A0A096MY32_PAPAN Loading...

T-box brain transcription factor 1

AlphaFold DB (Q16650), UniProt , Accession A0A096MY32, Species PAPAN (Papio anubis, Olive baboon), Gene TBR1, Length 682 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
1M40.5Very low39.2Very low250 Ų250147.8 Ų147.8100%1.23281%0.808SS**  0141.60-68.1178.1-114.700107.7
2Q33.5Very low38.9Very low169 Ų169149.3 Ų149.379%0.7981%0.809SS**  trans-101.2145.3178.5-67.9160.5-93.500110.4
3L39.7Very low38.9Very low166 Ų166148.2 Ų148.287%0.86980%0.801SS**  trans-159.3109.2141.9-111.9124.3000104.8
4E37.2Very low38.7Very low126 Ų126145.1 Ų145.159%0.58980%0.796SS**  57.995.271.7-62.2-60124.100110.6
5H39.9Very low38.8Very low139 Ų139148.3 Ų148.364%0.64480%0.799SS**  90.911280.1-105.6-82.3000112.6
6C42.1Very low38.8Very low134 Ų134151 Ų15191%0.90580%0.801SS**  trans-145.8104.7161.5-88.90000108.3
7L39.2Very low38.4Very low154 Ų154153.4 Ų153.481%0.80680%0.803SS**  trans-105.9134.1170.8-71.9168.3000108
8S37.5Very low38.3Very low118 Ų118154 Ų15483%0.82581%0.807SS**  trans-104.2136.2174.8-1650000110.1
9P42.6Very low37.9Very low115 Ų115152.8 Ų152.875%0.74780%0.801SS**PPolyproline II helixtrans-77.5154.9-170.931-35.9000113.6
10S36Very low37.8Very low96 Ų96152 Ų15267%0.67180%0.803SS**PPolyproline II helixtrans-81.1131.1174.3-64.30000111.9
11I42.7Very low37.4Very low159 Ų159149.4 Ų149.482%0.81580%0.797SS**PPolyproline II helixtrans-83.5118.2172.3-61.1175.7000109.3
12M36.6Very low37Very low166 Ų166143.3 Ų143.382%0.81878%0.779SS**  trans-90.9102.9172.8-73.8-146.8-59.700111.7S14M12-S14 PolarHBondContact O-N 3.42Å; M12-S14 VanDerWaalsContact O-N 3.17Å
13L38.5Very low37.1Very low135 Ų135140.2 Ų140.271%0.70778%0.776SS**  trans-77.796.9170.7-91.3161.7000111.5
14S35.8Very low36.7Very low104 Ų104143.4 Ų143.473%0.72778%0.778SS**  trans-96116.8163.7-70.20000110.1M12M12-S14 PolarHBondContact O-N 3.42Å; M12-S14 VanDerWaalsContact O-N 3.17Å
15K39.9Very low37.2Very low194 Ų194143.2 Ų143.284%0.84379%0.787SS**  trans-123.7110.4163.3-80.8-175.2176.8173.10110.6
16K39.2Very low37Very low191 Ų191145.7 Ų145.783%0.8380%0.799SS**  trans-86.8128.6169.7-81.2-178.4179.4176.90108.9
17F32.9Very low37Very low191 Ų191145.1 Ų145.184%0.83880%0.797SS**  trans61.5150.7139-80-81.9000122.8
18L35.5Very low36.7Very low165 Ų165141.7 Ų141.786%0.86480%0.799SS**  trans92.3140.1149.3-78.6158.7000120.2
19N30.3Very low36.9Very low131 Ų131139.9 Ų139.970%0.70180%0.798SS**  trans-118.3129.4-170.6164.624.4000107.1
20V36Very low36.8Very low137 Ų137139.7 Ų139.783%0.8380%0.8SS**  trans-141.5138.9169.4-176.20000108.2
21S29.1Very low36.8Very low98 Ų98142.7 Ų142.769%0.68580%0.803SS**  trans-124.9161.3179.6-68.70000111
22S33.7Very low36.8Very low121 Ų121142.9 Ų142.985%0.84681%0.805SS**  trans72.2141.1176.9-134.60000114.2
23S35.3Very low36.7Very low104 Ų104141.2 Ų141.273%0.72780%0.804SS**  cis-157.7160.510.346.10000111.4
24Y30.6Very low36.9Very low233 Ų233142.4 Ų142.491%0.91481%0.81SS**  trans-102.4153.1169.1-80.4-86.6000112.6
25P48.3Very low37.2Very low122 Ų122145.8 Ų145.879%0.79281%0.814SS**  trans-115.8176.5138.836.3-29.1000111.9
26H35Very low36.9Very low192 Ų192143.3 Ų143.389%0.88981%0.81SS**  trans-137.6125.5-153.9-171.375000114
27S41.9Very low36.8Very low122 Ų122143 Ų14385%0.85381%0.811SS**  trans-171.8139.5166.8560000109.3
28G34.3Very low37Very low82 Ų82139.5 Ų139.585%0.84581%0.807SS**  cis154.1111.3-4.100000109.9
29G41.2Very low37.1Very low80 Ų80138.9 Ų138.983%0.82580%0.804SS**  trans-175.1127.7-176.900000115.3
30S40.3Very low37.2Very low111 Ų111140 Ų14078%0.77681%0.808SS**  trans-55.2163.2164.7-87.50000113.4
31E36.5Very low37Very low158 Ų158138.2 Ų138.274%0.73880%0.801SS**  cis-178.3145.1-6.6161.6-179.9165.100108.8
32L41.6Very low37.3Very low164 Ų164139.1 Ų139.186%0.85980%0.803SS**  trans172.9156.2139.5-95.5166.9000110.6
33V35.8Very low37.5Very low131 Ų131139.4 Ų139.479%0.79480%0.8SS**  trans-120.6133.6-163.6175.70000112.5
34L42.7Very low37.5Very low159 Ų159141.6 Ų141.683%0.83280%0.803SS**  trans-157.9115.7153.5-125.3148.5000114.1
35H41.3Very low37.7Very low176 Ų176137.8 Ų137.882%0.81580%0.799SS**  trans35.2132.6165.8-69.4-32.6000124.5
36D33.8Very low37.1Very low142 Ų142138.8 Ų138.876%0.75980%0.797SS**  trans-62.9141.9167.8-74.7-78.5000115.6
37H37.2Very low37.1Very low185 Ų185138.5 Ų138.586%0.85680%0.796SS**  trans-149.4116.5135.6-83.3-24.4000109.9I39H37-I39 PolarHBondContact O-N 3.22Å
38P37.1Very low37Very low116 Ų116142.8 Ų142.875%0.75379%0.793SS**  trans-83.1113-177.631-33.3000112.4
39I37.2Very low37.1Very low153 Ų153144.1 Ų144.179%0.78579%0.79SS**  trans-95.2113.6166.4-62179.7000108.8H37 S41H37-I39 PolarHBondContact O-N 3.22Å; I39-S41 PolarHBondContact O-N 3.15Å
40I33Very low36.8Very low153 Ų153146.2 Ų146.279%0.78579%0.792SS**  trans-71.4112.4179-62.2174.9000109.5T42I40-T42 HydrophobicContact CG2-CG2 4.08Å
41S31.9Very low36.8Very low100 Ų100146.1 Ų146.170%0.69979%0.788SS**  trans-99.7103.6170.5-660000110.4I39 T43I39-S41 PolarHBondContact O-N 3.15Å; S41-T43 PolarHBondContact O-N 3.14Å
42T35.4Very low36.6Very low118 Ų118146.2 Ų146.272%0.72479%0.793SS**  trans-82.796.1175.453.50000111.4I40I40-T42 HydrophobicContact CG2-CG2 4.08Å
43T36.7Very low36.6Very low127 Ų127148.7 Ų148.778%0.77980%0.797SS**  trans-122.271.1167.655.10000110.3S41 N45S41-T43 PolarHBondContact O-N 3.14Å; T43-N45 PolarHBondContact O-N 3.27Å; T43-N45 VanDerWaalsContact O-N 3.14Å
44D34.9Very low36.9Very low149 Ų149151 Ų15180%0.79780%0.797SS**  trans-72.9102.3174.4-81.2-53.2000111
45N35.3Very low36.9Very low153 Ų153151.5 Ų151.582%0.81880%0.798SS**  trans-10788.5166.4-170.610.7000108.4T43T43-N45 PolarHBondContact O-N 3.27Å; T43-N45 VanDerWaalsContact O-N 3.14Å
46L36.7Very low36.8Very low143 Ų143148.1 Ų148.175%0.74979%0.79SS**  trans-107.677.2-169.7-165.672.4000112.7R48L46-R48 PolarHBondContact O-N 2.98Å; L46-R48 VanDerWaalsContact O-N 3.15Å
47E35Very low37.5Very low187 Ų187153.1 Ų153.187%0.87480%0.798SS**  trans-69.3100.2153.5-75.6-164.6105.200109.4
48R38.8Very low37.5Very low212 Ų212147.7 Ų147.780%0.879%0.792SS**  trans-144.7130.3158.7-171.4159.4-75.4-135.5-0.4112.4L46L46-R48 PolarHBondContact O-N 2.98Å; L46-R48 VanDerWaalsContact O-N 3.15Å
49S36.8Very low37.9Very low110 Ų110151.2 Ų151.277%0.76980%0.801SS**  trans-69.1143.7175.241.50000112.6
50S34.4Very low38.3Very low124 Ų124149.7 Ų149.787%0.86780%0.799SS**  trans-104.9117179-67.60000111.8
51P40.5Very low38.9Very low108 Ų108148.1 Ų148.170%0.70179%0.792SS**  trans-98141173.134.8-30.8000113.4
52L31.8Very low39.4Very low161 Ų161150.9 Ų150.984%0.84379%0.794SS**  trans42126.6157.4-70.989.4000120.8
53K41.3Very low39.7Very low216 Ų216149.7 Ų149.794%0.93979%0.79SS**  -145.7121.3125.6-113.4165-172173.20110.7
54K42.8Very low40.4Very low180 Ų180149.7 Ų149.778%0.78379%0.785SS**  trans-102.4125.3-179.3-180178.8179.1178.50109
55I43.9Very low40.9Very low169 Ų169148.1 Ų148.187%0.86778%0.781SS**  trans-95.7130.8169.7-68.5177.1000108.4
56T39.1Very low41.6Very low105 Ų105147 Ų14764%0.64478%0.775SS**  trans-124.2131.3175.6-56.90000108.5
57R47.6Very low42.2Very low247 Ų247146 Ų14693%0.93277%0.77SS**  trans-123136.4154.3-87.9-175.3169.1179.1-3.4107
58G37.1Very low42.8Very low70 Ų70146 Ų14672%0.72277%0.768SS**  trans-138.2153.2175.900000110.3
59M46Very low43.6Very low191 Ų191140.6 Ų140.694%0.94176%0.761SS**  trans-139.6147.1167.8-68.9-176.167.300107.9
60T45.9Very low43.9Very low121 Ų121142.1 Ų142.174%0.74276%0.76SS**  trans-103171.5-176.7580000109.7
61N44.1Very low44.4Very low120 Ų120141 Ų14164%0.64275%0.752SS**  cis-158.4156.433.4-96-51.5000112.2
62Q42.7Very low44.8Very low158 Ų158143.2 Ų143.274%0.73875%0.751SS**  trans32.1115.7132.9-59.9172.986.900119.2
63S42.8Very low45.4Very low92 Ų92141.2 Ų141.264%0.64374%0.741SS**  90153.286.880.70000112.7
64D50.7Low45.7Very low128 Ų128135.9 Ų135.968%0.68473%0.731SS**  cis-145.413516.3-72-77.5000110.9
65T45.8Very low46Very low115 Ų115133.8 Ų133.871%0.70674%0.735SS**  82.4150.9105.176.10000120.3
66D49.5Very low46.1Very low129 Ų129129.2 Ų129.269%0.6973%0.73SS**  trans75.1149.8163.1-61.1-62.2000122.1
67N49.5Very low46.2Very low122 Ų122132 Ų13265%0.65274%0.741SS**  cis-169.5122.3-47.9-114.4-17.6000113
68F46.8Very low46Very low187 Ų187125.5 Ų125.582%0.8273%0.729SS**  trans61.5169.6149.2-79.4-113.5000119.9
69P56.2Low46.2Very low100 Ų100130.2 Ų130.265%0.64973%0.732SS**  -144.4174.9-52.842.2-25.5000118
70D42.9Very low46Very low142 Ų142131.4 Ų131.476%0.75973%0.726SS**  trans95.7140.1134.5-123.7-55.8000124.4
71S46.3Very low45.7Very low99 Ų99130 Ų13069%0.69272%0.721SS**  trans67.1146.2152.5-78.20000120
72K47.6Very low45.8Very low156 Ų156133.4 Ų133.468%0.67873%0.73SS**  cis-163.6159.62.1-143.5179.8161.5-70.90111.9
73D44.7Very low46Very low119 Ų119133.3 Ų133.364%0.63673%0.734SS**  trans59163.2158.8-57.3-34.1000119.1
74S48.4Very low45.6Very low104 Ų104134.3 Ų134.373%0.72774%0.741SS**  cis-162.9156.1-33.9-920000108.7
75P48.7Very low45.5Very low135 Ų135133.7 Ų133.788%0.87774%0.744SS**  trans-98159.8-172.137.3-35.7000115.8
76G45.9Very low45.3Very low73 Ų73134.4 Ų134.475%0.75375%0.748SS**  trans-172.4102.717200000117.7
77D41.5Very low44.9Very low165 Ų165135 Ų13588%0.88275%0.751SS**  48.6170.1128.6-142.6-8.1000123.8
78V43.2Very low44.4Very low110 Ų110136.7 Ų136.767%0.66776%0.76SS**  trans86.587.6163.1-165.90000119.6
79Q41.2Very low44Very low169 Ų169131.5 Ų131.579%0.7976%0.758SS**  57.4134.3115.8-154.5-176.278.300121.7
80R41.4Very low43.3Very low215 Ų215133.5 Ų133.581%0.81177%0.769SS**  148.8103.1112.6-162.7171.3-151.2-138.66.7118.5
81S41Very low43Very low93 Ų93132.2 Ų132.265%0.6577%0.771SS**  trans67.9135.7137.3-58.80000125
82K44.8Very low42.6Very low191 Ų191136.1 Ų136.183%0.8378%0.778SS**  trans68.8139.5142.4-71.6176.5178.4-173.10117.2
83L46.8Very low42.2Very low155 Ų155135.3 Ų135.381%0.81278%0.78SS**  cis-143.6163.320.4-67.7168.9000112.7
84S35.2Very low41.8Very low114 Ų114140.3 Ų140.380%0.79779%0.79SS**  trans-117152155.3-51.80000108.6
85P48.3Very low41.3Very low115 Ų115144.5 Ų144.575%0.74780%0.798SS**  -150.3138.593.142.5-25.4000114.4
86V40.6Very low40.6Very low130 Ų130143.5 Ų143.579%0.78879%0.794SS**  100.2144.983.4164.70000114.6
87L42.5Very low40.2Very low142 Ų142149.9 Ų149.974%0.74380%0.801SS**  trans83.8107.5168.2-79.7162.8000121
88D38.3Very low39.9Very low157 Ų157149.9 Ų149.984%0.8480%0.802SS**  trans53.9119133.3-60.84.2000123.6
89G39.3Very low39.5Very low77 Ų77147.8 Ų147.879%0.79480%0.802SS**  trans-179.5130.4163.200000110.1
90V40.8Very low39.6Very low143 Ų143145.6 Ų145.687%0.86781%0.805SS**  trans-99.8123.8-164.9178.10000113.7
91S36.7Very low39.6Very low115 Ų115139.6 Ų139.680%0.80480%0.802SS**  trans38.4111.8155-55.80000120.5
92E36.8Very low39.4Very low181 Ų181140 Ų14085%0.84681%0.811SS**  trans-103.9169.3163.5-89.8-156.9114.100113.9
93L39.6Very low39.4Very low139 Ų139138.6 Ų138.673%0.72881%0.812SS**  trans61.292.5156-99.262.8000120.6
94R36Very low39.1Very low224 Ų224141 Ų14185%0.84581%0.811SS**  12.8135.8123.2-56178.8179.3-161.7-0.9118.4
95H38Very low38.9Very low191 Ų191145.4 Ų145.488%0.88481%0.811SS**  -152.9160.2117.4-98.4-66.5000110.5
96S33.7Very low38.5Very low114 Ų114148.5 Ų148.580%0.79782%0.821SS**  trans-108.7143.6-158.7-44.30000114.2
97F38.1Very low38.3Very low207 Ų207150 Ų15091%0.90882%0.823SS**  trans-154.4108.5147.1-157.3-88.7000111.3
98D35.3Very low38Very low166 Ų166148.5 Ų148.589%0.88883%0.825SS**  trans-150.3147.2160.2-164.4-0.4000107.7
99G35.6Very low37.9Very low65 Ų65149.9 Ų149.967%0.6783%0.826SS**  trans166.5100-173.300000116.2
100S42.9Very low38Very low123 Ų123151.4 Ų151.486%0.8683%0.825SS**  trans-149.8117.8133.1-170.60000108.3
101A40.2Very low38.1Very low89 Ų89149.7 Ų149.774%0.73682%0.819SS**  trans-81161.8-175.100000112.5
102A37.1Very low38Very low102 Ų102153 Ų15384%0.84382%0.822SS**  trans-108.4107167.800000109.2
103D45Very low38.2Very low161 Ų161148.8 Ų148.886%0.86181%0.81SS**  trans-78.6135178.7-81.2-51.6000112.5
104R41.8Very low38.2Very low206 Ų206150.4 Ų150.478%0.77781%0.814SS**  trans-148.1115.5165.4-117.3-163.6-66.5176.30.6111.3
105Y31.2Very low38.6Very low207 Ų207144.6 Ų144.681%0.81281%0.808SS**  trans63.6119.9167.5-49.9-66.4000118.3
106L39.2Very low38.8Very low180 Ų180140.4 Ų140.494%0.94281%0.806SS**  -157.1167.4111.6-105.8167.8000110.4
107L35.5Very low39.5Very low160 Ų160139.1 Ų139.184%0.83880%0.802SS**  trans-117.3133.2-162.1-172.580.1000112.3
108S37.6Very low39.7Very low112 Ų112136.2 Ų136.278%0.78380%0.801SS**  trans-161.3143.6156.8-169.70000111.4
109Q35.6Very low40.5Very low185 Ų185132.2 Ų132.286%0.86479%0.792SS**  trans-136.5147.6172.2-74.3-171.7200110.1
110S41.8Very low41Very low109 Ų109135.3 Ų135.376%0.76280%0.8SS**  trans-158141.7160.241.20000113.7
111S41.7Very low40.8Very low107 Ų107135.1 Ų135.175%0.74880%0.799SS**  trans49.398.6155.6510000121.7
112Q34.7Very low41.1Very low186 Ų186135.9 Ų135.987%0.86981%0.805SS**  21.4161.8105.4-95.5-158.3500121.2
113P41.7Very low41.3Very low91 Ų91138.9 Ų138.959%0.59180%0.804SS**  cis-148.4178.53643.8-23.8000120.2
114Q39.4Very low41.5Very low174 Ų174140.9 Ų140.981%0.81381%0.805SS**  trans70.4148.6149.6-80.7164.416.300119.8
115S44.2Very low41.8Very low102 Ų102136 Ų13671%0.71380%0.8SS**  cis-155153.78.4-106.80000113.8
116A43.3Very low42.4Very low103 Ų103136.5 Ų136.585%0.85180%0.802SS**  trans57.1133.3159.400000119.4
117A46.9Very low43Very low87 Ų87133.3 Ų133.372%0.71979%0.792SS**  cis-160-167.8-3.700000107.9
118T43.9Very low43.4Very low145 Ų145129.3 Ų129.389%0.8979%0.79SS**  cis-152.9-15415.2-290000111.4
119A50.8Low43.8Very low83 Ų83133.4 Ų133.469%0.68680%0.796SS**  trans-102.1176-17000000114.6
120P46.5Very low44.3Very low129 Ų129133.9 Ų133.984%0.83880%0.798SS**  cis-134.6178.5-28.429.4-8.4000115.2
121S38.7Very low44.4Very low120 Ų120132.3 Ų132.384%0.83980%0.799SS**  trans-83.1160.6-174.2-35.80000117.2
122A46.4Very low44.8Very low104 Ų104133.2 Ų133.286%0.8680%0.803SS**  trans-150143.5143.500000111.5
123M42.4Very low45Very low166 Ų166128.3 Ų128.382%0.81879%0.794SS**  trans-96.5160.8-177.5-57.8172.1177.900112.1
124F47.8Very low45.1Very low203 Ų203132.5 Ų132.589%0.8981%0.805SS**  168134.7125.4-88.4-59.9000112.6
125P49.3Very low45.4Very low104 Ų104129.2 Ų129.268%0.67580%0.799SS**  trans-123.9178.4174.937.3-23.4000115.9
126Y43.1Very low44.9Very low217 Ų217129 Ų12985%0.85180%0.803SS**  trans75.9159.4174.4-74-89000117.2
127P52.8Low44.8Very low112 Ų112133.3 Ų133.373%0.72780%0.803SS**  -143.7157.2-59.938.9-21000117.7
128G42.9Very low44.2Very low77 Ų77135 Ų13579%0.79481%0.809SS**  64.2138.9124.100000123.6
129Q45.8Very low44.2Very low198 Ų198135.4 Ų135.493%0.92580%0.804SS**  trans-150.4165.7146.5-115.9-175.516.500111.7
130H47.1Very low43.6Very low195 Ų195134.7 Ų134.790%0.90381%0.805SS**  trans-110159.5-169-67-118000113.1
131G42.7Very low43.2Very low76 Ų76134.4 Ų134.478%0.78481%0.806SS**  trans160.9105.516000000116.5
132P49.5Very low43.5Very low126 Ų126134.2 Ų134.282%0.81880%0.802SS**  trans-114.4152.5174.938.5-29.6000114.2
133A40.9Very low43.1Very low83 Ų83134.1 Ų134.169%0.68680%0.795SS**  trans170.3117143.300000116
134H43Very low42.9Very low179 Ų179136.9 Ų136.983%0.82980%0.796SS**  trans58.6-178.2142.8-52.2-57.3000119.4
135P44.8Very low42.9Very low105 Ų105138.7 Ų138.768%0.68280%0.799SS**  -133.8171.6-78.241.9-27.3000116.3
136A34.9Very low42.4Very low96 Ų96142.3 Ų142.379%0.79381%0.809SS**  trans27.3117.915200000120.8
137F41Very low42.3Very low195 Ų195135.5 Ų135.586%0.85580%0.797SS**  trans-106.3121.1162.8-77.9-81.4000112.3
138S34.3Very low41.8Very low121 Ų121139.2 Ų139.285%0.84680%0.804SS**  trans-125105.3162.7-72.90000108.7
139I43Very low41.5Very low155 Ų155143.7 Ų143.780%0.79580%0.804SS**  trans-132.7119.9170.9-61.8-179.5000107.5
140G37.8Very low41.6Very low67 Ų67139.6 Ų139.669%0.69180%0.795SS**  trans-105.4159.6173.400000111.5
141S39.6Very low41.3Very low123 Ų123136 Ų13686%0.8679%0.786SS**  trans-154.8156162-85.30000111.2
142P44.1Very low41.3Very low117 Ų117140.4 Ų140.476%0.7679%0.791SS**  trans-119.8-173.5-159.342.6-30.5000114.7
143S38.7Very low40.8Very low101 Ų101139.3 Ų139.371%0.70678%0.782SS**  trans96.1115.8176.2-46.50000113
144R38.4Very low40.9Very low225 Ų225142.2 Ų142.285%0.84979%0.786SS**  75.296.260.7-74.9-156.5-77.4-143.2-2.1113.9
145Y46.5Very low40.7Very low241 Ų241137.2 Ų137.295%0.94578%0.782SS**  trans-126.1159.9138.4-87.9-85.5000108.6
146M40.2Very low40.4Very low180 Ų180136.1 Ų136.189%0.88778%0.782SS**  trans-148169.5-165.2-127.6-173168.600112.8
147A40.6Very low40.6Very low74 Ų74141 Ų14161%0.61278%0.781SS**  trans82.6150.2165.700000116.8
148H41.4Very low40.4Very low189 Ų189138.6 Ų138.688%0.87578%0.778SS**  cis-128.3160.811.5-77.5-95.6000115.3
149H37Very low40.5Very low171 Ų171137 Ų13779%0.79277%0.767SS**  trans-86.8-168.1169.7-81.3-74.3000110.6
150P49Very low40.4Very low113 Ų113136.8 Ų136.873%0.73477%0.766SS**  cis-141.9149.315.639.2-15.3000118.9
151V39.8Very low40.6Very low118 Ų118140.9 Ų140.972%0.71577%0.772SS**  84.4132.691.5179.20000117.3
152I42.6Very low40.4Very low170 Ų170139.8 Ų139.887%0.87276%0.764SS**  trans-176.8164.2132.9-92.1161.8000109.5
153T39.3Very low39.9Very low103 Ų103141.2 Ų141.263%0.63277%0.765SS**  -143.8175.8-120.21780000117.2
154N42.1Very low39.9Very low144 Ų144141.3 Ų141.377%0.7777%0.766SS**  trans93.6133.1166-50.9-11.3000116.8
155G39.5Very low39.8Very low73 Ų73135.8 Ų135.875%0.75376%0.762SS**  cis105.8137.3-5.300000114.9
156A38.9Very low40.3Very low83 Ų83129.6 Ų129.669%0.68675%0.751SS**  cis-146.3-140.7-6.500000109.7
157Y38.2Very low40.4Very low197 Ų197130.7 Ų130.777%0.77375%0.754SS**  cis-163160.114.5-56.9-103000111.9
158N37.7Very low40.2Very low146 Ų146130 Ų13078%0.78175%0.754SS**  trans44.8152.2134.3-64.2-5.7000123.9
159S37.1Very low40.4Very low88 Ų88132.4 Ų132.462%0.61576%0.757SS**  cis-167.5146.63.2-1140000116.1
160L40.9Very low41.1Very low149 Ų149130.2 Ų130.278%0.7876%0.758SS**  trans68.9153.3135.8-64168.6000125.6
161L41.3Very low40.9Very low154 Ų154131.8 Ų131.881%0.80677%0.766SS**  trans71.7156.5164-47.9-171.6000119.5
162S35.2Very low41.3Very low99 Ų99130.6 Ų130.669%0.69277%0.769SS**  169.1138.2-7059.20000111.8
163N33.9Very low41.1Very low147 Ų147125.5 Ų125.579%0.78676%0.757SS**  trans109.9145141.2-15445.6000121.7
164S39.4Very low41.5Very low104 Ų104132 Ų13273%0.72777%0.772SS**  trans71.5143.5156.742.50000122.7
165S36.1Very low41.6Very low109 Ų109130.2 Ų130.276%0.76277%0.769SS**  trans-144.3-160.217665.60000107.4
166P55.8Low41.8Very low110 Ų110137.8 Ų137.871%0.71478%0.776SS**  cis-131.3167.2-29.638.9-24.1000114.2
167Q41.8Very low42Very low203 Ų203139 Ų13995%0.94978%0.777SS**  trans170.9149.8151.7-99.9167.218.400109.1
168G38.2Very low42.3Very low61 Ų61139.1 Ų139.163%0.62978%0.784SS**  cis143.5110.9-13.700000114.1
169Y45.7Very low42.1Very low239 Ų239140.7 Ų140.794%0.93779%0.787SS**  trans-166144.9161-95-64.8000112.2
170P49.9Very low42.1Very low124 Ų124146.2 Ų146.281%0.80580%0.796SS**  trans-121.5163.9-177.641.5-31.3000116
171T45.1Very low41.8Very low147 Ų147142.7 Ų142.790%0.90280%0.796SS**  trans-158.7167.8153.7-1670000112.2
172A48.3Very low41.6Very low93 Ų93142.3 Ų142.377%0.76979%0.789SS**  trans-87.1168.5-169.500000114.3
173G39.3Very low41.7Very low62 Ų62143 Ų14364%0.63979%0.794SS**  cis129.1127.7-6.200000114.5
174Y47.5Very low41.9Very low239 Ų239146.7 Ų146.794%0.93780%0.799SS**  trans-158.7149.3161-96.2-72.1000109.7
175P44.2Very low42Very low108 Ų108150.3 Ų150.370%0.70180%0.804SS**  trans-111.2153.1-171.539.2-30.9000114.9
176Y44.1Very low41.8Very low232 Ų232148.8 Ų148.891%0.9181%0.805SS**  trans-161.9149.8138.4-123.6-93.2000109.2
177P43.4Very low40.8Very low107 Ų107148 Ų14870%0.69581%0.808SS**  trans-113.1144.2-163.737.5-27.6000115.5
178Q42.9Very low40.6Very low200 Ų200142.8 Ų142.894%0.93579%0.792SS**  -160.8154.7124.7-112.9-177.516.900111.7
179Q34.6Very low40.5Very low179 Ų179147.5 Ų147.584%0.83680%0.795SS**  trans-103.6131.4-175.7-60.6157.5-86.800110.4
180Y37.3Very low40Very low205 Ų205147 Ų14780%0.80479%0.794SS**  trans-155.595.5144.8-111.6-72.6000110H182Y180-H182 AromaticContact CD1-CE1 3.7Å; Y180-H182 AromaticContact CD1-NE2 3.45Å; Y180-H182 WeakPolarHBondContact CD1-NE2 3.29Å; Y180-H182 AromaticContact CE1-CE1 3.86Å; Y180-H182 AromaticContact CE1-NE2 3.77Å
181G33.4Very low39.2Very low75 Ų75148.1 Ų148.177%0.77379%0.788SS**  trans-92.2113.9176.500000111
182H38.4Very low39.1Very low146 Ų146149.1 Ų149.168%0.67678%0.78SS**  trans-118.397.5172.2-72.6-35.6000110.8Y180 Y184Y180-H182 AromaticContact CD1-CE1 3.7Å; Y180-H182 AromaticContact CD1-NE2 3.45Å; Y180-H182 WeakPolarHBondContact CD1-NE2 3.29Å; Y180-H182 AromaticContact CE1-CE1 3.86Å; Y180-H182 AromaticContact CE1-NE2 3.77Å; H182-Y184 PolarHBondContact O-N 2.71Å
183S35.7Very low38.2Very low112 Ų112149.1 Ų149.178%0.78378%0.775SS**  trans-71108172.551.80000110.7Q185S183-Q185 PolarHBondContact O-N 3.17Å
184Y39.3Very low38.5Very low226 Ų226151.9 Ų151.989%0.88678%0.784SS**  trans-74.689.5167-84.8-93.8000110.1H182H182-Y184 PolarHBondContact O-N 2.71Å
185Q40.3Very low38.2Very low179 Ų179145.8 Ų145.884%0.83677%0.772SS**PPolyproline II helixtrans-72.1131.1158.2-77.4-171.5-27.300109S183 A187S183-Q185 PolarHBondContact O-N 3.17Å; Q185-A187 PolarHBondContact O-N 3.24Å
186G33.2Very low38Very low77 Ų77147.5 Ų147.579%0.79477%0.771SS**PPolyproline II helixtrans-71.8118174.500000110.8
187A34.4Very low37.6Very low94 Ų94142.6 Ų142.678%0.77777%0.767SS**PPolyproline II helixtrans-87.2130173.100000110.8Q185Q185-A187 PolarHBondContact O-N 3.24Å
188P36.8Very low37.7Very low94 Ų94140.8 Ų140.861%0.6177%0.768SS**  trans-71.4-160.7155.1-10.327.6000110.4
189F36.2Very low38.1Very low159 Ų159135.3 Ų135.370%0.69775%0.745SS**  trans74.880163.9-45.9-71.5000117.3Q191F189-Q191 HydrophobicContact CB-CB 3.99Å; F189-Q191 HydrophobicContact CD1-CB 4.33Å; F189-Q191 PolarHBondContact O-N 3.34Å; F189-Q191 VanDerWaalsContact O-N 3.17Å
190Y36.7Very low39.1Very low230 Ų230130.7 Ų130.790%0.90273%0.729SS**  -73.475.1129.2-85.6-82.8000108.6
191Q31.8Very low39.9Very low146 Ų146126.9 Ų126.968%0.68273%0.729SS**  trans-94.8101.7171.3-175.5165.7-13.200108.2F189 S193F189-Q191 HydrophobicContact CB-CB 3.99Å; F189-Q191 HydrophobicContact CD1-CB 4.33Å; F189-Q191 PolarHBondContact O-N 3.34Å; F189-Q191 VanDerWaalsContact O-N 3.17Å; Q191-S193 PolarHBondContact O-N 3.48Å; Q191-S193 VanDerWaalsContact O-N 3.1Å
192F42.4Very low41.5Very low168 Ų168125.3 Ų125.374%0.73771%0.713SS**  trans-64.6108.8174.4-88.8-93.8000109.9S194F192-S194 PolarHBondContact O-N 3.5Å
193S31.4Very low43.7Very low94 Ų94124.6 Ų124.666%0.65771%0.708SS**  trans-64.4113.5162.1-60.50000108.6Q191 T195Q191-S193 PolarHBondContact O-N 3.48Å; Q191-S193 VanDerWaalsContact O-N 3.1Å; S193-T195 PolarHBondContact O-N 3.18Å
194S45.3Very low46.4Very low120 Ų120119.6 Ų119.684%0.83967%0.673SS**SBendtrans-7117.5-176.349.10000114.7F192F192-S194 PolarHBondContact O-N 3.5Å
195T39.6Very low49.1Very low110 Ų110112.2 Ų112.268%0.67565%0.647SS**  trans-138.457.4-166.448.50000112S193 P197S193-T195 PolarHBondContact O-N 3.18Å; T195-P197 VanDerWaalsContact O-CD 3.29Å; T195-P197 WeakPolarHBondContact O-CD 3.36Å
196Q40Very low51.8Low145 Ų145104.5 Ų104.568%0.67861%0.612SS**  trans-92.3102.9162.4-83.1-69.7-5.900109.8G198Q196-G198 PolarHBondContact O-N 2.94Å
197P36.2Very low54.9Low128 Ų128106.8 Ų106.883%0.83160%0.597SS**THydrogen-bonded Turntrans-73.298.2-17930.4-34000110.1T195T195-P197 VanDerWaalsContact O-CD 3.29Å; T195-P197 WeakPolarHBondContact O-CD 3.36Å
198G45.7Very low58Low70 Ų70103 Ų10372%0.72256%0.564SS**THydrogen-bonded Turntrans157.3-12.6-17400000114.3Q196 V200Q196-G198 PolarHBondContact O-N 2.94Å; G198-V200 PolarHBondContact O-N 3.22Å; G198-V200 VanDerWaalsContact O-N 3.08Å
199L51.5Low60.9Low85 Ų8599.1 Ų99.145%0.44554%0.539SS..  trans-62104.2163.6-85157.9000110.1P201 Q205L199-P201 WeakPolarHBondContact O-CD 3.14Å; L199-Q205 HydrophobicContact CD2-CG 4.27Å
200V55.6Low63.8Low82 Ų8296 Ų9650%0.49753%0.53SS..  trans-71.7118.9166.5178.90000107.7G198 K203G198-V200 PolarHBondContact O-N 3.22Å; G198-V200 VanDerWaalsContact O-N 3.08Å; V200-K203 HydrophobicContact CB-CB 4.47Å; V200-K203 HydrophobicContact CB-CD 4.09Å; V200-K203 HydrophobicContact CB-CG 4.26Å; V200-K203 HydrophobicContact CG1-CD 4.03Å; V200-K203 HydrophobicContact CG1-CG 4.12Å; V200-K203 PolarHBondContact O-N 3.03Å
201P54.3Low66.7Low125 Ų12590.4 Ų90.481%0.81251%0.507SS*.THydrogen-bonded Turntrans-55.7143178.6-25.835.8000112L199 K203L199-P201 WeakPolarHBondContact O-CD 3.14Å; P201-K203 VanDerWaalsContact C-N 3.27Å; P201-K203 PolarHBondContact O-N 3.24Å
202G67Low69.9Low42 Ų4288.2 Ų88.243%0.43351%0.506SS..THydrogen-bonded Turntrans78.7-6.7-177.100000115.7Q357G202-Q357 PolarHBondContact O-NE2 3.48Å
203K84.2Confident72.6Confident130 Ų13081.8 Ų81.857%0.56548%0.479SS*.  trans-94.1115.2173.3-66.4-166.1179.1-178.60111.2V200 P201V200-K203 HydrophobicContact CB-CB 4.47Å; V200-K203 HydrophobicContact CB-CD 4.09Å; V200-K203 HydrophobicContact CB-CG 4.26Å; V200-K203 HydrophobicContact CG1-CD 4.03Å; V200-K203 HydrophobicContact CG1-CG 4.12Å; V200-K203 PolarHBondContact O-N 3.03Å; P201-K203 VanDerWaalsContact C-N 3.27Å; P201-K203 PolarHBondContact O-N 3.24Å
204A92.8Very high75.8Confident8 Ų877.3 Ų77.37%0.06645%0.448CS..  trans-67.6138.4177.800000111.1I241 S242 L244 F359A204-I241 HydrophobicContact CB-CG2 4.37Å; A204-S242 WeakPolarHBondContact CA-O 3.45Å; A204-L244 HydrophobicContact CB-CD2 3.57Å; A204-F359 HydrophobicContact CB-CE2 4.26Å; A204-F359 HydrophobicContact CB-CZ 3.88Å; A204-F359 WeakPolarHBondContact O-CE1 3.35Å; A204-F359 VanDerWaalsContact O-CZ 3.26Å; A204-F359 WeakPolarHBondContact O-CZ 3.43Å
205Q95.9Very high78.3Confident71 Ų7174.9 Ų74.933%0.33243%0.425SS..EExtended strand (participates in β ladder)trans-105.8129.5168-67.3-178.1-2500108.4L199 Y207 I241 S242L199-Q205 HydrophobicContact CD2-CG 4.27Å; Q205-Y207 HydrophobicContact CB-CE2 4.05Å; Q205-I241 CarbonylContact O-C 3.56Å; Q205-I241 VanDerWaalsContact O-CA 3.31Å; Q205-I241 WeakPolarHBondContact O-CA 3.32Å; Q205-S242 PolarHBondContact N-O 2.92Å; Q205-S242 PolarHBondContact O-N 2.55Å
206V97.8Very high81.1Confident17 Ų1774.1 Ų74.110%0.10341%0.412CS..EExtended strand (participates in β ladder)trans-125.7128.8-176.1-179.10000110F239 I241 L337 F359 F361V206-F239 HydrophobicContact CG1-CB 4.1Å; V206-F239 HydrophobicContact CG1-CD1 3.91Å; V206-F239 HydrophobicContact CG1-CG 4.25Å; V206-I241 HydrophobicContact CG1-CG1 4.35Å; V206-I241 HydrophobicContact CG2-CD1 4.11Å; V206-I241 HydrophobicContact CG2-CG1 4.03Å; V206-I241 HydrophobicContact CG2-CG2 4.31Å; V206-L337 HydrophobicContact CG1-CD2 3.61Å; V206-L337 HydrophobicContact CG2-CD2 4.32Å; V206-F359 HydrophobicContact CB-CB 4.25Å; V206-F359 HydrophobicContact CB-CD1 3.8Å; V206-F359 HydrophobicContact CB-CD2 4.2Å; V206-F359 HydrophobicContact CB-CE1 4.24Å; V206-F359 HydrophobicContact CB-CG 3.79Å; V206-F359 HydrophobicContact CG1-CB 4.41Å; V206-F359 HydrophobicContact CG1-CG 4.4Å; V206-F359 HydrophobicContact CG2-CB 4.42Å; V206-F359 HydrophobicContact CG2-CD1 3.74Å; V206-F359 HydrophobicContact CG2-CD2 3.47Å; V206-F359 VanDerWaalsContact CG2-CD2 3.47Å; V206-F359 HydrophobicContact CG2-CE1 3.82Å; V206-F359 HydrophobicContact CG2-CE2 3.56Å; V206-F359 HydrophobicContact CG2-CG 3.58Å; V206-F359 HydrophobicContact CG2-CZ 3.75Å; V206-F361 HydrophobicContact CB-CZ 4.39Å; V206-F361 HydrophobicContact CG1-CE2 4.07Å; V206-F361 HydrophobicContact CG1-CZ 3.92Å
207Y98.1Very high83.9Confident124 Ų12467.2 Ų67.249%0.48638%0.38SS..EExtended strand (participates in β ladder)trans-116.9127.2179.6-60.6-88.9000110.2Q205 C209 F239 N240Q205-Y207 HydrophobicContact CB-CE2 4.05Å; Y207-C209 PolarHBondContact O-N 3.44Å; Y207-F239 VanDerWaalsContact O-CA 3.28Å; Y207-F239 WeakPolarHBondContact O-CA 3.35Å; Y207-N240 PolarHBondContact N-O 2.85Å; Y207-N240 PolarHBondContact O-N 3.01Å
208L98.6Very high86.9Confident14 Ų1464.4 Ų64.47%0.07336%0.355CS..EExtended strand (participates in β ladder)trans-72.9112.7173.9179.970.2000110.4R211 W214 F239 F361 E363 T364L208-R211 HydrophobicContact CB-CB 4.47Å; L208-R211 HydrophobicContact CD2-CB 4.2Å; L208-R211 HydrophobicContact CD2-CG 4.36Å; L208-R211 HydrophobicContact CG-CB 4.39Å; L208-R211 WeakPolarHBondContact O-CB 3.38Å; L208-W214 HydrophobicContact CD2-CB 4.2Å; L208-W214 HydrophobicContact CD2-CG 3.94Å; L208-F239 HydrophobicContact CD1-CD1 4.04Å; L208-F239 HydrophobicContact CD1-CE1 3.63Å; L208-F239 HydrophobicContact CD1-CZ 4.35Å; L208-F361 HydrophobicContact CB-CD1 3.75Å; L208-F361 HydrophobicContact CB-CE1 3.82Å; L208-F361 HydrophobicContact CB-CG 4.17Å; L208-F361 HydrophobicContact CB-CZ 4.28Å; L208-F361 HydrophobicContact CD2-CB 4.29Å; L208-F361 HydrophobicContact CD2-CD1 4.43Å; L208-F361 HydrophobicContact CD2-CG 4.42Å; L208-E363 HydrophobicContact CD2-CG 3.91Å; L208-E363 WeakPolarHBondContact CD2-OE1 3.45Å; L208-T364 HydrophobicContact CD1-CG2 3.95Å; L208-T364 HydrophobicContact CD2-CG2 3.53Å; L208-T364 HydrophobicContact CG-CG2 4.43Å
209C98.2Very high89.4Confident14 Ų1470.9 Ų70.910%0.09536%0.358CS..THydrogen-bonded Turntrans-69.9150.4173.5-660000110.7Y207 R211 S238 E303Y207-C209 PolarHBondContact O-N 3.44Å; C209-R211 PolarHBondContact O-N 3.34Å; C209-R211 VanDerWaalsContact O-N 3.15Å; C209-S238 WeakPolarHBondContact CB-O 3.15Å; C209-S238 PolarHBondContact N-O 2.95Å; C209-E303 HydrophobicContact CB-CG 4.24Å; C209-E303 WeakPolarHBondContact CB-OE2 3.29Å; C209-E303 PolarHBondContact SG-OE2 3.49Å
210N96.9Very high91.6Very high92 Ų9270.2 Ų70.249%0.49235%0.353SS..THydrogen-bonded Turntrans55.624.8-174.3-61.3-59.4000114.9P212 L213 W214N210-P212 VanDerWaalsContact C-N 3.29Å; N210-P212 VanDerWaalsContact O-N 3.13Å; N210-L213 HydrophobicContact CB-CB 4.42Å; N210-L213 WeakPolarHBondContact O-CA 3.46Å; N210-L213 WeakPolarHBondContact O-CB 3.37Å; N210-L213 PolarHBondContact O-N 3.44Å; N210-W214 PolarHBondContact O-N 3.01Å
211R98Very high93.6Very high113 Ų11370.1 Ų70.143%0.42635%0.346SS..Hα-helixtrans-47.1-38.2176.2-178.5170.3172.8123.3-6.7114.9L208 C209 L213 W214 L215 E363L208-R211 HydrophobicContact CB-CB 4.47Å; L208-R211 HydrophobicContact CD2-CB 4.2Å; L208-R211 HydrophobicContact CD2-CG 4.36Å; L208-R211 HydrophobicContact CG-CB 4.39Å; L208-R211 WeakPolarHBondContact O-CB 3.38Å; C209-R211 PolarHBondContact O-N 3.34Å; C209-R211 VanDerWaalsContact O-N 3.15Å; R211-L213 VanDerWaalsContact C-N 3.29Å; R211-L213 PolarHBondContact O-N 3.23Å; R211-W214 PolarHBondContact O-N 3.18Å; R211-L215 HydrophobicContact CG-CD1 4.04Å; R211-L215 HydrophobicContact CG-CG 4.33Å; R211-L215 WeakPolarHBondContact O-CG 3.28Å; R211-L215 PolarHBondContact O-N 3.02Å; R211-E363 WeakPolarHBondContact CD-OE1 3.36Å; R211-E363 HydrophobicContact CG-CG 4.45Å; R211-E363 IonicContact CZ-OE1 2.62Å; R211-E363 IonicContact CZ-OE2 3.28Å; R211-E363 IonicContact NE-OE1 3.92Å; R211-E363 PolarHBondContact NE-OE1 3.14Å; R211-E363 VanDerWaalsContact NH1-CD 3.26Å; R211-E363 IonicContact NH1-OE1 3.9Å; R211-E363 PolarHBondContact NH1-OE1 3.31Å; R211-E363 IonicContact NH1-OE2 3.45Å; R211-E363 PolarHBondContact NH1-OE2 3.14Å; R211-E363 IonicContact NH2-OE2 3.18Å
212P98.5Very high95.7Very high101 Ų10164.2 Ų64.266%0.65631%0.308SS*.Hα-helixtrans-60.6-33.9173.9-25.936.3000114.2N210 K216N210-P212 VanDerWaalsContact C-N 3.29Å; N210-P212 VanDerWaalsContact O-N 3.13Å; P212-K216 PolarHBondContact O-N 3.29Å; P212-K216 VanDerWaalsContact O-N 3.15Å
213L98.5Very high97.2Very high33 Ų3362.2 Ų62.217%0.17329%0.287CS..Hα-helixtrans-73.3-41.8175.4-177.960000111.3N210 R211 L215 K216 F217 F234 P235 H384N210-L213 HydrophobicContact CB-CB 4.42Å; N210-L213 WeakPolarHBondContact O-CA 3.46Å; N210-L213 WeakPolarHBondContact O-CB 3.37Å; N210-L213 PolarHBondContact O-N 3.44Å; R211-L213 VanDerWaalsContact C-N 3.29Å; R211-L213 PolarHBondContact O-N 3.23Å; L213-L215 VanDerWaalsContact C-N 3.29Å; L213-L215 PolarHBondContact O-N 3.39Å; L213-K216 HydrophobicContact CD1-CD 4.32Å; L213-K216 WeakPolarHBondContact O-CB 3.09Å; L213-K216 PolarHBondContact O-N 3.49Å; L213-K216 VanDerWaalsContact O-N 3.13Å; L213-F217 HydrophobicContact CD1-CD2 4.13Å; L213-F217 HydrophobicContact CD1-CE2 3.83Å; L213-F217 HydrophobicContact CG-CD2 4.24Å; L213-F217 HydrophobicContact CG-CE2 4.13Å; L213-F217 WeakPolarHBondContact O-CD2 3.48Å; L213-F217 PolarHBondContact O-N 2.83Å; L213-F234 HydrophobicContact CD2-CZ 4.39Å; L213-P235 HydrophobicContact CD2-CB 4.32Å; L213-P235 HydrophobicContact CD2-CG 3.96Å; L213-P235 HydrophobicContact CG-CG 3.87Å; L213-H384 HydrophobicContact CD1-CB 3.99Å; L213-H384 WeakPolarHBondContact CD1-CD2 3.4Å; L213-H384 HydrophobicContact CD2-CB 4.43Å
214W98.7Very high97.9Very high0 Ų056.1 Ų56.10%026%0.261CS..Hα-helixtrans-56.5-44.2171.5-79.5105.5000111.7L208 N210 R211 K216 F217 H218 T222 M224 M233 P235 L237 E363 T364L208-W214 HydrophobicContact CD2-CB 4.2Å; L208-W214 HydrophobicContact CD2-CG 3.94Å; N210-W214 PolarHBondContact O-N 3.01Å; R211-W214 PolarHBondContact O-N 3.18Å; W214-K216 VanDerWaalsContact C-N 3.33Å; W214-K216 PolarHBondContact O-N 3.35Å; W214-F217 PolarHBondContact O-N 3.08Å; W214-H218 WeakPolarHBondContact O-CB 3.45Å; W214-H218 PolarHBondContact O-N 2.85Å; W214-T222 HydrophobicContact CZ3-CG2 4.46Å; W214-M224 HydrophobicContact CH2-CE 3.8Å; W214-M224 HydrophobicContact CZ3-CE 3.92Å; W214-M233 HydrophobicContact CH2-CE 4.36Å; W214-P235 HydrophobicContact CD2-CB 4.17Å; W214-P235 HydrophobicContact CD2-CG 4.32Å; W214-P235 HydrophobicContact CH2-CB 4.44Å; W214-P235 WeakPolarHBondContact CH2-O 3.44Å; W214-P235 HydrophobicContact CZ2-CB 3.9Å; W214-P235 WeakPolarHBondContact CZ2-O 3.44Å; W214-L237 HydrophobicContact CH2-CD2 3.94Å; W214-L237 HydrophobicContact CH2-CG 4.44Å; W214-L237 HydrophobicContact CZ2-CD2 3.65Å; W214-L237 HydrophobicContact CZ2-CG 4.16Å; W214-E363 HydrophobicContact CB-CG 4.03Å; W214-T364 HydrophobicContact CD2-CG2 3.85Å; W214-T364 HydrophobicContact CE3-CG2 3.96Å; W214-T364 HydrophobicContact CG-CG2 4.29Å; W214-T364 HydrophobicContact CH2-CG2 4.42Å; W214-T364 HydrophobicContact CZ2-CG2 4.32Å; W214-T364 HydrophobicContact CZ3-CG2 4.25Å
215L98.6Very high98.2Very high68 Ų6857.1 Ų57.136%0.35627%0.265SS..Hα-helixtrans-64.3-30.9175.8-70.7168.3000113.6R211 L213 R219 E363R211-L215 HydrophobicContact CG-CD1 4.04Å; R211-L215 HydrophobicContact CG-CG 4.33Å; R211-L215 WeakPolarHBondContact O-CG 3.28Å; R211-L215 PolarHBondContact O-N 3.02Å; L213-L215 VanDerWaalsContact C-N 3.29Å; L213-L215 PolarHBondContact O-N 3.39Å; L215-R219 WeakPolarHBondContact O-CG 3.45Å; L215-R219 PolarHBondContact O-N 3.25Å; L215-E363 HydrophobicContact CD2-CB 3.78Å; L215-E363 HydrophobicContact CD2-CG 4.29Å; L215-E363 HydrophobicContact CG-CB 4.4Å; L215-E363 HydrophobicContact CG-CG 4.49Å
216K98.4Very high98.3Very high95 Ų9553.8 Ų53.841%0.41325%0.25SC..Hα-helixtrans-61.7-53.4169.5-70-170.7-174.7-173.70110.8P212 L213 W214 H218 R219 H220 L380 H384P212-K216 PolarHBondContact O-N 3.29Å; P212-K216 VanDerWaalsContact O-N 3.15Å; L213-K216 HydrophobicContact CD1-CD 4.32Å; L213-K216 WeakPolarHBondContact O-CB 3.09Å; L213-K216 PolarHBondContact O-N 3.49Å; L213-K216 VanDerWaalsContact O-N 3.13Å; W214-K216 VanDerWaalsContact C-N 3.33Å; W214-K216 PolarHBondContact O-N 3.35Å; K216-H218 PolarHBondContact O-N 2.74Å; K216-R219 PolarHBondContact O-N 2.68Å; K216-H220 PolarHBondContact O-CD2 3.22Å; K216-L380 HydrophobicContact CB-CD2 4.5Å; K216-L380 HydrophobicContact CD-CD2 4.42Å; K216-H384 PolarHBondContact NZ-NE2 3.03Å
217F98.7Very high98.2Very high0 Ų055.3 Ų55.30%026%0.259CS..Hα-helixtrans-63.8-39.6-179.4-80.8-78.6000112.7L213 W214 R219 H220 Q221 T222 F234 P235 I377 L380 K381L213-F217 HydrophobicContact CD1-CD2 4.13Å; L213-F217 HydrophobicContact CD1-CE2 3.83Å; L213-F217 HydrophobicContact CG-CD2 4.24Å; L213-F217 HydrophobicContact CG-CE2 4.13Å; L213-F217 WeakPolarHBondContact O-CD2 3.48Å; L213-F217 PolarHBondContact O-N 2.83Å; W214-F217 PolarHBondContact O-N 3.08Å; F217-R219 VanDerWaalsContact C-N 3.29Å; F217-R219 PolarHBondContact O-N 3.15Å; F217-H220 PolarHBondContact O-N 2.78Å; F217-H220 VanDerWaalsContact O-N 3.14Å; F217-Q221 PolarHBondContact O-N 3.49Å; F217-T222 VanDerWaalsContact C-OG1 3.24Å; F217-T222 HydrophobicContact CB-CG2 4.08Å; F217-T222 PolarHBondContact O-N 3.17Å; F217-T222 VanDerWaalsContact O-N 3.14Å; F217-T222 PolarHBondContact O-OG1 2.83Å; F217-F234 HydrophobicContact CE2-CD1 4.32Å; F217-F234 AromaticContact CE2-CE1 3.9Å; F217-F234 HydrophobicContact CE2-CE1 3.9Å; F217-F234 HydrophobicContact CZ-CD1 4.02Å; F217-F234 AromaticContact CZ-CE1 3.82Å; F217-F234 HydrophobicContact CZ-CE1 3.82Å; F217-P235 VanDerWaalsContact CD2-CD 3.48Å; F217-P235 HydrophobicContact CD2-CG 3.49Å; F217-P235 VanDerWaalsContact CD2-CG 3.49Å; F217-P235 HydrophobicContact CE2-CG 3.62Å; F217-P235 HydrophobicContact CG-CG 4.43Å; F217-I377 HydrophobicContact CD1-CD1 3.95Å; F217-L380 HydrophobicContact CD1-CB 4.01Å; F217-L380 HydrophobicContact CD1-CD1 4.21Å; F217-L380 HydrophobicContact CE1-CB 3.4Å; F217-L380 HydrophobicContact CE1-CD1 4.44Å; F217-L380 HydrophobicContact CE2-CB 4.36Å; F217-L380 VanDerWaalsContact CZ-C 3.48Å; F217-L380 HydrophobicContact CZ-CB 3.62Å; F217-L380 WeakPolarHBondContact CZ-O 3.24Å; F217-K381 HydrophobicContact CE1-CD 3.68Å; F217-K381 HydrophobicContact CE1-CG 4.07Å; F217-K381 HydrophobicContact CZ-CD 3.98Å; F217-K381 HydrophobicContact CZ-CG 4.47Å
218H98.4Very high98Very high68 Ų6857.1 Ų57.132%0.31527%0.269SS..Hα-helixtrans-61.1-36.4-177.9-16879.8000112.8W214 K216 H220 Q221 T222 P362 E363W214-H218 WeakPolarHBondContact O-CB 3.45Å; W214-H218 PolarHBondContact O-N 2.85Å; K216-H218 PolarHBondContact O-N 2.74Å; H218-H220 PolarHBondContact O-N 3.24Å; H218-Q221 PolarHBondContact O-N 3.28Å; H218-T222 WeakPolarHBondContact CA-OG1 3.27Å; H218-T222 PolarHBondContact N-OG1 2.91Å; H218-P362 PolarHBondContact CE1-O 3.4Å; H218-E363 HydrophobicContact CB-CB 4.36Å; H218-E363 WeakPolarHBondContact ND1-CA 3.21Å; H218-E363 PolarHBondContact ND1-O 2.74Å
219R98.1Very high97.7Very high207 Ų20764.1 Ų64.178%0.78130%0.302SS*.Hα-helixtrans-59.1-31.7176.5-75168.3178.2-177.7-1.2113.7L215 K216 F217L215-R219 WeakPolarHBondContact O-CG 3.45Å; L215-R219 PolarHBondContact O-N 3.25Å; K216-R219 PolarHBondContact O-N 2.68Å; F217-R219 VanDerWaalsContact C-N 3.29Å; F217-R219 PolarHBondContact O-N 3.15Å
220H97.8Very high97.5Very high71 Ų7164 Ų6433%0.32930%0.303SS..THydrogen-bonded Turntrans-101.216.5178.9-59.9-99.7000112.3K216 F217 H218 N374 D376 I377K216-H220 PolarHBondContact O-CD2 3.22Å; F217-H220 PolarHBondContact O-N 2.78Å; F217-H220 VanDerWaalsContact O-N 3.14Å; H218-H220 PolarHBondContact O-N 3.24Å; H220-N374 PolarHBondContact O-ND2 2.86Å; H220-D376 HydrophobicContact CB-CB 4.24Å; H220-D376 IonicContact CE1-OD2 3.49Å; H220-D376 PolarHBondContact CE1-OD2 3.12Å; H220-D376 IonicContact CG-OD2 2.83Å; H220-D376 VanDerWaalsContact ND1-CB 3.3Å; H220-D376 WeakPolarHBondContact ND1-CB 3.47Å; H220-D376 IonicContact ND1-OD2 2.78Å; H220-D376 PolarHBondContact ND1-OD2 3.4Å; H220-I377 HydrophobicContact CB-CD1 3.66Å; H220-I377 HydrophobicContact CB-CG1 4.02Å
221Q98.1Very high97.5Very high79 Ų7966.4 Ų66.437%0.36931%0.305SS..  trans57.975-175.6-57-177.9-81.700113F217 H218 E223F217-Q221 PolarHBondContact O-N 3.49Å; H218-Q221 PolarHBondContact O-N 3.28Å; Q221-E223 PolarHBondContact O-N 2.91Å
222T98.7Very high97.4Very high1 Ų167.9 Ų67.91%0.00631%0.311CS..  trans-29.1122-179.8-47.50000114.4W214 F217 H218 M224 Q365 F366 I367W214-T222 HydrophobicContact CZ3-CG2 4.46Å; F217-T222 VanDerWaalsContact C-OG1 3.24Å; F217-T222 HydrophobicContact CB-CG2 4.08Å; F217-T222 PolarHBondContact O-N 3.17Å; F217-T222 VanDerWaalsContact O-N 3.14Å; F217-T222 PolarHBondContact O-OG1 2.83Å; H218-T222 WeakPolarHBondContact CA-OG1 3.27Å; H218-T222 PolarHBondContact N-OG1 2.91Å; T222-M224 HydrophobicContact CG2-CE 3.91Å; T222-Q365 WeakPolarHBondContact CB-O 3.44Å; T222-Q365 PolarHBondContact OG1-O 3.42Å; T222-F366 HydrophobicContact CG2-CB 3.81Å; T222-F366 CarbonylContact O-C 3.54Å; T222-F366 WeakPolarHBondContact O-CA 3.42Å; T222-F366 VanDerWaalsContact O-CB 3.27Å; T222-F366 WeakPolarHBondContact O-CB 3.4Å; T222-I367 PolarHBondContact O-N 3.49Å
223E98.9Very high97.4Very high0 Ų063.6 Ų63.60%028%0.282CS..EExtended strand (participates in β ladder)trans-107144.5172.4-55.5177.1-166.400111.1Q221 W271 I367 V369 Y372 Q373 N374 I377 K381Q221-E223 PolarHBondContact O-N 2.91Å; E223-W271 HydrophobicContact CG-CZ2 4.09Å; E223-I367 CarbonylContact C-O 3.6Å; E223-I367 WeakPolarHBondContact CA-O 3.35Å; E223-V369 HydrophobicContact CB-CG1 4.43Å; E223-V369 HydrophobicContact CB-CG2 3.96Å; E223-Y372 HydrophobicContact CB-CD1 4.03Å; E223-Y372 HydrophobicContact CB-CE1 4.38Å; E223-Y372 WeakPolarHBondContact OE2-CA 3.3Å; E223-Q373 PolarHBondContact OE1-N 2.79Å; E223-Q373 PolarHBondContact OE2-N 3.5Å; E223-N374 VanDerWaalsContact OE1-CB 3.3Å; E223-N374 WeakPolarHBondContact OE1-CB 3.37Å; E223-N374 PolarHBondContact OE1-N 3.03Å; E223-I377 HydrophobicContact CB-CG2 4.02Å; E223-I377 HydrophobicContact CG-CG1 4.32Å; E223-I377 HydrophobicContact CG-CG2 4.26Å; E223-K381 WeakPolarHBondContact O-CE 3.45Å; E223-K381 PolarHBondContact O-NZ 2.98Å
224M98.8Very high97.4Very high3 Ų363.2 Ų63.22%0.01528%0.279CS..EExtended strand (participates in β ladder)trans-125.6125.4172.6-65.6-7018000111.1W214 T222 M233 F234 L311 F366 I367 A368 V369W214-M224 HydrophobicContact CH2-CE 3.8Å; W214-M224 HydrophobicContact CZ3-CE 3.92Å; T222-M224 HydrophobicContact CG2-CE 3.91Å; M224-M233 HydrophobicContact CE-CB 4.32Å; M224-M233 HydrophobicContact CE-CE 3.96Å; M224-M233 HydrophobicContact CG-CE 4.42Å; M224-M233 HydrophobicContact SD-CB 4.1Å; M224-M233 HydrophobicContact SD-CE 4.47Å; M224-M233 HydrophobicContact SD-CG 4.46Å; M224-F234 WeakPolarHBondContact CE-O 3.46Å; M224-F234 PolarHBondContact SD-N 3.46Å; M224-L311 HydrophobicContact CB-CD1 3.79Å; M224-L311 HydrophobicContact CG-CD1 4.29Å; M224-F366 HydrophobicContact CB-CD2 3.51Å; M224-F366 HydrophobicContact CB-CE2 3.8Å; M224-F366 HydrophobicContact CB-CG 4.13Å; M224-F366 HydrophobicContact CG-CB 3.82Å; M224-F366 HydrophobicContact CG-CD1 4.1Å; M224-F366 HydrophobicContact CG-CD2 3.44Å; M224-F366 VanDerWaalsContact CG-CD2 3.44Å; M224-F366 HydrophobicContact CG-CE2 3.97Å; M224-F366 HydrophobicContact CG-CG 3.52Å; M224-F366 HydrophobicContact CG-CZ 4.5Å; M224-I367 PolarHBondContact N-O 3.29Å; M224-A368 WeakPolarHBondContact O-CA 3.2Å; M224-V369 PolarHBondContact O-N 2.88Å
225I98.6Very high97.4Very high28 Ų2863.4 Ų63.414%0.14428%0.28CS..EExtended strand (participates in β ladder)trans-67.6132.8176.8-65.4-76.1000110.1T227 R231 V369 Y372I225-T227 HydrophobicContact CG2-CG2 3.85Å; I225-R231 HydrophobicContact CB-CG 4.12Å; I225-R231 HydrophobicContact CG2-CB 4.32Å; I225-R231 HydrophobicContact CG2-CG 3.95Å; I225-R231 WeakPolarHBondContact O-CB 3.45Å; I225-V369 CarbonylContact C-O 3.55Å; I225-V369 VanDerWaalsContact CA-O 3.24Å; I225-V369 WeakPolarHBondContact CA-O 3.35Å; I225-V369 HydrophobicContact CD1-CG2 4.12Å; I225-Y372 HydrophobicContact CD1-CD1 4.03Å; I225-Y372 HydrophobicContact CD1-CD2 4.29Å; I225-Y372 HydrophobicContact CD1-CE1 3.98Å; I225-Y372 HydrophobicContact CD1-CE2 4.24Å; I225-Y372 HydrophobicContact CD1-CG 4.17Å; I225-Y372 HydrophobicContact CG1-CD1 4.12Å; I225-Y372 HydrophobicContact CG1-CE1 3.54Å; I225-Y372 HydrophobicContact CG1-CE2 3.98Å; I225-Y372 VanDerWaalsContact CG1-CZ 3.45Å
226I97.7Very high97.4Very high2 Ų263.8 Ų63.81%0.0128%0.279CS..  trans-118.8138.917268.4178.8000110.6L311 N313 L327 A368 V369 T370I226-L311 HydrophobicContact CG2-CB 3.77Å; I226-L311 HydrophobicContact CG2-CD1 4.48Å; I226-N313 HydrophobicContact CD1-CB 3.73Å; I226-N313 HydrophobicContact CG1-CB 4.04Å; I226-L327 HydrophobicContact CG2-CD1 4.38Å; I226-A368 HydrophobicContact CD1-CB 4.18Å; I226-A368 HydrophobicContact CG2-CB 3.98Å; I226-V369 PolarHBondContact N-O 2.84Å; I226-T370 HydrophobicContact CG1-CG2 4.47Å
227T96.3Very high97.4Very high48 Ų4859.4 Ų59.429%0.29426%0.26SS..  trans-141.4161.7-176.669.50000112.5I225 Q229 G230 R231 T312 N313I225-T227 HydrophobicContact CG2-CG2 3.85Å; T227-Q229 VanDerWaalsContact C-N 3.26Å; T227-Q229 PolarHBondContact O-N 3.02Å; T227-G230 PolarHBondContact O-N 2.77Å; T227-G230 PolarHBondContact OG1-N 3.32Å; T227-R231 HydrophobicContact CG2-CB 4.26Å; T227-T312 WeakPolarHBondContact O-CA 3.5Å; T227-T312 VanDerWaalsContact O-CB 3.28Å; T227-T312 WeakPolarHBondContact O-CB 3.37Å; T227-T312 PolarHBondContact O-OG1 3.12Å; T227-N313 VanDerWaalsContact C-OD1 3.26Å
228K93.4Very high97.4Very high162 Ų16259.4 Ų59.470%0.70426%0.261SS*.THydrogen-bonded Turntrans-57.5-33.7179.2-173.5178.1178.6-178.70113.9N313 N314K228-N313 PolarHBondContact N-OD1 3.04Å; K228-N314 HydrophobicContact CG-CB 4.48Å
229Q92.5Very high97.4Very high162 Ų16256.3 Ų56.376%0.75725%0.246SC*.THydrogen-bonded Turntrans-92.2-1.9178.2-62.6-179.8-0.400113.9T227 K310T227-Q229 VanDerWaalsContact C-N 3.26Å; T227-Q229 PolarHBondContact O-N 3.02Å; Q229-K310 PolarHBondContact O-NZ 3Å
230G94.3Very high97.4Very high12 Ų1249.9 Ų49.912%0.12423%0.227CC..  trans79.1137.1-174.200000114T227 L311T227-G230 PolarHBondContact O-N 2.77Å; T227-G230 PolarHBondContact OG1-N 3.32Å; G230-L311 CarbonylContact C-O 3.47Å; G230-L311 VanDerWaalsContact CA-O 3.29Å; G230-L311 WeakPolarHBondContact CA-O 3.46Å
231R96.6Very high97.4Very high141 Ų14147 Ų4753%0.53221%0.214SC..EExtended strand (participates in β ladder)trans-119.1137177.6-171.871.4173.8-177-2.2110.1I225 T227 K310 L311I225-R231 HydrophobicContact CB-CG 4.12Å; I225-R231 HydrophobicContact CG2-CB 4.32Å; I225-R231 HydrophobicContact CG2-CG 3.95Å; I225-R231 WeakPolarHBondContact O-CB 3.45Å; T227-R231 HydrophobicContact CG2-CB 4.26Å; R231-K310 CarbonylContact O-C 3.59Å; R231-K310 WeakPolarHBondContact O-CA 3.42Å; R231-L311 PolarHBondContact N-O 3.3Å; R231-L311 PolarHBondContact O-N 3.13Å
232R97.1Very high97.3Very high144 Ų14444.5 Ų44.554%0.54321%0.206SC..EExtended strand (participates in β ladder)trans-66.7143.6173.7-73.4176.9176.5176.12111G307 L309R232-G307 WeakPolarHBondContact CD-O 3.31Å; R232-G307 PolarHBondContact NE-O 3Å; R232-L309 WeakPolarHBondContact CA-O 3.44Å
233M98.2Very high97.2Very high12 Ų1245.7 Ų45.76%0.05922%0.218CC..  trans-64.8147.8173.4-63-178.374.300111.2W214 M224 P235 L237 L309 L311 P335 F366W214-M233 HydrophobicContact CH2-CE 4.36Å; M224-M233 HydrophobicContact CE-CB 4.32Å; M224-M233 HydrophobicContact CE-CE 3.96Å; M224-M233 HydrophobicContact CG-CE 4.42Å; M224-M233 HydrophobicContact SD-CB 4.1Å; M224-M233 HydrophobicContact SD-CE 4.47Å; M224-M233 HydrophobicContact SD-CG 4.46Å; M233-P235 CarbonylContact C-O 3.57Å; M233-L237 HydrophobicContact CE-CD1 4.22Å; M233-L237 HydrophobicContact CE-CG 4.33Å; M233-L237 HydrophobicContact SD-CD1 4.09Å; M233-L237 HydrophobicContact SD-CG 4.42Å; M233-L309 HydrophobicContact CG-CD2 4.33Å; M233-L309 HydrophobicContact SD-CD2 3.94Å; M233-L311 HydrophobicContact CE-CD1 4.49Å; M233-L311 HydrophobicContact CG-CD1 3.76Å; M233-L311 HydrophobicContact CG-CD2 4.26Å; M233-L311 HydrophobicContact CG-CG 3.84Å; M233-L311 HydrophobicContact SD-CD1 4.31Å; M233-L311 HydrophobicContact SD-CD2 4.24Å; M233-L311 HydrophobicContact SD-CG 4.42Å; M233-P335 HydrophobicContact CE-CG 4.48Å; M233-F366 HydrophobicContact CE-CD1 4.07Å; M233-F366 HydrophobicContact CE-CE1 3.73Å; M233-F366 HydrophobicContact CE-CZ 4.37Å
234F98.5Very high97Very high24 Ų2446.2 Ų46.211%0.10522%0.221CC..SBendtrans-145.8120.3166.8-172.3-86.3000111L213 F217 M224 K381 H384 N385L213-F234 HydrophobicContact CD2-CZ 4.39Å; F217-F234 HydrophobicContact CE2-CD1 4.32Å; F217-F234 AromaticContact CE2-CE1 3.9Å; F217-F234 HydrophobicContact CE2-CE1 3.9Å; F217-F234 HydrophobicContact CZ-CD1 4.02Å; F217-F234 AromaticContact CZ-CE1 3.82Å; F217-F234 HydrophobicContact CZ-CE1 3.82Å; M224-F234 WeakPolarHBondContact CE-O 3.46Å; M224-F234 PolarHBondContact SD-N 3.46Å; F234-K381 HydrophobicContact CD1-CD 3.95Å; F234-K381 PolarHBondContact O-NZ 2.9Å; F234-H384 HydrophobicContact CE1-CB 3.91Å; F234-H384 HydrophobicContact CZ-CB 3.86Å; F234-H384 VanDerWaalsContact CZ-O 3.29Å; F234-H384 WeakPolarHBondContact CZ-O 3.33Å; F234-N385 HydrophobicContact CD1-CB 3.96Å; F234-N385 HydrophobicContact CD2-CB 3.91Å; F234-N385 HydrophobicContact CE1-CB 3.86Å; F234-N385 HydrophobicContact CE2-CB 3.8Å; F234-N385 HydrophobicContact CG-CB 4Å; F234-N385 HydrophobicContact CZ-CB 3.8Å
235P98.3Very high96.7Very high5 Ų549.6 Ų49.63%0.03224%0.239CC..SBendcis-56.9152.4-7.7-20.734000111.2L213 W214 F217 M233L213-P235 HydrophobicContact CD2-CB 4.32Å; L213-P235 HydrophobicContact CD2-CG 3.96Å; L213-P235 HydrophobicContact CG-CG 3.87Å; W214-P235 HydrophobicContact CD2-CB 4.17Å; W214-P235 HydrophobicContact CD2-CG 4.32Å; W214-P235 HydrophobicContact CH2-CB 4.44Å; W214-P235 WeakPolarHBondContact CH2-O 3.44Å; W214-P235 HydrophobicContact CZ2-CB 3.9Å; W214-P235 WeakPolarHBondContact CZ2-O 3.44Å; F217-P235 VanDerWaalsContact CD2-CD 3.48Å; F217-P235 HydrophobicContact CD2-CG 3.49Å; F217-P235 VanDerWaalsContact CD2-CG 3.49Å; F217-P235 HydrophobicContact CE2-CG 3.62Å; F217-P235 HydrophobicContact CG-CG 4.43Å; M233-P235 CarbonylContact C-O 3.57Å
236F98Very high96.6Very high76 Ų7651.7 Ų51.733%0.33325%0.254SS..PPolyproline II helixtrans-85.2154.1171.953.4-96.1000109.9S238 S305F236-S238 WeakPolarHBondContact CE2-OG 3.26Å; F236-S305 WeakPolarHBondContact CD2-OG 3.17Å; F236-S305 VanDerWaalsContact CE2-OG 3.25Å; F236-S305 WeakPolarHBondContact CE2-OG 3.27Å
237L98.6Very high96.4Very high2 Ų256.6 Ų56.61%0.0128%0.284CS..PPolyproline II helixtrans-72.8131.9174.9-63.1164.6000108.6W214 M233 F239 V254 F306 P335 T364W214-L237 HydrophobicContact CH2-CD2 3.94Å; W214-L237 HydrophobicContact CH2-CG 4.44Å; W214-L237 HydrophobicContact CZ2-CD2 3.65Å; W214-L237 HydrophobicContact CZ2-CG 4.16Å; M233-L237 HydrophobicContact CE-CD1 4.22Å; M233-L237 HydrophobicContact CE-CG 4.33Å; M233-L237 HydrophobicContact SD-CD1 4.09Å; M233-L237 HydrophobicContact SD-CG 4.42Å; L237-F239 HydrophobicContact CB-CE2 3.86Å; L237-F239 HydrophobicContact CB-CZ 3.98Å; L237-F239 HydrophobicContact CD2-CZ 4.21Å; L237-V254 HydrophobicContact CD1-CG1 3.91Å; L237-V254 HydrophobicContact CD1-CG2 4.37Å; L237-F306 HydrophobicContact CB-CB 4.13Å; L237-F306 WeakPolarHBondContact O-CB 3.48Å; L237-F306 PolarHBondContact O-N 3.13Å; L237-P335 HydrophobicContact CD1-CB 3.61Å; L237-P335 HydrophobicContact CD1-CG 4.02Å; L237-P335 HydrophobicContact CD2-CB 4.18Å; L237-P335 HydrophobicContact CD2-CG 4.27Å; L237-T364 HydrophobicContact CD2-CG2 3.89Å
238S98.5Very high96.3Very high1 Ų155.1 Ų55.11%0.00728%0.277CS..EExtended strand (participates in β ladder)trans-155.9135.3-174.7-1260000108.4C209 F236 E303 I304 S305C209-S238 WeakPolarHBondContact CB-O 3.15Å; C209-S238 PolarHBondContact N-O 2.95Å; F236-S238 WeakPolarHBondContact CE2-OG 3.26Å; S238-E303 WeakPolarHBondContact CB-OE1 3.45Å; S238-E303 PolarHBondContact OG-OE1 2.82Å; S238-I304 CarbonylContact C-O 3.53Å; S238-I304 VanDerWaalsContact CA-O 3.31Å; S238-I304 WeakPolarHBondContact CA-O 3.42Å; S238-S305 WeakPolarHBondContact OG-CA 3.11Å; S238-S305 WeakPolarHBondContact OG-CB 3.48Å; S238-S305 PolarHBondContact OG-OG 3.49Å
239F98.6Very high96.3Very high3 Ų351.2 Ų51.21%0.01326%0.261CS..EExtended strand (participates in β ladder)trans-142.3146.4-167.7-50.9-85.4000112.7V206 Y207 L208 L237 V254 I304 F306 L337 F361V206-F239 HydrophobicContact CG1-CB 4.1Å; V206-F239 HydrophobicContact CG1-CD1 3.91Å; V206-F239 HydrophobicContact CG1-CG 4.25Å; Y207-F239 VanDerWaalsContact O-CA 3.28Å; Y207-F239 WeakPolarHBondContact O-CA 3.35Å; L208-F239 HydrophobicContact CD1-CD1 4.04Å; L208-F239 HydrophobicContact CD1-CE1 3.63Å; L208-F239 HydrophobicContact CD1-CZ 4.35Å; L237-F239 HydrophobicContact CB-CE2 3.86Å; L237-F239 HydrophobicContact CB-CZ 3.98Å; L237-F239 HydrophobicContact CD2-CZ 4.21Å; F239-V254 HydrophobicContact CE2-CG2 4.47Å; F239-I304 PolarHBondContact N-O 3.44Å; F239-I304 PolarHBondContact O-N 3.24Å; F239-F306 HydrophobicContact CD2-CD2 4.02Å; F239-F306 AromaticContact CD2-CE2 3.93Å; F239-F306 HydrophobicContact CD2-CE2 3.93Å; F239-F306 AromaticContact CE2-CD2 3.84Å; F239-F306 HydrophobicContact CE2-CD2 3.84Å; F239-F306 AromaticContact CE2-CE2 3.93Å; F239-F306 HydrophobicContact CE2-CE2 3.93Å; F239-L337 HydrophobicContact CB-CD2 4.38Å; F239-L337 HydrophobicContact CD1-CD2 4.27Å; F239-L337 HydrophobicContact CD2-CD1 3.99Å; F239-L337 HydrophobicContact CD2-CD2 3.94Å; F239-L337 HydrophobicContact CD2-CG 4.48Å; F239-L337 HydrophobicContact CE2-CB 4.35Å; F239-L337 HydrophobicContact CE2-CD1 3.81Å; F239-L337 HydrophobicContact CE2-CD2 4.25Å; F239-L337 HydrophobicContact CE2-CG 4.37Å; F239-L337 HydrophobicContact CG-CD2 3.95Å; F239-L337 HydrophobicContact CZ-CB 4.19Å; F239-L337 HydrophobicContact CZ-CD1 4.48Å; F239-F361 AromaticContact CD1-CE2 3.95Å; F239-F361 HydrophobicContact CD1-CE2 3.95Å; F239-F361 HydrophobicContact CD1-CZ 4.45Å; F239-F361 AromaticContact CE1-CD2 3.76Å; F239-F361 HydrophobicContact CE1-CD2 3.76Å; F239-F361 AromaticContact CE1-CE2 3.58Å; F239-F361 HydrophobicContact CE1-CE2 3.58Å; F239-F361 HydrophobicContact CE1-CZ 4.44Å
240N98.2Very high96.5Very high72 Ų7243.7 Ų43.739%0.38523%0.226SC..EExtended strand (participates in β ladder)trans-101.2141.2160.6-75.3-24.3000109.1Y207 E303Y207-N240 PolarHBondContact N-O 2.85Å; Y207-N240 PolarHBondContact O-N 3.01Å; N240-E303 VanDerWaalsContact OD1-CA 3.26Å; N240-E303 WeakPolarHBondContact OD1-CA 3.48Å; N240-E303 WeakPolarHBondContact OD1-CB 3.26Å; N240-E303 PolarHBondContact OD1-N 2.96Å
241I97.7Very high96.6Very high10 Ų1045 Ų455%0.05123%0.23CC..EExtended strand (participates in β ladder)trans-126.7142.6179.7-54.2-169.9000110.1A204 Q205 V206 L244 I252 M300 I304 L337 V339A204-I241 HydrophobicContact CB-CG2 4.37Å; Q205-I241 CarbonylContact O-C 3.56Å; Q205-I241 VanDerWaalsContact O-CA 3.31Å; Q205-I241 WeakPolarHBondContact O-CA 3.32Å; V206-I241 HydrophobicContact CG1-CG1 4.35Å; V206-I241 HydrophobicContact CG2-CD1 4.11Å; V206-I241 HydrophobicContact CG2-CG1 4.03Å; V206-I241 HydrophobicContact CG2-CG2 4.31Å; I241-L244 HydrophobicContact CG2-CD1 3.99Å; I241-L244 HydrophobicContact CG2-CD2 4.29Å; I241-L244 HydrophobicContact CG2-CG 3.98Å; I241-I252 HydrophobicContact CD1-CD1 3.83Å; I241-M300 WeakPolarHBondContact O-CG 3.28Å; I241-I304 HydrophobicContact CB-CD1 4.39Å; I241-I304 HydrophobicContact CD1-CD1 3.48Å; I241-I304 VanDerWaalsContact CD1-CD1 3.48Å; I241-I304 HydrophobicContact CG1-CD1 3.76Å; I241-L337 HydrophobicContact CD1-CD2 4.09Å; I241-V339 HydrophobicContact CD1-CG2 3.94Å
242S96.8Very high96.6Very high27 Ų2738.3 Ų38.319%0.18921%0.205CC..EExtended strand (participates in β ladder)trans-140.8164172.151.40000110.8A204 Q205A204-S242 WeakPolarHBondContact CA-O 3.45Å; Q205-S242 PolarHBondContact N-O 2.92Å; Q205-S242 PolarHBondContact O-N 2.55Å
243G94.9Very high96.6Very high26 Ų2633.6 Ų33.627%0.26819%0.188SC..SBendtrans83.312.2175.300000116M300G243-M300 PolarHBondContact N-SD 2.95Å; G243-M300 VanDerWaalsContact N-SD 3.42Å
244L94.7Very high96.6Very high11 Ų1133 Ų336%0.05819%0.185CC..SBendtrans-77.2158.8165.9-54.5178.9000110.4A204 I241 Y250 W299 M300 V339A204-L244 HydrophobicContact CB-CD2 3.57Å; I241-L244 HydrophobicContact CG2-CD1 3.99Å; I241-L244 HydrophobicContact CG2-CD2 4.29Å; I241-L244 HydrophobicContact CG2-CG 3.98Å; L244-Y250 HydrophobicContact CB-CD2 4.45Å; L244-Y250 HydrophobicContact CB-CE2 3.82Å; L244-Y250 HydrophobicContact CD1-CD2 4.11Å; L244-Y250 HydrophobicContact CD1-CE2 4.31Å; L244-Y250 HydrophobicContact CD1-CG 4.43Å; L244-Y250 HydrophobicContact CD2-CD1 4.33Å; L244-Y250 HydrophobicContact CD2-CE1 4.06Å; L244-Y250 HydrophobicContact CD2-CE2 4.39Å; L244-Y250 HydrophobicContact CG-CE2 4.4Å; L244-W299 HydrophobicContact CD1-CB 3.76Å; L244-W299 HydrophobicContact CD1-CG 4.41Å; L244-M300 HydrophobicContact CB-CE 4.02Å; L244-M300 HydrophobicContact CB-CG 4.35Å; L244-M300 HydrophobicContact CB-SD 3.95Å; L244-M300 HydrophobicContact CD1-CG 4.25Å; L244-M300 HydrophobicContact CG-CG 4.32Å; L244-M300 HydrophobicContact CG-SD 4.37Å; L244-M300 PolarHBondContact N-SD 3.21Å; L244-M300 VanDerWaalsContact O-CE 3.24Å; L244-M300 WeakPolarHBondContact O-CE 3.46Å; L244-V339 HydrophobicContact CD2-CG1 3.88Å
245D93.6Very high96.5Very high73 Ų7332.8 Ų32.839%0.3919%0.185SC..  trans-67128.1163.2-170.2-62.9000109T247 A248 Y250 G296D245-T247 PolarHBondContact O-N 2.86Å; D245-T247 WeakPolarHBondContact OD1-CA 3.46Å; D245-T247 WeakPolarHBondContact OD1-CB 3.28Å; D245-T247 PolarHBondContact OD1-N 3.42Å; D245-T247 PolarHBondContact OD1-OG1 3.28Å; D245-A248 HydrophobicContact CB-CB 3.86Å; D245-A248 PolarHBondContact OD1-N 2.95Å; D245-Y250 PolarHBondContact N-OH 3.1Å; D245-G296 VanDerWaalsContact O-CA 3.28Å; D245-G296 WeakPolarHBondContact O-CA 3.46Å
246P95.7Very high96.4Very high73 Ų7332.6 Ų32.647%0.47418%0.184SC..SBendtrans-59.9-28.6179.2-25.235.5000114.5A297 M300P246-A297 HydrophobicContact CB-CB 4.15Å; P246-A297 WeakPolarHBondContact O-CB 3.41Å; P246-A297 PolarHBondContact O-N 3.46Å; P246-M300 HydrophobicContact CG-CE 4.21Å
247T94.5Very high96.3Very high104 Ų10431.7 Ų31.764%0.63818%0.182SC*.SBendtrans-94.9-38.2-172.967.30000113.2D245D245-T247 PolarHBondContact O-N 2.86Å; D245-T247 WeakPolarHBondContact OD1-CA 3.46Å; D245-T247 WeakPolarHBondContact OD1-CB 3.28Å; D245-T247 PolarHBondContact OD1-N 3.42Å; D245-T247 PolarHBondContact OD1-OG1 3.28Å
248A93.1Very high96.2Very high17 Ų1733.6 Ų33.614%0.1419%0.192CC..SBendtrans-62.3151-18000000112D245 Y250 T295 G296 E341D245-A248 HydrophobicContact CB-CB 3.86Å; D245-A248 PolarHBondContact OD1-N 2.95Å; A248-Y250 HydrophobicContact CB-CE2 3.91Å; A248-Y250 WeakPolarHBondContact O-CD2 3.28Å; A248-Y250 WeakPolarHBondContact O-CE2 3.37Å; A248-T295 CarbonylContact O-C 3.58Å; A248-T295 WeakPolarHBondContact O-CA 3.4Å; A248-G296 PolarHBondContact O-N 2.88Å; A248-E341 HydrophobicContact CB-CG 4.29Å
249H94.6Very high96.1Very high81 Ų8135.3 Ų35.338%0.37521%0.207SC..EExtended strand (participates in β ladder)trans-94.4141.4179.1-7474.4000111.1N294 V342H249-N294 CarbonylContact C-O 3.58Å; H249-N294 WeakPolarHBondContact CA-O 3.22Å; H249-V342 HydrophobicContact CB-CB 4.04Å; H249-V342 HydrophobicContact CB-CG2 4.46Å; H249-V342 WeakPolarHBondContact O-CB 3.37Å; H249-V342 PolarHBondContact O-N 2.86Å
250Y95.7Very high96Very high3 Ų336.6 Ų36.61%0.01221%0.213CC..EExtended strand (participates in β ladder)trans-131.6137.4-179.4-60.6-89.7000111.2L244 D245 A248 P293 N294 W299 V339 V340 E341L244-Y250 HydrophobicContact CB-CD2 4.45Å; L244-Y250 HydrophobicContact CB-CE2 3.82Å; L244-Y250 HydrophobicContact CD1-CD2 4.11Å; L244-Y250 HydrophobicContact CD1-CE2 4.31Å; L244-Y250 HydrophobicContact CD1-CG 4.43Å; L244-Y250 HydrophobicContact CD2-CD1 4.33Å; L244-Y250 HydrophobicContact CD2-CE1 4.06Å; L244-Y250 HydrophobicContact CD2-CE2 4.39Å; L244-Y250 HydrophobicContact CG-CE2 4.4Å; D245-Y250 PolarHBondContact N-OH 3.1Å; A248-Y250 HydrophobicContact CB-CE2 3.91Å; A248-Y250 WeakPolarHBondContact O-CD2 3.28Å; A248-Y250 WeakPolarHBondContact O-CE2 3.37Å; Y250-P293 WeakPolarHBondContact O-CA 3.32Å; Y250-N294 PolarHBondContact N-O 2.95Å; Y250-N294 PolarHBondContact O-N 2.8Å; Y250-W299 PolarHBondContact O-NE1 3.21Å; Y250-V339 HydrophobicContact CD1-CG1 3.75Å; Y250-V339 HydrophobicContact CE1-CG1 4.49Å; Y250-V339 HydrophobicContact CG-CG1 4.26Å; Y250-V340 CarbonylContact C-O 3.53Å; Y250-V340 VanDerWaalsContact CA-O 3.27Å; Y250-V340 WeakPolarHBondContact CA-O 3.41Å; Y250-E341 HydrophobicContact CD1-CB 3.9Å; Y250-E341 HydrophobicContact CD1-CG 4.04Å; Y250-E341 HydrophobicContact CE1-CB 3.65Å; Y250-E341 HydrophobicContact CE1-CG 3.53Å; Y250-E341 WeakPolarHBondContact CE1-OE2 3.35Å; Y250-E341 VanDerWaalsContact CZ-OE2 3.24Å; Y250-E341 PolarHBondContact OH-OE2 3.46Å
251N96.2Very high95.8Very high40 Ų4036.9 Ų36.921%0.21422%0.219CC..EExtended strand (participates in β ladder)trans-87.6135.3159.5-76.4-48.3000109M288 P293 V340N251-M288 HydrophobicContact CB-SD 4.38Å; N251-P293 WeakPolarHBondContact OD1-CA 3.3Å; N251-P293 WeakPolarHBondContact OD1-CB 3.45Å; N251-V340 PolarHBondContact N-O 3.28Å; N251-V340 PolarHBondContact O-N 3.06Å
252I97.3Very high95.7Very high0 Ų038.2 Ų38.20%023%0.227CC..EExtended strand (participates in β ladder)trans-126.9124.5176.5-57.2-167000109.6I241 H289 S292 W299 I304 F306 L337 H338 V339I241-I252 HydrophobicContact CD1-CD1 3.83Å; I252-H289 WeakPolarHBondContact O-CB 3.13Å; I252-H289 PolarHBondContact O-N 3.42Å; I252-S292 PolarHBondContact N-OG 2.92Å; I252-S292 PolarHBondContact O-OG 2.92Å; I252-W299 HydrophobicContact CB-CH2 4.17Å; I252-W299 HydrophobicContact CB-CZ2 4.13Å; I252-W299 HydrophobicContact CB-CZ3 4.45Å; I252-W299 HydrophobicContact CD1-CB 3.91Å; I252-W299 HydrophobicContact CD1-CD2 3.43Å; I252-W299 VanDerWaalsContact CD1-CD2 3.43Å; I252-W299 HydrophobicContact CD1-CE3 3.88Å; I252-W299 HydrophobicContact CD1-CG 3.46Å; I252-W299 VanDerWaalsContact CD1-CG 3.46Å; I252-W299 HydrophobicContact CD1-CZ2 4.37Å; I252-W299 HydrophobicContact CD1-CZ3 4.5Å; I252-W299 HydrophobicContact CG1-CD2 3.99Å; I252-W299 HydrophobicContact CG1-CE3 4.46Å; I252-W299 HydrophobicContact CG1-CG 4.32Å; I252-W299 HydrophobicContact CG1-CH2 4.46Å; I252-W299 HydrophobicContact CG1-CZ2 4Å; I252-I304 HydrophobicContact CD1-CD1 3.95Å; I252-F306 HydrophobicContact CG2-CZ 4.23Å; I252-L337 HydrophobicContact CG2-CD1 3.75Å; I252-L337 HydrophobicContact CG2-CG 4.37Å; I252-H338 WeakPolarHBondContact CA-O 3.31Å; I252-V339 HydrophobicContact CD1-CG1 4.23Å; I252-V339 HydrophobicContact CD1-CG2 4.13Å; I252-V339 HydrophobicContact CG1-CG1 4.23Å; I252-V339 HydrophobicContact CG1-CG2 4.33Å
253F97.1Very high95.7Very high45 Ų4540.1 Ų40.120%0.19723%0.232CC..EExtended strand (participates in β ladder)trans-145.4162.1-175.264.5-98.7000112.6V286 Y287 M288 H338 V340F253-V286 HydrophobicContact CB-CG1 4.27Å; F253-V286 HydrophobicContact CD2-CG1 3.66Å; F253-V286 HydrophobicContact CE2-CG1 4.25Å; F253-V286 HydrophobicContact CG-CG1 4.16Å; F253-Y287 VanDerWaalsContact CA-O 3.31Å; F253-Y287 WeakPolarHBondContact CA-O 3.4Å; F253-Y287 VanDerWaalsContact CB-O 3.3Å; F253-Y287 WeakPolarHBondContact CB-O 3.49Å; F253-M288 HydrophobicContact CB-SD 4.16Å; F253-M288 HydrophobicContact CD1-SD 4.33Å; F253-H338 HydrophobicContact CD1-CB 4.23Å; F253-H338 HydrophobicContact CD2-CB 3.85Å; F253-H338 AromaticContact CD2-CD2 3.65Å; F253-H338 AromaticContact CD2-CG 3.96Å; F253-H338 HydrophobicContact CE1-CB 3.92Å; F253-H338 HydrophobicContact CE2-CB 3.5Å; F253-H338 AromaticContact CE2-CD2 3.37Å; F253-H338 WeakPolarHBondContact CE2-CD2 3.48Å; F253-H338 AromaticContact CE2-CG 3.41Å; F253-H338 VanDerWaalsContact CE2-CG 3.41Å; F253-H338 HydrophobicContact CG-CB 4.21Å; F253-H338 HydrophobicContact CZ-CB 3.54Å; F253-H338 AromaticContact CZ-CG 3.81Å; F253-H338 PolarHBondContact N-O 3.09Å; F253-H338 VanDerWaalsContact N-O 3.08Å; F253-H338 PolarHBondContact O-N 3.38Å; F253-V340 HydrophobicContact CE1-CG2 3.6Å; F253-V340 HydrophobicContact CZ-CG2 4.15Å
254V97.8Very high95.9Very high0 Ų040.7 Ų40.70%023%0.226CC..EExtended strand (participates in β ladder)trans-114.5132.9173.3166.90000109.3L237 F239 V256 V286 Y287 F306 L309 P335 R336 L337L237-V254 HydrophobicContact CD1-CG1 3.91Å; L237-V254 HydrophobicContact CD1-CG2 4.37Å; F239-V254 HydrophobicContact CE2-CG2 4.47Å; V254-V256 HydrophobicContact CG1-CG2 4.29Å; V254-V286 CarbonylContact O-C 3.6Å; V254-V286 WeakPolarHBondContact O-CA 3.38Å; V254-Y287 PolarHBondContact N-O 2.83Å; V254-Y287 PolarHBondContact O-N 2.91Å; V254-F306 HydrophobicContact CB-CD1 4.29Å; V254-F306 HydrophobicContact CB-CE1 4.18Å; V254-F306 HydrophobicContact CG2-CD1 3.82Å; V254-F306 HydrophobicContact CG2-CD2 4.13Å; V254-F306 HydrophobicContact CG2-CE1 3.66Å; V254-F306 HydrophobicContact CG2-CE2 3.98Å; V254-F306 HydrophobicContact CG2-CG 4.06Å; V254-F306 HydrophobicContact CG2-CZ 3.74Å; V254-L309 HydrophobicContact CB-CD1 4.37Å; V254-L309 HydrophobicContact CG1-CD1 4.31Å; V254-P335 HydrophobicContact CG1-CB 4.32Å; V254-R336 VanDerWaalsContact CA-O 3.28Å; V254-R336 WeakPolarHBondContact CA-O 3.25Å; V254-L337 HydrophobicContact CG2-CD1 3.8Å
255D96.4Very high96Very high20 Ų2045.5 Ų45.511%0.10724%0.244CC..EExtended strand (participates in β ladder)trans-105.1158160.985.1-32.7000111I257 R285 V286 P335 R336 H338D255-I257 VanDerWaalsContact OD2-CG2 3.28Å; D255-I257 WeakPolarHBondContact OD2-CG2 3.45Å; D255-R285 WeakPolarHBondContact CA-O 3.42Å; D255-V286 HydrophobicContact CB-CG2 4.1Å; D255-P335 WeakPolarHBondContact O-CA 3.36Å; D255-R336 PolarHBondContact N-O 3.07Å; D255-R336 VanDerWaalsContact N-O 3.07Å; D255-R336 PolarHBondContact O-N 2.84Å; D255-R336 VanDerWaalsContact OD1-CB 3.31Å; D255-R336 WeakPolarHBondContact OD1-CB 3.08Å; D255-R336 VanDerWaalsContact OD1-CD 3.3Å; D255-R336 WeakPolarHBondContact OD1-CD 3.43Å; D255-R336 IonicContact OD1-CZ 3.93Å; D255-R336 IonicContact OD1-NE 3.8Å; D255-R336 IonicContact OD1-NH1 3.46Å; D255-R336 PolarHBondContact OD1-NH1 3.46Å; D255-R336 IonicContact OD2-CZ 3.74Å; D255-R336 IonicContact OD2-NH1 3.81Å; D255-R336 PolarHBondContact OD2-NH1 2.95Å; D255-H338 VanDerWaalsContact CG-NE2 3.27Å; D255-H338 IonicContact OD1-CD2 3.58Å; D255-H338 IonicContact OD1-CE1 3.71Å; D255-H338 IonicContact OD1-NE2 3.86Å; D255-H338 PolarHBondContact OD1-NE2 3.22Å; D255-H338 IonicContact OD2-NE2 2.77Å
256V96.9Very high96.3Very high0 Ų044.2 Ų44.20%024%0.235CC..EExtended strand (participates in β ladder)trans-126103.8177.1-175.60000109.2V254 R285 V325 L327 Y333 F366V254-V256 HydrophobicContact CG1-CG2 4.29Å; V256-R285 PolarHBondContact N-O 2.8Å; V256-R285 VanDerWaalsContact N-O 3.11Å; V256-R285 PolarHBondContact O-NH1 3.32Å; V256-V325 HydrophobicContact CB-CG1 3.93Å; V256-V325 HydrophobicContact CG2-CG1 3.95Å; V256-L327 HydrophobicContact CB-CD2 4.25Å; V256-L327 HydrophobicContact CG1-CD1 4.47Å; V256-L327 HydrophobicContact CG1-CD2 3.74Å; V256-Y333 HydrophobicContact CG1-CD1 3.95Å; V256-Y333 HydrophobicContact CG1-CG 4.02Å; V256-F366 HydrophobicContact CG1-CE1 4.31Å; V256-F366 HydrophobicContact CG1-CZ 4.09Å
257I95.8Very high96.3Very high58 Ų5845.3 Ų45.330%0.29723%0.234SC..EExtended strand (participates in β ladder)trans-95.7160.9178.864.2164.3000111.2D255 Y333 Q334D255-I257 VanDerWaalsContact OD2-CG2 3.28Å; D255-I257 WeakPolarHBondContact OD2-CG2 3.45Å; I257-Y333 CarbonylContact O-C 3.42Å; I257-Y333 VanDerWaalsContact O-CA 3.22Å; I257-Y333 WeakPolarHBondContact O-CA 3.38Å; I257-Y333 WeakPolarHBondContact O-CB 3.25Å; I257-Y333 WeakPolarHBondContact O-CD1 3.41Å; I257-Q334 HydrophobicContact CG1-CB 4.07Å; I257-Q334 WeakPolarHBondContact CG1-O 3.12Å; I257-Q334 PolarHBondContact N-O 3.08Å; I257-Q334 VanDerWaalsContact N-O 3.09Å; I257-Q334 PolarHBondContact O-N 3.21Å
258L96.2Very high96.3Very high41 Ų4144.3 Ų44.322%0.21524%0.244CC..EExtended strand (participates in β ladder)trans-66.1138.1167.5-75.1167.7000109.2A277 V281 H331 Y333L258-A277 HydrophobicContact CD1-CB 4.39Å; L258-V281 HydrophobicContact CD1-CG2 4.01Å; L258-H331 HydrophobicContact CD2-CB 3.97Å; L258-Y333 HydrophobicContact CD2-CD1 4.01Å; L258-Y333 HydrophobicContact CD2-CE1 3.48Å; L258-Y333 VanDerWaalsContact CD2-CE1 3.48Å; L258-Y333 HydrophobicContact CG-CD1 4.47Å; L258-Y333 HydrophobicContact CG-CE1 4.08Å
259A96.6Very high96.4Very high38 Ų3846.1 Ų46.131%0.31426%0.264SS..EExtended strand (participates in β ladder)trans-89-26.2177.600000112.7K332 Q334A259-K332 HydrophobicContact CB-CB 4.27Å; A259-K332 HydrophobicContact CB-CD 4.1Å; A259-K332 HydrophobicContact CB-CG 4.01Å; A259-K332 PolarHBondContact N-O 3.28Å; A259-Q334 HydrophobicContact CB-CB 4.2Å
260D95.3Very high96.6Very high29 Ų2949.2 Ų49.216%0.15528%0.277CS..EExtended strand (participates in β ladder)trans-153.7160.9175.767.675.3000110.5N262 W264 K332D260-N262 VanDerWaalsContact C-N 3.27Å; D260-N262 PolarHBondContact O-N 2.86Å; D260-N262 VanDerWaalsContact OD1-CB 3.29Å; D260-N262 WeakPolarHBondContact OD1-CB 3.31Å; D260-N262 PolarHBondContact OD1-N 2.99Å; D260-N262 PolarHBondContact OD1-ND2 2.88Å; D260-W264 PolarHBondContact OD1-NE1 3.23Å; D260-W264 WeakPolarHBondContact OD2-CZ2 3.42Å; D260-W264 PolarHBondContact OD2-NE1 3.23Å; D260-K332 VanDerWaalsContact OD2-CB 3.32Å; D260-K332 WeakPolarHBondContact OD2-CB 3.22Å; D260-K332 WeakPolarHBondContact OD2-CD 3.3Å
261P95.2Very high96.7Very high79 Ų7949.8 Ų49.851%0.51328%0.279SS..EExtended strand (participates in β ladder)trans-89.124.9-174.637.4-37.6000113.3K276 A277P261-K276 WeakPolarHBondContact O-CA 3.26Å; P261-K276 WeakPolarHBondContact O-CD 3.43Å; P261-A277 PolarHBondContact O-N 3.13Å
262N96.2Very high96.7Very high38 Ų3850.1 Ų50.120%0.20328%0.282CS..EExtended strand (participates in β ladder)trans-106.4144.8-177-45.2-71.6000111.7D260 W264 P273 G275D260-N262 VanDerWaalsContact C-N 3.27Å; D260-N262 PolarHBondContact O-N 2.86Å; D260-N262 VanDerWaalsContact OD1-CB 3.29Å; D260-N262 WeakPolarHBondContact OD1-CB 3.31Å; D260-N262 PolarHBondContact OD1-N 2.99Å; D260-N262 PolarHBondContact OD1-ND2 2.88Å; N262-W264 VanDerWaalsContact O-CD1 3.25Å; N262-P273 HydrophobicContact CB-CB 4.05Å; N262-G275 WeakPolarHBondContact CA-O 3.29Å
263H96.7Very high96.8Very high67 Ų6753.7 Ų53.731%0.3131%0.306SS..EExtended strand (participates in β ladder)trans-86.1134.1160.2-174.8-150.6000107.4C274 G275 L330 H331H263-C274 PolarHBondContact O-N 3.02Å; H263-C274 PolarHBondContact O-SG 3.2Å; H263-G275 PolarHBondContact N-O 3.31Å; H263-G275 PolarHBondContact O-N 3.36Å; H263-L330 PolarHBondContact CD2-O 3.02Å; H263-H331 AromaticContact CD2-CE1 3.54Å; H263-H331 AromaticContact CD2-ND1 3.95Å
264W98Very high96.7Very high37 Ų3754.1 Ų54.114%0.1431%0.314CS..EExtended strand (participates in β ladder)trans-111.4159.3-171.2-69.783.6000112.4D260 N262 W271 V272 L330D260-W264 PolarHBondContact OD1-NE1 3.23Å; D260-W264 WeakPolarHBondContact OD2-CZ2 3.42Å; D260-W264 PolarHBondContact OD2-NE1 3.23Å; N262-W264 VanDerWaalsContact O-CD1 3.25Å; W264-W271 HydrophobicContact CB-CE3 3.87Å; W264-W271 HydrophobicContact CB-CZ3 4.05Å; W264-W271 HydrophobicContact CE3-CB 3.94Å; W264-W271 HydrophobicContact CZ3-CB 4.2Å; W264-V272 CarbonylContact C-O 3.58Å; W264-L330 WeakPolarHBondContact CB-O 3.42Å; W264-L330 PolarHBondContact N-O 2.95Å; W264-L330 WeakPolarHBondContact O-CB 3.41Å
265R97.9Very high96.5Very high112 Ų11255.8 Ų55.842%0.42333%0.33SS..EExtended strand (participates in β ladder)trans-143.9150.9167.166.3-174.5-174.5-1629.2110.5Q267 V272 C274R265-Q267 HydrophobicContact CG-CG 4.17Å; R265-V272 HydrophobicContact CG-CG2 3.61Å; R265-V272 PolarHBondContact N-O 2.77Å; R265-V272 PolarHBondContact O-N 3.26Å; R265-C274 HydrophobicContact CB-CB 4.37Å; R265-C274 HydrophobicContact CG-CB 3.82Å
266F98.2Very high96.4Very high46 Ų4662.2 Ų62.220%0.20236%0.357CS..EExtended strand (participates in β ladder)trans-95.6121.2174-165-111.4000109.7G269 K270 W271 Q373 N374F266-G269 VanDerWaalsContact CE2-C 3.46Å; F266-G269 WeakPolarHBondContact CZ-O 3.24Å; F266-K270 WeakPolarHBondContact CA-O 3.31Å; F266-K270 VanDerWaalsContact CD2-C 3.49Å; F266-W271 HydrophobicContact CB-CD2 4.22Å; F266-W271 HydrophobicContact CB-CE3 4.18Å; F266-W271 HydrophobicContact CB-CH2 4.36Å; F266-W271 HydrophobicContact CB-CZ2 4.35Å; F266-W271 HydrophobicContact CB-CZ3 4.26Å; F266-W271 AromaticContact CD2-CD1 3.64Å; F266-W271 AromaticContact CD2-CD2 3.87Å; F266-W271 HydrophobicContact CD2-CD2 3.87Å; F266-W271 AromaticContact CD2-CE2 3.81Å; F266-W271 AromaticContact CD2-CG 3.81Å; F266-W271 HydrophobicContact CD2-CG 3.81Å; F266-W271 AromaticContact CD2-NE1 3.61Å; F266-W271 AromaticContact CE2-CD1 3.93Å; F266-W271 HydrophobicContact CE2-CG 4.47Å; F266-W271 AromaticContact CE2-NE1 4Å; F266-Q373 HydrophobicContact CB-CB 3.59Å; F266-Q373 HydrophobicContact CB-CG 4.07Å; F266-Q373 HydrophobicContact CD1-CB 3.75Å; F266-Q373 HydrophobicContact CD2-CB 4.37Å; F266-Q373 HydrophobicContact CE1-CB 4.49Å; F266-Q373 VanDerWaalsContact CE1-O 3.27Å; F266-Q373 WeakPolarHBondContact CE1-O 3.44Å; F266-Q373 HydrophobicContact CG-CB 3.67Å; F266-N374 HydrophobicContact CE1-CB 4.47Å; F266-N374 HydrophobicContact CE2-CB 4.13Å; F266-N374 HydrophobicContact CZ-CB 3.83Å
267Q96.7Very high95.9Very high97 Ų9762.8 Ų62.845%0.45336%0.362SS..EExtended strand (participates in β ladder)trans-147.5138.5-179.3-71.3-172.1-30.500110.2R265 G269 K270R265-Q267 HydrophobicContact CG-CG 4.17Å; Q267-G269 PolarHBondContact O-N 2.88Å; Q267-K270 PolarHBondContact N-O 2.98Å; Q267-K270 PolarHBondContact O-N 2.82Å
268G95.3Very high95.2Very high83 Ų8363.1 Ų63.186%0.85637%0.365SS*.THydrogen-bonded Turntrans57.635178.900000113.9K270G268-K270 VanDerWaalsContact C-N 3.28Å; G268-K270 PolarHBondContact O-N 2.8Å
269G95.3Very high94.3Very high55 Ų5567.3 Ų67.357%0.56739%0.392SS*.THydrogen-bonded Turntrans72.911.3-176.500000115.2F266 Q267F266-G269 VanDerWaalsContact CE2-C 3.46Å; F266-G269 WeakPolarHBondContact CZ-O 3.24Å; Q267-G269 PolarHBondContact O-N 2.88Å
270K96.9Very high93.2Very high146 Ų14670.3 Ų70.364%0.63540%0.403SS*.EExtended strand (participates in β ladder)trans-134145.8-174.6-63.1178.9-176.4177.10112F266 Q267 G268F266-K270 WeakPolarHBondContact CA-O 3.31Å; F266-K270 VanDerWaalsContact CD2-C 3.49Å; Q267-K270 PolarHBondContact N-O 2.98Å; Q267-K270 PolarHBondContact O-N 2.82Å; G268-K270 VanDerWaalsContact C-N 3.28Å; G268-K270 PolarHBondContact O-N 2.8Å
271W98.2Very high91.9Very high14 Ų1470.2 Ų70.25%0.05340%0.403CS..EExtended strand (participates in β ladder)trans-78.6125.3168.1-76.2102.1000110.3E223 W264 F266 L330 I367 V369 Q373E223-W271 HydrophobicContact CG-CZ2 4.09Å; W264-W271 HydrophobicContact CB-CE3 3.87Å; W264-W271 HydrophobicContact CB-CZ3 4.05Å; W264-W271 HydrophobicContact CE3-CB 3.94Å; W264-W271 HydrophobicContact CZ3-CB 4.2Å; F266-W271 HydrophobicContact CB-CD2 4.22Å; F266-W271 HydrophobicContact CB-CE3 4.18Å; F266-W271 HydrophobicContact CB-CH2 4.36Å; F266-W271 HydrophobicContact CB-CZ2 4.35Å; F266-W271 HydrophobicContact CB-CZ3 4.26Å; F266-W271 AromaticContact CD2-CD1 3.64Å; F266-W271 AromaticContact CD2-CD2 3.87Å; F266-W271 HydrophobicContact CD2-CD2 3.87Å; F266-W271 AromaticContact CD2-CE2 3.81Å; F266-W271 AromaticContact CD2-CG 3.81Å; F266-W271 HydrophobicContact CD2-CG 3.81Å; F266-W271 AromaticContact CD2-NE1 3.61Å; F266-W271 AromaticContact CE2-CD1 3.93Å; F266-W271 HydrophobicContact CE2-CG 4.47Å; F266-W271 AromaticContact CE2-NE1 4Å; W271-L330 HydrophobicContact CH2-CD2 3.98Å; W271-L330 HydrophobicContact CZ3-CD2 4.06Å; W271-I367 HydrophobicContact CB-CD1 4.27Å; W271-I367 HydrophobicContact CD2-CD1 3.44Å; W271-I367 VanDerWaalsContact CD2-CD1 3.44Å; W271-I367 HydrophobicContact CE3-CD1 3.8Å; W271-I367 HydrophobicContact CG-CD1 3.67Å; W271-I367 HydrophobicContact CH2-CB 4.48Å; W271-I367 HydrophobicContact CH2-CD1 4.47Å; W271-I367 HydrophobicContact CH2-CG2 3.68Å; W271-I367 HydrophobicContact CZ2-CB 4.36Å; W271-I367 HydrophobicContact CZ2-CD1 4.2Å; W271-I367 HydrophobicContact CZ2-CG2 4.04Å; W271-I367 HydrophobicContact CZ3-CD1 4.29Å; W271-I367 HydrophobicContact CZ3-CG2 3.95Å; W271-V369 HydrophobicContact CH2-CG1 3.8Å; W271-V369 HydrophobicContact CZ2-CG1 4.04Å; W271-Q373 HydrophobicContact CH2-CB 4.24Å; W271-Q373 HydrophobicContact CH2-CG 3.62Å; W271-Q373 HydrophobicContact CZ2-CB 3.84Å; W271-Q373 HydrophobicContact CZ2-CG 3.67Å
272V97.7Very high91.1Very high47 Ų4771 Ų7129%0.28540%0.4SS..EExtended strand (participates in β ladder)trans-128.7144.1177.7-59.10000111W264 R265W264-V272 CarbonylContact C-O 3.58Å; R265-V272 HydrophobicContact CG-CG2 3.61Å; R265-V272 PolarHBondContact N-O 2.77Å; R265-V272 PolarHBondContact O-N 3.26Å
273P97.4Very high90.4Very high76 Ų7671.1 Ų71.149%0.49441%0.41SS..EExtended strand (participates in β ladder)trans-68.9143.3172.729.8-34.7000110.5N262N262-P273 HydrophobicContact CB-CB 4.05Å
274C95.8Very high90.1Very high54 Ų5470.3 Ų70.337%0.36541%0.408SS..EExtended strand (participates in β ladder)trans-133.2-4.9-177.467.70000114.4H263 R265H263-C274 PolarHBondContact O-N 3.02Å; H263-C274 PolarHBondContact O-SG 3.2Å; R265-C274 HydrophobicContact CB-CB 4.37Å; R265-C274 HydrophobicContact CG-CB 3.82Å
275G94.6Very high89.8Confident34 Ų3471.5 Ų71.535%0.35141%0.412SS..EExtended strand (participates in β ladder)trans-178.8-170.4178.400000111.4N262 H263N262-G275 WeakPolarHBondContact CA-O 3.29Å; H263-G275 PolarHBondContact N-O 3.31Å; H263-G275 PolarHBondContact O-N 3.36Å
276K92.7Very high89.6Confident155 Ų15568.9 Ų68.967%0.67441%0.409SS*.EExtended strand (participates in β ladder)trans-94.9150.3171.2-67.5-59.3-177.5-173.20111.4P261P261-K276 WeakPolarHBondContact O-CA 3.26Å; P261-K276 WeakPolarHBondContact O-CD 3.43Å
277A88.3Confident89.4Confident12 Ų1267.1 Ų67.110%0.09940%0.401CS..  trans-69.4143.4173.900000111.4L258 P261 T279 H331L258-A277 HydrophobicContact CD1-CB 4.39Å; P261-A277 PolarHBondContact O-N 3.13Å; A277-T279 PolarHBondContact O-N 3.17Å; A277-H331 VanDerWaalsContact CA-NE2 3.31Å; A277-H331 WeakPolarHBondContact CA-NE2 3.44Å; A277-H331 VanDerWaalsContact CB-CD2 3.42Å; A277-H331 WeakPolarHBondContact CB-CD2 3.5Å; A277-H331 WeakPolarHBondContact CB-NE2 3.45Å
278D80.9Confident89.4Confident66 Ų6667.2 Ų67.235%0.35340%0.403SS..  trans-69.1111.7166.6170.523.4000108.9N280 V281 K315 Q328D278-N280 PolarHBondContact O-N 2.94Å; D278-N280 VanDerWaalsContact OD1-CB 3.29Å; D278-N280 WeakPolarHBondContact OD1-CB 3.31Å; D278-N280 PolarHBondContact OD1-N 3.18Å; D278-V281 VanDerWaalsContact O-CG2 3.26Å; D278-V281 WeakPolarHBondContact O-CG2 3.42Å; D278-K315 IonicContact OD2-NZ 3.92Å; D278-Q328 PolarHBondContact OD2-NE2 2.89Å
279T75.5Confident89.4Confident129 Ų12963.8 Ų63.879%0.79136%0.364SS*.SBendtrans-74.1-17.3-178.4-53.20000111.7A277 V281A277-T279 PolarHBondContact O-N 3.17Å; T279-V281 PolarHBondContact O-N 2.92Å
280N75.3Confident89.5Confident101 Ų10164.6 Ų64.654%0.5436%0.36SS..  trans-80.762.2176.9-165.4-12.9000111.2D278 Q282D278-N280 PolarHBondContact O-N 2.94Å; D278-N280 VanDerWaalsContact OD1-CB 3.29Å; D278-N280 WeakPolarHBondContact OD1-CB 3.31Å; D278-N280 PolarHBondContact OD1-N 3.18Å; N280-Q282 PolarHBondContact O-N 2.9Å
281V68.2Low89.5Confident26 Ų2660.7 Ų60.716%0.15835%0.346CS..  trans-77.888.1-176.3-172.30000111L258 D278 T279 R285L258-V281 HydrophobicContact CD1-CG2 4.01Å; D278-V281 VanDerWaalsContact O-CG2 3.26Å; D278-V281 WeakPolarHBondContact O-CG2 3.42Å; T279-V281 PolarHBondContact O-N 2.92Å; V281-R285 VanDerWaalsContact CG2-NH2 3.33Å
282Q77Confident89.3Confident97 Ų9761.2 Ų61.245%0.45335%0.351SS..  trans-74.3137.3174-64.4156.7-14.300111.9N280 K315N280-Q282 PolarHBondContact O-N 2.9Å; Q282-K315 VanDerWaalsContact OE1-NZ 3.14Å
283G82.9Confident89.3Confident40 Ų4062.4 Ų62.441%0.41236%0.36SS..SBendtrans119.8170.8174.100000113.3R285G283-R285 PolarHBondContact O-N 3.47Å
284N88.5Confident89.3Confident49 Ų4960.8 Ų60.826%0.26235%0.347SS..  trans-69128.9179.6177.934.8000111.4V286 M324 V325 V326N284-V286 PolarHBondContact ND2-O 3.18Å; N284-V286 PolarHBondContact OD1-N 3.47Å; N284-V286 PolarHBondContact OD1-O 2.78Å; N284-M324 PolarHBondContact ND2-O 2.9Å; N284-V325 CarbonylContact O-C 3.47Å; N284-V325 WeakPolarHBondContact O-CA 3.37Å; N284-V326 PolarHBondContact O-N 3.01Å
285R91.8Very high89.3Confident62 Ų6259.9 Ų59.923%0.23434%0.34CS..  trans-104.3-10.3174.5-74-174.3177.3-97.419.4114.5D255 V256 V281 G283D255-R285 WeakPolarHBondContact CA-O 3.42Å; V256-R285 PolarHBondContact N-O 2.8Å; V256-R285 VanDerWaalsContact N-O 3.11Å; V256-R285 PolarHBondContact O-NH1 3.32Å; V281-R285 VanDerWaalsContact CG2-NH2 3.33Å; G283-R285 PolarHBondContact O-N 3.47Å
286V93.9Very high89.4Confident58 Ų5858.2 Ų58.235%0.35232%0.323SS..EExtended strand (participates in β ladder)trans-112.7139.1-167.9-179.20000110.8F253 V254 D255 N284F253-V286 HydrophobicContact CB-CG1 4.27Å; F253-V286 HydrophobicContact CD2-CG1 3.66Å; F253-V286 HydrophobicContact CE2-CG1 4.25Å; F253-V286 HydrophobicContact CG-CG1 4.16Å; V254-V286 CarbonylContact O-C 3.6Å; V254-V286 WeakPolarHBondContact O-CA 3.38Å; D255-V286 HydrophobicContact CB-CG2 4.1Å; N284-V286 PolarHBondContact ND2-O 3.18Å; N284-V286 PolarHBondContact OD1-N 3.47Å; N284-V286 PolarHBondContact OD1-O 2.78Å
287Y95.5Very high89.6Confident9 Ų952.4 Ų52.44%0.03530%0.304CS..EExtended strand (participates in β ladder)trans-124.8112.4171.3-179.8-83.4000109.5F253 V254 F306 K308 L309 Q323F253-Y287 VanDerWaalsContact CA-O 3.31Å; F253-Y287 WeakPolarHBondContact CA-O 3.4Å; F253-Y287 VanDerWaalsContact CB-O 3.3Å; F253-Y287 WeakPolarHBondContact CB-O 3.49Å; V254-Y287 PolarHBondContact N-O 2.83Å; V254-Y287 PolarHBondContact O-N 2.91Å; Y287-F306 AromaticContact CD1-CD1 3.54Å; Y287-F306 HydrophobicContact CD1-CD1 3.54Å; Y287-F306 AromaticContact CD1-CE1 3.9Å; Y287-F306 HydrophobicContact CD1-CE1 3.9Å; Y287-F306 AromaticContact CE1-CD1 3.78Å; Y287-F306 HydrophobicContact CE1-CD1 3.78Å; Y287-F306 HydrophobicContact CE1-CE1 4.28Å; Y287-K308 WeakPolarHBondContact OH-CB 3.47Å; Y287-L309 HydrophobicContact CD1-CB 4.16Å; Y287-L309 HydrophobicContact CD1-CD1 3.95Å; Y287-L309 HydrophobicContact CD1-CG 4.12Å; Y287-L309 HydrophobicContact CD2-CB 3.99Å; Y287-L309 HydrophobicContact CD2-CD1 4.37Å; Y287-L309 HydrophobicContact CD2-CG 3.76Å; Y287-L309 HydrophobicContact CE1-CB 4.21Å; Y287-L309 HydrophobicContact CE2-CB 4.05Å; Y287-L309 HydrophobicContact CE2-CG 4.34Å; Y287-L309 HydrophobicContact CG-CB 4.04Å; Y287-L309 HydrophobicContact CG-CD1 3.73Å; Y287-L309 HydrophobicContact CG-CG 3.64Å; Y287-Q323 WeakPolarHBondContact CD2-O 3.46Å; Y287-Q323 HydrophobicContact CE2-CB 4.26Å; Y287-Q323 WeakPolarHBondContact CE2-O 3.43Å
288M95.4Very high90.1Very high99 Ų9953.8 Ų53.849%0.48831%0.308SS..EExtended strand (participates in β ladder)trans-70.7134.1171.9-162.782.885.300109.8N251 F253N251-M288 HydrophobicContact CB-SD 4.38Å; F253-M288 HydrophobicContact CB-SD 4.16Å; F253-M288 HydrophobicContact CD1-SD 4.33Å
289H96.7Very high90.9Very high11 Ų1150.8 Ų50.85%0.05129%0.292CS..  trans-65.1131168.8-168.7-88.9000108.8I252 D291 S292 W299 S305 F306I252-H289 WeakPolarHBondContact O-CB 3.13Å; I252-H289 PolarHBondContact O-N 3.42Å; H289-D291 VanDerWaalsContact CE1-CG 3.44Å; H289-D291 IonicContact CE1-OD1 3.94Å; H289-D291 IonicContact CE1-OD2 4Å; H289-D291 PolarHBondContact ND1-N 3.06Å; H289-D291 IonicContact ND1-OD1 3.27Å; H289-D291 PolarHBondContact O-N 2.79Å; H289-S292 VanDerWaalsContact O-CB 3.25Å; H289-S292 WeakPolarHBondContact O-CB 3.29Å; H289-S292 PolarHBondContact O-N 2.94Å; H289-S292 PolarHBondContact O-OG 3.07Å; H289-W299 HydrophobicContact CB-CH2 4.04Å; H289-W299 HydrophobicContact CB-CZ3 4.38Å; H289-W299 AromaticContact CE1-CZ3 3.93Å; H289-W299 AromaticContact CG-CH2 3.97Å; H289-W299 AromaticContact CG-CZ3 3.92Å; H289-W299 AromaticContact ND1-CH2 3.48Å; H289-W299 WeakPolarHBondContact ND1-CH2 3.42Å; H289-W299 AromaticContact ND1-CZ3 3.38Å; H289-W299 WeakPolarHBondContact ND1-CZ3 3.43Å; H289-S305 PolarHBondContact NE2-O 3.11Å; H289-F306 HydrophobicContact CB-CE1 3.94Å; H289-F306 HydrophobicContact CB-CZ 3.94Å
290P95.6Very high92Very high72 Ų7247.6 Ų47.647%0.46827%0.269SS..THydrogen-bonded Turntrans-62.2-20.6-17023.7-35.4000114.5S292P290-S292 VanDerWaalsContact C-N 3.26Å; P290-S292 PolarHBondContact O-N 2.83Å
291D96.8Very high93.1Very high64 Ų6450.5 Ų50.534%0.34227%0.272SS..THydrogen-bonded Turntrans-84.12.7178.7-52.211.5000112.8H289 P293 N294 H298 W299H289-D291 VanDerWaalsContact CE1-CG 3.44Å; H289-D291 IonicContact CE1-OD1 3.94Å; H289-D291 IonicContact CE1-OD2 4Å; H289-D291 PolarHBondContact ND1-N 3.06Å; H289-D291 IonicContact ND1-OD1 3.27Å; H289-D291 PolarHBondContact O-N 2.79Å; D291-P293 CarbonylContact O-C 3.58Å; D291-N294 WeakPolarHBondContact O-CB 3.47Å; D291-N294 PolarHBondContact O-ND2 3.43Å; D291-H298 IonicContact OD2-CE1 3.73Å; D291-H298 IonicContact OD2-NE2 3.52Å; D291-H298 PolarHBondContact OD2-NE2 3.27Å; D291-W299 HydrophobicContact CB-CH2 3.91Å; D291-W299 HydrophobicContact CB-CZ3 4.2Å
292S95.5Very high94.4Very high24 Ų2455.8 Ų55.817%0.16830%0.295CS..  trans-85144-179.1-51.20000112.8I252 H289 P290 W299I252-S292 PolarHBondContact N-OG 2.92Å; I252-S292 PolarHBondContact O-OG 2.92Å; H289-S292 VanDerWaalsContact O-CB 3.25Å; H289-S292 WeakPolarHBondContact O-CB 3.29Å; H289-S292 PolarHBondContact O-N 2.94Å; H289-S292 PolarHBondContact O-OG 3.07Å; P290-S292 VanDerWaalsContact C-N 3.26Å; P290-S292 PolarHBondContact O-N 2.83Å; S292-W299 WeakPolarHBondContact OG-CH2 3.28Å
293P96Very high95.4Very high73 Ų7354.5 Ų54.547%0.47429%0.289SS..SBendcis-74.4152.5-8.131.2-35.5000111.9Y250 N251 D291 V342Y250-P293 WeakPolarHBondContact O-CA 3.32Å; N251-P293 WeakPolarHBondContact OD1-CA 3.3Å; N251-P293 WeakPolarHBondContact OD1-CB 3.45Å; D291-P293 CarbonylContact O-C 3.58Å; P293-V342 HydrophobicContact CB-CG2 4.21Å
294N97.6Very high96.1Very high42 Ų4253 Ų5323%0.22527%0.271CS..EExtended strand (participates in β ladder)trans-147.5159173.3-131.4-65000113.2H249 Y250 D291 H298 W299H249-N294 CarbonylContact C-O 3.58Å; H249-N294 WeakPolarHBondContact CA-O 3.22Å; Y250-N294 PolarHBondContact N-O 2.95Å; Y250-N294 PolarHBondContact O-N 2.8Å; D291-N294 WeakPolarHBondContact O-CB 3.47Å; D291-N294 PolarHBondContact O-ND2 3.43Å; N294-H298 HydrophobicContact CB-CB 3.93Å; N294-H298 VanDerWaalsContact CG-CG 3.43Å; N294-H298 WeakPolarHBondContact OD1-CB 3.38Å; N294-W299 HydrophobicContact CB-CD2 4.43Å; N294-W299 HydrophobicContact CB-CZ2 3.84Å; N294-W299 PolarHBondContact O-NE1 3.31Å
295T96.6Very high96.6Very high34 Ų3452.8 Ų52.821%0.20927%0.274CS..EExtended strand (participates in β ladder)trans-54.7147.517454.60000112.3A248 A297 H298 W299A248-T295 CarbonylContact O-C 3.58Å; A248-T295 WeakPolarHBondContact O-CA 3.4Å; T295-A297 PolarHBondContact O-N 3.27Å; T295-H298 WeakPolarHBondContact O-CA 3.49Å; T295-H298 VanDerWaalsContact O-CB 3.31Å; T295-H298 WeakPolarHBondContact O-CB 3.13Å; T295-H298 PolarHBondContact O-N 2.89Å; T295-H298 PolarHBondContact OG1-N 2.82Å; T295-W299 PolarHBondContact O-N 2.8Å
296G96.5Very high96.9Very high0 Ų050 Ų500%026%0.264CS..Hα-helixtrans-59.1-31.1171.500000112.3D245 A248 H298 W299 M300D245-G296 VanDerWaalsContact O-CA 3.28Å; D245-G296 WeakPolarHBondContact O-CA 3.46Å; A248-G296 PolarHBondContact O-N 2.88Å; G296-H298 PolarHBondContact O-N 3.14Å; G296-W299 PolarHBondContact O-N 2.68Å; G296-M300 WeakPolarHBondContact O-CB 3.31Å; G296-M300 WeakPolarHBondContact O-CG 3.46Å; G296-M300 PolarHBondContact O-N 2.9Å
297A97.8Very high97Very high32 Ų3248.2 Ų48.226%0.26426%0.257SS..Hα-helixtrans-61.3-26.9169.800000113.7P246 T295 R301P246-A297 HydrophobicContact CB-CB 4.15Å; P246-A297 WeakPolarHBondContact O-CB 3.41Å; P246-A297 PolarHBondContact O-N 3.46Å; T295-A297 PolarHBondContact O-N 3.27Å; A297-R301 VanDerWaalsContact O-CG 3.24Å; A297-R301 WeakPolarHBondContact O-CG 3.28Å; A297-R301 PolarHBondContact O-NH1 3.18Å; A297-R301 VanDerWaalsContact O-NH1 3.13Å
298H98.3Very high97Very high41 Ų4153.8 Ų53.819%0.1928%0.281CS..Hα-helixtrans-73.8-48.4171.6-17892.8000111.8D291 N294 T295 G296 M300 R301D291-H298 IonicContact OD2-CE1 3.73Å; D291-H298 IonicContact OD2-NE2 3.52Å; D291-H298 PolarHBondContact OD2-NE2 3.27Å; N294-H298 HydrophobicContact CB-CB 3.93Å; N294-H298 VanDerWaalsContact CG-CG 3.43Å; N294-H298 WeakPolarHBondContact OD1-CB 3.38Å; T295-H298 WeakPolarHBondContact O-CA 3.49Å; T295-H298 VanDerWaalsContact O-CB 3.31Å; T295-H298 WeakPolarHBondContact O-CB 3.13Å; T295-H298 PolarHBondContact O-N 2.89Å; T295-H298 PolarHBondContact OG1-N 2.82Å; G296-H298 PolarHBondContact O-N 3.14Å; H298-M300 VanDerWaalsContact C-N 3.29Å; H298-M300 PolarHBondContact O-N 3.41Å; H298-R301 VanDerWaalsContact CA-CZ 3.45Å; H298-R301 VanDerWaalsContact CA-NH2 3.33Å; H298-R301 VanDerWaalsContact CB-NH2 3.33Å; H298-R301 PolarHBondContact ND1-NH2 3.11Å; H298-R301 PolarHBondContact O-N 2.99Å
299W98.3Very high97Very high3 Ų349.1 Ų49.11%0.01126%0.258CS..Hα-helixtrans-67.2-28.3-177.6-59.9122.2000113.7L244 Y250 I252 H289 D291 S292 N294 T295 G296 I304L244-W299 HydrophobicContact CD1-CB 3.76Å; L244-W299 HydrophobicContact CD1-CG 4.41Å; Y250-W299 PolarHBondContact O-NE1 3.21Å; I252-W299 HydrophobicContact CB-CH2 4.17Å; I252-W299 HydrophobicContact CB-CZ2 4.13Å; I252-W299 HydrophobicContact CB-CZ3 4.45Å; I252-W299 HydrophobicContact CD1-CB 3.91Å; I252-W299 HydrophobicContact CD1-CD2 3.43Å; I252-W299 VanDerWaalsContact CD1-CD2 3.43Å; I252-W299 HydrophobicContact CD1-CE3 3.88Å; I252-W299 HydrophobicContact CD1-CG 3.46Å; I252-W299 VanDerWaalsContact CD1-CG 3.46Å; I252-W299 HydrophobicContact CD1-CZ2 4.37Å; I252-W299 HydrophobicContact CD1-CZ3 4.5Å; I252-W299 HydrophobicContact CG1-CD2 3.99Å; I252-W299 HydrophobicContact CG1-CE3 4.46Å; I252-W299 HydrophobicContact CG1-CG 4.32Å; I252-W299 HydrophobicContact CG1-CH2 4.46Å; I252-W299 HydrophobicContact CG1-CZ2 4Å; H289-W299 HydrophobicContact CB-CH2 4.04Å; H289-W299 HydrophobicContact CB-CZ3 4.38Å; H289-W299 AromaticContact CE1-CZ3 3.93Å; H289-W299 AromaticContact CG-CH2 3.97Å; H289-W299 AromaticContact CG-CZ3 3.92Å; H289-W299 AromaticContact ND1-CH2 3.48Å; H289-W299 WeakPolarHBondContact ND1-CH2 3.42Å; H289-W299 AromaticContact ND1-CZ3 3.38Å; H289-W299 WeakPolarHBondContact ND1-CZ3 3.43Å; D291-W299 HydrophobicContact CB-CH2 3.91Å; D291-W299 HydrophobicContact CB-CZ3 4.2Å; S292-W299 WeakPolarHBondContact OG-CH2 3.28Å; N294-W299 HydrophobicContact CB-CD2 4.43Å; N294-W299 HydrophobicContact CB-CZ2 3.84Å; N294-W299 PolarHBondContact O-NE1 3.31Å; T295-W299 PolarHBondContact O-N 2.8Å; G296-W299 PolarHBondContact O-N 2.68Å; W299-I304 HydrophobicContact CB-CD1 4.03Å; W299-I304 HydrophobicContact CD2-CD1 4.3Å; W299-I304 HydrophobicContact CE3-CD1 3.64Å; W299-I304 HydrophobicContact CE3-CG1 3.97Å; W299-I304 HydrophobicContact CE3-CG2 4.23Å; W299-I304 HydrophobicContact CZ3-CD1 4.43Å; W299-I304 HydrophobicContact CZ3-CG2 4Å
300M97.8Very high97Very high63 Ų6352.1 Ų52.131%0.3127%0.271SS..THydrogen-bonded Turntrans-87.8-5.3176-61.8-171.2-69.700114.2I241 G243 L244 P246 G296 H298I241-M300 WeakPolarHBondContact O-CG 3.28Å; G243-M300 PolarHBondContact N-SD 2.95Å; G243-M300 VanDerWaalsContact N-SD 3.42Å; L244-M300 HydrophobicContact CB-CE 4.02Å; L244-M300 HydrophobicContact CB-CG 4.35Å; L244-M300 HydrophobicContact CB-SD 3.95Å; L244-M300 HydrophobicContact CD1-CG 4.25Å; L244-M300 HydrophobicContact CG-CG 4.32Å; L244-M300 HydrophobicContact CG-SD 4.37Å; L244-M300 PolarHBondContact N-SD 3.21Å; L244-M300 VanDerWaalsContact O-CE 3.24Å; L244-M300 WeakPolarHBondContact O-CE 3.46Å; P246-M300 HydrophobicContact CG-CE 4.21Å; G296-M300 WeakPolarHBondContact O-CB 3.31Å; G296-M300 WeakPolarHBondContact O-CG 3.46Å; G296-M300 PolarHBondContact O-N 2.9Å; H298-M300 VanDerWaalsContact C-N 3.29Å; H298-M300 PolarHBondContact O-N 3.41Å
301R97.6Very high97Very high161 Ų16148.7 Ų48.761%0.60825%0.249SC*.SBendtrans-75.2-29.6-177.8-99.5-174.8-49-104.314.6114.2A297 H298A297-R301 VanDerWaalsContact O-CG 3.24Å; A297-R301 WeakPolarHBondContact O-CG 3.28Å; A297-R301 PolarHBondContact O-NH1 3.18Å; A297-R301 VanDerWaalsContact O-NH1 3.13Å; H298-R301 VanDerWaalsContact CA-CZ 3.45Å; H298-R301 VanDerWaalsContact CA-NH2 3.33Å; H298-R301 VanDerWaalsContact CB-NH2 3.33Å; H298-R301 PolarHBondContact ND1-NH2 3.11Å; H298-R301 PolarHBondContact O-N 2.99Å
302Q96.7Very high97Very high137 Ų13745.7 Ų45.764%0.6423%0.233SC*.SBendtrans-162.3174-17258.81677000112.4I304Q302-I304 PolarHBondContact O-N 2.93Å
303E97.9Very high96.9Very high71 Ų7148 Ų4833%0.33224%0.243SC..  trans-62.4129.2174.2-173.2176.9124.300111.9C209 S238 N240C209-E303 HydrophobicContact CB-CG 4.24Å; C209-E303 WeakPolarHBondContact CB-OE2 3.29Å; C209-E303 PolarHBondContact SG-OE2 3.49Å; S238-E303 WeakPolarHBondContact CB-OE1 3.45Å; S238-E303 PolarHBondContact OG-OE1 2.82Å; N240-E303 VanDerWaalsContact OD1-CA 3.26Å; N240-E303 WeakPolarHBondContact OD1-CA 3.48Å; N240-E303 WeakPolarHBondContact OD1-CB 3.26Å; N240-E303 PolarHBondContact OD1-N 2.96Å
304I98.4Very high96.6Very high7 Ų747.1 Ų47.14%0.03623%0.234CC..EExtended strand (participates in β ladder)trans-92.1114.7178.2-53.3174.1000108.3S238 F239 I241 I252 W299 Q302 F306S238-I304 CarbonylContact C-O 3.53Å; S238-I304 VanDerWaalsContact CA-O 3.31Å; S238-I304 WeakPolarHBondContact CA-O 3.42Å; F239-I304 PolarHBondContact N-O 3.44Å; F239-I304 PolarHBondContact O-N 3.24Å; I241-I304 HydrophobicContact CB-CD1 4.39Å; I241-I304 HydrophobicContact CD1-CD1 3.48Å; I241-I304 VanDerWaalsContact CD1-CD1 3.48Å; I241-I304 HydrophobicContact CG1-CD1 3.76Å; I252-I304 HydrophobicContact CD1-CD1 3.95Å; W299-I304 HydrophobicContact CB-CD1 4.03Å; W299-I304 HydrophobicContact CD2-CD1 4.3Å; W299-I304 HydrophobicContact CE3-CD1 3.64Å; W299-I304 HydrophobicContact CE3-CG1 3.97Å; W299-I304 HydrophobicContact CE3-CG2 4.23Å; W299-I304 HydrophobicContact CZ3-CD1 4.43Å; W299-I304 HydrophobicContact CZ3-CG2 4Å; Q302-I304 PolarHBondContact O-N 2.93Å; I304-F306 HydrophobicContact CG2-CE2 4.01Å
305S97.8Very high95.8Very high45 Ų4549.7 Ų49.732%0.31524%0.244SC..EExtended strand (participates in β ladder)trans-116.7118.5-168.5-165.60000114.5F236 S238 H289 G307F236-S305 WeakPolarHBondContact CD2-OG 3.17Å; F236-S305 VanDerWaalsContact CE2-OG 3.25Å; F236-S305 WeakPolarHBondContact CE2-OG 3.27Å; S238-S305 WeakPolarHBondContact OG-CA 3.11Å; S238-S305 WeakPolarHBondContact OG-CB 3.48Å; S238-S305 PolarHBondContact OG-OG 3.49Å; H289-S305 PolarHBondContact NE2-O 3.11Å; S305-G307 PolarHBondContact O-N 3.19Å; S305-G307 PolarHBondContact OG-N 3.28Å
306F97.7Very high94.7Very high4 Ų450.4 Ų50.42%0.01826%0.257CS..  trans-84.521.1174.2-67-95000112.7L237 F239 I252 V254 Y287 H289 I304 K308 L309 L337L237-F306 HydrophobicContact CB-CB 4.13Å; L237-F306 WeakPolarHBondContact O-CB 3.48Å; L237-F306 PolarHBondContact O-N 3.13Å; F239-F306 HydrophobicContact CD2-CD2 4.02Å; F239-F306 AromaticContact CD2-CE2 3.93Å; F239-F306 HydrophobicContact CD2-CE2 3.93Å; F239-F306 AromaticContact CE2-CD2 3.84Å; F239-F306 HydrophobicContact CE2-CD2 3.84Å; F239-F306 AromaticContact CE2-CE2 3.93Å; F239-F306 HydrophobicContact CE2-CE2 3.93Å; I252-F306 HydrophobicContact CG2-CZ 4.23Å; V254-F306 HydrophobicContact CB-CD1 4.29Å; V254-F306 HydrophobicContact CB-CE1 4.18Å; V254-F306 HydrophobicContact CG2-CD1 3.82Å; V254-F306 HydrophobicContact CG2-CD2 4.13Å; V254-F306 HydrophobicContact CG2-CE1 3.66Å; V254-F306 HydrophobicContact CG2-CE2 3.98Å; V254-F306 HydrophobicContact CG2-CG 4.06Å; V254-F306 HydrophobicContact CG2-CZ 3.74Å; Y287-F306 AromaticContact CD1-CD1 3.54Å; Y287-F306 HydrophobicContact CD1-CD1 3.54Å; Y287-F306 AromaticContact CD1-CE1 3.9Å; Y287-F306 HydrophobicContact CD1-CE1 3.9Å; Y287-F306 AromaticContact CE1-CD1 3.78Å; Y287-F306 HydrophobicContact CE1-CD1 3.78Å; Y287-F306 HydrophobicContact CE1-CE1 4.28Å; H289-F306 HydrophobicContact CB-CE1 3.94Å; H289-F306 HydrophobicContact CB-CZ 3.94Å; I304-F306 HydrophobicContact CG2-CE2 4.01Å; F306-K308 PolarHBondContact O-N 3.45Å; F306-L309 HydrophobicContact CB-CB 4.39Å; F306-L309 HydrophobicContact CB-CD1 4.39Å; F306-L309 HydrophobicContact CD1-CD1 4.32Å; F306-L309 WeakPolarHBondContact O-CB 3.43Å; F306-L309 PolarHBondContact O-N 2.62Å; F306-L337 HydrophobicContact CE2-CD1 3.61Å; F306-L337 HydrophobicContact CZ-CD1 3.69Å
307G96.2Very high93.3Very high20 Ų2050.6 Ų50.621%0.20626%0.259CS..THydrogen-bonded Turntrans-59.7-9.3-18000000116.1R232 S305R232-G307 WeakPolarHBondContact CD-O 3.31Å; R232-G307 PolarHBondContact NE-O 3Å; S305-G307 PolarHBondContact O-N 3.19Å; S305-G307 PolarHBondContact OG-N 3.28Å
308K95.3Very high91.6Very high126 Ų12653.8 Ų53.855%0.54828%0.28SS..THydrogen-bonded Turntrans-89.9-19.6172.1-69.7173.7-175.4167.80113.7Y287 F306 K310Y287-K308 WeakPolarHBondContact OH-CB 3.47Å; F306-K308 PolarHBondContact O-N 3.45Å; K308-K310 PolarHBondContact O-N 3.01Å
309L95.9Very high89.6Confident2 Ų257.6 Ų57.61%0.0130%0.302CS..  trans-59.5129.6-176.7-170.8166000111.4R232 M233 V254 Y287 F306 L311 V325R232-L309 WeakPolarHBondContact CA-O 3.44Å; M233-L309 HydrophobicContact CG-CD2 4.33Å; M233-L309 HydrophobicContact SD-CD2 3.94Å; V254-L309 HydrophobicContact CB-CD1 4.37Å; V254-L309 HydrophobicContact CG1-CD1 4.31Å; Y287-L309 HydrophobicContact CD1-CB 4.16Å; Y287-L309 HydrophobicContact CD1-CD1 3.95Å; Y287-L309 HydrophobicContact CD1-CG 4.12Å; Y287-L309 HydrophobicContact CD2-CB 3.99Å; Y287-L309 HydrophobicContact CD2-CD1 4.37Å; Y287-L309 HydrophobicContact CD2-CG 3.76Å; Y287-L309 HydrophobicContact CE1-CB 4.21Å; Y287-L309 HydrophobicContact CE2-CB 4.05Å; Y287-L309 HydrophobicContact CE2-CG 4.34Å; Y287-L309 HydrophobicContact CG-CB 4.04Å; Y287-L309 HydrophobicContact CG-CD1 3.73Å; Y287-L309 HydrophobicContact CG-CG 3.64Å; F306-L309 HydrophobicContact CB-CB 4.39Å; F306-L309 HydrophobicContact CB-CD1 4.39Å; F306-L309 HydrophobicContact CD1-CD1 4.32Å; F306-L309 WeakPolarHBondContact O-CB 3.43Å; F306-L309 PolarHBondContact O-N 2.62Å; L309-L311 HydrophobicContact CD2-CD2 3.57Å; L309-L311 HydrophobicContact CD2-CG 4.38Å; L309-V325 HydrophobicContact CD2-CG2 4.04Å; L309-V325 HydrophobicContact CG-CG2 4.36Å
310K96.1Very high87.9Confident73 Ų7360.7 Ų60.732%0.31732%0.318SS..EExtended strand (participates in β ladder)trans-111.6138.5178.3-75.1178.8171.8-169.10112.4Q229 R231 K308 Q323 M324 V325Q229-K310 PolarHBondContact O-NZ 3Å; R231-K310 CarbonylContact O-C 3.59Å; R231-K310 WeakPolarHBondContact O-CA 3.42Å; K308-K310 PolarHBondContact O-N 3.01Å; K310-Q323 PolarHBondContact N-O 3.27Å; K310-M324 HydrophobicContact CB-CG 4Å; K310-M324 HydrophobicContact CD-CG 4.19Å; K310-M324 HydrophobicContact CD-SD 4.47Å; K310-M324 WeakPolarHBondContact O-CA 3.21Å; K310-V325 PolarHBondContact O-N 3.47Å
311L96.9Very high86.3Confident1 Ų163.5 Ų63.51%0.00534%0.335CS..EExtended strand (participates in β ladder)trans-102134.9171.1-52.7-176.1000111M224 I226 G230 R231 M233 L309 V325 L327 F366M224-L311 HydrophobicContact CB-CD1 3.79Å; M224-L311 HydrophobicContact CG-CD1 4.29Å; I226-L311 HydrophobicContact CG2-CB 3.77Å; I226-L311 HydrophobicContact CG2-CD1 4.48Å; G230-L311 CarbonylContact C-O 3.47Å; G230-L311 VanDerWaalsContact CA-O 3.29Å; G230-L311 WeakPolarHBondContact CA-O 3.46Å; R231-L311 PolarHBondContact N-O 3.3Å; R231-L311 PolarHBondContact O-N 3.13Å; M233-L311 HydrophobicContact CE-CD1 4.49Å; M233-L311 HydrophobicContact CG-CD1 3.76Å; M233-L311 HydrophobicContact CG-CD2 4.26Å; M233-L311 HydrophobicContact CG-CG 3.84Å; M233-L311 HydrophobicContact SD-CD1 4.31Å; M233-L311 HydrophobicContact SD-CD2 4.24Å; M233-L311 HydrophobicContact SD-CG 4.42Å; L309-L311 HydrophobicContact CD2-CD2 3.57Å; L309-L311 HydrophobicContact CD2-CG 4.38Å; L311-V325 WeakPolarHBondContact CA-O 3.19Å; L311-V325 HydrophobicContact CD2-CB 3.92Å; L311-V325 HydrophobicContact CD2-CG1 4.23Å; L311-L327 HydrophobicContact CB-CD1 4.26Å; L311-L327 HydrophobicContact CD1-CD1 3.92Å; L311-L327 HydrophobicContact CD2-CD1 3.95Å; L311-L327 HydrophobicContact CG-CD1 4.27Å; L311-F366 HydrophobicContact CD1-CE2 3.87Å; L311-F366 HydrophobicContact CD1-CZ 3.76Å
312T95.5Very high85Confident0 Ų057.9 Ų57.90%033%0.326CS..EExtended strand (participates in β ladder)trans-135.4155.9-179-170.80000113.1T227 N314 A317 M324 V325 V326 L327T227-T312 WeakPolarHBondContact O-CA 3.5Å; T227-T312 VanDerWaalsContact O-CB 3.28Å; T227-T312 WeakPolarHBondContact O-CB 3.37Å; T227-T312 PolarHBondContact O-OG1 3.12Å; T312-N314 PolarHBondContact OG1-N 3.36Å; T312-N314 VanDerWaalsContact OG1-N 3.11Å; T312-A317 HydrophobicContact CG2-CB 4.16Å; T312-M324 HydrophobicContact CG2-CB 4.39Å; T312-M324 HydrophobicContact CG2-CE 3.77Å; T312-V325 PolarHBondContact N-O 2.86Å; T312-V326 HydrophobicContact CG2-CB 4.34Å; T312-V326 HydrophobicContact CG2-CG2 3.85Å; T312-V326 WeakPolarHBondContact O-CA 3.36Å; T312-L327 PolarHBondContact O-N 2.87Å
313N93.9Very high84.2Confident72 Ų7256.3 Ų56.339%0.38532%0.319SS..  trans-97-0.7167.563.4-20000113.7I226 T227 K228 K315 L327I226-N313 HydrophobicContact CD1-CB 3.73Å; I226-N313 HydrophobicContact CG1-CB 4.04Å; T227-N313 VanDerWaalsContact C-OD1 3.26Å; K228-N313 PolarHBondContact N-OD1 3.04Å; N313-K315 PolarHBondContact O-N 3.05Å; N313-L327 WeakPolarHBondContact CA-O 3.48Å
314N90.2Very high83.9Confident55 Ų5553.5 Ų53.529%0.29431%0.306SS..  trans-81.399.8-177179.412.2000111.2K228 T312 G316 A317K228-N314 HydrophobicContact CG-CB 4.48Å; T312-N314 PolarHBondContact OG1-N 3.36Å; T312-N314 VanDerWaalsContact OG1-N 3.11Å; N314-G316 PolarHBondContact O-N 3.11Å; N314-G316 VanDerWaalsContact O-N 3.11Å; N314-G316 PolarHBondContact OD1-N 3.13Å; N314-G316 VanDerWaalsContact OD1-N 3.13Å; N314-A317 HydrophobicContact CB-CB 4.02Å; N314-A317 VanDerWaalsContact O-CB 3.27Å; N314-A317 WeakPolarHBondContact O-CB 3.49Å; N314-A317 PolarHBondContact O-N 3.26Å
315K81.1Confident83.8Confident97 Ų9753.2 Ų53.242%0.42231%0.305SS..THydrogen-bonded Turntrans-52.9-29.6177-70.9-169.6170.7-161.90113.9D278 Q282 N313D278-K315 IonicContact OD2-NZ 3.92Å; Q282-K315 VanDerWaalsContact OE1-NZ 3.14Å; N313-K315 PolarHBondContact O-N 3.05Å
316G73.3Confident83.6Confident48 Ų4851.3 Ų51.350%0.49529%0.291SS..THydrogen-bonded Turntrans-90.37.9179.600000115.7N314 S318N314-G316 PolarHBondContact O-N 3.11Å; N314-G316 VanDerWaalsContact O-N 3.11Å; N314-G316 PolarHBondContact OD1-N 3.13Å; N314-G316 VanDerWaalsContact OD1-N 3.13Å; G316-S318 PolarHBondContact O-N 3.21Å
317A66.4Low83.5Confident5 Ų551.2 Ų51.24%0.04129%0.291CS..G310 helixtrans-75.115.9-174.400000115.5T312 N314 N319 N320 M324T312-A317 HydrophobicContact CG2-CB 4.16Å; N314-A317 HydrophobicContact CB-CB 4.02Å; N314-A317 VanDerWaalsContact O-CB 3.27Å; N314-A317 WeakPolarHBondContact O-CB 3.49Å; N314-A317 PolarHBondContact O-N 3.26Å; A317-N319 PolarHBondContact O-N 3.07Å; A317-N319 VanDerWaalsContact O-N 3.12Å; A317-N320 PolarHBondContact O-N 2.89Å; A317-N320 PolarHBondContact O-ND2 3.23Å; A317-M324 HydrophobicContact CB-CE 4.28Å
318S61.7Low83.4Confident99 Ų9952 Ų5269%0.69229%0.289SS*.G310 helixtrans-60.5-21.1-176.749.30000114.2G316 N320G316-S318 PolarHBondContact O-N 3.21Å; S318-N320 PolarHBondContact O-N 2.94Å
319N58Low83.5Confident121 Ų12147.6 Ų47.665%0.64727%0.274SS*.G310 helixtrans-73.7-0.1177.766.1-24.1000115.4A317 N321A317-N319 PolarHBondContact O-N 3.07Å; A317-N319 VanDerWaalsContact O-N 3.12Å; N319-N321 PolarHBondContact O-N 2.83Å
320N61.5Low83.6Confident67 Ų6749.7 Ų49.736%0.35829%0.285SS..SBendtrans-97.755.4-174.1-62.3-85.9000113.6A317 S318 G322 Q323 M324A317-N320 PolarHBondContact O-N 2.89Å; A317-N320 PolarHBondContact O-ND2 3.23Å; S318-N320 PolarHBondContact O-N 2.94Å; N320-G322 PolarHBondContact O-N 3.43Å; N320-Q323 PolarHBondContact O-N 2.89Å; N320-M324 HydrophobicContact CB-CG 4.18Å; N320-M324 HydrophobicContact CB-SD 3.58Å; N320-M324 VanDerWaalsContact CB-SD 3.58Å
321N63.8Low83.6Confident123 Ų12346.6 Ų46.666%0.65827%0.272SS*.THydrogen-bonded Turntrans45.734.8167-59.88000115.9N319 Q323N319-N321 PolarHBondContact O-N 2.83Å; N321-Q323 HydrophobicContact CB-CG 4.44Å; N321-Q323 PolarHBondContact O-N 2.88Å
322G70.1Confident83.7Confident42 Ų4248.9 Ų48.943%0.43328%0.282SS..THydrogen-bonded Turntrans66.21.8-176.400000116.2N320 M324N320-G322 PolarHBondContact O-N 3.43Å; G322-M324 VanDerWaalsContact C-N 3.28Å; G322-M324 PolarHBondContact O-N 2.78Å
323Q81.4Confident83.8Confident104 Ų10448.9 Ų48.949%0.48628%0.282SS..  trans-80.6-5.2-172-60.8-171.36.500114.5Y287 K310 N320 N321Y287-Q323 WeakPolarHBondContact CD2-O 3.46Å; Y287-Q323 HydrophobicContact CE2-CB 4.26Å; Y287-Q323 WeakPolarHBondContact CE2-O 3.43Å; K310-Q323 PolarHBondContact N-O 3.27Å; N320-Q323 PolarHBondContact O-N 2.89Å; N321-Q323 HydrophobicContact CB-CG 4.44Å; N321-Q323 PolarHBondContact O-N 2.88Å
324M91.6Very high84Confident13 Ų1346 Ų466%0.06427%0.266CS..EExtended strand (participates in β ladder)trans-126.1126.4-170.2-66.4179.557.800111N284 K310 T312 A317 N320 G322N284-M324 PolarHBondContact ND2-O 2.9Å; K310-M324 HydrophobicContact CB-CG 4Å; K310-M324 HydrophobicContact CD-CG 4.19Å; K310-M324 HydrophobicContact CD-SD 4.47Å; K310-M324 WeakPolarHBondContact O-CA 3.21Å; T312-M324 HydrophobicContact CG2-CB 4.39Å; T312-M324 HydrophobicContact CG2-CE 3.77Å; A317-M324 HydrophobicContact CB-CE 4.28Å; N320-M324 HydrophobicContact CB-CG 4.18Å; N320-M324 HydrophobicContact CB-SD 3.58Å; N320-M324 VanDerWaalsContact CB-SD 3.58Å; G322-M324 VanDerWaalsContact C-N 3.28Å; G322-M324 PolarHBondContact O-N 2.78Å
325V94.5Very high84.4Confident0 Ų043.6 Ų43.60%025%0.253CS..EExtended strand (participates in β ladder)trans-94.9124.6173.21770000108.7V256 N284 L309 K310 L311 T312 L327V256-V325 HydrophobicContact CB-CG1 3.93Å; V256-V325 HydrophobicContact CG2-CG1 3.95Å; N284-V325 CarbonylContact O-C 3.47Å; N284-V325 WeakPolarHBondContact O-CA 3.37Å; L309-V325 HydrophobicContact CD2-CG2 4.04Å; L309-V325 HydrophobicContact CG-CG2 4.36Å; K310-V325 PolarHBondContact O-N 3.47Å; L311-V325 WeakPolarHBondContact CA-O 3.19Å; L311-V325 HydrophobicContact CD2-CB 3.92Å; L311-V325 HydrophobicContact CD2-CG1 4.23Å; T312-V325 PolarHBondContact N-O 2.86Å; V325-L327 HydrophobicContact CG1-CD2 3.82Å; V325-L327 HydrophobicContact CG1-CG 4.16Å
326V94.5Very high85.2Confident5 Ų542.1 Ų42.13%0.0325%0.245CC..EExtended strand (participates in β ladder)trans-92122.5-178.2-176.70000109.5N284 T312N284-V326 PolarHBondContact O-N 3.01Å; T312-V326 HydrophobicContact CG2-CB 4.34Å; T312-V326 HydrophobicContact CG2-CG2 3.85Å; T312-V326 WeakPolarHBondContact O-CA 3.36Å
327L95.4Very high86.4Confident3 Ų339.9 Ų39.92%0.01622%0.222CC..  trans-130.2147-178.7-56179.6000110.8I226 V256 L311 T312 N313 V325 Y333 F366 A368I226-L327 HydrophobicContact CG2-CD1 4.38Å; V256-L327 HydrophobicContact CB-CD2 4.25Å; V256-L327 HydrophobicContact CG1-CD1 4.47Å; V256-L327 HydrophobicContact CG1-CD2 3.74Å; L311-L327 HydrophobicContact CB-CD1 4.26Å; L311-L327 HydrophobicContact CD1-CD1 3.92Å; L311-L327 HydrophobicContact CD2-CD1 3.95Å; L311-L327 HydrophobicContact CG-CD1 4.27Å; T312-L327 PolarHBondContact O-N 2.87Å; N313-L327 WeakPolarHBondContact CA-O 3.48Å; V325-L327 HydrophobicContact CG1-CD2 3.82Å; V325-L327 HydrophobicContact CG1-CG 4.16Å; L327-Y333 HydrophobicContact CB-CE1 4.45Å; L327-Y333 HydrophobicContact CB-CE2 4.07Å; L327-Y333 HydrophobicContact CD1-CD2 4.25Å; L327-Y333 HydrophobicContact CD1-CE2 4.34Å; L327-Y333 HydrophobicContact CD2-CD1 3.74Å; L327-Y333 HydrophobicContact CD2-CD2 4.46Å; L327-Y333 HydrophobicContact CD2-CE1 3.59Å; L327-Y333 HydrophobicContact CD2-CE2 4.34Å; L327-Y333 HydrophobicContact CD2-CG 4.19Å; L327-Y333 HydrophobicContact CG-CE2 4.49Å; L327-F366 HydrophobicContact CD1-CE2 3.77Å; L327-F366 HydrophobicContact CD1-CZ 3.71Å; L327-A368 HydrophobicContact CB-CB 4.33Å; L327-A368 HydrophobicContact CD1-CB 4.18Å
328Q95.2Very high87.9Confident36 Ų3640.1 Ų40.117%0.16822%0.222CC..  trans-80.3138.8164.6-53.4-162.75.100110.1D278 Y333D278-Q328 PolarHBondContact OD2-NE2 2.89Å; Q328-Y333 WeakPolarHBondContact CA-OH 3.07Å; Q328-Y333 PolarHBondContact N-OH 2.98Å; Q328-Y333 WeakPolarHBondContact O-CE2 3.44Å; Q328-Y333 PolarHBondContact O-OH 3.48Å
329S96.6Very high89.5Confident33 Ų3335.5 Ų35.523%0.23119%0.189CC..THydrogen-bonded Turntrans-66.8158.1174.2-163.30000111.3H331 A368S329-H331 PolarHBondContact O-N 3.49Å; S329-H331 PolarHBondContact O-ND1 3.44Å; S329-A368 CarbonylContact C-O 3.6Å
330L97.3Very high91.3Very high47 Ų4730.7 Ų30.725%0.24617%0.165CC..THydrogen-bonded Turntrans58.827.6178.4-56-178.1000114.7H263 W264 W271 A368 V369H263-L330 PolarHBondContact CD2-O 3.02Å; W264-L330 WeakPolarHBondContact CB-O 3.42Å; W264-L330 PolarHBondContact N-O 2.95Å; W264-L330 WeakPolarHBondContact O-CB 3.41Å; W271-L330 HydrophobicContact CH2-CD2 3.98Å; W271-L330 HydrophobicContact CZ3-CD2 4.06Å; L330-A368 PolarHBondContact N-O 2.92Å; L330-V369 HydrophobicContact CD2-CG1 4.46Å
331H97Very high92.8Very high8 Ų831 Ų314%0.03716%0.164CC..EExtended strand (participates in β ladder)trans-121.4148.4175.8-72.180.6000110.3L258 H263 A277 S329 Y333 I367 A368L258-H331 HydrophobicContact CD2-CB 3.97Å; H263-H331 AromaticContact CD2-CE1 3.54Å; H263-H331 AromaticContact CD2-ND1 3.95Å; A277-H331 VanDerWaalsContact CA-NE2 3.31Å; A277-H331 WeakPolarHBondContact CA-NE2 3.44Å; A277-H331 VanDerWaalsContact CB-CD2 3.42Å; A277-H331 WeakPolarHBondContact CB-CD2 3.5Å; A277-H331 WeakPolarHBondContact CB-NE2 3.45Å; S329-H331 PolarHBondContact O-N 3.49Å; S329-H331 PolarHBondContact O-ND1 3.44Å; H331-Y333 HydrophobicContact CB-CE2 3.59Å; H331-Y333 WeakPolarHBondContact O-CD2 3.33Å; H331-Y333 WeakPolarHBondContact O-CE2 3.27Å; H331-I367 WeakPolarHBondContact O-CA 3.41Å; H331-A368 PolarHBondContact O-N 2.89Å
332K98Very high94Very high48 Ų4827.2 Ų27.221%0.20915%0.145CC..EExtended strand (participates in β ladder)trans-93.1135.4179.1-159.5-171.4-172.1-159.50110.7A259 D260 F366 I367A259-K332 HydrophobicContact CB-CB 4.27Å; A259-K332 HydrophobicContact CB-CD 4.1Å; A259-K332 HydrophobicContact CB-CG 4.01Å; A259-K332 PolarHBondContact N-O 3.28Å; D260-K332 VanDerWaalsContact OD2-CB 3.32Å; D260-K332 WeakPolarHBondContact OD2-CB 3.22Å; D260-K332 WeakPolarHBondContact OD2-CD 3.3Å; K332-F366 CarbonylContact C-O 3.55Å; K332-F366 WeakPolarHBondContact CA-O 3.45Å; K332-I367 HydrophobicContact CB-CG1 4.16Å; K332-I367 HydrophobicContact CG-CG1 3.97Å
333Y98.3Very high94.6Very high1 Ų127.2 Ų27.20%0.00414%0.135CC..EExtended strand (participates in β ladder)trans-128.8153.6-175.5-63.2-86.1000112.6V256 I257 L258 L327 Q328 H331 Q365 F366 A368V256-Y333 HydrophobicContact CG1-CD1 3.95Å; V256-Y333 HydrophobicContact CG1-CG 4.02Å; I257-Y333 CarbonylContact O-C 3.42Å; I257-Y333 VanDerWaalsContact O-CA 3.22Å; I257-Y333 WeakPolarHBondContact O-CA 3.38Å; I257-Y333 WeakPolarHBondContact O-CB 3.25Å; I257-Y333 WeakPolarHBondContact O-CD1 3.41Å; L258-Y333 HydrophobicContact CD2-CD1 4.01Å; L258-Y333 HydrophobicContact CD2-CE1 3.48Å; L258-Y333 VanDerWaalsContact CD2-CE1 3.48Å; L258-Y333 HydrophobicContact CG-CD1 4.47Å; L258-Y333 HydrophobicContact CG-CE1 4.08Å; L327-Y333 HydrophobicContact CB-CE1 4.45Å; L327-Y333 HydrophobicContact CB-CE2 4.07Å; L327-Y333 HydrophobicContact CD1-CD2 4.25Å; L327-Y333 HydrophobicContact CD1-CE2 4.34Å; L327-Y333 HydrophobicContact CD2-CD1 3.74Å; L327-Y333 HydrophobicContact CD2-CD2 4.46Å; L327-Y333 HydrophobicContact CD2-CE1 3.59Å; L327-Y333 HydrophobicContact CD2-CE2 4.34Å; L327-Y333 HydrophobicContact CD2-CG 4.19Å; L327-Y333 HydrophobicContact CG-CE2 4.49Å; Q328-Y333 WeakPolarHBondContact CA-OH 3.07Å; Q328-Y333 PolarHBondContact N-OH 2.98Å; Q328-Y333 WeakPolarHBondContact O-CE2 3.44Å; Q328-Y333 PolarHBondContact O-OH 3.48Å; H331-Y333 HydrophobicContact CB-CE2 3.59Å; H331-Y333 WeakPolarHBondContact O-CD2 3.33Å; H331-Y333 WeakPolarHBondContact O-CE2 3.27Å; Y333-Q365 VanDerWaalsContact O-CA 3.28Å; Y333-Q365 WeakPolarHBondContact O-CA 3.48Å; Y333-F366 HydrophobicContact CD2-CE2 4.08Å; Y333-F366 HydrophobicContact CD2-CZ 4.45Å; Y333-F366 HydrophobicContact CG-CE2 4.48Å; Y333-F366 HydrophobicContact CG-CZ 4.42Å; Y333-F366 PolarHBondContact N-O 2.83Å; Y333-F366 PolarHBondContact O-N 2.9Å; Y333-F366 VanDerWaalsContact O-N 3.11Å; Y333-A368 HydrophobicContact CD2-CB 3.9Å; Y333-A368 HydrophobicContact CE2-CB 3.59Å
334Q98.3Very high94Very high12 Ų1231.4 Ų31.46%0.05616%0.155CC..EExtended strand (participates in β ladder)trans-121.7115173.4174.468.376.300108.4I257 A259 R336 T360 F361 T364 Q365I257-Q334 HydrophobicContact CG1-CB 4.07Å; I257-Q334 WeakPolarHBondContact CG1-O 3.12Å; I257-Q334 PolarHBondContact N-O 3.08Å; I257-Q334 VanDerWaalsContact N-O 3.09Å; I257-Q334 PolarHBondContact O-N 3.21Å; A259-Q334 HydrophobicContact CB-CB 4.2Å; Q334-R336 HydrophobicContact CG-CG 4.4Å; Q334-T360 VanDerWaalsContact CD-CG2 3.45Å; Q334-T360 HydrophobicContact CG-CG2 3.6Å; Q334-F361 PolarHBondContact NE2-O 2.89Å; Q334-T364 PolarHBondContact NE2-OG1 3.02Å; Q334-Q365 HydrophobicContact CB-CG 4.24Å
335P98.5Very high92.8Very high4 Ų436.1 Ų36.13%0.02618%0.18CC..EExtended strand (participates in β ladder)trans-66.8143.5162.9-17.430.7000111.1M233 L237 V254 D255 T364 F366M233-P335 HydrophobicContact CE-CG 4.48Å; L237-P335 HydrophobicContact CD1-CB 3.61Å; L237-P335 HydrophobicContact CD1-CG 4.02Å; L237-P335 HydrophobicContact CD2-CB 4.18Å; L237-P335 HydrophobicContact CD2-CG 4.27Å; V254-P335 HydrophobicContact CG1-CB 4.32Å; D255-P335 WeakPolarHBondContact O-CA 3.36Å; P335-T364 WeakPolarHBondContact CD-O 3.36Å; P335-F366 HydrophobicContact CG-CD1 4.24Å; P335-F366 HydrophobicContact CG-CE1 3.94Å
336R98.3Very high91.1Very high65 Ų6539.4 Ų39.425%0.24521%0.214CC..EExtended strand (participates in β ladder)trans-130.6139.2165.8-47.1147.658.9-153.79.7108.5V254 D255 Q334 T358 F359 T360V254-R336 VanDerWaalsContact CA-O 3.28Å; V254-R336 WeakPolarHBondContact CA-O 3.25Å; D255-R336 PolarHBondContact N-O 3.07Å; D255-R336 VanDerWaalsContact N-O 3.07Å; D255-R336 PolarHBondContact O-N 2.84Å; D255-R336 VanDerWaalsContact OD1-CB 3.31Å; D255-R336 WeakPolarHBondContact OD1-CB 3.08Å; D255-R336 VanDerWaalsContact OD1-CD 3.3Å; D255-R336 WeakPolarHBondContact OD1-CD 3.43Å; D255-R336 IonicContact OD1-CZ 3.93Å; D255-R336 IonicContact OD1-NE 3.8Å; D255-R336 IonicContact OD1-NH1 3.46Å; D255-R336 PolarHBondContact OD1-NH1 3.46Å; D255-R336 IonicContact OD2-CZ 3.74Å; D255-R336 IonicContact OD2-NH1 3.81Å; D255-R336 PolarHBondContact OD2-NH1 2.95Å; Q334-R336 HydrophobicContact CG-CG 4.4Å; R336-T358 HydrophobicContact CB-CG2 3.94Å; R336-T358 HydrophobicContact CG-CG2 4.42Å; R336-F359 WeakPolarHBondContact CA-O 3.34Å; R336-T360 HydrophobicContact CG-CG2 4.12Å
337L98.4Very high89.4Confident1 Ų141.7 Ų41.71%0.00523%0.228CC..EExtended strand (participates in β ladder)trans-88.6142.8169.7-174.873.4000108.7V206 F239 I241 I252 V254 F306 T358 F359V206-L337 HydrophobicContact CG1-CD2 3.61Å; V206-L337 HydrophobicContact CG2-CD2 4.32Å; F239-L337 HydrophobicContact CB-CD2 4.38Å; F239-L337 HydrophobicContact CD1-CD2 4.27Å; F239-L337 HydrophobicContact CD2-CD1 3.99Å; F239-L337 HydrophobicContact CD2-CD2 3.94Å; F239-L337 HydrophobicContact CD2-CG 4.48Å; F239-L337 HydrophobicContact CE2-CB 4.35Å; F239-L337 HydrophobicContact CE2-CD1 3.81Å; F239-L337 HydrophobicContact CE2-CD2 4.25Å; F239-L337 HydrophobicContact CE2-CG 4.37Å; F239-L337 HydrophobicContact CG-CD2 3.95Å; F239-L337 HydrophobicContact CZ-CB 4.19Å; F239-L337 HydrophobicContact CZ-CD1 4.48Å; I241-L337 HydrophobicContact CD1-CD2 4.09Å; I252-L337 HydrophobicContact CG2-CD1 3.75Å; I252-L337 HydrophobicContact CG2-CG 4.37Å; V254-L337 HydrophobicContact CG2-CD1 3.8Å; F306-L337 HydrophobicContact CE2-CD1 3.61Å; F306-L337 HydrophobicContact CZ-CD1 3.69Å; L337-T358 CarbonylContact O-C 3.57Å; L337-T358 WeakPolarHBondContact O-CA 3.4Å; L337-F359 HydrophobicContact CB-CB 4.4Å; L337-F359 PolarHBondContact N-O 2.56Å; L337-F359 PolarHBondContact O-N 3.27Å
338H97.3Very high87.4Confident11 Ų1148.9 Ų48.95%0.05126%0.261CS..EExtended strand (participates in β ladder)trans-125.5132.9172.9-55.5-96000109.1I252 F253 D255 V340 Q357 T358I252-H338 WeakPolarHBondContact CA-O 3.31Å; F253-H338 HydrophobicContact CD1-CB 4.23Å; F253-H338 HydrophobicContact CD2-CB 3.85Å; F253-H338 AromaticContact CD2-CD2 3.65Å; F253-H338 AromaticContact CD2-CG 3.96Å; F253-H338 HydrophobicContact CE1-CB 3.92Å; F253-H338 HydrophobicContact CE2-CB 3.5Å; F253-H338 AromaticContact CE2-CD2 3.37Å; F253-H338 WeakPolarHBondContact CE2-CD2 3.48Å; F253-H338 AromaticContact CE2-CG 3.41Å; F253-H338 VanDerWaalsContact CE2-CG 3.41Å; F253-H338 HydrophobicContact CG-CB 4.21Å; F253-H338 HydrophobicContact CZ-CB 3.54Å; F253-H338 AromaticContact CZ-CG 3.81Å; F253-H338 PolarHBondContact N-O 3.09Å; F253-H338 VanDerWaalsContact N-O 3.08Å; F253-H338 PolarHBondContact O-N 3.38Å; D255-H338 VanDerWaalsContact CG-NE2 3.27Å; D255-H338 IonicContact OD1-CD2 3.58Å; D255-H338 IonicContact OD1-CE1 3.71Å; D255-H338 IonicContact OD1-NE2 3.86Å; D255-H338 PolarHBondContact OD1-NE2 3.22Å; D255-H338 IonicContact OD2-NE2 2.77Å; H338-V340 HydrophobicContact CB-CG2 4.46Å; H338-Q357 WeakPolarHBondContact CA-O 3.28Å; H338-T358 PolarHBondContact CE1-OG1 3.34Å; H338-T358 PolarHBondContact ND1-OG1 2.87Å
339V96.7Very high85.4Confident1 Ų150.8 Ų50.81%0.00627%0.273CS..EExtended strand (participates in β ladder)trans-113.1123.9168.8-176.70000106.8I241 L244 Y250 I252 Q357 F359I241-V339 HydrophobicContact CD1-CG2 3.94Å; L244-V339 HydrophobicContact CD2-CG1 3.88Å; Y250-V339 HydrophobicContact CD1-CG1 3.75Å; Y250-V339 HydrophobicContact CE1-CG1 4.49Å; Y250-V339 HydrophobicContact CG-CG1 4.26Å; I252-V339 HydrophobicContact CD1-CG1 4.23Å; I252-V339 HydrophobicContact CD1-CG2 4.13Å; I252-V339 HydrophobicContact CG1-CG1 4.23Å; I252-V339 HydrophobicContact CG1-CG2 4.33Å; V339-Q357 PolarHBondContact N-O 2.92Å; V339-Q357 PolarHBondContact O-N 2.89Å; V339-F359 HydrophobicContact CG2-CD2 4.45Å; V339-F359 HydrophobicContact CG2-CE2 4.14Å
340V94.9Very high83.5Confident21 Ų2154.9 Ų54.913%0.12730%0.297CS..EExtended strand (participates in β ladder)trans-130.2120.9-174.8-175.50000110.1Y250 N251 F253 H338 R355 V356Y250-V340 CarbonylContact C-O 3.53Å; Y250-V340 VanDerWaalsContact CA-O 3.27Å; Y250-V340 WeakPolarHBondContact CA-O 3.41Å; N251-V340 PolarHBondContact N-O 3.28Å; N251-V340 PolarHBondContact O-N 3.06Å; F253-V340 HydrophobicContact CE1-CG2 3.6Å; F253-V340 HydrophobicContact CZ-CG2 4.15Å; H338-V340 HydrophobicContact CB-CG2 4.46Å; V340-R355 WeakPolarHBondContact CA-O 3.33Å; V340-R355 HydrophobicContact CG1-CG 4.44Å; V340-V356 HydrophobicContact CG1-CG2 3.99Å; V340-V356 HydrophobicContact CG2-CB 4.27Å; V340-V356 HydrophobicContact CG2-CG1 4.02Å; V340-V356 HydrophobicContact CG2-CG2 3.9Å
341E92.8Very high81.4Confident72 Ų7256.6 Ų56.634%0.33631%0.313SS..EExtended strand (participates in β ladder)trans-73.2145.3178.9-157.3162.8127.900111.4A248 Y250 R355A248-E341 HydrophobicContact CB-CG 4.29Å; Y250-E341 HydrophobicContact CD1-CB 3.9Å; Y250-E341 HydrophobicContact CD1-CG 4.04Å; Y250-E341 HydrophobicContact CE1-CB 3.65Å; Y250-E341 HydrophobicContact CE1-CG 3.53Å; Y250-E341 WeakPolarHBondContact CE1-OE2 3.35Å; Y250-E341 VanDerWaalsContact CZ-OE2 3.24Å; Y250-E341 PolarHBondContact OH-OE2 3.46Å; E341-R355 HydrophobicContact CB-CG 4.33Å; E341-R355 PolarHBondContact N-O 2.73Å; E341-R355 VanDerWaalsContact N-O 3.15Å; E341-R355 PolarHBondContact O-NE 2.84Å; E341-R355 PolarHBondContact O-NH2 2.86Å
342V89.7Confident79.4Confident44 Ų4461.8 Ų61.827%0.26734%0.337SS..EExtended strand (participates in β ladder)trans-109.4108.1-175.4-176.10000108.9H249 P293 E344H249-V342 HydrophobicContact CB-CB 4.04Å; H249-V342 HydrophobicContact CB-CG2 4.46Å; H249-V342 WeakPolarHBondContact O-CB 3.37Å; H249-V342 PolarHBondContact O-N 2.86Å; P293-V342 HydrophobicContact CB-CG2 4.21Å; V342-E344 PolarHBondContact O-N 3.26Å
343N80.9Confident77.3Confident42 Ų4265.7 Ų65.723%0.22537%0.367CS..  trans-52130.2172-71.620.5000111.1D345 G346 T347 R355N343-D345 WeakPolarHBondContact CB-OD1 3.48Å; N343-D345 PolarHBondContact O-N 3.18Å; N343-G346 PolarHBondContact O-N 3.15Å; N343-T347 PolarHBondContact ND2-O 3.46Å; N343-T347 PolarHBondContact ND2-OG1 2.9Å; N343-R355 VanDerWaalsContact CG-NH1 3.31Å; N343-R355 PolarHBondContact ND2-NH1 2.94Å; N343-R355 PolarHBondContact OD1-NE 3.22Å; N343-R355 PolarHBondContact OD1-NH1 2.83Å; N343-R355 PolarHBondContact OD1-NH2 3.4Å
344E69.7Low75.6Confident193 Ų19368.2 Ų68.290%0.90239%0.393SS*.THydrogen-bonded Turntrans-66.4-29.2178.3-58.9-165.7126.700112.3V342 G346V342-E344 PolarHBondContact O-N 3.26Å; E344-G346 PolarHBondContact O-N 2.87Å
345D66.3Low74.7Confident112 Ų11270 Ų7060%0.59940%0.4SS*.THydrogen-bonded Turntrans-782.7177.554.6-70.9000114.1N343 T347N343-D345 WeakPolarHBondContact CB-OD1 3.48Å; N343-D345 PolarHBondContact O-N 3.18Å; D345-T347 PolarHBondContact O-N 3.4Å; D345-T347 WeakPolarHBondContact OD2-CB 3.33Å; D345-T347 WeakPolarHBondContact OD2-CG2 3.34Å; D345-T347 PolarHBondContact OD2-OG1 3.35Å
346G58.4Low74.2Confident68 Ų6873.6 Ų73.670%0.70142%0.421SS*.  trans72.25.2172.500000115.5N343 E344N343-G346 PolarHBondContact O-N 3.15Å; E344-G346 PolarHBondContact O-N 2.87Å
347T58.4Low74Confident53 Ų5372.2 Ų72.233%0.32542%0.418SS..  trans-75.5128.8179.258.80000112.1N343 D345 D349 R355N343-T347 PolarHBondContact ND2-O 3.46Å; N343-T347 PolarHBondContact ND2-OG1 2.9Å; D345-T347 PolarHBondContact O-N 3.4Å; D345-T347 WeakPolarHBondContact OD2-CB 3.33Å; D345-T347 WeakPolarHBondContact OD2-CG2 3.34Å; D345-T347 PolarHBondContact OD2-OG1 3.35Å; T347-D349 PolarHBondContact O-N 3.11Å; T347-R355 PolarHBondContact O-NH1 3.34Å; T347-R355 PolarHBondContact O-NH2 3.15Å
348E55Low74Confident155 Ų15574.9 Ų74.972%0.72443%0.434SS*.  trans-79.448.5163.6-78-153.2133.300111.4T350E348-T350 PolarHBondContact O-N 3.36Å; E348-T350 PolarHBondContact O-OG1 3.04Å
349D52Low74Confident75 Ų7576.3 Ų76.340%0.40144%0.44SS..  trans-6681.2168.2-103.230.8000109.6T347 S351 R355T347-D349 PolarHBondContact O-N 3.11Å; D349-S351 PolarHBondContact O-N 3.23Å; D349-R355 PolarHBondContact O-NH1 3.24Å
350T56.7Low74Confident120 Ų12079.5 Ų79.574%0.73646%0.46SS*.THydrogen-bonded Turntrans-77.3-7.9176.1-50.60000110.8E348 Q352E348-T350 PolarHBondContact O-N 3.36Å; E348-T350 PolarHBondContact O-OG1 3.04Å; T350-Q352 VanDerWaalsContact C-N 3.32Å; T350-Q352 PolarHBondContact O-N 2.65Å
351S53.4Low74.2Confident83 Ų8379.7 Ų79.758%0.5846%0.459SS*.THydrogen-bonded Turntrans-67.8-22.4176.746.20000114.1D349 P353D349-S351 PolarHBondContact O-N 3.23Å; S351-P353 VanDerWaalsContact O-CD 3.29Å; S351-P353 WeakPolarHBondContact O-CD 3.45Å
352Q54.7Low74.5Confident116 Ų11679.8 Ų79.854%0.54247%0.466SS..SBendtrans-82.1111.3-171-64-65-6.600112.8T350 G354 R355T350-Q352 VanDerWaalsContact C-N 3.32Å; T350-Q352 PolarHBondContact O-N 2.65Å; Q352-G354 PolarHBondContact O-N 3Å; Q352-R355 PolarHBondContact O-N 3.24Å
353P54.4Low74.9Confident131 Ų13178.1 Ų78.185%0.85146%0.455SS*.THydrogen-bonded Turntrans-75.896.2-175.431.5-34.6000111.5S351S351-P353 VanDerWaalsContact O-CD 3.29Å; S351-P353 WeakPolarHBondContact O-CD 3.45Å
354G62.6Low75.8Confident54 Ų5476.2 Ų76.256%0.55745%0.445SS*.THydrogen-bonded Turntrans149.5-22177.500000113.9Q352 V356Q352-G354 PolarHBondContact O-N 3Å; G354-V356 PolarHBondContact O-N 3.18Å
355R79.2Confident77.1Confident49 Ų4968.9 Ų68.919%0.18541%0.41CS..SBendtrans-60.9-24-178.7-172.4176173.4-179.14.6114.3V340 E341 N343 T347 D349 Q352V340-R355 WeakPolarHBondContact CA-O 3.33Å; V340-R355 HydrophobicContact CG1-CG 4.44Å; E341-R355 HydrophobicContact CB-CG 4.33Å; E341-R355 PolarHBondContact N-O 2.73Å; E341-R355 VanDerWaalsContact N-O 3.15Å; E341-R355 PolarHBondContact O-NE 2.84Å; E341-R355 PolarHBondContact O-NH2 2.86Å; N343-R355 VanDerWaalsContact CG-NH1 3.31Å; N343-R355 PolarHBondContact ND2-NH1 2.94Å; N343-R355 PolarHBondContact OD1-NE 3.22Å; N343-R355 PolarHBondContact OD1-NH1 2.83Å; N343-R355 PolarHBondContact OD1-NH2 3.4Å; T347-R355 PolarHBondContact O-NH1 3.34Å; T347-R355 PolarHBondContact O-NH2 3.15Å; D349-R355 PolarHBondContact O-NH1 3.24Å; Q352-R355 PolarHBondContact O-N 3.24Å
356V88.9Confident78.7Confident79 Ų7963.6 Ų63.648%0.47938%0.382SS..EExtended strand (participates in β ladder)trans-112.3118.6178.2178.80000109.9V340 G354V340-V356 HydrophobicContact CG1-CG2 3.99Å; V340-V356 HydrophobicContact CG2-CB 4.27Å; V340-V356 HydrophobicContact CG2-CG1 4.02Å; V340-V356 HydrophobicContact CG2-CG2 3.9Å; G354-V356 PolarHBondContact O-N 3.18Å
357Q94.4Very high80.6Confident37 Ų3760.5 Ų60.517%0.17335%0.35CS..EExtended strand (participates in β ladder)trans-112.5107.9177.6-56.4-172.843.300109.7G202 H338 V339 F359G202-Q357 PolarHBondContact O-NE2 3.48Å; H338-Q357 WeakPolarHBondContact CA-O 3.28Å; V339-Q357 PolarHBondContact N-O 2.92Å; V339-Q357 PolarHBondContact O-N 2.89Å; Q357-F359 HydrophobicContact CB-CE2 3.64Å; Q357-F359 HydrophobicContact CB-CZ 3.92Å; Q357-F359 WeakPolarHBondContact O-CD2 3.29Å; Q357-F359 WeakPolarHBondContact O-CE2 3.24Å
358T96.6Very high82.5Confident56 Ų5658 Ų5834%0.34433%0.334SS..EExtended strand (participates in β ladder)trans-92.4130.9178.2-61.40000111.5R336 L337 H338R336-T358 HydrophobicContact CB-CG2 3.94Å; R336-T358 HydrophobicContact CG-CG2 4.42Å; L337-T358 CarbonylContact O-C 3.57Å; L337-T358 WeakPolarHBondContact O-CA 3.4Å; H338-T358 PolarHBondContact CE1-OG1 3.34Å; H338-T358 PolarHBondContact ND1-OG1 2.87Å
359F97.9Very high84.6Confident41 Ų4150.6 Ų50.618%0.1830%0.3CS..EExtended strand (participates in β ladder)trans-118.8129.4174.4-57-89.1000110.5A204 V206 R336 L337 V339 Q357 F361A204-F359 HydrophobicContact CB-CE2 4.26Å; A204-F359 HydrophobicContact CB-CZ 3.88Å; A204-F359 WeakPolarHBondContact O-CE1 3.35Å; A204-F359 VanDerWaalsContact O-CZ 3.26Å; A204-F359 WeakPolarHBondContact O-CZ 3.43Å; V206-F359 HydrophobicContact CB-CB 4.25Å; V206-F359 HydrophobicContact CB-CD1 3.8Å; V206-F359 HydrophobicContact CB-CD2 4.2Å; V206-F359 HydrophobicContact CB-CE1 4.24Å; V206-F359 HydrophobicContact CB-CG 3.79Å; V206-F359 HydrophobicContact CG1-CB 4.41Å; V206-F359 HydrophobicContact CG1-CG 4.4Å; V206-F359 HydrophobicContact CG2-CB 4.42Å; V206-F359 HydrophobicContact CG2-CD1 3.74Å; V206-F359 HydrophobicContact CG2-CD2 3.47Å; V206-F359 VanDerWaalsContact CG2-CD2 3.47Å; V206-F359 HydrophobicContact CG2-CE1 3.82Å; V206-F359 HydrophobicContact CG2-CE2 3.56Å; V206-F359 HydrophobicContact CG2-CG 3.58Å; V206-F359 HydrophobicContact CG2-CZ 3.75Å; R336-F359 WeakPolarHBondContact CA-O 3.34Å; L337-F359 HydrophobicContact CB-CB 4.4Å; L337-F359 PolarHBondContact N-O 2.56Å; L337-F359 PolarHBondContact O-N 3.27Å; V339-F359 HydrophobicContact CG2-CD2 4.45Å; V339-F359 HydrophobicContact CG2-CE2 4.14Å; Q357-F359 HydrophobicContact CB-CE2 3.64Å; Q357-F359 HydrophobicContact CB-CZ 3.92Å; Q357-F359 WeakPolarHBondContact O-CD2 3.29Å; Q357-F359 WeakPolarHBondContact O-CE2 3.24Å; F359-F361 HydrophobicContact CB-CE2 4.03Å
360T98.1Very high86.8Confident69 Ų6951.1 Ų51.142%0.42331%0.306SS..EExtended strand (participates in β ladder)trans-126.4129.4-175-51.50000110.2Q334 R336Q334-T360 VanDerWaalsContact CD-CG2 3.45Å; Q334-T360 HydrophobicContact CG-CG2 3.6Å; R336-T360 HydrophobicContact CG-CG2 4.12Å
361F98.5Very high88.8Confident25 Ų2548 Ų4811%0.1129%0.292CS..  trans-118.2101.8-177-64.6-85.4000109.5V206 L208 F239 Q334 F359 E363 T364V206-F361 HydrophobicContact CB-CZ 4.39Å; V206-F361 HydrophobicContact CG1-CE2 4.07Å; V206-F361 HydrophobicContact CG1-CZ 3.92Å; L208-F361 HydrophobicContact CB-CD1 3.75Å; L208-F361 HydrophobicContact CB-CE1 3.82Å; L208-F361 HydrophobicContact CB-CG 4.17Å; L208-F361 HydrophobicContact CB-CZ 4.28Å; L208-F361 HydrophobicContact CD2-CB 4.29Å; L208-F361 HydrophobicContact CD2-CD1 4.43Å; L208-F361 HydrophobicContact CD2-CG 4.42Å; F239-F361 AromaticContact CD1-CE2 3.95Å; F239-F361 HydrophobicContact CD1-CE2 3.95Å; F239-F361 HydrophobicContact CD1-CZ 4.45Å; F239-F361 AromaticContact CE1-CD2 3.76Å; F239-F361 HydrophobicContact CE1-CD2 3.76Å; F239-F361 AromaticContact CE1-CE2 3.58Å; F239-F361 HydrophobicContact CE1-CE2 3.58Å; F239-F361 HydrophobicContact CE1-CZ 4.44Å; Q334-F361 PolarHBondContact NE2-O 2.89Å; F359-F361 HydrophobicContact CB-CE2 4.03Å; F361-E363 PolarHBondContact O-N 2.69Å; F361-T364 HydrophobicContact CB-CG2 3.82Å; F361-T364 PolarHBondContact O-N 2.68Å; F361-T364 PolarHBondContact O-OG1 3.18Å
362P98.4Very high90.9Very high74 Ų7447.4 Ų47.448%0.48128%0.278SS..G310 helixtrans-57.5-31.6-174.8-27.636.3000114H218 T364 Q365H218-P362 PolarHBondContact CE1-O 3.4Å; P362-T364 PolarHBondContact O-N 3.29Å; P362-Q365 WeakPolarHBondContact O-CB 3.34Å; P362-Q365 VanDerWaalsContact O-CG 3.28Å; P362-Q365 WeakPolarHBondContact O-CG 3.46Å; P362-Q365 PolarHBondContact O-N 3.13Å; P362-Q365 VanDerWaalsContact O-N 3.14Å
363E98.4Very high93Very high9 Ų945.5 Ų45.54%0.04227%0.269CS..G310 helixtrans-66.3-16.3176.870.8-83-16500113.9L208 R211 W214 L215 H218 F361 Q365L208-E363 HydrophobicContact CD2-CG 3.91Å; L208-E363 WeakPolarHBondContact CD2-OE1 3.45Å; R211-E363 WeakPolarHBondContact CD-OE1 3.36Å; R211-E363 HydrophobicContact CG-CG 4.45Å; R211-E363 IonicContact CZ-OE1 2.62Å; R211-E363 IonicContact CZ-OE2 3.28Å; R211-E363 IonicContact NE-OE1 3.92Å; R211-E363 PolarHBondContact NE-OE1 3.14Å; R211-E363 VanDerWaalsContact NH1-CD 3.26Å; R211-E363 IonicContact NH1-OE1 3.9Å; R211-E363 PolarHBondContact NH1-OE1 3.31Å; R211-E363 IonicContact NH1-OE2 3.45Å; R211-E363 PolarHBondContact NH1-OE2 3.14Å; R211-E363 IonicContact NH2-OE2 3.18Å; W214-E363 HydrophobicContact CB-CG 4.03Å; L215-E363 HydrophobicContact CD2-CB 3.78Å; L215-E363 HydrophobicContact CD2-CG 4.29Å; L215-E363 HydrophobicContact CG-CB 4.4Å; L215-E363 HydrophobicContact CG-CG 4.49Å; H218-E363 HydrophobicContact CB-CB 4.36Å; H218-E363 WeakPolarHBondContact ND1-CA 3.21Å; H218-E363 PolarHBondContact ND1-O 2.74Å; F361-E363 PolarHBondContact O-N 2.69Å; E363-Q365 VanDerWaalsContact C-N 3.33Å
364T98.8Very high95.1Very high1 Ų140 Ų401%0.00623%0.232CC..G310 helixtrans-86.80.717668.70000113.8L208 W214 L237 Q334 P335 F361 P362L208-T364 HydrophobicContact CD1-CG2 3.95Å; L208-T364 HydrophobicContact CD2-CG2 3.53Å; L208-T364 HydrophobicContact CG-CG2 4.43Å; W214-T364 HydrophobicContact CD2-CG2 3.85Å; W214-T364 HydrophobicContact CE3-CG2 3.96Å; W214-T364 HydrophobicContact CG-CG2 4.29Å; W214-T364 HydrophobicContact CH2-CG2 4.42Å; W214-T364 HydrophobicContact CZ2-CG2 4.32Å; W214-T364 HydrophobicContact CZ3-CG2 4.25Å; L237-T364 HydrophobicContact CD2-CG2 3.89Å; Q334-T364 PolarHBondContact NE2-OG1 3.02Å; P335-T364 WeakPolarHBondContact CD-O 3.36Å; F361-T364 HydrophobicContact CB-CG2 3.82Å; F361-T364 PolarHBondContact O-N 2.68Å; F361-T364 PolarHBondContact O-OG1 3.18Å; P362-T364 PolarHBondContact O-N 3.29Å
365Q98.7Very high96.7Very high39 Ų3941.3 Ų41.318%0.18223%0.229CC..  trans-58.2141.5171.1-72-179.214.100111.6T222 Y333 Q334 P362 E363T222-Q365 WeakPolarHBondContact CB-O 3.44Å; T222-Q365 PolarHBondContact OG1-O 3.42Å; Y333-Q365 VanDerWaalsContact O-CA 3.28Å; Y333-Q365 WeakPolarHBondContact O-CA 3.48Å; Q334-Q365 HydrophobicContact CB-CG 4.24Å; P362-Q365 WeakPolarHBondContact O-CB 3.34Å; P362-Q365 VanDerWaalsContact O-CG 3.28Å; P362-Q365 WeakPolarHBondContact O-CG 3.46Å; P362-Q365 PolarHBondContact O-N 3.13Å; P362-Q365 VanDerWaalsContact O-N 3.14Å; E363-Q365 VanDerWaalsContact C-N 3.33Å
366F98.8Very high97.5Very high2 Ų242.3 Ų42.31%0.00924%0.238CC..EExtended strand (participates in β ladder)trans-146159.2178.468.7-91.3000112.6T222 M224 M233 V256 L311 L327 K332 Y333 P335 A368T222-F366 HydrophobicContact CG2-CB 3.81Å; T222-F366 CarbonylContact O-C 3.54Å; T222-F366 WeakPolarHBondContact O-CA 3.42Å; T222-F366 VanDerWaalsContact O-CB 3.27Å; T222-F366 WeakPolarHBondContact O-CB 3.4Å; M224-F366 HydrophobicContact CB-CD2 3.51Å; M224-F366 HydrophobicContact CB-CE2 3.8Å; M224-F366 HydrophobicContact CB-CG 4.13Å; M224-F366 HydrophobicContact CG-CB 3.82Å; M224-F366 HydrophobicContact CG-CD1 4.1Å; M224-F366 HydrophobicContact CG-CD2 3.44Å; M224-F366 VanDerWaalsContact CG-CD2 3.44Å; M224-F366 HydrophobicContact CG-CE2 3.97Å; M224-F366 HydrophobicContact CG-CG 3.52Å; M224-F366 HydrophobicContact CG-CZ 4.5Å; M233-F366 HydrophobicContact CE-CD1 4.07Å; M233-F366 HydrophobicContact CE-CE1 3.73Å; M233-F366 HydrophobicContact CE-CZ 4.37Å; V256-F366 HydrophobicContact CG1-CE1 4.31Å; V256-F366 HydrophobicContact CG1-CZ 4.09Å; L311-F366 HydrophobicContact CD1-CE2 3.87Å; L311-F366 HydrophobicContact CD1-CZ 3.76Å; L327-F366 HydrophobicContact CD1-CE2 3.77Å; L327-F366 HydrophobicContact CD1-CZ 3.71Å; K332-F366 CarbonylContact C-O 3.55Å; K332-F366 WeakPolarHBondContact CA-O 3.45Å; Y333-F366 HydrophobicContact CD2-CE2 4.08Å; Y333-F366 HydrophobicContact CD2-CZ 4.45Å; Y333-F366 HydrophobicContact CG-CE2 4.48Å; Y333-F366 HydrophobicContact CG-CZ 4.42Å; Y333-F366 PolarHBondContact N-O 2.83Å; Y333-F366 PolarHBondContact O-N 2.9Å; Y333-F366 VanDerWaalsContact O-N 3.11Å; P335-F366 HydrophobicContact CG-CD1 4.24Å; P335-F366 HydrophobicContact CG-CE1 3.94Å; F366-A368 HydrophobicContact CE2-CB 4.13Å
367I98.6Very high98Very high3 Ų338.5 Ų38.52%0.01522%0.215CC..EExtended strand (participates in β ladder)trans-98.2128.1166.9-60.3173.5000108.4T222 E223 M224 W271 H331 K332 V369T222-I367 PolarHBondContact O-N 3.49Å; E223-I367 CarbonylContact C-O 3.6Å; E223-I367 WeakPolarHBondContact CA-O 3.35Å; M224-I367 PolarHBondContact N-O 3.29Å; W271-I367 HydrophobicContact CB-CD1 4.27Å; W271-I367 HydrophobicContact CD2-CD1 3.44Å; W271-I367 VanDerWaalsContact CD2-CD1 3.44Å; W271-I367 HydrophobicContact CE3-CD1 3.8Å; W271-I367 HydrophobicContact CG-CD1 3.67Å; W271-I367 HydrophobicContact CH2-CB 4.48Å; W271-I367 HydrophobicContact CH2-CD1 4.47Å; W271-I367 HydrophobicContact CH2-CG2 3.68Å; W271-I367 HydrophobicContact CZ2-CB 4.36Å; W271-I367 HydrophobicContact CZ2-CD1 4.2Å; W271-I367 HydrophobicContact CZ2-CG2 4.04Å; W271-I367 HydrophobicContact CZ3-CD1 4.29Å; W271-I367 HydrophobicContact CZ3-CG2 3.95Å; H331-I367 WeakPolarHBondContact O-CA 3.41Å; K332-I367 HydrophobicContact CB-CG1 4.16Å; K332-I367 HydrophobicContact CG-CG1 3.97Å; I367-V369 HydrophobicContact CG2-CG1 4.1Å
368A98.5Very high98.1Very high0 Ų038 Ų380%021%0.214CC..EExtended strand (participates in β ladder)trans-78.7131.8176.600000109.7M224 I226 L327 S329 L330 H331 Y333 F366M224-A368 WeakPolarHBondContact O-CA 3.2Å; I226-A368 HydrophobicContact CD1-CB 4.18Å; I226-A368 HydrophobicContact CG2-CB 3.98Å; L327-A368 HydrophobicContact CB-CB 4.33Å; L327-A368 HydrophobicContact CD1-CB 4.18Å; S329-A368 CarbonylContact C-O 3.6Å; L330-A368 PolarHBondContact N-O 2.92Å; H331-A368 PolarHBondContact O-N 2.89Å; Y333-A368 HydrophobicContact CD2-CB 3.9Å; Y333-A368 HydrophobicContact CE2-CB 3.59Å; F366-A368 HydrophobicContact CE2-CB 4.13Å
369V98.7Very high98.1Very high0 Ų037.9 Ų37.90%021%0.21CC..EExtended strand (participates in β ladder)trans-139.8153.1-174.8-60.40000111.6E223 M224 I225 I226 W271 L330 I367 A371 Y372 Q373E223-V369 HydrophobicContact CB-CG1 4.43Å; E223-V369 HydrophobicContact CB-CG2 3.96Å; M224-V369 PolarHBondContact O-N 2.88Å; I225-V369 CarbonylContact C-O 3.55Å; I225-V369 VanDerWaalsContact CA-O 3.24Å; I225-V369 WeakPolarHBondContact CA-O 3.35Å; I225-V369 HydrophobicContact CD1-CG2 4.12Å; I226-V369 PolarHBondContact N-O 2.84Å; W271-V369 HydrophobicContact CH2-CG1 3.8Å; W271-V369 HydrophobicContact CZ2-CG1 4.04Å; L330-V369 HydrophobicContact CD2-CG1 4.46Å; I367-V369 HydrophobicContact CG2-CG1 4.1Å; V369-A371 WeakPolarHBondContact CB-O 3.36Å; V369-A371 WeakPolarHBondContact CG2-O 3.27Å; V369-Y372 HydrophobicContact CG2-CD1 4.34Å; V369-Q373 HydrophobicContact CG1-CG 4.28Å
370T98.4Very high98.1Very high85 Ų8537.1 Ų37.152%0.52121%0.208SC..SBendtrans-85.1-28.617444.60000112.9I226I226-T370 HydrophobicContact CG1-CG2 4.47Å
371A98.4Very high98.1Very high54 Ų5434.1 Ų34.145%0.44619%0.189SC..SBendtrans-142.1153.2169.900000108.3V369 Q373V369-A371 WeakPolarHBondContact CB-O 3.36Å; V369-A371 WeakPolarHBondContact CG2-O 3.27Å; A371-Q373 PolarHBondContact O-NE2 2.91Å
372Y98.6Very high98Very high72 Ų7233.6 Ų33.628%0.28219%0.187SC..  trans-63.4145.6178.9-63.9-57.1000111.4E223 I225 V369 I377 T378 K381E223-Y372 HydrophobicContact CB-CD1 4.03Å; E223-Y372 HydrophobicContact CB-CE1 4.38Å; E223-Y372 WeakPolarHBondContact OE2-CA 3.3Å; I225-Y372 HydrophobicContact CD1-CD1 4.03Å; I225-Y372 HydrophobicContact CD1-CD2 4.29Å; I225-Y372 HydrophobicContact CD1-CE1 3.98Å; I225-Y372 HydrophobicContact CD1-CE2 4.24Å; I225-Y372 HydrophobicContact CD1-CG 4.17Å; I225-Y372 HydrophobicContact CG1-CD1 4.12Å; I225-Y372 HydrophobicContact CG1-CE1 3.54Å; I225-Y372 HydrophobicContact CG1-CE2 3.98Å; I225-Y372 VanDerWaalsContact CG1-CZ 3.45Å; V369-Y372 HydrophobicContact CG2-CD1 4.34Å; Y372-I377 HydrophobicContact CD1-CG2 4.12Å; Y372-I377 HydrophobicContact CE1-CG2 4.3Å; Y372-T378 VanDerWaalsContact CB-OG1 3.24Å; Y372-T378 WeakPolarHBondContact CB-OG1 3.24Å; Y372-T378 HydrophobicContact CD2-CG2 4.28Å; Y372-K381 HydrophobicContact CE1-CD 4.3Å; Y372-K381 HydrophobicContact CE1-CG 4.21Å; Y372-K381 HydrophobicContact CE2-CG 4.06Å; Y372-K381 WeakPolarHBondContact OH-CD 3.4Å; Y372-K381 WeakPolarHBondContact OH-CE 3.3Å; Y372-K381 WeakPolarHBondContact OH-CG 3.45Å
373Q98.4Very high97.9Very high76 Ų7633.6 Ų33.636%0.35518%0.183SC..  trans-107.1-45.3179.4-52.1-62.3-74.200110.9E223 F266 W271 V369 A371E223-Q373 PolarHBondContact OE1-N 2.79Å; E223-Q373 PolarHBondContact OE2-N 3.5Å; F266-Q373 HydrophobicContact CB-CB 3.59Å; F266-Q373 HydrophobicContact CB-CG 4.07Å; F266-Q373 HydrophobicContact CD1-CB 3.75Å; F266-Q373 HydrophobicContact CD2-CB 4.37Å; F266-Q373 HydrophobicContact CE1-CB 4.49Å; F266-Q373 VanDerWaalsContact CE1-O 3.27Å; F266-Q373 WeakPolarHBondContact CE1-O 3.44Å; F266-Q373 HydrophobicContact CG-CB 3.67Å; W271-Q373 HydrophobicContact CH2-CB 4.24Å; W271-Q373 HydrophobicContact CH2-CG 3.62Å; W271-Q373 HydrophobicContact CZ2-CB 3.84Å; W271-Q373 HydrophobicContact CZ2-CG 3.67Å; V369-Q373 HydrophobicContact CG1-CG 4.28Å; A371-Q373 PolarHBondContact O-NE2 2.91Å
374N97.6Very high97.8Very high15 Ų1535.8 Ų35.88%0.0819%0.193CC..  trans-85.6126.3174.8-170.8-4.6000111.8H220 E223 F266 D376 I377 T378H220-N374 PolarHBondContact O-ND2 2.86Å; E223-N374 VanDerWaalsContact OE1-CB 3.3Å; E223-N374 WeakPolarHBondContact OE1-CB 3.37Å; E223-N374 PolarHBondContact OE1-N 3.03Å; F266-N374 HydrophobicContact CE1-CB 4.47Å; F266-N374 HydrophobicContact CE2-CB 4.13Å; F266-N374 HydrophobicContact CZ-CB 3.83Å; N374-D376 VanDerWaalsContact C-N 3.34Å; N374-D376 WeakPolarHBondContact OD1-CB 3.34Å; N374-D376 PolarHBondContact OD1-N 3.02Å; N374-I377 HydrophobicContact CB-CB 4.2Å; N374-I377 HydrophobicContact CB-CG1 3.93Å; N374-I377 PolarHBondContact O-N 3.25Å; N374-T378 PolarHBondContact O-N 3.39Å; N374-T378 VanDerWaalsContact O-N 3.16Å; N374-T378 PolarHBondContact O-OG1 2.89Å; N374-T378 VanDerWaalsContact O-OG1 3.11Å
375T96.4Very high97.8Very high81 Ų8136.9 Ų36.950%0.49720%0.199SC..Hα-helixtrans-63.9-35.4173.442.10000112.6I377 T378 Q379T375-I377 VanDerWaalsContact C-N 3.32Å; T375-I377 PolarHBondContact O-N 3.35Å; T375-T378 WeakPolarHBondContact O-CA 2.99Å; T375-T378 WeakPolarHBondContact O-CB 3.5Å; T375-T378 PolarHBondContact O-N 3.38Å; T375-T378 VanDerWaalsContact O-N 3.12Å; T375-Q379 PolarHBondContact O-N 3.1Å
376D97.1Very high97.6Very high70 Ų7039.6 Ų39.637%0.37422%0.22SC..Hα-helixtrans-62.5-42.4177.8-52.3-16000111H220 N374 T378 Q379 L380H220-D376 HydrophobicContact CB-CB 4.24Å; H220-D376 IonicContact CE1-OD2 3.49Å; H220-D376 PolarHBondContact CE1-OD2 3.12Å; H220-D376 IonicContact CG-OD2 2.83Å; H220-D376 VanDerWaalsContact ND1-CB 3.3Å; H220-D376 WeakPolarHBondContact ND1-CB 3.47Å; H220-D376 IonicContact ND1-OD2 2.78Å; H220-D376 PolarHBondContact ND1-OD2 3.4Å; N374-D376 VanDerWaalsContact C-N 3.34Å; N374-D376 WeakPolarHBondContact OD1-CB 3.34Å; N374-D376 PolarHBondContact OD1-N 3.02Å; D376-T378 VanDerWaalsContact C-N 3.33Å; D376-Q379 PolarHBondContact O-N 2.93Å; D376-L380 WeakPolarHBondContact O-CG 3.24Å; D376-L380 PolarHBondContact O-N 3.16Å
377I98.2Very high97.4Very high0 Ų048 Ų480%026%0.257CS..Hα-helixtrans-61.8-47174.8-67.6-69.6000108.8F217 H220 E223 Y372 N374 T375 Q379 L380 K381F217-I377 HydrophobicContact CD1-CD1 3.95Å; H220-I377 HydrophobicContact CB-CD1 3.66Å; H220-I377 HydrophobicContact CB-CG1 4.02Å; E223-I377 HydrophobicContact CB-CG2 4.02Å; E223-I377 HydrophobicContact CG-CG1 4.32Å; E223-I377 HydrophobicContact CG-CG2 4.26Å; Y372-I377 HydrophobicContact CD1-CG2 4.12Å; Y372-I377 HydrophobicContact CE1-CG2 4.3Å; N374-I377 HydrophobicContact CB-CB 4.2Å; N374-I377 HydrophobicContact CB-CG1 3.93Å; N374-I377 PolarHBondContact O-N 3.25Å; T375-I377 VanDerWaalsContact C-N 3.32Å; T375-I377 PolarHBondContact O-N 3.35Å; I377-Q379 VanDerWaalsContact C-N 3.31Å; I377-Q379 PolarHBondContact O-N 2.94Å; I377-L380 PolarHBondContact O-N 3.19Å; I377-K381 HydrophobicContact CG2-CG 4.38Å; I377-K381 VanDerWaalsContact O-CG 3.24Å; I377-K381 WeakPolarHBondContact O-CG 3.36Å; I377-K381 PolarHBondContact O-N 3.43Å
378T97.1Very high97.2Very high25 Ų2548.6 Ų48.615%0.15326%0.262CS..Hα-helixtrans-56.3-43.9178.5-56.10000112Y372 N374 T375 D376 K381 I382 Y395Y372-T378 VanDerWaalsContact CB-OG1 3.24Å; Y372-T378 WeakPolarHBondContact CB-OG1 3.24Å; Y372-T378 HydrophobicContact CD2-CG2 4.28Å; N374-T378 PolarHBondContact O-N 3.39Å; N374-T378 VanDerWaalsContact O-N 3.16Å; N374-T378 PolarHBondContact O-OG1 2.89Å; N374-T378 VanDerWaalsContact O-OG1 3.11Å; T375-T378 WeakPolarHBondContact O-CA 2.99Å; T375-T378 WeakPolarHBondContact O-CB 3.5Å; T375-T378 PolarHBondContact O-N 3.38Å; T375-T378 VanDerWaalsContact O-N 3.12Å; D376-T378 VanDerWaalsContact C-N 3.33Å; T378-K381 WeakPolarHBondContact O-CB 3.29Å; T378-K381 PolarHBondContact O-N 3.24Å; T378-I382 HydrophobicContact CG2-CD1 4.16Å; T378-I382 WeakPolarHBondContact O-CG1 3.37Å; T378-I382 PolarHBondContact O-N 2.92Å; T378-I382 VanDerWaalsContact O-N 3.11Å; T378-Y395 HydrophobicContact CG2-CE2 3.86Å
379Q96.2Very high96.8Very high55 Ų5555 Ų5526%0.25729%0.29SS..Hα-helixtrans-61.2-52173.1-81.5-69.9-77.800112.6T375 D376 I377 K381 I382 D383 Y395T375-Q379 PolarHBondContact O-N 3.1Å; D376-Q379 PolarHBondContact O-N 2.93Å; I377-Q379 VanDerWaalsContact C-N 3.31Å; I377-Q379 PolarHBondContact O-N 2.94Å; Q379-K381 PolarHBondContact O-N 3.49Å; Q379-K381 VanDerWaalsContact O-N 3.1Å; Q379-I382 WeakPolarHBondContact O-CA 3.49Å; Q379-I382 PolarHBondContact O-N 3.35Å; Q379-D383 PolarHBondContact O-N 3.11Å; Q379-Y395 HydrophobicContact CG-CD1 4.21Å; Q379-Y395 HydrophobicContact CG-CE1 3.78Å; Q379-Y395 VanDerWaalsContact NE2-CE1 3.34Å
380L97.7Very high96.5Very high24 Ų2458.2 Ų58.213%0.12632%0.323CS..Hα-helixtrans-55.7-33.6176.6-71.8172.9000112.5K216 F217 D376 I377 H384K216-L380 HydrophobicContact CB-CD2 4.5Å; K216-L380 HydrophobicContact CD-CD2 4.42Å; F217-L380 HydrophobicContact CD1-CB 4.01Å; F217-L380 HydrophobicContact CD1-CD1 4.21Å; F217-L380 HydrophobicContact CE1-CB 3.4Å; F217-L380 HydrophobicContact CE1-CD1 4.44Å; F217-L380 HydrophobicContact CE2-CB 4.36Å; F217-L380 VanDerWaalsContact CZ-C 3.48Å; F217-L380 HydrophobicContact CZ-CB 3.62Å; F217-L380 WeakPolarHBondContact CZ-O 3.24Å; D376-L380 WeakPolarHBondContact O-CG 3.24Å; D376-L380 PolarHBondContact O-N 3.16Å; I377-L380 PolarHBondContact O-N 3.19Å; L380-H384 WeakPolarHBondContact O-CB 3.44Å; L380-H384 PolarHBondContact O-N 3.32Å; L380-H384 PolarHBondContact O-ND1 3.29Å
381K98Very high96.1Very high7 Ų760 Ų603%0.0332%0.324CS..Hα-helixtrans-66.3-47.1172.4-57.1-73.3176.6167.20111.3F217 E223 F234 Y372 I377 T378 Q379 N385F217-K381 HydrophobicContact CE1-CD 3.68Å; F217-K381 HydrophobicContact CE1-CG 4.07Å; F217-K381 HydrophobicContact CZ-CD 3.98Å; F217-K381 HydrophobicContact CZ-CG 4.47Å; E223-K381 WeakPolarHBondContact O-CE 3.45Å; E223-K381 PolarHBondContact O-NZ 2.98Å; F234-K381 HydrophobicContact CD1-CD 3.95Å; F234-K381 PolarHBondContact O-NZ 2.9Å; Y372-K381 HydrophobicContact CE1-CD 4.3Å; Y372-K381 HydrophobicContact CE1-CG 4.21Å; Y372-K381 HydrophobicContact CE2-CG 4.06Å; Y372-K381 WeakPolarHBondContact OH-CD 3.4Å; Y372-K381 WeakPolarHBondContact OH-CE 3.3Å; Y372-K381 WeakPolarHBondContact OH-CG 3.45Å; I377-K381 HydrophobicContact CG2-CG 4.38Å; I377-K381 VanDerWaalsContact O-CG 3.24Å; I377-K381 WeakPolarHBondContact O-CG 3.36Å; I377-K381 PolarHBondContact O-N 3.43Å; T378-K381 WeakPolarHBondContact O-CB 3.29Å; T378-K381 PolarHBondContact O-N 3.24Å; Q379-K381 PolarHBondContact O-N 3.49Å; Q379-K381 VanDerWaalsContact O-N 3.1Å; K381-N385 WeakPolarHBondContact O-CA 3.44Å; K381-N385 WeakPolarHBondContact O-CB 3.48Å; K381-N385 PolarHBondContact O-N 2.78Å
382I96.8Very high95.8Very high13 Ų1361.8 Ų61.87%0.06732%0.319CS..Hα-helixtrans-62.8-45.2-177.8-71.5167.4000111T378 Q379 A388 F391 R392 Y395T378-I382 HydrophobicContact CG2-CD1 4.16Å; T378-I382 WeakPolarHBondContact O-CG1 3.37Å; T378-I382 PolarHBondContact O-N 2.92Å; T378-I382 VanDerWaalsContact O-N 3.11Å; Q379-I382 WeakPolarHBondContact O-CA 3.49Å; Q379-I382 PolarHBondContact O-N 3.35Å; I382-A388 HydrophobicContact CG1-CB 4.42Å; I382-F391 HydrophobicContact CD1-CB 3.91Å; I382-F391 HydrophobicContact CG1-CB 4.03Å; I382-F391 HydrophobicContact CG2-CB 4.03Å; I382-R392 HydrophobicContact CG2-CB 4.29Å; I382-R392 HydrophobicContact CG2-CG 3.52Å; I382-R392 VanDerWaalsContact O-CZ 3.26Å; I382-R392 PolarHBondContact O-NE 3.14Å; I382-R392 PolarHBondContact O-NH2 3.07Å; I382-Y395 HydrophobicContact CD1-CD2 3.35Å; I382-Y395 HydrophobicContact CD1-CE2 3.71Å; I382-Y395 HydrophobicContact CD1-CG 4.25Å
383D96.6Very high94.9Very high75 Ų7565 Ų6540%0.40134%0.341SS..Hα-helixtrans-66.2-39.2-179.5-68.9-19.2000114.3Q379 R392Q379-D383 PolarHBondContact O-N 3.11Å; D383-R392 PolarHBondContact O-NH1 3.12Å; D383-R392 PolarHBondContact O-NH2 3.1Å
384H97Very high93.7Very high55 Ų5565.4 Ų65.426%0.25535%0.346SS..Hα-helixtrans-105.3-22-169.7-58.583.9000113.3L213 K216 F234 L380 P386L213-H384 HydrophobicContact CD1-CB 3.99Å; L213-H384 WeakPolarHBondContact CD1-CD2 3.4Å; L213-H384 HydrophobicContact CD2-CB 4.43Å; K216-H384 PolarHBondContact NZ-NE2 3.03Å; F234-H384 HydrophobicContact CE1-CB 3.91Å; F234-H384 HydrophobicContact CZ-CB 3.86Å; F234-H384 VanDerWaalsContact CZ-O 3.29Å; F234-H384 WeakPolarHBondContact CZ-O 3.33Å; L380-H384 WeakPolarHBondContact O-CB 3.44Å; L380-H384 PolarHBondContact O-N 3.32Å; L380-H384 PolarHBondContact O-ND1 3.29Å; H384-P386 WeakPolarHBondContact O-CD 3.41Å
385N97Very high92.3Very high23 Ų2365.7 Ų65.712%0.12335%0.346CS..  trans-88.1119.5179.4-170-14.9000111.2F234 K381 F387 A388 R392F234-N385 HydrophobicContact CD1-CB 3.96Å; F234-N385 HydrophobicContact CD2-CB 3.91Å; F234-N385 HydrophobicContact CE1-CB 3.86Å; F234-N385 HydrophobicContact CE2-CB 3.8Å; F234-N385 HydrophobicContact CG-CB 4Å; F234-N385 HydrophobicContact CZ-CB 3.8Å; K381-N385 WeakPolarHBondContact O-CA 3.44Å; K381-N385 WeakPolarHBondContact O-CB 3.48Å; K381-N385 PolarHBondContact O-N 2.78Å; N385-F387 PolarHBondContact O-N 3.2Å; N385-F387 WeakPolarHBondContact OD1-CB 3.5Å; N385-F387 WeakPolarHBondContact OD1-CD2 3.5Å; N385-F387 PolarHBondContact OD1-N 3.24Å; N385-A388 HydrophobicContact CB-CB 4.1Å; N385-A388 PolarHBondContact O-N 2.91Å; N385-R392 PolarHBondContact O-NH2 3.41Å
386P95.8Very high91Very high97 Ų9766.5 Ų66.563%0.6335%0.347SS*.G310 helixtrans-57.6-34.9176.6-25.435.6000113.2H384 A388 K389H384-P386 WeakPolarHBondContact O-CD 3.41Å; P386-A388 PolarHBondContact O-N 3.11Å; P386-K389 WeakPolarHBondContact O-CB 3.5Å; P386-K389 PolarHBondContact O-N 2.94Å
387F94.3Very high89.8Confident179 Ų17968 Ų6879%0.78536%0.359SS*.G310 helixtrans-73.8-2.6179.3-57.2-72.4000114N385N385-F387 PolarHBondContact O-N 3.2Å; N385-F387 WeakPolarHBondContact OD1-CB 3.5Å; N385-F387 WeakPolarHBondContact OD1-CD2 3.5Å; N385-F387 PolarHBondContact OD1-N 3.24Å
388A94.1Very high88.4Confident15 Ų1573 Ų7312%0.12438%0.384CS..G310 helixtrans-112.96.817600000113.1I382 N385 P386 G390 F391I382-A388 HydrophobicContact CG1-CB 4.42Å; N385-A388 HydrophobicContact CB-CB 4.1Å; N385-A388 PolarHBondContact O-N 2.91Å; P386-A388 PolarHBondContact O-N 3.11Å; A388-G390 VanDerWaalsContact C-N 3.25Å; A388-G390 PolarHBondContact O-N 2.91Å; A388-G390 VanDerWaalsContact O-N 3.14Å; A388-F391 PolarHBondContact O-N 2.73Å; A388-F391 VanDerWaalsContact O-N 3.1Å
389K91.4Very high86.9Confident134 Ų13479 Ų7958%0.58341%0.405SS*.G310 helixtrans-52.5-39.9-174.4-172.2-173.6174.3-171.80113.5P386 F391 R392P386-K389 WeakPolarHBondContact O-CB 3.5Å; P386-K389 PolarHBondContact O-N 2.94Å; K389-F391 PolarHBondContact O-N 2.96Å; K389-R392 WeakPolarHBondContact O-CB 3.47Å; K389-R392 WeakPolarHBondContact O-CG 3.39Å; K389-R392 PolarHBondContact O-N 3.1Å; K389-R392 VanDerWaalsContact O-N 3.07Å
390G92.2Very high85.4Confident67 Ų6780.6 Ų80.669%0.69142%0.419SS*.G310 helixtrans-65.6-2.3-178.300000116.2A388A388-G390 VanDerWaalsContact C-N 3.25Å; A388-G390 PolarHBondContact O-N 2.91Å; A388-G390 VanDerWaalsContact O-N 3.14Å
391F90.2Very high83.4Confident124 Ų12481.5 Ų81.554%0.54443%0.434SS..G310 helixtrans-101.2-8.1173-63.1-75000113.7I382 A388 K389 N394 Y395I382-F391 HydrophobicContact CD1-CB 3.91Å; I382-F391 HydrophobicContact CG1-CB 4.03Å; I382-F391 HydrophobicContact CG2-CB 4.03Å; A388-F391 PolarHBondContact O-N 2.73Å; A388-F391 VanDerWaalsContact O-N 3.1Å; K389-F391 PolarHBondContact O-N 2.96Å; F391-N394 PolarHBondContact O-N 3.2Å; F391-Y395 WeakPolarHBondContact O-CB 3.43Å; F391-Y395 PolarHBondContact O-N 2.84Å; F391-Y395 VanDerWaalsContact O-N 3.1Å
392R90.5Very high81.3Confident90 Ų9086.3 Ų86.334%0.3447%0.467SS..G310 helixtrans-63.7-51.5-174.8-70172.7-167.3-157.92112I382 D383 N385 K389 N394I382-R392 HydrophobicContact CG2-CB 4.29Å; I382-R392 HydrophobicContact CG2-CG 3.52Å; I382-R392 VanDerWaalsContact O-CZ 3.26Å; I382-R392 PolarHBondContact O-NE 3.14Å; I382-R392 PolarHBondContact O-NH2 3.07Å; D383-R392 PolarHBondContact O-NH1 3.12Å; D383-R392 PolarHBondContact O-NH2 3.1Å; N385-R392 PolarHBondContact O-NH2 3.41Å; K389-R392 WeakPolarHBondContact O-CB 3.47Å; K389-R392 WeakPolarHBondContact O-CG 3.39Å; K389-R392 PolarHBondContact O-N 3.1Å; K389-R392 VanDerWaalsContact O-N 3.07Å; R392-N394 PolarHBondContact O-N 3.02Å; R392-N394 VanDerWaalsContact O-N 3.12Å
393D80.4Confident79.2Confident139 Ų13992 Ų9274%0.74350%0.498SS*.G310 helixtrans-75.5-1.6-172.5-44-53.8000112.9
394N72.3Confident77.2Confident85 Ų8594.8 Ų94.846%0.45551%0.51SS..G310 helixtrans-132-8-170.8-98.8114.2000115.2F391 R392 D396 T397 I398F391-N394 PolarHBondContact O-N 3.2Å; R392-N394 PolarHBondContact O-N 3.02Å; R392-N394 VanDerWaalsContact O-N 3.12Å; N394-D396 PolarHBondContact O-N 3.5Å; N394-T397 PolarHBondContact O-N 3.49Å; N394-I398 HydrophobicContact CB-CD1 4.13Å; N394-I398 WeakPolarHBondContact O-CD1 3.31Å; N394-I398 VanDerWaalsContact O-CG1 3.31Å; N394-I398 WeakPolarHBondContact O-CG1 3.5Å; N394-I398 PolarHBondContact O-N 3.16Å
395Y69.8Low75.1Confident22 Ų2299.5 Ų99.59%0.08654%0.537CS..Hα-helixtrans-62.8-47.3-170.4-175.1-91.5000112.8T378 Q379 I382 F391 T397 I398 Y399T378-Y395 HydrophobicContact CG2-CE2 3.86Å; Q379-Y395 HydrophobicContact CG-CD1 4.21Å; Q379-Y395 HydrophobicContact CG-CE1 3.78Å; Q379-Y395 VanDerWaalsContact NE2-CE1 3.34Å; I382-Y395 HydrophobicContact CD1-CD2 3.35Å; I382-Y395 HydrophobicContact CD1-CE2 3.71Å; I382-Y395 HydrophobicContact CD1-CG 4.25Å; F391-Y395 WeakPolarHBondContact O-CB 3.43Å; F391-Y395 PolarHBondContact O-N 2.84Å; F391-Y395 VanDerWaalsContact O-N 3.1Å; Y395-T397 PolarHBondContact O-N 2.79Å; Y395-I398 PolarHBondContact O-N 2.98Å; Y395-I398 VanDerWaalsContact O-N 3.07Å; Y395-Y399 HydrophobicContact CD1-CD2 4.24Å; Y395-Y399 AromaticContact CD2-CD2 3.65Å; Y395-Y399 HydrophobicContact CD2-CD2 3.65Å; Y395-Y399 AromaticContact CD2-CE2 3.91Å; Y395-Y399 HydrophobicContact CD2-CE2 3.91Å; Y395-Y399 HydrophobicContact CE1-CD2 4.05Å; Y395-Y399 HydrophobicContact CE1-CG 4.3Å; Y395-Y399 AromaticContact CE2-CD2 3.44Å; Y395-Y399 HydrophobicContact CE2-CD2 3.44Å; Y395-Y399 VanDerWaalsContact CE2-CD2 3.44Å; Y395-Y399 AromaticContact CE2-CE2 3.6Å; Y395-Y399 HydrophobicContact CE2-CE2 3.6Å; Y395-Y399 HydrophobicContact CE2-CG 4.28Å; Y395-Y399 HydrophobicContact CG-CD2 4.08Å; Y395-Y399 AromaticContact CZ-CD2 3.67Å; Y395-Y399 PolarHBondContact O-N 3.07Å
396D68.7Low72.7Confident97 Ų97108.3 Ų108.352%0.51957%0.569SS.*Hα-helixtrans-60.5-46.7-179.9-61.9-35000110.6N394 I398 Y399 T400 G401N394-D396 PolarHBondContact O-N 3.5Å; D396-I398 PolarHBondContact O-N 3.07Å; D396-I398 VanDerWaalsContact O-N 3.07Å; D396-Y399 PolarHBondContact O-N 3.21Å; D396-Y399 VanDerWaalsContact O-N 3.16Å; D396-T400 PolarHBondContact O-N 3.45Å; D396-T400 PolarHBondContact O-OG1 2.83Å; D396-G401 PolarHBondContact O-N 3.4Å
397T72.2Confident70.6Confident102 Ų102110.1 Ų110.163%0.62657%0.572SS**Hα-helixtrans-54.8-31.9175.6-38.90000113.2N394 Y395N394-T397 PolarHBondContact O-N 3.49Å; Y395-T397 PolarHBondContact O-N 2.79Å
398I67.6Low68.4Low104 Ų104106.9 Ų106.953%0.53357%0.568SS.*Hα-helixtrans-86.6-32.3-178-65.6167.4000112.4N394 Y395 D396N394-I398 HydrophobicContact CB-CD1 4.13Å; N394-I398 WeakPolarHBondContact O-CD1 3.31Å; N394-I398 VanDerWaalsContact O-CG1 3.31Å; N394-I398 WeakPolarHBondContact O-CG1 3.5Å; N394-I398 PolarHBondContact O-N 3.16Å; Y395-I398 PolarHBondContact O-N 2.98Å; Y395-I398 VanDerWaalsContact O-N 3.07Å; D396-I398 PolarHBondContact O-N 3.07Å; D396-I398 VanDerWaalsContact O-N 3.07Å
399Y65.3Low66.2Low151 Ų151111.8 Ų111.859%0.59260%0.598SS**Hα-helixtrans-115.8-20.4-170.9-73.5-79.3000116Y395 D396Y395-Y399 HydrophobicContact CD1-CD2 4.24Å; Y395-Y399 AromaticContact CD2-CD2 3.65Å; Y395-Y399 HydrophobicContact CD2-CD2 3.65Å; Y395-Y399 AromaticContact CD2-CE2 3.91Å; Y395-Y399 HydrophobicContact CD2-CE2 3.91Å; Y395-Y399 HydrophobicContact CE1-CD2 4.05Å; Y395-Y399 HydrophobicContact CE1-CG 4.3Å; Y395-Y399 AromaticContact CE2-CD2 3.44Å; Y395-Y399 HydrophobicContact CE2-CD2 3.44Å; Y395-Y399 VanDerWaalsContact CE2-CD2 3.44Å; Y395-Y399 AromaticContact CE2-CE2 3.6Å; Y395-Y399 HydrophobicContact CE2-CE2 3.6Å; Y395-Y399 HydrophobicContact CE2-CG 4.28Å; Y395-Y399 HydrophobicContact CG-CD2 4.08Å; Y395-Y399 AromaticContact CZ-CD2 3.67Å; Y395-Y399 PolarHBondContact O-N 3.07Å; D396-Y399 PolarHBondContact O-N 3.21Å; D396-Y399 VanDerWaalsContact O-N 3.16Å
400T66.2Low64.1Low90 Ų90110.3 Ų110.355%0.55261%0.605SS**THydrogen-bonded Turntrans-108.6-5.6175.667.70000113.1D396 C402D396-T400 PolarHBondContact O-N 3.45Å; D396-T400 PolarHBondContact O-OG1 2.83Å; T400-C402 PolarHBondContact O-N 2.88Å
401G55.1Low62.1Low42 Ų42113.1 Ų113.143%0.43361%0.611SS.*THydrogen-bonded Turntrans-66.221.4-178.500000117.4D396D396-G401 PolarHBondContact O-N 3.4Å
402C54.7Low59.9Low108 Ų108114.2 Ų114.273%0.7362%0.622SS**THydrogen-bonded Turntrans-101.6-12.3176.2-70.70000114.4T400T400-C402 PolarHBondContact O-N 2.88Å
403D51.9Low57.4Low133 Ų133117.9 Ų117.971%0.71165%0.649SS**SBendtrans-115.8-2.1-172-79.1-67.3000115.6
404M55Low55.8Low134 Ų134116.6 Ų116.666%0.6665%0.651SS**SBendtrans-86.4-47177.4-109-69.6118.200113.5R406 L407M404-R406 PolarHBondContact O-N 2.94Å; M404-L407 HydrophobicContact CE-CD1 4.13Å; M404-L407 PolarHBondContact O-N 3.47Å
405D53.3Low54.4Low154 Ų154118.5 Ų118.582%0.82467%0.667SS**THydrogen-bonded Turntrans-75.214.8-173.8-65.2-57.2000115
406R46.2Very low52.8Low207 Ų207128.9 Ų128.978%0.78171%0.706SS**THydrogen-bonded Turntrans-100.7-1.2173-97.4-178.8172.4161.2-0.5114.9M404 T408M404-R406 PolarHBondContact O-N 2.94Å; R406-T408 PolarHBondContact O-N 3.38Å
407L52.1Low51.8Low135 Ų135130.1 Ų130.171%0.70772%0.723SS**  trans-75.971.6163.3-64.5-178.6000110.2M404 P409M404-L407 HydrophobicContact CE-CD1 4.13Å; M404-L407 PolarHBondContact O-N 3.47Å; L407-P409 VanDerWaalsContact O-CD 3.3Å; L407-P409 WeakPolarHBondContact O-CD 3.3Å
408T48.3Very low50.5Low112 Ų112133.9 Ų133.969%0.68773%0.733SS**  trans-57.6118166.849.20000108.7R406 S410R406-T408 PolarHBondContact O-N 3.38Å; T408-S410 PolarHBondContact O-N 3.46Å
409P47.8Very low49.4Very low118 Ų118136.1 Ų136.177%0.76675%0.745SS**  trans-69.9106.4177.427.9-32.5000108.4L407 P411L407-P409 VanDerWaalsContact O-CD 3.3Å; L407-P409 WeakPolarHBondContact O-CD 3.3Å; P409-P411 WeakPolarHBondContact O-CD 3.21Å
410S45.6Very low48.7Very low103 Ų103135.7 Ų135.772%0.7276%0.758SS**  trans-52.8111.5-178.1-64.90000111T408 N412T408-S410 PolarHBondContact O-N 3.46Å; S410-N412 PolarHBondContact O-N 2.93Å
411P50Low47.5Very low125 Ų125137 Ų13781%0.81277%0.767SS**SBendtrans-85.459.8-172.635.1-35000110.8P409P409-P411 WeakPolarHBondContact O-CD 3.21Å
412N44.9Very low46.9Very low148 Ų148138.5 Ų138.579%0.79178%0.783SS**  trans-164.779.4173.6-112.2-13.5000112.3S410S410-N412 PolarHBondContact O-N 2.93Å
413D39Very low46.4Very low167 Ų167137.7 Ų137.789%0.89378%0.784SS**  trans-149.764.1160.1-115.1-37.2000110.4
414S45.1Very low46.1Very low112 Ų112140.5 Ų140.578%0.78379%0.785SS**  trans-84.5122173.7-73.40000110.2R416S414-R416 PolarHBondContact O-N 3.01Å
415P43.3Very low45.5Very low124 Ų124143.4 Ų143.481%0.80579%0.79SS**  trans-75125-173.428.4-34.4000112.9
416R36.1Very low45Very low240 Ų240140.2 Ų140.291%0.90679%0.785SS**  trans57.673.6138.9-167.5-167.917891.4-3116.5S414S414-R416 PolarHBondContact O-N 3.01Å
417S48Very low44.8Very low124 Ų124139 Ų13987%0.86779%0.79SS**  trans-105.4157.215360.90000110.9
418Q45.3Very low44.3Very low180 Ų180137 Ų13784%0.84179%0.793SS**  trans-99.8129.8-157.1-66.6161.9-76.500114.9
419I44.2Very low43.9Very low151 Ų151135.4 Ų135.477%0.77480%0.799SS**  trans26.4104.5133.7-47.9167.7000117.1
420V50.9Low43.5Very low143 Ų143135.1 Ų135.187%0.86780%0.8SS**  -152.3124.1123.1-173.40000109.1
421P40.8Very low43.1Very low116 Ų116139.8 Ų139.875%0.75381%0.808SS**  trans-103.1147.7172.736.4-30.6000113
422G43.5Very low42.8Very low75 Ų75141 Ų14177%0.77381%0.807SS**  trans-173.998175.300000118.6
423A43.5Very low42.5Very low91 Ų91142.5 Ų142.575%0.75281%0.809SS**  trans65.2150.6146.300000120.6
424R45.9Very low42.4Very low192 Ų192139.9 Ų139.973%0.72580%0.795SS**  cis-165158.4-19.1-113.7-167.2-78.6-177.1-10.1109.8
425Y42.4Very low42.1Very low195 Ų195143 Ų14377%0.76580%0.797SS**  trans67.1149.5168.8-55-65.7000117.2
426A42.7Very low41.9Very low86 Ų86145.2 Ų145.271%0.71179%0.794SS**  cis-162.9163.5-23.200000112.2
427M42.1Very low42.1Very low181 Ų181139.9 Ų139.989%0.89279%0.788SS**  trans-21.2156.9156.9-59.8-59.2-160.600118.2
428A41Very low41.5Very low94 Ų94138.4 Ų138.478%0.77778%0.778SS**  cis-177.9172.4-15.400000109.2
429G39.9Very low41.1Very low79 Ų79135.5 Ų135.581%0.81477%0.768SS**  trans127.6114.7149.400000116.3
430S38.3Very low40.8Very low111 Ų111138.3 Ų138.378%0.77677%0.77SS**  trans-75.1158.3167.5-45.10000111.4
431F38.5Very low40.2Very low201 Ų201135.6 Ų135.688%0.88276%0.763SS**  -167.9165.9107.5-117.2-89.3000112.3
432L43.4Very low40.1Very low151 Ų151140.2 Ų140.279%0.79177%0.771SS**  trans-81.5150.3-179.5-65.5156.4000112.1
433Q38.3Very low39.8Very low180 Ų180140.2 Ų140.284%0.84176%0.764SS**  -162141.8124-163.755.14500111.1
434D36.6Very low39.4Very low111 Ų111146.4 Ų146.459%0.59477%0.768SS**  trans-91.3136.5172.8162.235.5000111
435Q39.3Very low39.1Very low177 Ų177146.5 Ų146.583%0.82777%0.774SS**  trans-167.3112141.1-109.7170.76.700116.4
436F39Very low38.9Very low172 Ų172145.5 Ų145.575%0.75478%0.776SS**  57.4145.9122.4-84.2-103.8000125
437V40.4Very low39.1Very low128 Ų128147.4 Ų147.478%0.77678%0.781SS**  trans75.887.6161.1-159.80000121.5
438S36.2Very low38.9Very low93 Ų93142.2 Ų142.265%0.6577%0.773SS**  52.6129.1109.3-146.10000124.3
439N35.8Very low38.9Very low119 Ų119143 Ų14364%0.63678%0.781SS**  trans82.1153.7144-73.2-14.9000123.6
440Y38.5Very low38.8Very low210 Ų210142.7 Ų142.782%0.82478%0.777SS**  trans68.3108.4169.5-44.2-66.7000116.2
441A37.8Very low39Very low86 Ų86142.8 Ų142.871%0.71179%0.785SS**  cis97.2119.925.300000115.9
442K38.2Very low39.1Very low212 Ų212136.7 Ų136.792%0.92278%0.778SS**  trans67.7146.7171.6-57.1176177.8172.90114.6
443A38.9Very low39.1Very low75 Ų75136.1 Ų136.162%0.6278%0.784SS**  cis-164.3162.96.400000111.7
444R35.2Very low39Very low222 Ų222131 Ų13184%0.83878%0.78SS**  trans61.1143.6152.5-61170.4-167.7168.13.6116.4
445F39.1Very low39.5Very low194 Ų194132.5 Ų132.585%0.85180%0.795SS**  -144.8170.351.3-93-93.8000114.6
446H37.3Very low39.5Very low174 Ų174126.8 Ų126.881%0.80678%0.784SS**  trans-125.3-178.6179.3-81.3-69.8000108.5
447P47.8Very low39.7Very low125 Ų125124.9 Ų124.981%0.81279%0.786SS**  cis-138.3-173.8-47.140-24.2000112.6
448G37.6Very low39.5Very low72 Ų72125.6 Ų125.674%0.74279%0.786SS**  trans151.4167.8148.400000114.5
449A41Very low39.6Very low112 Ų112131.7 Ų131.793%0.92679%0.794SS**  cis-174.6140-27.800000108.4
450G38.4Very low39.7Very low72 Ų72131.1 Ų131.174%0.74280%0.8SS**  trans128.7111.4-17900000110.9
451A41.4Very low39.7Very low113 Ų113127.7 Ų127.793%0.93480%0.8SS**  70.6128.167.800000112.1
452G41.4Very low40Very low73 Ų73128.3 Ų128.375%0.75380%0.797SS**  cis-145.3-162.915.100000115.4
453P43.9Very low39.9Very low139 Ų139126.2 Ų126.290%0.90379%0.79SS**  trans-122.5175.2-151.943.1-33.5000116.3
454G35.9Very low39.6Very low73 Ų73127.8 Ų127.875%0.75379%0.793SS**  trans157.6130.1155.200000116.1
455P45.9Very low39.6Very low142 Ų142124.8 Ų124.892%0.92279%0.793SS**  trans-124.5170.8-178.141.9-30000115.9
456G39.7Very low39.6Very low57 Ų57118.9 Ų118.959%0.58879%0.787SS**  trans177.9125.3165.300000111
457T43.1Very low39.8Very low132 Ų132118 Ų11881%0.8179%0.787SS**  64.1126.774.262.90000113.5
458D37.3Very low39.6Very low142 Ų142119.1 Ų119.176%0.75979%0.786SS**  cis-169.5180-3.4-137.8-57.2000112.2
459R37.1Very low39.6Very low221 Ų221120.4 Ų120.483%0.83478%0.783SS**  trans75.3128.1146.4-103.7178.9173.2134.4-1.9124.9
460S37.4Very low40.1Very low107 Ų107119.6 Ų119.675%0.74877%0.768SS**  trans75.5109.6134.453.30000124.3
461V39.1Very low40.1Very low138 Ų138124 Ų12484%0.83677%0.77SS**  trans-66.5178.6140.6-107.70000112.1
462P45.2Very low40.1Very low99 Ų99125.7 Ų125.764%0.64376%0.758SS**  cis-139.9-172.52.537.1-15.3000117.4
463H34.5Very low40.5Very low168 Ų168125.6 Ų125.678%0.77875%0.751SS**  trans90.5129.9134.9-82.8-15.7000125.2
464T33.3Very low40.6Very low109 Ų109127.1 Ų127.167%0.66975%0.746SS**  trans79.5123134.9530000124.8
465N35.1Very low40.9Very low158 Ų158130.6 Ų130.685%0.84575%0.747SS**  trans75.7122.3130.4-64-2.4000123.4
466G38.5Very low41Very low70 Ų70129.1 Ų129.172%0.72274%0.737SS**  trans120.8156.8139.100000116.7
467L42.6Very low41.1Very low155 Ų155129.9 Ų129.981%0.81275%0.745SS**  cis-168.6149.2-12.5-107.9179.2000108.9
468L42.9Very low41.1Very low150 Ų150128.5 Ų128.579%0.78575%0.747SS**  trans66.1161.1154.2-64.7166.3000118.2
469S37.7Very low41.3Very low99 Ų99127.5 Ų127.569%0.69275%0.748SS**  cis171.5-172.2-29.4-123.40000107.6
470P51Low41.4Very low94 Ų94122.1 Ų122.161%0.6175%0.745SS**  cis-138.3178.9-24.437.7-19000116.2
471Q38.7Very low41.7Very low164 Ų164122.3 Ų122.377%0.76674%0.743SS**  trans64.1153.1149.7-79.2170-80.200120.7
472Q41.3Very low41.7Very low150 Ų150123.2 Ų123.270%0.70174%0.739SS**  cis-150.8-178.74.7-136.7173.9-87.400108.9
473A49.3Very low41.1Very low71 Ų71128.3 Ų128.359%0.58775%0.745SS**  cis-157.6167.1400000113.6
474E46.8Very low41.3Very low171 Ų171130.6 Ų130.680%0.79975%0.747SS**  trans18.9148.4139.6-66168.4133.400123.4
475D41.9Very low41.4Very low145 Ų145133.1 Ų133.178%0.77575%0.749SS**  cis-161-155.4-22.3-153.120000111.1
476P48.2Very low41.8Very low111 Ų111131.7 Ų131.772%0.72175%0.746SS**  -129.3-176.2-125.343.2-22.7000117.6
477G41.3Very low41.8Very low74 Ų74134.1 Ų134.176%0.76375%0.747SS**  trans175.873.2169.500000122
478A43.8Very low41.6Very low103 Ų103133 Ų13385%0.85175%0.749SS**  trans66.9156.7152.400000121.9
479P42.6Very low41.4Very low120 Ų120130.4 Ų130.478%0.77975%0.749SS**  trans-142.7-178.6-151.542.9-22.9000120.1
480S38.9Very low41.2Very low109 Ų109133.4 Ų133.476%0.76276%0.757SS**  trans85.6164154.587.60000118.7
481P43.1Very low40.5Very low110 Ų110137 Ų13771%0.71477%0.771SS**  cis-133.6163.5-0.826.1-2.6000118.1
482Q39.7Very low40.1Very low158 Ų158138.7 Ų138.774%0.73877%0.77SS**  trans64.4105.2146.8-68.8-76.2-26.200121.3
483R32.2Very low40Very low205 Ų205139.6 Ų139.677%0.77478%0.779SS**  trans-129.2128.3150.7175.1-176.1172.8-157.8-1.5108.5F485R483-F485 PolarHBondContact O-N 2.9Å
484W38.4Very low39.3Very low216 Ų216141.9 Ų141.982%0.81878%0.782SS**  trans-71127.1-178.9-70.389.3000112.7
485F34.4Very low38.6Very low163 Ų163144.1 Ų144.172%0.71579%0.789SS**  trans-128.8142.5156.8-92-82.9000107.5R483R483-F485 PolarHBondContact O-N 2.9Å
486V43.7Very low38.4Very low128 Ų128141.8 Ų141.878%0.77679%0.79SS**  trans-125.2117.5169.5178.40000107.4
487T39.1Very low37.6Very low121 Ų121141.6 Ų141.674%0.74280%0.798SS**  trans-84.1146.7172.435.40000110.5
488P37.7Very low37.4Very low131 Ų131142.8 Ų142.885%0.85179%0.794SS**  trans-74.5133.5172.531.2-33000110.2
489A39.9Very low36.9Very low96 Ų96141.7 Ų141.779%0.79379%0.786SS**  trans-128.9147.2170.600000109.7
490N32.5Very low36.6Very low162 Ų162145.7 Ų145.787%0.86679%0.786SS**  trans-44.9135.1-172.9-68.2-36.8000114.4
491N36.7Very low36.5Very low168 Ų168147.1 Ų147.190%0.89879%0.785SS**  trans-141.3127.1135.8-114.7-21.9000110.5
492R30.4Very low36Very low200 Ų200147.8 Ų147.876%0.75579%0.788SS**  trans-107.9123.5-176.5167.9-170.6176.3174.32.1107.6D494R492-D494 IonicContact NE-OD1 3.51Å; R492-D494 IonicContact NH2-OD1 3.79Å
493L38.7Very low35.7Very low170 Ų170144.5 Ų144.589%0.8979%0.787SS**  trans-142.6128.9168.6-96.9165.8000108.9
494D35.2Very low35.9Very low119 Ų119141 Ų14164%0.63679%0.789SS**  trans-90.9149.4-162.2-49.7-101000112.5R492R492-D494 IonicContact NE-OD1 3.51Å; R492-D494 IonicContact NH2-OD1 3.79Å
495F31.5Very low35.9Very low218 Ų218137.5 Ų137.596%0.95679%0.786SS**  trans-87110.2-179.8-129.1-87.8000110.3
496A38.5Very low35.9Very low95 Ų95139.1 Ų139.179%0.78579%0.793SS**  trans-92.9128.3171.600000110.4
497A31.5Very low35.5Very low108 Ų108137.6 Ų137.689%0.89379%0.794SS**  trans-87.7142.9178.900000112.1
498S36.2Very low35.2Very low98 Ų98134.9 Ų134.969%0.68579%0.79SS**  trans-134135.5152.2-171.80000108.6
499A33.9Very low35.2Very low81 Ų81136.8 Ų136.867%0.66979%0.793SS**  trans-93.7-160.8168.900000110
500Y35.6Very low34.9Very low203 Ų203137.6 Ų137.680%0.79680%0.8SS**  trans64139.6179.879.4-101.2000115.6
501D36.9Very low35.1Very low139 Ų139134 Ų13474%0.74379%0.793SS**  cis-140.5-166.4-5.8-144.4-45.4000111.4
502T34Very low35.3Very low125 Ų125133 Ų13377%0.76779%0.793SS**  trans-99.3172-148.142.30000117.3
503A32.2Very low35.6Very low88 Ų88130.8 Ų130.873%0.72780%0.796SS**  trans75.8102.4158.100000119.4
504T37.4Very low35.5Very low131 Ų131131 Ų13180%0.80480%0.797SS**  -165.6126.4100.931.80000112.2
505D38Very low35.5Very low143 Ų143130 Ų13077%0.76580%0.799SS**  trans42.3111.5144.2-56-52.9000124.1
506F34.6Very low35.8Very low197 Ų197130.1 Ų130.186%0.86480%0.795SS**  66.376.4128.8-103.8-93.9000121.7
507A34.2Very low35.9Very low96 Ų96130.2 Ų130.279%0.79380%0.796SS**  54.4113.2118.100000120.8
508G32.7Very low36.4Very low64 Ų64130 Ų13066%0.6679%0.794SS**  trans174.4123.815400000116.9
509N38.4Very low36.8Very low171 Ų171130.3 Ų130.391%0.91480%0.802SS**  trans76.749.8154.2-44.6-52.3000119.5
510A33.3Very low36.8Very low113 Ų113130 Ų13093%0.93481%0.807SS**  trans-102.246160.400000112.4
511A36.7Very low37.2Very low88 Ų88127.7 Ų127.773%0.72781%0.814SS**  trans-154.898.5178.200000112.2
512T40.4Very low37.4Very low146 Ų146131.2 Ų131.290%0.89682%0.822SS**  trans-127.758.7166.350.70000111.1
513L38.3Very low37.3Very low154 Ų154129.9 Ų129.981%0.80682%0.824SS**SBendtrans-133131.2162.4-70.9175.7000108.2
514L35.4Very low37.7Very low173 Ų173133.8 Ų133.891%0.90683%0.832SS**  trans53.492.1164.9-55.8175.2000117.2
515S35.6Very low37.6Very low99 Ų99133.3 Ų133.369%0.69283%0.831SS**  trans-168.4133.9170.8-79.10000109.4
516Y38.2Very low37.8Very low221 Ų221134.8 Ų134.887%0.86784%0.838SS**  cis-147.7159.1-11.9-105.5-72.8000108.6
517A40.5Very low37.9Very low97 Ų97134.6 Ų134.680%0.80284%0.84SS**PPolyproline II helixtrans-68.5149.9168.200000111.4
518A42.8Very low38Very low104 Ų104134.9 Ų134.986%0.8684%0.842SS**PPolyproline II helixtrans-72.3154.7-173.700000113.7
519A43.6Very low38.4Very low103 Ų103136.7 Ų136.785%0.85185%0.851SS**PPolyproline II helixtrans-83.9148.3-17900000113.6
520G34.5Very low38.3Very low75 Ų75132.1 Ų132.177%0.77384%0.844SS**  trans79.878.3136.400000119
521V42.6Very low38.3Very low154 Ų154133 Ų13393%0.93384%0.842SS**  trans-135.7156.3146.5-109.60000110.2
522K41.6Very low38.3Very low213 Ų213136 Ų13693%0.92685%0.852SS**  trans-74.5151.1-163.1-67.1177.9179.5176.10113.2
523A32.4Very low38.3Very low98 Ų98132.6 Ų132.681%0.8185%0.845SS**  trans-79.2150.6-172.600000114.6
524L41.3Very low38.4Very low170 Ų170136.9 Ų136.989%0.8985%0.851SS**  trans-136.3127.7155.8-91.5169.4000107.9
525P34Very low38.8Very low121 Ų121134.8 Ų134.879%0.78685%0.847SS**  trans-91.6119-178.133.3-30.9000111.8
526L42.5Very low39.1Very low173 Ų173136.9 Ų136.991%0.90685%0.85SS**  trans-131.1157.9164.1-84.5173.3000110.8
527Q36.3Very low39.6Very low193 Ų193129.9 Ų129.990%0.90285%0.846SS**  trans-77.5135.7-154.4-65.6165.7-32.300113.6
528A36.3Very low39.5Very low103 Ų103134.7 Ų134.785%0.85184%0.844SS**  trans-92.1114.5168.500000110.5
529A41.9Very low39.6Very low101 Ų101141 Ų14184%0.83585%0.847SS**  trans-77.3145.3160.100000109.5
530G35.1Very low39.6Very low75 Ų75140.9 Ų140.977%0.77385%0.847SS**  trans-83.2143.1-160.300000116.2
531C33.9Very low39.8Very low131 Ų131144.5 Ų144.589%0.88585%0.848SS**  trans-133.1108.5159.8-70.10000108.3
532T37.2Very low40.5Very low152 Ų152142.5 Ų142.593%0.93384%0.838SS**  trans-94.5110.1-179.951.20000111.3
533G39.5Very low40.7Very low74 Ų74137.5 Ų137.576%0.76383%0.83SS**  trans-135126.8171.300000110.5
534R42.2Very low41.1Very low245 Ų245136.2 Ų136.293%0.92583%0.826SS**  trans-94.1144.2-178.2-67-177.6174.9-154.5-0.7111.1
535P42.9Very low41.1Very low128 Ų128140.3 Ų140.383%0.83183%0.83SS**  trans-68.4139.4165.430.4-33.7000110.3
536L42.8Very low41.3Very low143 Ų143138.1 Ų138.175%0.74983%0.829SS**  trans-93.5100.5-177.8-171.966.4000110.4Y538L536-Y538 HydrophobicContact CD2-CD2 4.37Å; L536-Y538 HydrophobicContact CD2-CE2 3.62Å; L536-Y538 HydrophobicContact CG-CD2 4.25Å; L536-Y538 HydrophobicContact CG-CE2 3.91Å
537G48.6Very low40.9Very low75 Ų75134.9 Ų134.977%0.77383%0.828SS**  trans-92.3115.917600000112.1
538Y37Very low41Very low197 Ų197137.5 Ų137.577%0.77383%0.829SS**  trans-96.6104.7168.8-81.6-85.9000110.7L536L536-Y538 HydrophobicContact CD2-CD2 4.37Å; L536-Y538 HydrophobicContact CD2-CE2 3.62Å; L536-Y538 HydrophobicContact CG-CD2 4.25Å; L536-Y538 HydrophobicContact CG-CE2 3.91Å
539Y45.3Very low41.3Very low237 Ų237138 Ų13893%0.92983%0.827SS**  trans-163.2146.7132.2-112.3-76.3000108.5
540A43.5Very low41.9Very low101 Ų101139 Ų13984%0.83583%0.825SS**  trans-89.2148.3-168.400000113.5
541D38.5Very low42.2Very low151 Ų151141.4 Ų141.481%0.80783%0.827SS**  trans-120.7121.8-178.3-177.529.7000110.8S543D541-S543 PolarHBondContact O-N 3.38Å; D541-S543 VanDerWaalsContact O-N 3.12Å
542P57Low42.4Very low111 Ų111144.3 Ų144.372%0.72183%0.827SS**  trans-86.776.7-173.334.7-35.8000114
543S46.6Very low42.5Very low109 Ų109148.3 Ų148.376%0.76283%0.827SS**  trans35.6112.7143.263.50000120.8D541D541-S543 PolarHBondContact O-N 3.38Å; D541-S543 VanDerWaalsContact O-N 3.12Å
544G40.8Very low42.1Very low70 Ų70150.3 Ų150.372%0.72283%0.828SS**  trans100.9147.2162.800000113.8
545W40.8Very low41.8Very low256 Ų256141.9 Ų141.997%0.9782%0.817SS**  cis-140.3156.524.7-85.463.9000114
546G38.1Very low41.6Very low75 Ų75141.1 Ų141.177%0.77381%0.811SS**  trans60.396.5136.300000119.9
547A35Very low41.4Very low105 Ų105143.1 Ų143.187%0.86881%0.813SS**  trans-73.7139.1171.200000113.9
548R38.5Very low41Very low248 Ų248145.8 Ų145.894%0.93682%0.82SS**  trans-146.9134.3150.6-86.8-175.3-173.6-102.1-2109.8
549S42Very low41.1Very low115 Ų115139.3 Ų139.380%0.80481%0.813SS**PPolyproline II helixtrans-101.1141.6178.444.90000112.3
550P53.7Low41Very low121 Ų121133.9 Ų133.979%0.78681%0.81SS**PPolyproline II helixtrans-84.1151158.8-9.227.7000111.4
551P43.4Very low40.9Very low126 Ų126135.5 Ų135.582%0.81881%0.809SS**PPolyproline II helixtrans-89.5163.6-177.836-36.1000113.9
552Q36.4Very low41.3Very low191 Ų191135.8 Ų135.889%0.89381%0.81SS**PPolyproline II helixtrans-83.3142.3163.2-68.2-178.1-17.500111.1
553Y39.5Very low40.5Very low237 Ų237135 Ų13593%0.92981%0.805SS**  trans-150.3158.5154.2-145.7-98.6000111.3
554C31Very low39.7Very low115 Ų115136 Ų13678%0.77781%0.81SS**  trans-105146.4-175.1-1690000111.4
555G36.7Very low39.4Very low69 Ų69143.9 Ų143.971%0.71182%0.818SS**  trans-176.963.3-174.600000118.8
556T37.5Very low39.4Very low112 Ų112137.1 Ų137.169%0.68781%0.807SS**  trans15.3135.3146.348.60000123.6
557K39.1Very low39.2Very low185 Ų185141.3 Ų141.380%0.80481%0.812SS**  trans101.6132.2139.6-69.6148.5-176.4177.10121
558S40.5Very low39.1Very low130 Ų130142.2 Ų142.291%0.90981%0.812SS**  trans67140.7155.2-55.70000119.1
559G40Very low38.9Very low61 Ų61134.6 Ų134.663%0.62980%0.802SS**  cis166.4170.5-7.900000113.4
560S42.4Very low38.6Very low124 Ų124133.9 Ų133.987%0.86780%0.803SS**  trans72.8147.3175.688.50000116.2
561V41.2Very low37.7Very low135 Ų135132.5 Ų132.582%0.81880%0.802SS**  cis-132.2154.9-3.4-1760000110.8
562L47Very low37.2Very low156 Ų156131.2 Ų131.282%0.81780%0.802SS**  trans-68.7-174.3176.8-62.6169.5000115
563P39.7Very low37.1Very low96 Ų96126.5 Ų126.562%0.62380%0.796SS**  cis-132.3167.4-11.918.85.6000116.4
564C30.9Very low36.8Very low128 Ų128125.9 Ų125.987%0.86579%0.792SS**  trans-99153.5151-56.60000110.2
565W34.4Very low37.2Very low236 Ų236128.7 Ų128.789%0.89480%0.796SS**  trans-134.1152.7165.1-81.574.8000111.2
566P40Very low37.2Very low114 Ų114130.1 Ų130.174%0.7480%0.8SS**  trans-131.6-171.2-147.140.2-21.3000116.4
567N35.1Very low37.2Very low163 Ų163128.6 Ų128.687%0.87281%0.807SS**  trans-13.3143.6173.2-78.13.7000120.8
568S31.7Very low37.2Very low124 Ų124124.9 Ų124.987%0.86781%0.811SS**  trans-71132.8164.1177.40000113.4
569A35.2Very low37Very low89 Ų89126 Ų12674%0.73681%0.806SS**  trans-165149.6147.300000112.7
570A34.8Very low37.2Very low100 Ų100127.2 Ų127.283%0.82680%0.803SS**  trans73.7127152.100000122.8
571A34.3Very low37.1Very low92 Ų92130.6 Ų130.676%0.7680%0.798SS**  trans78.791.7133.300000122.7
572A33.6Very low36.9Very low99 Ų99131.1 Ų131.182%0.81880%0.796SS**  76.3135.2112.900000123.3
573A34.4Very low36.6Very low92 Ų92126.4 Ų126.476%0.7679%0.785SS**  trans70.4151.5154.100000118.2
574R33.3Very low36.6Very low224 Ų224130 Ų13085%0.84579%0.794SS**  cis-165.5167.4-17.1-110.8178.9-177.9174.80.3107.6
575M38.5Very low37Very low174 Ų174132.5 Ų132.586%0.85779%0.792SS**  trans71.7152.4169.9-50.1-45.9-155.400116.6
576A36.7Very low37.3Very low98 Ų98125.3 Ų125.381%0.8178%0.784SS**  cis-167.3157-25.200000111.2
577G37.4Very low37.2Very low80 Ų80129.5 Ų129.583%0.82579%0.793SS**  trans93.3144.5168.500000115.4
578A40.6Very low37.4Very low107 Ų107124.9 Ų124.988%0.88478%0.784SS**  cis-154165.6-8.500000112.1
579N34.9Very low37.7Very low153 Ų153127.6 Ų127.682%0.81879%0.788SS**  trans-83.7-172.5-176.3-128.520000112.6
580P45.9Very low37.8Very low87 Ų87127.5 Ų127.557%0.56579%0.787SS**  cis-119-168.9437.5-17000113.3
581Y38.4Very low38.1Very low195 Ų195127.4 Ų127.477%0.76579%0.786SS**  cis-134.4169.116.3-80.2-67.2000110.1
582L39.1Very low38.7Very low147 Ų147129.8 Ų129.877%0.7778%0.781SS**  cis76.6120.739.4-146.8167000113.7
583G39.3Very low39Very low57 Ų57134.8 Ų134.859%0.58878%0.779SS**  cis163.2161.4-6.200000113.2
584E40Very low40Very low172 Ų172135.8 Ų135.880%0.80478%0.781SS**  trans63.2165.3160.3-70.1160.4101.900119.8
585E39.2Very low40.8Very low179 Ų179130.6 Ų130.684%0.83678%0.776SS**  cis-165.6-169.6-49.8-129176.7-147.500111
586A40.6Very low41.3Very low86 Ų86130 Ų13071%0.71178%0.775SS**  trans71.9137.5176.600000117
587E38.9Very low42.3Very low202 Ų202130.6 Ų130.694%0.94477%0.771SS**  67.1133.951-63-157.4145.500114.6
588G37.9Very low43Very low65 Ų65132.7 Ų132.767%0.6777%0.77SS**  cis179.7-162.9-0.600000111.8
589L39.6Very low43.1Very low181 Ų181131 Ų13195%0.94876%0.763SS**  trans73.1158.1174.9-48.9172.9000117.1
590A37Very low43.5Very low87 Ų87128.9 Ų128.972%0.71977%0.767SS**  cis-171.3173.8-30.800000110.9
591A41.4Very low43.5Very low98 Ų98129.7 Ų129.781%0.8178%0.781SS**  trans76.7149.5170.400000117.9
592E45.1Very low43.6Very low142 Ų142129.4 Ų129.466%0.66479%0.786SS**  cis-156.3158.90.7-136-160.9120.100114
593R40.3Very low44.2Very low204 Ų204130.1 Ų130.177%0.7779%0.791SS**  trans44.5124.7162.5-71.6171.1167.3133.1-8.3120.3
594S56.4Low44.5Very low113 Ų113131.8 Ų131.879%0.7980%0.799SS**  cis76.315447.9-54.80000115.8
595P48.7Very low44.6Very low116 Ų116133.1 Ų133.175%0.75380%0.803SS**  cis-123.3163.9-18.322.12.4000113.6
596L50.2Low45.1Very low160 Ų160129.9 Ų129.984%0.83880%0.797SS**  79.2162.556.4-62.4177000116
597P57.8Low45.3Very low111 Ų111134 Ų13472%0.72180%0.799SS**  -135.5-127.8-81.341.6-19.2000111.9
598P51.2Low45.4Very low125 Ų125130.2 Ų130.281%0.81279%0.785SS**  cis-133.3-175-42.140.5-23.3000115.9
599G43.7Very low45.7Very low70 Ų70135 Ų13572%0.72280%0.795SS**  trans147.8113.2156.900000114.4
600A43.2Very low45.8Very low109 Ų109131.1 Ų131.190%0.90178%0.782SS**  80.3131.269.600000113.9
601A46.2Very low46Very low104 Ų104133.4 Ų133.486%0.8678%0.783SS**  cis-152.2-164.80.700000113
602E40.4Very low46.1Very low190 Ų190134 Ų13489%0.88878%0.781SS**  trans-88.4164.8-162.6-54.8165.596.400116.9
603D51.7Low45.8Very low161 Ų161131.3 Ų131.386%0.86178%0.778SS**  -166.3155.5125.2-135.6-32.1000116.3
604A44.8Very low46.1Very low93 Ų93133 Ų13377%0.76978%0.784SS**  trans62150.9157.600000124.3
605K42.6Very low45.7Very low200 Ų200133.8 Ų133.887%0.8778%0.778SS**  trans-148.4-174.3-170.7-113-172.9179.5174.70109
606P50.3Low45.3Very low110 Ų110137 Ų13771%0.71478%0.783SS**  cis-133.5-168.7-40.339.2-21.8000112.3
607K44.8Very low45Very low173 Ų173135.3 Ų135.375%0.75278%0.78SS**  154.2126.9112.6-166.6165.8-174176.80115.1
608D39.3Very low44.3Very low122 Ų122135.8 Ų135.865%0.65278%0.783SS**  trans35.6147.1153.4-43-17.3000120.9
609L46.3Very low43.5Very low167 Ų167135.5 Ų135.587%0.87478%0.784SS**  cis-142.9170.132.7-75.8160.1000113.3
610S40.9Very low43.5Very low99 Ų99137.1 Ų137.169%0.69278%0.784SS**  trans-82.6-178.3169.565.80000112
611D41.4Very low43.7Very low135 Ų135139.3 Ų139.372%0.72278%0.779SS**  cis-155.1174.321.3-126.5-77.8000107.8
612S43.3Very low43.5Very low111 Ų111143.6 Ų143.678%0.77678%0.778SS**  cis-155.3-158.19.8-1540000111.9
613S38.1Very low43.5Very low85 Ų85140 Ų14059%0.59477%0.774SS**  trans-132.3150.6-174.9178.30000114.7
614W47.3Very low43.5Very low239 Ų239140.4 Ų140.491%0.90577%0.774SS**  trans-143.673.4157-87.4111.5000113
615I47.3Very low43.3Very low129 Ų129142.2 Ų142.266%0.66277%0.771SS**  trans43.9118.4137.1-57.3176.5000119.1
616E41.3Very low43.1Very low183 Ų183137.1 Ų137.186%0.85576%0.761SS**  trans-85.8155.2164.4-179.6176.9-172.900111.9
617T44.2Very low42.6Very low126 Ų126137.7 Ų137.777%0.77377%0.767SS**  trans-125.6126.2177.3-47.20000110.8
618P41.2Very low42.6Very low120 Ų120136.6 Ų136.678%0.77977%0.77SS**  trans-85.8161.5-166.733.5-37.1000115.1
619S35.7Very low42.6Very low120 Ų120136.8 Ų136.884%0.83978%0.781SS**  trans-89.1143.3170.8-57.10000112
620S42.7Very low42.3Very low103 Ų103131.5 Ų131.572%0.7277%0.766SS**  trans167.4115.2138.6-178.10000113.7
621I47.1Very low42.4Very low155 Ų155134.8 Ų134.880%0.79577%0.774SS**  trans-177.5107.1139.4-101.7164.5000105.3
622K41.9Very low42.1Very low195 Ų195137.8 Ų137.885%0.84878%0.777SS**  77.1137.381.8-76.2-172.4176.1-175.40113.1
623S40.8Very low41.9Very low115 Ų115140.6 Ų140.680%0.80478%0.778SS**  trans-88.9160.7-16243.40000114.6
624I52.5Low42Very low169 Ų169144.3 Ų144.387%0.86779%0.786SS**  trans-123.6148.5146.4-169.560.9000107.3
625D39.6Very low41.6Very low130 Ų130138.2 Ų138.270%0.69579%0.786SS**  trans-133159.8-168.1-162.9-26.9000109.9
626S39.9Very low41.2Very low93 Ų93141.7 Ų141.765%0.6580%0.796SS**  trans79.1152.6153.3-65.70000120.3
627S39.7Very low41.2Very low122 Ų122144.9 Ų144.985%0.85380%0.801SS**  trans73.289159.2-54.80000118.8
628D43.8Very low40.8Very low151 Ų151150 Ų15081%0.80781%0.806SS**  -140.3137.6118.6-159.5-4.4000110.4
629S40.3Very low40.6Very low126 Ų126155.4 Ų155.488%0.88181%0.811SS**  trans-172.8102.2-178.4-81.20000112
630G39.6Very low40.8Very low55 Ų55157.3 Ų157.357%0.56781%0.81SS**  trans121.6163.8169.300000113.6
631I42.7Very low40.9Very low169 Ų169156.8 Ų156.887%0.86781%0.806SS**  trans70.1124.5-174.6-48.8162.5000110.5
632Y35.1Very low40.6Very low198 Ų198154.4 Ų154.478%0.77680%0.801SS**  cis-131.713429.5-163.8-93.3000112.7
633E40Very low40.1Very low169 Ų169150 Ų15079%0.7980%0.801SS**  trans-95.8165.5172.1-164.9-176.4-171.500110.4
634Q38.3Very low40.1Very low164 Ų164151 Ų15177%0.76680%0.797SS**  trans96.794.3173.4-51.9178.419.800117.8
635A39.5Very low39.5Very low111 Ų111149.2 Ų149.292%0.91780%0.795SS**  trans-149.555149.800000111.1R637A635-R637 PolarHBondContact O-N 3.12Å
636K39.5Very low39.9Very low201 Ų201149.1 Ų149.187%0.87480%0.801SS**  trans-81104.4-166.9180-178.9-176.9172.40113.2
637R40.4Very low39.7Very low250 Ų250150.9 Ų150.994%0.94381%0.807SS**  trans-144.3123.2156.6-119.4175.4-170.1-128.3-1.2114.9A635A635-R637 PolarHBondContact O-N 3.12Å
638R35.9Very low39.7Very low233 Ų233149.4 Ų149.488%0.87980%0.797SS**  trans-68.9147.5178.4-64.9166.1163.9168.5-9.3112
639R38.5Very low39.5Very low234 Ų234150.3 Ų150.388%0.88380%0.797SS**  -140.996.9128.5-176.8172.8-86.6-172.2-6109.8
640I39.9Very low39.3Very low161 Ų161149 Ų14983%0.82679%0.787SS**  trans-106.5128.2161.3-58.8170.9000105.1
641S43.9Very low39.4Very low91 Ų91152.1 Ų152.164%0.63680%0.801SS**  trans-156.2148.6-175.7-61.80000107.8
642P40.8Very low39.2Very low105 Ų105149.6 Ų149.668%0.68280%0.798SS**  -106.3174.1-115.3-1.421.7000115.1
643A32.3Very low39.9Very low104 Ų104145.1 Ų145.186%0.8679%0.793SS**  trans-95.4115.7157.300000108.3
644D40.8Very low40Very low135 Ų135144.5 Ų144.572%0.72279%0.794SS**  trans-125.3122.6176.8-77.6-61.5000110.1
645T38Very low40.4Very low132 Ų132145.3 Ų145.381%0.8180%0.795SS**  trans-115.5125.7171.448.60000110
646P49.4Very low40.5Very low127 Ų127143.8 Ų143.883%0.82578%0.778SS**  trans-93.8165.215833.1-27000111.8
647V35.9Very low40.8Very low130 Ų130142.1 Ų142.179%0.78877%0.773SS**  trans-122.2177.9-165.7-177.40000110.3
648S39.3Very low41Very low91 Ų91136 Ų13664%0.63676%0.763SS**  trans78.1148.4171.1-640000113.6
649E38.4Very low41.3Very low171 Ų171132.6 Ų132.680%0.79976%0.761SS**  cis172.4172.5-0.4-102.4162.1-141.400103
650S37.4Very low41.4Very low98 Ų98125.5 Ų125.569%0.68575%0.753SS**  cis-164.4156.7-31.760.30000107.7
651S41.6Very low41.3Very low121 Ų121125.4 Ų125.485%0.84675%0.749SS**  trans165.6155.314943.50000111.9
652S39.1Very low41.1Very low115 Ų115130.8 Ų130.880%0.80476%0.755SS**  trans-123.1-133.9-173.4-440000109.6
653P49.7Very low41.2Very low105 Ų105132.4 Ų132.468%0.68276%0.758SS**  cis-144.1-173.80.736.3-11.4000117.5
654L42.4Very low41.3Very low156 Ų156132.1 Ų132.182%0.81775%0.749SS**  trans75144162.9-46.8-179.3000117.7
655K45.9Very low41.3Very low181 Ų181132.5 Ų132.579%0.78775%0.746SS**  cis-125.5144.65.9-83-169.3175.1-1740110
656S41.1Very low41.3Very low78 Ų78134.1 Ų134.155%0.54574%0.742SS.*  69.4131.659.393.80000112.2
657E45.8Very low40.8Very low167 Ų167134.9 Ų134.978%0.7874%0.739SS**  cis-156.8172.212.5-91.3125.3129.700109.8
658V44.3Very low40.8Very low120 Ų120134 Ų13473%0.72774%0.738SS**  cis-175.5162.4-27.871.50000110.1
659L42.7Very low40.8Very low162 Ų162133.6 Ų133.685%0.84874%0.74SS**  trans68.9152171.9-63.3168.8000117.6
660A39.9Very low40.8Very low85 Ų85134.5 Ų134.570%0.70274%0.741SS**  cis-177172-12.100000108.4
661Q38.3Very low40.9Very low160 Ų160136.7 Ų136.775%0.74875%0.745SS**  cis-175.5162.7-29.3-174.8-178.81500107.9
662R41Very low40.9Very low204 Ų204138 Ų13877%0.7774%0.741SS**  trans76.6154.8174.4-62.1-169168.7106.91116.2
663D42Very low41Very low138 Ų138138 Ų13874%0.73874%0.742SS**  cis-173.6168.8-15.8-91.4-16.8000106
664C35.6Very low40.8Very low99 Ų99136.2 Ų136.267%0.66974%0.742SS**  cis-172.8105.7-14.6168.70000106.8
665E39.2Very low40.7Very low143 Ų143138.1 Ų138.167%0.66874%0.739SS**  95.1147.199.5-149.6-149.7143.100116.4
666K38.6Very low40.6Very low165 Ų165139.6 Ų139.672%0.71774%0.741SS**  trans73.2164.2165.3-57.3170.7172.7910120.6
667N38.5Very low40.8Very low143 Ų143138.5 Ų138.577%0.76574%0.743SS**  -169.5166.2-51.7-153.7-5.6000111.7
668C36.9Very low40.6Very low112 Ų112139.7 Ų139.776%0.75775%0.746SS**  trans68.1162160.6-69.20000120.2
669A38.4Very low40.8Very low83 Ų83144.4 Ų144.469%0.68675%0.752SS**  cis-171.2156.3-29.800000112.8
670K38.3Very low40.7Very low189 Ų189141.6 Ų141.682%0.82275%0.746SS**  trans32.8139.6150-67.2-177174.9-177.70123.8
671D39.6Very low41.1Very low144 Ų144146.4 Ų146.477%0.7775%0.753SS**  165.7160.2122.8-91.5-4.4000112
672I42.3Very low41.5Very low148 Ų148147.9 Ų147.976%0.75978%0.782SS**  cis-163.9168.6-31.5-138.7171.3000110.2
673S41.4Very low41.5Very low117 Ų117145.1 Ų145.182%0.81878%0.782SS**  trans72.3147.2174-155.80000116.7
674G44.4Very low41.5Very low66 Ų66145.5 Ų145.568%0.6879%0.785SS**  cis171178.50.200000108.9
675Y40.1Very low41.8Very low196 Ų196148.1 Ų148.177%0.76979%0.791SS**  cis-167.6164.5-11.3-147.5-88000109.6
676Y44.5Very low42Very low212 Ų212148.4 Ų148.483%0.83180%0.798SS**  trans66.5149.8178-64.5-76.9000118.6
677G44.7Very low42.2Very low56 Ų56147.3 Ų147.358%0.57780%0.803SS**  cis159122.9-16.200000116.5
678F41.4Very low42.5Very low191 Ų191147.6 Ų147.684%0.83881%0.806SS**  trans61.7145166.9-58.7-89.1000117.2
679Y49.1Very low42.9Very low220 Ų220150.1 Ų150.186%0.86381%0.809SS**  cis-140.2170.233.7-95.1-93.2000114.1
680S41.7Very low43.2Very low102 Ų102155.3 Ų155.371%0.71382%0.819SS**  trans-140.8138.7172.1520000111.6
681H48.1Very low43.6Very low186 Ų186152.5 Ų152.586%0.86182%0.819SS**  trans-163.8148.3159.1-100.6-67.2000110.9
682S46.1Very low44Very low192 Ų192153.3 Ų153.3100%1.34382%0.823SS**  trans49.80177.965.70000116.5

Retrieved 682 of 682 residues in 178.3 ms (Link to these results)