A0A087XC34_POEFO Loading...

ELAV-like protein

AlphaFold DB , UniProt , Accession A0A087XC34, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 422 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M30.9Very low31.9Very low236 Ų236165.2 Ų165.2100%1.16383%0.826SS**  0129.20-126.2166.8179.300107.2
2L32.4Very low31.6Very low154 Ų154161.5 Ų161.581%0.80683%0.826SS**  cis-162.3154.7-20.7-123.2156.4000104.2
3R34.2Very low31.5Very low217 Ų217167.4 Ų167.482%0.81983%0.831SS**  trans-47.3158-179.1-74.9171.2169.7167.3-5117
4K33.7Very low31.5Very low196 Ų196164.4 Ų164.485%0.85282%0.82SS**  165.5117.6113.9-88.6-179.9-179.7-174.20108.8
5D35.9Very low31.1Very low145 Ų145167.7 Ų167.778%0.77583%0.828SS**  72.2132.278.6-85.8-53.9000116.8
6C30.5Very low31.4Very low109 Ų109165.6 Ų165.674%0.73682%0.819SS**  trans109.6113.2148.3-101.80000122.1
7D30.4Very low31.3Very low133 Ų133167.9 Ų167.971%0.71182%0.823SS**  trans72.3119.9130.9-92.7-48.3000122.8
8Q30.6Very low31.1Very low176 Ų176170.6 Ų170.682%0.82283%0.825SS**  trans-160115.6133.6-137.9123.932.200114.1
9T31.6Very low31.7Very low118 Ų118167.8 Ų167.872%0.72482%0.822SS**  trans-51.4140.8151.730.80000112.9
10F30Very low31.5Very low201 Ų201171 Ų17188%0.88282%0.824SS**  trans-154.7146.5148.3-114.5-81.9000114
11V30.4Very low31.3Very low132 Ų132174.9 Ų174.980%0.883%0.83SS**  trans-93.4153.8-164.4172.60000112.2
12C29.2Very low31.3Very low121 Ų121175 Ų17582%0.81882%0.818SS**  trans-52.2152175.7-57.80000116.5
13R29.9Very low31.1Very low238 Ų238177 Ų17790%0.89882%0.82SS**  trans-156.1146.6142.3-138.4169.2179.5168.3-0.9114.5
14D30.8Very low30.7Very low126 Ų126173.5 Ų173.567%0.67482%0.818SS**  trans-51.6158.7-170.6-64.1-93000120.9
15F26.7Very low30.9Very low213 Ų213171 Ų17193%0.93482%0.819SS**  trans-152.5134.3132.2-128.3-92.4000113.2
16I34.5Very low30.8Very low134 Ų134169.2 Ų169.269%0.68782%0.818SS**  trans-101138.4-176.2-62.9175.1000110.6
17K30Very low31Very low206 Ų206175.3 Ų175.390%0.89683%0.825SS**  168135.1125.4-94.6-176.9179.4174.20114.3
18Y28.2Very low31Very low216 Ų216179.4 Ų179.485%0.84783%0.831SS**  trans-78.9172.7173.9-96.9-81000112.6
19P42.6Very low31.1Very low118 Ų118178.6 Ų178.677%0.76683%0.827SS**  cis-148.6158.241.637.3-13000121.9
20R28.3Very low31.4Very low231 Ų231180 Ų18087%0.87283%0.829SS**  trans29.4126.6149.1-68-174.3175.3-175.10.5122.4
21R26.8Very low31.6Very low253 Ų253177.8 Ų177.896%0.95582%0.822SS**  -151.1141.3118.6-92.7-171.9-167.5-166.73.1111.2
22R30.5Very low31.8Very low238 Ų238175.6 Ų175.690%0.89881%0.809SS**  trans-66.3143.7-174.9-71174.3175.1163.2-2.6112.6
23F27.7Very low32.1Very low196 Ų196175.7 Ų175.786%0.8680%0.802SS**  -174.7131.2126.5-110.9-80.6000112.6
24N27.1Very low32.3Very low144 Ų144170.5 Ų170.577%0.7779%0.789SS**  trans55.886.9158.8-88.2-12.8000122.4S26N24-S26 PolarHBondContact O-N 3.24Å
25T36.5Very low32.5Very low142 Ų142167.1 Ų167.187%0.87178%0.779SS**THydrogen-bonded Turntrans-71.7100152.9120000111.1
26S34.5Very low33Very low108 Ų108161 Ų16176%0.75576%0.758SS**THydrogen-bonded Turntrans-168.3-6155-98.60000116N24N24-S26 PolarHBondContact O-N 3.24Å
27R35.8Very low33.5Very low237 Ų237163.9 Ų163.989%0.89476%0.761SS**SBendtrans-100.6-7.8178.1-94.3-175.6177.8-173.6-0.3116.2
28R30.5Very low33.9Very low219 Ų219159.5 Ų159.583%0.82675%0.746SS**SBendtrans-96.5-13.1-176.8-83.8-172.2178.1-169.1-0.2116T32R28-T32 PolarHBondContact O-OG1 3.49Å
29Q30.9Very low34.3Very low159 Ų159153 Ų15374%0.74373%0.731SS**Hα-helixtrans-81-21.7179.3-94179-900114.4
30L38.2Very low34Very low147 Ų147151.5 Ų151.577%0.7772%0.717SS**Hα-helixtrans-82.2-23176.9-95.3135.7000113.5
31Q35.2Very low34.7Very low155 Ų155145 Ų14572%0.72470%0.703SS**Hα-helixtrans-85.5-24.7-179.7-137.7165.67.300112.5
32T34.9Very low35.1Very low87 Ų87135.4 Ų135.453%0.53468%0.678SS.*Hα-helixtrans-79.4-34.9175.28.30000112.4R28 M34 V36R28-T32 PolarHBondContact O-OG1 3.49Å; T32-M34 VanDerWaalsContact C-N 3.29Å; T32-M34 PolarHBondContact O-N 3.28Å; T32-V36 VanDerWaalsContact O-CG2 3.27Å; T32-V36 WeakPolarHBondContact O-CG2 3.46Å; T32-V36 PolarHBondContact O-N 3.01Å
33N33.8Very low35.4Very low123 Ų123127.4 Ų127.466%0.65866%0.658SS**Hα-helixtrans-71.2-20.1179.7-83.5-16.3000114.4
34M35.5Very low36Very low129 Ų129124.5 Ų124.564%0.63565%0.651SS**Hα-helixtrans-90.1-32.4178.7-162.1164.9149.200112.6T32 R37 L38T32-M34 VanDerWaalsContact C-N 3.29Å; T32-M34 PolarHBondContact O-N 3.28Å; M34-R37 PolarHBondContact O-N 3.38Å; M34-L38 PolarHBondContact O-N 3.39Å
35A34.5Very low36.5Very low55 Ų55124.9 Ų124.946%0.45565%0.652SS.*Hα-helixtrans-69.3-33.5173.700000112.5R37 L38 C39A35-R37 VanDerWaalsContact C-N 3.34Å; A35-R37 PolarHBondContact O-N 2.91Å; A35-L38 PolarHBondContact O-N 2.91Å; A35-C39 PolarHBondContact O-N 3.27Å; A35-C39 VanDerWaalsContact O-N 3.14Å; A35-C39 PolarHBondContact O-SG 3.46Å
36V37.8Very low36.5Very low84 Ų84128.5 Ų128.551%0.50965%0.65SS.*Hα-helixtrans-65.6-37.3176.3175.10000111.1T32 C39 D40T32-V36 VanDerWaalsContact O-CG2 3.27Å; T32-V36 WeakPolarHBondContact O-CG2 3.46Å; T32-V36 PolarHBondContact O-N 3.01Å; V36-C39 PolarHBondContact O-N 3.14Å; V36-D40 PolarHBondContact O-N 3.4Å; V36-D40 VanDerWaalsContact O-N 3.08Å
37R44.6Very low36.7Very low195 Ų195128 Ų12874%0.73665%0.647SS**Hα-helixtrans-73.2-27.3178.9-71.9-85.1179.2157.8-5.1114.1M34 A35M34-R37 PolarHBondContact O-N 3.38Å; A35-R37 VanDerWaalsContact C-N 3.34Å; A35-R37 PolarHBondContact O-N 2.91Å
38L37.4Very low36.4Very low113 Ų113120.4 Ų120.459%0.59264%0.642SS**Hα-helixtrans-78.4-30.9173.2-87.4154.8000112.1M34 A35 A42M34-L38 PolarHBondContact O-N 3.39Å; A35-L38 PolarHBondContact O-N 2.91Å; L38-A42 PolarHBondContact O-N 3.34Å
39C36.5Very low36.3Very low79 Ų79115.5 Ų115.553%0.53464%0.641SS.*Hα-helixtrans-74.5-28.3173-70.70000113.3A35 V36 A42 S43A35-C39 PolarHBondContact O-N 3.27Å; A35-C39 VanDerWaalsContact O-N 3.14Å; A35-C39 PolarHBondContact O-SG 3.46Å; V36-C39 PolarHBondContact O-N 3.14Å; C39-A42 PolarHBondContact O-N 3.08Å; C39-S43 WeakPolarHBondContact O-CB 3.38Å; C39-S43 PolarHBondContact O-N 3.38Å; C39-S43 PolarHBondContact O-OG 3.46Å
40D36.7Very low36.2Very low87 Ų87119.9 Ų119.947%0.46565%0.651SS.*Hα-helixtrans-64.1-39.2174.7-106.7-68.4000112.2V36 S43 L44V36-D40 PolarHBondContact O-N 3.4Å; V36-D40 VanDerWaalsContact O-N 3.08Å; D40-S43 PolarHBondContact O-N 3.14Å; D40-L44 WeakPolarHBondContact O-CB 3.4Å; D40-L44 PolarHBondContact O-N 2.85Å
41V43.8Very low35.7Very low94 Ų94116.8 Ų116.857%0.5765%0.646SS**Hα-helixtrans-70.8-35.9175.5-179.50000111.4S43 L45V41-S43 VanDerWaalsContact C-N 3.33Å; V41-L45 PolarHBondContact O-N 2.78Å
42A35.5Very low35.5Very low52 Ų52115.6 Ų115.643%0.4365%0.652SS.*Hα-helixtrans-73.3-21.9175.700000113.7L38 C39L38-A42 PolarHBondContact O-N 3.34Å; C39-A42 PolarHBondContact O-N 3.08Å
43S36.7Very low35.2Very low70 Ų70120 Ų12049%0.4967%0.667SS.*Hα-helixtrans-89.2-31.4176.8-60.50000112.9C39 D40 V41 L45 R46C39-S43 WeakPolarHBondContact O-CB 3.38Å; C39-S43 PolarHBondContact O-N 3.38Å; C39-S43 PolarHBondContact O-OG 3.46Å; D40-S43 PolarHBondContact O-N 3.14Å; V41-S43 VanDerWaalsContact C-N 3.33Å; S43-L45 PolarHBondContact O-N 3.24Å; S43-R46 PolarHBondContact O-N 3.48Å; S43-R46 VanDerWaalsContact O-N 3.14Å
44L38.8Very low35Very low135 Ų135118.8 Ų118.871%0.70767%0.666SS**Hα-helixtrans-68.7-20.1171.9-87.4158.1000113.5D40D40-L44 WeakPolarHBondContact O-CB 3.4Å; D40-L44 PolarHBondContact O-N 2.85Å
45L39Very low34.5Very low152 Ų152125.2 Ų125.280%0.79668%0.683SS**THydrogen-bonded Turntrans-87.5-2.2171.9-77.4166.4000113.8V41 S43V41-L45 PolarHBondContact O-N 2.78Å; S43-L45 PolarHBondContact O-N 3.24Å
46R35.8Very low34.2Very low218 Ų218128.5 Ų128.582%0.82370%0.698SS**SBendtrans-123.56.6-174.4-143.6-179.3-66.6-104.30.5115.3S43S43-R46 PolarHBondContact O-N 3.48Å; S43-R46 VanDerWaalsContact O-N 3.14Å
47S39.3Very low33.7Very low99 Ų99127.6 Ų127.669%0.69271%0.705SS**SBendtrans-144.7108.5170.555.80000111.2
48G28.2Very low32.8Very low77 Ų77127.3 Ų127.379%0.79471%0.712SS**  trans166.560.6-177.600000111.8W50G48-W50 PolarHBondContact O-N 2.93Å
49S30Very low32.2Very low116 Ų116127.9 Ų127.981%0.81172%0.72SS**  trans-66.3110.4166.9-174.70000108.7
50W27.6Very low31.8Very low251 Ų251131.9 Ų131.995%0.95173%0.734SS**  trans-128.2112.8158.8-84.9-22.5000109.3G48G48-W50 PolarHBondContact O-N 2.93Å
51A28.2Very low31.3Very low81 Ų81131.6 Ų131.667%0.66974%0.744SS**  trans-62.9149.4167.100000110E53A51-E53 PolarHBondContact O-N 3.31Å
52P31.1Very low30.4Very low130 Ų130133.2 Ų133.284%0.84475%0.754SS**  trans-79.6118.4173.531.2-29.2000109.2
53E29Very low30Very low181 Ų181139 Ų13985%0.84678%0.775SS**  trans-104.1138.1160.9-80.8-151.311200111.2A51A51-E53 PolarHBondContact O-N 3.31Å
54P29.6Very low29.5Very low97 Ų97142.8 Ų142.863%0.6379%0.785SS**  trans-86.3135.7-173.533.8-32.2000111.3T56P54-T56 PolarHBondContact O-N 2.98Å
55W25.1Very low28.8Very low263 Ų263142.8 Ų142.8100%0.99679%0.79SS**  trans-78.8105.7160.8-77.969.1000108.5
56T26.8Very low28.1Very low125 Ų125142.1 Ų142.177%0.76778%0.783SS**  trans-111.2147.3163470000108.7P54P54-T56 PolarHBondContact O-N 2.98Å
57G27.3Very low27.5Very low64 Ų64139 Ų13966%0.6678%0.782SS**  trans115.7132.5163.500000114
58Q25.7Very low26.8Very low189 Ų189138.8 Ų138.888%0.88378%0.781SS**  cis-168.8151.4-6.4-143.8143.3-11.500109
59V25.3Very low26.7Very low126 Ų126142.5 Ų142.576%0.76478%0.782SS**  trans-76.8141.4171.6-164.90000108.7
60I28.7Very low26.4Very low163 Ų163140.3 Ų140.384%0.83678%0.778SS**  trans-125.2124.1151.4-65.7-173.3000107.7
61A25.7Very low27Very low81 Ų81134.1 Ų134.167%0.66977%0.77SS**  trans-109.9146.5172.100000109.7
62T25.4Very low26.9Very low128 Ų128136 Ų13679%0.78577%0.773SS**  trans-150.9103155.941.60000104.4
63M27.1Very low26.7Very low173 Ų173135.7 Ų135.785%0.85277%0.773SS**  47.413489.4-66.5177.1171.600113.1
64E25.3Very low26.6Very low150 Ų150133.6 Ų133.670%0.70177%0.767SS**  cis-173.9163.6-6.2-116.2-172.1114.800106.5
65T25.1Very low26.5Very low134 Ų134136.9 Ų136.982%0.82278%0.78SS**  trans154.894.7147.9-59.20000107.6
66Q23.9Very low26.6Very low138 Ų138129.6 Ų129.665%0.64576%0.764SS**  84.2124.380.1-75.9-68.1-2.200116.8
67L24.1Very low26.7Very low153 Ų153128.6 Ų128.680%0.80176%0.762SS**  trans84.7114.8151.6-60.2166.8000122.5
68S23.9Very low26.8Very low95 Ų95133 Ų13366%0.66477%0.771SS**  133.6129.1106.3-158.10000117.8
69N26.5Very low26.8Very low154 Ų154127.4 Ų127.482%0.82476%0.764SS**  trans72.9126.2148.4-62.5-10.5000122.8
70G23Very low27.5Very low70 Ų70127.2 Ų127.272%0.72277%0.765SS**  trans-73-159.6160.600000113
71P40.6Very low27.4Very low121 Ų121124.2 Ų124.279%0.78676%0.759SS**  cis-140.9174.420.638.8-17.2000117.6
72T26Very low27.5Very low120 Ų120126.4 Ų126.474%0.73676%0.764SS**  trans35.9132.7141.2-162.10000123.2
73C26.9Very low27.8Very low124 Ų124127.8 Ų127.884%0.83877%0.765SS**  -160.8122.2115.754.10000112.4
74N26.9Very low28Very low137 Ų137124.2 Ų124.273%0.73376%0.758SS**  trans-69.8151.5164.9-72.8-15.8000111
75N27.3Very low28.3Very low167 Ų167124.3 Ų124.389%0.89376%0.763SS**  -157136.5120.8-117-14.8000114.1
76T26.8Very low28.8Very low109 Ų109125.4 Ų125.467%0.66976%0.764SS**  trans-87.4148.4-174.2-58.40000110.9
77S29.8Very low29Very low104 Ų104124.2 Ų124.273%0.72777%0.769SS**  173.7110.9125.956.30000114.6
78N28.8Very low29.5Very low156 Ų156122.1 Ų122.183%0.83477%0.768SS**  61125.1127.8-63.6-8.8000122.9
79G26Very low29.8Very low73 Ų73122.2 Ų122.275%0.75377%0.768SS**  trans-75.7-153.216900000114.8
80P39.3Very low30.3Very low121 Ų121121 Ų12179%0.78677%0.768SS**  -144.8155.651.331.3-7.6000119
81S27.1Very low30.8Very low101 Ų101123.9 Ų123.971%0.70677%0.772SS**  60.8118.3129.2-46.30000125.5
82T28.3Very low30.6Very low126 Ų126127 Ų12777%0.77378%0.776SS**  67.8122.1125.159.50000121
83I31.1Very low31.1Very low157 Ų157127 Ų12781%0.80578%0.781SS**  -154.5125.8117.4-89.4142.8000108.6
84S30.3Very low31.8Very low99 Ų99123.6 Ų123.669%0.69277%0.766SS**  trans-57.4139.2165.949.90000111.8
85N32.2Very low32.6Very low152 Ų152121.7 Ų121.781%0.81376%0.764SS**  trans-152.4114141.9-94.6-24000110.7
86N36.2Very low33.6Very low157 Ų157120.4 Ų120.484%0.8476%0.755SS**  trans-73.4118.7169.2-154.522.2000107.3
87C28.8Very low34.8Very low112 Ų112122.5 Ų122.576%0.75776%0.758SS**  trans-137.389.6165.1520000109.6S89C87-S89 PolarHBondContact O-N 3.32Å
88S33.2Very low35.9Very low110 Ų110122.7 Ų122.777%0.76975%0.751SS**  trans-57117.7157.9-54.50000108.6
89S30.4Very low37.4Very low97 Ų97117.7 Ų117.768%0.67873%0.728SS**  trans-138.4126.9159.7-72.80000106.9C87 V91C87-S89 PolarHBondContact O-N 3.32Å; S89-V91 PolarHBondContact O-N 2.86Å
90P38.2Very low39.7Very low127 Ų127119.4 Ų119.483%0.82571%0.714SS**  trans-69.6108-178.728.1-29.9000107.7E92P90-E92 PolarHBondContact O-N 3.37Å
91V32.3Very low42Very low131 Ų131114.4 Ų114.479%0.79468%0.682SS**  trans-68.993.7162.1-92.20000107S89 S93S89-V91 PolarHBondContact O-N 2.86Å; V91-S93 VanDerWaalsContact C-N 3.28Å; V91-S93 PolarHBondContact O-N 3.33Å; V91-S93 PolarHBondContact O-OG 3.14Å; V91-S93 VanDerWaalsContact O-OG 3.11Å
92E37.6Very low45Very low188 Ų188112.2 Ų112.288%0.87966%0.662SS**  trans-4892.6166.9-168.2168.8103.800109P90 G94P90-E92 PolarHBondContact O-N 3.37Å; E92-G94 PolarHBondContact O-N 3.19Å
93S35.1Very low48Very low119 Ų119106.2 Ų106.283%0.83263%0.626SS**  trans-80.761.4176.4-60.70000108.4V91V91-S93 VanDerWaalsContact C-N 3.28Å; V91-S93 PolarHBondContact O-N 3.33Å; V91-S93 PolarHBondContact O-OG 3.14Å; V91-S93 VanDerWaalsContact O-OG 3.11Å
94G41.5Very low50.8Low52 Ų52100.3 Ų100.354%0.53660%0.595SS.*  trans-88.7137.4168.400000110.1E92E92-G94 PolarHBondContact O-N 3.19Å
95S44.1Very low53.7Low98 Ų9895.6 Ų95.669%0.68556%0.562SS**SBendtrans90.647.5162.677.40000120.9
96I49.5Very low56.5Low139 Ų13990.6 Ų90.671%0.71354%0.536SS*.SBendtrans-124.8-19.3154.8-62-173000113.1
97E51.2Low58.9Low153 Ų15389.7 Ų89.772%0.71552%0.521SS*.THydrogen-bonded Turntrans-80-28.4-177.4-62.1-154.8125.900114.3S99 K100E97-S99 PolarHBondContact O-N 3.48Å; E97-K100 PolarHBondContact O-N 3.14Å
98D53Low61.8Low109 Ų10984.4 Ų84.458%0.58349%0.486SS*.Hα-helixtrans-63.9-16176.8-58-71.4000113.6K100 T101 N102D98-K100 VanDerWaalsContact C-N 3.33Å; D98-T101 PolarHBondContact O-OG1 3.22Å; D98-N102 PolarHBondContact O-ND2 2.96Å
99S59.9Low64.3Low50 Ų5079.4 Ų79.435%0.3545%0.451SS..Hα-helixtrans-81.8-10177.6-63.90000113.5E97E97-S99 PolarHBondContact O-N 3.48Å
100K74.1Confident66.9Low109 Ų10980.5 Ų80.547%0.47445%0.445SS..Hα-helixtrans-96.5-17.3-179.3-66.7-179.2-176.8173.90113.6E97 D98 P152 A155 Y176E97-K100 PolarHBondContact O-N 3.14Å; D98-K100 VanDerWaalsContact C-N 3.33Å; K100-P152 HydrophobicContact CB-CB 4.03Å; K100-A155 WeakPolarHBondContact O-CB 3.41Å; K100-Y176 HydrophobicContact CB-CE1 4.35Å; K100-Y176 WeakPolarHBondContact O-CE1 3.37Å
101T87.1Confident69.1Low17 Ų1779 Ų7910%0.10443%0.43CS..Hα-helixtrans-87.3-29.4177.845.10000112.6D98 N148 Y149 P152D98-T101 PolarHBondContact O-OG1 3.22Å; T101-N148 VanDerWaalsContact CB-OD1 3.25Å; T101-N148 WeakPolarHBondContact CB-OD1 3.27Å; T101-N148 PolarHBondContact O-OD1 3.44Å; T101-N148 PolarHBondContact OG1-OD1 2.78Å; T101-Y149 WeakPolarHBondContact CB-O 3.47Å; T101-Y149 PolarHBondContact O-N 3.27Å; T101-P152 HydrophobicContact CG2-CB 3.83Å; T101-P152 HydrophobicContact CG2-CG 4.34Å
102N90.7Very high71.7Confident54 Ų5473.2 Ų73.229%0.28939%0.394SS..EExtended strand (participates in β ladder)trans-83.8126.1-178.1-74.3-76.3000111.4D98 N148 Y176 A177D98-N102 PolarHBondContact O-ND2 2.96Å; N102-N148 WeakPolarHBondContact CA-OD1 3.3Å; N102-N148 PolarHBondContact N-OD1 3.3Å; N102-N148 PolarHBondContact ND2-OD1 2.96Å; N102-N148 WeakPolarHBondContact OD1-CB 3.31Å; N102-N148 PolarHBondContact OD1-OD1 3.15Å; N102-Y176 CarbonylContact O-C 3.46Å; N102-A177 HydrophobicContact CB-CB 3.96Å; N102-A177 PolarHBondContact O-N 2.95Å
103L91.3Very high74.2Confident1 Ų166.3 Ų66.31%0.00537%0.365CS..EExtended strand (participates in β ladder)trans-118.8144.4177.7-56.5-171000111.5F121 F146 V147 Y149 A155 A158 I159 V174 S175 Y176 A177L103-F121 HydrophobicContact CD1-CE1 4.45Å; L103-F146 CarbonylContact O-C 3.57Å; L103-F146 VanDerWaalsContact O-CA 3.29Å; L103-F146 WeakPolarHBondContact O-CA 3.21Å; L103-V147 WeakPolarHBondContact CA-O 3.37Å; L103-V147 WeakPolarHBondContact CB-O 3.46Å; L103-V147 PolarHBondContact N-O 3.29Å; L103-V147 PolarHBondContact O-N 3.26Å; L103-Y149 HydrophobicContact CD1-CD2 4Å; L103-Y149 HydrophobicContact CD1-CE2 3.64Å; L103-Y149 HydrophobicContact CG-CD2 4.33Å; L103-Y149 HydrophobicContact CG-CE2 4.41Å; L103-A155 HydrophobicContact CD1-CB 4.26Å; L103-A155 HydrophobicContact CD2-CB 4.03Å; L103-A155 HydrophobicContact CG-CB 4.13Å; L103-A158 HydrophobicContact CD1-CB 3.93Å; L103-I159 HydrophobicContact CD1-CG1 4.1Å; L103-I159 HydrophobicContact CD2-CD1 3.48Å; L103-I159 VanDerWaalsContact CD2-CD1 3.48Å; L103-I159 HydrophobicContact CD2-CG1 3.72Å; L103-V174 HydrophobicContact CB-CG1 4.42Å; L103-V174 HydrophobicContact CD1-CG1 3.93Å; L103-S175 WeakPolarHBondContact CA-O 3.11Å; L103-Y176 HydrophobicContact CD2-CD1 3.72Å; L103-Y176 HydrophobicContact CD2-CE1 4.07Å; L103-Y176 HydrophobicContact CD2-CG 4.44Å; L103-A177 VanDerWaalsContact C-CB 3.46Å
104I91.1Very high76.7Confident32 Ų3263.8 Ų63.816%0.16434%0.34CS..EExtended strand (participates in β ladder)trans-110.2131.7168.1-172.2173.2000109.1Y144 F146 S175 A177I104-Y144 HydrophobicContact CD1-CD2 4.47Å; I104-F146 HydrophobicContact CB-CD1 4.08Å; I104-F146 HydrophobicContact CB-CE1 3.98Å; I104-F146 HydrophobicContact CD1-CE1 3.71Å; I104-F146 HydrophobicContact CD1-CZ 3.95Å; I104-F146 HydrophobicContact CG1-CD1 4.15Å; I104-F146 HydrophobicContact CG1-CE1 3.81Å; I104-F146 HydrophobicContact CG1-CZ 4.33Å; I104-S175 WeakPolarHBondContact CG2-O 3.43Å; I104-S175 VanDerWaalsContact CG2-OG 3.3Å; I104-S175 WeakPolarHBondContact CG2-OG 3.29Å; I104-S175 PolarHBondContact N-O 2.77Å; I104-S175 PolarHBondContact O-N 2.84Å; I104-A177 HydrophobicContact CB-CB 4Å; I104-A177 HydrophobicContact CG2-CB 4.44Å
105V91.3Very high79.1Confident0 Ų067.1 Ų67.10%034%0.342CS..EExtended strand (participates in β ladder)trans-112.2110.4178.5-169.50000107.8L108 L117 F121 Y144 G145 V147 I172 K173 V174V105-L108 HydrophobicContact CB-CD1 4.19Å; V105-L108 HydrophobicContact CB-CG 4.46Å; V105-L108 HydrophobicContact CG1-CD1 4.11Å; V105-L108 HydrophobicContact CG1-CD2 3.7Å; V105-L108 HydrophobicContact CG1-CG 3.89Å; V105-L117 HydrophobicContact CG1-CD1 4.42Å; V105-L117 HydrophobicContact CG2-CD1 4.45Å; V105-F121 HydrophobicContact CB-CZ 4.33Å; V105-F121 HydrophobicContact CG1-CE2 4.29Å; V105-F121 HydrophobicContact CG1-CZ 4.04Å; V105-F121 HydrophobicContact CG2-CE1 3.85Å; V105-F121 HydrophobicContact CG2-CE2 3.85Å; V105-F121 HydrophobicContact CG2-CZ 3.31Å; V105-Y144 CarbonylContact O-C 3.52Å; V105-Y144 WeakPolarHBondContact O-CA 3.28Å; V105-Y144 WeakPolarHBondContact O-CB 3.36Å; V105-G145 PolarHBondContact N-O 3.45Å; V105-G145 PolarHBondContact O-N 2.73Å; V105-V147 HydrophobicContact CG2-CG2 4.21Å; V105-I172 HydrophobicContact CG1-CB 4.27Å; V105-I172 HydrophobicContact CG1-CD1 4.31Å; V105-K173 WeakPolarHBondContact CA-O 3.33Å; V105-V174 HydrophobicContact CG1-CG2 4.26Å; V105-V174 HydrophobicContact CG2-CG1 4.49Å; V105-V174 HydrophobicContact CG2-CG2 4.5Å
106N89.8Confident81.3Confident48 Ų4866.5 Ų66.526%0.25733%0.328SS..EExtended strand (participates in β ladder)trans-99.4158.6178.2-75.4-55000111.3I172 K173N106-I172 WeakPolarHBondContact O-CA 3.16Å; N106-K173 HydrophobicContact CB-CB 4.37Å; N106-K173 PolarHBondContact N-O 3.39Å; N106-K173 PolarHBondContact O-N 2.94Å
107Y87.9Confident83.3Confident138 Ų13859.9 Ų59.954%0.54129%0.294SS..SBendtrans65.932.4177.8-50.8-75.2000114.6G143 K170 T171 K173Y107-G143 PolarHBondContact N-O 3.45Å; Y107-K170 VanDerWaalsContact O-CB 3.28Å; Y107-K170 WeakPolarHBondContact O-CB 3.29Å; Y107-K170 VanDerWaalsContact O-CD 3.29Å; Y107-K170 WeakPolarHBondContact O-CD 3.28Å; Y107-T171 WeakPolarHBondContact CB-O 3.38Å; Y107-K173 HydrophobicContact CD2-CB 3.85Å; Y107-K173 HydrophobicContact CE2-CB 4.15Å; Y107-K173 HydrophobicContact CE2-CD 4.43Å
108L89Confident85.2Confident1 Ų157.8 Ų57.81%0.00528%0.283CS..  trans-66.1143.6170.8-66.7167.5000110.8V105 M112 L117 L132 G143 L167 K170 I172V105-L108 HydrophobicContact CB-CD1 4.19Å; V105-L108 HydrophobicContact CB-CG 4.46Å; V105-L108 HydrophobicContact CG1-CD1 4.11Å; V105-L108 HydrophobicContact CG1-CD2 3.7Å; V105-L108 HydrophobicContact CG1-CG 3.89Å; L108-M112 HydrophobicContact CD2-CE 4.35Å; L108-M112 HydrophobicContact CD2-SD 3.64Å; L108-L117 HydrophobicContact CD1-CD1 4Å; L108-L117 HydrophobicContact CD1-CD2 4.24Å; L108-L117 HydrophobicContact CD2-CD1 3.9Å; L108-L132 HydrophobicContact CD1-CD1 3.7Å; L108-G143 PolarHBondContact N-O 2.8Å; L108-G143 WeakPolarHBondContact O-CA 3.42Å; L108-L167 HydrophobicContact CD2-CD1 4.44Å; L108-K170 PolarHBondContact O-NZ 3.49Å; L108-K170 VanDerWaalsContact O-NZ 3.09Å; L108-I172 HydrophobicContact CD2-CG2 3.85Å
109P85.9Confident87.1Confident5 Ų556.8 Ų56.83%0.03228%0.284CS..  trans-71.2147.5174.126.8-25.3000110.3N111 M112 L167P109-N111 VanDerWaalsContact C-N 3.27Å; P109-N111 WeakPolarHBondContact CB-OD1 3.47Å; P109-N111 PolarHBondContact O-N 3.39Å; P109-M112 HydrophobicContact CG-CB 4.02Å; P109-M112 HydrophobicContact CG-SD 4.21Å; P109-M112 VanDerWaalsContact O-CB 3.26Å; P109-M112 WeakPolarHBondContact O-CB 3.49Å; P109-M112 PolarHBondContact O-N 3.43Å; P109-M112 VanDerWaalsContact O-N 3.1Å; P109-L167 HydrophobicContact CG-CB 4.19Å
110Q84.3Confident88.5Confident120 Ų12056.9 Ų56.956%0.56128%0.281SS*.THydrogen-bonded Turntrans-67.7-27.9-170.7-81.7-175.8-0.500113.4M112 S141Q110-M112 PolarHBondContact O-N 3.3Å; Q110-S141 PolarHBondContact O-OG 2.77Å
111N85.2Confident89.3Confident96 Ų9651.8 Ų51.851%0.51326%0.258SS..THydrogen-bonded Turntrans-76.4-9.9175.858.9-5.6000113.3P109 Q168P109-N111 VanDerWaalsContact C-N 3.27Å; P109-N111 WeakPolarHBondContact CB-OD1 3.47Å; P109-N111 PolarHBondContact O-N 3.39Å; N111-Q168 VanDerWaalsContact ND2-CD 3.34Å; N111-Q168 PolarHBondContact ND2-NE2 3.49Å; N111-Q168 PolarHBondContact ND2-OE1 2.92Å; N111-Q168 PolarHBondContact OD1-NE2 3.28Å; N111-Q168 PolarHBondContact OD1-OE1 3.31Å; N111-Q168 VanDerWaalsContact OD1-OE1 3.08Å
112M86.1Confident89.5Confident8 Ų853 Ų534%0.03927%0.274CS..  trans-70.9135.5-178.1-164.3158.9177.500111.2L108 P109 Q110 E116 L117 L120 L132 L167L108-M112 HydrophobicContact CD2-CE 4.35Å; L108-M112 HydrophobicContact CD2-SD 3.64Å; P109-M112 HydrophobicContact CG-CB 4.02Å; P109-M112 HydrophobicContact CG-SD 4.21Å; P109-M112 VanDerWaalsContact O-CB 3.26Å; P109-M112 WeakPolarHBondContact O-CB 3.49Å; P109-M112 PolarHBondContact O-N 3.43Å; P109-M112 VanDerWaalsContact O-N 3.1Å; Q110-M112 PolarHBondContact O-N 3.3Å; M112-E116 VanDerWaalsContact CA-OE2 3.3Å; M112-E116 WeakPolarHBondContact CA-OE2 3.47Å; M112-E116 HydrophobicContact CE-CB 4.13Å; M112-E116 HydrophobicContact CG-CB 4.16Å; M112-E116 WeakPolarHBondContact CG-OE2 3.24Å; M112-L117 HydrophobicContact CE-CB 4.21Å; M112-L117 HydrophobicContact CE-CD1 4.25Å; M112-L120 HydrophobicContact CE-CD1 3.26Å; M112-L132 VanDerWaalsContact O-CD2 3.27Å; M112-L132 WeakPolarHBondContact O-CD2 3.33Å; M112-L167 HydrophobicContact CE-CD1 3.9Å; M112-L167 HydrophobicContact SD-CD1 3.58Å; M112-L167 VanDerWaalsContact SD-CD1 3.58Å
113T89.9Confident89.5Confident44 Ų4455.1 Ų55.127%0.2729%0.293SS..  trans-97.2166.5179.382.90000112.4E115 E116 L117T113-E115 VanDerWaalsContact C-N 3.28Å; T113-E115 WeakPolarHBondContact CB-OE2 2.89Å; T113-E115 PolarHBondContact OG1-N 2.83Å; T113-E115 PolarHBondContact OG1-OE2 3.33Å; T113-E116 PolarHBondContact N-OE2 3.11Å; T113-E116 WeakPolarHBondContact OG1-CG 3.19Å; T113-E116 PolarHBondContact OG1-N 3.27Å; T113-L117 PolarHBondContact O-N 2.81Å; T113-L117 VanDerWaalsContact O-N 3.11Å
114Q88.8Confident89.5Confident66 Ų6657.2 Ų57.231%0.30830%0.304SS..Hα-helixtrans-68-34.2178.1-177.5171.3-68.100110.9L117 K118 C130 L132Q114-L117 PolarHBondContact O-N 3.05Å; Q114-K118 WeakPolarHBondContact O-CB 3.47Å; Q114-K118 PolarHBondContact O-N 3.06Å; Q114-C130 PolarHBondContact NE2-O 3.4Å; Q114-L132 HydrophobicContact CB-CB 3.94Å; Q114-L132 HydrophobicContact CG-CB 4.27Å; Q114-L132 VanDerWaalsContact OE1-N 3.1Å
115E90.6Very high89.4Confident122 Ų12256.4 Ų56.457%0.5730%0.303SS*.Hα-helixtrans-66.9-40.8179-54.971.6-149.900110.9T113 K118 S119T113-E115 VanDerWaalsContact C-N 3.28Å; T113-E115 WeakPolarHBondContact CB-OE2 2.89Å; T113-E115 PolarHBondContact OG1-N 2.83Å; T113-E115 PolarHBondContact OG1-OE2 3.33Å; E115-K118 PolarHBondContact O-N 3.06Å; E115-S119 PolarHBondContact O-N 3.17Å
116E90.6Very high89.5Confident84 Ų8463 Ų6339%0.39333%0.333SS..Hα-helixtrans-63.5-45.2173.5-69.8176.4153.900111.4M112 T113 K118 S119 L120M112-E116 VanDerWaalsContact CA-OE2 3.3Å; M112-E116 WeakPolarHBondContact CA-OE2 3.47Å; M112-E116 HydrophobicContact CE-CB 4.13Å; M112-E116 HydrophobicContact CG-CB 4.16Å; M112-E116 WeakPolarHBondContact CG-OE2 3.24Å; T113-E116 PolarHBondContact N-OE2 3.11Å; T113-E116 WeakPolarHBondContact OG1-CG 3.19Å; T113-E116 PolarHBondContact OG1-N 3.27Å; E116-K118 VanDerWaalsContact C-N 3.33Å; E116-K118 PolarHBondContact O-N 3.48Å; E116-S119 PolarHBondContact O-N 3.34Å; E116-L120 WeakPolarHBondContact O-CB 3.17Å; E116-L120 PolarHBondContact O-N 2.91Å
117L91.8Very high89.6Confident0 Ų061.6 Ų61.60%033%0.326CS..Hα-helixtrans-59.8-45.2174.8-175.170.7000110.9V105 L108 M112 T113 Q114 L120 F121 L132 V147V105-L117 HydrophobicContact CG1-CD1 4.42Å; V105-L117 HydrophobicContact CG2-CD1 4.45Å; L108-L117 HydrophobicContact CD1-CD1 4Å; L108-L117 HydrophobicContact CD1-CD2 4.24Å; L108-L117 HydrophobicContact CD2-CD1 3.9Å; M112-L117 HydrophobicContact CE-CB 4.21Å; M112-L117 HydrophobicContact CE-CD1 4.25Å; T113-L117 PolarHBondContact O-N 2.81Å; T113-L117 VanDerWaalsContact O-N 3.11Å; Q114-L117 PolarHBondContact O-N 3.05Å; L117-L120 PolarHBondContact O-N 3.09Å; L117-F121 HydrophobicContact CD1-CD2 3.73Å; L117-F121 HydrophobicContact CD1-CE2 3.52Å; L117-F121 HydrophobicContact CG-CD2 4.25Å; L117-F121 HydrophobicContact CG-CE2 4.47Å; L117-F121 WeakPolarHBondContact O-CD2 3.25Å; L117-F121 PolarHBondContact O-N 3.05Å; L117-F121 VanDerWaalsContact O-N 3.1Å; L117-L132 HydrophobicContact CD2-CD1 4.38Å; L117-V147 HydrophobicContact CD2-CG2 4.16Å; L117-V147 HydrophobicContact CG-CG2 4.27Å
118K91.6Very high89.8Confident110 Ų11061.2 Ų61.248%0.47833%0.329SS..Hα-helixtrans-62.4-43.6178.1-166.2-178.3-176.41780111.8Q114 E115 E116 G122 I127 C130Q114-K118 WeakPolarHBondContact O-CB 3.47Å; Q114-K118 PolarHBondContact O-N 3.06Å; E115-K118 PolarHBondContact O-N 3.06Å; E116-K118 VanDerWaalsContact C-N 3.33Å; E116-K118 PolarHBondContact O-N 3.48Å; K118-G122 WeakPolarHBondContact O-CA 3.36Å; K118-G122 PolarHBondContact O-N 3.05Å; K118-I127 HydrophobicContact CG-CD1 3.96Å; K118-I127 VanDerWaalsContact O-CD1 3.28Å; K118-I127 WeakPolarHBondContact O-CD1 3.49Å; K118-C130 HydrophobicContact CB-CB 4.46Å; K118-C130 HydrophobicContact CG-CB 4.45Å
119S91.4Very high89.7Confident87 Ų8764.4 Ų64.461%0.60835%0.351SS*.Hα-helixtrans-64.4-42.2177.6-82.90000112.7E115 E116 G122 S123E115-S119 PolarHBondContact O-N 3.17Å; E116-S119 PolarHBondContact O-N 3.34Å; S119-G122 PolarHBondContact O-N 3.01Å; S119-S123 PolarHBondContact O-N 3.18Å; S119-S123 PolarHBondContact O-OG 3.46Å
120L90.5Very high89.9Confident53 Ų5364.9 Ų64.928%0.27736%0.355SS..Hα-helixtrans-61.5-48.8178.7-93.1153.9000112M112 E116 L117 L167M112-L120 HydrophobicContact CE-CD1 3.26Å; E116-L120 WeakPolarHBondContact O-CB 3.17Å; E116-L120 PolarHBondContact O-N 2.91Å; L117-L120 PolarHBondContact O-N 3.09Å; L120-L167 HydrophobicContact CD1-CD1 4.4Å
121F91.3Very high90.2Very high2 Ų265.5 Ų65.51%0.00936%0.355CS..Hα-helixtrans-77.3-28.1-179.4-78.9-98.9000112.2L103 V105 L117 S123 I124 I127 V147 Y149 A158 L162 V174L103-F121 HydrophobicContact CD1-CE1 4.45Å; V105-F121 HydrophobicContact CB-CZ 4.33Å; V105-F121 HydrophobicContact CG1-CE2 4.29Å; V105-F121 HydrophobicContact CG1-CZ 4.04Å; V105-F121 HydrophobicContact CG2-CE1 3.85Å; V105-F121 HydrophobicContact CG2-CE2 3.85Å; V105-F121 HydrophobicContact CG2-CZ 3.31Å; L117-F121 HydrophobicContact CD1-CD2 3.73Å; L117-F121 HydrophobicContact CD1-CE2 3.52Å; L117-F121 HydrophobicContact CG-CD2 4.25Å; L117-F121 HydrophobicContact CG-CE2 4.47Å; L117-F121 WeakPolarHBondContact O-CD2 3.25Å; L117-F121 PolarHBondContact O-N 3.05Å; L117-F121 VanDerWaalsContact O-N 3.1Å; F121-S123 PolarHBondContact O-N 2.86Å; F121-I124 PolarHBondContact O-N 2.7Å; F121-I124 VanDerWaalsContact O-N 3.15Å; F121-I127 HydrophobicContact CB-CD1 3.62Å; F121-I127 HydrophobicContact CB-CG1 4.43Å; F121-V147 HydrophobicContact CB-CG1 4.03Å; F121-V147 HydrophobicContact CB-CG2 4.48Å; F121-V147 HydrophobicContact CD1-CB 4.39Å; F121-V147 HydrophobicContact CD1-CG1 4.19Å; F121-V147 HydrophobicContact CD1-CG2 4.21Å; F121-V147 HydrophobicContact CD2-CG2 4.33Å; F121-V147 HydrophobicContact CG-CG1 4.25Å; F121-V147 HydrophobicContact CG-CG2 4.07Å; F121-Y149 WeakPolarHBondContact CA-OH 3.29Å; F121-Y149 VanDerWaalsContact CB-OH 3.31Å; F121-Y149 WeakPolarHBondContact CB-OH 3.45Å; F121-Y149 HydrophobicContact CD1-CE2 4.16Å; F121-Y149 WeakPolarHBondContact CD1-OH 3.47Å; F121-Y149 PolarHBondContact O-OH 3.15Å; F121-A158 HydrophobicContact CD1-CB 4.3Å; F121-L162 HydrophobicContact CD1-CD1 3.65Å; F121-L162 HydrophobicContact CD2-CD1 4.16Å; F121-L162 HydrophobicContact CE1-CD1 3.62Å; F121-L162 HydrophobicContact CE2-CD1 4.14Å; F121-L162 HydrophobicContact CG-CD1 3.92Å; F121-L162 HydrophobicContact CZ-CB 4.44Å; F121-L162 HydrophobicContact CZ-CD1 3.86Å; F121-V174 HydrophobicContact CE1-CG1 3.94Å; F121-V174 HydrophobicContact CE1-CG2 4.17Å; F121-V174 HydrophobicContact CZ-CG1 4.31Å; F121-V174 HydrophobicContact CZ-CG2 3.78Å
122G90.6Very high90.5Very high41 Ų4161.4 Ų61.442%0.42333%0.334SS..Hα-helixtrans-70.8-15.4178.200000113.2K118 S119 I124 G125K118-G122 WeakPolarHBondContact O-CA 3.36Å; K118-G122 PolarHBondContact O-N 3.05Å; S119-G122 PolarHBondContact O-N 3.01Å; G122-I124 VanDerWaalsContact C-N 3.27Å; G122-G125 WeakPolarHBondContact CA-O 3.32Å
123S90.8Very high90.5Very high99 Ų9962.3 Ų62.369%0.69234%0.339SS*.THydrogen-bonded Turntrans-72.5-20.7172.5-580000112.8S119 F121S119-S123 PolarHBondContact O-N 3.18Å; S119-S123 PolarHBondContact O-OG 3.46Å; F121-S123 PolarHBondContact O-N 2.86Å
124I91.4Very high90.4Very high46 Ų4665.4 Ų65.424%0.23635%0.346CS..THydrogen-bonded Turntrans-91.5-38-179.8-57.8-62.8000111.9F121 G122 K157 A158 T161 L162F121-I124 PolarHBondContact O-N 2.7Å; F121-I124 VanDerWaalsContact O-N 3.15Å; G122-I124 VanDerWaalsContact C-N 3.27Å; I124-K157 HydrophobicContact CG2-CB 3.82Å; I124-A158 HydrophobicContact CB-CB 4.35Å; I124-A158 HydrophobicContact CG1-CB 4.43Å; I124-A158 HydrophobicContact CG2-CB 3.99Å; I124-T161 HydrophobicContact CD1-CG2 4.17Å; I124-L162 HydrophobicContact CG1-CD1 3.94Å; I124-L162 HydrophobicContact CG1-CG 4.29Å
125G89.6Confident90.1Very high14 Ų1464.7 Ų64.714%0.14434%0.344CS..SBendtrans-174.5178.7-176.900000112.5G122 I127G122-G125 WeakPolarHBondContact CA-O 3.32Å; G125-I127 PolarHBondContact O-N 2.97Å
126E92.3Very high89.5Confident138 Ų13868.9 Ų68.965%0.64536%0.361SS*.  trans-76.1122.7-176.6-167.7171.6178.500111.6Y149 V150E126-Y149 VanDerWaalsContact O-CD1 3.31Å; E126-Y149 WeakPolarHBondContact O-CD1 3.44Å; E126-V150 HydrophobicContact CB-CB 4.48Å; E126-V150 HydrophobicContact CB-CG2 4.17Å; E126-V150 HydrophobicContact CG-CG2 3.9Å; E126-V150 PolarHBondContact O-N 3Å
127I92.8Very high88.9Confident20 Ų2071.1 Ų71.110%0.10337%0.374CS..EExtended strand (participates in β ladder)trans-93119.3-180-60.8171.9000109K118 F121 G125 S129 C130 V147 N148 Y149K118-I127 HydrophobicContact CG-CD1 3.96Å; K118-I127 VanDerWaalsContact O-CD1 3.28Å; K118-I127 WeakPolarHBondContact O-CD1 3.49Å; F121-I127 HydrophobicContact CB-CD1 3.62Å; F121-I127 HydrophobicContact CB-CG1 4.43Å; G125-I127 PolarHBondContact O-N 2.97Å; I127-S129 VanDerWaalsContact CG2-C 3.49Å; I127-S129 WeakPolarHBondContact CG2-O 3.33Å; I127-C130 HydrophobicContact CG2-CB 4.1Å; I127-V147 HydrophobicContact CD1-CG1 4.05Å; I127-V147 HydrophobicContact CG1-CG1 4.02Å; I127-V147 HydrophobicContact CG2-CG1 3.96Å; I127-N148 WeakPolarHBondContact CG2-O 3.46Å; I127-Y149 HydrophobicContact CG1-CD1 4.38Å; I127-Y149 HydrophobicContact CG1-CE1 4.01Å
128E90.9Very high88.3Confident130 Ų13075.1 Ų75.161%0.60740%0.399SS*.EExtended strand (participates in β ladder)trans-70.5-46.5170.8-168.8-166.7-158.800110.7N148 V150E128-N148 PolarHBondContact N-O 3.18Å; E128-N148 PolarHBondContact OE2-ND2 3.23Å; E128-V150 HydrophobicContact CB-CG2 3.89Å
129S88Confident87.6Confident67 Ų6772.1 Ų72.147%0.46940%0.399SS..EExtended strand (participates in β ladder)trans-147.8137.1-178.4-1730000112.1I127 V147 N148I127-S129 VanDerWaalsContact CG2-C 3.49Å; I127-S129 WeakPolarHBondContact CG2-O 3.33Å; S129-V147 CarbonylContact O-C 3.57Å; S129-V147 WeakPolarHBondContact O-CA 3.48Å; S129-N148 PolarHBondContact N-O 2.85Å; S129-N148 VanDerWaalsContact N-O 3.15Å; S129-N148 PolarHBondContact O-N 3.35Å
130C90.3Very high87Confident15 Ų1573.2 Ų73.210%0.10139%0.394CS..EExtended strand (participates in β ladder)trans-128.1133.5169.963.50000109.5Q114 K118 I127 F146Q114-C130 PolarHBondContact NE2-O 3.4Å; K118-C130 HydrophobicContact CB-CB 4.46Å; K118-C130 HydrophobicContact CG-CB 4.45Å; I127-C130 HydrophobicContact CG2-CB 4.1Å; C130-F146 CarbonylContact C-O 3.46Å; C130-F146 WeakPolarHBondContact CA-O 3.39Å
131K89.9Confident86.7Confident133 Ų13371.1 Ų71.158%0.57838%0.384SS*.EExtended strand (participates in β ladder)trans-136.5111.6179.8-174.5172.3-175.9169.40110.2G145 F146K131-G145 CarbonylContact O-C 3.51Å; K131-G145 VanDerWaalsContact O-CA 3.29Å; K131-G145 WeakPolarHBondContact O-CA 3.3Å; K131-F146 PolarHBondContact N-O 3.18Å; K131-F146 PolarHBondContact O-N 3.03Å
132L90.6Very high86.4Confident11 Ų1175.2 Ų75.26%0.05841%0.405CS..EExtended strand (participates in β ladder)trans-82.9124.3170-174.865.6000109L108 M112 Q114 L117 R134L108-L132 HydrophobicContact CD1-CD1 3.7Å; M112-L132 VanDerWaalsContact O-CD2 3.27Å; M112-L132 WeakPolarHBondContact O-CD2 3.33Å; Q114-L132 HydrophobicContact CB-CB 3.94Å; Q114-L132 HydrophobicContact CG-CB 4.27Å; Q114-L132 VanDerWaalsContact OE1-N 3.1Å; L117-L132 HydrophobicContact CD2-CD1 4.38Å; L132-R134 PolarHBondContact O-N 2.78Å
133V87.4Confident86.1Confident26 Ų2673.6 Ų73.616%0.15839%0.389CS..EExtended strand (participates in β ladder)trans-82.5118.8-179.5-166.80000109.5L142 Y144 F146V133-L142 HydrophobicContact CB-CD1 4.46Å; V133-L142 HydrophobicContact CG1-CD1 3.65Å; V133-L142 HydrophobicContact CG1-CG 4.44Å; V133-L142 PolarHBondContact O-N 2.96Å; V133-Y144 HydrophobicContact CB-CD2 4.13Å; V133-Y144 HydrophobicContact CB-CE1 4.41Å; V133-Y144 HydrophobicContact CB-CE2 3.71Å; V133-Y144 HydrophobicContact CG1-CE2 4.08Å; V133-Y144 HydrophobicContact CG2-CD2 3.83Å; V133-Y144 HydrophobicContact CG2-CE2 3.44Å; V133-Y144 VanDerWaalsContact CG2-CE2 3.44Å; V133-Y144 PolarHBondContact N-O 2.9Å; V133-F146 HydrophobicContact CG2-CD2 3.75Å; V133-F146 HydrophobicContact CG2-CE2 3.64Å
134R87.1Confident86.1Confident110 Ų11072.4 Ų72.442%0.41537%0.37SS..EExtended strand (participates in β ladder)trans-114.4148.5175.2-61.2-176.8173.3169.92.1109.6L132 K136 Q140L132-R134 PolarHBondContact O-N 2.78Å; R134-K136 PolarHBondContact O-N 3.46Å; R134-Q140 CarbonylContact C-O 3.53Å; R134-Q140 VanDerWaalsContact CA-O 3.28Å; R134-Q140 WeakPolarHBondContact CA-O 3.48Å
135D83.2Confident86.1Confident50 Ų5070.2 Ų70.227%0.26736%0.359SS..  trans-59.7128170.2179.211.3000108.9I137 T138 G139 Q140 L142D135-I137 PolarHBondContact O-N 3.1Å; D135-I137 PolarHBondContact OD1-N 3.4Å; D135-I137 VanDerWaalsContact OD1-N 3.12Å; D135-T138 WeakPolarHBondContact CB-OG1 3.36Å; D135-T138 WeakPolarHBondContact OD2-CB 3.45Å; D135-T138 WeakPolarHBondContact OD2-CG2 3.31Å; D135-T138 PolarHBondContact OD2-N 3.35Å; D135-T138 PolarHBondContact OD2-OG1 2.93Å; D135-G139 WeakPolarHBondContact O-CA 3.31Å; D135-G139 PolarHBondContact O-N 2.88Å; D135-Q140 PolarHBondContact N-O 3.23Å; D135-L142 HydrophobicContact CB-CD2 3.98Å
136K77.5Confident86.2Confident211 Ų21173 Ų7392%0.91737%0.367SS*.THydrogen-bonded Turntrans-66.5-22.9-178-65.7-175.3177.4-170.90112.2R134R134-K136 PolarHBondContact O-N 3.46Å
137I77.6Confident86.3Confident131 Ų13166.5 Ų66.567%0.67234%0.337SS*.THydrogen-bonded Turntrans-93.6-53.8-175.4-55.1174.8000110.5D135 T272D135-I137 PolarHBondContact O-N 3.1Å; D135-I137 PolarHBondContact OD1-N 3.4Å; D135-I137 VanDerWaalsContact OD1-N 3.12Å; I137-T272 HydrophobicContact CD1-CG2 3.81Å
138T79Confident86.2Confident84 Ų8466.6 Ų66.652%0.51534%0.337SS..THydrogen-bonded Turntrans-89.6-12.1-175.6630000113.6D135 Q140D135-T138 WeakPolarHBondContact CB-OG1 3.36Å; D135-T138 WeakPolarHBondContact OD2-CB 3.45Å; D135-T138 WeakPolarHBondContact OD2-CG2 3.31Å; D135-T138 PolarHBondContact OD2-N 3.35Å; D135-T138 PolarHBondContact OD2-OG1 2.93Å; T138-Q140 PolarHBondContact O-N 3.43Å; T138-Q140 VanDerWaalsContact O-N 3.13Å; T138-Q140 PolarHBondContact OG1-N 2.97Å
139G78.3Confident86.4Confident46 Ų4660.4 Ų60.447%0.47431%0.309SS..  trans67.81.6-172.300000113.9D135D135-G139 WeakPolarHBondContact O-CA 3.31Å; D135-G139 PolarHBondContact O-N 2.88Å
140Q78.6Confident86.5Confident110 Ų11060.6 Ų60.651%0.51431%0.306SS..  trans-75.2141.9-178.2-66.7-1692.400111.4R134 D135 T138 L142R134-Q140 CarbonylContact C-O 3.53Å; R134-Q140 VanDerWaalsContact CA-O 3.28Å; R134-Q140 WeakPolarHBondContact CA-O 3.48Å; D135-Q140 PolarHBondContact N-O 3.23Å; T138-Q140 PolarHBondContact O-N 3.43Å; T138-Q140 VanDerWaalsContact O-N 3.13Å; T138-Q140 PolarHBondContact OG1-N 2.97Å; Q140-L142 PolarHBondContact O-N 3.05Å
141S84.2Confident86.5Confident10 Ų1063.7 Ų63.77%0.0732%0.322CS..EExtended strand (participates in β ladder)trans-62.4126.9174.8-59.30000110.9Q110 G143Q110-S141 PolarHBondContact O-OG 2.77Å; S141-G143 PolarHBondContact O-N 2.84Å; S141-G143 VanDerWaalsContact O-N 3.11Å
142L83.5Confident86.6Confident87 Ų8760 Ų6046%0.45531%0.312SS..EExtended strand (participates in β ladder)trans-72.81.3175.1-63.9-179.1000112.6V133 D135 Q140 Y144V133-L142 HydrophobicContact CB-CD1 4.46Å; V133-L142 HydrophobicContact CG1-CD1 3.65Å; V133-L142 HydrophobicContact CG1-CG 4.44Å; V133-L142 PolarHBondContact O-N 2.96Å; D135-L142 HydrophobicContact CB-CD2 3.98Å; Q140-L142 PolarHBondContact O-N 3.05Å; L142-Y144 VanDerWaalsContact C-N 3.3Å; L142-Y144 HydrophobicContact CB-CD1 3.72Å; L142-Y144 HydrophobicContact CB-CE1 3.42Å; L142-Y144 VanDerWaalsContact CB-CE1 3.42Å; L142-Y144 HydrophobicContact CD1-CE1 3.77Å; L142-Y144 HydrophobicContact CG-CE1 4.24Å; L142-Y144 PolarHBondContact O-N 2.82Å
143G85.8Confident86.6Confident8 Ų867 Ų678%0.08234%0.342CS..EExtended strand (participates in β ladder)trans74.719.7178.900000113.5Y107 L108 S141Y107-G143 PolarHBondContact N-O 3.45Å; L108-G143 PolarHBondContact N-O 2.8Å; L108-G143 WeakPolarHBondContact O-CA 3.42Å; S141-G143 PolarHBondContact O-N 2.84Å; S141-G143 VanDerWaalsContact O-N 3.11Å
144Y89.9Confident86.9Confident73 Ų7366.9 Ų66.929%0.28634%0.34SS..EExtended strand (participates in β ladder)trans-143.8155.6169.269.3-85.6000111.7I104 V105 V133 L142 F146I104-Y144 HydrophobicContact CD1-CD2 4.47Å; V105-Y144 CarbonylContact O-C 3.52Å; V105-Y144 WeakPolarHBondContact O-CA 3.28Å; V105-Y144 WeakPolarHBondContact O-CB 3.36Å; V133-Y144 HydrophobicContact CB-CD2 4.13Å; V133-Y144 HydrophobicContact CB-CE1 4.41Å; V133-Y144 HydrophobicContact CB-CE2 3.71Å; V133-Y144 HydrophobicContact CG1-CE2 4.08Å; V133-Y144 HydrophobicContact CG2-CD2 3.83Å; V133-Y144 HydrophobicContact CG2-CE2 3.44Å; V133-Y144 VanDerWaalsContact CG2-CE2 3.44Å; V133-Y144 PolarHBondContact N-O 2.9Å; L142-Y144 VanDerWaalsContact C-N 3.3Å; L142-Y144 HydrophobicContact CB-CD1 3.72Å; L142-Y144 HydrophobicContact CB-CE1 3.42Å; L142-Y144 VanDerWaalsContact CB-CE1 3.42Å; L142-Y144 HydrophobicContact CD1-CE1 3.77Å; L142-Y144 HydrophobicContact CG-CE1 4.24Å; L142-Y144 PolarHBondContact O-N 2.82Å; Y144-F146 HydrophobicContact CD2-CE2 4.12Å; Y144-F146 HydrophobicContact CD2-CZ 4.39Å; Y144-F146 AromaticContact CE2-CE2 3.86Å; Y144-F146 HydrophobicContact CE2-CE2 3.86Å; Y144-F146 HydrophobicContact CE2-CZ 4.2Å
145G91.4Very high87.1Confident0 Ų061.6 Ų61.60%032%0.32CS..EExtended strand (participates in β ladder)trans-146.9165.4-17900000111.7V105 K131V105-G145 PolarHBondContact N-O 3.45Å; V105-G145 PolarHBondContact O-N 2.73Å; K131-G145 CarbonylContact O-C 3.51Å; K131-G145 VanDerWaalsContact O-CA 3.29Å; K131-G145 WeakPolarHBondContact O-CA 3.3Å
146F92.3Very high87.4Confident73 Ų7364.4 Ų64.432%0.3233%0.332SS..EExtended strand (participates in β ladder)trans-116.9139.5175.8-62.8-83.6000109.6L103 I104 C130 K131 V133 Y144 A177L103-F146 CarbonylContact O-C 3.57Å; L103-F146 VanDerWaalsContact O-CA 3.29Å; L103-F146 WeakPolarHBondContact O-CA 3.21Å; I104-F146 HydrophobicContact CB-CD1 4.08Å; I104-F146 HydrophobicContact CB-CE1 3.98Å; I104-F146 HydrophobicContact CD1-CE1 3.71Å; I104-F146 HydrophobicContact CD1-CZ 3.95Å; I104-F146 HydrophobicContact CG1-CD1 4.15Å; I104-F146 HydrophobicContact CG1-CE1 3.81Å; I104-F146 HydrophobicContact CG1-CZ 4.33Å; C130-F146 CarbonylContact C-O 3.46Å; C130-F146 WeakPolarHBondContact CA-O 3.39Å; K131-F146 PolarHBondContact N-O 3.18Å; K131-F146 PolarHBondContact O-N 3.03Å; V133-F146 HydrophobicContact CG2-CD2 3.75Å; V133-F146 HydrophobicContact CG2-CE2 3.64Å; Y144-F146 HydrophobicContact CD2-CE2 4.12Å; Y144-F146 HydrophobicContact CD2-CZ 4.39Å; Y144-F146 AromaticContact CE2-CE2 3.86Å; Y144-F146 HydrophobicContact CE2-CE2 3.86Å; Y144-F146 HydrophobicContact CE2-CZ 4.2Å; F146-A177 HydrophobicContact CD1-CB 3.91Å; F146-A177 HydrophobicContact CE1-CB 4.19Å
147V93.2Very high88.2Confident1 Ų159.6 Ų59.61%0.00631%0.311CS..EExtended strand (participates in β ladder)trans-132.6120.2176.5-178.20000107L103 V105 L117 F121 I127 S129 Y149L103-V147 WeakPolarHBondContact CA-O 3.37Å; L103-V147 WeakPolarHBondContact CB-O 3.46Å; L103-V147 PolarHBondContact N-O 3.29Å; L103-V147 PolarHBondContact O-N 3.26Å; V105-V147 HydrophobicContact CG2-CG2 4.21Å; L117-V147 HydrophobicContact CD2-CG2 4.16Å; L117-V147 HydrophobicContact CG-CG2 4.27Å; F121-V147 HydrophobicContact CB-CG1 4.03Å; F121-V147 HydrophobicContact CB-CG2 4.48Å; F121-V147 HydrophobicContact CD1-CB 4.39Å; F121-V147 HydrophobicContact CD1-CG1 4.19Å; F121-V147 HydrophobicContact CD1-CG2 4.21Å; F121-V147 HydrophobicContact CD2-CG2 4.33Å; F121-V147 HydrophobicContact CG-CG1 4.25Å; F121-V147 HydrophobicContact CG-CG2 4.07Å; I127-V147 HydrophobicContact CD1-CG1 4.05Å; I127-V147 HydrophobicContact CG1-CG1 4.02Å; I127-V147 HydrophobicContact CG2-CG1 3.96Å; S129-V147 CarbonylContact O-C 3.57Å; S129-V147 WeakPolarHBondContact O-CA 3.48Å; V147-Y149 HydrophobicContact CG1-CD2 4.22Å; V147-Y149 HydrophobicContact CG1-CE2 3.87Å
148N92.1Very high88.9Confident22 Ų2253.4 Ų53.412%0.11828%0.279CS..EExtended strand (participates in β ladder)trans-104.1123.4171.8-160.724.2000109T101 N102 I127 E128 S129T101-N148 VanDerWaalsContact CB-OD1 3.25Å; T101-N148 WeakPolarHBondContact CB-OD1 3.27Å; T101-N148 PolarHBondContact O-OD1 3.44Å; T101-N148 PolarHBondContact OG1-OD1 2.78Å; N102-N148 WeakPolarHBondContact CA-OD1 3.3Å; N102-N148 PolarHBondContact N-OD1 3.3Å; N102-N148 PolarHBondContact ND2-OD1 2.96Å; N102-N148 WeakPolarHBondContact OD1-CB 3.31Å; N102-N148 PolarHBondContact OD1-OD1 3.15Å; I127-N148 WeakPolarHBondContact CG2-O 3.46Å; E128-N148 PolarHBondContact N-O 3.18Å; E128-N148 PolarHBondContact OE2-ND2 3.23Å; S129-N148 PolarHBondContact N-O 2.85Å; S129-N148 VanDerWaalsContact N-O 3.15Å; S129-N148 PolarHBondContact O-N 3.35Å
149Y93.4Very high89.5Confident1 Ų150.3 Ų50.30%0.00426%0.259CS..EExtended strand (participates in β ladder)trans-86.4153172.7-78.8-87.4000110.8T101 L103 F121 E126 I127 V147 D151 D154 A155 A158T101-Y149 WeakPolarHBondContact CB-O 3.47Å; T101-Y149 PolarHBondContact O-N 3.27Å; L103-Y149 HydrophobicContact CD1-CD2 4Å; L103-Y149 HydrophobicContact CD1-CE2 3.64Å; L103-Y149 HydrophobicContact CG-CD2 4.33Å; L103-Y149 HydrophobicContact CG-CE2 4.41Å; F121-Y149 WeakPolarHBondContact CA-OH 3.29Å; F121-Y149 VanDerWaalsContact CB-OH 3.31Å; F121-Y149 WeakPolarHBondContact CB-OH 3.45Å; F121-Y149 HydrophobicContact CD1-CE2 4.16Å; F121-Y149 WeakPolarHBondContact CD1-OH 3.47Å; F121-Y149 PolarHBondContact O-OH 3.15Å; E126-Y149 VanDerWaalsContact O-CD1 3.31Å; E126-Y149 WeakPolarHBondContact O-CD1 3.44Å; I127-Y149 HydrophobicContact CG1-CD1 4.38Å; I127-Y149 HydrophobicContact CG1-CE1 4.01Å; V147-Y149 HydrophobicContact CG1-CD2 4.22Å; V147-Y149 HydrophobicContact CG1-CE2 3.87Å; Y149-D151 VanDerWaalsContact C-N 3.34Å; Y149-D151 WeakPolarHBondContact CB-O 3.37Å; Y149-D154 HydrophobicContact CD1-CB 3.88Å; Y149-D154 HydrophobicContact CE1-CB 4.29Å; Y149-D154 HydrophobicContact CG-CB 4.43Å; Y149-A155 HydrophobicContact CD2-CB 3.73Å; Y149-A155 HydrophobicContact CG-CB 4.15Å; Y149-A158 HydrophobicContact CE2-CB 3.73Å; Y149-A158 WeakPolarHBondContact OH-CB 3.3Å
150V90.8Very high90.2Very high70 Ų7054.3 Ų54.342%0.42427%0.27SS..SBendtrans-65.9-44.8167.4-178.90000109.1E126 E128E126-V150 HydrophobicContact CB-CB 4.48Å; E126-V150 HydrophobicContact CB-CG2 4.17Å; E126-V150 HydrophobicContact CG-CG2 3.9Å; E126-V150 PolarHBondContact O-N 3Å; E128-V150 HydrophobicContact CB-CG2 3.89Å
151D91.2Very high90.7Very high81 Ų8153.3 Ų53.343%0.43327%0.271SS..SBendtrans-104131.3-178.3-76.6-54.8000113.2Y149 K153 D154 A155Y149-D151 VanDerWaalsContact C-N 3.34Å; Y149-D151 WeakPolarHBondContact CB-O 3.37Å; D151-K153 PolarHBondContact O-N 2.86Å; D151-D154 HydrophobicContact CB-CB 4.33Å; D151-D154 PolarHBondContact O-N 2.73Å; D151-A155 PolarHBondContact O-N 2.63Å
152P90.7Very high91Very high56 Ų5653.4 Ų53.436%0.36427%0.271SS..Hα-helixtrans-67.3-26177.225.6-33.2000112.6K100 T101 D154 A155 E156K100-P152 HydrophobicContact CB-CB 4.03Å; T101-P152 HydrophobicContact CG2-CB 3.83Å; T101-P152 HydrophobicContact CG2-CG 4.34Å; P152-D154 VanDerWaalsContact C-N 3.32Å; P152-A155 PolarHBondContact O-N 3.03Å; P152-E156 PolarHBondContact O-N 3.36Å; P152-E156 VanDerWaalsContact O-N 3.14Å
153K91.4Very high91.4Very high156 Ų15653 Ų5368%0.67827%0.27SS*.Hα-helixtrans-65.8-37.3176.3-65.3179.2-178.5175.20111.5D151 K157D151-K153 PolarHBondContact O-N 2.86Å; K153-K157 WeakPolarHBondContact O-CG 3.35Å; K153-K157 PolarHBondContact O-N 3.42Å; K153-K157 VanDerWaalsContact O-N 3.14Å
154D92.8Very high91.5Very high24 Ų2454.8 Ų54.813%0.12829%0.288CS..Hα-helixtrans-76.7-33.4179.5-68.9-16.2000111.4Y149 D151 P152 E156 K157 A158Y149-D154 HydrophobicContact CD1-CB 3.88Å; Y149-D154 HydrophobicContact CE1-CB 4.29Å; Y149-D154 HydrophobicContact CG-CB 4.43Å; D151-D154 HydrophobicContact CB-CB 4.33Å; D151-D154 PolarHBondContact O-N 2.73Å; P152-D154 VanDerWaalsContact C-N 3.32Å; D154-E156 PolarHBondContact O-N 2.84Å; D154-K157 PolarHBondContact O-N 2.96Å; D154-K157 IonicContact OD1-NZ 3.27Å; D154-K157 PolarHBondContact OD1-NZ 2.95Å; D154-A158 VanDerWaalsContact O-CB 3.31Å; D154-A158 WeakPolarHBondContact O-CB 3.43Å; D154-A158 PolarHBondContact O-N 3.11Å
155A91.4Very high91.4Very high0 Ų054.1 Ų54.10%029%0.289CS..Hα-helixtrans-59.5-43.6170.400000112.5K100 L103 Y149 D151 P152 A158 I159K100-A155 WeakPolarHBondContact O-CB 3.41Å; L103-A155 HydrophobicContact CD1-CB 4.26Å; L103-A155 HydrophobicContact CD2-CB 4.03Å; L103-A155 HydrophobicContact CG-CB 4.13Å; Y149-A155 HydrophobicContact CD2-CB 3.73Å; Y149-A155 HydrophobicContact CG-CB 4.15Å; D151-A155 PolarHBondContact O-N 2.63Å; P152-A155 PolarHBondContact O-N 3.03Å; A155-A158 PolarHBondContact O-N 3.37Å; A155-I159 WeakPolarHBondContact O-CG1 3.26Å; A155-I159 PolarHBondContact O-N 3.48Å
156E91.2Very high91.2Very high108 Ų10863.5 Ų63.551%0.50532%0.324SS..Hα-helixtrans-64.4-46.2175.8-174.7175-119.700112.1P152 D154 A158 I159 N160 Y176P152-E156 PolarHBondContact O-N 3.36Å; P152-E156 VanDerWaalsContact O-N 3.14Å; D154-E156 PolarHBondContact O-N 2.84Å; E156-A158 VanDerWaalsContact C-N 3.25Å; E156-A158 PolarHBondContact O-N 3.33Å; E156-I159 PolarHBondContact O-N 3.48Å; E156-N160 PolarHBondContact O-N 3.45Å; E156-N160 PolarHBondContact O-OD1 2.97Å; E156-Y176 WeakPolarHBondContact CB-OH 3.47Å
157K92.6Very high90.9Very high111 Ų11161.4 Ų61.448%0.48332%0.316SS..Hα-helixtrans-58.1-39.6174-71.9174.3-168.5161.70112.1I124 K153 D154 N160 T161I124-K157 HydrophobicContact CG2-CB 3.82Å; K153-K157 WeakPolarHBondContact O-CG 3.35Å; K153-K157 PolarHBondContact O-N 3.42Å; K153-K157 VanDerWaalsContact O-N 3.14Å; D154-K157 PolarHBondContact O-N 2.96Å; D154-K157 IonicContact OD1-NZ 3.27Å; D154-K157 PolarHBondContact OD1-NZ 2.95Å; K157-N160 PolarHBondContact O-N 3.44Å; K157-T161 VanDerWaalsContact O-CB 3.3Å; K157-T161 WeakPolarHBondContact O-CB 3.48Å; K157-T161 PolarHBondContact O-N 3.03Å; K157-T161 PolarHBondContact O-OG1 3.33Å
158A92.4Very high90.4Very high0 Ų067 Ų670%034%0.342CS..Hα-helixtrans-64.9-40.9178.900000111.3L103 F121 I124 Y149 D154 A155 E156 L162L103-A158 HydrophobicContact CD1-CB 3.93Å; F121-A158 HydrophobicContact CD1-CB 4.3Å; I124-A158 HydrophobicContact CB-CB 4.35Å; I124-A158 HydrophobicContact CG1-CB 4.43Å; I124-A158 HydrophobicContact CG2-CB 3.99Å; Y149-A158 HydrophobicContact CE2-CB 3.73Å; Y149-A158 WeakPolarHBondContact OH-CB 3.3Å; D154-A158 VanDerWaalsContact O-CB 3.31Å; D154-A158 WeakPolarHBondContact O-CB 3.43Å; D154-A158 PolarHBondContact O-N 3.11Å; A155-A158 PolarHBondContact O-N 3.37Å; E156-A158 VanDerWaalsContact C-N 3.25Å; E156-A158 PolarHBondContact O-N 3.33Å; A158-L162 HydrophobicContact CB-CD1 4.34Å; A158-L162 WeakPolarHBondContact O-CA 3.48Å; A158-L162 WeakPolarHBondContact O-CB 3.37Å; A158-L162 PolarHBondContact O-N 3.47Å
159I92.4Very high90Very high19 Ų1972.3 Ų72.310%0.09738%0.375CS..Hα-helixtrans-61.1-51.4171.9-65.9161.7000110.1L103 A155 E156 T161 N163 V174 Y176L103-I159 HydrophobicContact CD1-CG1 4.1Å; L103-I159 HydrophobicContact CD2-CD1 3.48Å; L103-I159 VanDerWaalsContact CD2-CD1 3.48Å; L103-I159 HydrophobicContact CD2-CG1 3.72Å; A155-I159 WeakPolarHBondContact O-CG1 3.26Å; A155-I159 PolarHBondContact O-N 3.48Å; E156-I159 PolarHBondContact O-N 3.48Å; I159-T161 PolarHBondContact O-N 3.16Å; I159-N163 HydrophobicContact CG2-CB 4.4Å; I159-N163 WeakPolarHBondContact O-CB 3.17Å; I159-N163 PolarHBondContact O-N 3.36Å; I159-V174 HydrophobicContact CG1-CG1 3.9Å; I159-Y176 HydrophobicContact CD1-CD1 3.74Å; I159-Y176 HydrophobicContact CD1-CD2 3.67Å; I159-Y176 HydrophobicContact CD1-CE1 3.46Å; I159-Y176 VanDerWaalsContact CD1-CE1 3.46Å; I159-Y176 HydrophobicContact CD1-CE2 3.41Å; I159-Y176 VanDerWaalsContact CD1-CE2 3.41Å; I159-Y176 HydrophobicContact CD1-CG 3.84Å
160N92Very high89.6Confident131 Ų13175.7 Ų75.770%0.70139%0.39SS*.Hα-helixtrans-64.7-29.3-174.7-73.819.2000113.1E156 K157E156-N160 PolarHBondContact O-N 3.45Å; E156-N160 PolarHBondContact O-OD1 2.97Å; K157-N160 PolarHBondContact O-N 3.44Å
161T90Very high89.5Confident89 Ų8975.8 Ų75.855%0.54639%0.391SS..Hα-helixtrans-95.8-40.8-175.6-47.70000113.1I124 K157 I159I124-T161 HydrophobicContact CD1-CG2 4.17Å; K157-T161 VanDerWaalsContact O-CB 3.3Å; K157-T161 WeakPolarHBondContact O-CB 3.48Å; K157-T161 PolarHBondContact O-N 3.03Å; K157-T161 PolarHBondContact O-OG1 3.33Å; I159-T161 PolarHBondContact O-N 3.16Å
162L89.9Confident89.6Confident12 Ų1272.2 Ų72.26%0.06337%0.372CS..Hα-helixtrans-98.8-16.2-172.1-57.5173.8000113.2F121 I124 A158 G164 L165 I172 V174F121-L162 HydrophobicContact CD1-CD1 3.65Å; F121-L162 HydrophobicContact CD2-CD1 4.16Å; F121-L162 HydrophobicContact CE1-CD1 3.62Å; F121-L162 HydrophobicContact CE2-CD1 4.14Å; F121-L162 HydrophobicContact CG-CD1 3.92Å; F121-L162 HydrophobicContact CZ-CB 4.44Å; F121-L162 HydrophobicContact CZ-CD1 3.86Å; I124-L162 HydrophobicContact CG1-CD1 3.94Å; I124-L162 HydrophobicContact CG1-CG 4.29Å; A158-L162 HydrophobicContact CB-CD1 4.34Å; A158-L162 WeakPolarHBondContact O-CA 3.48Å; A158-L162 WeakPolarHBondContact O-CB 3.37Å; A158-L162 PolarHBondContact O-N 3.47Å; L162-G164 PolarHBondContact O-N 2.79Å; L162-L165 HydrophobicContact CD2-CD1 3.97Å; L162-L165 VanDerWaalsContact O-CB 3.24Å; L162-L165 WeakPolarHBondContact O-CB 3.44Å; L162-L165 PolarHBondContact O-N 3.03Å; L162-L165 VanDerWaalsContact O-N 3.17Å; L162-I172 WeakPolarHBondContact O-CD1 3.17Å; L162-V174 HydrophobicContact CB-CG2 4.14Å
163N91.6Very high89.5Confident79 Ų7974 Ų7442%0.42237%0.374SS..THydrogen-bonded Turntrans-66.1125.6174.6-175.838.3000110.6I159 K173 V174I159-N163 HydrophobicContact CG2-CB 4.4Å; I159-N163 WeakPolarHBondContact O-CB 3.17Å; I159-N163 PolarHBondContact O-N 3.36Å; N163-K173 WeakPolarHBondContact OD1-CA 3.48Å; N163-V174 HydrophobicContact CB-CB 4.13Å; N163-V174 PolarHBondContact OD1-N 2.96Å; N163-V174 VanDerWaalsContact OD1-N 3.09Å; N163-V174 PolarHBondContact OD1-O 3.06Å
164G87.9Confident89.5Confident45 Ų4566.7 Ų66.746%0.46434%0.342SS..THydrogen-bonded Turntrans87.74.8-176.100000114.2L162 R166 T171 I172L162-G164 PolarHBondContact O-N 2.79Å; G164-R166 PolarHBondContact O-N 3.49Å; G164-T171 VanDerWaalsContact C-CG2 3.45Å; G164-T171 WeakPolarHBondContact O-CG2 3.37Å; G164-I172 WeakPolarHBondContact CA-O 3.45Å; G164-I172 PolarHBondContact N-O 3.37Å
165L88.1Confident89.4Confident58 Ų5867.4 Ų67.430%0.30435%0.349SS..  trans-69132.1178.1-169.7141.4000110.7L162 L167 T171 I172L162-L165 HydrophobicContact CD2-CD1 3.97Å; L162-L165 VanDerWaalsContact O-CB 3.24Å; L162-L165 WeakPolarHBondContact O-CB 3.44Å; L162-L165 PolarHBondContact O-N 3.03Å; L162-L165 VanDerWaalsContact O-N 3.17Å; L165-L167 HydrophobicContact CD2-CD1 4.48Å; L165-L167 HydrophobicContact CD2-CD2 3.26Å; L165-L167 HydrophobicContact CD2-CG 3.62Å; L165-L167 PolarHBondContact O-N 3.37Å; L165-T171 WeakPolarHBondContact O-CA 3.46Å; L165-I172 HydrophobicContact CB-CD1 4.11Å; L165-I172 HydrophobicContact CB-CG1 3.9Å; L165-I172 VanDerWaalsContact O-CG1 3.32Å; L165-I172 WeakPolarHBondContact O-CG1 3.45Å; L165-I172 PolarHBondContact O-N 3.33Å
166R88.2Confident89.3Confident197 Ų19771.6 Ų71.674%0.74337%0.366SS*.EExtended strand (participates in β ladder)trans-89.1109.3-178.4-159.8167.594.9-167.77.1110.8G164 K170G164-R166 PolarHBondContact O-N 3.49Å; R166-K170 CarbonylContact C-O 3.5Å
167L86Confident88.9Confident29 Ų2966.9 Ų66.915%0.15235%0.345CS..EExtended strand (participates in β ladder)trans-103.6110173.3-64.6-176.5000109.9L108 P109 M112 L120 L165 T169 K170 I172L108-L167 HydrophobicContact CD2-CD1 4.44Å; P109-L167 HydrophobicContact CG-CB 4.19Å; M112-L167 HydrophobicContact CE-CD1 3.9Å; M112-L167 HydrophobicContact SD-CD1 3.58Å; M112-L167 VanDerWaalsContact SD-CD1 3.58Å; L120-L167 HydrophobicContact CD1-CD1 4.4Å; L165-L167 HydrophobicContact CD2-CD1 4.48Å; L165-L167 HydrophobicContact CD2-CD2 3.26Å; L165-L167 HydrophobicContact CD2-CG 3.62Å; L165-L167 PolarHBondContact O-N 3.37Å; L167-T169 PolarHBondContact O-N 3.29Å; L167-K170 CarbonylContact C-O 3.59Å; L167-K170 PolarHBondContact N-O 2.78Å; L167-K170 PolarHBondContact O-N 3.33Å; L167-I172 HydrophobicContact CB-CG2 4.35Å; L167-I172 HydrophobicContact CD1-CD1 4.36Å; L167-I172 HydrophobicContact CD1-CG2 3.61Å; L167-I172 HydrophobicContact CG-CG2 4.01Å
168Q81.9Confident88.1Confident120 Ų12066.1 Ų66.156%0.56134%0.339SS*.THydrogen-bonded Turntrans57-106.9-179.7-56.2172.30.900112N111N111-Q168 VanDerWaalsContact ND2-CD 3.34Å; N111-Q168 PolarHBondContact ND2-NE2 3.49Å; N111-Q168 PolarHBondContact ND2-OE1 2.92Å; N111-Q168 PolarHBondContact OD1-NE2 3.28Å; N111-Q168 PolarHBondContact OD1-OE1 3.31Å; N111-Q168 VanDerWaalsContact OD1-OE1 3.08Å
169T83.8Confident86.9Confident132 Ų13270.2 Ų70.281%0.8137%0.366SS*.THydrogen-bonded Turntrans-102.1-0.1-179.455.80000113.3L167L167-T169 PolarHBondContact O-N 3.29Å
170K86Confident85.3Confident72 Ų7273 Ų7331%0.31339%0.387SS..EExtended strand (participates in β ladder)trans-124148.5-177.2-61.5-171.5-174.8179.90111.6Y107 L108 R166 L167Y107-K170 VanDerWaalsContact O-CB 3.28Å; Y107-K170 WeakPolarHBondContact O-CB 3.29Å; Y107-K170 VanDerWaalsContact O-CD 3.29Å; Y107-K170 WeakPolarHBondContact O-CD 3.28Å; L108-K170 PolarHBondContact O-NZ 3.49Å; L108-K170 VanDerWaalsContact O-NZ 3.09Å; R166-K170 CarbonylContact C-O 3.5Å; L167-K170 CarbonylContact C-O 3.59Å; L167-K170 PolarHBondContact N-O 2.78Å; L167-K170 PolarHBondContact O-N 3.33Å
171T88.9Confident83.7Confident73 Ų7369 Ų6945%0.44837%0.369SS..EExtended strand (participates in β ladder)trans-101.5118.1171.3-52.40000108Y107 G164 L165Y107-T171 WeakPolarHBondContact CB-O 3.38Å; G164-T171 VanDerWaalsContact C-CG2 3.45Å; G164-T171 WeakPolarHBondContact O-CG2 3.37Å; L165-T171 WeakPolarHBondContact O-CA 3.46Å
172I91.3Very high82Confident6 Ų668.9 Ų68.93%0.03138%0.377CS..  trans-73.1143.4-178.763.2164.7000110.4V105 N106 L108 L162 G164 L165 L167 V174V105-I172 HydrophobicContact CG1-CB 4.27Å; V105-I172 HydrophobicContact CG1-CD1 4.31Å; N106-I172 WeakPolarHBondContact O-CA 3.16Å; L108-I172 HydrophobicContact CD2-CG2 3.85Å; L162-I172 WeakPolarHBondContact O-CD1 3.17Å; G164-I172 WeakPolarHBondContact CA-O 3.45Å; G164-I172 PolarHBondContact N-O 3.37Å; L165-I172 HydrophobicContact CB-CD1 4.11Å; L165-I172 HydrophobicContact CB-CG1 3.9Å; L165-I172 VanDerWaalsContact O-CG1 3.32Å; L165-I172 WeakPolarHBondContact O-CG1 3.45Å; L165-I172 PolarHBondContact O-N 3.33Å; L167-I172 HydrophobicContact CB-CG2 4.35Å; L167-I172 HydrophobicContact CD1-CD1 4.36Å; L167-I172 HydrophobicContact CD1-CG2 3.61Å; L167-I172 HydrophobicContact CG-CG2 4.01Å; I172-V174 HydrophobicContact CD1-CG2 4.13Å
173K90.1Very high80.4Confident94 Ų9471.2 Ų71.241%0.40939%0.394SS..EExtended strand (participates in β ladder)trans-115.2117.7173.7-179.1173177.4171.70108.8V105 N106 Y107 N163V105-K173 WeakPolarHBondContact CA-O 3.33Å; N106-K173 HydrophobicContact CB-CB 4.37Å; N106-K173 PolarHBondContact N-O 3.39Å; N106-K173 PolarHBondContact O-N 2.94Å; Y107-K173 HydrophobicContact CD2-CB 3.85Å; Y107-K173 HydrophobicContact CE2-CB 4.15Å; Y107-K173 HydrophobicContact CE2-CD 4.43Å; N163-K173 WeakPolarHBondContact OD1-CA 3.48Å
174V91.6Very high79Confident2 Ų268.6 Ų68.61%0.01238%0.38CS..EExtended strand (participates in β ladder)trans-105.7131178.7-1700000108L103 V105 F121 I159 L162 N163 I172L103-V174 HydrophobicContact CB-CG1 4.42Å; L103-V174 HydrophobicContact CD1-CG1 3.93Å; V105-V174 HydrophobicContact CG1-CG2 4.26Å; V105-V174 HydrophobicContact CG2-CG1 4.49Å; V105-V174 HydrophobicContact CG2-CG2 4.5Å; F121-V174 HydrophobicContact CE1-CG1 3.94Å; F121-V174 HydrophobicContact CE1-CG2 4.17Å; F121-V174 HydrophobicContact CZ-CG1 4.31Å; F121-V174 HydrophobicContact CZ-CG2 3.78Å; I159-V174 HydrophobicContact CG1-CG1 3.9Å; L162-V174 HydrophobicContact CB-CG2 4.14Å; N163-V174 HydrophobicContact CB-CB 4.13Å; N163-V174 PolarHBondContact OD1-N 2.96Å; N163-V174 VanDerWaalsContact OD1-N 3.09Å; N163-V174 PolarHBondContact OD1-O 3.06Å; I172-V174 HydrophobicContact CD1-CG2 4.13Å
175S89.4Confident77.7Confident38 Ų3873.4 Ų73.427%0.26638%0.384SS..EExtended strand (participates in β ladder)trans-150.6159.7177.750.10000109.7L103 I104 A177L103-S175 WeakPolarHBondContact CA-O 3.11Å; I104-S175 WeakPolarHBondContact CG2-O 3.43Å; I104-S175 VanDerWaalsContact CG2-OG 3.3Å; I104-S175 WeakPolarHBondContact CG2-OG 3.29Å; I104-S175 PolarHBondContact N-O 2.77Å; I104-S175 PolarHBondContact O-N 2.84Å; S175-A177 PolarHBondContact O-N 2.76Å
176Y89.9Confident76.7Confident89 Ų8973.2 Ų73.235%0.34938%0.384SS..EExtended strand (participates in β ladder)trans-54.3127.6171.8-65-72.1000110.7K100 N102 L103 E156 I159K100-Y176 HydrophobicContact CB-CE1 4.35Å; K100-Y176 WeakPolarHBondContact O-CE1 3.37Å; N102-Y176 CarbonylContact O-C 3.46Å; L103-Y176 HydrophobicContact CD2-CD1 3.72Å; L103-Y176 HydrophobicContact CD2-CE1 4.07Å; L103-Y176 HydrophobicContact CD2-CG 4.44Å; E156-Y176 WeakPolarHBondContact CB-OH 3.47Å; I159-Y176 HydrophobicContact CD1-CD1 3.74Å; I159-Y176 HydrophobicContact CD1-CD2 3.67Å; I159-Y176 HydrophobicContact CD1-CE1 3.46Å; I159-Y176 VanDerWaalsContact CD1-CE1 3.46Å; I159-Y176 HydrophobicContact CD1-CE2 3.41Å; I159-Y176 VanDerWaalsContact CD1-CE2 3.41Å; I159-Y176 HydrophobicContact CD1-CG 3.84Å
177A82.8Confident76.4Confident8 Ų863.9 Ų63.97%0.06635%0.348CS..PPolyproline II helixtrans-71.8137.8173.300000108.6N102 L103 I104 F146 S175N102-A177 HydrophobicContact CB-CB 3.96Å; N102-A177 PolarHBondContact O-N 2.95Å; L103-A177 VanDerWaalsContact C-CB 3.46Å; I104-A177 HydrophobicContact CB-CB 4Å; I104-A177 HydrophobicContact CG2-CB 4.44Å; F146-A177 HydrophobicContact CD1-CB 3.91Å; F146-A177 HydrophobicContact CE1-CB 4.19Å; S175-A177 PolarHBondContact O-N 2.76Å
178R75.6Confident76.5Confident95 Ų9564 Ų6436%0.35835%0.349SS..PPolyproline II helixtrans-92.7142.8171.9-80.7-178.2170.2-176.4-5.8110.8S180 D236R178-S180 PolarHBondContact O-N 2.69Å; R178-D236 VanDerWaalsContact CZ-CG 3.41Å; R178-D236 IonicContact CZ-OD1 2.83Å; R178-D236 IonicContact CZ-OD2 3.54Å; R178-D236 VanDerWaalsContact CZ-OD2 3.24Å; R178-D236 IonicContact NH1-OD1 2.75Å; R178-D236 PolarHBondContact NH1-OD1 3.13Å; R178-D236 IonicContact NH1-OD2 3.25Å; R178-D236 PolarHBondContact NH1-OD2 3.3Å; R178-D236 VanDerWaalsContact NH1-OD2 3.17Å; R178-D236 VanDerWaalsContact NH2-CG 3.32Å; R178-D236 IonicContact NH2-OD1 3.86Å; R178-D236 IonicContact NH2-OD2 2.58Å; R178-D236 PolarHBondContact NH2-OD2 2.84Å
179P67.3Low76.9Confident87 Ų8758.2 Ų58.257%0.56532%0.322SS*.PPolyproline II helixtrans-54.9126.5168.323-31.1000108.2S181 I184P179-S181 PolarHBondContact O-N 3.17Å; P179-I184 WeakPolarHBondContact O-CD1 3.27Å
180S59.3Low77.2Confident78 Ų7855.8 Ų55.855%0.54530%0.299SS..  trans-72.878-179.9164.60000109.6R178 R185R178-S180 PolarHBondContact O-N 2.69Å; S180-R185 PolarHBondContact OG-NE 3.06Å; S180-R185 PolarHBondContact OG-NH2 2.82Å
181S58.2Low77.3Confident47 Ų4752.4 Ų52.433%0.32928%0.284SS..  trans-76.5145.5166.657.30000110.2P179 S183 I184P179-S181 PolarHBondContact O-N 3.17Å; S181-S183 PolarHBondContact O-N 2.58Å; S181-S183 VanDerWaalsContact O-N 3.09Å; S181-S183 PolarHBondContact OG-OG 2.85Å; S181-S183 VanDerWaalsContact OG-OG 3.07Å; S181-I184 PolarHBondContact O-N 2.83Å; S181-I184 WeakPolarHBondContact OG-CD1 3.06Å; S181-I184 WeakPolarHBondContact OG-CG1 3.26Å
182A54.7Low77.3Confident86 Ų8650.1 Ų50.171%0.71127%0.271SS*.G310 helixtrans-56.4-25.4178.600000112.3I184A182-I184 VanDerWaalsContact C-N 3.27Å; A182-I184 PolarHBondContact O-N 3.18Å
183S55.7Low76.9Confident60 Ų6050.5 Ų50.542%0.4228%0.276SS..G310 helixtrans-71-10.7175.946.80000115.1S181 R238S181-S183 PolarHBondContact O-N 2.58Å; S181-S183 VanDerWaalsContact O-N 3.09Å; S181-S183 PolarHBondContact OG-OG 2.85Å; S181-S183 VanDerWaalsContact OG-OG 3.07Å; S183-R238 VanDerWaalsContact O-CB 3.25Å; S183-R238 WeakPolarHBondContact O-CB 3.31Å; S183-R238 PolarHBondContact O-N 2.83Å; S183-R238 VanDerWaalsContact O-N 3.09Å
184I62.2Low76.7Confident25 Ų2546.4 Ų46.413%0.12826%0.259CS..G310 helixtrans-101.1-13-179-59.4169000112.1P179 S181 A182 D186P179-I184 WeakPolarHBondContact O-CD1 3.27Å; S181-I184 PolarHBondContact O-N 2.83Å; S181-I184 WeakPolarHBondContact OG-CD1 3.06Å; S181-I184 WeakPolarHBondContact OG-CG1 3.26Å; A182-I184 VanDerWaalsContact C-N 3.27Å; A182-I184 PolarHBondContact O-N 3.18Å; I184-D186 PolarHBondContact O-N 3.09Å
185R61.5Low76.2Confident145 Ų14547 Ų4755%0.54726%0.263SS..THydrogen-bonded Turntrans-77.7-19.9-173-66.9-171.6179.7-168.22.8114.6S180S180-R185 PolarHBondContact OG-NE 3.06Å; S180-R185 PolarHBondContact OG-NH2 2.82Å
186D67.4Low75.8Confident55 Ų5552.8 Ų52.829%0.29428%0.283SS..THydrogen-bonded Turntrans-125.124.6-175.4-58.1-30.2000113.1I184 N188 R238 F264 Q270I184-D186 PolarHBondContact O-N 3.09Å; D186-N188 VanDerWaalsContact C-N 3.26Å; D186-N188 PolarHBondContact O-N 2.81Å; D186-R238 IonicContact OD2-CZ 3.24Å; D186-R238 IonicContact OD2-NH1 2.69Å; D186-R238 PolarHBondContact OD2-NH1 2.77Å; D186-F264 VanDerWaalsContact O-CD1 3.24Å; D186-F264 WeakPolarHBondContact O-CD1 3.19Å; D186-F264 WeakPolarHBondContact O-CE1 3.33Å; D186-Q270 PolarHBondContact OD1-NE2 2.96Å; D186-Q270 VanDerWaalsContact OD1-NE2 3.11Å
187A81.1Confident75.5Confident0 Ų054.1 Ų54.10%030%0.301CS..  trans-88.814.8178.500000113.6F235 A241A187-F235 HydrophobicContact CB-CB 4.25Å; A187-F235 WeakPolarHBondContact CB-O 3.44Å; A187-F235 PolarHBondContact O-N 3.36Å; A187-A241 HydrophobicContact CB-CB 4.45Å
188N87.9Confident75.5Confident31 Ų3155 Ų5517%0.16630%0.304CS..EExtended strand (participates in β ladder)trans-88126.6177.6-64.2-16.3000109.3D186 I233 R234 A265D186-N188 VanDerWaalsContact C-N 3.26Å; D186-N188 PolarHBondContact O-N 2.81Å; N188-I233 CarbonylContact C-O 3.6Å; N188-R234 WeakPolarHBondContact OD1-CB 3.3Å; N188-R234 WeakPolarHBondContact OD1-CD 3.41Å; N188-R234 WeakPolarHBondContact OD1-CG 3.41Å; N188-R234 PolarHBondContact OD1-NE 3.44Å; N188-A265 HydrophobicContact CB-CB 3.88Å; N188-A265 PolarHBondContact O-N 2.81Å
189L89.4Confident76Confident0 Ų053.8 Ų53.80%031%0.307CS..EExtended strand (participates in β ladder)trans-109.4140.6176.4-58.1-170.7000110.8F207 F232 I233 F235 A241 A244 I245 V262 K263 F264L189-F207 HydrophobicContact CD1-CE1 4.45Å; L189-F232 WeakPolarHBondContact O-CA 3.49Å; L189-I233 HydrophobicContact CB-CB 4.48Å; L189-I233 PolarHBondContact N-O 3.33Å; L189-I233 PolarHBondContact O-N 2.88Å; L189-F235 HydrophobicContact CD1-CD2 3.76Å; L189-F235 HydrophobicContact CD1-CE2 3.48Å; L189-F235 VanDerWaalsContact CD1-CE2 3.48Å; L189-F235 HydrophobicContact CG-CD2 4.13Å; L189-F235 HydrophobicContact CG-CE2 4.29Å; L189-A241 HydrophobicContact CD1-CB 4.19Å; L189-A241 HydrophobicContact CD2-CB 3.87Å; L189-A241 HydrophobicContact CG-CB 4.06Å; L189-A244 HydrophobicContact CD1-CB 4.01Å; L189-I245 HydrophobicContact CD1-CG1 4.2Å; L189-I245 HydrophobicContact CD2-CD1 3.48Å; L189-I245 VanDerWaalsContact CD2-CD1 3.48Å; L189-I245 HydrophobicContact CD2-CG1 3.72Å; L189-V262 HydrophobicContact CB-CG1 4.24Å; L189-V262 HydrophobicContact CD1-CG1 3.71Å; L189-V262 HydrophobicContact CG-CG1 4.44Å; L189-K263 CarbonylContact C-O 3.56Å; L189-K263 VanDerWaalsContact CA-O 3.31Å; L189-K263 WeakPolarHBondContact CA-O 3.48Å; L189-F264 HydrophobicContact CD2-CD1 3.88Å; L189-F264 HydrophobicContact CD2-CE1 4.11Å
190Y90.1Very high77Confident81 Ų8154.3 Ų54.332%0.31830%0.302SS..EExtended strand (participates in β ladder)trans-101.1125.3167.1175.4-93000107.9V230 F232 V262 K263Y190-V230 HydrophobicContact CD2-CG1 4.05Å; Y190-V230 HydrophobicContact CE2-CG1 3.25Å; Y190-V230 WeakPolarHBondContact OH-CG2 3.34Å; Y190-F232 HydrophobicContact CD2-CD1 4.39Å; Y190-F232 AromaticContact CD2-CE1 3.68Å; Y190-F232 HydrophobicContact CD2-CE1 3.68Å; Y190-F232 HydrophobicContact CD2-CE2 4.43Å; Y190-F232 AromaticContact CD2-CZ 3.71Å; Y190-F232 HydrophobicContact CD2-CZ 3.71Å; Y190-F232 HydrophobicContact CE2-CZ 4.12Å; Y190-V262 WeakPolarHBondContact O-CA 3.24Å; Y190-K263 PolarHBondContact N-O 3.08Å; Y190-K263 PolarHBondContact O-N 3.11Å
191V89.5Confident78.4Confident0 Ų058.3 Ų58.30%031%0.309CS..EExtended strand (participates in β ladder)trans-118.1120.9-179.2-171.30000107.7L194 L203 F207 V230 G231 I233 I260 T261 V262V191-L194 HydrophobicContact CB-CD1 4.32Å; V191-L194 HydrophobicContact CG1-CD1 3.97Å; V191-L194 HydrophobicContact CG1-CD2 3.76Å; V191-L194 HydrophobicContact CG1-CG 3.86Å; V191-L203 HydrophobicContact CG1-CD1 4.42Å; V191-F207 HydrophobicContact CB-CZ 4.45Å; V191-F207 HydrophobicContact CG1-CE2 4.21Å; V191-F207 HydrophobicContact CG1-CZ 3.89Å; V191-F207 HydrophobicContact CG2-CE1 4.05Å; V191-F207 HydrophobicContact CG2-CE2 4.28Å; V191-F207 HydrophobicContact CG2-CZ 3.62Å; V191-V230 CarbonylContact O-C 3.56Å; V191-V230 VanDerWaalsContact O-CA 3.29Å; V191-V230 WeakPolarHBondContact O-CA 3.45Å; V191-G231 PolarHBondContact N-O 3.45Å; V191-G231 PolarHBondContact O-N 2.97Å; V191-I233 HydrophobicContact CG2-CD1 3.88Å; V191-I233 HydrophobicContact CG2-CG1 4.17Å; V191-I260 HydrophobicContact CG1-CG2 3.48Å; V191-I260 VanDerWaalsContact CG1-CG2 3.48Å; V191-T261 CarbonylContact C-O 3.59Å; V191-T261 WeakPolarHBondContact CA-O 3.45Å; V191-V262 HydrophobicContact CG1-CG2 4.39Å; V191-V262 HydrophobicContact CG2-CG1 4.37Å
192S88.4Confident79.8Confident26 Ų2660.3 Ų60.318%0.18231%0.314CS..EExtended strand (participates in β ladder)trans-124.9162.5174.758.40000111.7G229 I260 T261S192-G229 CarbonylContact C-O 3.27Å; S192-G229 WeakPolarHBondContact CA-O 3.5Å; S192-I260 CarbonylContact O-C 3.45Å; S192-I260 WeakPolarHBondContact O-CA 3.38Å; S192-T261 PolarHBondContact N-O 3.36Å; S192-T261 PolarHBondContact O-N 2.98Å; S192-T261 WeakPolarHBondContact OG-CB 3.49Å
193G82.9Confident81.4Confident13 Ų1356.2 Ų56.213%0.13428%0.28CS..  trans79.922.2-174.700000112.6G229G193-G229 PolarHBondContact N-O 2.9Å
194L85.1Confident83Confident8 Ų857.4 Ų57.44%0.04228%0.279CS..  trans-74.3141.1173.2-65172.2000110.2V191 L203 G229 I260V191-L194 HydrophobicContact CB-CD1 4.32Å; V191-L194 HydrophobicContact CG1-CD1 3.97Å; V191-L194 HydrophobicContact CG1-CD2 3.76Å; V191-L194 HydrophobicContact CG1-CG 3.86Å; L194-L203 HydrophobicContact CD1-CD1 3.77Å; L194-L203 HydrophobicContact CD1-CD2 4.09Å; L194-L203 HydrophobicContact CD2-CD1 3.73Å; L194-L203 HydrophobicContact CG-CD1 4.43Å; L194-G229 PolarHBondContact N-O 3.1Å; L194-G229 WeakPolarHBondContact O-CA 3.37Å; L194-I260 HydrophobicContact CD2-CD1 3.95Å; L194-I260 HydrophobicContact CD2-CG1 4.09Å
195P82Confident84.2Confident16 Ų1662.8 Ų62.810%0.10430%0.303CS..  trans-64.1148.3176.115.2-15.5000110.9T197 M198 A256P195-T197 PolarHBondContact O-N 3.36Å; P195-M198 HydrophobicContact CG-CB 3.92Å; P195-M198 HydrophobicContact CG-SD 4.31Å; P195-M198 WeakPolarHBondContact O-CB 3.5Å; P195-M198 PolarHBondContact O-N 2.69Å; P195-A256 HydrophobicContact CB-CB 4.26Å; P195-A256 HydrophobicContact CG-CB 4.1Å
196K81.7Confident85.4Confident158 Ų15858.5 Ų58.569%0.68729%0.291SS*.THydrogen-bonded Turntrans-63.1-25.4-178.5-65.9-178.4179-178.70112.9M198 V226 S227K196-M198 VanDerWaalsContact C-N 3.35Å; K196-V226 HydrophobicContact CB-CG1 4.48Å; K196-V226 HydrophobicContact CD-CG1 3.96Å; K196-V226 HydrophobicContact CG-CG1 4.37Å; K196-S227 WeakPolarHBondContact O-CB 3.16Å; K196-S227 PolarHBondContact O-OG 3.33Å
197T82.1Confident86.3Confident118 Ų11855.9 Ų55.972%0.72428%0.277SS*.THydrogen-bonded Turntrans-80.6-13.1175.752.60000113.3P195 T199P195-T197 PolarHBondContact O-N 3.36Å; T197-T199 PolarHBondContact O-N 3.48Å
198M83.1Confident86.7Confident27 Ų2758.9 Ų58.913%0.13330%0.298CS..  trans-66125.6-177.1-16375175.200110.9P195 K196 E202 I218P195-M198 HydrophobicContact CG-CB 3.92Å; P195-M198 HydrophobicContact CG-SD 4.31Å; P195-M198 WeakPolarHBondContact O-CB 3.5Å; P195-M198 PolarHBondContact O-N 2.69Å; K196-M198 VanDerWaalsContact C-N 3.35Å; M198-E202 VanDerWaalsContact CE-C 3.45Å; M198-E202 HydrophobicContact CE-CB 3.49Å; M198-E202 VanDerWaalsContact CE-CB 3.49Å; M198-E202 HydrophobicContact CG-CB 4.46Å; M198-E202 HydrophobicContact SD-CB 3.86Å; M198-I218 WeakPolarHBondContact O-CD1 3.31Å
199T87.5Confident86.7Confident68 Ų6863.5 Ų63.542%0.41732%0.319SS..  trans-91.6159.7176.765.10000111.6T197 K201 E202 L203 I218T197-T199 PolarHBondContact O-N 3.48Å; T199-K201 PolarHBondContact O-N 3.1Å; T199-E202 PolarHBondContact N-OE2 3.33Å; T199-E202 PolarHBondContact O-N 2.96Å; T199-E202 VanDerWaalsContact OG1-CD 3.23Å; T199-E202 VanDerWaalsContact OG1-CG 3.26Å; T199-E202 WeakPolarHBondContact OG1-CG 3.5Å; T199-E202 PolarHBondContact OG1-N 3.06Å; T199-E202 PolarHBondContact OG1-OE2 2.79Å; T199-L203 PolarHBondContact O-N 2.97Å; T199-I218 VanDerWaalsContact C-CD1 3.42Å
200Q87.2Confident86.5Confident98 Ų9865.8 Ų65.846%0.45833%0.327SS..Hα-helixtrans-58.2-37.3176.7-179.8-177.5-9.100112L203 E204 S216 I218Q200-L203 WeakPolarHBondContact O-CB 3.43Å; Q200-L203 PolarHBondContact O-N 2.84Å; Q200-E204 WeakPolarHBondContact O-CB 3.43Å; Q200-E204 PolarHBondContact O-N 3.46Å; Q200-S216 WeakPolarHBondContact CG-OG 3.47Å; Q200-S216 PolarHBondContact NE2-O 3.35Å; Q200-S216 PolarHBondContact NE2-OG 3.32Å; Q200-I218 HydrophobicContact CB-CD1 4.44Å
201K88.1Confident86.3Confident162 Ų16262.6 Ų62.670%0.70432%0.32SS*.Hα-helixtrans-66.9-43.2179.8-172.8-179.3178.2-1760111.8T199 L203 E204 Q205T199-K201 PolarHBondContact O-N 3.1Å; K201-L203 VanDerWaalsContact C-N 3.31Å; K201-L203 PolarHBondContact O-N 2.95Å; K201-E204 PolarHBondContact O-N 3.19Å; K201-Q205 WeakPolarHBondContact O-CB 3.24Å; K201-Q205 PolarHBondContact O-N 3.37Å
202E87.8Confident86.2Confident89 Ų8970.7 Ų70.742%0.41635%0.35SS..Hα-helixtrans-64.2-39.4175.5-69.1162.8158.200111.1M198 T199 E204 Q205 L206M198-E202 VanDerWaalsContact CE-C 3.45Å; M198-E202 HydrophobicContact CE-CB 3.49Å; M198-E202 VanDerWaalsContact CE-CB 3.49Å; M198-E202 HydrophobicContact CG-CB 4.46Å; M198-E202 HydrophobicContact SD-CB 3.86Å; T199-E202 PolarHBondContact N-OE2 3.33Å; T199-E202 PolarHBondContact O-N 2.96Å; T199-E202 VanDerWaalsContact OG1-CD 3.23Å; T199-E202 VanDerWaalsContact OG1-CG 3.26Å; T199-E202 WeakPolarHBondContact OG1-CG 3.5Å; T199-E202 PolarHBondContact OG1-N 3.06Å; T199-E202 PolarHBondContact OG1-OE2 2.79Å; E202-E204 VanDerWaalsContact C-N 3.32Å; E202-E204 PolarHBondContact O-N 3.19Å; E202-Q205 PolarHBondContact O-N 2.83Å; E202-L206 WeakPolarHBondContact O-CB 3.1Å; E202-L206 PolarHBondContact O-N 2.84Å
203L87.8Confident86.3Confident0 Ų070.7 Ų70.70%035%0.348CS..Hα-helixtrans-62.3-44.1176.4-178.668.3000110.7V191 L194 T199 Q200 K201 L206 F207 I218 I233V191-L203 HydrophobicContact CG1-CD1 4.42Å; L194-L203 HydrophobicContact CD1-CD1 3.77Å; L194-L203 HydrophobicContact CD1-CD2 4.09Å; L194-L203 HydrophobicContact CD2-CD1 3.73Å; L194-L203 HydrophobicContact CG-CD1 4.43Å; T199-L203 PolarHBondContact O-N 2.97Å; Q200-L203 WeakPolarHBondContact O-CB 3.43Å; Q200-L203 PolarHBondContact O-N 2.84Å; K201-L203 VanDerWaalsContact C-N 3.31Å; K201-L203 PolarHBondContact O-N 2.95Å; L203-L206 PolarHBondContact O-N 2.7Å; L203-F207 HydrophobicContact CD1-CD2 3.79Å; L203-F207 HydrophobicContact CD1-CE2 3.56Å; L203-F207 HydrophobicContact CG-CD2 4.39Å; L203-F207 VanDerWaalsContact O-CD2 3.31Å; L203-F207 WeakPolarHBondContact O-CD2 3.47Å; L203-F207 PolarHBondContact O-N 3.47Å; L203-I218 HydrophobicContact CB-CD1 4.35Å; L203-I218 HydrophobicContact CD2-CD1 4.27Å; L203-I218 HydrophobicContact CD2-CG1 3.82Å; L203-I233 HydrophobicContact CD1-CD1 3.89Å; L203-I233 HydrophobicContact CD2-CD1 4Å; L203-I233 HydrophobicContact CD2-CG1 4Å; L203-I233 HydrophobicContact CG-CD1 3.72Å; L203-I233 HydrophobicContact CG-CG1 4.24Å
204E89.6Confident86.3Confident86 Ų8673.4 Ų73.440%0.40236%0.358SS..Hα-helixtrans-61.9-45176.5-168.2168.9136.700111.5Q200 K201 E202 L206 F207 S208 I213 S216Q200-E204 WeakPolarHBondContact O-CB 3.43Å; Q200-E204 PolarHBondContact O-N 3.46Å; K201-E204 PolarHBondContact O-N 3.19Å; E202-E204 VanDerWaalsContact C-N 3.32Å; E202-E204 PolarHBondContact O-N 3.19Å; E204-L206 PolarHBondContact O-N 3.4Å; E204-F207 PolarHBondContact O-N 2.8Å; E204-S208 WeakPolarHBondContact O-CA 3.19Å; E204-S208 WeakPolarHBondContact O-CB 3.38Å; E204-S208 PolarHBondContact O-N 3.48Å; E204-S208 PolarHBondContact O-OG 3.4Å; E204-I213 HydrophobicContact CB-CD1 4.34Å; E204-I213 HydrophobicContact CG-CB 4.45Å; E204-I213 HydrophobicContact CG-CD1 3.76Å; E204-I213 HydrophobicContact CG-CG2 4.46Å; E204-I213 WeakPolarHBondContact O-CD1 3.39Å; E204-S216 PolarHBondContact OE2-OG 3.37Å
205Q88.1Confident86.3Confident138 Ų13876.3 Ų76.365%0.64538%0.377SS*.Hα-helixtrans-64.6-37.2179.4-171.7175.1-27.600113K201 E202 S208K201-Q205 WeakPolarHBondContact O-CB 3.24Å; K201-Q205 PolarHBondContact O-N 3.37Å; E202-Q205 PolarHBondContact O-N 2.83Å; Q205-S208 PolarHBondContact O-OG 3.21Å
206L86.1Confident86.6Confident55 Ų5576.1 Ų76.129%0.28838%0.376SS..Hα-helixtrans-66.1-42.3177.1-174.570.7000111.5E202 L203 E204 Q209 L248 I260E202-L206 WeakPolarHBondContact O-CB 3.1Å; E202-L206 PolarHBondContact O-N 2.84Å; L203-L206 PolarHBondContact O-N 2.7Å; E204-L206 PolarHBondContact O-N 3.4Å; L206-Q209 WeakPolarHBondContact O-CG 3.07Å; L206-L248 HydrophobicContact CD1-CD2 4.44Å; L206-L248 HydrophobicContact CD2-CD2 4.48Å; L206-L248 HydrophobicContact CG-CD1 4.46Å; L206-L248 HydrophobicContact CG-CD2 4.25Å; L206-I260 HydrophobicContact CD2-CD1 4.08Å
207F87.1Confident86.9Confident0 Ų076.5 Ų76.50%037%0.373CS..Hα-helixtrans-87.2-19.7-176.3-80.7-101.2000113.1L189 V191 L203 E204 Q209 Y210 I213 I233 F235 A244 L248 V262L189-F207 HydrophobicContact CD1-CE1 4.45Å; V191-F207 HydrophobicContact CB-CZ 4.45Å; V191-F207 HydrophobicContact CG1-CE2 4.21Å; V191-F207 HydrophobicContact CG1-CZ 3.89Å; V191-F207 HydrophobicContact CG2-CE1 4.05Å; V191-F207 HydrophobicContact CG2-CE2 4.28Å; V191-F207 HydrophobicContact CG2-CZ 3.62Å; L203-F207 HydrophobicContact CD1-CD2 3.79Å; L203-F207 HydrophobicContact CD1-CE2 3.56Å; L203-F207 HydrophobicContact CG-CD2 4.39Å; L203-F207 VanDerWaalsContact O-CD2 3.31Å; L203-F207 WeakPolarHBondContact O-CD2 3.47Å; L203-F207 PolarHBondContact O-N 3.47Å; E204-F207 PolarHBondContact O-N 2.8Å; F207-Q209 PolarHBondContact O-N 3.07Å; F207-Q209 VanDerWaalsContact O-N 3.16Å; F207-Y210 PolarHBondContact O-N 2.83Å; F207-Y210 VanDerWaalsContact O-N 3.1Å; F207-I213 HydrophobicContact CB-CD1 3.68Å; F207-I233 HydrophobicContact CB-CD1 3.74Å; F207-I233 HydrophobicContact CD1-CD1 3.5Å; F207-I233 VanDerWaalsContact CD1-CD1 3.5Å; F207-I233 HydrophobicContact CD2-CD1 3.31Å; F207-I233 HydrophobicContact CE1-CD1 3.82Å; F207-I233 HydrophobicContact CE2-CD1 3.65Å; F207-I233 HydrophobicContact CG-CD1 3.21Å; F207-I233 HydrophobicContact CZ-CD1 3.89Å; F207-F235 HydrophobicContact CB-CZ 3.92Å; F207-F235 HydrophobicContact CD1-CE2 4.01Å; F207-F235 AromaticContact CD1-CZ 3.97Å; F207-F235 HydrophobicContact CD1-CZ 3.97Å; F207-F235 HydrophobicContact CG-CZ 4.46Å; F207-F235 WeakPolarHBondContact O-CE1 3.29Å; F207-F235 WeakPolarHBondContact O-CZ 3.19Å; F207-A244 HydrophobicContact CD1-CB 4.22Å; F207-L248 HydrophobicContact CD1-CD1 3.44Å; F207-L248 VanDerWaalsContact CD1-CD1 3.44Å; F207-L248 HydrophobicContact CD2-CD1 3.82Å; F207-L248 HydrophobicContact CE1-CB 4.48Å; F207-L248 HydrophobicContact CE1-CD1 3.39Å; F207-L248 HydrophobicContact CE2-CD1 3.77Å; F207-L248 HydrophobicContact CG-CD1 3.68Å; F207-L248 HydrophobicContact CZ-CB 4.42Å; F207-L248 HydrophobicContact CZ-CD1 3.56Å; F207-V262 HydrophobicContact CE1-CG1 3.9Å; F207-V262 HydrophobicContact CE1-CG2 3.95Å; F207-V262 HydrophobicContact CZ-CG1 4.36Å; F207-V262 HydrophobicContact CZ-CG2 3.68Å
208S89.1Confident87.3Confident63 Ų6371.9 Ų71.944%0.44134%0.344SS..THydrogen-bonded Turntrans-65.5-18.7-178.663.50000113.2E204 Q205 Y210E204-S208 WeakPolarHBondContact O-CA 3.19Å; E204-S208 WeakPolarHBondContact O-CB 3.38Å; E204-S208 PolarHBondContact O-N 3.48Å; E204-S208 PolarHBondContact O-OG 3.4Å; Q205-S208 PolarHBondContact O-OG 3.21Å; S208-Y210 VanDerWaalsContact C-N 3.28Å; S208-Y210 PolarHBondContact O-N 3.49Å
209Q87.2Confident87.5Confident128 Ų12873.1 Ų73.160%0.59835%0.351SS*.THydrogen-bonded Turntrans-69.5-26.5175.977.895.890.400112.5L206 F207L206-Q209 WeakPolarHBondContact O-CG 3.07Å; F207-Q209 PolarHBondContact O-N 3.07Å; F207-Q209 VanDerWaalsContact O-N 3.16Å
210Y86.8Confident87.5Confident47 Ų4773.9 Ų73.918%0.18436%0.355CS..THydrogen-bonded Turntrans-89-16.5-178.8-63.1-85.2000112.9F207 S208 A244 L248F207-Y210 PolarHBondContact O-N 2.83Å; F207-Y210 VanDerWaalsContact O-N 3.1Å; S208-Y210 VanDerWaalsContact C-N 3.28Å; S208-Y210 PolarHBondContact O-N 3.49Å; Y210-A244 HydrophobicContact CD1-CB 4.37Å; Y210-A244 HydrophobicContact CD2-CB 4.24Å; Y210-A244 HydrophobicContact CG-CB 3.83Å; Y210-L248 HydrophobicContact CD2-CD1 3.63Å; Y210-L248 HydrophobicContact CD2-CG 4.01Å; Y210-L248 HydrophobicContact CE2-CD1 3.32Å; Y210-L248 HydrophobicContact CE2-CD2 3.57Å; Y210-L248 HydrophobicContact CE2-CG 3.25Å; Y210-L248 WeakPolarHBondContact OH-CD2 3.36Å
211G85.9Confident87.4Confident15 Ų1571.5 Ų71.516%0.15535%0.345CS..SBendtrans167.7-179-178.800000114.1I213G211-I213 PolarHBondContact O-N 3.11Å
212R86.8Confident86.9Confident169 Ų16973 Ų7364%0.63836%0.355SS*.  trans-82.7115.1-177.5-174.2-176.4-71-146.62.3109.8F235 D236 E240R212-F235 CarbonylContact O-C 3.58Å; R212-D236 HydrophobicContact CB-CB 4.02Å; R212-D236 WeakPolarHBondContact O-CB 3.32Å; R212-D236 PolarHBondContact O-N 3.06Å; R212-E240 PolarHBondContact N-OE2 3.48Å
213I89.6Confident86.7Confident27 Ų2775.2 Ų75.214%0.13837%0.374CS..EExtended strand (participates in β ladder)trans-81.2133.1177.3-60.4168.7000110E204 F207 G211 I233 F235E204-I213 HydrophobicContact CB-CD1 4.34Å; E204-I213 HydrophobicContact CG-CB 4.45Å; E204-I213 HydrophobicContact CG-CD1 3.76Å; E204-I213 HydrophobicContact CG-CG2 4.46Å; E204-I213 WeakPolarHBondContact O-CD1 3.39Å; F207-I213 HydrophobicContact CB-CD1 3.68Å; G211-I213 PolarHBondContact O-N 3.11Å; I213-I233 HydrophobicContact CD1-CG2 4.24Å; I213-I233 HydrophobicContact CG1-CG2 4.03Å; I213-I233 HydrophobicContact CG2-CG2 3.94Å; I213-F235 HydrophobicContact CG1-CD1 4.32Å; I213-F235 HydrophobicContact CG1-CE1 3.91Å; I213-F235 HydrophobicContact CG1-CZ 4.23Å
214I84.6Confident86.4Confident69 Ų6979.4 Ų79.435%0.35440%0.4SS..EExtended strand (participates in β ladder)trans-97.7-43.1178.3-54.5-54000111.2R234 D236I214-R234 HydrophobicContact CB-CB 4.5Å; I214-R234 HydrophobicContact CB-CG 4.24Å; I214-R234 PolarHBondContact N-O 2.92Å; I214-D236 HydrophobicContact CD1-CB 4.08Å; I214-D236 HydrophobicContact CG1-CB 4.32Å
215T84Confident85.9Confident69 Ų6977.9 Ų77.942%0.42341%0.407SS..EExtended strand (participates in β ladder)trans-145.2127173.559.20000109.7I233 R234T215-I233 CarbonylContact O-C 3.56Å; T215-I233 WeakPolarHBondContact O-CA 3.45Å; T215-R234 PolarHBondContact N-O 3.22Å; T215-R234 PolarHBondContact O-N 3.05Å; T215-R234 VanDerWaalsContact OG1-CB 3.24Å; T215-R234 WeakPolarHBondContact OG1-CB 3.03Å
216S88.6Confident85.6Confident12 Ų1274.4 Ų74.48%0.08440%0.395CS..EExtended strand (participates in β ladder)trans-103.7143.9164.6570000108.2Q200 E204 F232Q200-S216 WeakPolarHBondContact CG-OG 3.47Å; Q200-S216 PolarHBondContact NE2-O 3.35Å; Q200-S216 PolarHBondContact NE2-OG 3.32Å; E204-S216 PolarHBondContact OE2-OG 3.37Å; S216-F232 CarbonylContact C-O 3.55Å
217R87.6Confident85.5Confident166 Ų16672.8 Ų72.863%0.62639%0.389SS*.EExtended strand (participates in β ladder)trans-153.9131.2171.2-177.8175.2175.2178.3-1.5110.5G231 F232R217-G231 CarbonylContact O-C 3.54Å; R217-G231 WeakPolarHBondContact O-CA 3.16Å; R217-F232 PolarHBondContact N-O 3.07Å; R217-F232 PolarHBondContact O-N 3Å
218I89.9Confident85.3Confident22 Ų2280.9 Ų80.911%0.11342%0.419CS..EExtended strand (participates in β ladder)trans-98138.1169.5-63.2-177.3000109.1M198 T199 Q200 L203 V220M198-I218 WeakPolarHBondContact O-CD1 3.31Å; T199-I218 VanDerWaalsContact C-CD1 3.42Å; Q200-I218 HydrophobicContact CB-CD1 4.44Å; L203-I218 HydrophobicContact CB-CD1 4.35Å; L203-I218 HydrophobicContact CD2-CD1 4.27Å; L203-I218 HydrophobicContact CD2-CG1 3.82Å; I218-V220 PolarHBondContact O-N 3.19Å
219L87.3Confident85.1Confident53 Ų5378.3 Ų78.328%0.27740%0.402SS..EExtended strand (participates in β ladder)trans-82.8114.6171.3-9265.8000108.6R228 V230 F232L219-R228 HydrophobicContact CB-CB 4.46Å; L219-R228 WeakPolarHBondContact O-CB 3.2Å; L219-R228 PolarHBondContact O-N 2.99Å; L219-V230 HydrophobicContact CB-CB 4.5Å; L219-V230 PolarHBondContact N-O 3.46Å; L219-F232 HydrophobicContact CD1-CD2 3.33Å; L219-F232 HydrophobicContact CD1-CE2 3.33Å; L219-F232 HydrophobicContact CD2-CE2 3.99Å; L219-F232 HydrophobicContact CG-CE2 4.31Å
220V87.3Confident85.1Confident84 Ų8473.1 Ų73.151%0.50938%0.38SS..EExtended strand (participates in β ladder)trans-97143.7167.6-63.10000109I218 Q222I218-V220 PolarHBondContact O-N 3.19Å; V220-Q222 PolarHBondContact O-N 2.89Å
221D85.1Confident85.3Confident48 Ų4870.9 Ų70.926%0.25737%0.371SS..  trans-68.1127.7170.2-178.922.4000108.9V223 T224 G225 V226 R228D221-V223 VanDerWaalsContact C-N 3.26Å; D221-V223 PolarHBondContact O-N 3.38Å; D221-T224 WeakPolarHBondContact CB-OG1 3.21Å; D221-T224 WeakPolarHBondContact OD2-CG2 3.35Å; D221-T224 PolarHBondContact OD2-OG1 3.16Å; D221-G225 WeakPolarHBondContact O-CA 3.43Å; D221-G225 PolarHBondContact O-N 2.94Å; D221-V226 WeakPolarHBondContact CB-O 3.39Å; D221-V226 PolarHBondContact N-O 3.23Å; D221-R228 HydrophobicContact CB-CG 4.01Å
222Q79.6Confident85.6Confident193 Ų19373.9 Ų73.990%0.90238%0.38SS*.THydrogen-bonded Turntrans-76.8-18.8-170.2-162.2133.729.900112.3V220V220-Q222 PolarHBondContact O-N 2.89Å
223V82.4Confident85.8Confident135 Ų13565.9 Ų65.982%0.81835%0.35SS*.THydrogen-bonded Turntrans-87-48.2178.4-175.60000110.8D221D221-V223 VanDerWaalsContact C-N 3.26Å; D221-V223 PolarHBondContact O-N 3.38Å
224T81.6Confident85.7Confident88 Ų8869 Ų6954%0.5436%0.36SS..THydrogen-bonded Turntrans-95.6-14.3-173.961.10000113.5D221 V226D221-T224 WeakPolarHBondContact CB-OG1 3.21Å; D221-T224 WeakPolarHBondContact OD2-CG2 3.35Å; D221-T224 PolarHBondContact OD2-OG1 3.16Å; T224-V226 PolarHBondContact O-N 3.47Å; T224-V226 PolarHBondContact OG1-N 2.91Å
225G79Confident85.9Confident54 Ų5465.7 Ų65.756%0.55734%0.343SS*.  trans71.30-173.300000114D221D221-G225 WeakPolarHBondContact O-CA 3.43Å; D221-G225 PolarHBondContact O-N 2.94Å
226V81.3Confident85.8Confident65 Ų6563.6 Ų63.639%0.39433%0.329SS..  trans-84.3138.4-175.1-178.90000110.4K196 D221 T224 R228K196-V226 HydrophobicContact CB-CG1 4.48Å; K196-V226 HydrophobicContact CD-CG1 3.96Å; K196-V226 HydrophobicContact CG-CG1 4.37Å; D221-V226 WeakPolarHBondContact CB-O 3.39Å; D221-V226 PolarHBondContact N-O 3.23Å; T224-V226 PolarHBondContact O-N 3.47Å; T224-V226 PolarHBondContact OG1-N 2.91Å; V226-R228 PolarHBondContact O-N 3.49Å
227S84Confident85.6Confident22 Ų2269.8 Ų69.815%0.15435%0.35CS..EExtended strand (participates in β ladder)trans-56.3128173.3-62.10000111.5K196 G229K196-S227 WeakPolarHBondContact O-CB 3.16Å; K196-S227 PolarHBondContact O-OG 3.33Å; S227-G229 PolarHBondContact O-N 3.32Å; S227-G229 VanDerWaalsContact O-N 3.13Å
228R83.4Confident85.4Confident169 Ų16966 Ų6664%0.63834%0.336SS*.EExtended strand (participates in β ladder)trans-744.4176.6-64.5-173.365138.80.6113.3L219 D221 V226 V230L219-R228 HydrophobicContact CB-CB 4.46Å; L219-R228 WeakPolarHBondContact O-CB 3.2Å; L219-R228 PolarHBondContact O-N 2.99Å; D221-R228 HydrophobicContact CB-CG 4.01Å; V226-R228 PolarHBondContact O-N 3.49Å; R228-V230 PolarHBondContact O-N 2.97Å
229G84.2Confident85.3Confident9 Ų969.2 Ų69.29%0.09336%0.357CS..EExtended strand (participates in β ladder)trans66.119.9-173.600000113.6S192 G193 L194 S227S192-G229 CarbonylContact C-O 3.27Å; S192-G229 WeakPolarHBondContact CA-O 3.5Å; G193-G229 PolarHBondContact N-O 2.9Å; L194-G229 PolarHBondContact N-O 3.1Å; L194-G229 WeakPolarHBondContact O-CA 3.37Å; S227-G229 PolarHBondContact O-N 3.32Å; S227-G229 VanDerWaalsContact O-N 3.13Å
230V88.6Confident85.3Confident20 Ų2067.6 Ų67.612%0.12135%0.348CS..EExtended strand (participates in β ladder)trans-125.8135.6-178.1176.10000109.7Y190 V191 L219 R228 F232Y190-V230 HydrophobicContact CD2-CG1 4.05Å; Y190-V230 HydrophobicContact CE2-CG1 3.25Å; Y190-V230 WeakPolarHBondContact OH-CG2 3.34Å; V191-V230 CarbonylContact O-C 3.56Å; V191-V230 VanDerWaalsContact O-CA 3.29Å; V191-V230 WeakPolarHBondContact O-CA 3.45Å; L219-V230 HydrophobicContact CB-CB 4.5Å; L219-V230 PolarHBondContact N-O 3.46Å; R228-V230 PolarHBondContact O-N 2.97Å; V230-F232 HydrophobicContact CG1-CE2 4.4Å
231G90.4Very high85.4Confident0 Ų063.6 Ų63.60%032%0.324CS..EExtended strand (participates in β ladder)trans-135.5159.5176.200000112.5V191 R217V191-G231 PolarHBondContact N-O 3.45Å; V191-G231 PolarHBondContact O-N 2.97Å; R217-G231 CarbonylContact O-C 3.54Å; R217-G231 WeakPolarHBondContact O-CA 3.16Å
232F91.3Very high85.5Confident77 Ų7764.9 Ų64.934%0.33833%0.328SS..EExtended strand (participates in β ladder)trans-120.9132.4172-68.7-89.5000108.9L189 Y190 S216 R217 L219 V230 A265L189-F232 WeakPolarHBondContact O-CA 3.49Å; Y190-F232 HydrophobicContact CD2-CD1 4.39Å; Y190-F232 AromaticContact CD2-CE1 3.68Å; Y190-F232 HydrophobicContact CD2-CE1 3.68Å; Y190-F232 HydrophobicContact CD2-CE2 4.43Å; Y190-F232 AromaticContact CD2-CZ 3.71Å; Y190-F232 HydrophobicContact CD2-CZ 3.71Å; Y190-F232 HydrophobicContact CE2-CZ 4.12Å; S216-F232 CarbonylContact C-O 3.55Å; R217-F232 PolarHBondContact N-O 3.07Å; R217-F232 PolarHBondContact O-N 3Å; L219-F232 HydrophobicContact CD1-CD2 3.33Å; L219-F232 HydrophobicContact CD1-CE2 3.33Å; L219-F232 HydrophobicContact CD2-CE2 3.99Å; L219-F232 HydrophobicContact CG-CE2 4.31Å; V230-F232 HydrophobicContact CG1-CE2 4.4Å; F232-A265 HydrophobicContact CD1-CB 4.03Å; F232-A265 HydrophobicContact CE1-CB 4.12Å
233I90.9Very high85.9Confident2 Ų260.9 Ų60.91%0.0131%0.309CS..EExtended strand (participates in β ladder)trans-127.3130.9177.4-58.4178000107.5N188 L189 V191 L203 F207 I213 T215 F235N188-I233 CarbonylContact C-O 3.6Å; L189-I233 HydrophobicContact CB-CB 4.48Å; L189-I233 PolarHBondContact N-O 3.33Å; L189-I233 PolarHBondContact O-N 2.88Å; V191-I233 HydrophobicContact CG2-CD1 3.88Å; V191-I233 HydrophobicContact CG2-CG1 4.17Å; L203-I233 HydrophobicContact CD1-CD1 3.89Å; L203-I233 HydrophobicContact CD2-CD1 4Å; L203-I233 HydrophobicContact CD2-CG1 4Å; L203-I233 HydrophobicContact CG-CD1 3.72Å; L203-I233 HydrophobicContact CG-CG1 4.24Å; F207-I233 HydrophobicContact CB-CD1 3.74Å; F207-I233 HydrophobicContact CD1-CD1 3.5Å; F207-I233 VanDerWaalsContact CD1-CD1 3.5Å; F207-I233 HydrophobicContact CD2-CD1 3.31Å; F207-I233 HydrophobicContact CE1-CD1 3.82Å; F207-I233 HydrophobicContact CE2-CD1 3.65Å; F207-I233 HydrophobicContact CG-CD1 3.21Å; F207-I233 HydrophobicContact CZ-CD1 3.89Å; I213-I233 HydrophobicContact CD1-CG2 4.24Å; I213-I233 HydrophobicContact CG1-CG2 4.03Å; I213-I233 HydrophobicContact CG2-CG2 3.94Å; T215-I233 CarbonylContact O-C 3.56Å; T215-I233 WeakPolarHBondContact O-CA 3.45Å; I233-F235 HydrophobicContact CG2-CD2 4Å; I233-F235 HydrophobicContact CG2-CE2 3.67Å; I233-F235 HydrophobicContact CG2-CZ 4.24Å
234R87.8Confident86.2Confident91 Ų9154.5 Ų54.534%0.34327%0.27SS..EExtended strand (participates in β ladder)trans-110.3119.4172.3-179.4168.5-170.1166.43.5108.8N188 I214 T215N188-R234 WeakPolarHBondContact OD1-CB 3.3Å; N188-R234 WeakPolarHBondContact OD1-CD 3.41Å; N188-R234 WeakPolarHBondContact OD1-CG 3.41Å; N188-R234 PolarHBondContact OD1-NE 3.44Å; I214-R234 HydrophobicContact CB-CB 4.5Å; I214-R234 HydrophobicContact CB-CG 4.24Å; I214-R234 PolarHBondContact N-O 2.92Å; T215-R234 PolarHBondContact N-O 3.22Å; T215-R234 PolarHBondContact O-N 3.05Å; T215-R234 VanDerWaalsContact OG1-CB 3.24Å; T215-R234 WeakPolarHBondContact OG1-CB 3.03Å
235F88.4Confident86.5Confident0 Ų051.7 Ų51.70%025%0.252CS..EExtended strand (participates in β ladder)trans-84.8162.5171.7-78.8-86.1000111.6A187 L189 F207 R212 I213 I233 E240 A241 A244A187-F235 HydrophobicContact CB-CB 4.25Å; A187-F235 WeakPolarHBondContact CB-O 3.44Å; A187-F235 PolarHBondContact O-N 3.36Å; L189-F235 HydrophobicContact CD1-CD2 3.76Å; L189-F235 HydrophobicContact CD1-CE2 3.48Å; L189-F235 VanDerWaalsContact CD1-CE2 3.48Å; L189-F235 HydrophobicContact CG-CD2 4.13Å; L189-F235 HydrophobicContact CG-CE2 4.29Å; F207-F235 HydrophobicContact CB-CZ 3.92Å; F207-F235 HydrophobicContact CD1-CE2 4.01Å; F207-F235 AromaticContact CD1-CZ 3.97Å; F207-F235 HydrophobicContact CD1-CZ 3.97Å; F207-F235 HydrophobicContact CG-CZ 4.46Å; F207-F235 WeakPolarHBondContact O-CE1 3.29Å; F207-F235 WeakPolarHBondContact O-CZ 3.19Å; R212-F235 CarbonylContact O-C 3.58Å; I213-F235 HydrophobicContact CG1-CD1 4.32Å; I213-F235 HydrophobicContact CG1-CE1 3.91Å; I213-F235 HydrophobicContact CG1-CZ 4.23Å; I233-F235 HydrophobicContact CG2-CD2 4Å; I233-F235 HydrophobicContact CG2-CE2 3.67Å; I233-F235 HydrophobicContact CG2-CZ 4.24Å; F235-E240 HydrophobicContact CD1-CB 4.12Å; F235-A241 HydrophobicContact CB-CB 4.05Å; F235-A241 HydrophobicContact CD2-CB 3.89Å; F235-A241 HydrophobicContact CG-CB 4.19Å; F235-A244 HydrophobicContact CE2-CB 3.86Å; F235-A244 HydrophobicContact CZ-CB 3.8Å
236D82.4Confident86.8Confident25 Ų2557.7 Ų57.713%0.13426%0.263CS..SBendtrans-63-51.1171.5-169.7-14.9000110.4R178 R212 I214R178-D236 VanDerWaalsContact CZ-CG 3.41Å; R178-D236 IonicContact CZ-OD1 2.83Å; R178-D236 IonicContact CZ-OD2 3.54Å; R178-D236 VanDerWaalsContact CZ-OD2 3.24Å; R178-D236 IonicContact NH1-OD1 2.75Å; R178-D236 PolarHBondContact NH1-OD1 3.13Å; R178-D236 IonicContact NH1-OD2 3.25Å; R178-D236 PolarHBondContact NH1-OD2 3.3Å; R178-D236 VanDerWaalsContact NH1-OD2 3.17Å; R178-D236 VanDerWaalsContact NH2-CG 3.32Å; R178-D236 IonicContact NH2-OD1 3.86Å; R178-D236 IonicContact NH2-OD2 2.58Å; R178-D236 PolarHBondContact NH2-OD2 2.84Å; R212-D236 HydrophobicContact CB-CB 4.02Å; R212-D236 WeakPolarHBondContact O-CB 3.32Å; R212-D236 PolarHBondContact O-N 3.06Å; I214-D236 HydrophobicContact CD1-CB 4.08Å; I214-D236 HydrophobicContact CG1-CB 4.32Å
237R84Confident86.8Confident142 Ų14256.3 Ų56.354%0.53626%0.261SS..SBendtrans-118.7144.1-176-67.2-176.9-85.1-164.9-4111V239 E240 A241R237-V239 VanDerWaalsContact C-N 3.28Å; R237-V239 PolarHBondContact O-N 2.83Å; R237-E240 HydrophobicContact CB-CB 4.48Å; R237-E240 HydrophobicContact CB-CG 4.08Å; R237-E240 IonicContact CZ-OE1 3.19Å; R237-E240 VanDerWaalsContact CZ-OE1 3.25Å; R237-E240 IonicContact NE-OE1 2.78Å; R237-E240 PolarHBondContact NE-OE1 3.09Å; R237-E240 IonicContact NH2-OE1 2.84Å; R237-E240 PolarHBondContact NH2-OE1 2.76Å; R237-E240 PolarHBondContact O-N 2.7Å; R237-A241 PolarHBondContact O-N 3.39Å
238R84.6Confident86.7Confident87 Ų8755.3 Ų55.333%0.32826%0.255SS..Hα-helixtrans-58.9-38.9173.1-179.3-177.8-175.5140.16.8112.4S183 D186 E240 A241 E242 F264S183-R238 VanDerWaalsContact O-CB 3.25Å; S183-R238 WeakPolarHBondContact O-CB 3.31Å; S183-R238 PolarHBondContact O-N 2.83Å; S183-R238 VanDerWaalsContact O-N 3.09Å; D186-R238 IonicContact OD2-CZ 3.24Å; D186-R238 IonicContact OD2-NH1 2.69Å; D186-R238 PolarHBondContact OD2-NH1 2.77Å; R238-E240 VanDerWaalsContact C-N 3.35Å; R238-E240 PolarHBondContact O-N 2.74Å; R238-A241 CarbonylContact O-C 3.56Å; R238-A241 WeakPolarHBondContact O-CA 3.25Å; R238-A241 VanDerWaalsContact O-CB 3.26Å; R238-A241 WeakPolarHBondContact O-CB 3.45Å; R238-A241 PolarHBondContact O-N 2.79Å; R238-E242 HydrophobicContact CG-CG 4.42Å; R238-E242 WeakPolarHBondContact O-CG 3.28Å; R238-E242 PolarHBondContact O-N 3.5Å; R238-F264 HydrophobicContact CG-CE1 4.25Å; R238-F264 HydrophobicContact CG-CZ 4.34Å
239V86.8Confident86.5Confident89 Ų8950.1 Ų50.154%0.53924%0.239SC..Hα-helixtrans-58.8-47.2179.8-1790000110.9R237 A241 E242 E243R237-V239 VanDerWaalsContact C-N 3.28Å; R237-V239 PolarHBondContact O-N 2.83Å; V239-A241 VanDerWaalsContact C-N 3.26Å; V239-A241 PolarHBondContact O-N 3.43Å; V239-E242 WeakPolarHBondContact O-CB 3.26Å; V239-E242 PolarHBondContact O-N 3.34Å; V239-E243 PolarHBondContact O-N 2.99Å
240E89.1Confident85.8Confident20 Ų2054 Ų549%0.09326%0.264CS..Hα-helixtrans-59.6-38.2175.1-65.2172.5-174.700111.4R212 F235 R237 R238 E243 A244R212-E240 PolarHBondContact N-OE2 3.48Å; F235-E240 HydrophobicContact CD1-CB 4.12Å; R237-E240 HydrophobicContact CB-CB 4.48Å; R237-E240 HydrophobicContact CB-CG 4.08Å; R237-E240 IonicContact CZ-OE1 3.19Å; R237-E240 VanDerWaalsContact CZ-OE1 3.25Å; R237-E240 IonicContact NE-OE1 2.78Å; R237-E240 PolarHBondContact NE-OE1 3.09Å; R237-E240 IonicContact NH2-OE1 2.84Å; R237-E240 PolarHBondContact NH2-OE1 2.76Å; R237-E240 PolarHBondContact O-N 2.7Å; R238-E240 VanDerWaalsContact C-N 3.35Å; R238-E240 PolarHBondContact O-N 2.74Å; E240-E243 PolarHBondContact O-N 3.09Å; E240-A244 WeakPolarHBondContact O-CB 3.19Å; E240-A244 PolarHBondContact O-N 2.85Å
241A87.7Confident84.9Confident0 Ų057.5 Ų57.50%028%0.279CS..Hα-helixtrans-66.3-36.8175.400000112.5A187 L189 F235 R237 R238 V239 A244 I245 F264A187-A241 HydrophobicContact CB-CB 4.45Å; L189-A241 HydrophobicContact CD1-CB 4.19Å; L189-A241 HydrophobicContact CD2-CB 3.87Å; L189-A241 HydrophobicContact CG-CB 4.06Å; F235-A241 HydrophobicContact CB-CB 4.05Å; F235-A241 HydrophobicContact CD2-CB 3.89Å; F235-A241 HydrophobicContact CG-CB 4.19Å; R237-A241 PolarHBondContact O-N 3.39Å; R238-A241 CarbonylContact O-C 3.56Å; R238-A241 WeakPolarHBondContact O-CA 3.25Å; R238-A241 VanDerWaalsContact O-CB 3.26Å; R238-A241 WeakPolarHBondContact O-CB 3.45Å; R238-A241 PolarHBondContact O-N 2.79Å; V239-A241 VanDerWaalsContact C-N 3.26Å; V239-A241 PolarHBondContact O-N 3.43Å; A241-A244 PolarHBondContact O-N 2.77Å; A241-I245 VanDerWaalsContact O-CG1 3.3Å; A241-I245 WeakPolarHBondContact O-CG1 3.37Å; A241-I245 PolarHBondContact O-N 2.92Å; A241-F264 HydrophobicContact CB-CE1 4.34Å
242E88.2Confident83.6Confident74 Ų7464.7 Ų64.735%0.34631%0.31SS..Hα-helixtrans-67.1-41.6175.5-72.4175.8120.500111.9R238 V239 A244 I245 K246 F264R238-E242 HydrophobicContact CG-CG 4.42Å; R238-E242 WeakPolarHBondContact O-CG 3.28Å; R238-E242 PolarHBondContact O-N 3.5Å; V239-E242 WeakPolarHBondContact O-CB 3.26Å; V239-E242 PolarHBondContact O-N 3.34Å; E242-A244 VanDerWaalsContact C-N 3.35Å; E242-I245 PolarHBondContact O-N 3.37Å; E242-K246 WeakPolarHBondContact O-CG 3.35Å; E242-K246 PolarHBondContact O-N 3.13Å; E242-F264 HydrophobicContact CG-CE2 4.19Å; E242-F264 HydrophobicContact CG-CZ 3.51Å
243E87.9Confident82.2Confident110 Ų11062 Ų6251%0.51430%0.3SS..Hα-helixtrans-64.3-41.3174.9-67.7-173.7111.900111.3V239 E240 I245 K246 G247V239-E243 PolarHBondContact O-N 2.99Å; E240-E243 PolarHBondContact O-N 3.09Å; E243-I245 PolarHBondContact O-N 3.23Å; E243-K246 PolarHBondContact O-N 3.06Å; E243-G247 PolarHBondContact O-N 3.18Å
244A88.1Confident80.5Confident0 Ų068.3 Ų68.30%034%0.342CS..Hα-helixtrans-61.2-42.6173.200000112.3L189 F207 Y210 F235 E240 A241 E242 G247 L248L189-A244 HydrophobicContact CD1-CB 4.01Å; F207-A244 HydrophobicContact CD1-CB 4.22Å; Y210-A244 HydrophobicContact CD1-CB 4.37Å; Y210-A244 HydrophobicContact CD2-CB 4.24Å; Y210-A244 HydrophobicContact CG-CB 3.83Å; F235-A244 HydrophobicContact CE2-CB 3.86Å; F235-A244 HydrophobicContact CZ-CB 3.8Å; E240-A244 WeakPolarHBondContact O-CB 3.19Å; E240-A244 PolarHBondContact O-N 2.85Å; A241-A244 PolarHBondContact O-N 2.77Å; E242-A244 VanDerWaalsContact C-N 3.35Å; A244-G247 PolarHBondContact O-N 3.28Å; A244-L248 WeakPolarHBondContact O-CB 3.36Å; A244-L248 PolarHBondContact O-N 3.29Å
245I88.1Confident79Confident29 Ų2967.4 Ų67.415%0.14936%0.36CS..Hα-helixtrans-61.3-47174-68.8160.6000110.2L189 A241 E242 E243 G247 N249 V262 F264L189-I245 HydrophobicContact CD1-CG1 4.2Å; L189-I245 HydrophobicContact CD2-CD1 3.48Å; L189-I245 VanDerWaalsContact CD2-CD1 3.48Å; L189-I245 HydrophobicContact CD2-CG1 3.72Å; A241-I245 VanDerWaalsContact O-CG1 3.3Å; A241-I245 WeakPolarHBondContact O-CG1 3.37Å; A241-I245 PolarHBondContact O-N 2.92Å; E242-I245 PolarHBondContact O-N 3.37Å; E243-I245 PolarHBondContact O-N 3.23Å; I245-G247 VanDerWaalsContact C-N 3.32Å; I245-G247 PolarHBondContact O-N 2.79Å; I245-N249 HydrophobicContact CG2-CB 4.39Å; I245-N249 WeakPolarHBondContact O-CB 2.91Å; I245-N249 PolarHBondContact O-N 3.41Å; I245-N249 VanDerWaalsContact O-N 3.13Å; I245-V262 HydrophobicContact CG1-CB 4.42Å; I245-V262 HydrophobicContact CG1-CG1 3.78Å; I245-F264 HydrophobicContact CD1-CD1 4.13Å; I245-F264 HydrophobicContact CD1-CD2 3.67Å; I245-F264 HydrophobicContact CD1-CE1 3.96Å; I245-F264 HydrophobicContact CD1-CE2 3.49Å; I245-F264 VanDerWaalsContact CD1-CE2 3.49Å; I245-F264 HydrophobicContact CD1-CG 4Å; I245-F264 HydrophobicContact CD1-CZ 3.67Å
246K85.9Confident77.7Confident180 Ų18068.3 Ų68.378%0.78337%0.368SS*.Hα-helixtrans-64.2-36.1-178.4-74.3176.4-179.1178.50112.9E242 E243E242-K246 WeakPolarHBondContact O-CG 3.35Å; E242-K246 PolarHBondContact O-N 3.13Å; E243-K246 PolarHBondContact O-N 3.06Å
247G81Confident76.6Confident36 Ų3674.1 Ų74.137%0.37140%0.404SS..Hα-helixtrans-86.8-36.7-17600000115.3E243 A244 I245E243-G247 PolarHBondContact O-N 3.18Å; A244-G247 PolarHBondContact O-N 3.28Å; I245-G247 VanDerWaalsContact C-N 3.32Å; I245-G247 PolarHBondContact O-N 2.79Å
248L80.9Confident75.7Confident2 Ų273.7 Ų73.71%0.0141%0.408CS..Hα-helixtrans-104.2-17.2-172.4-66.6174.7000114.1L206 F207 Y210 A244 C250 Q251 V262L206-L248 HydrophobicContact CD1-CD2 4.44Å; L206-L248 HydrophobicContact CD2-CD2 4.48Å; L206-L248 HydrophobicContact CG-CD1 4.46Å; L206-L248 HydrophobicContact CG-CD2 4.25Å; F207-L248 HydrophobicContact CD1-CD1 3.44Å; F207-L248 VanDerWaalsContact CD1-CD1 3.44Å; F207-L248 HydrophobicContact CD2-CD1 3.82Å; F207-L248 HydrophobicContact CE1-CB 4.48Å; F207-L248 HydrophobicContact CE1-CD1 3.39Å; F207-L248 HydrophobicContact CE2-CD1 3.77Å; F207-L248 HydrophobicContact CG-CD1 3.68Å; F207-L248 HydrophobicContact CZ-CB 4.42Å; F207-L248 HydrophobicContact CZ-CD1 3.56Å; Y210-L248 HydrophobicContact CD2-CD1 3.63Å; Y210-L248 HydrophobicContact CD2-CG 4.01Å; Y210-L248 HydrophobicContact CE2-CD1 3.32Å; Y210-L248 HydrophobicContact CE2-CD2 3.57Å; Y210-L248 HydrophobicContact CE2-CG 3.25Å; Y210-L248 WeakPolarHBondContact OH-CD2 3.36Å; A244-L248 WeakPolarHBondContact O-CB 3.36Å; A244-L248 PolarHBondContact O-N 3.29Å; L248-C250 PolarHBondContact O-N 3.48Å; L248-Q251 WeakPolarHBondContact O-CB 3.38Å; L248-Q251 PolarHBondContact O-N 3.13Å; L248-Q251 VanDerWaalsContact O-N 3.16Å; L248-V262 HydrophobicContact CB-CG2 3.99Å
249N81.1Confident75.4Confident59 Ų5972 Ų7232%0.31641%0.409SS..THydrogen-bonded Turntrans-66.6131.5178.3-172.444.5000110.2I245 Q251 T261 V262I245-N249 HydrophobicContact CG2-CB 4.39Å; I245-N249 WeakPolarHBondContact O-CB 2.91Å; I245-N249 PolarHBondContact O-N 3.41Å; I245-N249 VanDerWaalsContact O-N 3.13Å; N249-Q251 VanDerWaalsContact C-N 3.28Å; N249-Q251 PolarHBondContact O-N 2.92Å; N249-T261 WeakPolarHBondContact OD1-CA 3.45Å; N249-V262 HydrophobicContact CB-CB 4.27Å; N249-V262 PolarHBondContact OD1-N 3.28Å; N249-V262 PolarHBondContact OD1-O 2.75Å
250C68.1Low75.3Confident90 Ų9067.9 Ų67.961%0.60838%0.384SS*.THydrogen-bonded Turntrans70.210-173.1-58.60000115.9L248 I260L248-C250 PolarHBondContact O-N 3.48Å; C250-I260 WeakPolarHBondContact CA-O 3.47Å; C250-I260 PolarHBondContact N-O 3.46Å
251Q70.4Confident75.1Confident95 Ų9568.6 Ų68.644%0.44439%0.39SS..  trans-79.6133.7174.1-155.9177.527.100110.6L248 N249 P253 I260L248-Q251 WeakPolarHBondContact O-CB 3.38Å; L248-Q251 PolarHBondContact O-N 3.13Å; L248-Q251 VanDerWaalsContact O-N 3.16Å; N249-Q251 VanDerWaalsContact C-N 3.28Å; N249-Q251 PolarHBondContact O-N 2.92Å; Q251-P253 WeakPolarHBondContact O-CD 3.33Å; Q251-I260 PolarHBondContact O-N 3.04Å
252K64Low75.2Confident151 Ų15168.6 Ų68.666%0.65739%0.39SS*.  trans-90.4103.1172.9-70.6-177.7-178.4-178.70108.8P259K252-P259 HydrophobicContact CG-CB 4.04Å
253P60.7Low75.2Confident19 Ų1971.1 Ų71.112%0.12340%0.4CS..  trans-66150.1173.833.6-40.1000109Q251 G255 A256 I260Q251-P253 WeakPolarHBondContact O-CD 3.33Å; P253-G255 PolarHBondContact O-N 2.81Å; P253-A256 HydrophobicContact CG-CB 3.54Å; P253-A256 PolarHBondContact O-N 2.89Å; P253-I260 HydrophobicContact CB-CD1 3.9Å; P253-I260 HydrophobicContact CG-CD1 3.44Å; P253-I260 VanDerWaalsContact CG-CD1 3.44Å; P253-I260 HydrophobicContact CG-CG1 3.72Å
254P55.8Low75.2Confident136 Ų13669.8 Ų69.888%0.88339%0.392SS*.THydrogen-bonded Turntrans-59.6115.5175.823.7-31.3000109.5
255G56.5Low74.9Confident71 Ų7170.8 Ų70.873%0.73240%0.4SS*.THydrogen-bonded Turntrans105.8-1.7179.300000116.5P253P253-G255 PolarHBondContact O-N 2.81Å
256A60.4Low74.3Confident19 Ų1974.6 Ų74.616%0.15742%0.421CS..  trans-96.5135.6172.200000112.5P195 P253 E258P195-A256 HydrophobicContact CB-CB 4.26Å; P195-A256 HydrophobicContact CG-CB 4.1Å; P253-A256 HydrophobicContact CG-CB 3.54Å; P253-A256 PolarHBondContact O-N 2.89Å; A256-E258 VanDerWaalsContact C-N 3.31Å; A256-E258 WeakPolarHBondContact CB-O 3.49Å
257T59.6Low73.1Confident147 Ų14768.5 Ų68.590%0.90240%0.397SS*.SBendtrans-73.9-26.5173-37.60000111.8
258E65.3Low71.8Confident133 Ų13371.9 Ų71.962%0.62141%0.412SS*.SBendtrans-115.2146.4-178.9-66.7-172121.900111.1A256A256-E258 VanDerWaalsContact C-N 3.31Å; A256-E258 WeakPolarHBondContact CB-O 3.49Å
259P77.9Confident70.4Confident53 Ų5376.3 Ų76.334%0.34444%0.443SS..  trans-64.6139.8172.628-33.2000110.6K252 T261K252-P259 HydrophobicContact CG-CB 4.04Å; P259-T261 PolarHBondContact O-N 2.91Å
260I84.5Confident68.9Low1 Ų176.7 Ų76.71%0.00544%0.443CS..  trans-64.3129.1172.8-65.8169.3000108.1V191 S192 L194 L206 C250 Q251 P253 V262V191-I260 HydrophobicContact CG1-CG2 3.48Å; V191-I260 VanDerWaalsContact CG1-CG2 3.48Å; S192-I260 CarbonylContact O-C 3.45Å; S192-I260 WeakPolarHBondContact O-CA 3.38Å; L194-I260 HydrophobicContact CD2-CD1 3.95Å; L194-I260 HydrophobicContact CD2-CG1 4.09Å; L206-I260 HydrophobicContact CD2-CD1 4.08Å; C250-I260 WeakPolarHBondContact CA-O 3.47Å; C250-I260 PolarHBondContact N-O 3.46Å; Q251-I260 PolarHBondContact O-N 3.04Å; P253-I260 HydrophobicContact CB-CD1 3.9Å; P253-I260 HydrophobicContact CG-CD1 3.44Å; P253-I260 VanDerWaalsContact CG-CD1 3.44Å; P253-I260 HydrophobicContact CG-CG1 3.72Å; I260-V262 HydrophobicContact CG2-CG2 3.75Å
261T85.2Confident67.9Low36 Ų3679 Ų7922%0.22144%0.443CS..EExtended strand (participates in β ladder)trans-106.2124170.1-59.50000108.8V191 S192 N249 P259 K263V191-T261 CarbonylContact C-O 3.59Å; V191-T261 WeakPolarHBondContact CA-O 3.45Å; S192-T261 PolarHBondContact N-O 3.36Å; S192-T261 PolarHBondContact O-N 2.98Å; S192-T261 WeakPolarHBondContact OG-CB 3.49Å; N249-T261 WeakPolarHBondContact OD1-CA 3.45Å; P259-T261 PolarHBondContact O-N 2.91Å; T261-K263 HydrophobicContact CG2-CD 4.02Å; T261-K263 HydrophobicContact CG2-CG 4.06Å
262V89.3Confident66.9Low0 Ų078.7 Ų78.70%045%0.448CS..EExtended strand (participates in β ladder)trans-116.3122.8177.6-170.10000108.5L189 Y190 V191 F207 I245 L248 N249 I260L189-V262 HydrophobicContact CB-CG1 4.24Å; L189-V262 HydrophobicContact CD1-CG1 3.71Å; L189-V262 HydrophobicContact CG-CG1 4.44Å; Y190-V262 WeakPolarHBondContact O-CA 3.24Å; V191-V262 HydrophobicContact CG1-CG2 4.39Å; V191-V262 HydrophobicContact CG2-CG1 4.37Å; F207-V262 HydrophobicContact CE1-CG1 3.9Å; F207-V262 HydrophobicContact CE1-CG2 3.95Å; F207-V262 HydrophobicContact CZ-CG1 4.36Å; F207-V262 HydrophobicContact CZ-CG2 3.68Å; I245-V262 HydrophobicContact CG1-CB 4.42Å; I245-V262 HydrophobicContact CG1-CG1 3.78Å; L248-V262 HydrophobicContact CB-CG2 3.99Å; N249-V262 HydrophobicContact CB-CB 4.27Å; N249-V262 PolarHBondContact OD1-N 3.28Å; N249-V262 PolarHBondContact OD1-O 2.75Å; I260-V262 HydrophobicContact CG2-CG2 3.75Å
263K88Confident65.9Low127 Ų12776 Ų7655%0.55245%0.448SS*.EExtended strand (participates in β ladder)trans-139.5162-179.9-69.4179.1-179.6175.50110.3L189 Y190 T261 A265L189-K263 CarbonylContact C-O 3.56Å; L189-K263 VanDerWaalsContact CA-O 3.31Å; L189-K263 WeakPolarHBondContact CA-O 3.48Å; Y190-K263 PolarHBondContact N-O 3.08Å; Y190-K263 PolarHBondContact O-N 3.11Å; T261-K263 HydrophobicContact CG2-CD 4.02Å; T261-K263 HydrophobicContact CG2-CG 4.06Å; K263-A265 PolarHBondContact O-N 3.01Å
264F88.6Confident64.9Low82 Ų8282.7 Ų82.736%0.3648%0.478SS..EExtended strand (participates in β ladder)trans-62.1130.6168.9-73.5-70.9000110.9D186 L189 R238 A241 E242 I245D186-F264 VanDerWaalsContact O-CD1 3.24Å; D186-F264 WeakPolarHBondContact O-CD1 3.19Å; D186-F264 WeakPolarHBondContact O-CE1 3.33Å; L189-F264 HydrophobicContact CD2-CD1 3.88Å; L189-F264 HydrophobicContact CD2-CE1 4.11Å; R238-F264 HydrophobicContact CG-CE1 4.25Å; R238-F264 HydrophobicContact CG-CZ 4.34Å; A241-F264 HydrophobicContact CB-CE1 4.34Å; E242-F264 HydrophobicContact CG-CE2 4.19Å; E242-F264 HydrophobicContact CG-CZ 3.51Å; I245-F264 HydrophobicContact CD1-CD1 4.13Å; I245-F264 HydrophobicContact CD1-CD2 3.67Å; I245-F264 HydrophobicContact CD1-CE1 3.96Å; I245-F264 HydrophobicContact CD1-CE2 3.49Å; I245-F264 VanDerWaalsContact CD1-CE2 3.49Å; I245-F264 HydrophobicContact CD1-CG 4Å; I245-F264 HydrophobicContact CD1-CZ 3.67Å
265A82.5Confident64.5Low20 Ų2078.9 Ų78.917%0.16546%0.457CS..PPolyproline II helixtrans-75.4130.5176.200000109.9N188 F232 K263 N267N188-A265 HydrophobicContact CB-CB 3.88Å; N188-A265 PolarHBondContact O-N 2.81Å; F232-A265 HydrophobicContact CD1-CB 4.03Å; F232-A265 HydrophobicContact CE1-CB 4.12Å; K263-A265 PolarHBondContact O-N 3.01Å; A265-N267 PolarHBondContact O-N 3.03Å
266N75.1Confident64.2Low110 Ų11081.9 Ų81.959%0.58846%0.456SS*.PPolyproline II helixtrans-72.7116.4171-168.84.9000109.2P268 K271N266-P268 WeakPolarHBondContact O-CD 3.41Å; N266-K271 WeakPolarHBondContact ND2-CE 3.11Å
267N61Low63.3Low52 Ų5287.5 Ų87.528%0.27848%0.483SS..PPolyproline II helixtrans-78.2116.9175.1-169.1-16.6000108.9A265 S269 Q270A265-N267 PolarHBondContact O-N 3.03Å; N267-S269 PolarHBondContact O-N 3.38Å; N267-S269 WeakPolarHBondContact OD1-CB 3.33Å; N267-S269 PolarHBondContact OD1-N 3.12Å; N267-S269 PolarHBondContact OD1-OG 3.3Å; N267-Q270 HydrophobicContact CB-CB 4.41Å; N267-Q270 HydrophobicContact CB-CG 4.34Å; N267-Q270 PolarHBondContact O-N 2.64Å
268P53.9Low62.5Low107 Ų10785.8 Ų85.870%0.69548%0.477SS*.THydrogen-bonded Turntrans-56.8-23.9177.223.3-33.5000112.7N266N266-P268 WeakPolarHBondContact O-CD 3.41Å
269S50.1Low61.4Low94 Ų9487.9 Ų87.966%0.65749%0.486SS*.THydrogen-bonded Turntrans-73.7-20177.6-49.30000114.7N267N267-S269 PolarHBondContact O-N 3.38Å; N267-S269 WeakPolarHBondContact OD1-CB 3.33Å; N267-S269 PolarHBondContact OD1-N 3.12Å; N267-S269 PolarHBondContact OD1-OG 3.3Å
270Q50.4Low59.5Low68 Ų6891.8 Ų91.832%0.31850%0.504SS..THydrogen-bonded Turntrans-91.7-14.7-174.6-83.4-148.727.500114.7D186 N267 T272 S273D186-Q270 PolarHBondContact OD1-NE2 2.96Å; D186-Q270 VanDerWaalsContact OD1-NE2 3.11Å; N267-Q270 HydrophobicContact CB-CB 4.41Å; N267-Q270 HydrophobicContact CB-CG 4.34Å; N267-Q270 PolarHBondContact O-N 2.64Å; Q270-T272 PolarHBondContact O-N 3.09Å; Q270-S273 PolarHBondContact O-N 2.95Å; Q270-S273 VanDerWaalsContact O-N 3.09Å
271K47Very low57.1Low138 Ų138102.3 Ų102.360%0.655%0.545SS*.THydrogen-bonded Turntrans-58.4-18.9-177-71.9-171.2176.4-178.10113.8N266N266-K271 WeakPolarHBondContact ND2-CE 3.11Å
272T49.7Very low54.8Low89 Ų89109.6 Ų109.655%0.54658%0.576SS.*THydrogen-bonded Turntrans-78.4-22.6-179.7-42.50000113.7I137 Q270I137-T272 HydrophobicContact CD1-CG2 3.81Å; Q270-T272 PolarHBondContact O-N 3.09Å
273S42.3Very low51.9Low94 Ų94115 Ų11566%0.65761%0.614SS**THydrogen-bonded Turntrans-104.3-27.2-169.1-63.80000115.9Q270Q270-S273 PolarHBondContact O-N 2.95Å; Q270-S273 VanDerWaalsContact O-N 3.09Å
274Q40.7Very low49.8Very low160 Ų160114.8 Ų114.875%0.74863%0.626SS**G310 helixtrans-83.1-19-174.1-150.1179.666.500113.6L276Q274-L276 VanDerWaalsContact C-N 3.27Å; Q274-L276 PolarHBondContact O-N 3.09Å
275A46.6Very low47.1Very low55 Ų55118.2 Ų118.246%0.45565%0.648SS.*G310 helixtrans-73.5-12.918000000114.3
276L49.4Very low44.7Very low135 Ų135128.5 Ų128.571%0.70768%0.682SS**G310 helixtrans-93.5-20.5-175.1-79.9163.7000114.5Q274Q274-L276 VanDerWaalsContact C-N 3.27Å; Q274-L276 PolarHBondContact O-N 3.09Å
277L42.5Very low42.6Very low137 Ų137134.2 Ų134.272%0.71770%0.696SS**G310 helixtrans-93.4-18.6-169.3-15069.7000114.7Q279L277-Q279 PolarHBondContact O-N 3.34Å
278S41.7Very low41.3Very low111 Ų111142.5 Ų142.578%0.77673%0.725SS**G310 helixtrans-77.8-1.1175.5-78.70000114.6
279Q44.1Very low41Very low176 Ų176143 Ų14382%0.82273%0.728SS**G310 helixtrans-99.53.3-179.1-69.4-152.1-25.900115.4L277L277-Q279 PolarHBondContact O-N 3.34Å
280L37.4Very low40Very low136 Ų136141.9 Ų141.971%0.71273%0.731SS**SBendtrans-106.44.9-175.7-77.1167.9000115.9
281Y33.5Very low39.8Very low222 Ų222144.9 Ų144.987%0.87176%0.757SS**SBendtrans-125.928.2-176.2-91.7-79.6000116
282Q36.3Very low39.4Very low188 Ų188146.4 Ų146.488%0.87977%0.771SS**  trans-124.679.3168.3-77.5166.811.800110.4
283S30.3Very low38.7Very low113 Ų113147.4 Ų147.479%0.7979%0.788SS**  trans-71.1141.7166.9-49.80000110.3
284P43.5Very low38.4Very low123 Ų123151.5 Ų151.580%0.79980%0.796SS**  trans-95.1129.5-177.334.6-29000111.3
285N30.6Very low38Very low154 Ų154152.5 Ų152.582%0.82480%0.801SS**  trans-161.1105.6155.9-133-6000112.4
286R32.4Very low37.3Very low237 Ų237153.8 Ų153.889%0.89481%0.812SS**  166.1123.2112.4-86.6-151.7175.9-162.81.1112.3
287R32.3Very low36.7Very low230 Ų230155.1 Ų155.187%0.86881%0.814SS**  trans-76.7151.7160.9-79.9-179.4156.9170.2-5.2110.5
288Y31.8Very low36Very low226 Ų226158 Ų15889%0.88682%0.816SS**  -170.5157.2108.4-112.9-98.3000111.3
289P48.3Very low35.4Very low116 Ų116159 Ų15975%0.75381%0.806SS**  trans-116.6171.9-160.338.5-22.6000115.2
290G29.7Very low35Very low71 Ų71160.3 Ų160.373%0.73280%0.804SS**  trans176.7158.1169.200000113.9
291P45Very low34.5Very low132 Ų132160.1 Ų160.186%0.85780%0.803SS**  -125.3178.3-110.439.6-28.3000118.1
292L39.7Very low34.3Very low170 Ų170156.5 Ų156.589%0.8980%0.798SS**  trans-41.3145.4177-84.473.6000117.4
293A33.8Very low34Very low109 Ų109152.9 Ų152.990%0.90179%0.785SS**  trans-157.8153.7139.500000112
294Q37.5Very low33.9Very low181 Ų181154.3 Ų154.385%0.84678%0.783SS**  trans-108.6166.5-159.7-146163.8-17.400111.2
295Q30.7Very low33.3Very low181 Ų181156.6 Ų156.685%0.84679%0.787SS**  trans99.2101.8143.6-147.1159.525.200121
296A32.6Very low33.3Very low82 Ų82155.1 Ų155.168%0.67878%0.78SS**  51.6128.2121.900000124.7
297Q36.3Very low33.4Very low162 Ų162151.9 Ų151.976%0.75778%0.777SS**  trans77.6113.2135.7-66.9-82.7-60.300120.9
298R29.1Very low33Very low198 Ų198144.6 Ų144.675%0.74777%0.766SS**  157.1129.6100.9-92.4-141.6144.6-174.6-12.3115
299F29.6Very low32.9Very low131 Ų131144.7 Ų144.758%0.57577%0.766SS**  trans68.4111.4139.4-76.4-103.7000121.3
300R33.8Very low31.8Very low205 Ų205142.6 Ų142.677%0.77477%0.766SS**  77.5130.598.3-93.8-164.2172.3169.60.1113
301L27.4Very low31.6Very low132 Ų132145.8 Ų145.869%0.69177%0.771SS**  -167.3138.554.5-15665.5000106.4
302D29.3Very low30.7Very low145 Ų145148.5 Ų148.578%0.77577%0.769SS**  -160.1153.479-147.6-87.1000114.3
303N29.9Very low30.1Very low113 Ų113145.4 Ų145.460%0.60476%0.762SS**  trans-81.9142.1-168.9-100.9-11.6000111.1
304L29.6Very low29.8Very low143 Ų143152.2 Ų152.275%0.74976%0.764SS**  65.2110.477.3-104169.9000115.4
305L30.5Very low29.3Very low170 Ų170152.9 Ų152.989%0.8976%0.764SS**  trans179.2144.1133.2-92.8155.6000106.4
306N30.9Very low29.2Very low123 Ų123148.7 Ų148.766%0.65876%0.755SS**  cis-170157.2-33.2173.636.5000104.2
307M33.2Very low29.7Very low169 Ų169150.1 Ų150.183%0.83376%0.758SS**  trans-36.2150.1176-61.9172167.500116.1
308A25.3Very low29.3Very low77 Ų77150.9 Ų150.964%0.63676%0.763SS**  176.2148.697.300000114.5
309Y28.6Very low29.3Very low228 Ų228145.9 Ų145.989%0.89476%0.764SS**  trans72.7101162.5-55.6-72.4000120.6
310G26.1Very low29.4Very low73 Ų73147.7 Ų147.775%0.75378%0.778SS**  53.5139.4110.400000122.1
311V25Very low29.1Very low138 Ų138145.4 Ų145.484%0.83678%0.781SS**  trans106.799.7152.4-169.90000116.7
312K26.6Very low29.1Very low189 Ų189142 Ų14282%0.82278%0.778SS**  30.3139.8128.3-69.8-179.4172.1179.20120.7
313S27.3Very low29Very low105 Ų105142.2 Ų142.273%0.73478%0.784SS**  trans94100.6144.7-53.70000116.8
314R26.6Very low28.9Very low251 Ų251142.9 Ų142.995%0.94779%0.793SS**  -142.396.7124.2-72-150.4-125.5-141.76.8111
315F26.6Very low29Very low195 Ų195140.9 Ų140.986%0.85579%0.791SS**  trans-52.4151.2134.1-93.8-83.4000108
316S29.3Very low28.9Very low93 Ų93141.1 Ų141.165%0.6579%0.792SS**  cis176.4-166.336.6-108.90000105.4
317P43.1Very low28.8Very low112 Ų112139.5 Ų139.573%0.72780%0.796SS**  cis-123.3177.3-40.529.6-8.3000109.1
318M28.6Very low28.6Very low179 Ų179134.7 Ų134.788%0.88279%0.789SS**  173.8143.762.7-147.7170.7-169.100109.8
319A27.7Very low28.9Very low92 Ų92138.5 Ų138.576%0.7680%0.798SS**  trans62.9107.714800000122.4
320I31.8Very low29.2Very low169 Ų169132.3 Ų132.387%0.86778%0.78SS**  -168.3104.992.5-171.7156000111.5
321D27Very low29.5Very low158 Ų158136.3 Ų136.385%0.84578%0.782SS**  trans-55.7148.9152.2-67.3-85.7000110.2
322G27.6Very low30Very low61 Ų61134.5 Ų134.563%0.62977%0.773SS**  cis177.199.98.800000104.8
323V26.9Very low30.3Very low149 Ų149128 Ų12890%0.90376%0.76SS**  trans-91.5109.6166.7-41.30000105.4
324T29.1Very low30.6Very low127 Ų127130 Ų13078%0.77976%0.757SS**  trans-138.3139.9170.5-20.60000108.9
325S31.3Very low31.2Very low101 Ų101121.3 Ų121.371%0.70674%0.739SS**  trans79.193.3158.763.30000118.9
326L27.8Very low32.1Very low174 Ų174114.4 Ų114.491%0.91172%0.723SS**  -154.594.6114.7-110.3126.8000106.3
327A28.8Very low33.7Very low89 Ų89116.1 Ų116.174%0.73673%0.73SS**  51.6101.87200000112.5
328G29.6Very low34.9Very low68 Ų68111.1 Ų111.170%0.70170%0.698SS**  trans112.4114.2146.900000117.2
329I31Very low37.7Very low158 Ų158108.2 Ų108.281%0.8168%0.677SS**  trans86.694.1150.4-48.2159.4000114
330N35.1Very low40.6Very low98 Ų98105.3 Ų105.352%0.52465%0.651SS.*  60.9103.271.3-155.8-88.7000114.7K369N330-K369 PolarHBondContact ND2-NZ 3.18Å
331I33.3Very low43.5Very low157 Ų15797.2 Ų97.281%0.80561%0.61SS**  trans-162.6150.5155-92.9149.4000107.5
332P33.9Very low46.7Very low99 Ų9992.4 Ų92.464%0.64358%0.581SS**SBendtrans-89.3149.9-154.333.7-24.5000112.5
333G33.1Very low49.8Very low52 Ų5289.5 Ų89.554%0.53655%0.551SS.*SBendtrans111.1-1.716300000117.6
334H34.8Very low52.9Low148 Ų14887.4 Ų87.469%0.68553%0.528SS*.  trans-124.9111.8169.9-142.470.9000110.1G336H334-G336 VanDerWaalsContact C-N 3.33Å; H334-G336 PolarHBondContact O-N 3.33Å
335A39.8Very low55.8Low69 Ų6983.9 Ų83.957%0.5750%0.504SS*.  trans-55.9102.7159.200000106.9T337 G338A335-T337 PolarHBondContact O-N 2.93Å; A335-G338 WeakPolarHBondContact CB-O 3.27Å
336G44.9Very low58.6Low49 Ų4979.1 Ų79.151%0.50547%0.471SS..SBendtrans-63.587.3159.100000106.6H334 G338H334-G336 VanDerWaalsContact C-N 3.33Å; H334-G336 PolarHBondContact O-N 3.33Å; G336-G338 PolarHBondContact O-N 2.95Å
337T61.8Low61.3Low130 Ų13071.6 Ų71.680%0.79843%0.434SS*.SBendtrans45.230.5169.363.80000115.7A335A335-T337 PolarHBondContact O-N 2.93Å
338G70.1Confident63.9Low6 Ų669.9 Ų69.96%0.06242%0.415CS..SBendtrans-165156.3-172.400000113.9A335 G336 M387A335-G338 WeakPolarHBondContact CB-O 3.27Å; G336-G338 PolarHBondContact O-N 2.95Å; G338-M387 CarbonylContact C-O 3.55Å; G338-M387 VanDerWaalsContact C-O 3.27Å; G338-M387 WeakPolarHBondContact CA-O 3.42Å
339W85.8Confident66.5Low118 Ų11872.4 Ų72.445%0.44741%0.413SS..EExtended strand (participates in β ladder)trans-87.6114.1-174.4-60.588.4000109.9T386 M387 Y390 A393 F414W339-T386 WeakPolarHBondContact O-CA 3.46Å; W339-M387 PolarHBondContact N-O 3.26Å; W339-M387 PolarHBondContact O-N 3.42Å; W339-Y390 VanDerWaalsContact CD1-CA 3.49Å; W339-Y390 AromaticContact CD2-CD2 3.61Å; W339-Y390 HydrophobicContact CD2-CD2 3.61Å; W339-Y390 HydrophobicContact CD2-CG 4.25Å; W339-Y390 VanDerWaalsContact CE2-CB 3.44Å; W339-Y390 AromaticContact CE2-CD2 3.83Å; W339-Y390 AromaticContact CE3-CD2 3.45Å; W339-Y390 HydrophobicContact CE3-CD2 3.45Å; W339-Y390 VanDerWaalsContact CE3-CD2 3.45Å; W339-Y390 HydrophobicContact CE3-CE2 4.11Å; W339-Y390 HydrophobicContact CE3-CG 4.45Å; W339-Y390 HydrophobicContact CG-CD2 4.33Å; W339-Y390 AromaticContact CH2-CD2 3.7Å; W339-Y390 HydrophobicContact CH2-CD2 3.7Å; W339-Y390 HydrophobicContact CH2-CE2 4.35Å; W339-Y390 HydrophobicContact CH2-CG 4.2Å; W339-Y390 AromaticContact CZ2-CD2 3.89Å; W339-Y390 HydrophobicContact CZ2-CD2 3.89Å; W339-Y390 HydrophobicContact CZ2-CG 4.04Å; W339-Y390 AromaticContact CZ3-CD2 3.49Å; W339-Y390 HydrophobicContact CZ3-CD2 3.49Å; W339-Y390 VanDerWaalsContact CZ3-CD2 3.49Å; W339-Y390 AromaticContact CZ3-CE2 3.93Å; W339-Y390 HydrophobicContact CZ3-CE2 3.93Å; W339-Y390 HydrophobicContact CZ3-CG 4.41Å; W339-A393 HydrophobicContact CB-CB 3.99Å; W339-F414 HydrophobicContact CB-CE1 4.29Å
340C89.8Confident69Low31 Ų3165.1 Ų65.121%0.20938%0.376CS..EExtended strand (participates in β ladder)trans-85.4120.6-177.7-169.10000110.7V385 K415C340-V385 CarbonylContact C-O 3.54Å; C340-V385 WeakPolarHBondContact CA-O 3.47Å; C340-K415 HydrophobicContact CB-CB 4.06Å; C340-K415 HydrophobicContact CB-CD 4.07Å; C340-K415 VanDerWaalsContact O-CB 3.3Å; C340-K415 WeakPolarHBondContact O-CB 3.38Å; C340-K415 PolarHBondContact O-N 3.07Å; C340-K415 WeakPolarHBondContact SG-CD 3.46Å
341I92.6Very high71.5Confident0 Ų064 Ų640%037%0.37CS..EExtended strand (participates in β ladder)trans-101.2132.4176.5-52.5175.7000107.7V343 F359 F384 V385 M387 A393 I397 V412 S413I341-V343 HydrophobicContact CG2-CG2 4.41Å; I341-F359 HydrophobicContact CD1-CD1 4.06Å; I341-F359 HydrophobicContact CD1-CE1 3.65Å; I341-F359 HydrophobicContact CG2-CE1 4.09Å; I341-F359 HydrophobicContact CG2-CZ 4.23Å; I341-F384 WeakPolarHBondContact O-CA 3.39Å; I341-V385 HydrophobicContact CB-CB 4.4Å; I341-V385 PolarHBondContact N-O 2.84Å; I341-V385 PolarHBondContact O-N 2.82Å; I341-M387 HydrophobicContact CD1-CG 3.95Å; I341-M387 HydrophobicContact CD1-SD 3.6Å; I341-A393 HydrophobicContact CD1-CB 3.84Å; I341-A393 HydrophobicContact CG1-CB 4.28Å; I341-I397 HydrophobicContact CD1-CD1 4.44Å; I341-I397 HydrophobicContact CD1-CG1 4.23Å; I341-I397 HydrophobicContact CG1-CD1 4.17Å; I341-I397 HydrophobicContact CG1-CG1 4.33Å; I341-I397 HydrophobicContact CG2-CD1 4.24Å; I341-I397 HydrophobicContact CG2-CG1 3.8Å; I341-V412 HydrophobicContact CG2-CG1 3.34Å; I341-S413 CarbonylContact C-O 3.48Å; I341-S413 WeakPolarHBondContact CA-O 3.27Å; I341-S413 WeakPolarHBondContact CG2-O 3.38Å
342F93.4Very high74.2Confident56 Ų5659.5 Ų59.525%0.24635%0.346CS..EExtended strand (participates in β ladder)trans-95126.4171.6177.6-118.4000109.3Y344 F382 F384 V412 S413 K415F342-Y344 HydrophobicContact CE1-CD2 4.07Å; F342-Y344 HydrophobicContact CE1-CG 4.16Å; F342-Y344 AromaticContact CZ-CD2 3.65Å; F342-Y344 HydrophobicContact CZ-CD2 3.65Å; F342-Y344 HydrophobicContact CZ-CG 4.17Å; F342-F382 HydrophobicContact CE2-CB 3.89Å; F342-F382 AromaticContact CE2-CD2 3.73Å; F342-F382 HydrophobicContact CE2-CD2 3.73Å; F342-F382 HydrophobicContact CE2-CG 4.09Å; F342-F382 HydrophobicContact CZ-CB 4.14Å; F342-F382 HydrophobicContact CZ-CD2 4.48Å; F342-F382 HydrophobicContact CZ-CG 4.48Å; F342-F384 AromaticContact CD2-CD1 3.97Å; F342-F384 HydrophobicContact CD2-CD1 3.97Å; F342-F384 AromaticContact CD2-CE1 3.45Å; F342-F384 HydrophobicContact CD2-CE1 3.45Å; F342-F384 VanDerWaalsContact CD2-CE1 3.45Å; F342-F384 AromaticContact CD2-CZ 3.96Å; F342-F384 HydrophobicContact CD2-CZ 3.96Å; F342-F384 HydrophobicContact CE2-CE1 4.08Å; F342-F384 HydrophobicContact CE2-CZ 4.13Å; F342-F384 HydrophobicContact CG-CE1 4.4Å; F342-V412 WeakPolarHBondContact O-CA 3.48Å; F342-S413 PolarHBondContact N-O 2.94Å; F342-S413 PolarHBondContact O-N 2.85Å; F342-K415 HydrophobicContact CB-CB 4.49Å
343V92.6Very high76.8Confident0 Ų058.9 Ų58.90%034%0.344CS..EExtended strand (participates in β ladder)trans-116.2121.5177.8-173.60000108.1I341 L346 L355 F359 F382 G383 V385 Q411 V412I341-V343 HydrophobicContact CG2-CG2 4.41Å; V343-L346 HydrophobicContact CG1-CD1 4.38Å; V343-L346 HydrophobicContact CG1-CD2 3.84Å; V343-L346 HydrophobicContact CG1-CG 4.1Å; V343-L355 HydrophobicContact CB-CD2 4.42Å; V343-L355 HydrophobicContact CG1-CD2 4.01Å; V343-L355 HydrophobicContact CG2-CD2 4.3Å; V343-F359 HydrophobicContact CG2-CE2 3.89Å; V343-F359 HydrophobicContact CG2-CZ 3.75Å; V343-F382 CarbonylContact O-C 3.57Å; V343-F382 WeakPolarHBondContact O-CA 3.33Å; V343-F382 WeakPolarHBondContact O-CB 3.18Å; V343-G383 PolarHBondContact N-O 2.92Å; V343-G383 PolarHBondContact O-N 2.9Å; V343-V385 HydrophobicContact CG2-CG2 4.12Å; V343-Q411 CarbonylContact C-O 3.52Å; V343-Q411 WeakPolarHBondContact CA-O 3.38Å; V343-V412 HydrophobicContact CG1-CG2 4.28Å; V343-V412 HydrophobicContact CG2-CG1 4.33Å
344Y91.8Very high79.5Confident106 Ų10659.2 Ų59.242%0.41633%0.333SS..EExtended strand (participates in β ladder)trans-122.8162.3-176.7-171.5-98.6000111.2F342 G381 F382 Q411F342-Y344 HydrophobicContact CE1-CD2 4.07Å; F342-Y344 HydrophobicContact CE1-CG 4.16Å; F342-Y344 AromaticContact CZ-CD2 3.65Å; F342-Y344 HydrophobicContact CZ-CD2 3.65Å; F342-Y344 HydrophobicContact CZ-CG 4.17Å; Y344-G381 CarbonylContact C-O 3.54Å; Y344-F382 HydrophobicContact CD2-CB 3.69Å; Y344-F382 HydrophobicContact CD2-CG 4.46Å; Y344-F382 HydrophobicContact CE2-CB 4.36Å; Y344-Q411 PolarHBondContact N-O 2.83Å; Y344-Q411 PolarHBondContact O-N 3.45Å
345N90.3Very high82.2Confident53 Ų5352.2 Ų52.228%0.28330%0.3SS..SBendtrans64.433.9-175.3-158.730.7000114.4G381 V409N345-G381 WeakPolarHBondContact CA-O 3.43Å; N345-G381 PolarHBondContact N-O 2.9Å; N345-V409 WeakPolarHBondContact CB-O 3.46Å; N345-V409 PolarHBondContact ND2-O 3.5Å
346L89.7Confident84.6Confident0 Ų054.2 Ų54.20%029%0.293CS..  trans-65.2152.3172-67.8170.7000111.2V343 A350 L355 V370 G381 R408 L410V343-L346 HydrophobicContact CG1-CD1 4.38Å; V343-L346 HydrophobicContact CG1-CD2 3.84Å; V343-L346 HydrophobicContact CG1-CG 4.1Å; L346-A350 HydrophobicContact CB-CB 4.09Å; L346-A350 HydrophobicContact CD2-CB 4.41Å; L346-L355 HydrophobicContact CD1-CD1 4.18Å; L346-L355 HydrophobicContact CD2-CD2 4.04Å; L346-V370 HydrophobicContact CD1-CG1 4.47Å; L346-V370 HydrophobicContact CD1-CG2 4.49Å; L346-G381 PolarHBondContact N-O 3.09Å; L346-R408 PolarHBondContact O-NH1 3.22Å; L346-L410 HydrophobicContact CD2-CD1 4.47Å; L346-L410 HydrophobicContact CD2-CD2 3.78Å; L346-L410 HydrophobicContact CG-CD2 4.5Å
347A85.2Confident86.8Confident16 Ų1659.3 Ų59.313%0.13230%0.304CS..  trans-66.5150172.900000110.7D349 A350A347-D349 WeakPolarHBondContact CB-OD1 3.48Å; A347-D349 PolarHBondContact O-N 2.83Å; A347-D349 VanDerWaalsContact O-N 3.17Å; A347-A350 HydrophobicContact CB-CB 4.1Å; A347-A350 VanDerWaalsContact O-CB 3.25Å; A347-A350 WeakPolarHBondContact O-CB 3.49Å; A347-A350 PolarHBondContact O-N 2.82Å
348P83.4Confident88.1Confident54 Ų5454.2 Ų54.235%0.35127%0.271SS..THydrogen-bonded Turntrans-64.7-17.5-178.127-34.4000113.6C379P348-C379 PolarHBondContact O-N 3.31Å
349D83.4Confident89.1Confident121 Ų12154 Ų5465%0.64727%0.268SS*.THydrogen-bonded Turntrans-102.94175.161.8-41.9000113.4A347 D351A347-D349 WeakPolarHBondContact CB-OD1 3.48Å; A347-D349 PolarHBondContact O-N 2.83Å; A347-D349 VanDerWaalsContact O-N 3.17Å; D349-D351 PolarHBondContact O-N 2.95Å
350A84.3Confident89.3Confident5 Ų550.3 Ų50.34%0.04127%0.267CS..  trans-74.8120.2-17800000112.3L346 A347 I354 C379L346-A350 HydrophobicContact CB-CB 4.09Å; L346-A350 HydrophobicContact CD2-CB 4.41Å; A347-A350 HydrophobicContact CB-CB 4.1Å; A347-A350 VanDerWaalsContact O-CB 3.25Å; A347-A350 WeakPolarHBondContact O-CB 3.49Å; A347-A350 PolarHBondContact O-N 2.82Å; A350-I354 HydrophobicContact CB-CG2 4.37Å; A350-C379 PolarHBondContact O-SG 3.01Å
351D88.1Confident89.4Confident75 Ų7554 Ų5440%0.40129%0.291SS..  trans-97.9168.1-179.2-64.5-39.7000114.1D349 S353 I354 R372D349-D351 PolarHBondContact O-N 2.95Å; D351-S353 PolarHBondContact O-N 2.77Å; D351-I354 VanDerWaalsContact O-CG2 3.25Å; D351-I354 WeakPolarHBondContact O-CG2 3.29Å; D351-I354 PolarHBondContact O-N 2.95Å; D351-R372 IonicContact OD1-CZ 2.67Å; D351-R372 IonicContact OD1-NH1 2.73Å; D351-R372 PolarHBondContact OD1-NH1 3.34Å; D351-R372 IonicContact OD1-NH2 3.6Å; D351-R372 PolarHBondContact OD1-NH2 2.78Å
352E89.3Confident89.2Confident61 Ų6156.7 Ų56.729%0.28530%0.303SS..Hα-helixtrans-56.2-34.2177-66.676.9-17300112.1I354 L355 W356 V368 V370 R372E352-I354 VanDerWaalsContact C-N 3.27Å; E352-I354 PolarHBondContact O-N 2.67Å; E352-L355 PolarHBondContact O-N 2.73Å; E352-L355 VanDerWaalsContact O-N 3.14Å; E352-W356 PolarHBondContact O-N 2.98Å; E352-V368 HydrophobicContact CB-CG1 3.95Å; E352-V368 HydrophobicContact CG-CG1 4.17Å; E352-V370 HydrophobicContact CG-CB 4.37Å; E352-V370 HydrophobicContact CG-CG2 4.01Å; E352-R372 IonicContact OE1-NE 3.65Å; E352-R372 IonicContact OE1-NH2 3.22Å; E352-R372 IonicContact OE2-CZ 3.79Å; E352-R372 IonicContact OE2-NH2 3.17Å; E352-R372 PolarHBondContact OE2-NH2 3.3Å
353S89.8Confident88.9Confident87 Ų8754.9 Ų54.961%0.60830%0.3SS*.Hα-helixtrans-57.3-37.4179.6-51.20000112.8D351 L355 W356 Q357D351-S353 PolarHBondContact O-N 2.77Å; S353-L355 VanDerWaalsContact C-N 3.34Å; S353-L355 PolarHBondContact O-N 2.81Å; S353-W356 PolarHBondContact O-N 2.82Å; S353-Q357 PolarHBondContact O-N 3.32Å
354I89.4Confident88.7Confident58 Ų5857.6 Ų57.630%0.29732%0.322SS..Hα-helixtrans-69-37.3-179.7-149.8157.1000111A350 D351 E352 Q357 M358 L405A350-I354 HydrophobicContact CB-CG2 4.37Å; D351-I354 VanDerWaalsContact O-CG2 3.25Å; D351-I354 WeakPolarHBondContact O-CG2 3.29Å; D351-I354 PolarHBondContact O-N 2.95Å; E352-I354 VanDerWaalsContact C-N 3.27Å; E352-I354 PolarHBondContact O-N 2.67Å; I354-Q357 PolarHBondContact O-N 2.95Å; I354-M358 WeakPolarHBondContact O-CB 3.08Å; I354-M358 WeakPolarHBondContact O-CG 2.96Å; I354-M358 PolarHBondContact O-N 3.03Å; I354-L405 HydrophobicContact CD1-CD1 3.82Å; I354-L405 HydrophobicContact CD1-CD2 4.09Å; I354-L405 HydrophobicContact CD1-CG 4.4Å; I354-L405 HydrophobicContact CG1-CD1 4.39Å; I354-L405 HydrophobicContact CG2-CD2 4.39Å
355L90.6Very high88.6Confident1 Ų153.5 Ų53.51%0.00531%0.308CS..Hα-helixtrans-69.8-39176.3-68.4176.8000111.4V343 L346 E352 S353 Q357 M358 F359 V368 V370 V385V343-L355 HydrophobicContact CB-CD2 4.42Å; V343-L355 HydrophobicContact CG1-CD2 4.01Å; V343-L355 HydrophobicContact CG2-CD2 4.3Å; L346-L355 HydrophobicContact CD1-CD1 4.18Å; L346-L355 HydrophobicContact CD2-CD2 4.04Å; E352-L355 PolarHBondContact O-N 2.73Å; E352-L355 VanDerWaalsContact O-N 3.14Å; S353-L355 VanDerWaalsContact C-N 3.34Å; S353-L355 PolarHBondContact O-N 2.81Å; L355-Q357 VanDerWaalsContact C-N 3.33Å; L355-Q357 PolarHBondContact O-N 3.21Å; L355-M358 PolarHBondContact O-N 3.02Å; L355-F359 HydrophobicContact CD2-CD2 4.46Å; L355-F359 HydrophobicContact CD2-CE2 4.08Å; L355-F359 WeakPolarHBondContact O-CB 3.42Å; L355-F359 WeakPolarHBondContact O-CD2 3.14Å; L355-F359 PolarHBondContact O-N 3.03Å; L355-V368 HydrophobicContact CB-CG1 3.64Å; L355-V368 HydrophobicContact CD1-CG1 3.72Å; L355-V368 HydrophobicContact CG-CG1 4.32Å; L355-V370 HydrophobicContact CD1-CG2 3.65Å; L355-V385 HydrophobicContact CB-CG2 4.21Å; L355-V385 HydrophobicContact CD1-CG2 4.23Å
356W91.5Very high88.5Confident112 Ų11254.2 Ų54.242%0.42431%0.314SS..Hα-helixtrans-58.1-45.9171.9-80.8108.6000112E352 S353 G360 V365 V368E352-W356 PolarHBondContact O-N 2.98Å; S353-W356 PolarHBondContact O-N 2.82Å; W356-G360 WeakPolarHBondContact O-CA 3.41Å; W356-G360 PolarHBondContact O-N 3.36Å; W356-V365 HydrophobicContact CD2-CG1 4.22Å; W356-V365 HydrophobicContact CE3-CB 3.66Å; W356-V365 HydrophobicContact CE3-CG1 3.67Å; W356-V365 HydrophobicContact CE3-CG2 4.47Å; W356-V365 HydrophobicContact CH2-CB 4Å; W356-V365 HydrophobicContact CH2-CG1 3.66Å; W356-V365 WeakPolarHBondContact CH2-O 3.18Å; W356-V365 HydrophobicContact CZ2-CG1 4.18Å; W356-V365 HydrophobicContact CZ3-CB 3.31Å; W356-V365 HydrophobicContact CZ3-CG1 3.41Å; W356-V365 VanDerWaalsContact CZ3-CG1 3.41Å; W356-V365 WeakPolarHBondContact CZ3-O 3.37Å; W356-V368 HydrophobicContact CD2-CB 4.49Å; W356-V368 HydrophobicContact CD2-CG2 3.66Å; W356-V368 HydrophobicContact CE3-CG2 4.37Å; W356-V368 HydrophobicContact CG-CG2 3.89Å; W356-V368 HydrophobicContact CZ2-CB 4.28Å; W356-V368 HydrophobicContact CZ2-CG2 3.87Å
357Q90.1Very high88.3Confident155 Ų15558.3 Ų58.372%0.72434%0.336SS*.Hα-helixtrans-67.1-37.3179.9-174172.9-15.600112.6S353 I354 L355 P361S353-Q357 PolarHBondContact O-N 3.32Å; I354-Q357 PolarHBondContact O-N 2.95Å; L355-Q357 VanDerWaalsContact C-N 3.33Å; L355-Q357 PolarHBondContact O-N 3.21Å; Q357-P361 VanDerWaalsContact O-CD 3.27Å; Q357-P361 WeakPolarHBondContact O-CD 3.25Å
358M88.7Confident88.5Confident23 Ų2358.3 Ų58.311%0.11334%0.335CS..Hα-helixtrans-75.6-37.4-179.9-66.7-128.7-66.700113.2I354 L355 F362 L400 Y403 L410I354-M358 WeakPolarHBondContact O-CB 3.08Å; I354-M358 WeakPolarHBondContact O-CG 2.96Å; I354-M358 PolarHBondContact O-N 3.03Å; L355-M358 PolarHBondContact O-N 3.02Å; M358-F362 VanDerWaalsContact O-CD2 3.29Å; M358-F362 WeakPolarHBondContact O-CD2 3.46Å; M358-F362 WeakPolarHBondContact O-CE2 3.25Å; M358-L400 HydrophobicContact CB-CD1 4.37Å; M358-L400 HydrophobicContact CB-CD2 4.39Å; M358-L400 HydrophobicContact CE-CD2 4.33Å; M358-L400 HydrophobicContact SD-CD2 4.3Å; M358-Y403 HydrophobicContact CE-CD1 3.81Å; M358-Y403 HydrophobicContact CE-CE1 4.07Å; M358-Y403 HydrophobicContact SD-CD1 3.78Å; M358-Y403 HydrophobicContact SD-CE1 3.46Å; M358-Y403 WeakPolarHBondContact SD-CE1 3.47Å; M358-L410 HydrophobicContact CE-CD1 3.29Å
359F91.6Very high88.8Confident1 Ų159 Ų590%0.00433%0.332CS..Hα-helixtrans-89.5-20.2-178-77.2-96.1000113.8I341 V343 L355 F362 V365 V385 M387 A396 L400 V412I341-F359 HydrophobicContact CD1-CD1 4.06Å; I341-F359 HydrophobicContact CD1-CE1 3.65Å; I341-F359 HydrophobicContact CG2-CE1 4.09Å; I341-F359 HydrophobicContact CG2-CZ 4.23Å; V343-F359 HydrophobicContact CG2-CE2 3.89Å; V343-F359 HydrophobicContact CG2-CZ 3.75Å; L355-F359 HydrophobicContact CD2-CD2 4.46Å; L355-F359 HydrophobicContact CD2-CE2 4.08Å; L355-F359 WeakPolarHBondContact O-CB 3.42Å; L355-F359 WeakPolarHBondContact O-CD2 3.14Å; L355-F359 PolarHBondContact O-N 3.03Å; F359-F362 PolarHBondContact O-N 3.12Å; F359-F362 VanDerWaalsContact O-N 3.13Å; F359-V365 HydrophobicContact CB-CG2 3.64Å; F359-V385 HydrophobicContact CB-CG1 4.15Å; F359-V385 HydrophobicContact CD1-CG1 4.02Å; F359-V385 HydrophobicContact CD2-CG1 4.34Å; F359-V385 HydrophobicContact CD2-CG2 3.97Å; F359-V385 HydrophobicContact CE2-CG2 3.94Å; F359-V385 HydrophobicContact CG-CG1 3.91Å; F359-V385 HydrophobicContact CG-CG2 4.37Å; F359-V385 HydrophobicContact CZ-CG2 4.33Å; F359-M387 HydrophobicContact CD1-SD 4.04Å; F359-A396 HydrophobicContact CD1-CB 3.88Å; F359-A396 HydrophobicContact CE1-CB 3.98Å; F359-L400 HydrophobicContact CD1-CD1 3.89Å; F359-L400 HydrophobicContact CD2-CD1 3.78Å; F359-L400 HydrophobicContact CE1-CD1 3.69Å; F359-L400 HydrophobicContact CE2-CD1 3.59Å; F359-L400 HydrophobicContact CG-CD1 3.94Å; F359-L400 HydrophobicContact CZ-CD1 3.55Å; F359-V412 HydrophobicContact CE1-CG1 4.27Å; F359-V412 HydrophobicContact CZ-CG1 3.82Å
360G89.1Confident89.1Confident41 Ų4153.7 Ų53.742%0.42330%0.304SS..G310 helixtrans-56.4-40.7-179.600000115.8W356 F362 G363W356-G360 WeakPolarHBondContact O-CA 3.41Å; W356-G360 PolarHBondContact O-N 3.36Å; G360-F362 PolarHBondContact O-N 2.74Å; G360-G363 PolarHBondContact O-N 2.76Å
361P92.3Very high89.2Confident108 Ų10855 Ų5570%0.70131%0.31SS*.G310 helixtrans-64.9-21.7177.2-24.234.3000114.4Q357Q357-P361 VanDerWaalsContact O-CD 3.27Å; Q357-P361 WeakPolarHBondContact O-CD 3.25Å
362F89.5Confident89.3Confident58 Ų5854.9 Ų54.925%0.25430%0.304SS..G310 helixtrans-91.7-18.6-175.6-60.9-77.2000113.2M358 F359 G360 M387 E392 V395 A396 S399 L400M358-F362 VanDerWaalsContact O-CD2 3.29Å; M358-F362 WeakPolarHBondContact O-CD2 3.46Å; M358-F362 WeakPolarHBondContact O-CE2 3.25Å; F359-F362 PolarHBondContact O-N 3.12Å; F359-F362 VanDerWaalsContact O-N 3.13Å; G360-F362 PolarHBondContact O-N 2.74Å; F362-M387 HydrophobicContact CB-CE 4.24Å; F362-E392 VanDerWaalsContact O-CB 3.25Å; F362-E392 WeakPolarHBondContact O-CB 3.33Å; F362-E392 WeakPolarHBondContact O-CG 3.3Å; F362-V395 HydrophobicContact CD1-CG1 4.07Å; F362-V395 HydrophobicContact CE1-CG1 4.46Å; F362-A396 HydrophobicContact CB-CB 3.65Å; F362-A396 HydrophobicContact CD1-CB 4.34Å; F362-A396 HydrophobicContact CD2-CB 4.04Å; F362-A396 HydrophobicContact CG-CB 3.75Å; F362-S399 WeakPolarHBondContact CE1-OG 3.39Å; F362-L400 HydrophobicContact CD2-CD1 4.17Å; F362-L400 HydrophobicContact CE2-CD1 3.85Å; F362-L400 HydrophobicContact CE2-CD2 4.06Å; F362-L400 HydrophobicContact CE2-CG 3.87Å; F362-L400 HydrophobicContact CZ-CD2 4.5Å; F362-L400 HydrophobicContact CZ-CG 4.33Å
363G86.5Confident89Confident18 Ų1854.5 Ų54.519%0.18630%0.304CS..SBendtrans164.1178-178.300000114.7G360 V365 M387 E392G360-G363 PolarHBondContact O-N 2.76Å; G363-V365 PolarHBondContact O-N 3.37Å; G363-M387 VanDerWaalsContact CA-CE 3.48Å; G363-E392 WeakPolarHBondContact CA-OE2 3.34Å
364A87.6Confident88.4Confident56 Ų5659.3 Ų59.346%0.46331%0.314SS..  trans-72.5111.417900000110.6T388 E392A364-T388 HydrophobicContact CB-CG2 4.18Å; A364-T388 PolarHBondContact O-N 2.97Å; A364-T388 VanDerWaalsContact O-N 3.12Å; A364-E392 PolarHBondContact N-OE2 2.95Å
365V90.1Very high88Confident20 Ų2063.1 Ų63.112%0.12134%0.335CS..EExtended strand (participates in β ladder)trans-85.1122.2175.9179.70000108.9W356 F359 G363 V368 V385 M387W356-V365 HydrophobicContact CD2-CG1 4.22Å; W356-V365 HydrophobicContact CE3-CB 3.66Å; W356-V365 HydrophobicContact CE3-CG1 3.67Å; W356-V365 HydrophobicContact CE3-CG2 4.47Å; W356-V365 HydrophobicContact CH2-CB 4Å; W356-V365 HydrophobicContact CH2-CG1 3.66Å; W356-V365 WeakPolarHBondContact CH2-O 3.18Å; W356-V365 HydrophobicContact CZ2-CG1 4.18Å; W356-V365 HydrophobicContact CZ3-CB 3.31Å; W356-V365 HydrophobicContact CZ3-CG1 3.41Å; W356-V365 VanDerWaalsContact CZ3-CG1 3.41Å; W356-V365 WeakPolarHBondContact CZ3-O 3.37Å; F359-V365 HydrophobicContact CB-CG2 3.64Å; G363-V365 PolarHBondContact O-N 3.37Å; V365-V368 HydrophobicContact CG1-CG2 3.56Å; V365-V385 HydrophobicContact CG1-CG1 3.73Å; V365-V385 HydrophobicContact CG2-CG1 4.32Å; V365-M387 HydrophobicContact CG2-CG 4.44Å
366T88.2Confident87.6Confident68 Ų6867.1 Ų67.142%0.41736%0.36SS..EExtended strand (participates in β ladder)trans-86.5-38-179.9-49.90000111.3T386 T388T366-T386 PolarHBondContact N-O 3.18Å; T366-T388 VanDerWaalsContact OG1-CG2 3.29Å; T366-T388 WeakPolarHBondContact OG1-CG2 3.42Å
367N85.2Confident86.8Confident87 Ų8767.5 Ų67.547%0.46537%0.37SS..EExtended strand (participates in β ladder)trans-155.9142.7-175-156.2-94.4000111.7V385 T386N367-V385 CarbonylContact O-C 3.56Å; N367-V385 WeakPolarHBondContact O-CA 3.16Å; N367-T386 PolarHBondContact N-O 3Å; N367-T386 PolarHBondContact O-N 3.37Å
368V89.9Confident86.4Confident16 Ų1666.2 Ų66.210%0.09736%0.362CS..EExtended strand (participates in β ladder)trans-130.4134.6171.7177.90000107.9E352 L355 W356 V365 F384 V385E352-V368 HydrophobicContact CB-CG1 3.95Å; E352-V368 HydrophobicContact CG-CG1 4.17Å; L355-V368 HydrophobicContact CB-CG1 3.64Å; L355-V368 HydrophobicContact CD1-CG1 3.72Å; L355-V368 HydrophobicContact CG-CG1 4.32Å; W356-V368 HydrophobicContact CD2-CB 4.49Å; W356-V368 HydrophobicContact CD2-CG2 3.66Å; W356-V368 HydrophobicContact CE3-CG2 4.37Å; W356-V368 HydrophobicContact CG-CG2 3.89Å; W356-V368 HydrophobicContact CZ2-CB 4.28Å; W356-V368 HydrophobicContact CZ2-CG2 3.87Å; V365-V368 HydrophobicContact CG1-CG2 3.56Å; V368-F384 CarbonylContact C-O 3.51Å; V368-F384 WeakPolarHBondContact CA-O 3.44Å; V368-V385 HydrophobicContact CG1-CG2 4.42Å; V368-V385 HydrophobicContact CG2-CG1 4.25Å; V368-V385 HydrophobicContact CG2-CG2 4.28Å
369K88.8Confident86.1Confident69 Ų6965.7 Ų65.730%0.336%0.361SS..EExtended strand (participates in β ladder)trans-140.1115.2176.6-175.8177.6-178.5-1800110.6N330 I371 G383 F384N330-K369 PolarHBondContact ND2-NZ 3.18Å; K369-I371 HydrophobicContact CD-CD1 4.07Å; K369-I371 HydrophobicContact CG-CD1 4.14Å; K369-G383 CarbonylContact O-C 3.54Å; K369-G383 WeakPolarHBondContact O-CA 3.12Å; K369-F384 PolarHBondContact N-O 3.03Å; K369-F384 PolarHBondContact O-N 3.5Å
370V90.1Very high85.6Confident8 Ų871.1 Ų71.15%0.04838%0.384CS..EExtended strand (participates in β ladder)trans-90.8134.8169.6-179.50000109L346 E352 L355 R372 C379L346-V370 HydrophobicContact CD1-CG1 4.47Å; L346-V370 HydrophobicContact CD1-CG2 4.49Å; E352-V370 HydrophobicContact CG-CB 4.37Å; E352-V370 HydrophobicContact CG-CG2 4.01Å; L355-V370 HydrophobicContact CD1-CG2 3.65Å; V370-R372 HydrophobicContact CG1-CG 4.37Å; V370-C379 HydrophobicContact CG1-CB 3.96Å
371I88Confident85.5Confident33 Ų3369.6 Ų69.617%0.16937%0.368CS..EExtended strand (participates in β ladder)trans-87.8119175.9-56.3-52.9000108.6K369 K380 F382 F384K369-I371 HydrophobicContact CD-CD1 4.07Å; K369-I371 HydrophobicContact CG-CD1 4.14Å; I371-K380 HydrophobicContact CG2-CB 4.48Å; I371-K380 HydrophobicContact CG2-CD 3.82Å; I371-K380 HydrophobicContact CG2-CG 4.27Å; I371-K380 WeakPolarHBondContact O-CB 3.43Å; I371-K380 PolarHBondContact O-N 3.14Å; I371-F382 HydrophobicContact CB-CD2 4.08Å; I371-F382 HydrophobicContact CB-CE1 4.34Å; I371-F382 HydrophobicContact CB-CE2 3.67Å; I371-F382 HydrophobicContact CB-CZ 3.79Å; I371-F382 HydrophobicContact CG1-CD2 3.83Å; I371-F382 HydrophobicContact CG1-CE2 3.37Å; I371-F382 HydrophobicContact CG1-CZ 3.97Å; I371-F382 HydrophobicContact CG2-CE1 4.35Å; I371-F382 HydrophobicContact CG2-CE2 4.08Å; I371-F382 HydrophobicContact CG2-CZ 3.75Å; I371-F382 PolarHBondContact N-O 3.17Å; I371-F384 HydrophobicContact CD1-CD2 4.26Å; I371-F384 HydrophobicContact CD1-CE2 4.07Å; I371-F384 HydrophobicContact CG1-CD2 4.17Å; I371-F384 HydrophobicContact CG1-CE2 3.74Å
372R88.5Confident85.4Confident72 Ų7267 Ų6727%0.27235%0.346SS..EExtended strand (participates in β ladder)trans-110.7152.5178.7-59.7176-167.8-105.66.1110.5D351 E352 V370 K378 C379D351-R372 IonicContact OD1-CZ 2.67Å; D351-R372 IonicContact OD1-NH1 2.73Å; D351-R372 PolarHBondContact OD1-NH1 3.34Å; D351-R372 IonicContact OD1-NH2 3.6Å; D351-R372 PolarHBondContact OD1-NH2 2.78Å; E352-R372 IonicContact OE1-NE 3.65Å; E352-R372 IonicContact OE1-NH2 3.22Å; E352-R372 IonicContact OE2-CZ 3.79Å; E352-R372 IonicContact OE2-NH2 3.17Å; E352-R372 PolarHBondContact OE2-NH2 3.3Å; V370-R372 HydrophobicContact CG1-CG 4.37Å; R372-K378 CarbonylContact C-O 3.55Å; R372-K378 VanDerWaalsContact CA-O 3.27Å; R372-K378 WeakPolarHBondContact CA-O 3.49Å; R372-C379 PolarHBondContact NH1-SG 2.8Å
373D82.8Confident85.5Confident54 Ų5464.2 Ų64.229%0.28933%0.334SS..  trans-73.7134172.3-157.6-59.5000109.5N375 N377 K378 K380D373-N375 PolarHBondContact O-N 3.02Å; D373-N375 PolarHBondContact OD1-N 2.75Å; D373-N375 VanDerWaalsContact OD1-N 3.09Å; D373-N377 VanDerWaalsContact O-CA 3.27Å; D373-N377 WeakPolarHBondContact O-CA 3.1Å; D373-N377 PolarHBondContact O-N 3.17Å; D373-K378 PolarHBondContact N-O 2.92Å; D373-K380 HydrophobicContact CB-CD 4.45Å; D373-K380 HydrophobicContact CB-CG 4.13Å
374F78.8Confident85.8Confident187 Ų18765.1 Ų65.182%0.8233%0.333SS*.THydrogen-bonded Turntrans-67.6-26.5-176.4-175-101.3000112.3
375N80.4Confident86.1Confident138 Ų13862.5 Ų62.574%0.73831%0.311SS*.THydrogen-bonded Turntrans-89.7-30.4-176.3-60.1139.9000113.5D373D373-N375 PolarHBondContact O-N 3.02Å; D373-N375 PolarHBondContact OD1-N 2.75Å; D373-N375 VanDerWaalsContact OD1-N 3.09Å
376T81.4Confident86.1Confident85 Ų8562.7 Ų62.752%0.52131%0.312SS..THydrogen-bonded Turntrans-111.6-7.9-175.963.20000113.7K378T376-K378 PolarHBondContact O-N 2.72Å; T376-K378 PolarHBondContact OG1-N 3.39Å
377N76.3Confident86.2Confident120 Ų12059.4 Ų59.464%0.64229%0.292SS*.  trans53.48.6-170.1-78.1-75.8000114.9D373D373-N377 VanDerWaalsContact O-CA 3.27Å; D373-N377 WeakPolarHBondContact O-CA 3.1Å; D373-N377 PolarHBondContact O-N 3.17Å
378K79.8Confident86.3Confident129 Ų12957.8 Ų57.856%0.56129%0.285SS*.  trans-82.4151.1177.2-70179.9178.4-74.90110.6R372 D373 T376 K380R372-K378 CarbonylContact C-O 3.55Å; R372-K378 VanDerWaalsContact CA-O 3.27Å; R372-K378 WeakPolarHBondContact CA-O 3.49Å; D373-K378 PolarHBondContact N-O 2.92Å; T376-K378 PolarHBondContact O-N 2.72Å; T376-K378 PolarHBondContact OG1-N 3.39Å; K378-K380 PolarHBondContact O-N 2.9Å
379C82.4Confident86.3Confident12 Ų1260.6 Ų60.68%0.08130%0.3CS..EExtended strand (participates in β ladder)trans-68131.4-179.2-59.10000110.2P348 A350 V370 R372 G381P348-C379 PolarHBondContact O-N 3.31Å; A350-C379 PolarHBondContact O-SG 3.01Å; V370-C379 HydrophobicContact CG1-CB 3.96Å; R372-C379 PolarHBondContact NH1-SG 2.8Å; C379-G381 PolarHBondContact O-N 2.74Å
380K83Confident86.3Confident115 Ų11562.3 Ų62.350%0.531%0.305SS..EExtended strand (participates in β ladder)trans-73.19.7176.8-57.6-169.581168.50112.6I371 D373 K378 F382I371-K380 HydrophobicContact CG2-CB 4.48Å; I371-K380 HydrophobicContact CG2-CD 3.82Å; I371-K380 HydrophobicContact CG2-CG 4.27Å; I371-K380 WeakPolarHBondContact O-CB 3.43Å; I371-K380 PolarHBondContact O-N 3.14Å; D373-K380 HydrophobicContact CB-CD 4.45Å; D373-K380 HydrophobicContact CB-CG 4.13Å; K378-K380 PolarHBondContact O-N 2.9Å; K380-F382 HydrophobicContact CB-CD1 4.1Å; K380-F382 HydrophobicContact CB-CE1 3.76Å; K380-F382 WeakPolarHBondContact O-CD1 3.32Å
381G86Confident86.3Confident8 Ų867.8 Ų67.88%0.08233%0.334CS..EExtended strand (participates in β ladder)trans84.511.6179.300000114.9Y344 N345 L346 C379Y344-G381 CarbonylContact C-O 3.54Å; N345-G381 WeakPolarHBondContact CA-O 3.43Å; N345-G381 PolarHBondContact N-O 2.9Å; L346-G381 PolarHBondContact N-O 3.09Å; C379-G381 PolarHBondContact O-N 2.74Å
382F90.7Very high86.5Confident53 Ų5369.1 Ų69.123%0.23234%0.34CS..EExtended strand (participates in β ladder)trans-150.9156.5177.468.6-86.9000113.8F342 V343 Y344 I371 K380 F384F342-F382 HydrophobicContact CE2-CB 3.89Å; F342-F382 AromaticContact CE2-CD2 3.73Å; F342-F382 HydrophobicContact CE2-CD2 3.73Å; F342-F382 HydrophobicContact CE2-CG 4.09Å; F342-F382 HydrophobicContact CZ-CB 4.14Å; F342-F382 HydrophobicContact CZ-CD2 4.48Å; F342-F382 HydrophobicContact CZ-CG 4.48Å; V343-F382 CarbonylContact O-C 3.57Å; V343-F382 WeakPolarHBondContact O-CA 3.33Å; V343-F382 WeakPolarHBondContact O-CB 3.18Å; Y344-F382 HydrophobicContact CD2-CB 3.69Å; Y344-F382 HydrophobicContact CD2-CG 4.46Å; Y344-F382 HydrophobicContact CE2-CB 4.36Å; I371-F382 HydrophobicContact CB-CD2 4.08Å; I371-F382 HydrophobicContact CB-CE1 4.34Å; I371-F382 HydrophobicContact CB-CE2 3.67Å; I371-F382 HydrophobicContact CB-CZ 3.79Å; I371-F382 HydrophobicContact CG1-CD2 3.83Å; I371-F382 HydrophobicContact CG1-CE2 3.37Å; I371-F382 HydrophobicContact CG1-CZ 3.97Å; I371-F382 HydrophobicContact CG2-CE1 4.35Å; I371-F382 HydrophobicContact CG2-CE2 4.08Å; I371-F382 HydrophobicContact CG2-CZ 3.75Å; I371-F382 PolarHBondContact N-O 3.17Å; K380-F382 HydrophobicContact CB-CD1 4.1Å; K380-F382 HydrophobicContact CB-CE1 3.76Å; K380-F382 WeakPolarHBondContact O-CD1 3.32Å; F382-F384 HydrophobicContact CD2-CE2 4.03Å; F382-F384 HydrophobicContact CD2-CZ 4.2Å; F382-F384 AromaticContact CE2-CE2 3.96Å; F382-F384 HydrophobicContact CE2-CE2 3.96Å; F382-F384 HydrophobicContact CE2-CZ 4.16Å
383G90.9Very high86.6Confident0 Ų065.7 Ų65.70%033%0.327CS..EExtended strand (participates in β ladder)trans-151.4173.6-178.200000112.1V343 K369V343-G383 PolarHBondContact N-O 2.92Å; V343-G383 PolarHBondContact O-N 2.9Å; K369-G383 CarbonylContact O-C 3.54Å; K369-G383 WeakPolarHBondContact O-CA 3.12Å
384F93.2Very high86.9Confident38 Ų3864.7 Ų64.717%0.16733%0.326CS..EExtended strand (participates in β ladder)trans-129.4135.2-179-59.3-82.5000109.2I341 F342 V368 K369 I371 F382 K415I341-F384 WeakPolarHBondContact O-CA 3.39Å; F342-F384 AromaticContact CD2-CD1 3.97Å; F342-F384 HydrophobicContact CD2-CD1 3.97Å; F342-F384 AromaticContact CD2-CE1 3.45Å; F342-F384 HydrophobicContact CD2-CE1 3.45Å; F342-F384 VanDerWaalsContact CD2-CE1 3.45Å; F342-F384 AromaticContact CD2-CZ 3.96Å; F342-F384 HydrophobicContact CD2-CZ 3.96Å; F342-F384 HydrophobicContact CE2-CE1 4.08Å; F342-F384 HydrophobicContact CE2-CZ 4.13Å; F342-F384 HydrophobicContact CG-CE1 4.4Å; V368-F384 CarbonylContact C-O 3.51Å; V368-F384 WeakPolarHBondContact CA-O 3.44Å; K369-F384 PolarHBondContact N-O 3.03Å; K369-F384 PolarHBondContact O-N 3.5Å; I371-F384 HydrophobicContact CD1-CD2 4.26Å; I371-F384 HydrophobicContact CD1-CE2 4.07Å; I371-F384 HydrophobicContact CG1-CD2 4.17Å; I371-F384 HydrophobicContact CG1-CE2 3.74Å; F382-F384 HydrophobicContact CD2-CE2 4.03Å; F382-F384 HydrophobicContact CD2-CZ 4.2Å; F382-F384 AromaticContact CE2-CE2 3.96Å; F382-F384 HydrophobicContact CE2-CE2 3.96Å; F382-F384 HydrophobicContact CE2-CZ 4.16Å; F384-K415 HydrophobicContact CD1-CD 4.04Å; F384-K415 HydrophobicContact CE1-CD 4.03Å; F384-K415 HydrophobicContact CE1-CG 4.43Å
385V93.1Very high87.6Confident0 Ų059.7 Ų59.70%031%0.31CS..EExtended strand (participates in β ladder)trans-121.3136.1174-178.80000107.5C340 I341 V343 L355 F359 V365 N367 V368 M387C340-V385 CarbonylContact C-O 3.54Å; C340-V385 WeakPolarHBondContact CA-O 3.47Å; I341-V385 HydrophobicContact CB-CB 4.4Å; I341-V385 PolarHBondContact N-O 2.84Å; I341-V385 PolarHBondContact O-N 2.82Å; V343-V385 HydrophobicContact CG2-CG2 4.12Å; L355-V385 HydrophobicContact CB-CG2 4.21Å; L355-V385 HydrophobicContact CD1-CG2 4.23Å; F359-V385 HydrophobicContact CB-CG1 4.15Å; F359-V385 HydrophobicContact CD1-CG1 4.02Å; F359-V385 HydrophobicContact CD2-CG1 4.34Å; F359-V385 HydrophobicContact CD2-CG2 3.97Å; F359-V385 HydrophobicContact CE2-CG2 3.94Å; F359-V385 HydrophobicContact CG-CG1 3.91Å; F359-V385 HydrophobicContact CG-CG2 4.37Å; F359-V385 HydrophobicContact CZ-CG2 4.33Å; V365-V385 HydrophobicContact CG1-CG1 3.73Å; V365-V385 HydrophobicContact CG2-CG1 4.32Å; N367-V385 CarbonylContact O-C 3.56Å; N367-V385 WeakPolarHBondContact O-CA 3.16Å; V368-V385 HydrophobicContact CG1-CG2 4.42Å; V368-V385 HydrophobicContact CG2-CG1 4.25Å; V368-V385 HydrophobicContact CG2-CG2 4.28Å; V385-M387 HydrophobicContact CG1-CG 4.34Å
386T90.7Very high88.2Confident24 Ų2453.1 Ų53.115%0.14728%0.275CS..EExtended strand (participates in β ladder)trans-116.4120.7176.7-52.20000108.1W339 T366 N367W339-T386 WeakPolarHBondContact O-CA 3.46Å; T366-T386 PolarHBondContact N-O 3.18Å; N367-T386 PolarHBondContact N-O 3Å; N367-T386 PolarHBondContact O-N 3.37Å
387M89.4Confident88.8Confident0 Ų050 Ų500%026%0.255CS..EExtended strand (participates in β ladder)trans-106.9155.3176.9-61.8-170.173.300110.6G338 W339 I341 F359 F362 G363 V365 V385 E392 A393 A396G338-M387 CarbonylContact C-O 3.55Å; G338-M387 VanDerWaalsContact C-O 3.27Å; G338-M387 WeakPolarHBondContact CA-O 3.42Å; W339-M387 PolarHBondContact N-O 3.26Å; W339-M387 PolarHBondContact O-N 3.42Å; I341-M387 HydrophobicContact CD1-CG 3.95Å; I341-M387 HydrophobicContact CD1-SD 3.6Å; F359-M387 HydrophobicContact CD1-SD 4.04Å; F362-M387 HydrophobicContact CB-CE 4.24Å; G363-M387 VanDerWaalsContact CA-CE 3.48Å; V365-M387 HydrophobicContact CG2-CG 4.44Å; V385-M387 HydrophobicContact CG1-CG 4.34Å; M387-E392 HydrophobicContact CE-CB 4.09Å; M387-A393 HydrophobicContact CB-CB 4.21Å; M387-A393 HydrophobicContact SD-CB 4.07Å; M387-A396 HydrophobicContact SD-CB 4.01Å
388T88.4Confident89.6Confident53 Ų5348.2 Ų48.233%0.32526%0.257SS..SBendtrans-72-39.1179.152.50000112.7A364 T366A364-T388 HydrophobicContact CB-CG2 4.18Å; A364-T388 PolarHBondContact O-N 2.97Å; A364-T388 VanDerWaalsContact O-N 3.12Å; T366-T388 VanDerWaalsContact OG1-CG2 3.29Å; T366-T388 WeakPolarHBondContact OG1-CG2 3.42Å
389N89.4Confident90.1Very high74 Ų7445 Ų4540%0.39625%0.251SS..  trans-111146.8-170.7-65.2-31000112.7E392 A393N389-E392 HydrophobicContact CB-CB 4.04Å; N389-E392 HydrophobicContact CB-CG 3.98Å; N389-E392 VanDerWaalsContact ND2-CD 3.3Å; N389-E392 PolarHBondContact ND2-OE1 3.39Å; N389-E392 PolarHBondContact ND2-OE2 3.47Å; N389-A393 VanDerWaalsContact O-CB 3.32Å; N389-A393 WeakPolarHBondContact O-CB 3.39Å; N389-A393 PolarHBondContact O-N 3.37Å
390Y89.4Confident90.6Very high106 Ų10644.9 Ų44.942%0.41625%0.249SC..Hα-helixtrans-72.6-50.4-179.3177.9-107.8000111.7W339 E392 A393 A394 F414W339-Y390 VanDerWaalsContact CD1-CA 3.49Å; W339-Y390 AromaticContact CD2-CD2 3.61Å; W339-Y390 HydrophobicContact CD2-CD2 3.61Å; W339-Y390 HydrophobicContact CD2-CG 4.25Å; W339-Y390 VanDerWaalsContact CE2-CB 3.44Å; W339-Y390 AromaticContact CE2-CD2 3.83Å; W339-Y390 AromaticContact CE3-CD2 3.45Å; W339-Y390 HydrophobicContact CE3-CD2 3.45Å; W339-Y390 VanDerWaalsContact CE3-CD2 3.45Å; W339-Y390 HydrophobicContact CE3-CE2 4.11Å; W339-Y390 HydrophobicContact CE3-CG 4.45Å; W339-Y390 HydrophobicContact CG-CD2 4.33Å; W339-Y390 AromaticContact CH2-CD2 3.7Å; W339-Y390 HydrophobicContact CH2-CD2 3.7Å; W339-Y390 HydrophobicContact CH2-CE2 4.35Å; W339-Y390 HydrophobicContact CH2-CG 4.2Å; W339-Y390 AromaticContact CZ2-CD2 3.89Å; W339-Y390 HydrophobicContact CZ2-CD2 3.89Å; W339-Y390 HydrophobicContact CZ2-CG 4.04Å; W339-Y390 AromaticContact CZ3-CD2 3.49Å; W339-Y390 HydrophobicContact CZ3-CD2 3.49Å; W339-Y390 VanDerWaalsContact CZ3-CD2 3.49Å; W339-Y390 AromaticContact CZ3-CE2 3.93Å; W339-Y390 HydrophobicContact CZ3-CE2 3.93Å; W339-Y390 HydrophobicContact CZ3-CG 4.41Å; Y390-E392 VanDerWaalsContact C-N 3.34Å; Y390-E392 PolarHBondContact O-N 2.93Å; Y390-A393 CarbonylContact O-C 3.59Å; Y390-A393 WeakPolarHBondContact O-CA 3.25Å; Y390-A393 WeakPolarHBondContact O-CB 3.22Å; Y390-A393 PolarHBondContact O-N 3.05Å; Y390-A393 VanDerWaalsContact O-N 3.1Å; Y390-A394 PolarHBondContact O-N 3.33Å; Y390-F414 HydrophobicContact CD2-CE1 4.24Å; Y390-F414 AromaticContact CD2-CZ 3.95Å; Y390-F414 HydrophobicContact CD2-CZ 3.95Å; Y390-F414 HydrophobicContact CE2-CE1 4.11Å; Y390-F414 AromaticContact CE2-CE2 3.96Å; Y390-F414 HydrophobicContact CE2-CE2 3.96Å; Y390-F414 AromaticContact CE2-CZ 3.54Å; Y390-F414 HydrophobicContact CE2-CZ 3.54Å
391D90.2Very high91Very high122 Ų12243.6 Ų43.665%0.65225%0.248SC*.Hα-helixtrans-62.4-43.2-175.4-61.1-84.3000111.1A393 A394 V395D391-A393 PolarHBondContact O-N 2.78Å; D391-A394 PolarHBondContact O-N 2.78Å; D391-V395 WeakPolarHBondContact O-CG2 3.27Å; D391-V395 PolarHBondContact O-N 3.26Å
392E90.8Very high91.1Very high62 Ų6245.2 Ų45.229%0.2927%0.265SS..Hα-helixtrans-59.1-44.2172.2-70.4174.6-161.600112F362 G363 A364 M387 N389 Y390 A394 V395 A396F362-E392 VanDerWaalsContact O-CB 3.25Å; F362-E392 WeakPolarHBondContact O-CB 3.33Å; F362-E392 WeakPolarHBondContact O-CG 3.3Å; G363-E392 WeakPolarHBondContact CA-OE2 3.34Å; A364-E392 PolarHBondContact N-OE2 2.95Å; M387-E392 HydrophobicContact CE-CB 4.09Å; N389-E392 HydrophobicContact CB-CB 4.04Å; N389-E392 HydrophobicContact CB-CG 3.98Å; N389-E392 VanDerWaalsContact ND2-CD 3.3Å; N389-E392 PolarHBondContact ND2-OE1 3.39Å; N389-E392 PolarHBondContact ND2-OE2 3.47Å; Y390-E392 VanDerWaalsContact C-N 3.34Å; Y390-E392 PolarHBondContact O-N 2.93Å; E392-A394 PolarHBondContact O-N 2.97Å; E392-V395 PolarHBondContact O-N 3.13Å; E392-A396 WeakPolarHBondContact O-CB 3.5Å; E392-A396 PolarHBondContact O-N 3.43Å
393A90.5Very high91.1Very high0 Ų047.9 Ų47.90%027%0.274CS..Hα-helixtrans-64.2-39.2176.600000112.5W339 I341 M387 N389 Y390 D391 A396 I397 F414W339-A393 HydrophobicContact CB-CB 3.99Å; I341-A393 HydrophobicContact CD1-CB 3.84Å; I341-A393 HydrophobicContact CG1-CB 4.28Å; M387-A393 HydrophobicContact CB-CB 4.21Å; M387-A393 HydrophobicContact SD-CB 4.07Å; N389-A393 VanDerWaalsContact O-CB 3.32Å; N389-A393 WeakPolarHBondContact O-CB 3.39Å; N389-A393 PolarHBondContact O-N 3.37Å; Y390-A393 CarbonylContact O-C 3.59Å; Y390-A393 WeakPolarHBondContact O-CA 3.25Å; Y390-A393 WeakPolarHBondContact O-CB 3.22Å; Y390-A393 PolarHBondContact O-N 3.05Å; Y390-A393 VanDerWaalsContact O-N 3.1Å; D391-A393 PolarHBondContact O-N 2.78Å; A393-A396 PolarHBondContact O-N 2.93Å; A393-I397 WeakPolarHBondContact O-CD1 3.38Å; A393-I397 VanDerWaalsContact O-CG1 3.23Å; A393-I397 WeakPolarHBondContact O-CG1 3.29Å; A393-I397 PolarHBondContact O-N 2.97Å; A393-F414 HydrophobicContact CB-CE1 3.89Å; A393-F414 HydrophobicContact CB-CZ 4.22Å
394A90.6Very high91.1Very high33 Ų3357.2 Ų57.227%0.27331%0.309SS..Hα-helixtrans-66.1-42.5177.700000111.7Y390 D391 E392 I397 A398 F414Y390-A394 PolarHBondContact O-N 3.33Å; D391-A394 PolarHBondContact O-N 2.78Å; E392-A394 PolarHBondContact O-N 2.97Å; A394-I397 PolarHBondContact O-N 3.01Å; A394-A398 WeakPolarHBondContact O-CB 3.23Å; A394-A398 PolarHBondContact O-N 2.85Å; A394-F414 HydrophobicContact CB-CE2 4.43Å; A394-F414 HydrophobicContact CB-CZ 4.17Å
395V93.2Very high90.6Very high82 Ų8256.9 Ų56.950%0.49731%0.309SS..Hα-helixtrans-65.5-41.4175.4175.80000111.1F362 D391 E392 A398 S399F362-V395 HydrophobicContact CD1-CG1 4.07Å; F362-V395 HydrophobicContact CE1-CG1 4.46Å; D391-V395 WeakPolarHBondContact O-CG2 3.27Å; D391-V395 PolarHBondContact O-N 3.26Å; E392-V395 PolarHBondContact O-N 3.13Å; V395-A398 PolarHBondContact O-N 3.46Å; V395-S399 WeakPolarHBondContact O-CB 3.4Å; V395-S399 PolarHBondContact O-N 3.44Å; V395-S399 PolarHBondContact O-OG 2.94Å
396A93.2Very high90.1Very high0 Ų060.4 Ų60.40%035%0.346CS..Hα-helixtrans-60.7-45.1175.100000111.7F359 F362 M387 E392 A393 S399 L400F359-A396 HydrophobicContact CD1-CB 3.88Å; F359-A396 HydrophobicContact CE1-CB 3.98Å; F362-A396 HydrophobicContact CB-CB 3.65Å; F362-A396 HydrophobicContact CD1-CB 4.34Å; F362-A396 HydrophobicContact CD2-CB 4.04Å; F362-A396 HydrophobicContact CG-CB 3.75Å; M387-A396 HydrophobicContact SD-CB 4.01Å; E392-A396 WeakPolarHBondContact O-CB 3.5Å; E392-A396 PolarHBondContact O-N 3.43Å; A393-A396 PolarHBondContact O-N 2.93Å; A396-S399 PolarHBondContact O-N 3.41Å; A396-L400 VanDerWaalsContact O-CB 3.25Å; A396-L400 WeakPolarHBondContact O-CB 3.25Å; A396-L400 WeakPolarHBondContact O-CG 3.02Å; A396-L400 PolarHBondContact O-N 3.47Å
397I93.7Very high89.8Confident20 Ų2067.3 Ų67.310%0.10338%0.382CS..Hα-helixtrans-60.8-48.7176.2-71.5160.8000110.6I341 A393 A394 S399 L400 N401 V412 F414I341-I397 HydrophobicContact CD1-CD1 4.44Å; I341-I397 HydrophobicContact CD1-CG1 4.23Å; I341-I397 HydrophobicContact CG1-CD1 4.17Å; I341-I397 HydrophobicContact CG1-CG1 4.33Å; I341-I397 HydrophobicContact CG2-CD1 4.24Å; I341-I397 HydrophobicContact CG2-CG1 3.8Å; A393-I397 WeakPolarHBondContact O-CD1 3.38Å; A393-I397 VanDerWaalsContact O-CG1 3.23Å; A393-I397 WeakPolarHBondContact O-CG1 3.29Å; A393-I397 PolarHBondContact O-N 2.97Å; A394-I397 PolarHBondContact O-N 3.01Å; I397-S399 PolarHBondContact O-N 3.49Å; I397-L400 PolarHBondContact O-N 3.1Å; I397-N401 WeakPolarHBondContact O-CB 3.36Å; I397-N401 PolarHBondContact O-N 3.26Å; I397-V412 HydrophobicContact CB-CG1 4.41Å; I397-V412 HydrophobicContact CG1-CG1 3.92Å; I397-V412 WeakPolarHBondContact CG2-O 3.46Å; I397-F414 HydrophobicContact CD1-CB 4.48Å; I397-F414 HydrophobicContact CD1-CD1 3.63Å; I397-F414 HydrophobicContact CD1-CD2 3.48Å; I397-F414 VanDerWaalsContact CD1-CD2 3.48Å; I397-F414 HydrophobicContact CD1-CE1 3.56Å; I397-F414 HydrophobicContact CD1-CE2 3.41Å; I397-F414 VanDerWaalsContact CD1-CE2 3.41Å; I397-F414 HydrophobicContact CD1-CG 3.59Å; I397-F414 HydrophobicContact CD1-CZ 3.45Å; I397-F414 VanDerWaalsContact CD1-CZ 3.45Å
398A91.9Very high89.7Confident81 Ų8172 Ų7267%0.66940%0.399SS*.Hα-helixtrans-61.2-33.4-179.300000112.6A394 V395A394-A398 WeakPolarHBondContact O-CB 3.23Å; A394-A398 PolarHBondContact O-N 2.85Å; V395-A398 PolarHBondContact O-N 3.46Å
399S91.4Very high89.8Confident63 Ų6372.3 Ų72.344%0.44140%0.401SS..Hα-helixtrans-85.9-33.2-177-52.80000113.4F362 V395 A396 I397F362-S399 WeakPolarHBondContact CE1-OG 3.39Å; V395-S399 WeakPolarHBondContact O-CB 3.4Å; V395-S399 PolarHBondContact O-N 3.44Å; V395-S399 PolarHBondContact O-OG 2.94Å; A396-S399 PolarHBondContact O-N 3.41Å; I397-S399 PolarHBondContact O-N 3.49Å
400L92Very high89.9Confident8 Ų868.9 Ų68.94%0.04238%0.383CS..Hα-helixtrans-100.2-17.1-174.4-63.9173.8000113.5M358 F359 F362 A396 I397 G402 Y403 V412M358-L400 HydrophobicContact CB-CD1 4.37Å; M358-L400 HydrophobicContact CB-CD2 4.39Å; M358-L400 HydrophobicContact CE-CD2 4.33Å; M358-L400 HydrophobicContact SD-CD2 4.3Å; F359-L400 HydrophobicContact CD1-CD1 3.89Å; F359-L400 HydrophobicContact CD2-CD1 3.78Å; F359-L400 HydrophobicContact CE1-CD1 3.69Å; F359-L400 HydrophobicContact CE2-CD1 3.59Å; F359-L400 HydrophobicContact CG-CD1 3.94Å; F359-L400 HydrophobicContact CZ-CD1 3.55Å; F362-L400 HydrophobicContact CD2-CD1 4.17Å; F362-L400 HydrophobicContact CE2-CD1 3.85Å; F362-L400 HydrophobicContact CE2-CD2 4.06Å; F362-L400 HydrophobicContact CE2-CG 3.87Å; F362-L400 HydrophobicContact CZ-CD2 4.5Å; F362-L400 HydrophobicContact CZ-CG 4.33Å; A396-L400 VanDerWaalsContact O-CB 3.25Å; A396-L400 WeakPolarHBondContact O-CB 3.25Å; A396-L400 WeakPolarHBondContact O-CG 3.02Å; A396-L400 PolarHBondContact O-N 3.47Å; I397-L400 PolarHBondContact O-N 3.1Å; L400-G402 PolarHBondContact O-N 3.46Å; L400-Y403 HydrophobicContact CD2-CD2 4.48Å; L400-Y403 HydrophobicContact CD2-CG 4.41Å; L400-Y403 WeakPolarHBondContact O-CB 3.39Å; L400-Y403 PolarHBondContact O-N 3.28Å; L400-V412 HydrophobicContact CB-CG2 3.93Å; L400-V412 WeakPolarHBondContact O-CG2 3.43Å
401N91.8Very high90Very high88 Ų8869 Ų6947%0.47139%0.387SS..THydrogen-bonded Turntrans-69.9116.6172.4-170.528.7000109.6I397 Q411 V412I397-N401 WeakPolarHBondContact O-CB 3.36Å; I397-N401 PolarHBondContact O-N 3.26Å; N401-Q411 WeakPolarHBondContact OD1-CA 3.48Å; N401-V412 HydrophobicContact CB-CB 4.04Å; N401-V412 VanDerWaalsContact CG-O 3.29Å; N401-V412 PolarHBondContact OD1-N 2.8Å; N401-V412 PolarHBondContact OD1-O 2.88Å
402G88.9Confident90.2Very high43 Ų4363.3 Ų63.344%0.44336%0.357SS..THydrogen-bonded Turntrans93.42.2-171.300000114.4L400 V409 L410L400-G402 PolarHBondContact O-N 3.46Å; G402-V409 WeakPolarHBondContact O-CG1 3.49Å; G402-L410 WeakPolarHBondContact CA-O 3.47Å; G402-L410 PolarHBondContact N-O 2.97Å
403Y90.3Very high90.2Very high108 Ų10862.9 Ų62.942%0.42436%0.36SS..  trans-68135.3178.5-173.7-95000111.8M358 L400 L405 V409 L410M358-Y403 HydrophobicContact CE-CD1 3.81Å; M358-Y403 HydrophobicContact CE-CE1 4.07Å; M358-Y403 HydrophobicContact SD-CD1 3.78Å; M358-Y403 HydrophobicContact SD-CE1 3.46Å; M358-Y403 WeakPolarHBondContact SD-CE1 3.47Å; L400-Y403 HydrophobicContact CD2-CD2 4.48Å; L400-Y403 HydrophobicContact CD2-CG 4.41Å; L400-Y403 WeakPolarHBondContact O-CB 3.39Å; L400-Y403 PolarHBondContact O-N 3.28Å; Y403-L405 HydrophobicContact CD1-CB 4.44Å; Y403-L405 HydrophobicContact CE1-CD1 4.24Å; Y403-V409 WeakPolarHBondContact O-CA 3.49Å; Y403-L410 HydrophobicContact CD1-CD1 4.31Å; Y403-L410 PolarHBondContact O-N 2.89Å
404R89.9Confident90.3Very high197 Ų19766 Ų6674%0.74337%0.374SS*.EExtended strand (participates in β ladder)trans-89.6110.9179.6-68.1-171.6176.8-144.51.1110.6R408 V409R404-R408 CarbonylContact C-O 3.55Å; R404-R408 WeakPolarHBondContact CA-O 3.19Å; R404-V409 HydrophobicContact CG-CG2 4.17Å
405L83.6Confident90Very high30 Ų3068.4 Ų68.416%0.15738%0.379CS..EExtended strand (participates in β ladder)trans-109.896.2174.7-167.969.5000108.9I354 Y403 R408 L410I354-L405 HydrophobicContact CD1-CD1 3.82Å; I354-L405 HydrophobicContact CD1-CD2 4.09Å; I354-L405 HydrophobicContact CD1-CG 4.4Å; I354-L405 HydrophobicContact CG1-CD1 4.39Å; I354-L405 HydrophobicContact CG2-CD2 4.39Å; Y403-L405 HydrophobicContact CD1-CB 4.44Å; Y403-L405 HydrophobicContact CE1-CD1 4.24Å; L405-R408 PolarHBondContact N-O 3.38Å; L405-R408 PolarHBondContact O-N 3.33Å; L405-L410 HydrophobicContact CB-CD1 4.15Å; L405-L410 HydrophobicContact CB-CD2 4.15Å; L405-L410 HydrophobicContact CB-CG 4.06Å; L405-L410 HydrophobicContact CD2-CD1 4.23Å; L405-L410 HydrophobicContact CD2-CD2 4.31Å
406G82.3Confident89.2Confident75 Ų7570.2 Ų70.277%0.77339%0.39SS*.THydrogen-bonded Turntrans67.5-128.9-168.600000111.2R408G406-R408 VanDerWaalsContact C-N 3.29Å
407D84.8Confident87.3Confident169 Ų16975.3 Ų75.390%0.90442%0.417SS*.THydrogen-bonded Turntrans-85.60.3177.5-159.7-114.9000113.2
408R86.4Confident85Confident98 Ų9883.5 Ų83.537%0.3745%0.452SS..EExtended strand (participates in β ladder)trans-110.3143.8-174.8-64.1-173.8-179.7-157.1-7.3112L346 R404 L405 G406L346-R408 PolarHBondContact O-NH1 3.22Å; R404-R408 CarbonylContact C-O 3.55Å; R404-R408 WeakPolarHBondContact CA-O 3.19Å; L405-R408 PolarHBondContact N-O 3.38Å; L405-R408 PolarHBondContact O-N 3.33Å; G406-R408 VanDerWaalsContact C-N 3.29Å
409V90.9Very high82.5Confident59 Ų5985.8 Ų85.836%0.35846%0.458SS..EExtended strand (participates in β ladder)trans-99.8117.7174.1-175.10000108.5N345 G402 Y403 R404N345-V409 WeakPolarHBondContact CB-O 3.46Å; N345-V409 PolarHBondContact ND2-O 3.5Å; G402-V409 WeakPolarHBondContact O-CG1 3.49Å; Y403-V409 WeakPolarHBondContact O-CA 3.49Å; R404-V409 HydrophobicContact CG-CG2 4.17Å
410L92.6Very high79.8Confident2 Ų291.6 Ų91.61%0.0148%0.478CS..  trans-71.3141.9179.8-58.8-173.4000111.1L346 M358 G402 Y403 L405 V412L346-L410 HydrophobicContact CD2-CD1 4.47Å; L346-L410 HydrophobicContact CD2-CD2 3.78Å; L346-L410 HydrophobicContact CG-CD2 4.5Å; M358-L410 HydrophobicContact CE-CD1 3.29Å; G402-L410 WeakPolarHBondContact CA-O 3.47Å; G402-L410 PolarHBondContact N-O 2.97Å; Y403-L410 HydrophobicContact CD1-CD1 4.31Å; Y403-L410 PolarHBondContact O-N 2.89Å; L405-L410 HydrophobicContact CB-CD1 4.15Å; L405-L410 HydrophobicContact CB-CD2 4.15Å; L405-L410 HydrophobicContact CB-CG 4.06Å; L405-L410 HydrophobicContact CD2-CD1 4.23Å; L405-L410 HydrophobicContact CD2-CD2 4.31Å; L410-V412 HydrophobicContact CB-CG2 4.37Å
411Q91.3Very high77Confident110 Ų110101 Ų10151%0.51452%0.518SS..EExtended strand (participates in β ladder)trans-110.8119.2170.5-71.4-177-18.800108.6V343 Y344 N401V343-Q411 CarbonylContact C-O 3.52Å; V343-Q411 WeakPolarHBondContact CA-O 3.38Å; Y344-Q411 PolarHBondContact N-O 2.83Å; Y344-Q411 PolarHBondContact O-N 3.45Å; N401-Q411 WeakPolarHBondContact OD1-CA 3.48Å
412V93.7Very high74.2Confident2 Ų2104.8 Ų104.81%0.01256%0.562CS.*EExtended strand (participates in β ladder)trans-122128.9-174.9-169.90000108.3I341 F342 V343 F359 I397 L400 N401 L410I341-V412 HydrophobicContact CG2-CG1 3.34Å; F342-V412 WeakPolarHBondContact O-CA 3.48Å; V343-V412 HydrophobicContact CG1-CG2 4.28Å; V343-V412 HydrophobicContact CG2-CG1 4.33Å; F359-V412 HydrophobicContact CE1-CG1 4.27Å; F359-V412 HydrophobicContact CZ-CG1 3.82Å; I397-V412 HydrophobicContact CB-CG1 4.41Å; I397-V412 HydrophobicContact CG1-CG1 3.92Å; I397-V412 WeakPolarHBondContact CG2-O 3.46Å; L400-V412 HydrophobicContact CB-CG2 3.93Å; L400-V412 WeakPolarHBondContact O-CG2 3.43Å; N401-V412 HydrophobicContact CB-CB 4.04Å; N401-V412 VanDerWaalsContact CG-O 3.29Å; N401-V412 PolarHBondContact OD1-N 2.8Å; N401-V412 PolarHBondContact OD1-O 2.88Å; L410-V412 HydrophobicContact CB-CG2 4.37Å
413S91.5Very high73.5Confident52 Ų52107.9 Ų107.936%0.36457%0.567SS.*EExtended strand (participates in β ladder)trans-154.3161.9-177.856.70000111.2I341 F342I341-S413 CarbonylContact C-O 3.48Å; I341-S413 WeakPolarHBondContact CA-O 3.27Å; I341-S413 WeakPolarHBondContact CG2-O 3.38Å; F342-S413 PolarHBondContact N-O 2.94Å; F342-S413 PolarHBondContact O-N 2.85Å
414F91.9Very high72.6Confident65 Ų65107.9 Ų107.929%0.28558%0.575SS.*EExtended strand (participates in β ladder)trans-64.4138.9168.6-74.5-69.3000110.4W339 Y390 A393 A394 I397 T416W339-F414 HydrophobicContact CB-CE1 4.29Å; Y390-F414 HydrophobicContact CD2-CE1 4.24Å; Y390-F414 AromaticContact CD2-CZ 3.95Å; Y390-F414 HydrophobicContact CD2-CZ 3.95Å; Y390-F414 HydrophobicContact CE2-CE1 4.11Å; Y390-F414 AromaticContact CE2-CE2 3.96Å; Y390-F414 HydrophobicContact CE2-CE2 3.96Å; Y390-F414 AromaticContact CE2-CZ 3.54Å; Y390-F414 HydrophobicContact CE2-CZ 3.54Å; A393-F414 HydrophobicContact CB-CE1 3.89Å; A393-F414 HydrophobicContact CB-CZ 4.22Å; A394-F414 HydrophobicContact CB-CE2 4.43Å; A394-F414 HydrophobicContact CB-CZ 4.17Å; I397-F414 HydrophobicContact CD1-CB 4.48Å; I397-F414 HydrophobicContact CD1-CD1 3.63Å; I397-F414 HydrophobicContact CD1-CD2 3.48Å; I397-F414 VanDerWaalsContact CD1-CD2 3.48Å; I397-F414 HydrophobicContact CD1-CE1 3.56Å; I397-F414 HydrophobicContact CD1-CE2 3.41Å; I397-F414 VanDerWaalsContact CD1-CE2 3.41Å; I397-F414 HydrophobicContact CD1-CG 3.59Å; I397-F414 HydrophobicContact CD1-CZ 3.45Å; I397-F414 VanDerWaalsContact CD1-CZ 3.45Å; F414-T416 PolarHBondContact O-N 3.26Å; F414-T416 VanDerWaalsContact O-N 3.09Å
415K84.4Confident71.6Confident85 Ų85102.9 Ų102.937%0.3757%0.566SS.*  trans-64.9112177.1-179.7178.7175.1178.10109.8C340 F342 F384C340-K415 HydrophobicContact CB-CB 4.06Å; C340-K415 HydrophobicContact CB-CD 4.07Å; C340-K415 VanDerWaalsContact O-CB 3.3Å; C340-K415 WeakPolarHBondContact O-CB 3.38Å; C340-K415 PolarHBondContact O-N 3.07Å; C340-K415 WeakPolarHBondContact SG-CD 3.46Å; F342-K415 HydrophobicContact CB-CB 4.49Å; F384-K415 HydrophobicContact CD1-CD 4.04Å; F384-K415 HydrophobicContact CE1-CD 4.03Å; F384-K415 HydrophobicContact CE1-CG 4.43Å
416T77.1Confident70.9Confident119 Ų119107.2 Ų107.273%0.7359%0.59SS**  trans-81.6133.8172.857.80000110.1F414 K418F414-T416 PolarHBondContact O-N 3.26Å; F414-T416 VanDerWaalsContact O-N 3.09Å; T416-K418 PolarHBondContact O-N 2.84Å
417N53.1Low70.2Confident107 Ų107109.3 Ų109.357%0.57258%0.578SS**  trans-77.2112.7166.6-83.3-48.4000107.6T419N417-T419 PolarHBondContact O-N 2.8Å
418K44.8Very low69.2Low193 Ų193105.3 Ų105.384%0.83956%0.556SS**  trans-65.998166.1-92.4-179.3174176.60108.3T416 H420T416-K418 PolarHBondContact O-N 2.84Å; K418-H420 PolarHBondContact O-N 3.48Å
419T39.9Very low68Low129 Ų129105.8 Ų105.879%0.79157%0.57SS**  trans-62.7111.5155.345.20000106.7N417 K421N417-T419 PolarHBondContact O-N 2.8Å; T419-K421 PolarHBondContact O-N 3.01Å
420H35.3Very low66.2Low185 Ų185109.4 Ų109.486%0.85659%0.586SS**  trans-55.5114.6167.7-101.4-102.1000107.2K418 A422K418-H420 PolarHBondContact O-N 3.48Å; H420-A422 PolarHBondContact O-N 3.35Å
421K32.9Very low64Low206 Ų206118.3 Ų118.390%0.89663%0.634SS**  trans-65.7117.9170.8-162.3176.7-178.8-175.70105.8T419T419-K421 PolarHBondContact O-N 3.01Å
422A32.5Very low61.6Low167 Ų167119.1 Ų119.1100%1.3865%0.645SS**  trans-57.70-178.100000112.5H420H420-A422 PolarHBondContact O-N 3.35Å

Retrieved 422 of 422 residues in 640.7 ms (Link to these results)