A0A060D5A5_MAIZE Loading...

C2C2-DOF transcription factor

AlphaFold DB , UniProt , Accession A0A060D5A5, Species MAIZE (Zea mays, Maize), Gene DOF37, Length 260 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
1M60.4Low64.2Low244 Ų244123.6 Ų123.6100%1.20271%0.712SS**  066.80-61.5-169-162.600110.1
2L65.1Low64.5Low180 Ų180118.8 Ų118.894%0.94268%0.677SS**  trans-93.1106.6172.4-85.290.6000108.3H4L2-H4 PolarHBondContact O-N 3.39Å
3S70.4Confident65.3Low107 Ų107121.1 Ų121.175%0.74867%0.674SS**  trans-59.9120.9173.547.50000110.6V5S3-V5 PolarHBondContact O-N 3.05Å
4H71.3Confident66.1Low157 Ų157118 Ų11873%0.72766%0.655SS**  trans-61.1115.6170.3-176.2-105.7000109.9L2 E6L2-H4 PolarHBondContact O-N 3.39Å; H4-E6 IonicContact CE1-OE2 3.44Å
5V67.8Low66.7Low73 Ų73123.5 Ų123.544%0.44267%0.67SS.*  trans-91.8102.5167.9174.50000107S3 M7S3-V5 PolarHBondContact O-N 3.05Å; V5-M7 PolarHBondContact O-N 3.45Å
6E67.6Low67.3Low151 Ų151120.7 Ų120.771%0.70668%0.679SS**  trans-72.5116.7172.8-173.1163.3112.700109.5H4 A8H4-E6 IonicContact CE1-OE2 3.44Å; E6-A8 PolarHBondContact O-N 3.34Å
7M53.9Low67.7Low165 Ų165122.9 Ų122.981%0.81368%0.68SS**  trans-79.497.4172.8-8099.2170.500109.9V5V5-M7 PolarHBondContact O-N 3.45Å
8A55.6Low68.3Low63 Ų63120.7 Ų120.752%0.52167%0.67SS.*  trans-82.6143.7159.500000109.7E6 G10E6-A8 PolarHBondContact O-N 3.34Å; A8-G10 PolarHBondContact O-N 3Å
9P59.4Low68.4Low140 Ų140118.2 Ų118.291%0.90966%0.655SS**THydrogen-bonded Turntrans-66.899.917527.9-32.3000109
10G64Low68.8Low57 Ų57116.9 Ų116.959%0.58865%0.65SS**THydrogen-bonded Turntrans154.4-2.8-178.400000116.7A8A8-G10 PolarHBondContact O-N 3Å
11G70.3Confident68.8Low23 Ų23118.1 Ų118.124%0.23765%0.651CS.*  trans138.9162.7176.900000112.1I19G11-I19 CarbonylContact C-O 3.57Å; G11-I19 WeakPolarHBondContact CA-O 3.29Å
12F68.8Low68.7Low66 Ų66112.6 Ų112.629%0.28964%0.635SS.*EExtended strand (participates in β ladder)trans-116.3139.2178.558.6-77.6000110.1L14 I19 Q21F12-L14 HydrophobicContact CD2-CD1 3.85Å; F12-L14 HydrophobicContact CD2-CG 3.94Å; F12-L14 HydrophobicContact CE2-CD1 3.47Å; F12-L14 VanDerWaalsContact CE2-CD1 3.47Å; F12-L14 HydrophobicContact CE2-CG 4.08Å; F12-I19 HydrophobicContact CE1-CB 4.24Å; F12-I19 HydrophobicContact CE1-CG2 4.06Å; F12-I19 HydrophobicContact CE2-CB 4.34Å; F12-I19 HydrophobicContact CE2-CD1 3.95Å; F12-I19 HydrophobicContact CZ-CB 4.13Å; F12-I19 HydrophobicContact CZ-CD1 4.22Å; F12-I19 HydrophobicContact CZ-CG2 3.95Å; F12-I19 PolarHBondContact N-O 3.32Å; F12-I19 PolarHBondContact O-N 3.41Å; F12-Q21 HydrophobicContact CD1-CG 4.17Å; F12-Q21 HydrophobicContact CE1-CG 3.83Å
13K75Confident68.3Low148 Ų148108.3 Ų108.364%0.64363%0.626SS**EExtended strand (participates in β ladder)trans-86.6120.2176.8-80.9177.3172.3172.20109.9K17 V18K13-K17 WeakPolarHBondContact CA-O 3.33Å; K13-V18 HydrophobicContact CD-CG2 4.13Å; K13-V18 VanDerWaalsContact CE-CG2 3.41Å; K13-V18 HydrophobicContact CG-CB 4.42Å; K13-V18 HydrophobicContact CG-CG2 3.59Å
14L75.7Confident67.5Low78 Ų78112.3 Ų112.341%0.40863%0.632SS.*EExtended strand (participates in β ladder)trans-124.3131.3166.4-78.7172.8000108.5F12 G16 K17 I19F12-L14 HydrophobicContact CD2-CD1 3.85Å; F12-L14 HydrophobicContact CD2-CG 3.94Å; F12-L14 HydrophobicContact CE2-CD1 3.47Å; F12-L14 VanDerWaalsContact CE2-CD1 3.47Å; F12-L14 HydrophobicContact CE2-CG 4.08Å; L14-G16 VanDerWaalsContact C-N 3.32Å; L14-G16 PolarHBondContact O-N 3.29Å; L14-K17 PolarHBondContact N-O 2.94Å; L14-K17 PolarHBondContact O-N 3.2Å; L14-K17 VanDerWaalsContact O-N 3.08Å; L14-K17 VanDerWaalsContact O-O 3.13Å; L14-I19 HydrophobicContact CB-CD1 4.11Å; L14-I19 HydrophobicContact CD1-CD1 4.04Å
15F75.4Confident66.7Low200 Ų200110 Ų11088%0.87763%0.634SS**THydrogen-bonded Turntrans53.642.2176.8-51.9-77.5000114.5K17F15-K17 PolarHBondContact O-N 3.27Å; F15-K17 VanDerWaalsContact O-N 3.16Å
16G76.3Confident66.3Low79 Ų79110.4 Ų110.481%0.81465%0.645SS**THydrogen-bonded Turntrans71.24.7179.100000115L14L14-G16 VanDerWaalsContact C-N 3.32Å; L14-G16 PolarHBondContact O-N 3.29Å
17K74.7Confident66.3Low158 Ų158108.9 Ų108.969%0.68765%0.648SS**EExtended strand (participates in β ladder)trans-111.4131.5174.8-72.6166.7177.3162.80109.8K13 L14 F15 I19K13-K17 WeakPolarHBondContact CA-O 3.33Å; L14-K17 PolarHBondContact N-O 2.94Å; L14-K17 PolarHBondContact O-N 3.2Å; L14-K17 VanDerWaalsContact O-N 3.08Å; L14-K17 VanDerWaalsContact O-O 3.13Å; F15-K17 PolarHBondContact O-N 3.27Å; F15-K17 VanDerWaalsContact O-N 3.16Å; K17-I19 PolarHBondContact O-N 3.26Å
18V77.9Confident66.7Low84 Ų84107 Ų10751%0.50965%0.648SS.*EExtended strand (participates in β ladder)trans-76.9115.3172176.10000107.5K13 T20K13-V18 HydrophobicContact CD-CG2 4.13Å; K13-V18 VanDerWaalsContact CE-CG2 3.41Å; K13-V18 HydrophobicContact CG-CB 4.42Å; K13-V18 HydrophobicContact CG-CG2 3.59Å; V18-T20 PolarHBondContact O-N 2.93Å
19I70.9Confident67.1Low73 Ų73108.2 Ų108.237%0.37466%0.658SS.*EExtended strand (participates in β ladder)trans-92.494.9169.8-54.7177.5000106.1G11 F12 L14 K17 Q21G11-I19 CarbonylContact C-O 3.57Å; G11-I19 WeakPolarHBondContact CA-O 3.29Å; F12-I19 HydrophobicContact CE1-CB 4.24Å; F12-I19 HydrophobicContact CE1-CG2 4.06Å; F12-I19 HydrophobicContact CE2-CB 4.34Å; F12-I19 HydrophobicContact CE2-CD1 3.95Å; F12-I19 HydrophobicContact CZ-CB 4.13Å; F12-I19 HydrophobicContact CZ-CD1 4.22Å; F12-I19 HydrophobicContact CZ-CG2 3.95Å; F12-I19 PolarHBondContact N-O 3.32Å; F12-I19 PolarHBondContact O-N 3.41Å; L14-I19 HydrophobicContact CB-CD1 4.11Å; L14-I19 HydrophobicContact CD1-CD1 4.04Å; K17-I19 PolarHBondContact O-N 3.26Å; I19-Q21 PolarHBondContact O-N 3.06Å
20T76.4Confident67.5Low92 Ų92106.7 Ų106.756%0.56465%0.648SS**  trans-65.7117.9169-480000107.1V18 C22V18-T20 PolarHBondContact O-N 2.93Å; T20-C22 PolarHBondContact O-N 2.76Å; T20-C22 VanDerWaalsContact O-N 3.09Å
21Q67.6Low67.1Low143 Ų143110.4 Ų110.467%0.66866%0.662SS**  trans-63.8115.6169.9-76.9-176.4-9.800107.1F12 I19 A23F12-Q21 HydrophobicContact CD1-CG 4.17Å; F12-Q21 HydrophobicContact CE1-CG 3.83Å; I19-Q21 PolarHBondContact O-N 3.06Å; Q21-A23 PolarHBondContact O-N 2.83Å
22C59.6Low66.3Low127 Ų127117.8 Ų117.886%0.85869%0.69SS**  trans-59.4107.1167.9-61.60000106.8T20 E24T20-C22 PolarHBondContact O-N 2.76Å; T20-C22 VanDerWaalsContact O-N 3.09Å; C22-E24 PolarHBondContact O-N 3.19Å
23A55.9Low65.5Low91 Ų91119.2 Ų119.275%0.75271%0.714SS**  trans-54.3123.8165.800000107Q21 S25Q21-A23 PolarHBondContact O-N 2.83Å; A23-S25 VanDerWaalsContact C-N 3.28Å; A23-S25 PolarHBondContact O-N 2.83Å
24E54.1Low64.2Low191 Ų191116.7 Ų116.789%0.89372%0.721SS**  trans-49.694170-174.297.492.100108.1C22 A26C22-E24 PolarHBondContact O-N 3.19Å; E24-A26 PolarHBondContact O-N 3.03Å; E24-A26 VanDerWaalsContact O-N 3.14Å
25S53.1Low62.9Low108 Ų108116.7 Ų116.776%0.75573%0.732SS**  trans-70.9110.4174.454.60000106.7A23A23-S25 VanDerWaalsContact C-N 3.28Å; A23-S25 PolarHBondContact O-N 2.83Å
26A61.1Low61.6Low82 Ų82111 Ų11168%0.67872%0.722SS**  trans-42.2140174.100000111.4E24E24-A26 PolarHBondContact O-N 3.03Å; E24-A26 VanDerWaalsContact O-N 3.14Å
27P66.6Low60.3Low118 Ų118111.5 Ų111.577%0.76672%0.719SS**PPolyproline II helixtrans-59.2138-178.524.6-33.3000110.4A29P27-A29 PolarHBondContact O-N 2.75Å
28P63Low59.4Low127 Ų127108.5 Ų108.583%0.82572%0.717SS**PPolyproline II helixtrans-63.2128.8178.726-32.9000110
29A62.4Low58.2Low87 Ų87115.2 Ų115.272%0.71973%0.734SS**PPolyproline II helixtrans-58.2143.217400000110.8P27P27-A29 PolarHBondContact O-N 2.75Å
30P68Low57.1Low108 Ų108116 Ų11670%0.70175%0.751SS**PPolyproline II helixtrans-64.1139.1-179.125.5-33.2000111.6E32P30-E32 VanDerWaalsContact C-N 3.3Å; P30-E32 PolarHBondContact O-N 3.25Å
31P57.1Low56.1Low135 Ų135118.2 Ų118.288%0.87777%0.765SS**THydrogen-bonded Turntrans-79.374.9179.934.2-35.3000110.5
32E53Low55.1Low178 Ų178114.6 Ų114.683%0.83276%0.759SS**THydrogen-bonded Turntrans-133-8.8173.7-133.7-178.5122.600114.5P30P30-E32 VanDerWaalsContact C-N 3.3Å; P30-E32 PolarHBondContact O-N 3.25Å
33A51.4Low54.4Low96 Ų96118.3 Ų118.379%0.79376%0.761SS**SBendtrans-96.3-9.2-177.800000115.2
34A48.7Very low53.6Low95 Ų95118.4 Ų118.479%0.78576%0.762SS**SBendtrans-93.3-10.1-174.600000114.9
35A48.1Very low53.4Low78 Ų78120.2 Ų120.265%0.64576%0.76SS**SBendtrans-95.2-5.7-176.400000114.5
36A47.3Very low53.3Low81 Ų81122.2 Ų122.267%0.66976%0.758SS**SBendtrans-89.7-11.1-17700000114.2
37A49.8Very low53Low90 Ų90128.5 Ų128.574%0.74476%0.764SS**THydrogen-bonded Turntrans-82.5-9.7-175.200000114.7
38S55.2Low52Low94 Ų94130 Ų13066%0.65777%0.766SS**THydrogen-bonded Turntrans-1032.5-174.845.10000114.9
39R52.8Low51Low226 Ų226130.8 Ų130.885%0.85376%0.763SS**SBendtrans-102.87.8178.8-75-179.2135.3175.4-4.7114.5T41R39-T41 VanDerWaalsContact C-N 3.35Å; R39-T41 PolarHBondContact O-N 2.96Å
40A47.9Very low50.5Low90 Ų90131.6 Ų131.674%0.74476%0.761SS**THydrogen-bonded Turntrans-85.716.1-171.800000115.8
41T54.7Low49.7Very low138 Ų138133.3 Ų133.385%0.84776%0.764SS**THydrogen-bonded Turntrans-130.217.1-169.710.50000116.5R39R39-T41 VanDerWaalsContact C-N 3.35Å; R39-T41 PolarHBondContact O-N 2.96Å
42A46.8Very low49.3Very low67 Ų67134 Ų13455%0.55476%0.756SS**SBendtrans-137.8139.7172.700000109.9
43F44.9Very low49.2Very low205 Ų205134.5 Ų134.590%0.89975%0.75SS**  trans86.653.1-179.9-43.4-68000115.9
44A39Very low49.1Very low92 Ų92136.9 Ų136.976%0.7675%0.749SS**  trans-78150.9145.100000109.3
45R50.9Low48.7Very low229 Ų229141 Ų14186%0.86475%0.752SS**  trans89.9120.3-174.6-51.8-170.4128.1849.9111.4
46E50.9Low48.7Very low150 Ų150142.5 Ų142.570%0.70176%0.756SS**  cis-174.1136.435.1-170.2151.19800109.8
47R53.7Low48.3Very low215 Ų215146.6 Ų146.681%0.81176%0.763SS**  trans57.1147.3143.8-70.1166.1117.3-116.7-3.6119.7
48D46.6Very low48.5Very low150 Ų150149.1 Ų149.180%0.80277%0.768SS**  cis-177.1134.1-10.6-162.8-128.5000102.5
49D42.6Very low48.1Very low143 Ų143153.1 Ų153.177%0.76577%0.774SS**  trans-65.6-174.4171.1-118.1-81000110.8
50P51.2Low48.1Very low103 Ų103153 Ų15367%0.66977%0.774SS**  cis-131-179.1-20.927.9-5.2000111.3
51D51.3Low48.2Very low144 Ų144155.5 Ų155.577%0.7777%0.77SS**  164.4157.1122.8-143.3-93.9000112.1
52E48.4Very low47.3Very low151 Ų151154 Ų15471%0.70677%0.771SS**  trans-95.8170.8-157.2-152.2-151.7112.700111.7
53R50.4Low47.4Very low188 Ų188155.4 Ų155.471%0.70978%0.783SS**  trans77.9109.1165.7-47.7-165.4-52.8-82.7-5.7117.1
54D49.3Very low47.2Very low146 Ų146149.9 Ų149.978%0.78178%0.775SS**  174.5118.799.3-143.4-105.2000108.2
55Q40.9Very low48Very low180 Ų180151.5 Ų151.584%0.84178%0.781SS**  trans-95.6148.1164.8-74.2-148.242.700109.1
56P47.4Very low47.9Very low111 Ų111147.4 Ų147.472%0.72178%0.777SS**  -142.1125.1122.529.9-12.4000115
57M40.1Very low48.3Very low166 Ų166149.6 Ų149.682%0.81879%0.786SS**  33.4110.5123.5-166.2163.677.400119.8
58V54.2Low48Very low143 Ų143146.3 Ų146.387%0.86779%0.785SS**  trans-15795.1142.9-79.20000108.9
59K47.1Very low47.8Very low178 Ų178147.8 Ų147.877%0.77479%0.785SS**  59.4102.192.2-168.2154.7-178.9174.60116.2
60R51.7Low48.1Very low224 Ų224143.8 Ų143.885%0.84577%0.771SS**  trans-16798.9140.9-151.6154.2-171.9156.51.6110.2
61E50.3Low47.5Very low142 Ų142143.7 Ų143.766%0.66478%0.779SS**  57.7102.496.2-62178.4125.800112.7
62A36.6Very low47.6Very low106 Ų106142.6 Ų142.688%0.87678%0.777SS**  79.6101.256.800000115
63A47.6Very low47.3Very low97 Ų97141.6 Ų141.680%0.80278%0.777SS**  trans-165.294.9153.300000106.3
64A41.4Very low47.6Very low89 Ų89141.4 Ų141.474%0.73678%0.781SS**  55.8104.66900000113.1
65S55.1Low47.5Very low126 Ų126140.8 Ų140.888%0.88177%0.773SS**  trans-168.395148.4-74.20000109.7
66D50.2Low47.9Very low144 Ų144140.2 Ų140.277%0.7777%0.77SS**  trans-58.5147160.6-65.5-88.1000112.1
67H58.7Low47.9Very low195 Ų195142 Ų14290%0.90377%0.769SS**  trans-145.597.5151.4-104.3-63.4000111
68D46.5Very low48.4Very low146 Ų146142.3 Ų142.378%0.78177%0.768SS**  trans-62.9137159.1-133.3-70.2000110.8
69F43.7Very low48.3Very low182 Ų182141 Ų14180%0.79877%0.765SS**  trans-156.888.8151.3-167.1-100000111.8
70A47.6Very low47.9Very low59 Ų59136.5 Ų136.549%0.48877%0.769SS.*  32.9114.5123.700000120.1
71A38.3Very low47.2Very low100 Ų100129.4 Ų129.483%0.82677%0.766SS**  trans3.3123.4135.200000118.6
72V54Low47Very low122 Ų122128.7 Ų128.774%0.73978%0.777SS**  trans-138.5105.5144.3177.10000109.2
73D43.3Very low47.4Very low129 Ų129127.5 Ų127.569%0.6977%0.774SS**  trans-59.7130.8158.1-169.4-78.1000109.8H75D73-H75 IonicContact OD1-CD2 3.94Å; D73-H75 PolarHBondContact OD1-CD2 3.19Å
74K54.8Low47.1Very low184 Ų184126.3 Ų126.380%0.877%0.772SS**  trans-153.4101159.8-142172.3178.91790111.9
75H48.4Very low47.5Very low133 Ų133128.6 Ų128.662%0.61678%0.779SS**  trans-37.9131157.7-79.7-126.9000113D73D73-H75 IonicContact OD1-CD2 3.94Å; D73-H75 PolarHBondContact OD1-CD2 3.19Å
76H49.4Very low47Very low168 Ų168126 Ų12678%0.77877%0.772SS**  trans-138.487.6150.4-105.862.7000108.6
77Q46.5Very low47.3Very low150 Ų150125.4 Ų125.470%0.70178%0.776SS**  trans-70136149.2-60.6176.623.200106.6
78H50.5Low46.7Very low172 Ų172119.1 Ų119.180%0.79676%0.764SS**  trans-176.8127.9145-94.2-67.4000110.6
79S53.2Low46.9Very low114 Ų114118.8 Ų118.880%0.79777%0.77SS**  trans58116.7153.353.80000117.9
80G38Very low47.2Very low84 Ų84117 Ų11787%0.86677%0.769SS**  cis94.1108.647.500000108
81G37.8Very low47.2Very low75 Ų75123.4 Ų123.477%0.77379%0.788SS**  trans17577.5-179.100000113.7
82S46.4Very low48Very low128 Ų128124.3 Ų124.390%0.89579%0.789SS**  trans-34.9141.5163.245.50000116.1
83G43.5Very low48.2Very low80 Ų80125.5 Ų125.583%0.82579%0.791SS**  trans17081.5160.700000113.7
84G42.4Very low48.8Very low73 Ų73125.4 Ų125.475%0.75379%0.79SS**  trans-106.2-167.4154.700000109.7
85P50.1Low48.9Very low136 Ų136121.7 Ų121.788%0.88379%0.787SS**  cis-124.8-176-31.330.1-9000111.2
86G43.8Very low49.1Very low71 Ų71125.5 Ų125.573%0.73280%0.802SS**  trans-70.8-170-173.800000117.4
87P56.5Low48.9Very low133 Ų133120.6 Ų120.686%0.86480%0.797SS**  -134.4146.9124.830.2-13.9000110.4
88G45.6Very low49.1Very low62 Ų62122.6 Ų122.664%0.63981%0.806SS**  91.5114.360.800000108.3
89P51.7Low49Very low139 Ų139123.2 Ų123.290%0.90381%0.809SS**  trans-92.2132.3-171.534.5-29.2000111.7
90D48.6Very low48.9Very low146 Ų146127 Ų12778%0.78182%0.815SS**  trans-131.5116.3166.568.8-72.8000109.5
91E49Very low49.4Very low193 Ų193130.6 Ų130.690%0.90281%0.809SS**  trans-161.6104.1142.4-133.6174.877.800107.5
92S54.6Low49.9Very low119 Ų119134.5 Ų134.583%0.83281%0.807SS**  trans-109.3116.3164.7-54.30000105.2
93D57.6Low50.1Low147 Ų147136.2 Ų136.279%0.78680%0.801SS**  trans-156.9132158.8-151.4-114000112
94D55.9Low50.5Low126 Ų126141.6 Ų141.667%0.67480%0.804SS**  trans43.2106.3158.2-92.4-115.4000121.3
95S57.6Low51.2Low106 Ų106144 Ų14474%0.74181%0.806SS**  63.3123.674.5-67.80000116.1
96K52.9Low51.5Low214 Ų214148.6 Ų148.693%0.9381%0.806SS**  trans84102.7147.6-157179.1-176.2-171.10117.8
97G44Very low52.2Low64 Ų64150.1 Ų150.166%0.6680%0.803SS**  trans16589153.900000117.3
98Q51.1Low52.1Low193 Ų193153 Ų15390%0.90280%0.796SS**  trans73.4110142.7-61.917977.400118.9Q100Q98-Q100 PolarHBondContact O-N 2.93Å
99Q48.4Very low52.6Low184 Ų184156.6 Ų156.686%0.8680%0.796SS**  trans-49.4122.1156.5-67.6164.212.200110.9
100Q50.9Low52.8Low195 Ų195158.1 Ų158.191%0.91179%0.791SS**  trans-142.4118.9145.2-116.4167.348.300109.1Q98Q98-Q100 PolarHBondContact O-N 2.93Å
101Q49.8Very low53.2Low158 Ų158157.3 Ų157.374%0.73878%0.783SS**  trans-67.6146.8-178.1-56.7164.921.700109.2
102Q48.3Very low53.4Low158 Ų158154.3 Ų154.374%0.73877%0.768SS**  trans133.9116.3136.4-68.6171.872.400114.3
103H49.1Very low53.5Low164 Ų164154.1 Ų154.176%0.75975%0.754SS**  trans76.383.6163-53.4-71.3000119.4P105H103-P105 WeakPolarHBondContact O-CD 3.39Å
104H52.1Low53.6Low193 Ų193152.9 Ų152.989%0.89474%0.743SS**PPolyproline II helixtrans-79.5116.9157.4-69.578.2000110
105P58.1Low53.7Low122 Ų122152.8 Ų152.879%0.79274%0.739SS**PPolyproline II helixtrans-71.2134.3165.129-30.1000109.3H103H103-P105 WeakPolarHBondContact O-CD 3.39Å
106R56.9Low53.8Low233 Ų233153.2 Ų153.288%0.87973%0.729SS**PPolyproline II helixtrans-52.9142.1-177.1-61.4172.185.2-164.97.3111.3R108R106-R108 PolarHBondContact O-N 3.48Å
107P58.2Low54Low103 Ų103147.9 Ų147.967%0.66971%0.707SS**PPolyproline II helixtrans-67.6123.3-177.4-8.722.4000110.7H109P107-H109 HydrophobicContact CB-CB 4.48Å; P107-H109 PolarHBondContact O-N 2.96Å
108R53.1Low54.7Low195 Ų195149.5 Ų149.574%0.73670%0.698SS**  trans-71.741.8169.4-78-158.9161.7-166.4-1112.6R106 H110R106-R108 PolarHBondContact O-N 3.48Å; R108-H110 PolarHBondContact O-N 2.89Å
109H57.1Low55.2Low137 Ų137144 Ų14463%0.63467%0.674SS**Hα-helixtrans-69.4-14.9-179-101.7-82.4000114P107P107-H109 HydrophobicContact CB-CB 4.48Å; P107-H109 PolarHBondContact O-N 2.96Å
110H56.1Low56Low170 Ų170139 Ų13979%0.78766%0.657SS**Hα-helixtrans-80.4-23.7-179-72.874.6000113.7R108R108-H110 PolarHBondContact O-N 2.89Å
111Q55.6Low56.7Low130 Ų130134.1 Ų134.161%0.60764%0.64SS**Hα-helixtrans-80.5-35.8-176.9-151.1174.462.300111.8H113 H114 Q115Q111-H113 VanDerWaalsContact C-N 3.34Å; Q111-H113 PolarHBondContact O-N 2.91Å; Q111-H114 PolarHBondContact O-N 3.35Å; Q111-Q115 PolarHBondContact O-N 3.17Å
112H53.6Low57.2Low130 Ų130130.7 Ų130.760%0.60262%0.624SS**Hα-helixtrans-66.5-34176-83.5-110000113H114 Q115 Q116H112-H114 VanDerWaalsContact C-N 3.3Å; H112-H114 PolarHBondContact O-N 3.46Å; H112-Q115 PolarHBondContact O-N 3.21Å; H112-Q116 PolarHBondContact O-N 3.18Å; H112-Q116 VanDerWaalsContact O-N 3.1Å
113H58.1Low57.8Low114 Ų114125.2 Ų125.253%0.52861%0.606SS.*Hα-helixtrans-66.2-31.7179.1-111.1-78.3000112.9Q111 Q117Q111-H113 VanDerWaalsContact C-N 3.34Å; Q111-H113 PolarHBondContact O-N 2.91Å; H113-Q117 WeakPolarHBondContact O-CB 3.46Å; H113-Q117 WeakPolarHBondContact O-CG 3.4Å; H113-Q117 PolarHBondContact O-N 3.4Å; H113-Q117 PolarHBondContact O-NE2 2.9Å
114H58Low58.3Low122 Ų122126.8 Ų126.857%0.56561%0.605SS**Hα-helixtrans-77-38.4-179.8-135.175.7000111.8Q111 H112 Q117 Q118Q111-H114 PolarHBondContact O-N 3.35Å; H112-H114 VanDerWaalsContact C-N 3.3Å; H112-H114 PolarHBondContact O-N 3.46Å; H114-Q117 PolarHBondContact O-N 2.9Å; H114-Q118 WeakPolarHBondContact O-CG 3.18Å; H114-Q118 PolarHBondContact O-N 3.16Å
115Q59.2Low58.7Low124 Ų124120.6 Ų120.658%0.57959%0.588SS**Hα-helixtrans-65.6-45.7176-154.695.584.500111.3Q111 H112 Q117 Q118 D119Q111-Q115 PolarHBondContact O-N 3.17Å; H112-Q115 PolarHBondContact O-N 3.21Å; Q115-Q117 VanDerWaalsContact C-N 3.29Å; Q115-Q117 PolarHBondContact O-N 3.18Å; Q115-Q118 PolarHBondContact O-N 3.31Å; Q115-D119 PolarHBondContact O-N 3.36Å; Q115-D119 VanDerWaalsContact O-N 3.12Å
116Q58.4Low58.7Low115 Ų115116.7 Ų116.754%0.53757%0.566SS.*Hα-helixtrans-62.8-34.6176.7-77.3178.25.300112.9H112 D119 T120H112-Q116 PolarHBondContact O-N 3.18Å; H112-Q116 VanDerWaalsContact O-N 3.1Å; Q116-D119 PolarHBondContact O-N 2.9Å; Q116-T120 WeakPolarHBondContact O-CG2 3.46Å; Q116-T120 PolarHBondContact O-N 3.01Å
117Q58.7Low58.5Low101 Ų101108.5 Ų108.547%0.47255%0.547SS..Hα-helixtrans-66.7-40.1176.5-78.9170.663.400111.9H113 H114 Q115 T120 V121H113-Q117 WeakPolarHBondContact O-CB 3.46Å; H113-Q117 WeakPolarHBondContact O-CG 3.4Å; H113-Q117 PolarHBondContact O-N 3.4Å; H113-Q117 PolarHBondContact O-NE2 2.9Å; H114-Q117 PolarHBondContact O-N 2.9Å; Q115-Q117 VanDerWaalsContact C-N 3.29Å; Q115-Q117 PolarHBondContact O-N 3.18Å; Q117-T120 PolarHBondContact O-N 3.16Å; Q117-T120 PolarHBondContact O-OG1 2.7Å; Q117-V121 PolarHBondContact O-N 2.94Å
118Q58.8Low58.4Low99 Ų99106.9 Ų106.946%0.46354%0.543SS..Hα-helixtrans-63.1-42.6175.3-69.8174.4-800111.8H114 Q115 T120 V121 E122H114-Q118 WeakPolarHBondContact O-CG 3.18Å; H114-Q118 PolarHBondContact O-N 3.16Å; Q115-Q118 PolarHBondContact O-N 3.31Å; Q118-T120 PolarHBondContact O-N 3.42Å; Q118-V121 WeakPolarHBondContact O-CG2 3.23Å; Q118-V121 PolarHBondContact O-N 3.05Å; Q118-E122 PolarHBondContact O-N 3.08Å
119D61.4Low58.5Low77 Ų77100.5 Ų100.541%0.41253%0.532SS..Hα-helixtrans-61.2-34.2176.3-65.4-41.1000112.1Q115 Q116 A123Q115-D119 PolarHBondContact O-N 3.36Å; Q115-D119 VanDerWaalsContact O-N 3.12Å; Q116-D119 PolarHBondContact O-N 2.9Å; D119-A123 WeakPolarHBondContact O-CB 3.01Å; D119-A123 PolarHBondContact O-N 3.27Å
120T63.6Low58.5Low79 Ų7999 Ų9949%0.48554%0.536SS..Hα-helixtrans-75.5-34.3-179.558.80000114.8Q116 Q117 Q118 R124Q116-T120 WeakPolarHBondContact O-CG2 3.46Å; Q116-T120 PolarHBondContact O-N 3.01Å; Q117-T120 PolarHBondContact O-N 3.16Å; Q117-T120 PolarHBondContact O-OG1 2.7Å; Q118-T120 PolarHBondContact O-N 3.42Å; T120-R124 WeakPolarHBondContact O-CG 3.4Å; T120-R124 PolarHBondContact O-N 3.44Å; T120-R124 VanDerWaalsContact O-N 3.08Å
121V66.1Low58.5Low93 Ų9396.1 Ų96.156%0.56454%0.536SS*.Hα-helixtrans-71.9-37.5176.9-67.60000111.1Q117 Q118 R124 A125Q117-V121 PolarHBondContact O-N 2.94Å; Q118-V121 WeakPolarHBondContact O-CG2 3.23Å; Q118-V121 PolarHBondContact O-N 3.05Å; V121-R124 PolarHBondContact O-N 2.9Å; V121-A125 PolarHBondContact O-N 2.78Å
122E61.3Low58.9Low85 Ų8592.7 Ų92.740%0.39753%0.53SS..Hα-helixtrans-74.2-36.1179.3-146.3139.210800111.2Q118 R124 A125 A126 N156Q118-E122 PolarHBondContact O-N 3.08Å; E122-R124 VanDerWaalsContact C-N 3.34Å; E122-R124 PolarHBondContact O-N 2.87Å; E122-A125 PolarHBondContact O-N 2.93Å; E122-A126 PolarHBondContact O-N 3.37Å; E122-N156 VanDerWaalsContact CG-OD1 3.26Å; E122-N156 WeakPolarHBondContact CG-OD1 3.19Å; E122-N156 PolarHBondContact OE1-ND2 3.46Å; E122-N156 PolarHBondContact OE1-OD1 3.06Å
123A59.6Low59.8Low44 Ų4491.8 Ų91.836%0.36454%0.536SS..Hα-helixtrans-63.8-35169.700000112.9D119 A126 A127D119-A123 WeakPolarHBondContact O-CB 3.01Å; D119-A123 PolarHBondContact O-N 3.27Å; A123-A126 PolarHBondContact O-N 2.81Å; A123-A127 WeakPolarHBondContact O-CB 3.34Å; A123-A127 PolarHBondContact O-N 2.82Å
124R60.8Low60.5Low196 Ų19689.8 Ų89.874%0.7453%0.533SS*.Hα-helixtrans-70.1-37.4173.4-80.1178.5176.2-175.90.3112.3T120 V121 E122 A126 A127 A128T120-R124 WeakPolarHBondContact O-CG 3.4Å; T120-R124 PolarHBondContact O-N 3.44Å; T120-R124 VanDerWaalsContact O-N 3.08Å; V121-R124 PolarHBondContact O-N 2.9Å; E122-R124 VanDerWaalsContact C-N 3.34Å; E122-R124 PolarHBondContact O-N 2.87Å; R124-A126 VanDerWaalsContact C-N 3.32Å; R124-A127 WeakPolarHBondContact O-CB 3.25Å; R124-A127 PolarHBondContact O-N 3.24Å; R124-A128 PolarHBondContact O-N 3.06Å
125A59.3Low61.6Low64 Ų6488.6 Ų88.653%0.52953%0.53SS..Hα-helixtrans-63.9-39.5172.300000111.5V121 E122 A127 A128 A129V121-A125 PolarHBondContact O-N 2.78Å; E122-A125 PolarHBondContact O-N 2.93Å; A125-A127 VanDerWaalsContact C-N 3.33Å; A125-A127 PolarHBondContact O-N 3.07Å; A125-A128 PolarHBondContact O-N 3.43Å; A125-A129 PolarHBondContact O-N 3.02Å
126A57.9Low63Low40 Ų4086.2 Ų86.233%0.33153%0.525SS..Hα-helixtrans-67.3-31.8172.700000113.1E122 A123 R124 A129 F150E122-A126 PolarHBondContact O-N 3.37Å; A123-A126 PolarHBondContact O-N 2.81Å; R124-A126 VanDerWaalsContact C-N 3.32Å; A126-A129 PolarHBondContact O-N 3.48Å; A126-F150 HydrophobicContact CB-CE1 3.9Å; A126-F150 HydrophobicContact CB-CZ 3.63Å
127A54.3Low64.5Low60 Ų6080.8 Ų80.850%0.49650%0.5SS..Hα-helixtrans-70.8-36.6172.600000112A123 R124 A125 A129 S130A123-A127 WeakPolarHBondContact O-CB 3.34Å; A123-A127 PolarHBondContact O-N 2.82Å; R124-A127 WeakPolarHBondContact O-CB 3.25Å; R124-A127 PolarHBondContact O-N 3.24Å; A125-A127 VanDerWaalsContact C-N 3.33Å; A125-A127 PolarHBondContact O-N 3.07Å; A127-A129 PolarHBondContact O-N 3.02Å; A127-S130 VanDerWaalsContact O-CB 3.28Å; A127-S130 WeakPolarHBondContact O-CB 3.35Å; A127-S130 PolarHBondContact O-N 3.48Å; A127-S130 PolarHBondContact O-OG 3.47Å
128A54.7Low65.9Low70 Ų7078.7 Ų78.758%0.57950%0.495SS*.Hα-helixtrans-64.4-27.5173.900000112.5R124 A125 S130 S131R124-A128 PolarHBondContact O-N 3.06Å; A125-A128 PolarHBondContact O-N 3.43Å; A128-S130 PolarHBondContact O-N 3.37Å; A128-S131 PolarHBondContact O-OG 2.87Å
129A55.7Low67.2Low61 Ų6175.8 Ų75.850%0.50448%0.48SS..G310 helixtrans-71.6-6.9173.300000113.9A125 A126 A127 S131 A132A125-A129 PolarHBondContact O-N 3.02Å; A126-A129 PolarHBondContact O-N 3.48Å; A127-A129 PolarHBondContact O-N 3.02Å; A129-S131 PolarHBondContact O-N 2.85Å; A129-A132 WeakPolarHBondContact O-CB 3.34Å; A129-A132 PolarHBondContact O-N 2.78Å
130S57.4Low68.5Low104 Ų10474.7 Ų74.773%0.72748%0.478SS*.G310 helixtrans-73.6-11.1179.778.30000114.2A127 A128A127-S130 VanDerWaalsContact O-CB 3.28Å; A127-S130 WeakPolarHBondContact O-CB 3.35Å; A127-S130 PolarHBondContact O-N 3.48Å; A127-S130 PolarHBondContact O-OG 3.47Å; A128-S130 PolarHBondContact O-N 3.37Å
131S56.8Low69.7Low111 Ų11180.6 Ų80.678%0.77649%0.491SS*.G310 helixtrans-90.5-6.9172.561.70000113.1A128 A129A128-S131 PolarHBondContact O-OG 2.87Å; A129-S131 PolarHBondContact O-N 2.85Å
132A64Low70.8Confident58 Ų5876.8 Ų76.848%0.47947%0.469SS..SBendtrans-70.2142.5171.600000109.7A129A129-A132 WeakPolarHBondContact O-CB 3.34Å; A129-A132 PolarHBondContact O-N 2.78Å
133P71.3Confident72.3Confident111 Ų11182.3 Ų82.372%0.72149%0.486SS*.PPolyproline II helixtrans-52.8132.2176.221.6-32.3000109.8L135P133-L135 PolarHBondContact O-N 3.32Å; P133-L135 VanDerWaalsContact O-N 3.1Å
134P73.1Confident73.8Confident72 Ų7284.4 Ų84.447%0.46849%0.491SS..PPolyproline II helixtrans-60.4120.9-173.923.8-33.4000109.4
135L81Confident75.3Confident97 Ų9776.1 Ų76.151%0.50846%0.462SS..PPolyproline II helixtrans-57.1133.1178.8-70.5169.8000109.7P133 T145 W169 A171P133-L135 PolarHBondContact O-N 3.32Å; P133-L135 VanDerWaalsContact O-N 3.1Å; L135-T145 PolarHBondContact O-OG1 3.06Å; L135-W169 HydrophobicContact CB-CH2 3.75Å; L135-W169 HydrophobicContact CB-CZ3 4.39Å; L135-W169 HydrophobicContact CD1-CH2 4.48Å; L135-A171 HydrophobicContact CD1-CB 3.54Å
136P88.7Confident76.9Confident73 Ų7379.7 Ų79.747%0.47447%0.466SS..PPolyproline II helixtrans-66142.2-177.927.3-34000110.2P138 S142P136-P138 WeakPolarHBondContact O-CD 3.46Å; P136-S142 WeakPolarHBondContact CA-O 2.85Å
137C90.3Very high78.6Confident1 Ų182 Ų821%0.00747%0.469CS..PPolyproline II helixtrans-60.6124.2176.4-179.90000110R139 C140 R141 S142 T145 C162C137-R139 PolarHBondContact O-N 3.28Å; C137-C140 PolarHBondContact O-N 3.43Å; C137-R141 WeakPolarHBondContact O-CA 3.4Å; C137-R141 PolarHBondContact O-N 3.08Å; C137-S142 WeakPolarHBondContact CB-OG 3.36Å; C137-S142 PolarHBondContact N-O 3.16Å; C137-T145 HydrophobicContact CB-CG2 3.76Å; C137-C162 HydrophobicContact CB-CB 3.95Å; C137-C162 VanDerWaalsContact SG-CB 3.58Å; C137-C162 VanDerWaalsContact SG-SG 3.67Å
138P88.2Confident80.4Confident58 Ų5882 Ų8238%0.37746%0.464SS..THydrogen-bonded Turntrans-66.3-13.4-177.525.9-35.3000113.7P136 W169 L175P136-P138 WeakPolarHBondContact O-CD 3.46Å; P138-W169 HydrophobicContact CG-CB 4.37Å; P138-W169 HydrophobicContact CG-CG 4.46Å; P138-L175 HydrophobicContact CB-CD2 4.11Å; P138-L175 HydrophobicContact CG-CD1 4.15Å; P138-L175 HydrophobicContact CG-CD2 4.35Å
139R85.6Confident82.3Confident38 Ų3883.5 Ų83.514%0.14346%0.456CS..THydrogen-bonded Turntrans-89.9-37.5-177.2-57.1-175.8179.8170.34113.6C137 Y168 V178C137-R139 PolarHBondContact O-N 3.28Å; R139-Y168 PolarHBondContact NH2-O 2.9Å; R139-V178 HydrophobicContact CG-CG1 3.95Å
140C88.9Confident84.1Confident54 Ų5483.9 Ų83.937%0.36545%0.446SS..THydrogen-bonded Turntrans-1332.1-173.361.60000113.8C137 S142 C165C137-C140 PolarHBondContact O-N 3.43Å; C140-S142 PolarHBondContact O-N 2.78Å; C140-S142 VanDerWaalsContact O-N 3.07Å; C140-S142 PolarHBondContact SG-OG 3.02Å; C140-C165 HydrophobicContact CB-CB 4.2Å; C140-C165 VanDerWaalsContact SG-SG 3.65Å
141R88.7Confident85.6Confident203 Ų20379.7 Ų79.777%0.76642%0.415SS*.  trans59.712.8-179.1-55.2177.2-176.9169.3-0.5114.9C137C137-R141 WeakPolarHBondContact O-CA 3.4Å; C137-R141 PolarHBondContact O-N 3.08Å
142S89.9Confident87.1Confident13 Ų1381.7 Ų81.79%0.09142%0.417CS..  trans-66.1143.1175.164.10000112.5P136 C137 C140 N144 C162 D164P136-S142 WeakPolarHBondContact CA-O 2.85Å; C137-S142 WeakPolarHBondContact CB-OG 3.36Å; C137-S142 PolarHBondContact N-O 3.16Å; C140-S142 PolarHBondContact O-N 2.78Å; C140-S142 VanDerWaalsContact O-N 3.07Å; C140-S142 PolarHBondContact SG-OG 3.02Å; S142-N144 VanDerWaalsContact C-N 3.31Å; S142-C162 PolarHBondContact OG-SG 3.4Å; S142-D164 WeakPolarHBondContact CB-OD2 3.35Å
143R92.4Very high88.2Confident200 Ų20089 Ų8976%0.75543%0.434SS*.SBendtrans-84.7-2.5168.3-64.9-177.7177.2129.3-2.3113.7T145R143-T145 PolarHBondContact O-N 2.94Å
144N91.7Very high88.7Confident89 Ų8987.2 Ų87.248%0.47642%0.418SS..  trans-81.759.1178.6-60.1-46.9000112.1S142 K163 D164S142-N144 VanDerWaalsContact C-N 3.31Å; N144-K163 HydrophobicContact CB-CB 4.06Å; N144-K163 HydrophobicContact CB-CD 4.34Å; N144-K163 PolarHBondContact O-N 3.4Å; N144-D164 WeakPolarHBondContact CB-OD2 3.16Å; N144-D164 PolarHBondContact ND2-OD2 3.47Å
145T92.4Very high89.4Confident21 Ų2187 Ų8713%0.12942%0.415CS..EExtended strand (participates in β ladder)trans-108139.7176.360.90000109.9L135 C137 R143 F161 C162 W169L135-T145 PolarHBondContact O-OG1 3.06Å; C137-T145 HydrophobicContact CB-CG2 3.76Å; R143-T145 PolarHBondContact O-N 2.94Å; T145-F161 CarbonylContact C-O 3.49Å; T145-F161 WeakPolarHBondContact CA-O 3.21Å; T145-C162 HydrophobicContact CG2-CB 4.2Å; T145-W169 HydrophobicContact CG2-CZ2 3.67Å
146K92.9Very high89.7Confident140 Ų14087 Ų8761%0.60942%0.416SS*.EExtended strand (participates in β ladder)trans-128.7136.5178.2-167.9-170.5172.2177.70109.5C148 H160 F161K146-C148 PolarHBondContact O-N 3.25Å; K146-H160 CarbonylContact O-C 3.19Å; K146-H160 VanDerWaalsContact O-CA 3.27Å; K146-H160 WeakPolarHBondContact O-CA 3.41Å; K146-F161 PolarHBondContact N-O 3.24Å; K146-F161 PolarHBondContact O-N 3.27Å
147F92.2Very high89.7Confident89 Ų8986.3 Ų86.339%0.3941%0.407SS..EExtended strand (participates in β ladder)trans-56.7134.5165.5175.2-98.5000110.4F150 P158F147-F150 HydrophobicContact CE1-CE2 4.31Å; F147-F150 HydrophobicContact CE2-CD1 4.05Å; F147-F150 HydrophobicContact CE2-CD2 4.43Å; F147-F150 AromaticContact CE2-CE1 3.86Å; F147-F150 HydrophobicContact CE2-CE1 3.86Å; F147-F150 HydrophobicContact CE2-CE2 4.23Å; F147-F150 HydrophobicContact CE2-CG 4.35Å; F147-F150 AromaticContact CE2-CZ 3.94Å; F147-F150 HydrophobicContact CE2-CZ 3.94Å; F147-F150 HydrophobicContact CZ-CD1 4.14Å; F147-F150 AromaticContact CZ-CD2 3.71Å; F147-F150 HydrophobicContact CZ-CD2 3.71Å; F147-F150 AromaticContact CZ-CE1 3.98Å; F147-F150 HydrophobicContact CZ-CE1 3.98Å; F147-F150 AromaticContact CZ-CE2 3.5Å; F147-F150 HydrophobicContact CZ-CE2 3.5Å; F147-F150 HydrophobicContact CZ-CG 4.02Å; F147-F150 AromaticContact CZ-CZ 3.65Å; F147-F150 HydrophobicContact CZ-CZ 3.65Å; F147-P158 HydrophobicContact CD2-CB 3.84Å; F147-P158 HydrophobicContact CE2-CB 3.56Å
148C93.2Very high89.7Confident60 Ų6087.8 Ų87.841%0.40542%0.416SS..EExtended strand (participates in β ladder)trans-113.6-57.1-176.8-163.10000112.1K146 R159 F161 Y168K146-C148 PolarHBondContact O-N 3.25Å; C148-R159 PolarHBondContact N-O 3.28Å; C148-F161 HydrophobicContact CB-CB 4.45Å; C148-Y168 HydrophobicContact CB-CE1 4.28Å
149Y94.8Very high89.9Confident101 Ų10186.8 Ų86.840%0.39640%0.404SS..EExtended strand (participates in β ladder)trans-166.5163.5179.462.6-78.9000110R159 Y168Y149-R159 HydrophobicContact CE1-CB 4.49Å; Y149-R159 VanDerWaalsContact CE2-CD 3.42Å; Y149-R159 WeakPolarHBondContact O-CB 3.28Å; Y149-R159 PolarHBondContact O-N 3.1Å; Y149-R159 WeakPolarHBondContact OH-CD 3.19Å; Y149-Y168 HydrophobicContact CE1-CE1 4.42Å
150F93.2Very high90.3Very high69 Ų6986.6 Ų86.630%0.30341%0.405SS..EExtended strand (participates in β ladder)trans-81.8152172.1-66.1-73.8000111.4A126 F147 V155 P158A126-F150 HydrophobicContact CB-CE1 3.9Å; A126-F150 HydrophobicContact CB-CZ 3.63Å; F147-F150 HydrophobicContact CE1-CE2 4.31Å; F147-F150 HydrophobicContact CE2-CD1 4.05Å; F147-F150 HydrophobicContact CE2-CD2 4.43Å; F147-F150 AromaticContact CE2-CE1 3.86Å; F147-F150 HydrophobicContact CE2-CE1 3.86Å; F147-F150 HydrophobicContact CE2-CE2 4.23Å; F147-F150 HydrophobicContact CE2-CG 4.35Å; F147-F150 AromaticContact CE2-CZ 3.94Å; F147-F150 HydrophobicContact CE2-CZ 3.94Å; F147-F150 HydrophobicContact CZ-CD1 4.14Å; F147-F150 AromaticContact CZ-CD2 3.71Å; F147-F150 HydrophobicContact CZ-CD2 3.71Å; F147-F150 AromaticContact CZ-CE1 3.98Å; F147-F150 HydrophobicContact CZ-CE1 3.98Å; F147-F150 AromaticContact CZ-CE2 3.5Å; F147-F150 HydrophobicContact CZ-CE2 3.5Å; F147-F150 HydrophobicContact CZ-CG 4.02Å; F147-F150 AromaticContact CZ-CZ 3.65Å; F147-F150 HydrophobicContact CZ-CZ 3.65Å; F150-V155 WeakPolarHBondContact CD1-O 3.34Å; F150-P158 HydrophobicContact CD1-CB 4.07Å; F150-P158 HydrophobicContact CE1-CB 3.97Å
151N89.1Confident90.5Very high15 Ų1586.8 Ų86.88%0.0840%0.4CS..EExtended strand (participates in β ladder)trans-73.9134.8176.8-169.520.4000110.9Y153 N154 Q157 R159N151-Y153 PolarHBondContact O-N 3.29Å; N151-Y153 VanDerWaalsContact O-N 3.16Å; N151-N154 CarbonylContact O-C 3.58Å; N151-N154 PolarHBondContact O-N 3.03Å; N151-N154 VanDerWaalsContact O-N 3.08Å; N151-Q157 HydrophobicContact CB-CB 4.07Å; N151-Q157 PolarHBondContact N-O 2.89Å; N151-Q157 PolarHBondContact ND2-OE1 3.03Å; N151-R159 VanDerWaalsContact CG-NH2 3.3Å; N151-R159 PolarHBondContact ND2-NH2 2.94Å; N151-R159 PolarHBondContact OD1-NH2 2.96Å
152N87Confident90.7Very high154 Ų15477.1 Ų77.182%0.82436%0.363SS*.THydrogen-bonded Turntrans-63.1-24.3-179.9-62.8-32.8000113.5
153Y86.9Confident90.8Very high212 Ų21282.2 Ų82.283%0.83138%0.384SS*.THydrogen-bonded Turntrans-84.4-21.5178.4-57.6-76.3000113.1N151N151-Y153 PolarHBondContact O-N 3.29Å; N151-Y153 VanDerWaalsContact O-N 3.16Å
154N83Confident90.7Very high73 Ų7375.4 Ų75.439%0.3936%0.363SS..EExtended strand (participates in β ladder)trans-158.8111.5-177.7-174.5-9.5000110N151 N156 Q157N151-N154 CarbonylContact O-C 3.58Å; N151-N154 PolarHBondContact O-N 3.03Å; N151-N154 VanDerWaalsContact O-N 3.08Å; N154-N156 PolarHBondContact O-N 3.09Å; N154-N156 WeakPolarHBondContact OD1-CA 3.27Å; N154-N156 VanDerWaalsContact OD1-CB 3.28Å; N154-N156 WeakPolarHBondContact OD1-CB 3.49Å; N154-N156 PolarHBondContact OD1-N 3.39Å; N154-Q157 HydrophobicContact CB-CB 4.13Å; N154-Q157 WeakPolarHBondContact O-CB 3.02Å; N154-Q157 PolarHBondContact O-N 3.18Å
155V86.8Confident90.6Very high66 Ų6671.8 Ų71.840%0.434%0.344SS..EExtended strand (participates in β ladder)trans-61.1-26.2176.6-64.90000112.4F150 Q157F150-V155 WeakPolarHBondContact CD1-O 3.34Å; V155-Q157 PolarHBondContact O-N 2.81Å
156N87.9Confident90.6Very high98 Ų9877.1 Ų77.152%0.52437%0.367SS..EExtended strand (participates in β ladder)trans-81.39176.8-64.9-30.8000114E122 N154 P158E122-N156 VanDerWaalsContact CG-OD1 3.26Å; E122-N156 WeakPolarHBondContact CG-OD1 3.19Å; E122-N156 PolarHBondContact OE1-ND2 3.46Å; E122-N156 PolarHBondContact OE1-OD1 3.06Å; N154-N156 PolarHBondContact O-N 3.09Å; N154-N156 WeakPolarHBondContact OD1-CA 3.27Å; N154-N156 VanDerWaalsContact OD1-CB 3.28Å; N154-N156 WeakPolarHBondContact OD1-CB 3.49Å; N154-N156 PolarHBondContact OD1-N 3.39Å; N156-P158 VanDerWaalsContact C-CD 3.42Å; N156-P158 WeakPolarHBondContact O-CD 3.49Å
157Q88.1Confident90.5Very high59 Ų5974.3 Ų74.328%0.27635%0.353SS..EExtended strand (participates in β ladder)trans-116.576.3177.8-162.8-17816.500111.7N151 N154 V155 R159 T170N151-Q157 HydrophobicContact CB-CB 4.07Å; N151-Q157 PolarHBondContact N-O 2.89Å; N151-Q157 PolarHBondContact ND2-OE1 3.03Å; N154-Q157 HydrophobicContact CB-CB 4.13Å; N154-Q157 WeakPolarHBondContact O-CB 3.02Å; N154-Q157 PolarHBondContact O-N 3.18Å; V155-Q157 PolarHBondContact O-N 2.81Å; Q157-R159 PolarHBondContact O-N 3.27Å; Q157-T170 HydrophobicContact CG-CG2 3.89Å
158P91.5Very high90.4Very high31 Ų3175.6 Ų75.620%0.20136%0.356CS..EExtended strand (participates in β ladder)trans-65.9128.7179.226.6-34.7000112F147 F150 N156 H160F147-P158 HydrophobicContact CD2-CB 3.84Å; F147-P158 HydrophobicContact CE2-CB 3.56Å; F150-P158 HydrophobicContact CD1-CB 4.07Å; F150-P158 HydrophobicContact CE1-CB 3.97Å; N156-P158 VanDerWaalsContact C-CD 3.42Å; N156-P158 WeakPolarHBondContact O-CD 3.49Å; P158-H160 PolarHBondContact O-ND1 3.22Å
159R92.1Very high90.3Very high37 Ų3773.5 Ų73.514%0.1434%0.339CS..EExtended strand (participates in β ladder)trans-91.7132.3175.2-63.9176.7178.9-78-1.3110.6C148 Y149 N151 Q157 T170C148-R159 PolarHBondContact N-O 3.28Å; Y149-R159 HydrophobicContact CE1-CB 4.49Å; Y149-R159 VanDerWaalsContact CE2-CD 3.42Å; Y149-R159 WeakPolarHBondContact O-CB 3.28Å; Y149-R159 PolarHBondContact O-N 3.1Å; Y149-R159 WeakPolarHBondContact OH-CD 3.19Å; N151-R159 VanDerWaalsContact CG-NH2 3.3Å; N151-R159 PolarHBondContact ND2-NH2 2.94Å; N151-R159 PolarHBondContact OD1-NH2 2.96Å; Q157-R159 PolarHBondContact O-N 3.27Å; R159-T170 HydrophobicContact CG-CG2 3.89Å
160H93.6Very high90.1Very high35 Ų3569.9 Ų69.916%0.16233%0.328CS..EExtended strand (participates in β ladder)trans-113.2138.9178.2-63.476.2000109.9K146 P158 Y168 W169K146-H160 CarbonylContact O-C 3.19Å; K146-H160 VanDerWaalsContact O-CA 3.27Å; K146-H160 WeakPolarHBondContact O-CA 3.41Å; P158-H160 PolarHBondContact O-ND1 3.22Å; H160-Y168 CarbonylContact O-C 3.53Å; H160-Y168 VanDerWaalsContact O-CA 3.25Å; H160-Y168 WeakPolarHBondContact O-CA 3.39Å; H160-W169 HydrophobicContact CB-CD2 3.92Å; H160-W169 HydrophobicContact CB-CE3 4.47Å; H160-W169 HydrophobicContact CB-CG 4.39Å; H160-W169 HydrophobicContact CB-CH2 3.95Å; H160-W169 HydrophobicContact CB-CZ2 3.4Å; H160-W169 HydrophobicContact CB-CZ3 4.49Å; H160-W169 AromaticContact CG-CH2 3.76Å; H160-W169 AromaticContact CG-CZ2 3.67Å; H160-W169 PolarHBondContact N-O 2.79Å; H160-W169 PolarHBondContact O-N 3.14Å
161F92.6Very high89.6Confident57 Ų5768.2 Ų68.225%0.2533%0.327CS..EExtended strand (participates in β ladder)trans-100.9127.4172.9-179.3-103.4000109.8T145 K146 C148 K163 H166 Y168T145-F161 CarbonylContact C-O 3.49Å; T145-F161 WeakPolarHBondContact CA-O 3.21Å; K146-F161 PolarHBondContact N-O 3.24Å; K146-F161 PolarHBondContact O-N 3.27Å; C148-F161 HydrophobicContact CB-CB 4.45Å; F161-K163 HydrophobicContact CD1-CG 4.41Å; F161-K163 HydrophobicContact CE1-CG 4.36Å; F161-H166 HydrophobicContact CZ-CB 4.23Å; F161-Y168 HydrophobicContact CB-CD1 4.04Å; F161-Y168 HydrophobicContact CB-CE1 3.95Å; F161-Y168 AromaticContact CD2-CD1 3.89Å; F161-Y168 HydrophobicContact CD2-CD1 3.89Å; F161-Y168 AromaticContact CD2-CE1 3.6Å; F161-Y168 HydrophobicContact CD2-CE1 3.6Å; F161-Y168 HydrophobicContact CD2-CE2 4.24Å; F161-Y168 HydrophobicContact CD2-CG 4.34Å; F161-Y168 AromaticContact CD2-CZ 3.78Å; F161-Y168 HydrophobicContact CG-CD1 4.47Å; F161-Y168 HydrophobicContact CG-CE1 4.17Å
162C93.2Very high89.2Confident0 Ų072 Ų720%037%0.369CS..EExtended strand (participates in β ladder)trans-91.4122.5171.1172.10000110.3C137 S142 T145 D164 C165 H166 R167C137-C162 HydrophobicContact CB-CB 3.95Å; C137-C162 VanDerWaalsContact SG-CB 3.58Å; C137-C162 VanDerWaalsContact SG-SG 3.67Å; S142-C162 PolarHBondContact OG-SG 3.4Å; T145-C162 HydrophobicContact CG2-CB 4.2Å; C162-D164 PolarHBondContact SG-N 3.48Å; C162-D164 VanDerWaalsContact SG-N 3.44Å; C162-C165 PolarHBondContact SG-N 3.48Å; C162-C165 VanDerWaalsContact SG-N 3.4Å; C162-C165 PolarHBondContact SG-SG 3.1Å; C162-H166 WeakPolarHBondContact O-CA 3.28Å; C162-H166 PolarHBondContact O-N 3.18Å; C162-R167 PolarHBondContact N-O 3Å; C162-R167 PolarHBondContact O-N 3.2Å
163K92.1Very high88.7Confident121 Ų12166 Ų6653%0.52634%0.344SS..THydrogen-bonded Turntrans-69.8-30.6177.9-70170174.8-89.90112.9N144 F161 H166N144-K163 HydrophobicContact CB-CB 4.06Å; N144-K163 HydrophobicContact CB-CD 4.34Å; N144-K163 PolarHBondContact O-N 3.4Å; F161-K163 HydrophobicContact CD1-CG 4.41Å; F161-K163 HydrophobicContact CE1-CG 4.36Å; K163-H166 PolarHBondContact O-CD2 3.28Å; K163-H166 PolarHBondContact O-NE2 3.24Å
164D90.8Very high87.9Confident57 Ų5760.5 Ų60.531%0.30534%0.343SS..THydrogen-bonded Turntrans-78.3-40.5-176.6-69.9-55.8000113.2S142 N144 C162 R184S142-D164 WeakPolarHBondContact CB-OD2 3.35Å; N144-D164 WeakPolarHBondContact CB-OD2 3.16Å; N144-D164 PolarHBondContact ND2-OD2 3.47Å; C162-D164 PolarHBondContact SG-N 3.48Å; C162-D164 VanDerWaalsContact SG-N 3.44Å; D164-R184 PolarHBondContact O-NH1 3.04Å; D164-R184 PolarHBondContact O-NH2 3.32Å
165C90.2Very high87.4Confident13 Ų1360 Ų609%0.08834%0.339CS..THydrogen-bonded Turntrans-104.54.3178.670.10000114.6C140 C162 R167C140-C165 HydrophobicContact CB-CB 4.2Å; C140-C165 VanDerWaalsContact SG-SG 3.65Å; C162-C165 PolarHBondContact SG-N 3.48Å; C162-C165 VanDerWaalsContact SG-N 3.4Å; C162-C165 PolarHBondContact SG-SG 3.1Å; C165-R167 VanDerWaalsContact C-N 3.3Å; C165-R167 HydrophobicContact CB-CB 4.5Å; C165-R167 WeakPolarHBondContact O-CB 3.26Å; C165-R167 WeakPolarHBondContact O-CD 3.45Å; C165-R167 VanDerWaalsContact O-CG 3.23Å; C165-R167 WeakPolarHBondContact O-CG 3.49Å; C165-R167 PolarHBondContact O-N 3.12Å
166H91Very high86.8Confident133 Ų13366.3 Ų66.362%0.61636%0.356SS*.THydrogen-bonded Turntrans52.444.9175.9-67.8-139.9000112.9F161 C162 K163F161-H166 HydrophobicContact CZ-CB 4.23Å; C162-H166 WeakPolarHBondContact O-CA 3.28Å; C162-H166 PolarHBondContact O-N 3.18Å; K163-H166 PolarHBondContact O-CD2 3.28Å; K163-H166 PolarHBondContact O-NE2 3.24Å
167R90.4Very high85.3Confident80 Ų8069.4 Ų69.430%0.30237%0.373SS..EExtended strand (participates in β ladder)trans-141.3131.7-162.9-95.7173.7177.5-96.114110.7C162 C165 A182C162-R167 PolarHBondContact N-O 3Å; C162-R167 PolarHBondContact O-N 3.2Å; C165-R167 VanDerWaalsContact C-N 3.3Å; C165-R167 HydrophobicContact CB-CB 4.5Å; C165-R167 WeakPolarHBondContact O-CB 3.26Å; C165-R167 WeakPolarHBondContact O-CD 3.45Å; C165-R167 VanDerWaalsContact O-CG 3.23Å; C165-R167 WeakPolarHBondContact O-CG 3.49Å; C165-R167 PolarHBondContact O-N 3.12Å; R167-A182 PolarHBondContact NH2-O 3.46Å
168Y91.8Very high83.8Confident116 Ų11668 Ų6846%0.45537%0.368SS..EExtended strand (participates in β ladder)trans-76.9141.5174.8-58.5-81000111.8R139 C148 Y149 H160 F161R139-Y168 PolarHBondContact NH2-O 2.9Å; C148-Y168 HydrophobicContact CB-CE1 4.28Å; Y149-Y168 HydrophobicContact CE1-CE1 4.42Å; H160-Y168 CarbonylContact O-C 3.53Å; H160-Y168 VanDerWaalsContact O-CA 3.25Å; H160-Y168 WeakPolarHBondContact O-CA 3.39Å; F161-Y168 HydrophobicContact CB-CD1 4.04Å; F161-Y168 HydrophobicContact CB-CE1 3.95Å; F161-Y168 AromaticContact CD2-CD1 3.89Å; F161-Y168 HydrophobicContact CD2-CD1 3.89Å; F161-Y168 AromaticContact CD2-CE1 3.6Å; F161-Y168 HydrophobicContact CD2-CE1 3.6Å; F161-Y168 HydrophobicContact CD2-CE2 4.24Å; F161-Y168 HydrophobicContact CD2-CG 4.34Å; F161-Y168 AromaticContact CD2-CZ 3.78Å; F161-Y168 HydrophobicContact CG-CD1 4.47Å; F161-Y168 HydrophobicContact CG-CE1 4.17Å
169W90.3Very high82.7Confident16 Ų1671 Ų716%0.06139%0.387CS..EExtended strand (participates in β ladder)trans-147.4168.4175.465-83.7000110.2L135 P138 T145 H160 A171L135-W169 HydrophobicContact CB-CH2 3.75Å; L135-W169 HydrophobicContact CB-CZ3 4.39Å; L135-W169 HydrophobicContact CD1-CH2 4.48Å; P138-W169 HydrophobicContact CG-CB 4.37Å; P138-W169 HydrophobicContact CG-CG 4.46Å; T145-W169 HydrophobicContact CG2-CZ2 3.67Å; H160-W169 HydrophobicContact CB-CD2 3.92Å; H160-W169 HydrophobicContact CB-CE3 4.47Å; H160-W169 HydrophobicContact CB-CG 4.39Å; H160-W169 HydrophobicContact CB-CH2 3.95Å; H160-W169 HydrophobicContact CB-CZ2 3.4Å; H160-W169 HydrophobicContact CB-CZ3 4.49Å; H160-W169 AromaticContact CG-CH2 3.76Å; H160-W169 AromaticContact CG-CZ2 3.67Å; H160-W169 PolarHBondContact N-O 2.79Å; H160-W169 PolarHBondContact O-N 3.14Å; W169-A171 HydrophobicContact CZ3-CB 3.97Å
170T90.9Very high81.3Confident25 Ų2574.3 Ų74.315%0.15341%0.412CS..EExtended strand (participates in β ladder)trans-129.9137.2-179.949.80000109.1Q157 R159Q157-T170 HydrophobicContact CG-CG2 3.89Å; R159-T170 HydrophobicContact CG-CG2 3.89Å
171A83.5Confident80Confident35 Ų3575.9 Ų75.929%0.28944%0.437SS..THydrogen-bonded Turntrans-67.1133.3173.700000109.8L135 W169 G173L135-A171 HydrophobicContact CD1-CB 3.54Å; W169-A171 HydrophobicContact CZ3-CB 3.97Å; A171-G173 PolarHBondContact O-N 3.28Å
172G79.1Confident78.6Confident93 Ų9376.1 Ų76.196%0.95945%0.45SS*.THydrogen-bonded Turntrans69.7-5.1179.300000116.5
173G77.7Confident77.3Confident28 Ų2877.2 Ų77.229%0.28946%0.461SS..SBendtrans-81.5147.9175.600000112.2A171 L175A171-G173 PolarHBondContact O-N 3.28Å; G173-L175 PolarHBondContact O-N 2.94Å
174A68.6Low75.9Confident98 Ų9880.1 Ų80.181%0.8147%0.469SS*.  trans-55.4115.4169.100000109.3R176A174-R176 PolarHBondContact O-N 2.9Å; A174-R176 VanDerWaalsContact O-N 3.16Å
175L73.9Confident74.5Confident61 Ų6188.9 Ų88.932%0.31950%0.498SS..  trans-63120.7172.1-17463.2000106.5P138 G173 N177 V178P138-L175 HydrophobicContact CB-CD2 4.11Å; P138-L175 HydrophobicContact CG-CD1 4.15Å; P138-L175 HydrophobicContact CG-CD2 4.35Å; G173-L175 PolarHBondContact O-N 2.94Å; L175-N177 PolarHBondContact O-N 3.49Å; L175-V178 HydrophobicContact CD1-CB 4.27Å; L175-V178 HydrophobicContact CD1-CG2 3.83Å; L175-V178 HydrophobicContact CD2-CB 3.86Å; L175-V178 HydrophobicContact CD2-CG2 4.3Å; L175-V178 HydrophobicContact CG-CB 3.92Å; L175-V178 HydrophobicContact CG-CG2 3.81Å
176R73.2Confident73.1Confident199 Ų19996.9 Ų96.975%0.75153%0.531SS*.  trans-59.788.1176.3-64.8180-173.4140-3.6109.3A174 V178A174-R176 PolarHBondContact O-N 2.9Å; A174-R176 VanDerWaalsContact O-N 3.16Å; R176-V178 WeakPolarHBondContact O-CG2 3.18Å; R176-V178 PolarHBondContact O-N 3.21Å
177N57.7Low71.3Confident164 Ų16497.7 Ų97.788%0.87754%0.54SS*.SBendtrans10.377.1-175.1-69.7-37.9000113.6L175 P179L175-N177 PolarHBondContact O-N 3.49Å; N177-P179 WeakPolarHBondContact O-CD 3.45Å
178V56.3Low69.6Low30 Ų30104 Ų10418%0.18256%0.563CS.*  trans-105.4106.6-178.6-175.70000109.3R139 L175 R176 V180R139-V178 HydrophobicContact CG-CG1 3.95Å; L175-V178 HydrophobicContact CD1-CB 4.27Å; L175-V178 HydrophobicContact CD1-CG2 3.83Å; L175-V178 HydrophobicContact CD2-CB 3.86Å; L175-V178 HydrophobicContact CD2-CG2 4.3Å; L175-V178 HydrophobicContact CG-CB 3.92Å; L175-V178 HydrophobicContact CG-CG2 3.81Å; R176-V178 WeakPolarHBondContact O-CG2 3.18Å; R176-V178 PolarHBondContact O-N 3.21Å; V178-V180 PolarHBondContact O-N 3.44Å
179P67.5Low68Low92 Ų92103.1 Ų103.160%0.59757%0.572SS**  trans-61.413616823.2-30.3000110.2N177 G181 A182N177-P179 WeakPolarHBondContact O-CD 3.45Å; P179-G181 PolarHBondContact O-N 3.43Å; P179-G181 VanDerWaalsContact O-N 3.17Å; P179-A182 HydrophobicContact CG-CB 4.03Å; P179-A182 PolarHBondContact O-N 2.88Å
180V63.1Low66.4Low108 Ų108111.2 Ų111.266%0.65562%0.616SS**THydrogen-bonded Turntrans-57.8119.3175.1179.60000107.8V178V178-V180 PolarHBondContact O-N 3.44Å
181G65.5Low64.8Low68 Ų68112 Ų11270%0.70163%0.629SS**THydrogen-bonded Turntrans108-9.9177.700000117.3P179 G183P179-G181 PolarHBondContact O-N 3.43Å; P179-G181 VanDerWaalsContact O-N 3.17Å; G181-G183 PolarHBondContact O-N 3.27Å
182A64.5Low63.6Low62 Ų62115.3 Ų115.351%0.51265%0.647SS.*THydrogen-bonded Turntrans-77.223.5-179.800000114.9R167 P179R167-A182 PolarHBondContact NH2-O 3.46Å; P179-A182 HydrophobicContact CG-CB 4.03Å; P179-A182 PolarHBondContact O-N 2.88Å
183G64.8Low62.3Low23 Ų23117.5 Ų117.524%0.23764%0.641CS.*THydrogen-bonded Turntrans-99-33.3-159.400000117G181G181-G183 PolarHBondContact O-N 3.27Å
184R63.4Low61.1Low181 Ų181119.5 Ų119.568%0.68365%0.648SS**  trans-99102.3-175.5-76.2-166.6-174.1-74.9-0.8110.2D164 K186D164-R184 PolarHBondContact O-NH1 3.04Å; D164-R184 PolarHBondContact O-NH2 3.32Å; R184-K186 PolarHBondContact O-N 3.23Å
185R61.3Low60.5Low242 Ų242119.8 Ų119.891%0.91365%0.65SS**  trans-67.390.6148.7-65.3-172.9-169-169.73.7105.6N187R185-N187 PolarHBondContact O-N 3.32Å
186K61.6Low59.3Low180 Ų180120.5 Ų120.578%0.78367%0.673SS**  trans-52.7123.3159.7-175.896.6172.8-171.10104.1R184 R188R184-K186 PolarHBondContact O-N 3.23Å; K186-R188 PolarHBondContact O-N 2.76Å
187N53.1Low58.5Low151 Ų151113.9 Ų113.981%0.80766%0.661SS**  trans-52102.5164.9-65.8-28.4000104.8R185 P189R185-N187 PolarHBondContact O-N 3.32Å; N187-P189 WeakPolarHBondContact O-CD 3.36Å
188R53.5Low58.6Low211 Ų211112.6 Ų112.680%0.79666%0.658SS**  trans-60.4120166.9-166.1122.468-112.24.3102.3K186 L190K186-R188 PolarHBondContact O-N 2.76Å; R188-L190 PolarHBondContact O-N 2.88Å
189P59Low58.9Low98 Ų98116.3 Ų116.364%0.63668%0.683SS**  trans-49.8133.9160.724.1-30.8000105N187 G191N187-P189 WeakPolarHBondContact O-CD 3.36Å; P189-G191 VanDerWaalsContact C-N 3.34Å; P189-G191 PolarHBondContact O-N 3.22Å
190L57.2Low58.8Low187 Ų187117.7 Ų117.798%0.97969%0.689SS**SBendtrans-47.1108.2168.9-66.8160000106.2R188R188-L190 PolarHBondContact O-N 2.88Å
191G56.4Low59.1Low41 Ų41118.2 Ų118.242%0.42370%0.695SS.*SBendtrans83.3139.6-179.800000116.3P189 V193P189-G191 VanDerWaalsContact C-N 3.34Å; P189-G191 PolarHBondContact O-N 3.22Å; G191-V193 PolarHBondContact O-N 3.32Å
192P57.8Low59.2Low104 Ų104120.6 Ų120.668%0.67570%0.695SS**  trans-64.3116.5150.330.1-28.2000106.9V194P192-V194 HydrophobicContact CB-CG1 4.11Å; P192-V194 HydrophobicContact CG-CG1 4.32Å; P192-V194 PolarHBondContact O-N 3.44Å
193V51.3Low59.4Low139 Ų139123.3 Ų123.384%0.84271%0.708SS**  trans-65.693.1137.8178.70000103.1G191 A195G191-V193 PolarHBondContact O-N 3.32Å; V193-A195 PolarHBondContact O-N 2.95Å
194V54.1Low59.6Low71 Ų71128.3 Ų128.343%0.4373%0.734SS.*  trans-54.983.5161.1-89.50000106.5P192 G196 A197P192-V194 HydrophobicContact CB-CG1 4.11Å; P192-V194 HydrophobicContact CG-CG1 4.32Å; P192-V194 PolarHBondContact O-N 3.44Å; V194-G196 PolarHBondContact O-N 2.85Å; V194-A197 HydrophobicContact CB-CB 4.38Å; V194-A197 HydrophobicContact CG1-CB 4.2Å; V194-A197 VanDerWaalsContact CG2-O 3.29Å; V194-A197 WeakPolarHBondContact CG2-O 3.39Å
195A55.1Low59.8Low103 Ų103124.6 Ų124.685%0.85173%0.733SS**THydrogen-bonded Turntrans-65.487.4151.100000105.1V193V193-A195 PolarHBondContact O-N 2.95Å
196G49.5Very low59.9Low77 Ų77116.9 Ų116.979%0.79472%0.721SS**THydrogen-bonded Turntrans106.154.8177.700000115.6V194V194-G196 PolarHBondContact O-N 2.85Å
197A55.7Low60.1Low60 Ų60117.3 Ų117.350%0.49673%0.725SS.*SBendtrans-171.9121.1147.200000108.5V194V194-A197 HydrophobicContact CB-CB 4.38Å; V194-A197 HydrophobicContact CG1-CB 4.2Å; V194-A197 VanDerWaalsContact CG2-O 3.29Å; V194-A197 WeakPolarHBondContact CG2-O 3.39Å
198V60.6Low60.7Low137 Ų137118.4 Ų118.483%0.8373%0.725SS**  trans-53.5122.2-179-162.30000110V200V198-V200 PolarHBondContact O-N 3.23Å
199P62.1Low61.4Low107 Ų107116.8 Ų116.870%0.69573%0.726SS**  trans-77.2113.1174.329.7-29.1000108.6
200V66.1Low61.4Low121 Ų121120.9 Ų120.973%0.73374%0.737SS**  trans-72.8124.9164.1-176.30000107.3V198 V202V198-V200 PolarHBondContact O-N 3.23Å; V200-V202 PolarHBondContact O-N 3.4Å
201P69Low62Low119 Ų119119.8 Ų119.877%0.77373%0.726SS**  trans-75.3109.1176.829.2-30.4000109.1
202V67Low62Low118 Ų118126.7 Ų126.772%0.71575%0.747SS**  trans-95.2119.4166.3-165.30000107.4V200 V204V200-V202 PolarHBondContact O-N 3.4Å; V202-V204 PolarHBondContact O-N 3.34Å
203P69.3Low62.2Low120 Ų120129.4 Ų129.478%0.77976%0.755SS**  trans-74.5114.1176.227.9-29.9000109.5
204V67.7Low62.5Low128 Ų128131.7 Ų131.778%0.77676%0.756SS**PPolyproline II helixtrans-92.4124.8168.4-174.50000107.6V202 A206V202-V204 PolarHBondContact O-N 3.34Å; V204-A206 PolarHBondContact O-N 2.88Å
205P68.1Low62.4Low103 Ų103133.9 Ų133.967%0.66977%0.772SS**PPolyproline II helixtrans-69.8127.8179.327.7-31.4000110.2H207P205-H207 PolarHBondContact O-N 2.72Å
206A63.1Low62.3Low80 Ų80133.5 Ų133.566%0.66177%0.769SS**PPolyproline II helixtrans-68.5117.1169.100000109V204 H208V204-A206 PolarHBondContact O-N 2.88Å; A206-H208 VanDerWaalsContact C-N 3.35Å; A206-H208 PolarHBondContact O-N 3.46Å
207H67.1Low62.4Low188 Ų188134.9 Ų134.987%0.8777%0.773SS**  trans-69.896.7163.3-73.7-73.1000108.1P205 H209P205-H207 PolarHBondContact O-N 2.72Å; H207-H209 PolarHBondContact O-N 3.2Å
208H66.1Low62.1Low175 Ų175136.5 Ų136.581%0.8179%0.786SS**  trans-64.7126.4168.4-88-69.6000109.8A206 H210A206-H208 VanDerWaalsContact C-N 3.35Å; A206-H208 PolarHBondContact O-N 3.46Å; H208-H210 PolarHBondContact O-N 3.38Å
209H66.9Low61.6Low176 Ų176134.4 Ų134.482%0.81578%0.783SS**  trans-59.3123.6159-91.7-58000109H207 H211H207-H209 PolarHBondContact O-N 3.2Å; H209-H211 PolarHBondContact O-N 3.25Å
210H59.4Low61Low185 Ų185134.2 Ų134.286%0.85679%0.79SS**  trans-7296.2177.9-136.2-31.6000109.1H208H208-H210 PolarHBondContact O-N 3.38Å
211H69.8Low60.3Low164 Ų164132.8 Ų132.876%0.75979%0.791SS**  trans-100.2124.9158.1-83.6-81.5000108.3H209 L213H209-H211 PolarHBondContact O-N 3.25Å; H211-L213 PolarHBondContact O-N 3.28Å
212H55.8Low59.4Low186 Ų186132 Ų13286%0.86180%0.795SS**  trans-69.6114.9-177.9-149.2-81.2000109.2
213L61.6Low58.7Low161 Ų161131 Ų13184%0.84380%0.799SS**  trans-133.7133.5171.3-78.6172.9000111.7H211H211-L213 PolarHBondContact O-N 3.28Å
214H58.3Low58.2Low186 Ų186130.2 Ų130.286%0.86180%0.803SS**  trans-59.4139.9174.8-139.2-120000111.2
215P53.1Low57.3Low117 Ų117127.8 Ų127.876%0.7680%0.804SS**  trans-99.9143.8179.436.1-28.9000112.1
216A51.9Low56.9Low95 Ų95131.9 Ų131.979%0.78581%0.811SS**  trans-158122.7158.900000111.2
217A50.9Low56.8Low107 Ų107134.4 Ų134.488%0.88482%0.818SS**  trans61.9144.5155.500000118
218A50.8Low57.1Low93 Ų93132.5 Ų132.577%0.76981%0.814SS**  cis-174.2171.1-6.800000106.5
219A49.1Very low56.4Low93 Ų93127.5 Ų127.577%0.76981%0.809SS**  trans77.7105.6166.100000116.2
220A50.3Low56.3Low103 Ų103129 Ų12985%0.85181%0.814SS**  72.3133.474.500000111.2
221A50.6Low56.4Low91 Ų91126 Ų12675%0.75281%0.811SS**  cis-163.8164.115.200000109.7
222A51Low55.5Low103 Ų103121.7 Ų121.785%0.85181%0.811SS**  trans60.6144.9145.500000118.9
223A52.6Low55.4Low96 Ų96121.7 Ų121.779%0.79381%0.811SS**  cis-170.2148.8-6.200000105.4
224A58.1Low55.2Low104 Ų104122 Ų12286%0.8681%0.808SS**  trans154.9100.8146.800000108.3
225G49.4Very low55Low77 Ų77121.2 Ų121.279%0.79481%0.805SS**  trans-74.6138.5168.700000110.5
226F58.8Low55.1Low189 Ų189121 Ų12183%0.82980%0.803SS**  trans-130.4108.7157-143.8-92.7000107.1L228F226-L228 HydrophobicContact CD1-CD1 4.49Å; F226-L228 HydrophobicContact CD1-CG 4.36Å; F226-L228 HydrophobicContact CE1-CD1 3.8Å; F226-L228 HydrophobicContact CE1-CG 4.06Å
227V61.8Low55Low134 Ų134121.6 Ų121.681%0.81280%0.802SS**  trans-96.9114.9173.5170.90000106.5
228L72Confident55.1Low147 Ų147122.2 Ų122.277%0.7780%0.799SS**  trans-142.4116.5153-72.2-178.5000107.7F226F226-L228 HydrophobicContact CD1-CD1 4.49Å; F226-L228 HydrophobicContact CD1-CG 4.36Å; F226-L228 HydrophobicContact CE1-CD1 3.8Å; F226-L228 HydrophobicContact CE1-CG 4.06Å
229G51.9Low55.6Low70 Ų70123.1 Ų123.172%0.72280%0.797SS**  trans-72.1154.9-176.700000113.4
230F64.6Low55.9Low208 Ų208125.2 Ų125.291%0.91280%0.801SS**  trans-117.6120.3162.8-106.6-90.5000108.3
231P62.3Low56.3Low122 Ų122126 Ų12679%0.79280%0.8SS**  trans-81.9149.9169.633.3-29.9000110.3
232G50.7Low56.9Low73 Ų73127.4 Ų127.475%0.75380%0.801SS**  trans-75.3162-172.600000116.8
233Q54.8Low57.1Low187 Ų187127.3 Ų127.387%0.87480%0.795SS**  trans-151.5108.3146.9-79.3-149.326.200105.3
234Q56.2Low57.8Low168 Ų168128.4 Ų128.479%0.78579%0.794SS**  57.59580.1-65.5-1660.200115.1
235H54.4Low57.9Low169 Ų169127.9 Ų127.978%0.78278%0.784SS**  trans65.5164.4142.6-69.5-84.7000119.4
236P54.5Low58.6Low112 Ų112130.1 Ų130.173%0.72778%0.784SS**  cis-131166.5-4.921.52.9000115.4
237S49.9Very low58.5Low108 Ų108127 Ų12776%0.75578%0.781SS**  trans-35.7141.2161.3-36.40000115.8
238S54.3Low58.1Low119 Ų119130.3 Ų130.383%0.83278%0.78SS**  trans-152.8152.5153.3-830000110.8
239P59.5Low57.2Low112 Ų112126.8 Ų126.873%0.72777%0.772SS**  trans-99.2157-133.935.3-34.4000115.1
240T55.4Low57.1Low138 Ų138129.8 Ų129.885%0.84777%0.771SS**  trans-30.5123.4154.942.40000114.6
241S58.7Low56.9Low120 Ų120130.7 Ų130.784%0.83977%0.769SS**  trans-112.1123.8160.2-113.70000109
242P64.6Low56.5Low119 Ų119135.2 Ų135.277%0.77377%0.77SS**  trans-81.4137.8176.130.9-30.7000111.8
243S55.3Low57.3Low102 Ų102137.1 Ų137.171%0.71377%0.77SS**  trans-59.7132.9168.5-179.60000112
244P67Low57.9Low119 Ų119134.6 Ų134.677%0.77377%0.767SS**  trans-90.6102.2155.631.4-25.3000109.2
245S59.7Low58.2Low92 Ų92132 Ų13264%0.64377%0.766SS**  trans-58.1128.5163.7-430000109.2V247S245-V247 PolarHBondContact O-N 3.31Å
246P64.2Low58.9Low124 Ų124129.2 Ų129.281%0.80576%0.763SS**  trans-69.3109.4162.428.5-28.4000106.6Y248P246-Y248 PolarHBondContact O-N 3.08Å
247V57.5Low59.2Low125 Ų125130 Ų13076%0.75876%0.76SS**  trans-54112.1169.2-178.40000106.9S245 A249S245-V247 PolarHBondContact O-N 3.31Å; V247-A249 HydrophobicContact CG1-CB 4.13Å; V247-A249 PolarHBondContact O-N 3.02Å
248Y51.9Low59.8Low202 Ų202136.7 Ų136.779%0.79277%0.769SS**  trans-69.278163.6-162.7-90.5000106.2P246 D250P246-Y248 PolarHBondContact O-N 3.08Å; Y248-D250 PolarHBondContact O-N 3.31Å
249A53.5Low60.5Low74 Ų74141 Ų14161%0.61277%0.767SS**  trans-77.9104.4172.400000107.1V247 R251V247-A249 HydrophobicContact CG1-CB 4.13Å; V247-A249 PolarHBondContact O-N 3.02Å; A249-R251 PolarHBondContact O-N 2.9Å
250D51.3Low60.3Low132 Ų132148.9 Ų148.971%0.70679%0.791SS**  trans-42.3102.7158.3-81.5-70.3000110.6Y248Y248-D250 PolarHBondContact O-N 3.31Å
251R59.2Low60.5Low228 Ų228149.5 Ų149.586%0.8679%0.788SS**  trans-153.371168.1-149.8158.9164.4-154.8-5.1110.6A249A249-R251 PolarHBondContact O-N 2.9Å
252W54.5Low60.6Low216 Ų216151 Ų15182%0.81879%0.785SS**  trans-61.5128.5156.9-70.391.6000107.9V254W252-V254 PolarHBondContact O-N 3.22Å
253P67.8Low60.4Low114 Ų114152.8 Ų152.874%0.7479%0.786SS**  trans-62.3107.8176.4-16.628.7000109C255P253-C255 PolarHBondContact O-N 3.32Å
254V66.2Low60.7Low134 Ų134155.8 Ų155.881%0.81279%0.79SS**  trans-70.6107.3160.7-175.60000105.2W252 P256W252-V254 PolarHBondContact O-N 3.22Å; V254-P256 WeakPolarHBondContact O-CD 3.46Å
255C63.3Low60.3Low114 Ų114158.1 Ų158.177%0.7779%0.791SS**  trans-56.1124.1171.3-68.80000109.1P253P253-C255 PolarHBondContact O-N 3.32Å
256P68.4Low60.3Low110 Ų110162.5 Ų162.571%0.71480%0.801SS**  trans-80.5146.5171.133.1-29.6000110V254V254-P256 WeakPolarHBondContact O-CD 3.46Å
257D61.8Low60Low127 Ų127165.2 Ų165.268%0.67980%0.801SS**  trans60.4100.4154.8-91-81.8000119.3R259D257-R259 WeakPolarHBondContact OD1-CG 3.15Å; D257-R259 IonicContact OD1-NE 3.99Å
258R62.1Low60.2Low249 Ų249168.3 Ų168.394%0.9480%0.804SS**  trans-106.3105.8132.9-102-165.8175.2-150.11.2108.2
259R67.9Low60.9Low210 Ų210165.5 Ų165.579%0.79281%0.805SS**  trans-99.5141.7158.4-86.8-173.8178.7-1570.4108.7D257D257-R259 WeakPolarHBondContact OD1-CG 3.15Å; D257-R259 IonicContact OD1-NE 3.99Å
260F55.2Low61.6Low278 Ų278173.8 Ų173.8100%1.21982%0.823SS**  trans77.80-174.9-73.8-86000116.6

Retrieved 260 of 260 residues in 224.5 ms (Link to these results)