A0A096NYG7_PAPAN Loading...

Purine rich element binding protein G

AlphaFold DB (F7FM41), UniProt , Accession A0A096NYG7, Species PAPAN (Papio anubis, Olive baboon), Gene PURG, Length 391 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
1M35.2Very low43.7Very low236 Ų236182.3 Ų182.3100%1.16391%0.905SS**  0130.20-84.2-151.3177.500109.2
2R39.8Very low44.2Very low250 Ų250177 Ų17794%0.94389%0.894SS**  trans41.7127.8158.1-63.1-175.7-173.4-124.30.9120.8
3G39.1Very low45Very low84 Ų84173.2 Ų173.287%0.86689%0.889SS**  trans170.774.8154.500000113.6
4A45.9Very low45.1Very low103 Ų103170.9 Ų170.985%0.85189%0.887SS**  trans-79.5144.5172.200000111.6
5R44Very low44.6Very low259 Ų259164.5 Ų164.598%0.97788%0.88SS**  trans-159.7147.1148.8-123.9177.4-176.7-141.2-0.1112.6
6A43.1Very low44.3Very low98 Ų98170 Ų17081%0.8188%0.884SS**  trans-93.2168.8-157.100000114.7
7E47.8Very low43.9Very low182 Ų182171.3 Ų171.385%0.8589%0.885SS**  trans-49.8163.1169.9-75.9-157.6130.500115.8
8P56.9Low43.4Very low123 Ų123171.4 Ų171.480%0.79988%0.881SS**  trans-114.5137.9150.335.1-22.8000114.1
9E39.7Very low43.1Very low188 Ų188170.6 Ų170.688%0.87988%0.877SS**  trans-83.6169.2178.1-145.7-172.3162.800113.2
10R42.1Very low43.1Very low236 Ų236171.1 Ų171.189%0.89188%0.876SS**  trans-70.2157.7-165.3-58.9176-178.5-142.4-0.7115.9
11R46.9Very low43.5Very low246 Ų246168.8 Ų168.893%0.92887%0.872SS**  trans-133.3147.6153.8-77.1-169.8-179.3-158.51111.5
12P49.6Very low43.4Very low119 Ų119169.6 Ų169.677%0.77386%0.862SS**PPolyproline II helixtrans-98.9163.8-176.438.7-32.6000112.7
13P54.9Low43.3Very low128 Ų128162.7 Ų162.783%0.83186%0.858SS**PPolyproline II helixtrans-102.5143.5165.234.4-26.6000113.7
14T46.2Very low43.1Very low140 Ų140163.6 Ų163.686%0.85986%0.858SS**PPolyproline II helixtrans-68.2152178.644.40000114.4
15G37.7Very low42.8Very low75 Ų75163.2 Ų163.277%0.77386%0.855SS**PPolyproline II helixtrans-75.2166177.900000116
16R40.1Very low43.1Very low253 Ų253157 Ų15796%0.95585%0.848SS**  trans-144.6127159.5-94.5-172.4175.5-176.8-2.1109.2
17Q37.2Very low42.7Very low192 Ų192155.6 Ų155.690%0.89784%0.843SS**  trans-81143.7165.2-69.4172.8-1.600109
18E34.5Very low42.2Very low174 Ų174156.1 Ų156.181%0.81385%0.845SS**  trans-159.4117148.2-147.1167.4129.500113.6
19L38.5Very low41.9Very low155 Ų155155 Ų15581%0.81284%0.838SS**  trans60.4121.3139.2-60.7169.8000123.7
20E43.5Very low41.7Very low180 Ų180149.6 Ų149.684%0.84183%0.833SS**  trans-75163.6159.5-65.4-144.3131.800114
21P49.7Very low41.4Very low123 Ų123149.9 Ų149.980%0.79983%0.834SS**  trans-110.9134154.533.9-21000113.7
22R33.7Very low40.9Very low253 Ų253142.4 Ų142.496%0.95583%0.825SS**  trans-57141.2169.8-75.1168.6135.2-161.6-3.5113.1
23A39Very low40.2Very low105 Ų105149 Ų14987%0.86883%0.834SS**  trans-108.6137.3162.200000110.9
24A34.5Very low39.1Very low104 Ų104146.5 Ų146.586%0.8683%0.832SS**  trans-92.9146.3-17800000112.3
25A39.9Very low38.6Very low94 Ų94145.7 Ų145.778%0.77783%0.832SS**  trans-77.5162.4166.300000111.1
26P50.4Low38.5Very low130 Ų130154 Ų15484%0.84484%0.84SS**  -137.8163.178.825.3-2.9000111.7
27G33.3Very low38.1Very low68 Ų68146.8 Ų146.870%0.70184%0.835SS**  cis101.9108.344.500000109.4
28E38Very low37.9Very low192 Ų192142.7 Ų142.790%0.89783%0.833SS**  trans156.7160.5152.2-86-103.5127.200113.8
29P49.7Very low37.9Very low99 Ų99139.7 Ų139.764%0.64384%0.838SS**  -112.3171.4-128.541.5-37.1000116.4
30G35.3Very low37.5Very low75 Ų75136.1 Ų136.177%0.77384%0.839SS**  trans-68.1148.717300000114.6
31R36.1Very low37.1Very low243 Ų243132.5 Ų132.592%0.91784%0.84SS**  trans-136.3118.4157.3-75.5-172.3-173.7-118.60109.5
32A36.3Very low36.3Very low89 Ų89131.4 Ų131.474%0.73684%0.842SS**  trans-64.4161.7154.800000110.1
33W36.3Very low36.5Very low257 Ų257130.8 Ų130.897%0.97384%0.839SS**  trans169.9129.7146.3-84.422.4000103.2
34G31.7Very low37.1Very low76 Ų76130.9 Ų130.978%0.78483%0.831SS**  cis131.3101.630.700000105.8
35S35.2Very low37Very low123 Ų123137.8 Ų137.886%0.8684%0.835SS**  trans-58.8140176.2-52.90000111.9
36R34.9Very low36.6Very low249 Ų249137.1 Ų137.194%0.9484%0.837SS**  trans-160.4120.4144.1-112.7169.2-162.9-117.33.2112
37A31.9Very low35.8Very low102 Ų102137.5 Ų137.584%0.84384%0.837SS**  trans-74.6148.2160.800000110.2
38A34.2Very low35.8Very low105 Ų105140.9 Ų140.987%0.86885%0.848SS**  trans-154.1120.1151.600000109.2
39A33Very low35.4Very low111 Ų111138.6 Ų138.692%0.91784%0.842SS**  trans-74.9153.6169.300000110.7
40G31Very low34.4Very low80 Ų80138.4 Ų138.483%0.82584%0.842SS**  trans-169.4102.7171.100000110.7
41A35.1Very low34.2Very low104 Ų104139.5 Ų139.586%0.8684%0.837SS**  trans-72.9151.3-179.800000113
42A33.1Very low34.1Very low101 Ų101137.3 Ų137.384%0.83584%0.837SS**  162.4120.6127.400000111.8
43R36.8Very low34.1Very low240 Ų240141.8 Ų141.891%0.90684%0.843SS**  trans-84.3179.1152.2-67.2-176.9158.4-156.4-3.1107.6
44P51.5Low34.6Very low106 Ų106135.5 Ų135.569%0.68884%0.835SS**  cis-153.2-175.215.247.9-27.4000118.3
45R33.9Very low34.8Very low250 Ų250136.4 Ų136.494%0.94383%0.829SS**  trans74.3127.3151.2-69.5-176.2-173.6-133.3-1.4121.1
46G30.7Very low35.1Very low80 Ų80136.6 Ų136.683%0.82583%0.828SS**  trans-172.599.5157.100000110.4
47V34Very low35.4Very low138 Ų138130.7 Ų130.784%0.83682%0.82SS**  trans-92.3135.2171.5171.60000107.2
48C32.2Very low36Very low138 Ų138131.2 Ų131.293%0.93281%0.814SS**  trans-153.5139.5154.5-79.40000109.2
49D30.5Very low36.3Very low145 Ų145132.4 Ų132.478%0.77581%0.813SS**  trans-118158.6-166-171.916.3000111.1
50C29.7Very low36.3Very low95 Ų95138.4 Ų138.464%0.64281%0.812SS**  trans73.1116.9153.9-82.10000123
51S30.9Very low36.4Very low97 Ų97141 Ų14168%0.67881%0.811SS**  86.5111.2122.8-600000121.6
52Q33.1Very low36.1Very low197 Ų197141.5 Ų141.592%0.92181%0.809SS**  -177.3120.5117.9-94.8150.332.700113.2
53H36.4Very low36Very low183 Ų183142.1 Ų142.185%0.84780%0.802SS**  trans-94.8153.6157.7-91.9-71.6000108
54P46.3Very low35.7Very low125 Ų125136.8 Ų136.881%0.81280%0.8SS**  -142.2166.178.231-9.7000116.1
55S35.5Very low34.6Very low95 Ų95139 Ų13966%0.66480%0.801SS**  trans-69.7170.6176.951.80000114
56P41.8Very low34.4Very low127 Ų127135.8 Ų135.883%0.82580%0.801SS**  -134.8168.5104.333.6-19.4000114.6
57T41.5Very low34.5Very low126 Ų126138.9 Ų138.977%0.77379%0.794SS**  trans-88.6-165.6-164.955.60000113.4
58P45.6Very low34.5Very low112 Ų112139.3 Ų139.373%0.72779%0.791SS**  -118.1-174.9-105.935.5-14.8000113.3
59P39.1Very low34.4Very low130 Ų130142.3 Ų142.384%0.84479%0.789SS**  trans-121.6150.815033.6-22000114.1
60R34.3Very low34.6Very low237 Ų237143.6 Ų143.689%0.89479%0.792SS**  trans-81.5148.1-171.1-67.3167.4128.6-150.9-0.9113.2
61V31.5Very low34.7Very low134 Ų134147.8 Ų147.881%0.81280%0.802SS**  trans1.1129.6146.8-160.80000118.3
62S29.8Very low34.7Very low115 Ų115153 Ų15380%0.80481%0.807SS**  trans-148.6133.1141.9-173.70000111.9
63V31.9Very low34.7Very low114 Ų114148.7 Ų148.769%0.69181%0.805SS**  trans-68.7131.3-179.8176.40000110.5
64C28.6Very low34.5Very low128 Ų128150.4 Ų150.487%0.86580%0.804SS**  trans-11598.7166.8-80.60000110.6
65H29.4Very low34.1Very low154 Ų154156.4 Ų156.471%0.71381%0.81SS**  trans-48.5127.7154.6-99.8-1.1000110.9
66L28.8Very low34.1Very low181 Ų181164 Ų16495%0.94882%0.824SS**  trans-108.382.6157.4-150.874.5000108.7
67Q34.1Very low33.6Very low145 Ų145161.9 Ų161.968%0.67883%0.826SS**  trans-70.7142.9171.3-165.690.6-21.200109.9
68L33.8Very low33Very low148 Ų148159.9 Ų159.978%0.77583%0.83SS**  trans-43.8133177.3-72.187.4000114.7M70L68-M70 PolarHBondContact O-N 2.95Å
69K30.3Very low32.3Very low201 Ų201158.5 Ų158.587%0.87484%0.836SS**  trans-80.6101.6155.5-96.4-177.61721780109.6
70M35.2Very low31.9Very low172 Ų172156.4 Ų156.485%0.84784%0.839SS**  trans-112.299.4157.6-164.6-172.6-82.800106.7L68L68-M70 PolarHBondContact O-N 2.95Å
71E30.8Very low31.8Very low182 Ų182148.4 Ų148.485%0.8583%0.83SS**  trans-99.7112.5175.4-164.7132.1-174.500110
72R31.7Very low32Very low207 Ų207154.3 Ų154.378%0.78184%0.838SS**  trans-92.7103.6-178.9-169.4-178.3-160172.96.6107.3R74R72-R74 PolarHBondContact O-N 3.36Å
73A32.7Very low32Very low106 Ų106152.2 Ų152.288%0.87683%0.834SS**  trans-70110.5168.700000109.4
74R32.4Very low32.3Very low219 Ų219159.2 Ų159.283%0.82685%0.848SS**  trans-117.3107.3166.7-137.1-177.4-177.1169.90.4106.5R72R72-R74 PolarHBondContact O-N 3.36Å
75R36.8Very low32.5Very low252 Ų252157.1 Ų157.195%0.95185%0.848SS**  trans-116.8130.7157.3-83.9-161.8175.1-139.71.1109.3
76R36.3Very low32.7Very low253 Ų253153 Ų15396%0.95585%0.848SS**  trans-69.8145.4176.8-85.5172151.2-175.8-6.1111
77G30.8Very low33.1Very low83 Ų83153.5 Ų153.586%0.85684%0.842SS**  115.8117.9122.100000117.3
78G30.3Very low33.2Very low84 Ų84153.3 Ų153.387%0.86685%0.846SS**  trans128.198.5139.100000118.3
79G29.9Very low33.2Very low83 Ų83153.3 Ų153.386%0.85685%0.852SS**  92.2121.6123.400000121.3
80G31.1Very low33.2Very low87 Ų87147.4 Ų147.490%0.89785%0.848SS**  trans82128.7152.800000115.4
81G32.3Very low33.1Very low69 Ų69142.6 Ų142.671%0.71184%0.843SS**  cis125.5135.726.700000108
82R34.3Very low33.3Very low258 Ų258139.8 Ų139.897%0.97484%0.843SS**  trans89.4122.8-176.9-52172-174-126.4-0.1113.2
83G31.4Very low33.3Very low71 Ų71133.1 Ų133.173%0.73284%0.839SS**  cis117.8105.518.600000109.2
84R38.2Very low33.7Very low260 Ų260136.8 Ų136.898%0.98184%0.843SS**  trans141.6121.1166.5-86.2173178.7-124.90.7107
85G31.4Very low33.8Very low84 Ų84131.9 Ų131.987%0.86684%0.842SS**  cis134.9121.915.300000107.2
86G35Very low33.7Very low69 Ų69130 Ų13071%0.71184%0.841SS**  trans123.796.3150.500000119.2
87K37Very low33.6Very low190 Ų190123.2 Ų123.283%0.82683%0.832SS**  69.6109121.8-66.2176.2-179.1-175.40120.2
88N34.9Very low33.8Very low142 Ų142130.3 Ų130.376%0.75983%0.833SS**  169.5116.598.7-79.8-36000110.1
89V34.3Very low33.8Very low147 Ų147133.8 Ų133.889%0.89183%0.831SS**  53.5122.3100.2-170.60000112.3
90G31.4Very low33.9Very low77 Ų77139.7 Ų139.779%0.79483%0.829SS**  cis175.51626.700000107.3
91G31.9Very low34.8Very low72 Ų72141.4 Ų141.474%0.74282%0.824SS**  trans163.391.3175.100000114.5
92S35.8Very low34.8Very low123 Ų123146.1 Ų146.186%0.8683%0.828SS**  trans-16.6134.1155.246.30000115.8
93G31.7Very low34.8Very low67 Ų67137.8 Ų137.869%0.69181%0.814SS**  cis98.288.633.300000109.8
94L39.6Very low35Very low183 Ų183142.7 Ų142.796%0.95882%0.818SS**  trans-152.1105.7157.6-80.2-176.7000110.2
95S35Very low34.7Very low115 Ų115138.4 Ų138.480%0.80481%0.809SS**  trans-89135.2164.9-550000109.4
96K34.6Very low34.7Very low214 Ų214138.9 Ų138.993%0.9380%0.799SS**  trans-145.3107.1147.9-81.5-167.7179.2168.60110.6
97S34.1Very low34.7Very low110 Ų110145 Ų14577%0.76981%0.808SS**  trans-91.8139.7163510000110.5
98R35.7Very low34.3Very low232 Ų232146.4 Ų146.488%0.87581%0.81SS**  trans165131.3150.3-103.6-178.3-168.2-1653.6107.5
99L30.3Very low34.9Very low157 Ų157144.2 Ų144.282%0.82280%0.803SS**  cis-154.7153.428-72.8113.7000111.4
100Y32Very low34.9Very low206 Ų206146.7 Ų146.781%0.80881%0.805SS**  trans-97.8159.9153.7-106-89.5000107.8
101P50.7Low34.9Very low123 Ų123154.1 Ų154.180%0.79981%0.81SS**  -144.6143.862.130.2-6.6000115
102Q31Very low35.3Very low169 Ų169155.4 Ų155.479%0.7981%0.814SS**  69.511285.3-161.6151.7-11.500118.9
103A34.8Very low35Very low82 Ų82153.9 Ų153.968%0.67881%0.809SS**  trans72144149.800000118.8
104Q36.7Very low35.1Very low174 Ų174156 Ų15681%0.81381%0.813SS**  cis-160.2152.243.4-62.8-168.2-11.800113.9
105H31.6Very low34.9Very low171 Ų171152.4 Ų152.479%0.79281%0.809SS**  trans26.1151.4141.1-69.698.3000121.5
106S30.8Very low35Very low94 Ų94152.9 Ų152.966%0.65781%0.808SS**  cis-178.9137.512.9-105.40000107.8
107H34.1Very low35.4Very low196 Ų196148.4 Ų148.491%0.90780%0.801SS**  trans-171.2135.1142.4-11265.5000112.8
108Y29.3Very low35.6Very low221 Ų221151 Ų15187%0.86781%0.806SS**  trans-71.1-172.7-176.5-102.4-103.8000113.7
109P48.2Very low36Very low95 Ų95148.8 Ų148.862%0.61781%0.806SS**  -122.3152.4-72.435.4-17.7000112.2
110H33Very low36.4Very low199 Ų199146.1 Ų146.192%0.92181%0.806SS**  trans-142.1141.3165.1-88.1-75.2000113.9
111Y31.3Very low36.5Very low234 Ų234139.9 Ų139.992%0.91881%0.805SS**  trans-61.5160-174-108.4-111.3000114.8
112A40.2Very low35.8Very low98 Ų98138.3 Ų138.381%0.8181%0.81SS**  trans-53.5142.4179.100000115.7
113A30.4Very low36.4Very low92 Ų92134.5 Ų134.576%0.7681%0.808SS**  trans-151.2115.1154.400000111
114S34.2Very low37.2Very low111 Ų111133.4 Ų133.478%0.77680%0.799SS**  trans18.1110.2146.353.80000118.5T116S114-T116 PolarHBondContact O-N 3.07Å
115A35.6Very low39Very low107 Ų107133.9 Ų133.988%0.88480%0.801SS**PPolyproline II helixtrans-63.4125161.400000110.3
116T36Very low41.7Very low125 Ų125130.1 Ų130.177%0.76779%0.786SS**PPolyproline II helixtrans-54.6141.7-17349.20000115.6S114S114-T116 PolarHBondContact O-N 3.07Å
117P43.8Very low44.7Very low121 Ų121130.9 Ų130.979%0.78678%0.779SS**PPolyproline II helixtrans-76.3141.7164.432-29.4000110.4Q119P117-Q119 PolarHBondContact O-N 2.73Å
118N37.8Very low47.5Very low165 Ų165126.8 Ų126.888%0.88276%0.76SS**  trans-67.5109.2-179.3-153-1.2000109.8A120N118-A120 PolarHBondContact O-N 3.47Å
119Q43.7Very low50.7Low185 Ų185118.2 Ų118.286%0.86473%0.729SS**  trans-75.8114.6168.2-86.2-17445.300109.7P117P117-Q119 PolarHBondContact O-N 2.73Å
120A40.4Very low53Low101 Ų101114.5 Ų114.584%0.83571%0.706SS**  trans-109.9111.1153.700000107N118N118-A120 PolarHBondContact O-N 3.47Å
121G32.7Very low56Low75 Ų75108.1 Ų108.177%0.77368%0.684SS**  trans-71.6152.3-172.500000114.9
122G35.4Very low59.1Low89 Ų8999.6 Ų99.692%0.91865%0.652SS**  trans89.79.2142.400000118.9
123A44.2Very low61.8Low90 Ų90101 Ų10174%0.74464%0.636SS**SBendtrans-92.4119.4160.300000107.1E125A123-E125 PolarHBondContact O-N 3.2Å
124A52.8Low65Low58 Ų5897.2 Ų97.248%0.47960%0.603SS.*  trans-41.3131168.600000109.5I126A124-I126 VanDerWaalsContact C-N 3.34Å; A124-I126 WeakPolarHBondContact O-CG1 3.4Å; A124-I126 PolarHBondContact O-N 3.08Å
125E73.1Confident67.9Low184 Ų18495.5 Ų95.586%0.8659%0.586SS**  trans-5790.6-173.5-171.6176-177.100110.3A123 Q127A123-E125 PolarHBondContact O-N 3.2Å; E125-Q127 PolarHBondContact O-N 2.77Å
126I89Confident70.7Confident93 Ų9390.8 Ų90.848%0.47755%0.546SS..  trans-78.7103.8175.7-64.3176.7000106.9A124 K146 Q147 F153A124-I126 VanDerWaalsContact C-N 3.34Å; A124-I126 WeakPolarHBondContact O-CG1 3.4Å; A124-I126 PolarHBondContact O-N 3.08Å; I126-K146 HydrophobicContact CG2-CB 3.88Å; I126-K146 HydrophobicContact CG2-CD 4.04Å; I126-K146 HydrophobicContact CG2-CG 4.34Å; I126-Q147 CarbonylContact C-O 3.5Å; I126-Q147 VanDerWaalsContact CA-O 3.24Å; I126-Q147 WeakPolarHBondContact CA-O 3.44Å; I126-F153 HydrophobicContact CD1-CZ 4.46Å; I126-F153 HydrophobicContact CG2-CE1 4.1Å; I126-F153 HydrophobicContact CG2-CZ 3.91Å
127Q92.9Very high73.3Confident110 Ų11091.6 Ų91.651%0.51454%0.541SS..EExtended strand (participates in β ladder)trans-79.1135.7176.5-170.1178.629.800110.2E125 L129 K146 Q147E125-Q127 PolarHBondContact O-N 2.77Å; Q127-L129 HydrophobicContact CG-CD2 4.2Å; Q127-K146 CarbonylContact O-C 3.51Å; Q127-K146 VanDerWaalsContact O-CA 3.24Å; Q127-K146 WeakPolarHBondContact O-CA 3.43Å; Q127-Q147 HydrophobicContact CB-CB 4.39Å; Q127-Q147 PolarHBondContact N-O 2.68Å; Q127-Q147 PolarHBondContact O-N 3.33Å
128E94.6Very high75.4Confident109 Ų10992 Ų9251%0.50953%0.53SS..EExtended strand (participates in β ladder)trans-88.6120.3169.7-171.5165133.600109.2K146E128-K146 IonicContact OE2-NZ 3.71Å; E128-K146 PolarHBondContact OE2-NZ 3.22Å
129L95.1Very high78Confident42 Ų4285.1 Ų85.122%0.2249%0.492CS..EExtended strand (participates in β ladder)trans-94.2-42.3-176.8-61.5-176.2000111.6Q127 V145 Q147 R152 Y312Q127-L129 HydrophobicContact CG-CD2 4.2Å; L129-V145 HydrophobicContact CB-CB 4.43Å; L129-V145 HydrophobicContact CB-CG1 4.12Å; L129-V145 HydrophobicContact CD1-CG1 4.12Å; L129-V145 PolarHBondContact N-O 2.81Å; L129-Q147 HydrophobicContact CD1-CB 3.98Å; L129-Q147 HydrophobicContact CD2-CB 4.28Å; L129-Q147 HydrophobicContact CG-CB 4.11Å; L129-R152 HydrophobicContact CD1-CG 4.03Å; L129-Y312 HydrophobicContact CB-CD1 4.01Å; L129-Y312 HydrophobicContact CB-CE1 3.84Å; L129-Y312 HydrophobicContact CD1-CD1 4.1Å; L129-Y312 PolarHBondContact O-OH 2.84Å
130A96.8Very high80.3Confident16 Ų1679.9 Ų79.913%0.13247%0.465CS..EExtended strand (participates in β ladder)trans-153153.1176.900000110.9D144 V145 L308 Y312A130-D144 CarbonylContact O-C 3.53Å; A130-D144 WeakPolarHBondContact O-CA 3.48Å; A130-V145 HydrophobicContact CB-CB 4.27Å; A130-V145 PolarHBondContact N-O 2.96Å; A130-V145 PolarHBondContact O-N 3.16Å; A130-L308 HydrophobicContact CB-CD2 3.93Å; A130-Y312 HydrophobicContact CB-CD2 4.19Å; A130-Y312 HydrophobicContact CB-CE2 3.41Å; A130-Y312 VanDerWaalsContact CB-CE2 3.41Å
131S96.4Very high83Confident66 Ų6675.1 Ų75.146%0.46243%0.425SS..EExtended strand (participates in β ladder)trans-134.3126.6167.4-175.20000109.3L143 D144S131-L143 WeakPolarHBondContact CA-O 3.37Å; S131-D144 WeakPolarHBondContact CB-OD1 3.23Å; S131-D144 PolarHBondContact OG-OD1 3.29Å
132K97Very high86.1Confident55 Ų5574.9 Ų74.924%0.23940%0.401CS..EExtended strand (participates in β ladder)trans-120.2136.2174.9-172.8162.3177.6176.10110.1L143 A304 Q307 L308K132-L143 HydrophobicContact CB-CB 4.44Å; K132-L143 PolarHBondContact N-O 2.76Å; K132-L143 PolarHBondContact O-N 3.04Å; K132-A304 HydrophobicContact CD-CB 3.77Å; K132-A304 HydrophobicContact CG-CB 4.37Å; K132-Q307 VanDerWaalsContact NZ-CD 3.35Å; K132-L308 HydrophobicContact CB-CD1 4.2Å; K132-L308 HydrophobicContact CB-CD2 4.39Å
133R96.8Very high89.1Confident128 Ų12870.7 Ų70.748%0.48336%0.358SS..EExtended strand (participates in β ladder)trans-108.8132.2177.8175.8177.7151.7-151.9-9.9110.3D135 R140 F141 Y142R133-D135 WeakPolarHBondContact CG-OD1 3.13Å; R133-D135 IonicContact CZ-OD1 3.47Å; R133-D135 IonicContact CZ-OD2 3.48Å; R133-D135 IonicContact NE-OD1 3.89Å; R133-D135 PolarHBondContact NE-OD1 3.23Å; R133-D135 IonicContact NE-OD2 2.82Å; R133-D135 IonicContact NH2-OD1 2.64Å; R133-D135 PolarHBondContact NH2-OD1 2.87Å; R133-D135 IonicContact NH2-OD2 2.69Å; R133-D135 PolarHBondContact NH2-OD2 3.43Å; R133-R140 VanDerWaalsContact NH2-NE 3.17Å; R133-F141 CarbonylContact C-O 3.58Å; R133-F141 VanDerWaalsContact CA-O 3.32Å; R133-F141 WeakPolarHBondContact CA-O 3.33Å; R133-Y142 HydrophobicContact CB-CD1 4.26Å; R133-Y142 HydrophobicContact CB-CE1 4.33Å; R133-Y142 HydrophobicContact CG-CD1 4.36Å; R133-Y142 HydrophobicContact CG-CE1 4.1Å
134V97.1Very high91.6Very high11 Ų1167.4 Ų67.47%0.06733%0.328CS..EExtended strand (participates in β ladder)trans-121.6117.8174.2-168.60000108.6I136 F141 L143 E300 A304V134-I136 HydrophobicContact CG1-CD1 3.78Å; V134-I136 HydrophobicContact CG1-CG1 3.83Å; V134-F141 HydrophobicContact CB-CB 4.4Å; V134-F141 PolarHBondContact N-O 2.82Å; V134-F141 PolarHBondContact O-N 3Å; V134-L143 HydrophobicContact CG2-CD1 4.06Å; V134-E300 HydrophobicContact CG1-CB 3.95Å; V134-A304 HydrophobicContact CG2-CB 3.63Å
135D94.9Very high93.7Very high76 Ų7664.7 Ų64.741%0.40631%0.305SS..EExtended strand (participates in β ladder)trans-98.1120.4178.4-82.519.1000109.7R133 R140R133-D135 WeakPolarHBondContact CG-OD1 3.13Å; R133-D135 IonicContact CZ-OD1 3.47Å; R133-D135 IonicContact CZ-OD2 3.48Å; R133-D135 IonicContact NE-OD1 3.89Å; R133-D135 PolarHBondContact NE-OD1 3.23Å; R133-D135 IonicContact NE-OD2 2.82Å; R133-D135 IonicContact NH2-OD1 2.64Å; R133-D135 PolarHBondContact NH2-OD1 2.87Å; R133-D135 IonicContact NH2-OD2 2.69Å; R133-D135 PolarHBondContact NH2-OD2 3.43Å; D135-R140 VanDerWaalsContact OD1-CG 3.26Å; D135-R140 WeakPolarHBondContact OD1-CG 3.27Å; D135-R140 IonicContact OD1-NE 3.41Å; D135-R140 IonicContact OD2-NE 3.42Å; D135-R140 PolarHBondContact OD2-NE 3.16Å
136I94.2Very high94.8Very high8 Ų857.3 Ų57.34%0.04127%0.27CS..EExtended strand (participates in β ladder)trans-133.3112.6-176.2-56.2166.2000108.3V134 K138 K139 F141 L293 P294 G297V134-I136 HydrophobicContact CG1-CD1 3.78Å; V134-I136 HydrophobicContact CG1-CG1 3.83Å; I136-K138 PolarHBondContact O-N 3.17Å; I136-K138 VanDerWaalsContact O-N 3.12Å; I136-K139 PolarHBondContact N-O 2.79Å; I136-K139 WeakPolarHBondContact O-CB 3.43Å; I136-K139 PolarHBondContact O-N 3.34Å; I136-F141 HydrophobicContact CB-CE2 4.2Å; I136-F141 HydrophobicContact CD1-CD2 3.82Å; I136-F141 HydrophobicContact CD1-CE2 3.86Å; I136-F141 HydrophobicContact CG1-CD2 4.35Å; I136-F141 HydrophobicContact CG1-CE2 4.42Å; I136-L293 HydrophobicContact CD1-CD1 3.31Å; I136-P294 HydrophobicContact CG2-CB 3.8Å; I136-P294 HydrophobicContact CG2-CG 3.73Å; I136-G297 WeakPolarHBondContact CD1-O 2.99Å
137Q90.3Very high95Very high142 Ų14256.3 Ų56.366%0.66426%0.263SS*.THydrogen-bonded Turntrans53-114.4-176.5-58179.2-14.800112.1
138K88.4Confident94.8Very high129 Ų12952.3 Ų52.356%0.56125%0.248SC*.THydrogen-bonded Turntrans-101.819.6178.2-63.4-179.6-179.8178.70112I136 W160 I161I136-K138 PolarHBondContact O-N 3.17Å; I136-K138 VanDerWaalsContact O-N 3.12Å; K138-W160 HydrophobicContact CB-CD2 4.27Å; K138-W160 HydrophobicContact CB-CE3 4.43Å; K138-W160 HydrophobicContact CB-CH2 3.65Å; K138-W160 HydrophobicContact CB-CZ2 3.5Å; K138-W160 VanDerWaalsContact CB-CZ2 3.5Å; K138-W160 HydrophobicContact CB-CZ3 4.14Å; K138-W160 HydrophobicContact CD-CH2 4.16Å; K138-W160 HydrophobicContact CD-CZ2 3.62Å; K138-W160 HydrophobicContact CG-CH2 4.45Å; K138-W160 HydrophobicContact CG-CZ2 4.17Å; K138-W160 CarbonylContact O-C 3.57Å; K138-W160 WeakPolarHBondContact O-CA 3.5Å; K138-I161 PolarHBondContact O-N 3.22Å
139K91.5Very high94.5Very high20 Ų2052.2 Ų52.29%0.08726%0.259CS..EExtended strand (participates in β ladder)trans-122.5145.9179.6-62.7-173.6-179.5-163.10110.8I136 F141 E158 V159 W160 V292 P294I136-K139 PolarHBondContact N-O 2.79Å; I136-K139 WeakPolarHBondContact O-CB 3.43Å; I136-K139 PolarHBondContact O-N 3.34Å; K139-F141 HydrophobicContact CB-CD2 4.46Å; K139-F141 HydrophobicContact CB-CE2 3.75Å; K139-F141 HydrophobicContact CB-CZ 4.16Å; K139-F141 HydrophobicContact CD-CE2 4.27Å; K139-F141 HydrophobicContact CD-CZ 3.91Å; K139-E158 HydrophobicContact CD-CG 4.13Å; K139-E158 WeakPolarHBondContact CD-OE1 3.28Å; K139-E158 WeakPolarHBondContact CE-OE1 3.37Å; K139-E158 IonicContact NZ-OE1 3.66Å; K139-E158 PolarHBondContact NZ-OE1 3.22Å; K139-E158 IonicContact NZ-OE2 3.37Å; K139-V159 CarbonylContact C-O 3.51Å; K139-V159 VanDerWaalsContact CA-O 3.32Å; K139-V159 WeakPolarHBondContact CA-O 3.26Å; K139-W160 HydrophobicContact CD-CE3 4.24Å; K139-W160 HydrophobicContact CD-CZ3 4.29Å; K139-W160 HydrophobicContact CG-CE3 3.55Å; K139-W160 HydrophobicContact CG-CZ3 3.77Å; K139-V292 PolarHBondContact NZ-O 3.47Å; K139-P294 HydrophobicContact CD-CG 4.43Å
140R93.8Very high94Very high76 Ų7661.5 Ų61.529%0.28729%0.291SS..EExtended strand (participates in β ladder)trans-114.1132.6165.1-54.7-171.7165.31441.8108.3R133 D135 Y142 V159 I161R133-R140 VanDerWaalsContact NH2-NE 3.17Å; D135-R140 VanDerWaalsContact OD1-CG 3.26Å; D135-R140 WeakPolarHBondContact OD1-CG 3.27Å; D135-R140 IonicContact OD1-NE 3.41Å; D135-R140 IonicContact OD2-NE 3.42Å; D135-R140 PolarHBondContact OD2-NE 3.16Å; R140-Y142 HydrophobicContact CB-CE2 3.9Å; R140-V159 PolarHBondContact N-O 3.4Å; R140-V159 PolarHBondContact O-N 3.25Å; R140-I161 HydrophobicContact CG-CD1 3.29Å; R140-I161 HydrophobicContact CG-CG1 3.46Å; R140-I161 VanDerWaalsContact CG-CG1 3.46Å
141F96.4Very high93.5Very high0 Ų062 Ų620%030%0.298CS..EExtended strand (participates in β ladder)trans-108.4126.9170.2-62.2-90.3000108.2R133 V134 I136 K139 L143 I156 A157 E158 V292 L293 F301R133-F141 CarbonylContact C-O 3.58Å; R133-F141 VanDerWaalsContact CA-O 3.32Å; R133-F141 WeakPolarHBondContact CA-O 3.33Å; V134-F141 HydrophobicContact CB-CB 4.4Å; V134-F141 PolarHBondContact N-O 2.82Å; V134-F141 PolarHBondContact O-N 3Å; I136-F141 HydrophobicContact CB-CE2 4.2Å; I136-F141 HydrophobicContact CD1-CD2 3.82Å; I136-F141 HydrophobicContact CD1-CE2 3.86Å; I136-F141 HydrophobicContact CG1-CD2 4.35Å; I136-F141 HydrophobicContact CG1-CE2 4.42Å; K139-F141 HydrophobicContact CB-CD2 4.46Å; K139-F141 HydrophobicContact CB-CE2 3.75Å; K139-F141 HydrophobicContact CB-CZ 4.16Å; K139-F141 HydrophobicContact CD-CE2 4.27Å; K139-F141 HydrophobicContact CD-CZ 3.91Å; F141-L143 HydrophobicContact CB-CD1 3.9Å; F141-I156 HydrophobicContact CD1-CG2 4.38Å; F141-A157 CarbonylContact C-O 3.58Å; F141-A157 VanDerWaalsContact CA-O 3.28Å; F141-A157 WeakPolarHBondContact CA-O 3.2Å; F141-E158 HydrophobicContact CD1-CB 4.05Å; F141-E158 HydrophobicContact CD1-CG 4.3Å; F141-E158 HydrophobicContact CE1-CB 3.79Å; F141-E158 HydrophobicContact CE1-CG 3.68Å; F141-E158 HydrophobicContact CZ-CG 4.04Å; F141-V292 WeakPolarHBondContact CZ-O 3.32Å; F141-L293 HydrophobicContact CD2-CD1 4.38Å; F141-L293 HydrophobicContact CE1-CD1 4.49Å; F141-L293 HydrophobicContact CE2-CD1 3.92Å; F141-L293 HydrophobicContact CZ-CD1 3.97Å; F141-F301 HydrophobicContact CB-CD2 4.41Å; F141-F301 HydrophobicContact CB-CE2 3.97Å; F141-F301 HydrophobicContact CD1-CE2 4.14Å; F141-F301 HydrophobicContact CG-CD2 4.41Å; F141-F301 HydrophobicContact CG-CE2 4.07Å
142Y97.3Very high93.4Very high71 Ų7162.1 Ų62.128%0.27829%0.288SS..EExtended strand (participates in β ladder)trans-105.4123.9170.6-60.4-90.2000107.7R133 R140 I156 A157 V159R133-Y142 HydrophobicContact CB-CD1 4.26Å; R133-Y142 HydrophobicContact CB-CE1 4.33Å; R133-Y142 HydrophobicContact CG-CD1 4.36Å; R133-Y142 HydrophobicContact CG-CE1 4.1Å; R140-Y142 HydrophobicContact CB-CE2 3.9Å; Y142-I156 CarbonylContact O-C 3.57Å; Y142-I156 VanDerWaalsContact O-CA 3.28Å; Y142-I156 WeakPolarHBondContact O-CA 3.14Å; Y142-A157 PolarHBondContact N-O 2.92Å; Y142-A157 PolarHBondContact O-N 2.77Å; Y142-V159 HydrophobicContact CD2-CG2 4.13Å; Y142-V159 HydrophobicContact CE2-CB 4.31Å; Y142-V159 HydrophobicContact CE2-CG2 3.88Å
143L97.9Very high93.3Very high0 Ų061.4 Ų61.40%029%0.285CS..EExtended strand (participates in β ladder)trans-111.798-179.6-74.971.7000106.6S131 K132 V134 F141 L154 I156 F301 A304 L305 L308S131-L143 WeakPolarHBondContact CA-O 3.37Å; K132-L143 HydrophobicContact CB-CB 4.44Å; K132-L143 PolarHBondContact N-O 2.76Å; K132-L143 PolarHBondContact O-N 3.04Å; V134-L143 HydrophobicContact CG2-CD1 4.06Å; F141-L143 HydrophobicContact CB-CD1 3.9Å; L143-L154 HydrophobicContact CB-CD1 4.14Å; L143-I156 HydrophobicContact CG-CG1 4.46Å; L143-F301 HydrophobicContact CD1-CD2 4.44Å; L143-F301 HydrophobicContact CD1-CE2 3.77Å; L143-F301 HydrophobicContact CD1-CZ 4.25Å; L143-F301 HydrophobicContact CD2-CE2 4.3Å; L143-F301 HydrophobicContact CD2-CZ 4.17Å; L143-F301 HydrophobicContact CG-CE2 4.34Å; L143-F301 HydrophobicContact CG-CZ 4.34Å; L143-A304 HydrophobicContact CD2-CB 4.05Å; L143-L305 HydrophobicContact CD2-CD2 3.86Å; L143-L305 HydrophobicContact CD2-CG 4.33Å; L143-L308 HydrophobicContact CB-CD1 3.76Å; L143-L308 HydrophobicContact CD2-CD1 4.07Å
144D97.3Very high93.3Very high21 Ų2155.4 Ų55.411%0.11226%0.263CS..EExtended strand (participates in β ladder)trans-103114.4-177.2-51.5-35.7000109.3A130 S131 K146 K155A130-D144 CarbonylContact O-C 3.53Å; A130-D144 WeakPolarHBondContact O-CA 3.48Å; S131-D144 WeakPolarHBondContact CB-OD1 3.23Å; S131-D144 PolarHBondContact OG-OD1 3.29Å; D144-K146 HydrophobicContact CB-CG 4.35Å; D144-K155 HydrophobicContact CB-CB 4.41Å; D144-K155 PolarHBondContact N-O 3.07Å; D144-K155 PolarHBondContact O-N 2.81Å
145V97.3Very high93.2Very high1 Ų158.3 Ų58.31%0.00628%0.275CS..EExtended strand (participates in β ladder)trans-82.3124.3167.8-178.70000107.8L129 A130 L154 L178 L308 Y312L129-V145 HydrophobicContact CB-CB 4.43Å; L129-V145 HydrophobicContact CB-CG1 4.12Å; L129-V145 HydrophobicContact CD1-CG1 4.12Å; L129-V145 PolarHBondContact N-O 2.81Å; A130-V145 HydrophobicContact CB-CB 4.27Å; A130-V145 PolarHBondContact N-O 2.96Å; A130-V145 PolarHBondContact O-N 3.16Å; V145-L154 HydrophobicContact CG2-CD1 3.91Å; V145-L178 HydrophobicContact CG1-CD1 4.36Å; V145-L308 HydrophobicContact CG2-CB 4.11Å; V145-L308 HydrophobicContact CG2-CD1 4.17Å; V145-L308 HydrophobicContact CG2-CD2 3.88Å; V145-L308 HydrophobicContact CG2-CG 4.28Å; V145-Y312 HydrophobicContact CG1-CG 4.1Å; V145-Y312 HydrophobicContact CG2-CD2 4.43Å
146K95.8Very high93.3Very high29 Ų2954.7 Ų54.713%0.12626%0.255CS..EExtended strand (participates in β ladder)trans-130.3152.3-176.9-66.7179-174.9-72.30109.9I126 Q127 E128 D144 R152 F153I126-K146 HydrophobicContact CG2-CB 3.88Å; I126-K146 HydrophobicContact CG2-CD 4.04Å; I126-K146 HydrophobicContact CG2-CG 4.34Å; Q127-K146 CarbonylContact O-C 3.51Å; Q127-K146 VanDerWaalsContact O-CA 3.24Å; Q127-K146 WeakPolarHBondContact O-CA 3.43Å; E128-K146 IonicContact OE2-NZ 3.71Å; E128-K146 PolarHBondContact OE2-NZ 3.22Å; D144-K146 HydrophobicContact CB-CG 4.35Å; K146-R152 CarbonylContact O-C 3.5Å; K146-R152 WeakPolarHBondContact O-CA 3.39Å; K146-F153 HydrophobicContact CB-CD1 4.26Å; K146-F153 HydrophobicContact CB-CD2 4.35Å; K146-F153 HydrophobicContact CB-CE1 3.66Å; K146-F153 HydrophobicContact CB-CE2 3.8Å; K146-F153 HydrophobicContact CB-CZ 3.43Å; K146-F153 VanDerWaalsContact CB-CZ 3.43Å; K146-F153 HydrophobicContact CD-CE2 3.98Å; K146-F153 HydrophobicContact CD-CZ 3.9Å; K146-F153 HydrophobicContact CG-CE2 4.41Å; K146-F153 HydrophobicContact CG-CZ 4.28Å; K146-F153 PolarHBondContact N-O 2.95Å; K146-F153 PolarHBondContact O-N 3.4Å
147Q92.9Very high93.3Very high72 Ų7255.3 Ų55.334%0.33626%0.261SS..EExtended strand (participates in β ladder)trans-113.6132.8174.8-176.8166.5-23.500109.3I126 Q127 L129 R152I126-Q147 CarbonylContact C-O 3.5Å; I126-Q147 VanDerWaalsContact CA-O 3.24Å; I126-Q147 WeakPolarHBondContact CA-O 3.44Å; Q127-Q147 HydrophobicContact CB-CB 4.39Å; Q127-Q147 PolarHBondContact N-O 2.68Å; Q127-Q147 PolarHBondContact O-N 3.33Å; L129-Q147 HydrophobicContact CD1-CB 3.98Å; L129-Q147 HydrophobicContact CD2-CB 4.28Å; L129-Q147 HydrophobicContact CG-CB 4.11Å; Q147-R152 HydrophobicContact CB-CG 4.39Å; Q147-R152 HydrophobicContact CG-CG 4.36Å
148S89.8Confident93.4Very high27 Ų2749.6 Ų49.619%0.18924%0.235CC..EExtended strand (participates in β ladder)trans-124.1174.1170.9-175.90000108.9R150 G151S148-R150 PolarHBondContact O-N 3.47Å; S148-R150 VanDerWaalsContact O-N 3.09Å; S148-G151 PolarHBondContact N-O 3.24Å; S148-G151 PolarHBondContact O-N 2.82Å
149S87.4Confident93.5Very high107 Ų10745.6 Ų45.675%0.74822%0.221SC*.THydrogen-bonded Turntrans-58.4-18.7170.8560000113.6
150R83.8Confident93.4Very high236 Ų23648 Ų4889%0.89123%0.23SC*.THydrogen-bonded Turntrans-88.92.1175.9-63.7-179.161.9112.45.3114.2S148S148-R150 PolarHBondContact O-N 3.47Å; S148-R150 VanDerWaalsContact O-N 3.09Å
151G88.1Confident92.7Very high26 Ų2647.5 Ų47.527%0.26823%0.232SC..EExtended strand (participates in β ladder)trans107.4-171.4-173.800000113.6S148S148-G151 PolarHBondContact N-O 3.24Å; S148-G151 PolarHBondContact O-N 2.82Å
152R93.3Very high91.7Very high70 Ų7049.1 Ų49.126%0.26425%0.249SC..EExtended strand (participates in β ladder)trans-85.4144-177.4-62.6-179.4-175166.15.6111.1L129 K146 Q147 L178 Y312L129-R152 HydrophobicContact CD1-CG 4.03Å; K146-R152 CarbonylContact O-C 3.5Å; K146-R152 WeakPolarHBondContact O-CA 3.39Å; Q147-R152 HydrophobicContact CB-CG 4.39Å; Q147-R152 HydrophobicContact CG-CG 4.36Å; R152-L178 HydrophobicContact CB-CD1 3.58Å; R152-Y312 PolarHBondContact NH1-O 2.91Å
153F94.6Very high89.9Confident39 Ų3958.5 Ų58.517%0.17128%0.283CS..EExtended strand (participates in β ladder)trans-145.5155.2178.668.5-87.5000111.8I126 K146 K155 T175 L176I126-F153 HydrophobicContact CD1-CZ 4.46Å; I126-F153 HydrophobicContact CG2-CE1 4.1Å; I126-F153 HydrophobicContact CG2-CZ 3.91Å; K146-F153 HydrophobicContact CB-CD1 4.26Å; K146-F153 HydrophobicContact CB-CD2 4.35Å; K146-F153 HydrophobicContact CB-CE1 3.66Å; K146-F153 HydrophobicContact CB-CE2 3.8Å; K146-F153 HydrophobicContact CB-CZ 3.43Å; K146-F153 VanDerWaalsContact CB-CZ 3.43Å; K146-F153 HydrophobicContact CD-CE2 3.98Å; K146-F153 HydrophobicContact CD-CZ 3.9Å; K146-F153 HydrophobicContact CG-CE2 4.41Å; K146-F153 HydrophobicContact CG-CZ 4.28Å; K146-F153 PolarHBondContact N-O 2.95Å; K146-F153 PolarHBondContact O-N 3.4Å; F153-K155 HydrophobicContact CE2-CB 4.45Å; F153-T175 HydrophobicContact CD2-CG2 3.64Å; F153-T175 HydrophobicContact CE2-CG2 4.03Å; F153-L176 WeakPolarHBondContact CB-O 3.48Å
154L96.6Very high88Confident3 Ų361.9 Ų61.92%0.01632%0.319CS..EExtended strand (participates in β ladder)trans-104.4128.5176.2-178.468.3000110.1L143 V145 I156 T175 L176 A181 L305 L308L143-L154 HydrophobicContact CB-CD1 4.14Å; V145-L154 HydrophobicContact CG2-CD1 3.91Å; L154-I156 HydrophobicContact CD2-CD1 4.22Å; L154-I156 HydrophobicContact CD2-CG1 4.07Å; L154-I156 HydrophobicContact CG-CG1 4.15Å; L154-T175 WeakPolarHBondContact O-CA 3.24Å; L154-L176 HydrophobicContact CB-CG 4.44Å; L154-L176 PolarHBondContact N-O 3.25Å; L154-L176 PolarHBondContact O-N 2.87Å; L154-A181 HydrophobicContact CD2-CB 3.94Å; L154-L305 HydrophobicContact CD2-CD2 3.39Å; L154-L308 HydrophobicContact CD1-CD1 4.17Å
155K96.3Very high86.1Confident72 Ų7269.1 Ų69.131%0.31335%0.345SS..EExtended strand (participates in β ladder)trans-110.5120171.7-177.1-175.2177.6-169.10109.7D144 F153D144-K155 HydrophobicContact CB-CB 4.41Å; D144-K155 PolarHBondContact N-O 3.07Å; D144-K155 PolarHBondContact O-N 2.81Å; F153-K155 HydrophobicContact CE2-CB 4.45Å
156I96.3Very high84.1Confident0 Ų078.2 Ų78.20%039%0.387CS..EExtended strand (participates in β ladder)trans-104.5124.7176.3-52.6163.2000108.4F141 Y142 L143 L154 K173 L174 L176 L184 I291 F301F141-I156 HydrophobicContact CD1-CG2 4.38Å; Y142-I156 CarbonylContact O-C 3.57Å; Y142-I156 VanDerWaalsContact O-CA 3.28Å; Y142-I156 WeakPolarHBondContact O-CA 3.14Å; L143-I156 HydrophobicContact CG-CG1 4.46Å; L154-I156 HydrophobicContact CD2-CD1 4.22Å; L154-I156 HydrophobicContact CD2-CG1 4.07Å; L154-I156 HydrophobicContact CG-CG1 4.15Å; I156-K173 CarbonylContact O-C 3.53Å; I156-K173 VanDerWaalsContact O-CA 3.23Å; I156-K173 WeakPolarHBondContact O-CA 3.43Å; I156-L174 HydrophobicContact CB-CB 4.38Å; I156-L174 HydrophobicContact CD1-CD2 4.34Å; I156-L174 PolarHBondContact N-O 3Å; I156-L174 PolarHBondContact O-N 3.19Å; I156-L176 HydrophobicContact CD1-CD2 3.68Å; I156-L176 HydrophobicContact CG1-CD2 4.33Å; I156-L184 HydrophobicContact CD1-CD2 4.48Å; I156-I291 HydrophobicContact CB-CD1 4.28Å; I156-I291 HydrophobicContact CD1-CD1 4.07Å; I156-I291 HydrophobicContact CG2-CD1 3.71Å; I156-F301 HydrophobicContact CD1-CE1 4.43Å; I156-F301 HydrophobicContact CD1-CZ 3.95Å; I156-F301 HydrophobicContact CG1-CZ 4.38Å; I156-F301 HydrophobicContact CG2-CE2 4.21Å; I156-F301 HydrophobicContact CG2-CZ 3.94Å
157A94.6Very high82Confident21 Ų2182.1 Ų82.117%0.17441%0.409CS..EExtended strand (participates in β ladder)trans-119.7126.1174.700000110.9F141 Y142F141-A157 CarbonylContact C-O 3.58Å; F141-A157 VanDerWaalsContact CA-O 3.28Å; F141-A157 WeakPolarHBondContact CA-O 3.2Å; Y142-A157 PolarHBondContact N-O 2.92Å; Y142-A157 PolarHBondContact O-N 2.77Å
158E92.9Very high80Confident22 Ų2286 Ų8610%0.10343%0.432CS..EExtended strand (participates in β ladder)trans-96.5129174.5179.7-171152.300110.4K139 F141 S172 I291 V292K139-E158 HydrophobicContact CD-CG 4.13Å; K139-E158 WeakPolarHBondContact CD-OE1 3.28Å; K139-E158 WeakPolarHBondContact CE-OE1 3.37Å; K139-E158 IonicContact NZ-OE1 3.66Å; K139-E158 PolarHBondContact NZ-OE1 3.22Å; K139-E158 IonicContact NZ-OE2 3.37Å; F141-E158 HydrophobicContact CD1-CB 4.05Å; F141-E158 HydrophobicContact CD1-CG 4.3Å; F141-E158 HydrophobicContact CE1-CB 3.79Å; F141-E158 HydrophobicContact CE1-CG 3.68Å; F141-E158 HydrophobicContact CZ-CG 4.04Å; E158-S172 PolarHBondContact N-O 2.83Å; E158-I291 HydrophobicContact CB-CG2 4.23Å; E158-I291 WeakPolarHBondContact OE2-CA 3.44Å; E158-V292 PolarHBondContact OE2-N 3.23Å
159V90.8Very high78.3Confident44 Ų4487.6 Ų87.627%0.26744%0.438SS..EExtended strand (participates in β ladder)trans-131.2127.3178.5-1770000110.4K139 R140 Y142K139-V159 CarbonylContact C-O 3.51Å; K139-V159 VanDerWaalsContact CA-O 3.32Å; K139-V159 WeakPolarHBondContact CA-O 3.26Å; R140-V159 PolarHBondContact N-O 3.4Å; R140-V159 PolarHBondContact O-N 3.25Å; Y142-V159 HydrophobicContact CD2-CG2 4.13Å; Y142-V159 HydrophobicContact CE2-CB 4.31Å; Y142-V159 HydrophobicContact CE2-CG2 3.88Å
160W87.8Confident77Confident72 Ų7292.6 Ų92.627%0.27344%0.44SS..EExtended strand (participates in β ladder)trans-82.7131.7174.8-171.1-90.5000111.8K138 K139K138-W160 HydrophobicContact CB-CD2 4.27Å; K138-W160 HydrophobicContact CB-CE3 4.43Å; K138-W160 HydrophobicContact CB-CH2 3.65Å; K138-W160 HydrophobicContact CB-CZ2 3.5Å; K138-W160 VanDerWaalsContact CB-CZ2 3.5Å; K138-W160 HydrophobicContact CB-CZ3 4.14Å; K138-W160 HydrophobicContact CD-CH2 4.16Å; K138-W160 HydrophobicContact CD-CZ2 3.62Å; K138-W160 HydrophobicContact CG-CH2 4.45Å; K138-W160 HydrophobicContact CG-CZ2 4.17Å; K138-W160 CarbonylContact O-C 3.57Å; K138-W160 WeakPolarHBondContact O-CA 3.5Å; K139-W160 HydrophobicContact CD-CE3 4.24Å; K139-W160 HydrophobicContact CD-CZ3 4.29Å; K139-W160 HydrophobicContact CG-CE3 3.55Å; K139-W160 HydrophobicContact CG-CZ3 3.77Å
161I80.7Confident76.3Confident64 Ų6489 Ų8933%0.32843%0.431SS..  trans-104.485.8176.5-32.4157.8000108K138 R140K138-I161 PolarHBondContact O-N 3.22Å; R140-I161 HydrophobicContact CG-CD1 3.29Å; R140-I161 HydrophobicContact CG-CG1 3.46Å; R140-I161 VanDerWaalsContact CG-CG1 3.46Å
162G75.1Confident76.3Confident35 Ų3589.1 Ų89.136%0.36143%0.428SS..  trans-152.7124.8174.400000110.6G164G162-G164 PolarHBondContact O-N 3.34Å
163R58.4Low76.2Confident267 Ų26790.4 Ų90.4100%1.00844%0.436SS*.THydrogen-bonded Turntrans-64.9120171.5-71.1-165.1-168.7-122.77.1108.1
164G58Low76.1Confident72 Ų7288.6 Ų88.674%0.74243%0.428SS*.THydrogen-bonded Turntrans130.2-8.9170.800000117.1G162G162-G164 PolarHBondContact O-N 3.34Å
165R57.4Low76Confident173 Ų17390.3 Ų90.365%0.65344%0.438SS*.  trans-101.784.9163.3-94-166.8-176.9-176.40.1108.9I169R165-I169 HydrophobicContact CB-CD1 4.5Å; R165-I169 HydrophobicContact CB-CG1 4.38Å
166Q55.1Low75.9Confident191 Ų19187.1 Ų87.189%0.89343%0.425SS*.  trans-85.93.7173.7-165.478.2-100111.1
167D51.9Low75.8Confident112 Ų11288.4 Ų88.460%0.59943%0.434SS*.SBendtrans-118.593.8-167.528.8-47.5000107.8I169D167-I169 PolarHBondContact O-N 3.37Å
168N52Low75.7Confident153 Ų15387.8 Ų87.882%0.81843%0.427SS*.  trans4765.7168.2-71.1-69.9000114.8R170N168-R170 PolarHBondContact O-N 2.97Å
169I53.7Low75.7Confident60 Ų6088.7 Ų88.731%0.30844%0.436SS..  trans-55.795.5154.7-74.5159.6000106.2R165 D167 K171R165-I169 HydrophobicContact CB-CD1 4.5Å; R165-I169 HydrophobicContact CB-CG1 4.38Å; D167-I169 PolarHBondContact O-N 3.37Å; I169-K171 VanDerWaalsContact C-N 3.33Å; I169-K171 PolarHBondContact O-N 2.96Å
170R59.7Low75.9Confident212 Ų21286.8 Ų86.880%0.842%0.424SS*.  trans-53.3106.8164.7-66.7-178.7179.7-173-0.7104.8N168 S172N168-R170 PolarHBondContact O-N 2.97Å; R170-S172 PolarHBondContact O-N 2.88Å
171K68.6Low76.4Confident161 Ų16183.4 Ų83.470%0.741%0.412SS*.  trans-67.393.4171.7-68-178.9-178179.30105.3I169 K173I169-K171 VanDerWaalsContact C-N 3.33Å; I169-K171 PolarHBondContact O-N 2.96Å; K171-K173 PolarHBondContact O-N 3.09Å
172S87.9Confident77.1Confident29 Ų2981.8 Ų81.820%0.20341%0.408CS..EExtended strand (participates in β ladder)trans-63126.5175.1-98.60000107.6E158 R170 T290E158-S172 PolarHBondContact N-O 2.83Å; R170-S172 PolarHBondContact O-N 2.88Å; S172-T290 WeakPolarHBondContact CB-O 3.35Å; S172-T290 PolarHBondContact OG-O 2.98Å
173K91.2Very high78.1Confident97 Ų9783.5 Ų83.542%0.42241%0.407SS..EExtended strand (participates in β ladder)trans-137.1147.9-178.467.9175.1-177.4176.30110.2I156 K171 Q289I156-K173 CarbonylContact O-C 3.53Å; I156-K173 VanDerWaalsContact O-CA 3.23Å; I156-K173 WeakPolarHBondContact O-CA 3.43Å; K171-K173 PolarHBondContact O-N 3.09Å; K173-Q289 WeakPolarHBondContact O-CA 3.24Å
174L93.9Very high80Confident1 Ų171 Ų711%0.00536%0.36CS..EExtended strand (participates in β ladder)trans-133.8138.1174-170.665.6000108I156 L176 Y252 I267 Q269 Q289 I291I156-L174 HydrophobicContact CB-CB 4.38Å; I156-L174 HydrophobicContact CD1-CD2 4.34Å; I156-L174 PolarHBondContact N-O 3Å; I156-L174 PolarHBondContact O-N 3.19Å; L174-L176 HydrophobicContact CB-CD2 4.46Å; L174-L176 HydrophobicContact CD2-CD2 3.83Å; L174-L176 HydrophobicContact CG-CD2 3.77Å; L174-Y252 HydrophobicContact CD1-CD1 4.23Å; L174-Y252 HydrophobicContact CD1-CE1 4.21Å; L174-I267 HydrophobicContact CD2-CB 4.41Å; L174-I267 HydrophobicContact CD2-CG2 3.61Å; L174-Q269 HydrophobicContact CD1-CB 3.59Å; L174-Q289 HydrophobicContact CD1-CB 4.02Å; L174-I291 HydrophobicContact CB-CD1 4.48Å; L174-I291 HydrophobicContact CB-CG2 4.17Å; L174-I291 HydrophobicContact CD2-CD1 4.11Å; L174-I291 HydrophobicContact CD2-CG1 4.28Å
175T93.6Very high81.8Confident39 Ų3969.9 Ų69.924%0.23934%0.335CS..EExtended strand (participates in β ladder)trans-132.5118.6177.9-59.90000109.2F153 L154 Q269F153-T175 HydrophobicContact CD2-CG2 3.64Å; F153-T175 HydrophobicContact CE2-CG2 4.03Å; L154-T175 WeakPolarHBondContact O-CA 3.24Å; T175-Q269 PolarHBondContact O-OE1 2.87Å
176L94.1Very high83.8Confident4 Ų465.7 Ų65.72%0.02133%0.325CS..EExtended strand (participates in β ladder)trans-136.8158.6-173.555.2141.8000110.4F153 L154 I156 L174 V180 A181 L184 Y252F153-L176 WeakPolarHBondContact CB-O 3.48Å; L154-L176 HydrophobicContact CB-CG 4.44Å; L154-L176 PolarHBondContact N-O 3.25Å; L154-L176 PolarHBondContact O-N 2.87Å; I156-L176 HydrophobicContact CD1-CD2 3.68Å; I156-L176 HydrophobicContact CG1-CD2 4.33Å; L174-L176 HydrophobicContact CB-CD2 4.46Å; L174-L176 HydrophobicContact CD2-CD2 3.83Å; L174-L176 HydrophobicContact CG-CD2 3.77Å; L176-V180 HydrophobicContact CB-CB 4.15Å; L176-V180 HydrophobicContact CB-CG1 3.94Å; L176-V180 HydrophobicContact CD1-CB 4.11Å; L176-V180 HydrophobicContact CD1-CG1 3.81Å; L176-A181 HydrophobicContact CD1-CB 3.68Å; L176-L184 HydrophobicContact CD1-CD2 4.42Å; L176-Y252 HydrophobicContact CB-CE1 4.06Å
177S93.6Very high85.8Confident27 Ų2757.3 Ų57.319%0.18929%0.288CS..EExtended strand (participates in β ladder)trans-69161.3171.757.10000110.9S179 V180 A181S177-S179 VanDerWaalsContact C-N 3.25Å; S177-S179 WeakPolarHBondContact CB-OG 3.33Å; S177-S179 PolarHBondContact O-N 3.18Å; S177-S179 PolarHBondContact OG-OG 3.5Å; S177-V180 PolarHBondContact O-N 2.86Å; S177-V180 VanDerWaalsContact OG-CG2 3.31Å; S177-V180 WeakPolarHBondContact OG-CG2 3.46Å; S177-V180 PolarHBondContact OG-N 2.94Å; S177-A181 PolarHBondContact O-N 3.41Å
178L93.8Very high88Confident9 Ų952 Ų525%0.04726%0.259CS..Hα-helixtrans-64.6-32.2174-86.881.2000112.1V145 R152 V180 A181 A182 Y312V145-L178 HydrophobicContact CG1-CD1 4.36Å; R152-L178 HydrophobicContact CB-CD1 3.58Å; L178-V180 PolarHBondContact O-N 2.86Å; L178-A181 WeakPolarHBondContact O-CA 3.35Å; L178-A181 WeakPolarHBondContact O-CB 3.36Å; L178-A181 PolarHBondContact O-N 3.12Å; L178-A182 PolarHBondContact O-N 3.23Å; L178-Y312 VanDerWaalsContact CD2-C 3.48Å; L178-Y312 VanDerWaalsContact CD2-O 3.27Å; L178-Y312 WeakPolarHBondContact CD2-O 3.5Å
179S92.6Very high90.2Very high41 Ų4145.4 Ų45.429%0.28723%0.228SC..Hα-helixtrans-57.1-47.9171.542.50000112.8S177 A181 A182 E183S177-S179 VanDerWaalsContact C-N 3.25Å; S177-S179 WeakPolarHBondContact CB-OG 3.33Å; S177-S179 PolarHBondContact O-N 3.18Å; S177-S179 PolarHBondContact OG-OG 3.5Å; S179-A181 PolarHBondContact O-N 2.93Å; S179-A182 WeakPolarHBondContact O-CB 3.18Å; S179-A182 PolarHBondContact O-N 2.9Å; S179-E183 PolarHBondContact O-N 3.03Å
180V95.4Very high92.2Very high3 Ų346.1 Ų46.12%0.01823%0.232CC..Hα-helixtrans-66.7-29.7174.9173.60000111.2L176 S177 L178 A182 E183 L184 I245 R247 Y252L176-V180 HydrophobicContact CB-CB 4.15Å; L176-V180 HydrophobicContact CB-CG1 3.94Å; L176-V180 HydrophobicContact CD1-CB 4.11Å; L176-V180 HydrophobicContact CD1-CG1 3.81Å; S177-V180 PolarHBondContact O-N 2.86Å; S177-V180 VanDerWaalsContact OG-CG2 3.31Å; S177-V180 WeakPolarHBondContact OG-CG2 3.46Å; S177-V180 PolarHBondContact OG-N 2.94Å; L178-V180 PolarHBondContact O-N 2.86Å; V180-A182 VanDerWaalsContact C-N 3.33Å; V180-E183 PolarHBondContact O-N 2.86Å; V180-L184 WeakPolarHBondContact O-CB 3.41Å; V180-L184 PolarHBondContact O-N 3.07Å; V180-I245 HydrophobicContact CG1-CG2 4.06Å; V180-I245 HydrophobicContact CG2-CG2 4.5Å; V180-R247 HydrophobicContact CG2-CB 3.57Å; V180-R247 HydrophobicContact CG2-CG 3.78Å; V180-Y252 HydrophobicContact CG1-CD2 3.87Å; V180-Y252 HydrophobicContact CG1-CE1 4.48Å; V180-Y252 HydrophobicContact CG1-CE2 3.72Å; V180-Y252 HydrophobicContact CG1-CG 4.34Å; V180-Y252 HydrophobicContact CG2-CE2 4.15Å
181A96.8Very high94.1Very high2 Ų236 Ų362%0.01719%0.194CC..Hα-helixtrans-68-35176.800000111.6L154 L176 S177 L178 S179 L184 K185 I309L154-A181 HydrophobicContact CD2-CB 3.94Å; L176-A181 HydrophobicContact CD1-CB 3.68Å; S177-A181 PolarHBondContact O-N 3.41Å; L178-A181 WeakPolarHBondContact O-CA 3.35Å; L178-A181 WeakPolarHBondContact O-CB 3.36Å; L178-A181 PolarHBondContact O-N 3.12Å; S179-A181 PolarHBondContact O-N 2.93Å; A181-L184 PolarHBondContact O-N 2.83Å; A181-K185 PolarHBondContact O-N 2.78Å; A181-I309 HydrophobicContact CB-CD1 4.45Å
182A95.8Very high95.4Very high30 Ų3029.9 Ų29.925%0.24817%0.168CC..Hα-helixtrans-64.6-45.8173.400000112L178 S179 V180 L184 K185 D186 I309L178-A182 PolarHBondContact O-N 3.23Å; S179-A182 WeakPolarHBondContact O-CB 3.18Å; S179-A182 PolarHBondContact O-N 2.9Å; V180-A182 VanDerWaalsContact C-N 3.33Å; A182-L184 VanDerWaalsContact C-N 3.33Å; A182-L184 PolarHBondContact O-N 2.84Å; A182-K185 WeakPolarHBondContact O-CB 3.31Å; A182-K185 PolarHBondContact O-N 2.76Å; A182-D186 PolarHBondContact O-N 3.38Å; A182-I309 HydrophobicContact CB-CD1 4.27Å
183E96.9Very high95.8Very high70 Ų7034.3 Ų34.333%0.32719%0.186SC..Hα-helixtrans-62.3-41173.8-65.7-179.5-127.500111.4S179 V180 K185 D186 C187 I245S179-E183 PolarHBondContact O-N 3.03Å; V180-E183 PolarHBondContact O-N 2.86Å; E183-K185 VanDerWaalsContact C-N 3.33Å; E183-K185 PolarHBondContact O-N 3.06Å; E183-D186 PolarHBondContact O-N 3.12Å; E183-D186 VanDerWaalsContact O-N 3.13Å; E183-C187 PolarHBondContact O-N 2.69Å; E183-C187 PolarHBondContact O-SG 3.06Å; E183-I245 HydrophobicContact CB-CD1 3.91Å; E183-I245 HydrophobicContact CB-CG1 4.18Å; E183-I245 HydrophobicContact CB-CG2 4.22Å; E183-I245 WeakPolarHBondContact OE2-CG2 3.33Å
184L97.8Very high96Very high4 Ų432.6 Ų32.62%0.02118%0.179CC..Hα-helixtrans-60.6-40.8175.6174.361.6000112.3I156 L176 V180 A181 A182 D186 L188 I245 L254 I267 L305I156-L184 HydrophobicContact CD1-CD2 4.48Å; L176-L184 HydrophobicContact CD1-CD2 4.42Å; V180-L184 WeakPolarHBondContact O-CB 3.41Å; V180-L184 PolarHBondContact O-N 3.07Å; A181-L184 PolarHBondContact O-N 2.83Å; A182-L184 VanDerWaalsContact C-N 3.33Å; A182-L184 PolarHBondContact O-N 2.84Å; L184-D186 VanDerWaalsContact C-N 3.29Å; L184-D186 PolarHBondContact O-N 2.63Å; L184-L188 HydrophobicContact CD1-CD1 4.36Å; L184-L188 HydrophobicContact CD1-CG 4.27Å; L184-L188 HydrophobicContact CG-CD1 4.2Å; L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 VanDerWaalsContact O-CG 3.25Å; L184-L188 WeakPolarHBondContact O-CG 3.31Å; L184-L188 PolarHBondContact O-N 2.78Å; L184-I245 HydrophobicContact CB-CD1 4.05Å; L184-L254 HydrophobicContact CD1-CD2 3.51Å; L184-L254 HydrophobicContact CD1-CG 4.5Å; L184-I267 HydrophobicContact CD1-CD1 3.91Å; L184-I267 HydrophobicContact CD2-CD1 4.48Å; L184-L305 HydrophobicContact CD2-CD1 4.01Å; L184-L305 HydrophobicContact CG-CD1 4.01Å
185K97Very high96.1Very high49 Ų4935.7 Ų35.721%0.21319%0.191CC..Hα-helixtrans-57.6-43.3174.2158.7-163.1152.9-94.80111A181 A182 E183 L188 G189 R302 L305 V306 I309A181-K185 PolarHBondContact O-N 2.78Å; A182-K185 WeakPolarHBondContact O-CB 3.31Å; A182-K185 PolarHBondContact O-N 2.76Å; E183-K185 VanDerWaalsContact C-N 3.33Å; E183-K185 PolarHBondContact O-N 3.06Å; K185-L188 PolarHBondContact O-N 2.88Å; K185-G189 PolarHBondContact O-N 2.86Å; K185-R302 HydrophobicContact CG-CG 4.42Å; K185-L305 HydrophobicContact CB-CB 4.33Å; K185-L305 HydrophobicContact CB-CD1 4.48Å; K185-V306 HydrophobicContact CD-CG2 3.64Å; K185-V306 HydrophobicContact CG-CG2 3.89Å; K185-I309 HydrophobicContact CB-CD1 4.06Å; K185-I309 HydrophobicContact CD-CD1 3.96Å
186D97.6Very high96.2Very high86 Ų8636.6 Ų36.646%0.4620%0.202SC..Hα-helixtrans-71.3-47.6-177.5-63.9-23.1000110.8A182 E183 L184 L188 G189 D190A182-D186 PolarHBondContact O-N 3.38Å; E183-D186 PolarHBondContact O-N 3.12Å; E183-D186 VanDerWaalsContact O-N 3.13Å; L184-D186 VanDerWaalsContact C-N 3.29Å; L184-D186 PolarHBondContact O-N 2.63Å; D186-L188 PolarHBondContact O-N 2.85Å; D186-G189 WeakPolarHBondContact O-CA 3.39Å; D186-G189 PolarHBondContact O-N 3.37Å; D186-D190 PolarHBondContact O-N 2.84Å
187C97.9Very high96.1Very high15 Ų1541.8 Ų41.810%0.10123%0.227CC..Hα-helixtrans-54.6-40.9172.6-69.20000112E183 G189 D190 F191 D243 L254E183-C187 PolarHBondContact O-N 2.69Å; E183-C187 PolarHBondContact O-SG 3.06Å; C187-G189 VanDerWaalsContact C-N 3.26Å; C187-G189 PolarHBondContact O-N 3.03Å; C187-D190 PolarHBondContact O-N 2.82Å; C187-D190 VanDerWaalsContact O-N 3.14Å; C187-F191 HydrophobicContact CB-CE2 4.41Å; C187-F191 WeakPolarHBondContact O-CD2 3.48Å; C187-F191 PolarHBondContact O-N 3.42Å; C187-D243 PolarHBondContact SG-OD2 2.84Å; C187-L254 HydrophobicContact CB-CD2 3.99Å
188L97.9Very high95.9Very high0 Ų042.1 Ų42.10%023%0.226CC..Hα-helixtrans-59.5-36176.6-80.1167.8000112.2L184 K185 D186 F191 I192 L265 L293 M298 F301 R302 L305L184-L188 HydrophobicContact CD1-CD1 4.36Å; L184-L188 HydrophobicContact CD1-CG 4.27Å; L184-L188 HydrophobicContact CG-CD1 4.2Å; L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 VanDerWaalsContact O-CG 3.25Å; L184-L188 WeakPolarHBondContact O-CG 3.31Å; L184-L188 PolarHBondContact O-N 2.78Å; K185-L188 PolarHBondContact O-N 2.88Å; D186-L188 PolarHBondContact O-N 2.85Å; L188-F191 PolarHBondContact O-N 3.28Å; L188-I192 WeakPolarHBondContact O-CB 3.45Å; L188-I192 VanDerWaalsContact O-CD1 3.26Å; L188-I192 WeakPolarHBondContact O-CD1 3.45Å; L188-I192 WeakPolarHBondContact O-CG1 3.32Å; L188-I192 PolarHBondContact O-N 3.09Å; L188-L265 HydrophobicContact CD2-CD2 3.51Å; L188-L293 HydrophobicContact CD2-CD2 4.24Å; L188-M298 HydrophobicContact CD2-CB 4.43Å; L188-M298 HydrophobicContact CD2-CG 4.42Å; L188-F301 HydrophobicContact CD1-CD1 3.86Å; L188-F301 HydrophobicContact CD1-CE1 4.5Å; L188-R302 HydrophobicContact CB-CB 4.24Å; L188-R302 HydrophobicContact CB-CG 4.42Å; L188-R302 HydrophobicContact CD1-CB 4.29Å; L188-L305 HydrophobicContact CD1-CD1 3.75Å
189G97.7Very high95.1Very high15 Ų1544.3 Ų44.316%0.15525%0.25CS..Hα-helixtrans-55-52.4171.600000111.4K185 D186 C187 F191 I192 E193K185-G189 PolarHBondContact O-N 2.86Å; D186-G189 WeakPolarHBondContact O-CA 3.39Å; D186-G189 PolarHBondContact O-N 3.37Å; C187-G189 VanDerWaalsContact C-N 3.26Å; C187-G189 PolarHBondContact O-N 3.03Å; G189-F191 VanDerWaalsContact C-N 3.29Å; G189-F191 PolarHBondContact O-N 3.3Å; G189-I192 PolarHBondContact O-N 3.05Å; G189-I192 VanDerWaalsContact O-N 3.15Å; G189-E193 PolarHBondContact O-N 3.01Å
190D97.6Very high94.2Very high75 Ų7548.5 Ų48.540%0.40127%0.269SS..Hα-helixtrans-65.6-30.7-179.3-55.7-23.9000112.9D186 C187 H194 K241D186-D190 PolarHBondContact O-N 2.84Å; C187-D190 PolarHBondContact O-N 2.82Å; C187-D190 VanDerWaalsContact O-N 3.14Å; D190-H194 WeakPolarHBondContact O-CB 3.5Å; D190-H194 PolarHBondContact O-N 3.23Å; D190-H194 VanDerWaalsContact O-N 3.15Å; D190-K241 VanDerWaalsContact C-NZ 3.27Å; D190-K241 PolarHBondContact O-NZ 3.28Å
191F97.8Very high92.6Very high0 Ų056.2 Ų56.20%030%0.302CS..Hα-helixtrans-72.4-39.1174.3-79.8-71000112.2C187 L188 G189 H194 Y195 K241 D243 L254 L256 L265 M298C187-F191 HydrophobicContact CB-CE2 4.41Å; C187-F191 WeakPolarHBondContact O-CD2 3.48Å; C187-F191 PolarHBondContact O-N 3.42Å; L188-F191 PolarHBondContact O-N 3.28Å; G189-F191 VanDerWaalsContact C-N 3.29Å; G189-F191 PolarHBondContact O-N 3.3Å; F191-H194 PolarHBondContact O-N 3.44Å; F191-Y195 VanDerWaalsContact O-CB 3.27Å; F191-Y195 WeakPolarHBondContact O-CB 3.31Å; F191-Y195 PolarHBondContact O-N 2.93Å; F191-K241 HydrophobicContact CD1-CB 4.17Å; F191-K241 HydrophobicContact CD1-CD 3.74Å; F191-K241 HydrophobicContact CD1-CG 4.01Å; F191-K241 HydrophobicContact CE1-CB 3.76Å; F191-K241 HydrophobicContact CE1-CD 3.74Å; F191-K241 HydrophobicContact CE1-CG 3.52Å; F191-K241 HydrophobicContact CZ-CG 4.26Å; F191-D243 HydrophobicContact CE2-CB 3.86Å; F191-D243 HydrophobicContact CZ-CB 3.7Å; F191-L254 HydrophobicContact CE2-CB 3.75Å; F191-L254 HydrophobicContact CE2-CD2 3.92Å; F191-L254 HydrophobicContact CZ-CB 3.85Å; F191-L256 HydrophobicContact CD1-CB 3.73Å; F191-L256 HydrophobicContact CD1-CD2 4.23Å; F191-L256 HydrophobicContact CE1-CB 3.77Å; F191-L265 HydrophobicContact CD1-CD1 4.03Å; F191-L265 HydrophobicContact CD2-CD1 4.17Å; F191-L265 HydrophobicContact CD2-CD2 4.47Å; F191-L265 HydrophobicContact CE1-CD1 3.92Å; F191-L265 HydrophobicContact CE2-CD1 4.12Å; F191-L265 HydrophobicContact CG-CD1 4.16Å; F191-L265 HydrophobicContact CZ-CD1 3.99Å; F191-M298 HydrophobicContact CB-SD 4.18Å
192I97.1Very high90.7Very high32 Ų3259.6 Ų59.616%0.16434%0.338CS..Hα-helixtrans-62.7-46.8176.3-70.1157.8000109.9L188 G189 H194 Y195 A196 M298 I299 R302L188-I192 WeakPolarHBondContact O-CB 3.45Å; L188-I192 VanDerWaalsContact O-CD1 3.26Å; L188-I192 WeakPolarHBondContact O-CD1 3.45Å; L188-I192 WeakPolarHBondContact O-CG1 3.32Å; L188-I192 PolarHBondContact O-N 3.09Å; G189-I192 PolarHBondContact O-N 3.05Å; G189-I192 VanDerWaalsContact O-N 3.15Å; I192-H194 PolarHBondContact O-N 3.03Å; I192-Y195 PolarHBondContact O-N 3.18Å; I192-A196 PolarHBondContact O-N 3.23Å; I192-M298 HydrophobicContact CD1-CB 4.26Å; I192-M298 HydrophobicContact CG1-CB 3.74Å; I192-M298 HydrophobicContact CG1-CE 4.31Å; I192-I299 HydrophobicContact CD1-CB 4.49Å; I192-I299 HydrophobicContact CD1-CG1 3.89Å; I192-I299 HydrophobicContact CG1-CG1 4.03Å; I192-I299 HydrophobicContact CG2-CD1 4.16Å; I192-I299 HydrophobicContact CG2-CG1 3.87Å; I192-R302 HydrophobicContact CD1-CB 4.19Å
193E96.6Very high88.3Confident121 Ų12166.4 Ų66.457%0.56536%0.364SS*.Hα-helixtrans-59.6-48.4176.3-71.3-178.5-173.400111.4G189 Y195 A196 H197G189-E193 PolarHBondContact O-N 3.01Å; E193-Y195 VanDerWaalsContact C-N 3.32Å; E193-Y195 PolarHBondContact O-N 3.46Å; E193-A196 PolarHBondContact O-N 2.95Å; E193-H197 PolarHBondContact O-N 3.28Å; E193-H197 PolarHBondContact O-ND1 3.13Å
194H95.8Very high85.9Confident61 Ų6174 Ų7428%0.28239%0.39SS..Hα-helixtrans-60.2-42.3177.3-175.582.4000112.1D190 F191 I192 A196 H197 L198 K241D190-H194 WeakPolarHBondContact O-CB 3.5Å; D190-H194 PolarHBondContact O-N 3.23Å; D190-H194 VanDerWaalsContact O-N 3.15Å; F191-H194 PolarHBondContact O-N 3.44Å; I192-H194 PolarHBondContact O-N 3.03Å; H194-A196 PolarHBondContact O-N 3.37Å; H194-H197 PolarHBondContact O-N 2.82Å; H194-L198 WeakPolarHBondContact O-CG 3.49Å; H194-L198 PolarHBondContact O-N 3.48Å; H194-L198 VanDerWaalsContact O-N 3.13Å; H194-K241 HydrophobicContact CB-CD 3.91Å
195Y95.1Very high83.4Confident67 Ų6782.7 Ų82.726%0.26343%0.43SS..Hα-helixtrans-63-39.7178178.8-102.4000112.7F191 I192 E193 H197 L198 G199 R263 A295 M298F191-Y195 VanDerWaalsContact O-CB 3.27Å; F191-Y195 WeakPolarHBondContact O-CB 3.31Å; F191-Y195 PolarHBondContact O-N 2.93Å; I192-Y195 PolarHBondContact O-N 3.18Å; E193-Y195 VanDerWaalsContact C-N 3.32Å; E193-Y195 PolarHBondContact O-N 3.46Å; Y195-H197 VanDerWaalsContact C-N 3.34Å; Y195-H197 PolarHBondContact O-N 3.4Å; Y195-L198 PolarHBondContact O-N 3.26Å; Y195-G199 PolarHBondContact O-N 3.44Å; Y195-R263 HydrophobicContact CE2-CB 4.02Å; Y195-R263 HydrophobicContact CE2-CG 4.37Å; Y195-A295 HydrophobicContact CD2-CB 3.79Å; Y195-A295 HydrophobicContact CE2-CB 3.46Å; Y195-A295 VanDerWaalsContact CE2-CB 3.46Å; Y195-A295 HydrophobicContact CG-CB 4.45Å; Y195-M298 HydrophobicContact CD1-CE 4.28Å; Y195-M298 HydrophobicContact CD2-CE 4.44Å; Y195-M298 HydrophobicContact CG-CE 3.92Å
196A94.8Very high81Confident57 Ų5789 Ų8947%0.47146%0.46SS..Hα-helixtrans-60.4-43175.200000111.8I192 E193 H194 L198 G199I192-A196 PolarHBondContact O-N 3.23Å; E193-A196 PolarHBondContact O-N 2.95Å; H194-A196 PolarHBondContact O-N 3.37Å; A196-L198 VanDerWaalsContact C-N 3.33Å; A196-L198 PolarHBondContact O-N 3.07Å; A196-G199 PolarHBondContact O-N 3.49Å
197H93.1Very high78.6Confident114 Ų11494.6 Ų94.653%0.52848%0.483SS..Hα-helixtrans-65.4-34176.7-68.799000113.2E193 H194 Y195 G199 L200 K201E193-H197 PolarHBondContact O-N 3.28Å; E193-H197 PolarHBondContact O-ND1 3.13Å; H194-H197 PolarHBondContact O-N 2.82Å; Y195-H197 VanDerWaalsContact C-N 3.34Å; Y195-H197 PolarHBondContact O-N 3.4Å; H197-G199 VanDerWaalsContact C-N 3.31Å; H197-L200 PolarHBondContact O-N 3.3Å; H197-K201 PolarHBondContact O-N 3.45Å
198L89.3Confident75.4Confident34 Ų3497.6 Ų97.618%0.17852%0.517CS..Hα-helixtrans-68.4-30175.5-68.1172.9000112.5H194 Y195 A196 L200 L240H194-L198 WeakPolarHBondContact O-CG 3.49Å; H194-L198 PolarHBondContact O-N 3.48Å; H194-L198 VanDerWaalsContact O-N 3.13Å; Y195-L198 PolarHBondContact O-N 3.26Å; A196-L198 VanDerWaalsContact C-N 3.33Å; A196-L198 PolarHBondContact O-N 3.07Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.15Å; L198-L240 HydrophobicContact CD1-CB 4.32Å; L198-L240 HydrophobicContact CD1-CD1 3.74Å; L198-L240 HydrophobicContact CD1-CD2 4.48Å; L198-L240 HydrophobicContact CD1-CG 4.41Å
199G77.8Confident72.9Confident54 Ų54107.2 Ų107.256%0.55756%0.561SS**Hα-helixtrans-64.8-32.7174.600000113.1Y195 A196 H197Y195-G199 PolarHBondContact O-N 3.44Å; A196-G199 PolarHBondContact O-N 3.49Å; H197-G199 VanDerWaalsContact C-N 3.31Å
200L72.1Confident69.6Low130 Ų130112.1 Ų112.168%0.68159%0.594SS**Hα-helixtrans-82-28.3-179.6-62173.9000113.2H197 L198H197-L200 PolarHBondContact O-N 3.3Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.15Å
201K62.6Low67.2Low164 Ų164117.8 Ų117.871%0.71362%0.615SS**Hα-helixtrans-76.7-21.6-178.8-74.1-178.1177179.70114H197 H203H197-K201 PolarHBondContact O-N 3.45Å; K201-H203 PolarHBondContact O-N 2.8Å
202G55.8Low64.1Low74 Ų74127.1 Ų127.176%0.76366%0.658SS**THydrogen-bonded Turntrans-67.6-10.3177.900000115.4
203H46.5Very low61.6Low173 Ų173134.9 Ų134.980%0.80169%0.694SS**THydrogen-bonded Turntrans-113.48.4-175.1-158-68.3000114K201K201-H203 PolarHBondContact O-N 2.8Å
204R45.7Very low58.7Low230 Ų230132.6 Ų132.687%0.86870%0.703SS**SBendtrans-114.224.2-178.2-79.9-169.985.2166.65.7115.3
205Q46.7Very low56Low185 Ų185135.9 Ų135.986%0.86473%0.732SS**SBendtrans-130.642.3178.9-143173.120.200114.6
206E46.6Very low53.6Low181 Ų181144.5 Ų144.585%0.84677%0.765SS**SBendtrans-152.579.8155.7-84.3-152.8136.200110.4
207H45.4Very low51Low204 Ų204152.7 Ų152.794%0.94478%0.783SS**  trans173.3112.7142.9-96.76.6000110.1
208G32.1Very low48.3Very low79 Ų79157.8 Ų157.881%0.81480%0.798SS**  trans167.937.4177.300000114.5S210G208-S210 PolarHBondContact O-N 3.18Å
209H44.2Very low46.2Very low201 Ų201164.5 Ų164.593%0.93183%0.828SS**  trans-74.9105.5159.3-114.3-65000107.4
210S29.8Very low44.2Very low119 Ų119171.8 Ų171.883%0.83285%0.845SS**  trans-139.4132.8154.1-166.10000110.2G208G208-S210 PolarHBondContact O-N 3.18Å
211K45.8Very low42.5Very low193 Ų193173.8 Ų173.884%0.83985%0.85SS**  trans-64.4142.5-175.9-65.6163.8171.8173.70110.7
212E34.5Very low41.2Very low197 Ų197171.8 Ų171.892%0.92186%0.857SS**  trans-148.3121.9134.6-132.8173-172.800111.3
213Q42.8Very low40.5Very low194 Ų194172.6 Ų172.691%0.90786%0.857SS**  trans-79.3146.5174-76174.9-27.400109.8
214G36Very low40.3Very low73 Ų73170.5 Ų170.575%0.75386%0.858SS**  trans126.192139.300000116.9
215S40.1Very low39.9Very low130 Ų130164.9 Ų164.991%0.90985%0.854SS**  -170.3127.3118.8-91.60000112.7
216R45.2Very low40.2Very low249 Ų249161.8 Ų161.894%0.9485%0.85SS**  trans-69.2132176.8-63.9167.3171.4170.6-4.1110.4
217R39.3Very low40.4Very low228 Ų228158.4 Ų158.486%0.8684%0.844SS**  trans-158.8102.9142.9-149.8168.3176.8-170.9-2.5114.4
218R37.1Very low40Very low221 Ų221155 Ų15583%0.83484%0.837SS**  trans69.2108.5138.5-160.4171.8171.3-166.9-0.9119.9
219Q44.4Very low40.9Very low176 Ų176157.2 Ų157.282%0.82284%0.84SS**  trans-57.9139.5163.1-72.7167.7-49.400113.2
220K36.3Very low41Very low206 Ų206154 Ų15490%0.89683%0.834SS**  trans-152.5136.3142.4-150.2175.4-177.6-172.20109.9
221H36.5Very low41.1Very low172 Ų172151.8 Ų151.880%0.79683%0.83SS**  trans-74.6143.8-163.9-61-97.4000115.4
222S34.9Very low41Very low123 Ų123147.7 Ų147.786%0.8683%0.826SS**  trans-150.6147.3143.447.30000109.7
223A41.1Very low41.2Very low91 Ų91146.1 Ų146.175%0.75282%0.818SS**PPolyproline II helixtrans-72.3167.2-155.300000116.2
224P41.8Very low41.2Very low129 Ų129144.3 Ų144.384%0.83881%0.81SS**PPolyproline II helixtrans-86.2135-168.534-29.4000112.3
225S38.2Very low41.7Very low111 Ų111147.7 Ų147.778%0.77681%0.806SS**PPolyproline II helixtrans-91.5149.7166.1-52.80000110.1
226P52.5Low42.3Very low120 Ų120146.8 Ų146.878%0.77980%0.797SS**PPolyproline II helixtrans-70.5151.7-166.428.7-34.5000112.9
227P50.7Low43.3Very low111 Ų111139 Ų13972%0.72177%0.771SS**PPolyproline II helixtrans-80.2160.6171.635.7-32.3000110.1
228V37.4Very low45.6Very low133 Ų133130.8 Ų130.881%0.80675%0.748SS**  trans101.169.9170.1-44.30000116.5
229S51.2Low48.2Very low124 Ų124124 Ų12487%0.86773%0.731SS**  trans-140.872144.2-78.20000108.8
230V44.7Very low50.6Low134 Ų134117.9 Ų117.981%0.81270%0.704SS**  trans-134.854162.4-71.70000108.7S232V230-S232 PolarHBondContact O-N 2.64Å
231G33.3Very low53.5Low72 Ų72110.5 Ų110.574%0.74267%0.672SS**  trans-77.786.8144.100000105.4E233G231-E233 PolarHBondContact O-N 3.41Å
232S43.3Very low56.4Low108 Ų108105.8 Ų105.876%0.75566%0.656SS**  trans-57.1101.4161.5-68.80000105.6V230 E234V230-S232 PolarHBondContact O-N 2.64Å; S232-E234 VanDerWaalsContact C-N 3.29Å; S232-E234 PolarHBondContact O-N 3.42Å
233E38.5Very low59.4Low163 Ų163102 Ų10276%0.76263%0.626SS**  trans-54.9108.1158.8-69.6-157.1119.300105.1G231 H235G231-E233 PolarHBondContact O-N 3.41Å; E233-H235 PolarHBondContact O-N 2.71Å; E233-H235 PolarHBondContact O-ND1 2.8Å
234E42.9Very low62Low157 Ų157104.2 Ų104.273%0.73462%0.616SS**  trans-57.389.6170.1-173.7178.4155.100105.9S232 P236S232-E234 VanDerWaalsContact C-N 3.29Å; S232-E234 PolarHBondContact O-N 3.42Å; E234-P236 WeakPolarHBondContact O-CD 3.43Å
235H46.4Very low64.5Low144 Ų14498.3 Ų98.367%0.66758%0.577SS**  trans-58.3112.5-179.2-80.565.5000105.8E233 H237E233-H235 PolarHBondContact O-N 2.71Å; E233-H235 PolarHBondContact O-ND1 2.8Å; H235-H237 PolarHBondContact O-N 2.9Å
236P53.8Low67.1Low111 Ų11197.2 Ų97.272%0.72156%0.559SS**SBendtrans-58.2-27.4-162.7-27.133.9000112.5E234E234-P236 WeakPolarHBondContact O-CD 3.43Å
237H65.2Low68.8Low85 Ų8597 Ų9739%0.39454%0.543SS..SBendtrans-144.1114.3177.2-55.6-28.4000108.9H235 N259H235-H237 PolarHBondContact O-N 2.9Å; H237-N259 WeakPolarHBondContact CB-OD1 3.23Å; H237-N259 PolarHBondContact CE1-ND2 3.23Å; H237-N259 VanDerWaalsContact CG-CG 3.5Å; H237-N259 PolarHBondContact ND1-ND2 2.93Å; H237-N259 PolarHBondContact ND1-OD1 2.95Å; H237-N259 PolarHBondContact NE2-ND2 3.46Å
238S86.8Confident70.2Confident55 Ų5597.5 Ų97.539%0.38554%0.54SS..EExtended strand (participates in β ladder)trans-75.4132.3175.959.90000110K257 E258S238-K257 CarbonylContact O-C 3.59Å; S238-K257 VanDerWaalsContact O-CA 3.29Å; S238-K257 WeakPolarHBondContact O-CA 3.28Å; S238-E258 PolarHBondContact N-O 3.31Å; S238-E258 PolarHBondContact O-N 3.35Å
239V93.1Very high72.5Confident78 Ų7896.6 Ų96.647%0.47353%0.531SS..EExtended strand (participates in β ladder)trans-83.4123.8173.9-177.20000107.6T242 K257V239-T242 VanDerWaalsContact CG1-OG1 3.23Å; V239-T242 WeakPolarHBondContact CG1-OG1 3.48Å; V239-K257 HydrophobicContact CG2-CG 4.48Å
240L94.8Very high74.3Confident48 Ų4895.5 Ų95.525%0.25151%0.507SS..EExtended strand (participates in β ladder)trans-92.7-42.8-178.9-62.7172.6000111.8L198 L256 E258 R263L198-L240 HydrophobicContact CD1-CB 4.32Å; L198-L240 HydrophobicContact CD1-CD1 3.74Å; L198-L240 HydrophobicContact CD1-CD2 4.48Å; L198-L240 HydrophobicContact CD1-CG 4.41Å; L240-L256 HydrophobicContact CB-CD2 4.32Å; L240-L256 HydrophobicContact CB-CG 4.28Å; L240-L256 WeakPolarHBondContact CB-O 3.33Å; L240-L256 HydrophobicContact CD1-CD2 4.4Å; L240-L256 HydrophobicContact CD1-CG 4.25Å; L240-L256 PolarHBondContact N-O 2.94Å; L240-E258 HydrophobicContact CD1-CB 3.87Å; L240-E258 HydrophobicContact CD2-CB 4.41Å; L240-E258 HydrophobicContact CG-CB 4.17Å; L240-R263 HydrophobicContact CD1-CG 4.1Å
241K95.9Very high76.6Confident51 Ų5191.4 Ų91.422%0.22248%0.479CS..EExtended strand (participates in β ladder)trans-151.4139.2178.2-178.6175.2169175.70108.8D190 F191 H194 L256D190-K241 VanDerWaalsContact C-NZ 3.27Å; D190-K241 PolarHBondContact O-NZ 3.28Å; F191-K241 HydrophobicContact CD1-CB 4.17Å; F191-K241 HydrophobicContact CD1-CD 3.74Å; F191-K241 HydrophobicContact CD1-CG 4.01Å; F191-K241 HydrophobicContact CE1-CB 3.76Å; F191-K241 HydrophobicContact CE1-CD 3.74Å; F191-K241 HydrophobicContact CE1-CG 3.52Å; F191-K241 HydrophobicContact CZ-CG 4.26Å; H194-K241 HydrophobicContact CB-CD 3.91Å; K241-L256 HydrophobicContact CB-CB 4.29Å; K241-L256 PolarHBondContact N-O 3.31Å; K241-L256 PolarHBondContact O-N 3.14Å
242T97.4Very high79.6Confident74 Ų7488.4 Ų88.445%0.45445%0.445SS..EExtended strand (participates in β ladder)trans-125.5143.3173.4-70.40000109.3V239 L254 D255V239-T242 VanDerWaalsContact CG1-OG1 3.23Å; V239-T242 WeakPolarHBondContact CG1-OG1 3.48Å; T242-L254 CarbonylContact C-O 3.55Å; T242-L254 VanDerWaalsContact CA-O 3.27Å; T242-L254 WeakPolarHBondContact CA-O 3.4Å; T242-D255 VanDerWaalsContact CG2-OD1 3.27Å; T242-D255 WeakPolarHBondContact CG2-OD1 3.45Å; T242-D255 PolarHBondContact OG1-OD1 3.38Å
243D97.6Very high82.2Confident44 Ų4486.7 Ų86.724%0.23542%0.422CS..EExtended strand (participates in β ladder)trans-143.3168.2171.4-158.90.8000109.8C187 F191 L254C187-D243 PolarHBondContact SG-OD2 2.84Å; F191-D243 HydrophobicContact CE2-CB 3.86Å; F191-D243 HydrophobicContact CZ-CB 3.7Å; D243-L254 HydrophobicContact CB-CB 4.45Å; D243-L254 PolarHBondContact N-O 3Å; D243-L254 PolarHBondContact O-N 3.49Å
244Y96.1Very high85Confident137 Ų13778.9 Ų78.954%0.53739%0.386SS..EExtended strand (participates in β ladder)trans-147.9150.3175.768.9-88000113.5Y252Y244-Y252 CarbonylContact C-O 3.56Å; Y244-Y252 WeakPolarHBondContact CA-O 3.39Å; Y244-Y252 WeakPolarHBondContact CB-O 3.11Å
245I95.7Very high87.6Confident5 Ų572.3 Ų72.33%0.02636%0.356CS..EExtended strand (participates in β ladder)trans-115.8130.6172.4-61.1162.3000108.3V180 E183 L184 K251 Y252 L254V180-I245 HydrophobicContact CG1-CG2 4.06Å; V180-I245 HydrophobicContact CG2-CG2 4.5Å; E183-I245 HydrophobicContact CB-CD1 3.91Å; E183-I245 HydrophobicContact CB-CG1 4.18Å; E183-I245 HydrophobicContact CB-CG2 4.22Å; E183-I245 WeakPolarHBondContact OE2-CG2 3.33Å; L184-I245 HydrophobicContact CB-CD1 4.05Å; I245-K251 CarbonylContact O-C 3.58Å; I245-K251 WeakPolarHBondContact O-CA 3.44Å; I245-Y252 HydrophobicContact CB-CD2 4.39Å; I245-Y252 HydrophobicContact CG2-CD2 4.41Å; I245-Y252 PolarHBondContact N-O 3.28Å; I245-Y252 PolarHBondContact O-N 2.93Å; I245-L254 HydrophobicContact CD1-CD1 4.19Å; I245-L254 HydrophobicContact CG1-CD1 4.27Å
246E92.3Very high90Very high87 Ų8765.4 Ų65.441%0.40732%0.324SS..EExtended strand (participates in β ladder)trans-118119.7177.9-176.2170.9177.500110.8R250 K251 M272E246-R250 WeakPolarHBondContact CA-O 3.46Å; E246-K251 HydrophobicContact CB-CG 4.35Å; E246-K251 HydrophobicContact CG-CG 4.11Å; E246-K251 WeakPolarHBondContact OE1-CE 3.31Å; E246-K251 IonicContact OE1-NZ 3.53Å; E246-K251 WeakPolarHBondContact OE2-CE 3.25Å; E246-K251 IonicContact OE2-NZ 3.75Å; E246-K251 PolarHBondContact OE2-NZ 3.01Å; E246-K251 VanDerWaalsContact OE2-NZ 3.16Å; E246-M272 HydrophobicContact CG-SD 4.44Å
247R87.7Confident92.1Very high116 Ų11661.6 Ų61.644%0.43830%0.296SS..EExtended strand (participates in β ladder)trans-151.7136.5179.9-161.976.2-175.3-176.5-2.1111V180 N249 R250V180-R247 HydrophobicContact CG2-CB 3.57Å; V180-R247 HydrophobicContact CG2-CG 3.78Å; R247-N249 VanDerWaalsContact C-N 3.33Å; R247-N249 PolarHBondContact O-N 2.85Å; R247-R250 PolarHBondContact N-O 3.13Å; R247-R250 WeakPolarHBondContact O-CA 3.46Å; R247-R250 VanDerWaalsContact O-CB 3.31Å; R247-R250 WeakPolarHBondContact O-CB 3.36Å; R247-R250 PolarHBondContact O-N 3.49Å
248D80.6Confident93.5Very high122 Ų12260.7 Ų60.765%0.65229%0.292SS*.THydrogen-bonded Turntrans48.747172.2-54.2-36.4000114.4R250D248-R250 PolarHBondContact O-N 3.23Å
249N85.3Confident93.7Very high114 Ų11459.8 Ų59.861%0.6128%0.283SS*.THydrogen-bonded Turntrans5927.3-175.1-58.7-44.4000114.3R247 M272R247-N249 VanDerWaalsContact C-N 3.33Å; R247-N249 PolarHBondContact O-N 2.85Å; N249-M272 HydrophobicContact CB-CB 4.47Å; N249-M272 PolarHBondContact O-N 2.89Å
250R89.4Confident93.6Very high100 Ų10064.9 Ų64.938%0.37730%0.302SS..EExtended strand (participates in β ladder)trans-121.4139.3172.7-59.1176.2-177.7-172.85.3109.3E246 R247 D248 Y252 T270E246-R250 WeakPolarHBondContact CA-O 3.46Å; R247-R250 PolarHBondContact N-O 3.13Å; R247-R250 WeakPolarHBondContact O-CA 3.46Å; R247-R250 VanDerWaalsContact O-CB 3.31Å; R247-R250 WeakPolarHBondContact O-CB 3.36Å; R247-R250 PolarHBondContact O-N 3.49Å; D248-R250 PolarHBondContact O-N 3.23Å; R250-Y252 HydrophobicContact CB-CE2 3.9Å; R250-T270 CarbonylContact C-O 3.57Å; R250-T270 WeakPolarHBondContact CA-O 3.49Å
251K92.8Very high93.2Very high49 Ų4972.5 Ų72.521%0.21333%0.327CS..EExtended strand (participates in β ladder)trans-116123.8173.7-73-174.1164.2177.30108.9I245 E246 Y253 Q269 T270 M272I245-K251 CarbonylContact O-C 3.58Å; I245-K251 WeakPolarHBondContact O-CA 3.44Å; E246-K251 HydrophobicContact CB-CG 4.35Å; E246-K251 HydrophobicContact CG-CG 4.11Å; E246-K251 WeakPolarHBondContact OE1-CE 3.31Å; E246-K251 IonicContact OE1-NZ 3.53Å; E246-K251 WeakPolarHBondContact OE2-CE 3.25Å; E246-K251 IonicContact OE2-NZ 3.75Å; E246-K251 PolarHBondContact OE2-NZ 3.01Å; E246-K251 VanDerWaalsContact OE2-NZ 3.16Å; K251-Y253 HydrophobicContact CB-CE2 3.87Å; K251-Q269 CarbonylContact O-C 3.55Å; K251-Q269 WeakPolarHBondContact O-CA 3.41Å; K251-T270 PolarHBondContact N-O 2.82Å; K251-T270 PolarHBondContact O-N 2.87Å; K251-T270 PolarHBondContact O-OG1 2.89Å; K251-M272 HydrophobicContact CD-CG 4.09Å; K251-M272 HydrophobicContact CD-SD 3.83Å; K251-M272 WeakPolarHBondContact CE-SD 3.27Å; K251-M272 HydrophobicContact CG-CG 4.21Å; K251-M272 HydrophobicContact CG-SD 3.9Å
252Y96Very high93.1Very high8 Ų871.7 Ų71.73%0.03133%0.333CS..EExtended strand (participates in β ladder)trans-103.5114.5172.9-55.8-97000106.8L174 L176 V180 Y244 I245 R250 L254 R268 Q269L174-Y252 HydrophobicContact CD1-CD1 4.23Å; L174-Y252 HydrophobicContact CD1-CE1 4.21Å; L176-Y252 HydrophobicContact CB-CE1 4.06Å; V180-Y252 HydrophobicContact CG1-CD2 3.87Å; V180-Y252 HydrophobicContact CG1-CE1 4.48Å; V180-Y252 HydrophobicContact CG1-CE2 3.72Å; V180-Y252 HydrophobicContact CG1-CG 4.34Å; V180-Y252 HydrophobicContact CG2-CE2 4.15Å; Y244-Y252 CarbonylContact C-O 3.56Å; Y244-Y252 WeakPolarHBondContact CA-O 3.39Å; Y244-Y252 WeakPolarHBondContact CB-O 3.11Å; I245-Y252 HydrophobicContact CB-CD2 4.39Å; I245-Y252 HydrophobicContact CG2-CD2 4.41Å; I245-Y252 PolarHBondContact N-O 3.28Å; I245-Y252 PolarHBondContact O-N 2.93Å; R250-Y252 HydrophobicContact CB-CE2 3.9Å; Y252-L254 WeakPolarHBondContact O-CD1 3.26Å; Y252-R268 CarbonylContact C-O 3.56Å; Y252-R268 WeakPolarHBondContact CA-O 3.25Å; Y252-Q269 HydrophobicContact CD1-CB 3.67Å; Y252-Q269 HydrophobicContact CD1-CG 3.93Å; Y252-Q269 HydrophobicContact CE1-CB 3.72Å; Y252-Q269 HydrophobicContact CE1-CG 3.56Å; Y252-Q269 VanDerWaalsContact CE1-OE1 3.22Å
253Y97.1Very high93Very high72 Ų7271 Ų7128%0.28232%0.322SS..EExtended strand (participates in β ladder)trans-93.1132.3175.8-64.2-85.6000109.4K251 I267 R268 T270K251-Y253 HydrophobicContact CB-CE2 3.87Å; Y253-I267 CarbonylContact O-C 3.57Å; Y253-I267 WeakPolarHBondContact O-CA 3.15Å; Y253-R268 PolarHBondContact N-O 3.31Å; Y253-R268 PolarHBondContact O-N 3.22Å; Y253-T270 HydrophobicContact CD2-CG2 4.05Å; Y253-T270 HydrophobicContact CE2-CG2 3.84Å; Y253-T270 WeakPolarHBondContact CE2-OG1 3.48Å
254L98.1Very high92.9Very high0 Ų070.3 Ų70.30%032%0.317CS..EExtended strand (participates in β ladder)trans-118.5108.2179.8-65.384.2000108.2L184 C187 F191 T242 D243 I245 Y252 L265 R266 I267L184-L254 HydrophobicContact CD1-CD2 3.51Å; L184-L254 HydrophobicContact CD1-CG 4.5Å; C187-L254 HydrophobicContact CB-CD2 3.99Å; F191-L254 HydrophobicContact CE2-CB 3.75Å; F191-L254 HydrophobicContact CE2-CD2 3.92Å; F191-L254 HydrophobicContact CZ-CB 3.85Å; T242-L254 CarbonylContact C-O 3.55Å; T242-L254 VanDerWaalsContact CA-O 3.27Å; T242-L254 WeakPolarHBondContact CA-O 3.4Å; D243-L254 HydrophobicContact CB-CB 4.45Å; D243-L254 PolarHBondContact N-O 3Å; D243-L254 PolarHBondContact O-N 3.49Å; I245-L254 HydrophobicContact CD1-CD1 4.19Å; I245-L254 HydrophobicContact CG1-CD1 4.27Å; Y252-L254 WeakPolarHBondContact O-CD1 3.26Å; L254-L265 HydrophobicContact CB-CD1 4.28Å; L254-R266 WeakPolarHBondContact CA-O 3.26Å; L254-I267 HydrophobicContact CG-CG1 4.35Å; L254-I267 HydrophobicContact CG-CG2 4.48Å
255D97.3Very high93Very high18 Ų1863.8 Ų63.810%0.09629%0.291CS..EExtended strand (participates in β ladder)trans-115.5110.3-177.9-59.6-47.2000110T242 K257 L265 R266T242-D255 VanDerWaalsContact CG2-OD1 3.27Å; T242-D255 WeakPolarHBondContact CG2-OD1 3.45Å; T242-D255 PolarHBondContact OG1-OD1 3.38Å; D255-K257 HydrophobicContact CB-CD 4.22Å; D255-K257 HydrophobicContact CB-CG 3.94Å; D255-K257 PolarHBondContact O-N 3.15Å; D255-L265 CarbonylContact O-C 3.55Å; D255-L265 WeakPolarHBondContact O-CA 3.45Å; D255-R266 HydrophobicContact CB-CB 4.48Å; D255-R266 PolarHBondContact N-O 3.05Å; D255-R266 PolarHBondContact O-N 3.3Å; D255-R266 IonicContact OD2-NE 3.43Å; D255-R266 IonicContact OD2-NH2 3.14Å
256L97.8Very high93Very high0 Ų066.5 Ų66.50%030%0.301CS..EExtended strand (participates in β ladder)trans-79.4116.3166.5-178.566.2000108F191 L240 K241 L265 A295 M298F191-L256 HydrophobicContact CD1-CB 3.73Å; F191-L256 HydrophobicContact CD1-CD2 4.23Å; F191-L256 HydrophobicContact CE1-CB 3.77Å; L240-L256 HydrophobicContact CB-CD2 4.32Å; L240-L256 HydrophobicContact CB-CG 4.28Å; L240-L256 WeakPolarHBondContact CB-O 3.33Å; L240-L256 HydrophobicContact CD1-CD2 4.4Å; L240-L256 HydrophobicContact CD1-CG 4.25Å; L240-L256 PolarHBondContact N-O 2.94Å; K241-L256 HydrophobicContact CB-CB 4.29Å; K241-L256 PolarHBondContact N-O 3.31Å; K241-L256 PolarHBondContact O-N 3.14Å; L256-L265 HydrophobicContact CB-CD1 4.18Å; L256-A295 HydrophobicContact CD1-CB 4.24Å; L256-M298 HydrophobicContact CD1-SD 4.39Å
257K96.5Very high93.2Very high31 Ų3162.4 Ų62.414%0.13528%0.282CS..EExtended strand (participates in β ladder)trans-123.5155.7-175.4-49-170.383.4-177.90111.5S238 V239 D255 R263 F264S238-K257 CarbonylContact O-C 3.59Å; S238-K257 VanDerWaalsContact O-CA 3.29Å; S238-K257 WeakPolarHBondContact O-CA 3.28Å; V239-K257 HydrophobicContact CG2-CG 4.48Å; D255-K257 HydrophobicContact CB-CD 4.22Å; D255-K257 HydrophobicContact CB-CG 3.94Å; D255-K257 PolarHBondContact O-N 3.15Å; K257-R263 CarbonylContact O-C 3.57Å; K257-R263 VanDerWaalsContact O-CA 3.22Å; K257-R263 WeakPolarHBondContact O-CA 3.28Å; K257-F264 HydrophobicContact CB-CE1 3.92Å; K257-F264 HydrophobicContact CB-CE2 4Å; K257-F264 HydrophobicContact CB-CZ 3.62Å; K257-F264 HydrophobicContact CD-CE2 4.12Å; K257-F264 HydrophobicContact CD-CZ 4.09Å; K257-F264 HydrophobicContact CG-CE2 4.28Å; K257-F264 HydrophobicContact CG-CZ 4.27Å; K257-F264 PolarHBondContact N-O 3.3Å; K257-F264 PolarHBondContact O-N 3.29Å
258E94.6Very high93.5Very high65 Ų6559.8 Ų59.830%0.30427%0.272SS..EExtended strand (participates in β ladder)trans-118.5129.6174.8-176.2160.4-135.500111.6S238 L240 R263S238-E258 PolarHBondContact N-O 3.31Å; S238-E258 PolarHBondContact O-N 3.35Å; L240-E258 HydrophobicContact CD1-CB 3.87Å; L240-E258 HydrophobicContact CD2-CB 4.41Å; L240-E258 HydrophobicContact CG-CB 4.17Å; E258-R263 HydrophobicContact CB-CG 3.98Å; E258-R263 HydrophobicContact CG-CG 3.9Å; E258-R263 IonicContact OE1-CZ 2.71Å; E258-R263 IonicContact OE1-NE 3.88Å; E258-R263 PolarHBondContact OE1-NE 3.44Å; E258-R263 IonicContact OE1-NH2 2.65Å; E258-R263 PolarHBondContact OE1-NH2 3.1Å; E258-R263 VanDerWaalsContact OE1-NH2 3.14Å; E258-R263 IonicContact OE2-NE 3.16Å; E258-R263 IonicContact OE2-NH2 3.84Å
259N91.2Very high94.1Very high36 Ų3655 Ų5519%0.19325%0.246CC..EExtended strand (participates in β ladder)trans-127.2171.6176.2-65.48.3000110H237 R261 G262 F264H237-N259 WeakPolarHBondContact CB-OD1 3.23Å; H237-N259 PolarHBondContact CE1-ND2 3.23Å; H237-N259 VanDerWaalsContact CG-CG 3.5Å; H237-N259 PolarHBondContact ND1-ND2 2.93Å; H237-N259 PolarHBondContact ND1-OD1 2.95Å; H237-N259 PolarHBondContact NE2-ND2 3.46Å; N259-R261 PolarHBondContact O-N 2.94Å; N259-G262 PolarHBondContact N-O 2.91Å; N259-G262 PolarHBondContact O-N 3.41Å; N259-F264 HydrophobicContact CB-CE1 4.14Å; N259-F264 WeakPolarHBondContact ND2-CE1 3.17Å; N259-F264 VanDerWaalsContact OD1-CE1 3.25Å; N259-F264 WeakPolarHBondContact OD1-CE1 3.3Å
260Q90.8Very high94.2Very high186 Ų18651.7 Ų51.787%0.86923%0.23SC*.THydrogen-bonded Turntrans-52.6-27.2169.9-62.7177.91.300113.8G262Q260-G262 VanDerWaalsContact C-N 3.33Å
261R88.1Confident93.7Very high207 Ų20751.9 Ų51.978%0.78124%0.237SC*.THydrogen-bonded Turntrans-85.3-2178.3-68.1179.262.8-166.5-2.6114N259N259-R261 PolarHBondContact O-N 2.94Å
262G92.2Very high92.3Very high34 Ų3453.4 Ų53.435%0.35125%0.246SC..EExtended strand (participates in β ladder)trans109.8-169.7-172.700000113.2N259 Q260N259-G262 PolarHBondContact N-O 2.91Å; N259-G262 PolarHBondContact O-N 3.41Å; Q260-G262 VanDerWaalsContact C-N 3.33Å
263R95.5Very high90.7Very high60 Ų6059.8 Ų59.823%0.22627%0.27CS..EExtended strand (participates in β ladder)trans-97.1145.6-174-57-179.9-170.9151.7-0.9112Y195 L240 K257 E258 A295Y195-R263 HydrophobicContact CE2-CB 4.02Å; Y195-R263 HydrophobicContact CE2-CG 4.37Å; L240-R263 HydrophobicContact CD1-CG 4.1Å; K257-R263 CarbonylContact O-C 3.57Å; K257-R263 VanDerWaalsContact O-CA 3.22Å; K257-R263 WeakPolarHBondContact O-CA 3.28Å; E258-R263 HydrophobicContact CB-CG 3.98Å; E258-R263 HydrophobicContact CG-CG 3.9Å; E258-R263 IonicContact OE1-CZ 2.71Å; E258-R263 IonicContact OE1-NE 3.88Å; E258-R263 PolarHBondContact OE1-NE 3.44Å; E258-R263 IonicContact OE1-NH2 2.65Å; E258-R263 PolarHBondContact OE1-NH2 3.1Å; E258-R263 VanDerWaalsContact OE1-NH2 3.14Å; E258-R263 IonicContact OE2-NE 3.16Å; E258-R263 IonicContact OE2-NH2 3.84Å; R263-A295 HydrophobicContact CB-CB 3.86Å; R263-A295 WeakPolarHBondContact O-CB 3.32Å; R263-A295 PolarHBondContact O-N 3.26Å
264F96.6Very high88.4Confident29 Ų2959.4 Ų59.413%0.12729%0.288CS..EExtended strand (participates in β ladder)trans-151.4150.6179.161.3-79.9000111K257 N259 R266 V292 L293K257-F264 HydrophobicContact CB-CE1 3.92Å; K257-F264 HydrophobicContact CB-CE2 4Å; K257-F264 HydrophobicContact CB-CZ 3.62Å; K257-F264 HydrophobicContact CD-CE2 4.12Å; K257-F264 HydrophobicContact CD-CZ 4.09Å; K257-F264 HydrophobicContact CG-CE2 4.28Å; K257-F264 HydrophobicContact CG-CZ 4.27Å; K257-F264 PolarHBondContact N-O 3.3Å; K257-F264 PolarHBondContact O-N 3.29Å; N259-F264 HydrophobicContact CB-CE1 4.14Å; N259-F264 WeakPolarHBondContact ND2-CE1 3.17Å; N259-F264 VanDerWaalsContact OD1-CE1 3.25Å; N259-F264 WeakPolarHBondContact OD1-CE1 3.3Å; F264-R266 HydrophobicContact CD2-CB 4.43Å; F264-R266 HydrophobicContact CE2-CB 4.3Å; F264-V292 HydrophobicContact CB-CG1 4.06Å; F264-V292 HydrophobicContact CD2-CG1 3.48Å; F264-V292 VanDerWaalsContact CD2-CG1 3.48Å; F264-V292 HydrophobicContact CE2-CG1 4.21Å; F264-V292 HydrophobicContact CG-CG1 3.93Å; F264-L293 CarbonylContact C-O 3.53Å; F264-L293 VanDerWaalsContact CA-O 3.31Å; F264-L293 WeakPolarHBondContact CA-O 3.32Å; F264-L293 WeakPolarHBondContact CB-O 3.48Å
265L97.6Very high86Confident0 Ų067.2 Ų67.20%034%0.335CS..EExtended strand (participates in β ladder)trans-94.4123.1170.8-174.767.4000109.1L188 F191 L254 D255 L256 I267 L293 M298L188-L265 HydrophobicContact CD2-CD2 3.51Å; F191-L265 HydrophobicContact CD1-CD1 4.03Å; F191-L265 HydrophobicContact CD2-CD1 4.17Å; F191-L265 HydrophobicContact CD2-CD2 4.47Å; F191-L265 HydrophobicContact CE1-CD1 3.92Å; F191-L265 HydrophobicContact CE2-CD1 4.12Å; F191-L265 HydrophobicContact CG-CD1 4.16Å; F191-L265 HydrophobicContact CZ-CD1 3.99Å; L254-L265 HydrophobicContact CB-CD1 4.28Å; D255-L265 CarbonylContact O-C 3.55Å; D255-L265 WeakPolarHBondContact O-CA 3.45Å; L256-L265 HydrophobicContact CB-CD1 4.18Å; L265-I267 HydrophobicContact CD2-CD1 4.18Å; L265-I267 HydrophobicContact CD2-CG1 4.19Å; L265-I267 HydrophobicContact CG-CG1 4.14Å; L265-L293 HydrophobicContact CB-CB 4.37Å; L265-L293 PolarHBondContact N-O 3.39Å; L265-L293 PolarHBondContact O-N 2.74Å; L265-M298 HydrophobicContact CB-SD 4.17Å; L265-M298 HydrophobicContact CD2-SD 4.33Å
266R95.9Very high83.6Confident62 Ų6269.1 Ų69.123%0.23436%0.359CS..EExtended strand (participates in β ladder)trans-100.2122.4171.7-173176.684.6164.26.8109L254 D255 F264 V292L254-R266 WeakPolarHBondContact CA-O 3.26Å; D255-R266 HydrophobicContact CB-CB 4.48Å; D255-R266 PolarHBondContact N-O 3.05Å; D255-R266 PolarHBondContact O-N 3.3Å; D255-R266 IonicContact OD2-NE 3.43Å; D255-R266 IonicContact OD2-NH2 3.14Å; F264-R266 HydrophobicContact CD2-CB 4.43Å; F264-R266 HydrophobicContact CE2-CB 4.3Å; R266-V292 HydrophobicContact CG-CG2 4.13Å
267I96.4Very high81.3Confident2 Ų276.7 Ų76.71%0.0140%0.396CS..EExtended strand (participates in β ladder)trans-111.4115.6177.1-54.4167.9000107.6L174 L184 Y253 L254 L265 T290 I291L174-I267 HydrophobicContact CD2-CB 4.41Å; L174-I267 HydrophobicContact CD2-CG2 3.61Å; L184-I267 HydrophobicContact CD1-CD1 3.91Å; L184-I267 HydrophobicContact CD2-CD1 4.48Å; Y253-I267 CarbonylContact O-C 3.57Å; Y253-I267 WeakPolarHBondContact O-CA 3.15Å; L254-I267 HydrophobicContact CG-CG1 4.35Å; L254-I267 HydrophobicContact CG-CG2 4.48Å; L265-I267 HydrophobicContact CD2-CD1 4.18Å; L265-I267 HydrophobicContact CD2-CG1 4.19Å; L265-I267 HydrophobicContact CG-CG1 4.14Å; I267-T290 VanDerWaalsContact O-CA 3.23Å; I267-T290 WeakPolarHBondContact O-CA 3.43Å; I267-T290 PolarHBondContact O-OG1 3.28Å; I267-I291 HydrophobicContact CB-CD1 4.49Å; I267-I291 HydrophobicContact CB-CG1 3.9Å; I267-I291 HydrophobicContact CD1-CD1 4.09Å; I267-I291 HydrophobicContact CD1-CG1 4.28Å; I267-I291 HydrophobicContact CG1-CG1 4.49Å; I267-I291 PolarHBondContact N-O 2.94Å; I267-I291 PolarHBondContact O-N 3.28Å
268R94.6Very high79.2Confident61 Ų6183.6 Ų83.623%0.2343%0.433CS..EExtended strand (participates in β ladder)trans-125.6124.3-176.3179.1179.664.3168.20.1110.9Y252 Y253 E288Y252-R268 CarbonylContact C-O 3.56Å; Y252-R268 WeakPolarHBondContact CA-O 3.25Å; Y253-R268 PolarHBondContact N-O 3.31Å; Y253-R268 PolarHBondContact O-N 3.22Å; R268-E288 IonicContact NH1-OE1 3.99Å; R268-E288 PolarHBondContact NH1-OE1 2.79Å
269Q92.1Very high77.2Confident20 Ų2082.6 Ų82.69%0.09344%0.44CS..EExtended strand (participates in β ladder)trans-89.6132171.3177.8-173.4-30.400111.3L174 T175 K251 Y252 Q289L174-Q269 HydrophobicContact CD1-CB 3.59Å; T175-Q269 PolarHBondContact O-OE1 2.87Å; K251-Q269 CarbonylContact O-C 3.55Å; K251-Q269 WeakPolarHBondContact O-CA 3.41Å; Y252-Q269 HydrophobicContact CD1-CB 3.67Å; Y252-Q269 HydrophobicContact CD1-CG 3.93Å; Y252-Q269 HydrophobicContact CE1-CB 3.72Å; Y252-Q269 HydrophobicContact CE1-CG 3.56Å; Y252-Q269 VanDerWaalsContact CE1-OE1 3.22Å; Q269-Q289 HydrophobicContact CB-CB 4.1Å; Q269-Q289 PolarHBondContact N-O 3.42Å; Q269-Q289 VanDerWaalsContact OE1-OE1 3.13Å
270T88.8Confident74.9Confident45 Ų4592 Ų9228%0.27647%0.474SS..EExtended strand (participates in β ladder)trans-120.5155.6164.372.80000109.2R250 K251 Y253R250-T270 CarbonylContact C-O 3.57Å; R250-T270 WeakPolarHBondContact CA-O 3.49Å; K251-T270 PolarHBondContact N-O 2.82Å; K251-T270 PolarHBondContact O-N 2.87Å; K251-T270 PolarHBondContact O-OG1 2.89Å; Y253-T270 HydrophobicContact CD2-CG2 4.05Å; Y253-T270 HydrophobicContact CE2-CG2 3.84Å; Y253-T270 WeakPolarHBondContact CE2-OG1 3.48Å
271M78.6Confident72.8Confident105 Ų10592.3 Ų92.352%0.51747%0.473SS..EExtended strand (participates in β ladder)trans-106.1131.317243.7-177.7173.700107.8R273M271-R273 VanDerWaalsContact C-N 3.26Å; M271-R273 PolarHBondContact O-N 3.12Å
272M63.4Low70.7Confident81 Ų8184.2 Ų84.240%0.39945%0.453SS..  trans-7187.4170.6-76164.662.100107.9E246 N249 K251 G274E246-M272 HydrophobicContact CG-SD 4.44Å; N249-M272 HydrophobicContact CB-CB 4.47Å; N249-M272 PolarHBondContact O-N 2.89Å; K251-M272 HydrophobicContact CD-CG 4.09Å; K251-M272 HydrophobicContact CD-SD 3.83Å; K251-M272 WeakPolarHBondContact CE-SD 3.27Å; K251-M272 HydrophobicContact CG-CG 4.21Å; K251-M272 HydrophobicContact CG-SD 3.9Å; M272-G274 PolarHBondContact O-N 2.77Å
273R60.8Low68.5Low142 Ų14291.3 Ų91.354%0.53648%0.477SS..  trans-72116.6162.3-80.6-176.2172155.8-4.3106.8M271 G282M271-R273 VanDerWaalsContact C-N 3.26Å; M271-R273 PolarHBondContact O-N 3.12Å; R273-G282 PolarHBondContact NH1-O 3.38Å; R273-G282 VanDerWaalsContact NH1-O 3.12Å
274G48.7Very low65.9Low64 Ų6493.5 Ų93.566%0.6650%0.502SS*.  trans-51.9144176.800000112M272 G276M272-G274 PolarHBondContact O-N 2.77Å; G274-G276 PolarHBondContact O-N 2.82Å
275T48.3Very low63.6Low164 Ų16499.3 Ų99.3100%1.00653%0.534SS*.THydrogen-bonded Turntrans-46.5103.8173.8-50.60000110.3
276G48.3Very low61.2Low57 Ų57102.6 Ų102.659%0.58857%0.567SS**THydrogen-bonded Turntrans156.2-12.1178.500000117.1G274G274-G276 PolarHBondContact O-N 2.82Å
277M48Very low59.3Low159 Ų159106 Ų10678%0.78359%0.586SS**  trans-121.263.5175.1-79.9-77.4100.600111.6
278I53.8Low57.8Low177 Ų177111.4 Ų111.491%0.90861%0.611SS**  trans-94.4108.5158.8-65.1171.6000105.7
279G50.8Low57.5Low43 Ų43111.5 Ų111.544%0.44361%0.614SS.*SBendtrans137.9114.7171.700000114.1F281G279-F281 PolarHBondContact O-N 2.83Å
280Y44.6Very low57.5Low235 Ų235111.7 Ų111.792%0.92262%0.617SS**SBendtrans79.1-14.5153.4-66.5-88.4000121.6
281F45.2Very low57.8Low192 Ų192109.5 Ų109.584%0.84260%0.603SS**SBendtrans-137.537.5174.3-87.1-85000115.1G279G279-F281 PolarHBondContact O-N 2.83Å
282G44.1Very low58.6Low36 Ų36106.4 Ų106.437%0.37159%0.59SS.*  trans-108.4-18.1-168.400000118.3R273R273-G282 PolarHBondContact NH1-O 3.38Å; R273-G282 VanDerWaalsContact NH1-O 3.12Å
283H46.7Very low60.1Low183 Ų183102.6 Ų102.685%0.84757%0.571SS**  trans-100.13.6-169.3-73.9-76.1000115.3L285 G286H283-L285 VanDerWaalsContact C-N 3.29Å; H283-L285 PolarHBondContact O-N 3.18Å; H283-G286 PolarHBondContact O-N 3.16Å
284S40.2Very low61.8Low107 Ų10796.2 Ų96.275%0.74855%0.548SS*.THydrogen-bonded Turntrans-83.210.5-175.145.80000115.8
285L49Very low64.1Low151 Ų15193.3 Ų93.379%0.79152%0.518SS*.THydrogen-bonded Turntrans-128.537.4164.2-86.1156.2000110.5H283 Q287H283-L285 VanDerWaalsContact C-N 3.29Å; H283-L285 PolarHBondContact O-N 3.18Å; L285-Q287 PolarHBondContact O-N 2.93Å
286G46.5Very low66.4Low69 Ų6991.3 Ų91.371%0.71150%0.497SS*.  trans-69.243-171.400000117.2H283H283-G286 PolarHBondContact O-N 3.16Å
287Q56.6Low68.7Low134 Ų13488.6 Ų88.663%0.62647%0.47SS*.  trans-109.6107.3158.2-68.1-174.6-18.500107.1L285 Q289L285-Q287 PolarHBondContact O-N 2.93Å; Q287-Q289 PolarHBondContact O-N 3.2Å
288E65.1Low71Confident114 Ų11481.1 Ų81.153%0.53343%0.433SS..  trans-50.8120165.2-73-171.7143.500107.3R268 T290R268-E288 IonicContact NH1-OE1 3.99Å; R268-E288 PolarHBondContact NH1-OE1 2.79Å; E288-T290 VanDerWaalsContact C-N 3.28Å; E288-T290 HydrophobicContact CB-CG2 4.24Å; E288-T290 WeakPolarHBondContact O-CG2 3.36Å; E288-T290 PolarHBondContact O-N 3.21Å
289Q88.4Confident73.1Confident64 Ų6476.9 Ų76.930%0.29941%0.411SS..EExtended strand (participates in β ladder)trans-72.993.3174.1-70.4-177.444.200106.5K173 L174 Q269 Q287K173-Q289 WeakPolarHBondContact O-CA 3.24Å; L174-Q289 HydrophobicContact CD1-CB 4.02Å; Q269-Q289 HydrophobicContact CB-CB 4.1Å; Q269-Q289 PolarHBondContact N-O 3.42Å; Q269-Q289 VanDerWaalsContact OE1-OE1 3.13Å; Q287-Q289 PolarHBondContact O-N 3.2Å
290T92.4Very high75.4Confident23 Ų2379.3 Ų79.314%0.14141%0.411CS..EExtended strand (participates in β ladder)trans-139.7140-171.2-170.30000110.5S172 I267 E288S172-T290 WeakPolarHBondContact CB-O 3.35Å; S172-T290 PolarHBondContact OG-O 2.98Å; I267-T290 VanDerWaalsContact O-CA 3.23Å; I267-T290 WeakPolarHBondContact O-CA 3.43Å; I267-T290 PolarHBondContact O-OG1 3.28Å; E288-T290 VanDerWaalsContact C-N 3.28Å; E288-T290 HydrophobicContact CB-CG2 4.24Å; E288-T290 WeakPolarHBondContact O-CG2 3.36Å; E288-T290 PolarHBondContact O-N 3.21Å
291I94.7Very high77.9Confident0 Ų068.1 Ų68.10%037%0.367CS..EExtended strand (participates in β ladder)trans-129.4151171.660.1174.7000109.1I156 E158 L174 I267 F301I156-I291 HydrophobicContact CB-CD1 4.28Å; I156-I291 HydrophobicContact CD1-CD1 4.07Å; I156-I291 HydrophobicContact CG2-CD1 3.71Å; E158-I291 HydrophobicContact CB-CG2 4.23Å; E158-I291 WeakPolarHBondContact OE2-CA 3.44Å; L174-I291 HydrophobicContact CB-CD1 4.48Å; L174-I291 HydrophobicContact CB-CG2 4.17Å; L174-I291 HydrophobicContact CD2-CD1 4.11Å; L174-I291 HydrophobicContact CD2-CG1 4.28Å; I267-I291 HydrophobicContact CB-CD1 4.49Å; I267-I291 HydrophobicContact CB-CG1 3.9Å; I267-I291 HydrophobicContact CD1-CD1 4.09Å; I267-I291 HydrophobicContact CD1-CG1 4.28Å; I267-I291 HydrophobicContact CG1-CG1 4.49Å; I267-I291 PolarHBondContact N-O 2.94Å; I267-I291 PolarHBondContact O-N 3.28Å; I291-F301 HydrophobicContact CD1-CZ 4.49Å
292V94.8Very high80.4Confident39 Ų3962.8 Ų62.824%0.23634%0.341CS..EExtended strand (participates in β ladder)trans-124.4104.5-178.81750000109.3K139 F141 E158 F264 R266K139-V292 PolarHBondContact NZ-O 3.47Å; F141-V292 WeakPolarHBondContact CZ-O 3.32Å; E158-V292 PolarHBondContact OE2-N 3.23Å; F264-V292 HydrophobicContact CB-CG1 4.06Å; F264-V292 HydrophobicContact CD2-CG1 3.48Å; F264-V292 VanDerWaalsContact CD2-CG1 3.48Å; F264-V292 HydrophobicContact CE2-CG1 4.21Å; F264-V292 HydrophobicContact CG-CG1 3.93Å; R266-V292 HydrophobicContact CG-CG2 4.13Å
293L96Very high83Confident1 Ų164.4 Ų64.41%0.00534%0.341CS..EExtended strand (participates in β ladder)trans-94.4118.5-177.4-177.864.9000110.2I136 F141 L188 F264 L265 A295 M298 F301I136-L293 HydrophobicContact CD1-CD1 3.31Å; F141-L293 HydrophobicContact CD2-CD1 4.38Å; F141-L293 HydrophobicContact CE1-CD1 4.49Å; F141-L293 HydrophobicContact CE2-CD1 3.92Å; F141-L293 HydrophobicContact CZ-CD1 3.97Å; L188-L293 HydrophobicContact CD2-CD2 4.24Å; F264-L293 CarbonylContact C-O 3.53Å; F264-L293 VanDerWaalsContact CA-O 3.31Å; F264-L293 WeakPolarHBondContact CA-O 3.32Å; F264-L293 WeakPolarHBondContact CB-O 3.48Å; L265-L293 HydrophobicContact CB-CB 4.37Å; L265-L293 PolarHBondContact N-O 3.39Å; L265-L293 PolarHBondContact O-N 2.74Å; L293-A295 PolarHBondContact O-N 3.49Å; L293-M298 HydrophobicContact CD2-CG 4Å; L293-M298 HydrophobicContact CG-CG 4.42Å; L293-F301 HydrophobicContact CD1-CB 4.11Å; L293-F301 HydrophobicContact CD1-CD2 3.8Å; L293-F301 HydrophobicContact CD1-CG 4.05Å; L293-F301 HydrophobicContact CD2-CB 3.86Å; L293-F301 HydrophobicContact CD2-CD1 4.08Å; L293-F301 HydrophobicContact CD2-CD2 4.33Å; L293-F301 HydrophobicContact CD2-CG 3.83Å
294P96.4Very high85.5Confident8 Ų855.7 Ų55.75%0.05230%0.301CS..EExtended strand (participates in β ladder)trans-57.2136.8171.6-23.935.1000110.9I136 K139 Q296 G297I136-P294 HydrophobicContact CG2-CB 3.8Å; I136-P294 HydrophobicContact CG2-CG 3.73Å; K139-P294 HydrophobicContact CD-CG 4.43Å; P294-Q296 PolarHBondContact O-N 2.87Å; P294-Q296 VanDerWaalsContact O-N 3.16Å; P294-G297 PolarHBondContact O-N 3.43Å
295A96.6Very high88.2Confident4 Ų450.6 Ų50.63%0.03327%0.266CS..G310 helixtrans-59.4-32.9-174.800000112.5Y195 L256 R263 L293 G297 M298Y195-A295 HydrophobicContact CD2-CB 3.79Å; Y195-A295 HydrophobicContact CE2-CB 3.46Å; Y195-A295 VanDerWaalsContact CE2-CB 3.46Å; Y195-A295 HydrophobicContact CG-CB 4.45Å; L256-A295 HydrophobicContact CD1-CB 4.24Å; R263-A295 HydrophobicContact CB-CB 3.86Å; R263-A295 WeakPolarHBondContact O-CB 3.32Å; R263-A295 PolarHBondContact O-N 3.26Å; L293-A295 PolarHBondContact O-N 3.49Å; A295-G297 PolarHBondContact O-N 3.15Å; A295-M298 HydrophobicContact CB-CE 4Å; A295-M298 HydrophobicContact CB-SD 4.44Å; A295-M298 WeakPolarHBondContact O-CE 3.48Å; A295-M298 WeakPolarHBondContact O-CG 3.46Å; A295-M298 PolarHBondContact O-N 2.9Å
296Q95.3Very high90.5Very high121 Ų12144.6 Ų44.657%0.56524%0.235SC*.G310 helixtrans-57.7-29175.5-174.661.223.300113.3P294P294-Q296 PolarHBondContact O-N 2.87Å; P294-Q296 VanDerWaalsContact O-N 3.16Å
297G96.8Very high92.9Very high1 Ų146 Ų461%0.0122%0.223CC..G310 helixtrans-98.89.6-17600000114.7I136 P294 A295 I299 E300 F301I136-G297 WeakPolarHBondContact CD1-O 2.99Å; P294-G297 PolarHBondContact O-N 3.43Å; A295-G297 PolarHBondContact O-N 3.15Å; G297-I299 VanDerWaalsContact C-N 3.3Å; G297-I299 PolarHBondContact O-N 3.01Å; G297-E300 VanDerWaalsContact C-OE2 3.28Å; G297-E300 WeakPolarHBondContact CA-OE2 3.35Å; G297-F301 VanDerWaalsContact O-CB 3.3Å; G297-F301 WeakPolarHBondContact O-CB 3.36Å; G297-F301 PolarHBondContact O-N 3.27Å; G297-F301 VanDerWaalsContact O-N 3.13Å
298M97.9Very high94.8Very high2 Ų240.1 Ų40.11%0.0120%0.196CC..Hα-helixtrans-66.4-33.7-176.8-70.5-175.6-53.400112.2L188 F191 I192 Y195 L256 L265 L293 A295 R302L188-M298 HydrophobicContact CD2-CB 4.43Å; L188-M298 HydrophobicContact CD2-CG 4.42Å; F191-M298 HydrophobicContact CB-SD 4.18Å; I192-M298 HydrophobicContact CD1-CB 4.26Å; I192-M298 HydrophobicContact CG1-CB 3.74Å; I192-M298 HydrophobicContact CG1-CE 4.31Å; Y195-M298 HydrophobicContact CD1-CE 4.28Å; Y195-M298 HydrophobicContact CD2-CE 4.44Å; Y195-M298 HydrophobicContact CG-CE 3.92Å; L256-M298 HydrophobicContact CD1-SD 4.39Å; L265-M298 HydrophobicContact CB-SD 4.17Å; L265-M298 HydrophobicContact CD2-SD 4.33Å; L293-M298 HydrophobicContact CD2-CG 4Å; L293-M298 HydrophobicContact CG-CG 4.42Å; A295-M298 HydrophobicContact CB-CE 4Å; A295-M298 HydrophobicContact CB-SD 4.44Å; A295-M298 WeakPolarHBondContact O-CE 3.48Å; A295-M298 WeakPolarHBondContact O-CG 3.46Å; A295-M298 PolarHBondContact O-N 2.9Å; M298-R302 WeakPolarHBondContact O-CB 3.38Å; M298-R302 PolarHBondContact O-N 2.83Å
299I97.4Very high96.2Very high88 Ų8836.1 Ų36.145%0.45118%0.178SC..Hα-helixtrans-69.3-51.3-179.2-61.4174.4000109.9I192 G297 F301 R302 D303I192-I299 HydrophobicContact CD1-CB 4.49Å; I192-I299 HydrophobicContact CD1-CG1 3.89Å; I192-I299 HydrophobicContact CG1-CG1 4.03Å; I192-I299 HydrophobicContact CG2-CD1 4.16Å; I192-I299 HydrophobicContact CG2-CG1 3.87Å; G297-I299 VanDerWaalsContact C-N 3.3Å; G297-I299 PolarHBondContact O-N 3.01Å; I299-F301 PolarHBondContact O-N 2.9Å; I299-R302 WeakPolarHBondContact O-CB 3.4Å; I299-R302 PolarHBondContact O-N 2.82Å; I299-R302 VanDerWaalsContact O-N 3.09Å; I299-D303 VanDerWaalsContact O-CG 3.31Å; I299-D303 PolarHBondContact O-N 2.86Å
300E98.1Very high96.5Very high93 Ų9339.6 Ų39.644%0.43519%0.194SC..Hα-helixtrans-62.2-35.7179.5-59.689.5154.100111.5V134 G297 A304V134-E300 HydrophobicContact CG1-CB 3.95Å; G297-E300 VanDerWaalsContact C-OE2 3.28Å; G297-E300 WeakPolarHBondContact CA-OE2 3.35Å; E300-A304 VanDerWaalsContact O-CB 3.31Å; E300-A304 WeakPolarHBondContact O-CB 3.45Å; E300-A304 PolarHBondContact O-N 2.94Å
301F98.3Very high96.6Very high0 Ų043.8 Ų43.80%022%0.216CC..Hα-helixtrans-68.2-42.7175-161.5-87000111.9F141 L143 I156 L188 I291 L293 G297 I299 A304 L305F141-F301 HydrophobicContact CB-CD2 4.41Å; F141-F301 HydrophobicContact CB-CE2 3.97Å; F141-F301 HydrophobicContact CD1-CE2 4.14Å; F141-F301 HydrophobicContact CG-CD2 4.41Å; F141-F301 HydrophobicContact CG-CE2 4.07Å; L143-F301 HydrophobicContact CD1-CD2 4.44Å; L143-F301 HydrophobicContact CD1-CE2 3.77Å; L143-F301 HydrophobicContact CD1-CZ 4.25Å; L143-F301 HydrophobicContact CD2-CE2 4.3Å; L143-F301 HydrophobicContact CD2-CZ 4.17Å; L143-F301 HydrophobicContact CG-CE2 4.34Å; L143-F301 HydrophobicContact CG-CZ 4.34Å; I156-F301 HydrophobicContact CD1-CE1 4.43Å; I156-F301 HydrophobicContact CD1-CZ 3.95Å; I156-F301 HydrophobicContact CG1-CZ 4.38Å; I156-F301 HydrophobicContact CG2-CE2 4.21Å; I156-F301 HydrophobicContact CG2-CZ 3.94Å; L188-F301 HydrophobicContact CD1-CD1 3.86Å; L188-F301 HydrophobicContact CD1-CE1 4.5Å; I291-F301 HydrophobicContact CD1-CZ 4.49Å; L293-F301 HydrophobicContact CD1-CB 4.11Å; L293-F301 HydrophobicContact CD1-CD2 3.8Å; L293-F301 HydrophobicContact CD1-CG 4.05Å; L293-F301 HydrophobicContact CD2-CB 3.86Å; L293-F301 HydrophobicContact CD2-CD1 4.08Å; L293-F301 HydrophobicContact CD2-CD2 4.33Å; L293-F301 HydrophobicContact CD2-CG 3.83Å; G297-F301 VanDerWaalsContact O-CB 3.3Å; G297-F301 WeakPolarHBondContact O-CB 3.36Å; G297-F301 PolarHBondContact O-N 3.27Å; G297-F301 VanDerWaalsContact O-N 3.13Å; I299-F301 PolarHBondContact O-N 2.9Å; F301-A304 WeakPolarHBondContact O-CB 3.16Å; F301-A304 PolarHBondContact O-N 2.86Å; F301-L305 HydrophobicContact CD1-CD1 4.01Å; F301-L305 HydrophobicContact CD1-CG 4.28Å; F301-L305 HydrophobicContact CE1-CD1 3.86Å; F301-L305 HydrophobicContact CE1-CD2 4.45Å; F301-L305 HydrophobicContact CE1-CG 4.15Å; F301-L305 WeakPolarHBondContact O-CG 3.27Å; F301-L305 PolarHBondContact O-N 2.82Å
302R98.1Very high96.5Very high81 Ų8146.8 Ų46.831%0.30623%0.228SC..Hα-helixtrans-61.3-49.4174.8178.1-174.9171.1-81.22.6111.1K185 L188 I192 M298 I299 A304 L305 V306K185-R302 HydrophobicContact CG-CG 4.42Å; L188-R302 HydrophobicContact CB-CB 4.24Å; L188-R302 HydrophobicContact CB-CG 4.42Å; L188-R302 HydrophobicContact CD1-CB 4.29Å; I192-R302 HydrophobicContact CD1-CB 4.19Å; M298-R302 WeakPolarHBondContact O-CB 3.38Å; M298-R302 PolarHBondContact O-N 2.83Å; I299-R302 WeakPolarHBondContact O-CB 3.4Å; I299-R302 PolarHBondContact O-N 2.82Å; I299-R302 VanDerWaalsContact O-N 3.09Å; R302-A304 PolarHBondContact O-N 2.76Å; R302-L305 WeakPolarHBondContact O-CA 3.1Å; R302-L305 WeakPolarHBondContact O-CB 3.38Å; R302-L305 PolarHBondContact O-N 2.86Å; R302-V306 HydrophobicContact CG-CG2 4.38Å; R302-V306 WeakPolarHBondContact O-CG2 3.42Å; R302-V306 PolarHBondContact O-N 2.75Å
303D98.2Very high96Very high69 Ų6945.4 Ų45.437%0.36922%0.221SC..Hα-helixtrans-64.3-31.6-179.1-64.1-13.4000111.4I299 Q307I299-D303 VanDerWaalsContact O-CG 3.31Å; I299-D303 PolarHBondContact O-N 2.86Å; D303-Q307 WeakPolarHBondContact O-CG 3.34Å; D303-Q307 PolarHBondContact O-N 3.2Å
304A98.2Very high94.6Very high0 Ų050.2 Ų50.20%024%0.243CC..Hα-helixtrans-64.5-42.6169.900000113.3K132 V134 L143 E300 F301 R302 L308K132-A304 HydrophobicContact CD-CB 3.77Å; K132-A304 HydrophobicContact CG-CB 4.37Å; V134-A304 HydrophobicContact CG2-CB 3.63Å; L143-A304 HydrophobicContact CD2-CB 4.05Å; E300-A304 VanDerWaalsContact O-CB 3.31Å; E300-A304 WeakPolarHBondContact O-CB 3.45Å; E300-A304 PolarHBondContact O-N 2.94Å; F301-A304 WeakPolarHBondContact O-CB 3.16Å; F301-A304 PolarHBondContact O-N 2.86Å; R302-A304 PolarHBondContact O-N 2.76Å; A304-L308 WeakPolarHBondContact O-CG 3.41Å; A304-L308 PolarHBondContact O-N 3.44Å
305L97.8Very high92.7Very high1 Ų151 Ų511%0.00525%0.253CS..Hα-helixtrans-65.7-43.5174.5-69.4176.3000112L143 L154 L184 K185 L188 F301 R302 Q307 L308 I309L143-L305 HydrophobicContact CD2-CD2 3.86Å; L143-L305 HydrophobicContact CD2-CG 4.33Å; L154-L305 HydrophobicContact CD2-CD2 3.39Å; L184-L305 HydrophobicContact CD2-CD1 4.01Å; L184-L305 HydrophobicContact CG-CD1 4.01Å; K185-L305 HydrophobicContact CB-CB 4.33Å; K185-L305 HydrophobicContact CB-CD1 4.48Å; L188-L305 HydrophobicContact CD1-CD1 3.75Å; F301-L305 HydrophobicContact CD1-CD1 4.01Å; F301-L305 HydrophobicContact CD1-CG 4.28Å; F301-L305 HydrophobicContact CE1-CD1 3.86Å; F301-L305 HydrophobicContact CE1-CD2 4.45Å; F301-L305 HydrophobicContact CE1-CG 4.15Å; F301-L305 WeakPolarHBondContact O-CG 3.27Å; F301-L305 PolarHBondContact O-N 2.82Å; R302-L305 WeakPolarHBondContact O-CA 3.1Å; R302-L305 WeakPolarHBondContact O-CB 3.38Å; R302-L305 PolarHBondContact O-N 2.86Å; L305-Q307 PolarHBondContact O-N 2.8Å; L305-L308 PolarHBondContact O-N 2.77Å; L305-I309 HydrophobicContact CB-CD1 4.19Å; L305-I309 WeakPolarHBondContact O-CB 3.46Å; L305-I309 VanDerWaalsContact O-CD1 3.31Å; L305-I309 WeakPolarHBondContact O-CD1 3.31Å; L305-I309 WeakPolarHBondContact O-CG1 3.34Å; L305-I309 PolarHBondContact O-N 2.82Å
306V97.3Very high90.6Very high24 Ų2453.2 Ų53.215%0.14526%0.264CS..Hα-helixtrans-52.7-54178.4171.20000110.5K185 R302 L308 I309 E310K185-V306 HydrophobicContact CD-CG2 3.64Å; K185-V306 HydrophobicContact CG-CG2 3.89Å; R302-V306 HydrophobicContact CG-CG2 4.38Å; R302-V306 WeakPolarHBondContact O-CG2 3.42Å; R302-V306 PolarHBondContact O-N 2.75Å; V306-L308 PolarHBondContact O-N 2.94Å; V306-I309 PolarHBondContact O-N 2.96Å; V306-E310 HydrophobicContact CG1-CG 4.35Å; V306-E310 VanDerWaalsContact CG1-OE1 3.23Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.32Å; V306-E310 WeakPolarHBondContact O-CG 3.05Å; V306-E310 PolarHBondContact O-N 3Å
307Q96.6Very high88.4Confident98 Ų9850.3 Ų50.346%0.45825%0.252SS..Hα-helixtrans-59.9-45.4179.8-69.7-179.2-1.100112.4K132 D303 L305 I309 E310 D311K132-Q307 VanDerWaalsContact NZ-CD 3.35Å; D303-Q307 WeakPolarHBondContact O-CG 3.34Å; D303-Q307 PolarHBondContact O-N 3.2Å; L305-Q307 PolarHBondContact O-N 2.8Å; Q307-I309 VanDerWaalsContact C-N 3.29Å; Q307-I309 PolarHBondContact O-N 2.65Å; Q307-E310 PolarHBondContact O-N 2.88Å; Q307-D311 WeakPolarHBondContact O-CB 3.39Å; Q307-D311 VanDerWaalsContact O-CG 3.27Å; Q307-D311 PolarHBondContact O-N 3Å
308L96.4Very high86Confident11 Ų1157.6 Ų57.66%0.05829%0.286CS..Hα-helixtrans-65.8-32.3179.5-69.5173.7000112.7A130 K132 L143 V145 L154 A304 L305 V306 Y312A130-L308 HydrophobicContact CB-CD2 3.93Å; K132-L308 HydrophobicContact CB-CD1 4.2Å; K132-L308 HydrophobicContact CB-CD2 4.39Å; L143-L308 HydrophobicContact CB-CD1 3.76Å; L143-L308 HydrophobicContact CD2-CD1 4.07Å; V145-L308 HydrophobicContact CG2-CB 4.11Å; V145-L308 HydrophobicContact CG2-CD1 4.17Å; V145-L308 HydrophobicContact CG2-CD2 3.88Å; V145-L308 HydrophobicContact CG2-CG 4.28Å; L154-L308 HydrophobicContact CD1-CD1 4.17Å; A304-L308 WeakPolarHBondContact O-CG 3.41Å; A304-L308 PolarHBondContact O-N 3.44Å; L305-L308 PolarHBondContact O-N 2.77Å; V306-L308 PolarHBondContact O-N 2.94Å; L308-Y312 HydrophobicContact CD2-CD2 4.42Å; L308-Y312 HydrophobicContact CD2-CE2 4.43Å; L308-Y312 WeakPolarHBondContact O-CB 3.31Å; L308-Y312 WeakPolarHBondContact O-CD2 3.23Å; L308-Y312 PolarHBondContact O-N 3.28Å
309I95.4Very high83.7Confident30 Ų3065.9 Ų65.915%0.15433%0.325CS..Hα-helixtrans-75.9-39.8177.2-66.8158.8000110.4A181 A182 K185 L305 V306 Q307 D311 G313A181-I309 HydrophobicContact CB-CD1 4.45Å; A182-I309 HydrophobicContact CB-CD1 4.27Å; K185-I309 HydrophobicContact CB-CD1 4.06Å; K185-I309 HydrophobicContact CD-CD1 3.96Å; L305-I309 HydrophobicContact CB-CD1 4.19Å; L305-I309 WeakPolarHBondContact O-CB 3.46Å; L305-I309 VanDerWaalsContact O-CD1 3.31Å; L305-I309 WeakPolarHBondContact O-CD1 3.31Å; L305-I309 WeakPolarHBondContact O-CG1 3.34Å; L305-I309 PolarHBondContact O-N 2.82Å; V306-I309 PolarHBondContact O-N 2.96Å; Q307-I309 VanDerWaalsContact C-N 3.29Å; Q307-I309 PolarHBondContact O-N 2.65Å; I309-D311 VanDerWaalsContact C-N 3.35Å; I309-G313 WeakPolarHBondContact O-CA 3.15Å; I309-G313 PolarHBondContact O-N 3.23Å
310E94.5Very high81.4Confident137 Ų13771 Ų7164%0.6434%0.339SS*.Hα-helixtrans-62.2-43174.9-72.9170.3174.800111.4V306 Q307V306-E310 HydrophobicContact CG1-CG 4.35Å; V306-E310 VanDerWaalsContact CG1-OE1 3.23Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.32Å; V306-E310 WeakPolarHBondContact O-CG 3.05Å; V306-E310 PolarHBondContact O-N 3Å; Q307-E310 PolarHBondContact O-N 2.88Å
311D93.6Very high79.1Confident112 Ų11276.6 Ų76.660%0.59936%0.355SS*.Hα-helixtrans-77.1-33.8-177.6-67.5-21.6000113.1Q307 I309Q307-D311 WeakPolarHBondContact O-CB 3.39Å; Q307-D311 VanDerWaalsContact O-CG 3.27Å; Q307-D311 PolarHBondContact O-N 3Å; I309-D311 VanDerWaalsContact C-N 3.35Å
312Y93.6Very high76.4Confident63 Ų6379.9 Ų79.925%0.24739%0.39CS..Hα-helixtrans-128.3-5.6-168.5-58-81.3000115.7L129 A130 V145 R152 L178 L308 E314L129-Y312 HydrophobicContact CB-CD1 4.01Å; L129-Y312 HydrophobicContact CB-CE1 3.84Å; L129-Y312 HydrophobicContact CD1-CD1 4.1Å; L129-Y312 PolarHBondContact O-OH 2.84Å; A130-Y312 HydrophobicContact CB-CD2 4.19Å; A130-Y312 HydrophobicContact CB-CE2 3.41Å; A130-Y312 VanDerWaalsContact CB-CE2 3.41Å; V145-Y312 HydrophobicContact CG1-CG 4.1Å; V145-Y312 HydrophobicContact CG2-CD2 4.43Å; R152-Y312 PolarHBondContact NH1-O 2.91Å; L178-Y312 VanDerWaalsContact CD2-C 3.48Å; L178-Y312 VanDerWaalsContact CD2-O 3.27Å; L178-Y312 WeakPolarHBondContact CD2-O 3.5Å; L308-Y312 HydrophobicContact CD2-CD2 4.42Å; L308-Y312 HydrophobicContact CD2-CE2 4.43Å; L308-Y312 WeakPolarHBondContact O-CB 3.31Å; L308-Y312 WeakPolarHBondContact O-CD2 3.23Å; L308-Y312 PolarHBondContact O-N 3.28Å; Y312-E314 VanDerWaalsContact C-N 3.33Å; Y312-E314 PolarHBondContact O-N 3.05Å
313G83.1Confident73.8Confident10 Ų1078.5 Ų78.510%0.10340%0.4CS..G310 helixtrans-66.1-28.9-17700000114.5I309 G315I309-G313 WeakPolarHBondContact O-CA 3.15Å; I309-G313 PolarHBondContact O-N 3.23Å; G313-G315 PolarHBondContact O-N 3.46Å
314E67.2Low71.4Confident101 Ų10183.6 Ų83.647%0.47243%0.428SS..G310 helixtrans-76.1-6.2-173.3-58-46.8-111.900114.3Y312 D316 I317 E318Y312-E314 VanDerWaalsContact C-N 3.33Å; Y312-E314 PolarHBondContact O-N 3.05Å; E314-D316 PolarHBondContact O-N 3.18Å; E314-I317 CarbonylContact O-C 3.23Å; E314-I317 PolarHBondContact O-N 3.48Å; E314-I317 WeakPolarHBondContact OE2-CD1 3.43Å; E314-E318 PolarHBondContact O-N 2.88Å
315G56.7Low69Low25 Ų2591.1 Ų91.126%0.25847%0.468SS..G310 helixtrans-63.7-23.917700000114.7G313G313-G315 PolarHBondContact O-N 3.46Å
316D53.2Low66.6Low50 Ų5097.5 Ų97.527%0.26750%0.502SS..G310 helixtrans-91.3-9.6174.8-73.6-7.7000112.3E314 R320E314-D316 PolarHBondContact O-N 3.18Å; D316-R320 PolarHBondContact O-NH1 2.82Å; D316-R320 VanDerWaalsContact O-NH1 3.16Å
317I49.2Very low64.7Low61 Ų61101.2 Ų101.231%0.31353%0.527SS..THydrogen-bonded Turntrans-109.9-28.6-173.9-31-174.2000111.9E314 E319 R320 R321E314-I317 CarbonylContact O-C 3.23Å; E314-I317 PolarHBondContact O-N 3.48Å; E314-I317 WeakPolarHBondContact OE2-CD1 3.43Å; I317-E319 PolarHBondContact O-N 2.87Å; I317-R320 CarbonylContact O-C 3.52Å; I317-R320 VanDerWaalsContact O-C 3.23Å; I317-R320 VanDerWaalsContact O-CA 3.26Å; I317-R320 WeakPolarHBondContact O-CA 3.42Å; I317-R320 WeakPolarHBondContact O-CB 3.41Å; I317-R320 PolarHBondContact O-N 2.81Å; I317-R321 HydrophobicContact CG2-CB 4.46Å; I317-R321 HydrophobicContact CG2-CG 3.99Å; I317-R321 WeakPolarHBondContact O-CB 3.33Å; I317-R321 PolarHBondContact O-N 2.87Å
318E45.6Very low62.9Low153 Ų153102.4 Ų102.472%0.71554%0.535SS*.Hα-helixtrans-63.3-29.8171.9-78.8-137146.300112E314 R320 R321 G322E314-E318 PolarHBondContact O-N 2.88Å; E318-R320 PolarHBondContact O-N 2.81Å; E318-R321 PolarHBondContact O-N 3.33Å; E318-G322 PolarHBondContact O-N 3.5Å
319E48.4Very low60.9Low177 Ų177111 Ų11183%0.82758%0.576SS**Hα-helixtrans-68.8-9.8168.4-149.4-176.3-153.900112.8I317I317-E319 PolarHBondContact O-N 2.87Å
320R49.8Very low59.4Low196 Ų196111.8 Ų111.874%0.7458%0.58SS**Hα-helixtrans-119.8-5.6178.1-71.9-172.8174.779.36.7114.9D316 I317 E318D316-R320 PolarHBondContact O-NH1 2.82Å; D316-R320 VanDerWaalsContact O-NH1 3.16Å; I317-R320 CarbonylContact O-C 3.52Å; I317-R320 VanDerWaalsContact O-C 3.23Å; I317-R320 VanDerWaalsContact O-CA 3.26Å; I317-R320 WeakPolarHBondContact O-CA 3.42Å; I317-R320 WeakPolarHBondContact O-CB 3.41Å; I317-R320 PolarHBondContact O-N 2.81Å; E318-R320 PolarHBondContact O-N 2.81Å
321R49.3Very low58.1Low209 Ų209109.6 Ų109.679%0.78958%0.577SS**Hα-helixtrans-131.7-3-175.9-83.4-171.2173.9-157.8-2.6114I317 E318I317-R321 HydrophobicContact CG2-CB 4.46Å; I317-R321 HydrophobicContact CG2-CG 3.99Å; I317-R321 WeakPolarHBondContact O-CB 3.33Å; I317-R321 PolarHBondContact O-N 2.87Å; E318-R321 PolarHBondContact O-N 3.33Å
322G42.5Very low56.8Low70 Ų70112.8 Ų112.872%0.72259%0.588SS**SBendtrans-93.688.4164.300000111.1E318E318-G322 PolarHBondContact O-N 3.5Å
323G42.7Very low55.8Low51 Ų51111.7 Ų111.753%0.52660%0.596SS.*  trans12277.8165.400000114.6D325G323-D325 PolarHBondContact O-N 3.36Å
324D48.8Very low55.4Low177 Ų177115.7 Ų115.795%0.94762%0.619SS**THydrogen-bonded Turntrans-69.723.9164.1-146.619.7000112.1
325D46.5Very low55.8Low158 Ų158113.3 Ų113.385%0.84561%0.614SS**THydrogen-bonded Turntrans-162.619.2-178.2-115.9-29.7000114.6G323G323-D325 PolarHBondContact O-N 3.36Å
326D47.7Very low56.8Low134 Ų134118.4 Ų118.472%0.71763%0.629SS**  trans-113.499.3166.5-154.431.8000108.1L328D326-L328 PolarHBondContact O-N 3.13Å; D326-L328 VanDerWaalsContact O-N 3.08Å
327P58.1Low57.8Low103 Ų103123 Ų12367%0.66964%0.643SS**  trans-52122.5168.3-19.230.3000106.6E329P327-E329 PolarHBondContact O-N 2.9Å
328L57.9Low59.2Low122 Ų122123.2 Ų123.264%0.63965%0.646SS**  trans-42.8109.8167.1-71.6169.3000106.2D326 L330D326-L328 PolarHBondContact O-N 3.13Å; D326-L328 VanDerWaalsContact O-N 3.08Å; L328-L330 HydrophobicContact CB-CD2 4.39Å; L328-L330 HydrophobicContact CB-CG 4.48Å; L328-L330 WeakPolarHBondContact O-CG 3.44Å; L328-L330 PolarHBondContact O-N 2.8Å
329E54.6Low60.8Low193 Ų193123.3 Ų123.390%0.90265%0.652SS**  trans-72.581.9-172.3-153.4-178-159.200106.3P327P327-E329 PolarHBondContact O-N 2.9Å
330L65.2Low62Low45 Ų45120.2 Ų120.224%0.23664%0.641CS.*PPolyproline II helixtrans-69.8139179.6-65.1178.7000106.7L328 E332 V347 G348 I354L328-L330 HydrophobicContact CB-CD2 4.39Å; L328-L330 HydrophobicContact CB-CG 4.48Å; L328-L330 WeakPolarHBondContact O-CG 3.44Å; L328-L330 PolarHBondContact O-N 2.8Å; L330-E332 PolarHBondContact O-N 2.85Å; L330-V347 HydrophobicContact CB-CB 4.4Å; L330-V347 HydrophobicContact CB-CG1 4.28Å; L330-V347 HydrophobicContact CD1-CG1 4.47Å; L330-V347 WeakPolarHBondContact CD1-O 3.44Å; L330-V347 HydrophobicContact CD2-CG1 4.09Å; L330-G348 VanDerWaalsContact CD1-C 3.5Å; L330-I354 HydrophobicContact CD2-CD1 4.1Å; L330-I354 HydrophobicContact CD2-CG1 4.23Å; L330-I354 HydrophobicContact CD2-CG2 4.19Å
331P66.5Low62.9Low91 Ų91116.2 Ų116.259%0.59163%0.629SS**PPolyproline II helixtrans-49.2130.5175.4-26.333000110.3G333 V347P331-G333 PolarHBondContact O-N 3.48Å; P331-V347 HydrophobicContact CB-CG2 4.46Å
332E67.4Low64.2Low179 Ų179110.5 Ų110.584%0.83661%0.608SS**PPolyproline II helixtrans-53.8134.4177.3-167.2178.8178.500109.1L330 T334L330-E332 PolarHBondContact O-N 2.85Å; E332-T334 PolarHBondContact O-N 2.77Å; E332-T334 VanDerWaalsContact O-N 3.16Å
333G71.9Confident66Low40 Ų40110.3 Ų110.341%0.41259%0.587SS.*PPolyproline II helixtrans-53.9123.5-175.600000110.8P331 F345P331-G333 PolarHBondContact O-N 3.48Å; G333-F345 CarbonylContact C-O 3.57Å; G333-F345 WeakPolarHBondContact CA-O 3.35Å
334T73.9Confident67.8Low95 Ų95112.2 Ų112.258%0.58358%0.579SS**EExtended strand (participates in β ladder)trans-91.5151.4179.954.10000109.8E332 F345E332-T334 PolarHBondContact O-N 2.77Å; E332-T334 VanDerWaalsContact O-N 3.16Å; T334-F345 PolarHBondContact N-O 3.26Å; T334-F345 WeakPolarHBondContact O-CB 3.27Å; T334-F345 PolarHBondContact O-N 3.29Å
335S75.8Confident69.5Low51 Ų51106.8 Ų106.836%0.35755%0.547SS..EExtended strand (participates in β ladder)trans-128.7135.5172.773.50000111.5R342 F343S335-R342 PolarHBondContact OG-NH1 2.91Å; S335-F343 CarbonylContact C-O 3.54Å; S335-F343 WeakPolarHBondContact CA-O 3.4Å; S335-F343 WeakPolarHBondContact CB-O 2.84Å
336F77.1Confident71.2Confident132 Ų132102 Ų10258%0.57952%0.522SS*.EExtended strand (participates in β ladder)trans-117.3138.7177.4-166.4-106.5000109.7V338 F343 F345F336-V338 HydrophobicContact CD1-CG2 3.52Å; F336-V338 HydrophobicContact CE1-CG2 3.51Å; F336-F343 PolarHBondContact N-O 3.01Å; F336-F343 PolarHBondContact O-N 3.16Å; F336-F345 HydrophobicContact CB-CE2 3.93Å
337R75.4Confident72.6Confident146 Ų14697.8 Ų97.855%0.55150%0.5SS*.EExtended strand (participates in β ladder)trans-104125.5176.9-66.9-179.480.8146.2-0.8109K341 R342R337-K341 WeakPolarHBondContact CA-O 3.43Å; R337-R342 HydrophobicContact CG-CB 4.21Å; R337-R342 HydrophobicContact CG-CG 4.06Å
338V78.6Confident73.5Confident65 Ų6593.6 Ų93.639%0.39448%0.476SS..EExtended strand (participates in β ladder)trans-122.8121.8167.6-172.20000106.4F336 N340 K341 F343F336-V338 HydrophobicContact CD1-CG2 3.52Å; F336-V338 HydrophobicContact CE1-CG2 3.51Å; V338-N340 PolarHBondContact O-N 3.29Å; V338-K341 PolarHBondContact N-O 3.35Å; V338-K341 PolarHBondContact O-N 3.42Å; V338-F343 HydrophobicContact CB-CE2 4.08Å; V338-F343 HydrophobicContact CG2-CD2 4.37Å; V338-F343 HydrophobicContact CG2-CE2 4.16Å
339D79.7Confident74.3Confident155 Ų15590.6 Ų90.683%0.82947%0.465SS*.THydrogen-bonded Turntrans52.4-126.7-172-50.9-42.1000112.4
340N73.6Confident75.2Confident113 Ų11385.1 Ų85.160%0.60444%0.442SS*.THydrogen-bonded Turntrans-94.313178.7-139.716.4000113.2V338V338-N340 PolarHBondContact O-N 3.29Å
341K68.4Low75.2Confident111 Ų11191.4 Ų91.448%0.48347%0.468SS..EExtended strand (participates in β ladder)trans-114.8144.6178.9-70.5-177.1-179.4178.30110.8R337 V338 F343R337-K341 WeakPolarHBondContact CA-O 3.43Å; V338-K341 PolarHBondContact N-O 3.35Å; V338-K341 PolarHBondContact O-N 3.42Å; K341-F343 HydrophobicContact CB-CE2 4.3Å
342R76.6Confident75Confident90 Ų9096.1 Ų96.134%0.3448%0.475SS..EExtended strand (participates in β ladder)trans-116129.9174.9-173.5-175.9-72.2-108.813.2108.3S335 R337 Y344S335-R342 PolarHBondContact OG-NH1 2.91Å; R337-R342 HydrophobicContact CG-CB 4.21Å; R337-R342 HydrophobicContact CG-CG 4.06Å; R342-Y344 HydrophobicContact CB-CE2 4.45Å; R342-Y344 VanDerWaalsContact CD-OH 3.28Å; R342-Y344 WeakPolarHBondContact CD-OH 3.48Å; R342-Y344 HydrophobicContact CG-CE1 4.44Å; R342-Y344 HydrophobicContact CG-CE2 4.13Å
343F80.7Confident75.1Confident66 Ų6689.3 Ų89.329%0.28945%0.453SS..EExtended strand (participates in β ladder)trans-103.2128.8174.5-62.8-91.3000108.1S335 F336 V338 K341 F345 N360S335-F343 CarbonylContact C-O 3.54Å; S335-F343 WeakPolarHBondContact CA-O 3.4Å; S335-F343 WeakPolarHBondContact CB-O 2.84Å; F336-F343 PolarHBondContact N-O 3.01Å; F336-F343 PolarHBondContact O-N 3.16Å; V338-F343 HydrophobicContact CB-CE2 4.08Å; V338-F343 HydrophobicContact CG2-CD2 4.37Å; V338-F343 HydrophobicContact CG2-CE2 4.16Å; K341-F343 HydrophobicContact CB-CE2 4.3Å; F343-F345 HydrophobicContact CB-CD2 4.47Å; F343-F345 HydrophobicContact CB-CE2 3.71Å; F343-F345 HydrophobicContact CB-CZ 4.14Å; F343-N360 HydrophobicContact CD1-CB 4.35Å; F343-N360 HydrophobicContact CE1-CB 4.34Å; F343-N360 WeakPolarHBondContact CE1-ND2 3.27Å
344Y79.1Confident75.4Confident91 Ų9192.9 Ų92.936%0.35746%0.461SS..EExtended strand (participates in β ladder)trans-102.6132.4173.5-61.6-89.9000109.1R342 L358 T359 Y361R342-Y344 HydrophobicContact CB-CE2 4.45Å; R342-Y344 VanDerWaalsContact CD-OH 3.28Å; R342-Y344 WeakPolarHBondContact CD-OH 3.48Å; R342-Y344 HydrophobicContact CG-CE1 4.44Å; R342-Y344 HydrophobicContact CG-CE2 4.13Å; Y344-L358 WeakPolarHBondContact O-CA 3.23Å; Y344-T359 PolarHBondContact N-O 3.02Å; Y344-T359 VanDerWaalsContact N-O 3.07Å; Y344-T359 PolarHBondContact O-N 2.87Å; Y344-Y361 HydrophobicContact CD2-CD2 4.44Å; Y344-Y361 HydrophobicContact CE2-CD2 4.29Å
345F84.9Confident75.3Confident63 Ų6392.6 Ų92.628%0.27645%0.452SS..EExtended strand (participates in β ladder)trans-116.388.3-179-63.9-95.8000107.5G333 T334 F336 F343 L356 L358G333-F345 CarbonylContact C-O 3.57Å; G333-F345 WeakPolarHBondContact CA-O 3.35Å; T334-F345 PolarHBondContact N-O 3.26Å; T334-F345 WeakPolarHBondContact O-CB 3.27Å; T334-F345 PolarHBondContact O-N 3.29Å; F336-F345 HydrophobicContact CB-CE2 3.93Å; F343-F345 HydrophobicContact CB-CD2 4.47Å; F343-F345 HydrophobicContact CB-CE2 3.71Å; F343-F345 HydrophobicContact CB-CZ 4.14Å; F345-L356 HydrophobicContact CB-CD1 4.12Å; F345-L356 HydrophobicContact CD1-CD2 4.27Å; F345-L358 HydrophobicContact CD1-CD2 3.22Å; F345-L358 HydrophobicContact CE1-CD2 3.2Å; F345-L358 HydrophobicContact CG-CD2 4.13Å; F345-L358 HydrophobicContact CZ-CD2 4.09Å
346D82.4Confident75.6Confident58 Ų5893.6 Ų93.631%0.3145%0.453SS..EExtended strand (participates in β ladder)trans-94.7118.5-178.6-47.2-57.1000108.9K357D346-K357 HydrophobicContact CB-CB 4.22Å; D346-K357 PolarHBondContact N-O 3.14Å; D346-K357 PolarHBondContact O-N 2.98Å
347V77.3Confident75.6Confident45 Ų4592.2 Ų92.227%0.27345%0.447SS..EExtended strand (participates in β ladder)trans-82.2122.1171.4-173.20000107.5L330 P331 I354 L356L330-V347 HydrophobicContact CB-CB 4.4Å; L330-V347 HydrophobicContact CB-CG1 4.28Å; L330-V347 HydrophobicContact CD1-CG1 4.47Å; L330-V347 WeakPolarHBondContact CD1-O 3.44Å; L330-V347 HydrophobicContact CD2-CG1 4.09Å; P331-V347 HydrophobicContact CB-CG2 4.46Å; V347-I354 HydrophobicContact CG1-CG2 3.48Å; V347-I354 VanDerWaalsContact CG1-CG2 3.48Å; V347-L356 HydrophobicContact CG2-CD1 3.93Å
348G76.7Confident75.5Confident15 Ų1587.7 Ų87.716%0.15543%0.433CS..EExtended strand (participates in β ladder)trans-123.1160.8177.600000111.4L330 I354 F355L330-G348 VanDerWaalsContact CD1-C 3.5Å; G348-I354 CarbonylContact O-C 3.53Å; G348-I354 WeakPolarHBondContact O-CA 3.29Å; G348-F355 VanDerWaalsContact C-CE1 3.44Å; G348-F355 PolarHBondContact N-O 2.83Å; G348-F355 VanDerWaalsContact O-CD1 3.31Å; G348-F355 WeakPolarHBondContact O-CD1 3.22Å; G348-F355 PolarHBondContact O-N 2.78Å; G348-F355 VanDerWaalsContact O-O 3.11Å
349S74.9Confident75.4Confident59 Ų5985.7 Ų85.741%0.41342%0.421SS..EExtended strand (participates in β ladder)trans-120.7143.4173.664.20000109.8
350N73.1Confident74.6Confident78 Ų7880.9 Ų80.942%0.41740%0.395SS..EExtended strand (participates in β ladder)trans-137175.5170.465.636.5000109.4Y352 G353 F355N350-Y352 PolarHBondContact O-N 2.82Å; N350-Y352 VanDerWaalsContact OD1-CA 3.27Å; N350-Y352 WeakPolarHBondContact OD1-CA 3.25Å; N350-Y352 VanDerWaalsContact OD1-CB 3.25Å; N350-Y352 WeakPolarHBondContact OD1-CB 3.17Å; N350-Y352 PolarHBondContact OD1-N 2.93Å; N350-G353 PolarHBondContact N-O 3.2Å; N350-G353 PolarHBondContact O-N 3.37Å; N350-G353 PolarHBondContact OD1-N 3.12Å; N350-G353 VanDerWaalsContact OD1-N 3.12Å; N350-G353 PolarHBondContact OD1-O 3.37Å; N350-F355 HydrophobicContact CB-CD1 4.26Å; N350-F355 HydrophobicContact CB-CE1 3.92Å; N350-F355 WeakPolarHBondContact ND2-CD1 3.47Å
351K64.9Low73.6Confident177 Ų17783.2 Ų83.277%0.7740%0.397SS*.THydrogen-bonded Turntrans-58.4-12179.169.7-178.7-174.6178.20115
352Y62.9Low73Confident190 Ų19079.7 Ų79.775%0.74539%0.385SS*.THydrogen-bonded Turntrans-103-5.7178.3-53.7-72000113.3N350N350-Y352 PolarHBondContact O-N 2.82Å; N350-Y352 VanDerWaalsContact OD1-CA 3.27Å; N350-Y352 WeakPolarHBondContact OD1-CA 3.25Å; N350-Y352 VanDerWaalsContact OD1-CB 3.25Å; N350-Y352 WeakPolarHBondContact OD1-CB 3.17Å; N350-Y352 PolarHBondContact OD1-N 2.93Å
353G68.4Low71.7Confident36 Ų3684 Ų8437%0.37141%0.407SS..EExtended strand (participates in β ladder)trans133.3-172.317700000114N350N350-G353 PolarHBondContact N-O 3.2Å; N350-G353 PolarHBondContact O-N 3.37Å; N350-G353 PolarHBondContact OD1-N 3.12Å; N350-G353 VanDerWaalsContact OD1-N 3.12Å; N350-G353 PolarHBondContact OD1-O 3.37Å
354I78.5Confident70.2Confident115 Ų11584.6 Ų84.659%0.5942%0.418SS*.EExtended strand (participates in β ladder)trans-80.9136.3175.3-57.3172.7000109.1L330 V347 G348L330-I354 HydrophobicContact CD2-CD1 4.1Å; L330-I354 HydrophobicContact CD2-CG1 4.23Å; L330-I354 HydrophobicContact CD2-CG2 4.19Å; V347-I354 HydrophobicContact CG1-CG2 3.48Å; V347-I354 VanDerWaalsContact CG1-CG2 3.48Å; G348-I354 CarbonylContact O-C 3.53Å; G348-I354 WeakPolarHBondContact O-CA 3.29Å
355F72.1Confident68.5Low88 Ų8892.6 Ų92.639%0.38645%0.448SS..EExtended strand (participates in β ladder)trans-132.2154.3178.765.3-89000110.8G348 N350 K357G348-F355 VanDerWaalsContact C-CE1 3.44Å; G348-F355 PolarHBondContact N-O 2.83Å; G348-F355 VanDerWaalsContact O-CD1 3.31Å; G348-F355 WeakPolarHBondContact O-CD1 3.22Å; G348-F355 PolarHBondContact O-N 2.78Å; G348-F355 VanDerWaalsContact O-O 3.11Å; N350-F355 HydrophobicContact CB-CD1 4.26Å; N350-F355 HydrophobicContact CB-CE1 3.92Å; N350-F355 WeakPolarHBondContact ND2-CD1 3.47Å; F355-K357 HydrophobicContact CD2-CB 4.45Å; F355-K357 HydrophobicContact CE2-CB 4.22Å
356L81.9Confident66.6Low72 Ų7296.7 Ų96.738%0.37747%0.468SS..EExtended strand (participates in β ladder)trans-104.4119.6172.8-175.866.8000108.9F345 V347F345-L356 HydrophobicContact CB-CD1 4.12Å; F345-L356 HydrophobicContact CD1-CD2 4.27Å; V347-L356 HydrophobicContact CG2-CD1 3.93Å
357K78.1Confident64.6Low104 Ų10499.9 Ų99.945%0.45249%0.485SS..EExtended strand (participates in β ladder)trans-93.1121.9173-177.1-173.8178.2-169.90108.9D346 F355D346-K357 HydrophobicContact CB-CB 4.22Å; D346-K357 PolarHBondContact N-O 3.14Å; D346-K357 PolarHBondContact O-N 2.98Å; F355-K357 HydrophobicContact CD2-CB 4.45Å; F355-K357 HydrophobicContact CE2-CB 4.22Å
358L73.1Confident62.9Low51 Ų51104.4 Ų104.427%0.26751%0.506SS..EExtended strand (participates in β ladder)trans-103.7113176.5-70.8157.2000108.6Y344 F345 C373Y344-L358 WeakPolarHBondContact O-CA 3.23Å; F345-L358 HydrophobicContact CD1-CD2 3.22Å; F345-L358 HydrophobicContact CE1-CD2 3.2Å; F345-L358 HydrophobicContact CG-CD2 4.13Å; F345-L358 HydrophobicContact CZ-CD2 4.09Å; L358-C373 HydrophobicContact CD1-CB 3.93Å
359T75.4Confident61.4Low22 Ų22109 Ų10914%0.13553%0.527CS..EExtended strand (participates in β ladder)trans-113.8123.8177.6-47.40000110.6Y344 Y361Y344-T359 PolarHBondContact N-O 3.02Å; Y344-T359 VanDerWaalsContact N-O 3.07Å; Y344-T359 PolarHBondContact O-N 2.87Å; T359-Y361 HydrophobicContact CG2-CD2 3.76Å; T359-Y361 HydrophobicContact CG2-CE2 3.39Å
360N62.8Low59.6Low54 Ų54112.5 Ų112.529%0.28954%0.541SS..EExtended strand (participates in β ladder)trans-111.6116.2168.9-174.2-17.9000108.1F343 P362F343-N360 HydrophobicContact CD1-CB 4.35Å; F343-N360 HydrophobicContact CE1-CB 4.34Å; F343-N360 WeakPolarHBondContact CE1-ND2 3.27Å; N360-P362 WeakPolarHBondContact O-CD 3.15Å
361Y54.6Low58.2Low162 Ų162115.9 Ų115.964%0.63555%0.552SS**  trans-94.7101.4170-77.6-80.3000109.1Y344 T359Y344-Y361 HydrophobicContact CD2-CD2 4.44Å; Y344-Y361 HydrophobicContact CE2-CD2 4.29Å; T359-Y361 HydrophobicContact CG2-CD2 3.76Å; T359-Y361 HydrophobicContact CG2-CE2 3.39Å
362P54.3Low56.9Low37 Ų37115.8 Ų115.824%0.2455%0.554CS.*  trans-64142.7164.425.8-30.9000109.5N360 S364N360-P362 WeakPolarHBondContact O-CD 3.15Å; P362-S364 WeakPolarHBondContact CG-O 3.09Å; P362-S364 PolarHBondContact O-N 2.73Å; P362-S364 VanDerWaalsContact O-N 3.12Å
363K49.3Very low55.6Low182 Ų182110.2 Ų110.279%0.79154%0.542SS*.SBendtrans-63-12173.3-75.3-178.7178.2172.40113
364S49.3Very low53.9Low77 Ų77113.9 Ų113.954%0.53856%0.561SS.*SBendtrans-108.4131.2172.4550000109.9P362 E366P362-S364 WeakPolarHBondContact CG-O 3.09Å; P362-S364 PolarHBondContact O-N 2.73Å; P362-S364 VanDerWaalsContact O-N 3.12Å; S364-E366 PolarHBondContact O-N 3.4Å
365R44.7Very low51.8Low260 Ų260116.9 Ų116.998%0.98157%0.572SS**SBendtrans-64.621.9-174.6-87.6-175.3170.6158.1-2.4116.4
366E43.4Very low49.9Very low148 Ų148119.4 Ų119.469%0.69259%0.588SS**SBendtrans-125.7120.1-176.9-66.4177.4-176.700108.7S364S364-E366 PolarHBondContact O-N 3.4Å
367N40.9Very low47.5Very low126 Ų126124.6 Ų124.667%0.67461%0.608SS**  trans94.376.2176.1-45.9-47.7000116.5N369N367-N369 PolarHBondContact O-N 2.94Å
368I42.8Very low45.4Very low139 Ų139127.9 Ų127.971%0.71362%0.624SS**  trans-81.9101.8157.9-57.8172000107.3
369N43.3Very low43.3Very low111 Ų111134.6 Ų134.659%0.59465%0.651SS**  trans-92.3106.5170.1-73.8-36.6000109.3N367 F371N367-N369 PolarHBondContact O-N 2.94Å; N369-F371 HydrophobicContact CB-CD2 3.99Å; N369-F371 HydrophobicContact CB-CE2 3.53Å; N369-F371 HydrophobicContact CB-CZ 4.21Å; N369-F371 PolarHBondContact O-N 2.97Å; N369-F371 VanDerWaalsContact O-N 3.15Å
370L38.4Very low41.3Very low133 Ų133141.9 Ų141.970%0.69668%0.684SS**  trans-8087.9175.2-150.683.7000108.9H372L370-H372 PolarHBondContact O-N 2.87Å
371F43.2Very low39.8Very low149 Ų149147.5 Ų147.565%0.65471%0.708SS**  trans-77.6110.5172.7-71.6-80.7000109.6N369 C373N369-F371 HydrophobicContact CB-CD2 3.99Å; N369-F371 HydrophobicContact CB-CE2 3.53Å; N369-F371 HydrophobicContact CB-CZ 4.21Å; N369-F371 PolarHBondContact O-N 2.97Å; N369-F371 VanDerWaalsContact O-N 3.15Å; F371-C373 PolarHBondContact O-N 3.24Å
372H37.2Very low39.2Very low175 Ų175145.7 Ų145.781%0.8172%0.717SS**  trans-73.1106.2163.3-112.545.6000108L370 C374L370-H372 PolarHBondContact O-N 2.87Å; H372-C374 PolarHBondContact O-N 3.26Å
373C35Very low38.2Very low74 Ų74153 Ų15350%0.575%0.747SS.*  trans-74.4110.6175.7-169.60000109.5L358 F371L358-C373 HydrophobicContact CD1-CB 3.93Å; F371-C373 PolarHBondContact O-N 3.24Å
374C33.2Very low37.5Very low112 Ų112150.9 Ų150.976%0.75774%0.744SS**  trans-62.1145.6168.3-73.20000111.4H372 I376H372-C374 PolarHBondContact O-N 3.26Å; C374-I376 PolarHBondContact O-N 2.87Å
375Q34.2Very low36.8Very low179 Ų179153.9 Ų153.984%0.83676%0.759SS**  trans-28.6116.2174.4-62.5-175.3-5.900114.6K377Q375-K377 PolarHBondContact O-N 2.74Å
376I33.7Very low36.7Very low140 Ų140147.4 Ų147.472%0.71875%0.749SS**  trans-71101166.3-60.6178.7000107.3C374 H378C374-I376 PolarHBondContact O-N 2.87Å; I376-H378 PolarHBondContact O-N 3.33Å
377K31.6Very low36.4Very low182 Ų182149.9 Ų149.979%0.79176%0.758SS**  trans-70.5120.6158.4-74.6-179.2178.6175.30107.1Q375 K379Q375-K377 PolarHBondContact O-N 2.74Å; K377-K379 PolarHBondContact O-N 2.9Å; K377-K379 VanDerWaalsContact O-N 3.1Å
378H32.6Very low36.3Very low172 Ų172150.2 Ų150.280%0.79676%0.764SS**  trans-50.3117.3166.2-86.3-106.5000109.5I376I376-H378 PolarHBondContact O-N 3.33Å
379K29.9Very low36.1Very low193 Ų193150.1 Ų150.184%0.83977%0.77SS**  trans-12091.5156-169.6176.8-179.3-1750105.8K377 Q381K377-K379 PolarHBondContact O-N 2.9Å; K377-K379 VanDerWaalsContact O-N 3.1Å; K379-Q381 PolarHBondContact O-N 2.85Å
380E34Very low35.9Very low174 Ų174153.9 Ų153.981%0.81378%0.784SS**  trans-60.3131.5164.6-71.6-176139.800109
381Q29.6Very low35.6Very low173 Ų173160.4 Ų160.481%0.80881%0.811SS**  trans-134.6131.1145.6-115.2-166.40.300107.1K379K379-Q381 PolarHBondContact O-N 2.85Å
382P42.1Very low35.3Very low124 Ų124161 Ų16181%0.80582%0.819SS**  trans-77.6144.6-175.931.5-32000110.8
383H34.8Very low35.1Very low189 Ų189160.3 Ų160.388%0.87582%0.819SS**  trans-61.1143.4174.1-75.4-81.7000112.2
384D32.9Very low35.2Very low139 Ų139165.1 Ų165.174%0.74384%0.837SS**  trans-147.9106.3143.2-153-1.4000110.2
385T36.2Very low35.3Very low139 Ų139168.2 Ų168.285%0.85384%0.842SS**  trans-168.582.9147.3340000109.1K387T385-K387 PolarHBondContact O-N 3.3Å
386T42.1Very low35.3Very low125 Ų125167.5 Ų167.577%0.76784%0.842SS**  trans-72.6112.9148.444.20000108.6
387K36.9Very low35.5Very low199 Ų199169.3 Ų169.387%0.86585%0.85SS**  trans-148.199.8144.9-75.3-158.8179.3178.80110.2T385T385-K387 PolarHBondContact O-N 3.3Å
388T39.6Very low35.7Very low133 Ų133168.4 Ų168.482%0.81686%0.855SS**  trans-43.9136.1138.638.80000111.2
389V37.9Very low36Very low137 Ų137168.2 Ų168.283%0.8386%0.859SS**  -177.3125.9119.3164.20000107.4
390E38Very low36.5Very low190 Ų190166.1 Ų166.189%0.88886%0.861SS**  trans-69.1155.2167.1-66.7176.2134.500111.2
391E33.6Very low36.7Very low271 Ų271165.4 Ų165.4100%1.26687%0.865SS**  trans77.30169.8-147.5174.616200118.6

Retrieved 391 of 391 residues in 267.4 ms (Link to these results)