų179138.6 Ų138.684%0.83679%0.788SS**  trans-155.791.2179.6-156.4176.4-169.400110.2N294N294-E296 PolarHBondContact O-N 2.85Å
297G44.8Very low48.8Very low74 Ų74139.2 Ų139.276%0.76379%0.791SS**  trans179.213.4-178.500000118.1A299G297-A299 VanDerWaalsContact C-N 3.31Å; G297-A299 PolarHBondContact O-N 2.77Å
298L47.8Very low48.4Very low184 Ų184139.7 Ų139.796%0.96380%0.8SS**  trans-9333.7178.8-67.1-177000113.8
299A50.9Low47.6Very low98 Ų98135.7 Ų135.781%0.8179%0.79SS**SBendtrans-143.150.1-174.800000113.6G297G297-A299 VanDerWaalsContact C-N 3.31Å; G297-A299 PolarHBondContact O-N 2.77Å
300A51.1Low47.7Very low91 Ų91136.7 Ų136.775%0.75280%0.798SS**SBendtrans-173.798.4152.500000110.4
301L46.8Very low47.2Very low167 Ų167140.8 Ų140.887%0.87481%0.813SS**  trans161.1153.3138.8-80.9-179.3000110.8
302P50.6Low46.8Very low121 Ų121142.7 Ų142.779%0.78682%0.822SS**  trans-115.254.1-132.841.5-32.5000115.8
303Y47.8Very low46.3Very low228 Ų228136.6 Ų136.689%0.89482%0.824SS**  trans-168.2152.8161.8-159.8-107.9000112.1
304A43.8Very low46Very low87 Ų87137.7 Ų137.772%0.71983%0.833SS**  trans80.691.1-179.300000115
305G50.8Low46Very low64 Ų64139.6 Ų139.666%0.6684%0.839SS**  66.996.458.200000107.3
306W38.8Very low45.2Very low263 Ų263145.3 Ų145.3100%0.99683%0.833SS**  -146130.853.9-68.972.6000110.1
307K37.8Very low44.4Very low198 Ų198141.8 Ų141.886%0.86183%0.828SS**  trans-99.3102.2-179.5-179.6170.61691790108.5
308L41.8Very low44.2Very low173 Ų173143.6 Ų143.691%0.90683%0.826SS**  trans-98111.7165.6-142.579.6000108
309S37.4Very low43.7Very low88 Ų88141.9 Ų141.962%0.61581%0.813SS**  trans-64.1141.6175.2-64.70000111.3M311S309-M311 PolarHBondContact O-N 3.38Å
310P51.3Low43.2Very low130 Ų130143.3 Ų143.384%0.84481%0.806SS**SBendtrans-90.573175.536.2-31.3000109.7
311M41.8Very low42.4Very low176 Ų176150.1 Ų150.187%0.86781%0.814SS**  trans-157.7120166.5-109.6158.4-170.500107S309S309-M311 PolarHBondContact O-N 3.38Å
312V45.5Very low41.8Very low154 Ų154147.5 Ų147.593%0.93381%0.806SS**  trans10181.3-167.8-1780000112.2
313G40.7Very low40.9Very low85 Ų85148.3 Ų148.388%0.87681%0.808SS**  trans-149.735.2165.600000110.5
314A44.7Very low40.5Very low98 Ų98143.3 Ų143.381%0.8180%0.804SS**  trans-121.758.7175.500000108.7
315M45.4Very low40.1Very low178 Ų178142 Ų14288%0.87780%0.799SS**SBendtrans-16565.3169-129.6-177.2163.900111.9
316Y36.9Very low39.3Very low216 Ų216148.8 Ų148.885%0.84781%0.81SS**  trans-176.196.1139.6-128.6-106.3000109.6
317S36Very low39.7Very low105 Ų105142.1 Ų142.173%0.73480%0.801SS**  trans-77.2142.8152.8-66.80000108.2
318P41.2Very low39.8Very low112 Ų112143.3 Ų143.373%0.72780%0.802SS**  -120.5111.3127.512.26.3000109.8
319E36.2Very low40Very low147 Ų147141 Ų14169%0.68780%0.796SS**  trans8.2119143.1-63.7-67.1134.600118.1
320L42Very low40.3Very low128 Ų128141.8 Ų141.867%0.6781%0.809SS**  37.2106.5126.2-55.9178.2000118.3
321Y33.8Very low40Very low234 Ų234140.4 Ų140.492%0.91881%0.808SS**  trans-130.4104.2134.8-107.2-89.3000109.6
322T33.1Very low40Very low113 Ų113137 Ų13769%0.69381%0.808SS**  trans-77.9127.8169.857.20000108.2
323V32Very low39.7Very low137 Ų137134.9 Ų134.983%0.8381%0.807SS**  trans-102.2115.8162.6175.90000106.2
324P39.6Very low39.9Very low124 Ų124135.7 Ų135.781%0.80581%0.805SS**  trans-84.2126.517932.7-28.9000109.2
325G36.3Very low39.8Very low60 Ų60135.9 Ų135.962%0.61981%0.807SS**  trans173.7122.516900000112.7
326F33.3Very low39.4Very low206 Ų206132.5 Ų132.590%0.90481%0.807SS**  trans95.3100.5172.7-58.7-74.7000117
327P47.8Very low39.7Very low122 Ų122127 Ų12779%0.79281%0.806SS**  trans-82.4133.8172.532.9-30.9000111.2
328Y39.1Very low40.1Very low224 Ų224127.1 Ų127.188%0.87881%0.807SS**  trans-125.9140.4152.7-99.8-91.7000109
329P46.3Very low40Very low123 Ų123128.8 Ų128.880%0.79982%0.815SS**  trans-77.1135.5-166.229.6-33.9000112.9
330A42.7Very low40.1Very low105 Ų105126.9 Ų126.987%0.86883%0.825SS**  trans-87112.317100000110.4
331A46.3Very low39.8Very low101 Ų101124.8 Ų124.884%0.83583%0.826SS**  trans-162.871.4161.100000111.5
332A41.2Very low40Very low104 Ų104119.6 Ų119.686%0.8682%0.819SS**  trans-167.217.7158.600000114.8
333A40.1Very low40.1Very low111 Ų111124 Ų12492%0.91783%0.829SS**  trans-104.348.5-179.500000112.4
334A43.2Very low40.3Very low101 Ų101129.4 Ų129.484%0.83583%0.834SS**  trans-149.359.8174.600000111.9
335A42.8Very low39.8Very low103 Ų103127.1 Ų127.185%0.85183%0.833SS**SBendtrans-164.259.7164.500000112.2
336A38Very low39.9Very low107 Ų107129.8 Ų129.888%0.88484%0.837SS**  trans-156.246.7166.100000111.9
337A43.5Very low40.5Very low99 Ų99127.9 Ų127.982%0.81883%0.831SS**  trans-135.867.9172.400000109.8
338S43.5Very low40Very low109 Ų109130.5 Ų130.576%0.76284%0.837SS**SBendtrans-174.753.6168.346.70000114.2
339T38.8Very low40.2Very low146 Ų146131.7 Ų131.790%0.89684%0.84SS**  trans-161.368.2153.4-10.40000112.9
340A38.4Very low39.5Very low108 Ų108129.3 Ų129.389%0.89384%0.838SS**  trans-137.969.4167.400000110.7
341A35.9Very low39.9Very low84 Ų84136.7 Ų136.769%0.69484%0.843SS**  trans-169.8121.7157.400000103.4
342T37.4Very low39.2Very low124 Ų124136.2 Ų136.276%0.76184%0.84SS**  -179.2134.659.6-30.50000104.1
343F35.7Very low39.5Very low207 Ų207142.5 Ų142.591%0.90884%0.841SS**  trans-177.496.6138.2-107.6-76.8000108.8
344R35.4Very low39.7Very low250 Ų250142.5 Ų142.594%0.94383%0.832SS**  trans-72.8137.7149.3-80.4-163.2-164.9-144.77.5107.1
345G31.1Very low39.5Very low75 Ų75144 Ų14477%0.77383%0.83SS**  trans179.2101.616900000110.9
346T37.4Very low39Very low116 Ų116149.7 Ų149.771%0.71283%0.831SS**  trans-77.5156.7175.245.70000111.4
347H45.8Very low38.7Very low166 Ų166149.1 Ų149.177%0.76982%0.821SS**  trans78111.3166.8-43.4-82.9000117.7
348L38.4Very low38.7Very low178 Ų178149.4 Ų149.493%0.93282%0.823SS**  -173.6151.6103.4-90.9164.4000112.1
349R42.8Very low38.4Very low249 Ų249149.8 Ų149.894%0.9482%0.821SS**  trans-69.7132.2-173.9-175.9178.1-164147.30.8111.6
350G31.3Very low38.8Very low73 Ų73154.4 Ų154.475%0.75382%0.822SS**  trans168.4122.7166.600000114.8A352G350-A352 PolarHBondContact O-N 3.17Å
351R50.4Low38.5Very low259 Ų259153.3 Ų153.398%0.97781%0.813SS**  trans-58122170.3-76.6-179.7165.7-175.3-2.9110.8
352A32.4Very low38.6Very low92 Ų92153.7 Ų153.776%0.7682%0.816SS**  trans-161.6123.9149.300000110.1G350G350-A352 PolarHBondContact O-N 3.17Å
353R47.6Very low38.7Very low236 Ų236153.9 Ų153.989%0.89182%0.816SS**PPolyproline II helixtrans-77.8122.5169.2-61.7168.576.6-173.94.7106.9V355R353-V355 PolarHBondContact O-N 3.06Å
354P43.1Very low38.8Very low111 Ų111149.4 Ų149.472%0.72181%0.808SS**PPolyproline II helixtrans-70.7117.616726.7-29.6000108.8Y356P354-Y356 PolarHBondContact O-N 3.35Å
355V39.3Very low39.1Very low132 Ų132145.9 Ų145.980%0.880%0.803SS**PPolyproline II helixtrans-68.6119165.5173.30000107R353 S357R353-V355 PolarHBondContact O-N 3.06Å; V355-S357 PolarHBondContact O-N 3.17Å; V355-S357 VanDerWaalsContact O-N 3.12Å
356Y32.9Very low39.5Very low222 Ų222148 Ų14887%0.87180%0.803SS**  trans-73.3100.7165.3-77.6-84.9000108.2P354P354-Y356 PolarHBondContact O-N 3.35Å
357S31.9Very low39.6Very low96 Ų96147.2 Ų147.267%0.67181%0.808SS**  trans-80.1112.6160.3-172.50000107.6V355 V359V355-S357 PolarHBondContact O-N 3.17Å; V355-S357 VanDerWaalsContact O-N 3.12Å; S357-V359 VanDerWaalsContact C-N 3.26Å; S357-V359 PolarHBondContact O-N 2.81Å
358A43Very low39.3Very low105 Ų105147 Ų14787%0.86881%0.811SS**  trans-75.581.5171.500000109R360A358-R360 PolarHBondContact O-N 2.94Å
359V36.5Very low39.6Very low117 Ų117143.5 Ų143.571%0.70980%0.799SS**  trans-77.7107.6162.6174.80000107.6S357 A361S357-V359 VanDerWaalsContact C-N 3.26Å; S357-V359 PolarHBondContact O-N 2.81Å; V359-A361 PolarHBondContact O-N 2.88Å
360R47Very low39.2Very low243 Ų243136.4 Ų136.492%0.91779%0.793SS**  trans-62.993.1166.2-170.8178.4-160.9-118.53.9108.6A358A358-R360 PolarHBondContact O-N 2.94Å
361A33.7Very low39.2Very low84 Ų84143.3 Ų143.369%0.69480%0.798SS**  trans-88.2109.7167.400000108.7V359 V363V359-A361 PolarHBondContact O-N 2.88Å; A361-V363 PolarHBondContact O-N 2.66Å
362A38.3Very low38.6Very low93 Ų93136.6 Ų136.677%0.76979%0.788SS**PPolyproline II helixtrans-65.2123.1170.800000109.5
363V38.2Very low38.6Very low127 Ų127135.7 Ų135.777%0.7779%0.788SS**PPolyproline II helixtrans-81125.8166.8178.20000107.6A361A361-V363 PolarHBondContact O-N 2.66Å
364P39Very low37.9Very low113 Ų113131.5 Ų131.573%0.73479%0.788SS**PPolyproline II helixtrans-71.9137.1175.128.6-32.3000110.9
365Q40.3Very low37.5Very low177 Ų177134.7 Ų134.783%0.82780%0.796SS**PPolyproline II helixtrans-69.4137.2173.1-59.9-70.6-30.700110
366P40.7Very low37.1Very low119 Ų119132.2 Ų132.277%0.77379%0.789SS**PPolyproline II helixtrans-76.1132.7171.728.6-31.1000111.6
367A39.8Very low37.2Very low100 Ų100131.1 Ų131.183%0.82678%0.784SS**PPolyproline II helixtrans-71139.6176.400000112.1
368I38.8Very low37.2Very low161 Ų161133.6 Ų133.683%0.82679%0.785SS**PPolyproline II helixtrans-85.6126.9172.9-57.2170.9000108.6
369P43.8Very low36.5Very low105 Ų105135.7 Ų135.768%0.68278%0.782SS**PPolyproline II helixtrans-81.4124172.429.4-29.4000111.5
370A34.9Very low36.3Very low99 Ų99134 Ų13482%0.81879%0.788SS**PPolyproline II helixtrans-77.4132.816300000109.7
371Y30.9Very low35.4Very low218 Ų218130.8 Ų130.886%0.85578%0.781SS**  trans-117.4129168.3-99.8-83000110.7
372P39Very low35.4Very low118 Ų118136.7 Ų136.777%0.76679%0.787SS**  trans-94.7140.3177.134.9-29.5000113.1
373G32.4Very low34.9Very low73 Ų73135.4 Ų135.475%0.75378%0.783SS**  trans29.1139.115200000123.8
374V32.7Very low34.5Very low149 Ų149134.5 Ų134.590%0.90379%0.789SS**  trans-149135.7138.1-176.20000110.6
375M33.5Very low34.2Very low178 Ų178133.9 Ų133.988%0.87779%0.793SS**  trans-55153.1173.3-73.2-90.6-177.500115.7
376A32.2Very low33.8Very low79 Ų79132.5 Ų132.565%0.65379%0.791SS**  151.7146.6106.600000115.2
377Y34.6Very low33.4Very low200 Ų200134.4 Ų134.478%0.78479%0.794SS**  trans77.9107.1165.7-70.4-87.8000118.5
378Q32.3Very low33Very low147 Ų147140.4 Ų140.469%0.68780%0.797SS**  79.7128.561.5-170.7157.343.700110.4
379D28.2Very low32.6Very low149 Ų149136.6 Ų136.680%0.79780%0.797SS**  cis-165.4165.334.5-117.6-37.3000109.3
380G31.4Very low31.9Very low81 Ų81134.9 Ų134.984%0.83580%0.798SS**  trans149.7111.1156.300000117.4
381F29Very low31.7Very low176 Ų176141.6 Ų141.677%0.77280%0.804SS**  trans-117.2160.6-165.3-170.3-118.3000112.4
382Y33Very low31.7Very low209 Ų209135.9 Ų135.982%0.8280%0.802SS**  trans67141.5-179.9-79-74.9000117.1
383G28Very low31.3Very low66 Ų66134.9 Ų134.968%0.6880%0.803SS**  cis145.1129.210.600000109.1
384A30Very low31.1Very low108 Ų108141.7 Ų141.789%0.89381%0.808SS**  trans46121.7156.800000121.9
385A32.8Very low30.8Very low99 Ų99145.4 Ų145.482%0.81881%0.806SS**  163.8146.6118.400000112.1
386D32.3Very low30.6Very low148 Ų148147.3 Ų147.379%0.79181%0.805SS**  trans-56.6147.7-168.7-53.1-87000117.4
387L32.5Very low30.4Very low160 Ų160147.3 Ų147.384%0.83881%0.805SS**  179.1129112.3-124.464.3000113.9
388Y31.5Very low30.2Very low226 Ų226147 Ų14789%0.88681%0.81SS**  trans82.292.5142.7-123.7-101.2000121.2
389G29.8Very low30.3Very low80 Ų80145.7 Ų145.783%0.82582%0.815SS**  90.3112.9116.700000119
390G28.5Very low30.4Very low69 Ų69143.7 Ų143.771%0.71182%0.819SS**  trans145.689.7149.700000116.9
391Y32Very low30.5Very low241 Ų241144.3 Ų144.395%0.94582%0.816SS**  trans56.9117.2152.7-68.8-84.1000121
392A29.9Very low30.7Very low98 Ų98143.1 Ų143.181%0.8182%0.823SS**  trans-68.7138.2175.900000113.8
393A30Very low30.7Very low96 Ų96137.7 Ų137.779%0.79382%0.821SS**  trans-122.5114.5152.400000108.1R395A393-R395 PolarHBondContact O-N 2.82Å
394Y29Very low31Very low216 Ų216139.9 Ų139.985%0.84782%0.822SS**  trans-59.4127-179.7-109.1-100.3000111.5
395R26.8Very low31.3Very low228 Ų228141.3 Ų141.386%0.8682%0.822SS**  trans-80136159.8-75.9-112-173.4179.91.4109.2A393A393-R395 PolarHBondContact O-N 2.82Å
396Y28.1Very low31.4Very low217 Ų217141.1 Ų141.185%0.85182%0.82SS**  trans-140.496.8147.6-120-94.1000105.4
397A29.3Very low31.4Very low79 Ų79138.9 Ų138.965%0.65382%0.822SS**  6494.395.300000112
398Q30.1Very low31.5Very low193 Ų193136.2 Ų136.290%0.90282%0.824SS**PPolyproline II helixtrans-64.3146.5162.8-73.4171.5-54.100110
399P33.3Very low31.6Very low121 Ų121130.4 Ų130.479%0.78682%0.822SS**PPolyproline II helixtrans-90.1130.4147.131.6-24.6000109.6A401P399-A401 PolarHBondContact O-N 2.79Å
400A30.9Very low32.1Very low107 Ų107131.8 Ų131.888%0.88483%0.825SS**PPolyproline II helixtrans-62.9126.8168.100000110
401A32.6Very low32.6Very low94 Ų94133.1 Ų133.178%0.77783%0.83SS**  trans-133.2119.9160.600000108.3P399 A403P399-A401 PolarHBondContact O-N 2.79Å; A401-A403 PolarHBondContact O-N 2.74Å
402V33.8Very low33.1Very low150 Ų150126.8 Ų126.891%0.90983%0.827SS**  trans-55.4115.2179.1175.40000109.6
403A34.3Very low33.5Very low95 Ų95126.9 Ų126.979%0.78583%0.828SS**  trans-103.3113.8174.200000110A401A401-A403 PolarHBondContact O-N 2.74Å
404T32.6Very low34.1Very low112 Ų112125.9 Ų125.969%0.68782%0.82SS**  trans-61.6149.1160.645.20000110.5A406T404-A406 PolarHBondContact O-N 2.8Å
405P37.2Very low34.6Very low139 Ų139124.9 Ų124.990%0.90382%0.816SS**SBendtrans-78.983.2-173.532.9-33.7000111
406A34Very low35.4Very low95 Ų95118 Ų11879%0.78580%0.803SS**SBendtrans-153.215.6172.300000114.9T404T404-A406 PolarHBondContact O-N 2.8Å
407A33.4Very low36.4Very low100 Ų100112.4 Ų112.483%0.82679%0.788SS**  trans-146.149.6-174.100000114.2
408A33.4Very low37.3Very low105 Ų105113.7 Ų113.787%0.86879%0.792SS**  trans-130.265.1172.100000110.9
409A35.4Very low37.9Very low104 Ų104114.5 Ų114.586%0.8679%0.788SS**SBendtrans-159.938.5169.400000113.3
410A39.5Very low38.5Very low108 Ų108111.8 Ų111.889%0.89378%0.782SS**  trans-145.940.4-177.600000115
411A38.3Very low39.7Very low98 Ų98115.4 Ų115.481%0.8177%0.773SS**SBendtrans-139.9129.1165.200000110.7
412A43.9Very low40.4Very low107 Ų107115.8 Ų115.888%0.88477%0.765SS**  trans82.766.5177.900000117.2
413A36.8Very low40.9Very low100 Ų100117.9 Ų117.983%0.82676%0.758SS**  trans-101.591.314900000108.7Y415A413-Y415 PolarHBondContact O-N 2.87Å
414A42.6Very low41.6Very low76 Ų76119.7 Ų119.763%0.62876%0.759SS**  trans-72.4107.9161.100000107S416 V422A414-S416 PolarHBondContact O-N 2.8Å; A414-V422 HydrophobicContact CB-CG1 4.41Å
415Y40.9Very low42.1Very low195 Ų195119.4 Ų119.477%0.76577%0.768SS**  trans-79.5112.6177-158.4-93.3000108.7A413A413-Y415 PolarHBondContact O-N 2.87Å
416S43.1Very low42.1Very low82 Ų82119.2 Ų119.257%0.57376%0.76SS**BIsolated β-bridgetrans-96.6122168.8600000109.3A414A414-S416 PolarHBondContact O-N 2.8Å
417D49Very low42.8Very low100 Ų100119.8 Ų119.854%0.53576%0.755SS.*  trans-77.3157.4167.2-170.315.4000110.4Y419 G420D417-Y419 PolarHBondContact O-N 2.85Å; D417-G420 PolarHBondContact O-N 2.89Å
418S48.7Very low43Very low106 Ų106124.8 Ų124.874%0.74175%0.754SS**THydrogen-bonded Turntrans-54.32.7-177590000116.9
419Y42.9Very low43.3Very low211 Ų211129.3 Ų129.383%0.82776%0.757SS**THydrogen-bonded Turntrans-119.514.6172.3-88.8-90.2000114.2D417D417-Y419 PolarHBondContact O-N 2.85Å
420G45.7Very low43.3Very low63 Ų63128.9 Ų128.965%0.64975%0.754SS**  trans77.929.316500000116.2D417D417-G420 PolarHBondContact O-N 2.89Å
421R55.1Low43.1Very low184 Ų184128.8 Ų128.869%0.69475%0.752SS**  trans-102.1130.5174.1-61.4-65.2-175.7173.7-0.7110.8Y423R421-Y423 HydrophobicContact CB-CE2 4.45Å
422V47.3Very low42.8Very low101 Ų101132.6 Ų132.661%0.61276%0.758SS**BIsolated β-bridgetrans-108.1124.6176.4-178.70000108.2A414A414-V422 HydrophobicContact CB-CG1 4.41Å
423Y44.3Very low42.3Very low195 Ų195131.6 Ų131.677%0.76575%0.75SS**PPolyproline II helixtrans-104125170.3-68.4-84.1000109.5R421R421-Y423 HydrophobicContact CB-CE2 4.45Å
424T49Very low42.5Very low133 Ų133133.3 Ų133.382%0.81675%0.752SS**PPolyproline II helixtrans-80.2134.7168.751.20000109.3
425A43.5Very low42Very low105 Ų105134.5 Ų134.587%0.86876%0.762SS**PPolyproline II helixtrans-58.8139.2-179.300000112.8
426D37.6Very low41.6Very low136 Ų136129.1 Ų129.173%0.72776%0.759SS**PPolyproline II helixtrans-79.1147.3-177.8-152.822.7000111.7Y428D426-Y428 PolarHBondContact O-N 3.38Å; D426-Y428 VanDerWaalsContact O-N 3.16Å
427P49.7Very low41.1Very low107 Ų107136.7 Ų136.770%0.69578%0.776SS**SBendtrans-93.954.2-163.539.2-33.1000113.2
428Y36.5Very low40.2Very low204 Ų204135.7 Ų135.780%0.879%0.79SS**  trans-135.338.8-178.1-83-79.7000114.8D426D426-Y428 PolarHBondContact O-N 3.38Å; D426-Y428 VanDerWaalsContact O-N 3.16Å
429H38.9Very low39.4Very low201 Ų201137.9 Ų137.993%0.93180%0.798SS**  trans-109.679163.8-91.2-76.2000110.8
430A36.5Very low38.9Very low95 Ų95131.3 Ų131.379%0.78579%0.794SS**  trans-98.9115.7158.200000108.3L432A430-L432 PolarHBondContact O-N 3.21Å
431A34.7Very low38.5Very low105 Ų105133.2 Ų133.287%0.86880%0.804SS**  trans-61.1126.2171.800000110.3
432L32.8Very low37.7Very low179 Ų179133.8 Ų133.894%0.93782%0.817SS**  trans-80.3113.3166.6-89.7156.3000108.9A430A430-L432 PolarHBondContact O-N 3.21Å
433A33.9Very low37.3Very low85 Ų85133.6 Ų133.670%0.70283%0.826SS**  trans-85.1150.1161.500000109.7
434P41Very low37.2Very low136 Ų136130.8 Ų130.888%0.88383%0.829SS**  trans-82.4121.9-176.432.1-31000110.8
435A32.1Very low36.8Very low101 Ų101133 Ų13384%0.83584%0.835SS**  trans-134.2130.6166.800000110
436A32.5Very low36.3Very low83 Ų83138.6 Ų138.669%0.68684%0.835SS**  trans-75.5167.1-178.400000113.2
437Y32.5Very low36.3Very low241 Ų241143.8 Ų143.895%0.94585%0.845SS**  trans82.4131166.4-69.4-88.4000118.9
438G29.6Very low35.5Very low79 Ų79141.4 Ų141.481%0.81484%0.84SS**  trans142.1105.9147.400000116.3
439V31.2Very low35.4Very low151 Ų151134.8 Ų134.892%0.91583%0.833SS**  trans-71.1137.7175.1170.20000112
440G32.7Very low35.3Very low73 Ų73136.3 Ų136.375%0.75383%0.832SS**  trans69.4112.414100000120.1
441A37.2Very low35.5Very low103 Ų103137.8 Ų137.885%0.85184%0.837SS**  trans-168117.2137.300000110.6
442M37.7Very low36Very low197 Ų197143.9 Ų143.997%0.9784%0.838SS**  trans-74.3128.1162.5-75.7-77.4155.900108.9
443A38.9Very low36.6Very low96 Ų96145.6 Ų145.679%0.79384%0.838SS**  trans-140.798.3163.600000109.5
444T42.7Very low36.8Very low136 Ų136146.1 Ų146.183%0.83484%0.842SS**  trans-52.8129.2158.632.30000110.4
445L40.7Very low37.7Very low179 Ų179145.1 Ų145.194%0.93784%0.836SS**  trans-141.7100.4149.3-132.880.1000110.3
446Y33.6Very low38.1Very low224 Ų224155 Ų15588%0.87885%0.853SS**  trans-67.2126.7168.6-159.7-97.6000109
447R37Very low38.4Very low245 Ų245158.6 Ų158.693%0.92586%0.862SS**  trans-139.784.4156.9-159.9172.8-160.8-159.24109.8
448G33.5Very low38.7Very low57 Ų57154.2 Ų154.259%0.58886%0.857SS**  trans-65.6167.1154.300000110
449G33.8Very low39.2Very low65 Ų65158.4 Ų158.467%0.6786%0.86SS**  cis175.5168.24.100000106.8
450Y36.8Very low39.7Very low232 Ų232158.8 Ų158.891%0.9186%0.856SS**  trans-177.890.2144.1-109.4-77.6000108.1
451S41.3Very low40.1Very low127 Ų127164.2 Ų164.289%0.88886%0.863SS**  trans-99.3120.3163.9-60.20000107.5
452R43.8Very low40.3Very low232 Ų232168.3 Ų168.388%0.87586%0.864SS**  trans-100.398.6-176.6-160.9-167-56-147.53.9108.8
453F45.3Very low40.5Very low216 Ų216166.2 Ų166.295%0.94786%0.856SS**  trans-146.9118.9161-100-82.3000108.2
454A39.2Very low40.6Very low95 Ų95171.6 Ų171.679%0.78586%0.861SS**  trans-120.7137.316900000107.8
455P58.9Low40.4Very low115 Ų115174.6 Ų174.675%0.74786%0.863SS**  trans-93.6137.9170.834.7-27.7000110.4
456Y41.1Very low40.4Very low308 Ų308174.2 Ų174.2100%1.20886%0.856SS**  trans-162.40137.8-102.6-71.1000109

Retrieved 456 of 456 residues in 556.5 ms (Link to these results)