A0A087XG85_POEFO Loading...

DNA damage-inducible transcript 4 protein

AlphaFold DB , UniProt , Accession A0A087XG85, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 225 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
1M39.2Very low42.4Very low241 Ų241142.2 Ų142.2100%1.18782%0.823SS**  0142.30-71.6-171.597.900107.8
2P42.8Very low42.5Very low107 Ų107140.1 Ų140.170%0.69582%0.823SS**  trans-89.7148.2-159.235.3-31.7000112.1
3E39.4Very low42.8Very low172 Ų172141.3 Ų141.380%0.80482%0.821SS**  trans-115.1117150.6-80.5-145.3134.200108.5
4V41.7Very low43.4Very low130 Ų130138.7 Ų138.779%0.78881%0.811SS**  trans-85.5114.81791730000106.8
5F42.2Very low43.6Very low184 Ų184137.7 Ų137.781%0.80781%0.81SS**  trans-88.8115.3165.3-76.3-85.7000108.6
6A47.1Very low43.6Very low84 Ų84135.5 Ų135.569%0.69481%0.805SS**  trans-73.8143.5171.400000110.3
7P44.1Very low43.5Very low125 Ų125134.8 Ų134.881%0.81281%0.805SS**  trans-75.5134.2171.30.117.2000109.8E9P7-E9 PolarHBondContact O-N 3.32Å
8I45.5Very low43.5Very low167 Ų167134.6 Ų134.686%0.85680%0.804SS**  trans-69.8114171-65.6160.9000107.7A10I8-A10 PolarHBondContact O-N 3.31Å
9E41.8Very low43.2Very low185 Ų185134.9 Ų134.986%0.86480%0.801SS**PPolyproline II helixtrans-62.1120.5168.6-82.8-174.9144.900109.5P7 G11P7-E9 PolarHBondContact O-N 3.32Å; E9-G11 PolarHBondContact O-N 3.26Å
10A47.1Very low43.1Very low96 Ų96133.3 Ų133.379%0.79380%0.797SS**PPolyproline II helixtrans-64.9122.2166.700000108.6I8 S12I8-A10 PolarHBondContact O-N 3.31Å; A10-S12 PolarHBondContact O-N 3.34Å
11G36Very low42.9Very low73 Ų73129.7 Ų129.775%0.75378%0.778SS**PPolyproline II helixtrans-51.4122.2-17700000112.9E9 I13E9-G11 PolarHBondContact O-N 3.26Å; G11-I13 PolarHBondContact O-N 3.32Å
12S42.9Very low42.8Very low117 Ų117123 Ų12382%0.81875%0.753SS**  trans-66.5114.5167.820.60000109.4A10A10-S12 PolarHBondContact O-N 3.34Å
13I47.2Very low42.7Very low156 Ų156128.5 Ų128.580%0.876%0.76SS**PPolyproline II helixtrans-63.1127.4168.3-61.8161.4000107.2G11G11-I13 PolarHBondContact O-N 3.32Å
14P50.3Low43Very low105 Ų105129.7 Ų129.768%0.68276%0.757SS**PPolyproline II helixtrans-65.2138.617526.5-32000109.4S16P14-S16 PolarHBondContact O-N 3.5Å
15P46.8Very low43.1Very low123 Ų123128.7 Ų128.780%0.79975%0.746SS**PPolyproline II helixtrans-60.6128.5177.124.7-31.6000109.4
16S43.5Very low43.1Very low103 Ų103124.5 Ų124.572%0.7274%0.74SS**PPolyproline II helixtrans-50.4137170.146.50000109.8P14 V18P14-S16 PolarHBondContact O-N 3.5Å; S16-V18 PolarHBondContact O-N 3.01Å; S16-V18 VanDerWaalsContact O-N 3.17Å
17P42.6Very low43.3Very low124 Ų124124.1 Ų124.181%0.80572%0.721SS**PPolyproline II helixtrans-57.7126.5-178.724.1-31.7000108.9D19P17-D19 PolarHBondContact O-N 3.1Å
18V42.9Very low43.7Very low130 Ų130120.2 Ų120.279%0.78870%0.704SS**  trans-55.5113.8167.21450000106.6S16 S20S16-V18 PolarHBondContact O-N 3.01Å; S16-V18 VanDerWaalsContact O-N 3.17Å; V18-S20 PolarHBondContact O-N 3.38Å
19D37.4Very low44Very low141 Ų141120 Ų12075%0.75470%0.696SS**  trans-68.986169.5-171.117.3000107.1P17 S21P17-D19 PolarHBondContact O-N 3.1Å; D19-S21 PolarHBondContact O-N 3.26Å; D19-S21 PolarHBondContact OD1-N 3.17Å
20S40.5Very low44.6Very low103 Ų103113.8 Ų113.872%0.7267%0.669SS**  trans-75.259.9163.656.80000108.5V18 P22V18-S20 PolarHBondContact O-N 3.38Å; S20-P22 WeakPolarHBondContact O-CD 3.49Å
21S39Very low45.2Very low57 Ų57113.6 Ų113.640%0.39966%0.657SS.*  trans-64.8119.21671580000107.3D19 R23D19-S21 PolarHBondContact O-N 3.26Å; D19-S21 PolarHBondContact OD1-N 3.17Å; S21-R23 PolarHBondContact O-N 3Å
22P38.8Very low46Very low102 Ų102116.6 Ų116.666%0.66265%0.652SS**  trans-60.1128.3161.326.1-29.8000106.8S20 R24S20-P22 WeakPolarHBondContact O-CD 3.49Å; P22-R24 PolarHBondContact O-N 2.87Å
23R40.8Very low46.6Very low221 Ų221118.9 Ų118.983%0.83464%0.642SS**  trans-29.9106.7-173.4-66.2175.8-173.1-177.61.1111.9S21 L25S21-R23 PolarHBondContact O-N 3Å; R23-L25 PolarHBondContact O-N 3.32Å
24R44.1Very low47Very low198 Ų198113.9 Ų113.975%0.74762%0.617SS**  trans-54.899.9172.9-147.7177.5-164.2-89.1-1.6108.3P22 S26P22-R24 PolarHBondContact O-N 2.87Å; R24-S26 PolarHBondContact O-N 3.16Å
25L44.8Very low47.3Very low108 Ų108111.6 Ų111.657%0.56561%0.607SS**  trans-60.7134.4174.4-69.1172.8000108R23 W27R23-L25 PolarHBondContact O-N 3.32Å; L25-W27 PolarHBondContact O-N 2.97Å
26S43Very low47.3Very low96 Ų96111 Ų11167%0.67160%0.597SS**  trans-66.695.8-1721620000111.3R24 G28R24-S26 PolarHBondContact O-N 3.16Å; S26-G28 PolarHBondContact O-N 3.35Å
27W50.1Low47.5Very low76 Ų76113.9 Ų113.929%0.28860%0.597SS.*THydrogen-bonded Turntrans-51.3-19.7171.9-73.1101.6000115.4L25 K29 L30 V31 Q155L25-W27 PolarHBondContact O-N 2.97Å; W27-K29 PolarHBondContact O-N 3.23Å; W27-K29 VanDerWaalsContact O-N 3.08Å; W27-L30 HydrophobicContact CE3-CD1 4.14Å; W27-L30 HydrophobicContact CH2-CD1 4.42Å; W27-L30 HydrophobicContact CZ3-CD1 3.68Å; W27-L30 PolarHBondContact O-N 3.33Å; W27-L30 VanDerWaalsContact O-N 3.11Å; W27-V31 PolarHBondContact O-N 2.88Å; W27-Q155 HydrophobicContact CH2-CB 4.46Å; W27-Q155 WeakPolarHBondContact CH2-O 3.49Å; W27-Q155 HydrophobicContact CZ2-CB 4.01Å; W27-Q155 WeakPolarHBondContact CZ2-O 3.38Å; W27-Q155 WeakPolarHBondContact CZ3-O 3.5Å
28G53.3Low47.7Very low44 Ų44111.8 Ų111.845%0.45459%0.586SS.*Hα-helixtrans-55.1-30.6-178.800000114.3S26 Q32S26-G28 PolarHBondContact O-N 3.35Å; G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.4Å; G28-Q32 PolarHBondContact O-N 3.04Å
29K50.7Low47.6Very low163 Ų163111 Ų11171%0.70958%0.581SS**Hα-helixtrans-78.5-25.4-179-78.2177.1174.2174.10114.5W27W27-K29 PolarHBondContact O-N 3.23Å; W27-K29 VanDerWaalsContact O-N 3.08Å
30L55.5Low48Very low54 Ų54111.5 Ų111.528%0.28358%0.584SS.*Hα-helixtrans-88.7-42.3-179.9-69.1174.9000110.9W27 Q32 R33 L34W27-L30 HydrophobicContact CE3-CD1 4.14Å; W27-L30 HydrophobicContact CH2-CD1 4.42Å; W27-L30 HydrophobicContact CZ3-CD1 3.68Å; W27-L30 PolarHBondContact O-N 3.33Å; W27-L30 VanDerWaalsContact O-N 3.11Å; L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.43Å; L30-R33 PolarHBondContact O-N 2.82Å; L30-L34 PolarHBondContact O-N 2.94Å
31V59.9Low48.2Very low91 Ų91114 Ų11455%0.55259%0.589SS**Hα-helixtrans-63-40.6177.3177.60000111.5W27 R33 L34 A35W27-V31 PolarHBondContact O-N 2.88Å; V31-R33 VanDerWaalsContact C-N 3.25Å; V31-R33 PolarHBondContact O-N 3.13Å; V31-L34 PolarHBondContact O-N 3.26Å; V31-A35 PolarHBondContact O-N 2.92Å
32Q52.4Low48.3Very low136 Ų136116.4 Ų116.464%0.63661%0.606SS**Hα-helixtrans-65-29.7179.6-167.9158.719.100112.7G28 L30G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.4Å; G28-Q32 PolarHBondContact O-N 3.04Å; L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.43Å
33R55.3Low48.5Very low165 Ų165117.2 Ų117.262%0.62361%0.614SS**Hα-helixtrans-77.8-31.9177.8-77.6-173.5169.5159-2.3113.4L30 V31 A35 D36 F37L30-R33 PolarHBondContact O-N 2.82Å; V31-R33 VanDerWaalsContact C-N 3.25Å; V31-R33 PolarHBondContact O-N 3.13Å; R33-A35 VanDerWaalsContact C-N 3.32Å; R33-D36 PolarHBondContact O-N 3.24Å; R33-F37 WeakPolarHBondContact O-CD2 3.48Å; R33-F37 WeakPolarHBondContact O-CE2 3.34Å
34L55.8Low48.7Very low51 Ų51115 Ų11527%0.26762%0.617SS.*Hα-helixtrans-64.9-38176-73.1168.2000111.6L30 V31 D36 F37 E86L30-L34 PolarHBondContact O-N 2.94Å; V31-L34 PolarHBondContact O-N 3.26Å; L34-D36 VanDerWaalsContact C-N 3.32Å; L34-D36 PolarHBondContact O-N 3.48Å; L34-F37 PolarHBondContact O-N 3.07Å; L34-E86 WeakPolarHBondContact CD2-OE1 3.34Å
35A57.2Low48.5Very low57 Ų57115 Ų11547%0.47163%0.625SS.*Hα-helixtrans-66.3-30.8179.100000113.6V31 R33 F37V31-A35 PolarHBondContact O-N 2.92Å; R33-A35 VanDerWaalsContact C-N 3.32Å; A35-F37 VanDerWaalsContact C-N 3.34Å; A35-F37 PolarHBondContact O-N 3.07Å
36D46Very low48.4Very low111 Ų111116 Ų11659%0.59464%0.641SS**Hα-helixtrans-74.4-21.4-177-68.7-25000113.1R33 L34R33-D36 PolarHBondContact O-N 3.24Å; L34-D36 VanDerWaalsContact C-N 3.32Å; L34-D36 PolarHBondContact O-N 3.48Å
37F47.4Very low48Very low163 Ų163115.4 Ų115.472%0.71565%0.65SS**Hα-helixtrans-88.9-27.4-176.9-72.2-71.8000114.4R33 L34 A35 T39R33-F37 WeakPolarHBondContact O-CD2 3.48Å; R33-F37 WeakPolarHBondContact O-CE2 3.34Å; L34-F37 PolarHBondContact O-N 3.07Å; A35-F37 VanDerWaalsContact C-N 3.34Å; A35-F37 PolarHBondContact O-N 3.07Å; F37-T39 PolarHBondContact O-N 3.17Å; F37-T39 VanDerWaalsContact O-N 3.16Å
38S46.3Very low47.8Very low81 Ų81117.2 Ų117.257%0.56668%0.675SS**THydrogen-bonded Turntrans-68.9-10.5-179.1-63.40000114.6
39T41.8Very low47.3Very low113 Ų113122 Ų12269%0.69369%0.69SS**THydrogen-bonded Turntrans-89-7.9-174-40.50000113.4F37F37-T39 PolarHBondContact O-N 3.17Å; F37-T39 VanDerWaalsContact O-N 3.16Å
40N44.9Very low46.9Very low151 Ų151121.3 Ų121.381%0.80769%0.694SS**SBendtrans-104.60.8-170.4-87.110.9000116
41D44.4Very low46.2Very low156 Ų156122.1 Ų122.183%0.83472%0.715SS**  trans-12876.1-174.4-148.19.1000112.6
42S42Very low45.3Very low108 Ų108123.9 Ų123.976%0.75573%0.732SS**  trans-15083.8163.470.50000111.2
43S43.1Very low45.5Very low118 Ų118129.2 Ų129.283%0.82575%0.746SS**  trans-164.691158.9-830000110.7
44I45.8Very low45Very low174 Ų174127 Ų12789%0.89276%0.756SS**  trans-142.3130.7147.851.4169.9000110
45E39Very low44.5Very low198 Ų198132 Ų13293%0.92578%0.783SS**PPolyproline II helixtrans-70.6147-171-66.1178.1130.300113.2
46S42.4Very low44.2Very low130 Ų130137 Ų13791%0.90980%0.801SS**PPolyproline II helixtrans-73.3120172.3-65.10000111.6
47G35.4Very low44.4Very low83 Ų83137.7 Ų137.786%0.85681%0.814SS**PPolyproline II helixtrans-104116.5169.100000111.5
48S45.7Very low44.5Very low115 Ų115137.6 Ų137.680%0.80482%0.821SS**PPolyproline II helixtrans-85.3139.4176.3-163.80000111
49N43.1Very low45Very low144 Ų144139.4 Ų139.477%0.7783%0.834SS**  trans-173.1133.8137.5-109-7.5000116.8
50N41.2Very low45.4Very low148 Ų148137.8 Ų137.879%0.79184%0.839SS**  trans56.6121.8142.7-74.86.5000122.9
51G41.6Very low45.7Very low71 Ų71136.2 Ų136.273%0.73284%0.84SS**  trans-86.4178.2170.700000115.1
52S41.4Very low45.9Very low129 Ų129136.1 Ų136.190%0.90284%0.84SS**  trans-157.8131.3154.2-82.10000108.5
53R55.1Low46.5Very low248 Ų248137.1 Ų137.194%0.93684%0.841SS**  trans-88.8138.2175.7-56.3165.787.6179.26.1107.2
54S44.8Very low46.5Very low119 Ų119141.5 Ų141.583%0.83285%0.846SS**  trans-158.5145.6154.555.50000111.2
55D45.8Very low46.8Very low155 Ų155139.7 Ų139.783%0.82984%0.838SS**  trans-82.2161.8-155.8-65.6-59.2000116.3
56L51Low47Very low163 Ų163137.3 Ų137.385%0.85383%0.832SS**  trans-17132.5158.2-53.7170.8000117.5
57S50.8Low47.3Very low125 Ų125138 Ų13887%0.87483%0.825SS**  trans-148.8116.7142.3-77.10000110
58D48.8Very low47.6Very low161 Ų161139.3 Ų139.386%0.86182%0.819SS**  trans-80.5125172.1-176.522.6000108.6
59S56.4Low47.6Very low118 Ų118138.5 Ų138.583%0.82581%0.811SS**  trans-160.1101.8167.2-84.80000109.5
60G50Low47.7Very low79 Ų79137.1 Ų137.181%0.81481%0.808SS**  trans-69.4131.7166.500000111.1
61S52.4Low47.8Very low118 Ų118135 Ų13583%0.82580%0.796SS**  trans-145.5125.9150.970.30000110
62D47.4Very low48.3Very low155 Ų155137.7 Ų137.783%0.82979%0.794SS**  trans-72.9149.6-177.4-68-57.3000113.4
63V55.9Low48.8Very low128 Ų128137.4 Ų137.478%0.77678%0.782SS**  trans55.2109159.4-125.70000118.7
64F41.8Very low48.5Very low210 Ų210132.5 Ų132.592%0.92177%0.774SS**  -151.5131.8122.2-104.9-80.9000109.8D66F64-D66 PolarHBondContact O-N 2.99Å; F64-D66 VanDerWaalsContact O-N 3.09Å
65N53Low48.9Very low137 Ų137136 Ų13673%0.73378%0.775SS**  trans-60.499.5175.2175.182.3000110.3
66D42.8Very low49.3Very low148 Ų148134.4 Ų134.479%0.79176%0.76SS**  trans-109.5116.4167.5-135.1-8.7000109F64 C68F64-D66 PolarHBondContact O-N 2.99Å; F64-D66 VanDerWaalsContact O-N 3.09Å; D66-C68 VanDerWaalsContact C-N 3.35Å; D66-C68 PolarHBondContact O-N 2.86Å
67L49.7Very low50.2Low145 Ų145130.4 Ų130.476%0.75974%0.74SS**  trans-66.293177.4-70.3156000107.6P69L67-P69 VanDerWaalsContact O-CD 3.28Å; L67-P69 WeakPolarHBondContact O-CD 3.25Å
68C40.8Very low51.5Low109 Ų109129.1 Ų129.174%0.73673%0.728SS**  trans-63120.2159.4-63.70000106.4D66 V70D66-C68 VanDerWaalsContact C-N 3.35Å; D66-C68 PolarHBondContact O-N 2.86Å; C68-V70 PolarHBondContact O-N 3.1Å
69P45.6Very low53.1Low99 Ų99126.3 Ų126.364%0.64371%0.711SS**  trans-56.5122.9156.726.6-28.4000104.4L67 N71L67-P69 VanDerWaalsContact O-CD 3.28Å; L67-P69 WeakPolarHBondContact O-CD 3.25Å; P69-N71 PolarHBondContact O-N 3.33Å
70V45.7Very low54.4Low115 Ų115123.1 Ų123.170%0.69768%0.684SS**  trans-56.993.5163.9167.50000104.5C68 D72C68-V70 PolarHBondContact O-N 3.1Å; V70-D72 WeakPolarHBondContact CG1-OD1 3.49Å; V70-D72 PolarHBondContact O-N 3.4Å
71N43.2Very low56.2Low104 Ų104125.5 Ų125.556%0.55667%0.673SS**  trans-70.997.3160.6-74.9-13.9000103.3P69 D73P69-N71 PolarHBondContact O-N 3.33Å; N71-D73 PolarHBondContact O-N 2.87Å
72D52Low58.1Low126 Ų126122.8 Ų122.867%0.67466%0.658SS**G310 helixtrans-54.5-7.1169.9-82-46.8000112.4V70V70-D72 WeakPolarHBondContact CG1-OD1 3.49Å; V70-D72 PolarHBondContact O-N 3.4Å
73D51Low60.2Low124 Ų124116.8 Ų116.866%0.66363%0.626SS**G310 helixtrans-79.1-10.5-177.1-74.7-21.5000115.9N71 F75N71-D73 PolarHBondContact O-N 2.87Å; D73-F75 VanDerWaalsContact C-N 3.32Å; D73-F75 PolarHBondContact O-N 3.05Å
74L49.7Very low62.1Low145 Ų145112.3 Ų112.376%0.75960%0.597SS**G310 helixtrans-84.51.7-173.5-67.4179.6000115.4
75F52.1Low64.6Low193 Ų193108.5 Ų108.585%0.84658%0.58SS**G310 helixtrans-124.311.9178.1-64.9-79.1000114.1D73 D77D73-F75 VanDerWaalsContact C-N 3.32Å; D73-F75 PolarHBondContact O-N 3.05Å; F75-D77 PolarHBondContact O-N 3.14Å; F75-D77 VanDerWaalsContact O-N 3.16Å
76F55.4Low66.6Low120 Ų120106.5 Ų106.553%0.52657%0.566SS.*  trans-74.7106.5175.6-87.3-91.7000110.5P78F76-P78 WeakPolarHBondContact O-CD 3.48Å
77D70Confident69.2Low79 Ų7999.6 Ų99.642%0.42253%0.53SS..  trans-70.9119.61711800.1000109.1F75 M79 E80 E81F75-D77 PolarHBondContact O-N 3.14Å; F75-D77 VanDerWaalsContact O-N 3.16Å; D77-M79 PolarHBondContact O-N 2.83Å; D77-M79 WeakPolarHBondContact OD1-CB 3.34Å; D77-M79 PolarHBondContact OD1-N 2.83Å; D77-E80 HydrophobicContact CB-CB 3.98Å; D77-E80 WeakPolarHBondContact O-CB 3.47Å; D77-E80 PolarHBondContact O-N 2.72Å; D77-E81 PolarHBondContact O-N 3.23Å; D77-E81 VanDerWaalsContact O-N 3.11Å
78P77.8Confident71.4Confident98 Ų9893.8 Ų93.864%0.63650%0.5SS*.Hα-helixtrans-54.3-27.9176.5-26.134.9000113.6F76 A82F76-P78 WeakPolarHBondContact O-CD 3.48Å; P78-A82 PolarHBondContact O-N 2.92Å
79M81.9Confident74Confident103 Ų10391.7 Ų91.751%0.50748%0.482SS..Hα-helixtrans-68.3-43.2174-173.3-167.4-62.900111.5D77 A82 I83D77-M79 PolarHBondContact O-N 2.83Å; D77-M79 WeakPolarHBondContact OD1-CB 3.34Å; D77-M79 PolarHBondContact OD1-N 2.83Å; M79-A82 PolarHBondContact O-N 2.76Å; M79-I83 HydrophobicContact CG-CD1 3.96Å; M79-I83 VanDerWaalsContact O-CG1 3.28Å; M79-I83 WeakPolarHBondContact O-CG1 3.39Å; M79-I83 PolarHBondContact O-N 2.85Å; M79-I83 VanDerWaalsContact O-N 3.1Å; M79-I83 HydrophobicContact SD-CD1 4.47Å
80E83.8Confident76.3Confident51 Ų5187.7 Ų87.724%0.23846%0.455CS..Hα-helixtrans-67.5-37.5-178.9-172.4164.6-127.400111.4D77 I83 L84 I125D77-E80 HydrophobicContact CB-CB 3.98Å; D77-E80 WeakPolarHBondContact O-CB 3.47Å; D77-E80 PolarHBondContact O-N 2.72Å; E80-I83 PolarHBondContact O-N 2.92Å; E80-L84 WeakPolarHBondContact O-CB 3.32Å; E80-L84 PolarHBondContact O-N 3.5Å; E80-I125 HydrophobicContact CG-CD1 3.59Å
81E88.2Confident78.6Confident128 Ų12882.4 Ų82.460%0.59842%0.423SS*.Hα-helixtrans-61.3-44.4172.9-173.6-176.9178.900112.1D77 I83 L84 K85D77-E81 PolarHBondContact O-N 3.23Å; D77-E81 VanDerWaalsContact O-N 3.11Å; E81-I83 VanDerWaalsContact C-N 3.35Å; E81-I83 PolarHBondContact O-N 3.23Å; E81-L84 WeakPolarHBondContact O-CB 3.37Å; E81-L84 PolarHBondContact O-N 2.92Å; E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 2.95Å
82A91.7Very high81Confident61 Ų6177.6 Ų77.650%0.50440%0.397SS..Hα-helixtrans-62.4-43.3178.700000111.8P78 M79 K85 E86P78-A82 PolarHBondContact O-N 2.92Å; M79-A82 PolarHBondContact O-N 2.76Å; A82-K85 PolarHBondContact O-N 3.41Å; A82-E86 PolarHBondContact O-N 2.77Å
83I93.1Very high82.9Confident30 Ų3076 Ų7615%0.15438%0.382CS..Hα-helixtrans-65.7-43.8178.1-67168.2000110.4M79 E80 E81 K85 E86 V87 L135 R136 V158M79-I83 HydrophobicContact CG-CD1 3.96Å; M79-I83 VanDerWaalsContact O-CG1 3.28Å; M79-I83 WeakPolarHBondContact O-CG1 3.39Å; M79-I83 PolarHBondContact O-N 2.85Å; M79-I83 VanDerWaalsContact O-N 3.1Å; M79-I83 HydrophobicContact SD-CD1 4.47Å; E80-I83 PolarHBondContact O-N 2.92Å; E81-I83 VanDerWaalsContact C-N 3.35Å; E81-I83 PolarHBondContact O-N 3.23Å; I83-K85 VanDerWaalsContact C-N 3.31Å; I83-K85 PolarHBondContact O-N 3.2Å; I83-E86 PolarHBondContact O-N 2.87Å; I83-V87 HydrophobicContact CG2-CG2 4.31Å; I83-V87 WeakPolarHBondContact O-CB 3.46Å; I83-V87 VanDerWaalsContact O-CG2 3.31Å; I83-V87 WeakPolarHBondContact O-CG2 3.34Å; I83-V87 PolarHBondContact O-N 2.94Å; I83-L135 HydrophobicContact CG2-CD2 4.27Å; I83-R136 HydrophobicContact CD1-CG 3.5Å; I83-R136 HydrophobicContact CG2-CG 4.49Å; I83-V158 HydrophobicContact CG2-CG1 3.58Å
84L95Very high84.8Confident33 Ų3371.7 Ų71.717%0.17336%0.361CS..Hα-helixtrans-55.6-49.5175.9179.660.7000111.3E80 E81 E86 V87 V88 G121 I125 L135E80-L84 WeakPolarHBondContact O-CB 3.32Å; E80-L84 PolarHBondContact O-N 3.5Å; E81-L84 WeakPolarHBondContact O-CB 3.37Å; E81-L84 PolarHBondContact O-N 2.92Å; L84-E86 VanDerWaalsContact C-N 3.32Å; L84-E86 PolarHBondContact O-N 3.5Å; L84-V87 PolarHBondContact O-N 3.03Å; L84-V88 HydrophobicContact CD1-CG2 4.14Å; L84-V88 HydrophobicContact CG-CG2 4.47Å; L84-V88 WeakPolarHBondContact O-CB 3.06Å; L84-V88 WeakPolarHBondContact O-CG2 3.35Å; L84-V88 PolarHBondContact O-N 2.87Å; L84-G121 WeakPolarHBondContact CD1-O 3.39Å; L84-I125 HydrophobicContact CB-CD1 4.26Å; L84-I125 HydrophobicContact CB-CG1 4.47Å; L84-I125 HydrophobicContact CD1-CD1 4.1Å; L84-I125 HydrophobicContact CD1-CG1 3.77Å; L84-I125 HydrophobicContact CD2-CD1 4.41Å; L84-I125 HydrophobicContact CD2-CG1 3.75Å; L84-I125 HydrophobicContact CG-CD1 4.49Å; L84-I125 HydrophobicContact CG-CG1 4.19Å; L84-L135 HydrophobicContact CB-CD2 4.45Å; L84-L135 HydrophobicContact CD1-CD2 4.02Å
85K94.8Very high86.7Confident131 Ų13164.8 Ų64.857%0.5733%0.325SS*.Hα-helixtrans-58.8-45.1179.3-175.3-177.4175.7-61.60111.3E81 A82 I83 V88 D89E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 2.95Å; A82-K85 PolarHBondContact O-N 3.41Å; I83-K85 VanDerWaalsContact C-N 3.31Å; I83-K85 PolarHBondContact O-N 3.2Å; K85-V88 PolarHBondContact O-N 3.05Å; K85-D89 IonicContact NZ-OD2 3.01Å; K85-D89 PolarHBondContact NZ-OD2 2.91Å; K85-D89 WeakPolarHBondContact O-CB 3.4Å; K85-D89 PolarHBondContact O-N 2.86Å
86E95Very high88.5Confident94 Ų9461.5 Ų61.544%0.43931%0.307SS..Hα-helixtrans-62.8-44.5177.9-175.7175.5-175.900112.4L34 A82 I83 L84 D89 L90L34-E86 WeakPolarHBondContact CD2-OE1 3.34Å; A82-E86 PolarHBondContact O-N 2.77Å; I83-E86 PolarHBondContact O-N 2.87Å; L84-E86 VanDerWaalsContact C-N 3.32Å; L84-E86 PolarHBondContact O-N 3.5Å; E86-D89 PolarHBondContact O-N 3.39Å; E86-L90 HydrophobicContact CG-CD1 4.18Å; E86-L90 WeakPolarHBondContact O-CB 3.49Å; E86-L90 WeakPolarHBondContact O-CG 3.49Å; E86-L90 PolarHBondContact O-N 2.79Å
87V95.9Very high89.9Confident4 Ų460.9 Ų60.92%0.02431%0.306CS..Hα-helixtrans-61.1-47.1177.51680000111I83 L84 D89 L90 I91 L124 L135 I140 L156 V158I83-V87 HydrophobicContact CG2-CG2 4.31Å; I83-V87 WeakPolarHBondContact O-CB 3.46Å; I83-V87 VanDerWaalsContact O-CG2 3.31Å; I83-V87 WeakPolarHBondContact O-CG2 3.34Å; I83-V87 PolarHBondContact O-N 2.94Å; L84-V87 PolarHBondContact O-N 3.03Å; V87-D89 VanDerWaalsContact C-N 3.35Å; V87-D89 PolarHBondContact O-N 2.85Å; V87-L90 WeakPolarHBondContact O-CB 3.35Å; V87-L90 PolarHBondContact O-N 3.05Å; V87-I91 HydrophobicContact CG1-CD1 3.91Å; V87-I91 WeakPolarHBondContact O-CG1 3.5Å; V87-I91 PolarHBondContact O-N 2.73Å; V87-L124 HydrophobicContact CG1-CD1 4.09Å; V87-L135 HydrophobicContact CG2-CD2 4.36Å; V87-I140 HydrophobicContact CG1-CD1 3.47Å; V87-I140 VanDerWaalsContact CG1-CD1 3.47Å; V87-L156 HydrophobicContact CG1-CD2 4.26Å; V87-L156 HydrophobicContact CG2-CD2 4.38Å; V87-V158 HydrophobicContact CG2-CB 4.4Å; V87-V158 HydrophobicContact CG2-CG1 3.74Å; V87-V158 HydrophobicContact CG2-CG2 4Å
88V96.3Very high90.6Very high22 Ų2257.2 Ų57.213%0.13329%0.287CS..Hα-helixtrans-64.1-41178172.30000111L84 K85 L90 I91 A92 L117L84-V88 HydrophobicContact CD1-CG2 4.14Å; L84-V88 HydrophobicContact CG-CG2 4.47Å; L84-V88 WeakPolarHBondContact O-CB 3.06Å; L84-V88 WeakPolarHBondContact O-CG2 3.35Å; L84-V88 PolarHBondContact O-N 2.87Å; K85-V88 PolarHBondContact O-N 3.05Å; V88-L90 VanDerWaalsContact C-N 3.32Å; V88-L90 PolarHBondContact O-N 2.81Å; V88-I91 PolarHBondContact O-N 2.79Å; V88-A92 WeakPolarHBondContact O-CB 3.32Å; V88-A92 PolarHBondContact O-N 3.03Å; V88-L117 HydrophobicContact CG1-CB 3.77Å; V88-L117 HydrophobicContact CG1-CD2 4.3Å; V88-L117 HydrophobicContact CG1-CG 4.42Å
89D95.1Very high90.6Very high65 Ų6555.8 Ų55.835%0.34827%0.27SS..Hα-helixtrans-62.3-38.3174.6-80.3-28.5000111.7K85 E86 V87 R93K85-D89 IonicContact NZ-OD2 3.01Å; K85-D89 PolarHBondContact NZ-OD2 2.91Å; K85-D89 WeakPolarHBondContact O-CB 3.4Å; K85-D89 PolarHBondContact O-N 2.86Å; E86-D89 PolarHBondContact O-N 3.39Å; V87-D89 VanDerWaalsContact C-N 3.35Å; V87-D89 PolarHBondContact O-N 2.85Å; D89-R93 WeakPolarHBondContact O-CB 3.19Å; D89-R93 VanDerWaalsContact O-CG 3.32Å; D89-R93 WeakPolarHBondContact O-CG 3.35Å; D89-R93 PolarHBondContact O-N 3.24Å; D89-R93 PolarHBondContact O-NE 2.78Å
90L94.5Very high90Very high15 Ų1555.6 Ų55.68%0.07927%0.271CS..Hα-helixtrans-65.8-45.6174.4-87.3162.8000112.3E86 V87 V88 A92 R93 S94 L156E86-L90 HydrophobicContact CG-CD1 4.18Å; E86-L90 WeakPolarHBondContact O-CB 3.49Å; E86-L90 WeakPolarHBondContact O-CG 3.49Å; E86-L90 PolarHBondContact O-N 2.79Å; V87-L90 WeakPolarHBondContact O-CB 3.35Å; V87-L90 PolarHBondContact O-N 3.05Å; V88-L90 VanDerWaalsContact C-N 3.32Å; V88-L90 PolarHBondContact O-N 2.81Å; L90-A92 VanDerWaalsContact C-N 3.35Å; L90-R93 VanDerWaalsContact CD2-NH1 3.31Å; L90-R93 VanDerWaalsContact CD2-NH2 3.31Å; L90-R93 VanDerWaalsContact CG-NH2 3.25Å; L90-R93 PolarHBondContact O-N 2.87Å; L90-S94 WeakPolarHBondContact O-CB 3.46Å; L90-S94 PolarHBondContact O-N 3.3Å; L90-S94 PolarHBondContact O-OG 3.33Å; L90-L156 HydrophobicContact CB-CD2 4.05Å; L90-L156 HydrophobicContact CD1-CD1 3.89Å; L90-L156 HydrophobicContact CD1-CD2 3.85Å
91I95Very high88.6Confident5 Ų555.9 Ų55.93%0.02628%0.279CS..Hα-helixtrans-59.3-49.6176.2-70.3165.3000109.4V87 V88 R93 S94 L95 I120 L124 L142 L170V87-I91 HydrophobicContact CG1-CD1 3.91Å; V87-I91 WeakPolarHBondContact O-CG1 3.5Å; V87-I91 PolarHBondContact O-N 2.73Å; V88-I91 PolarHBondContact O-N 2.79Å; I91-R93 VanDerWaalsContact C-N 3.31Å; I91-R93 PolarHBondContact O-N 3.38Å; I91-S94 PolarHBondContact O-N 3.5Å; I91-L95 HydrophobicContact CG2-CD1 3.94Å; I91-L95 WeakPolarHBondContact O-CG 3.09Å; I91-L95 PolarHBondContact O-N 2.99Å; I91-I120 HydrophobicContact CD1-CG2 4.26Å; I91-L124 HydrophobicContact CD1-CD1 3.96Å; I91-L142 HydrophobicContact CG2-CD1 4.23Å; I91-L142 HydrophobicContact CG2-CD2 4.32Å; I91-L170 HydrophobicContact CD1-CD2 4Å; I91-L170 HydrophobicContact CG2-CD2 4.29Å
92A93.8Very high87.5Confident2 Ų257.2 Ų57.22%0.01729%0.29CS..Hα-helixtrans-61.5-39.3-179.300000112.1V88 L90 R96 L117V88-A92 WeakPolarHBondContact O-CB 3.32Å; V88-A92 PolarHBondContact O-N 3.03Å; L90-A92 VanDerWaalsContact C-N 3.35Å; A92-R96 VanDerWaalsContact C-CZ 3.5Å; A92-R96 WeakPolarHBondContact O-CG 3.07Å; A92-R96 VanDerWaalsContact O-CZ 3.25Å; A92-R96 PolarHBondContact O-N 3.15Å; A92-R96 PolarHBondContact O-NE 3.43Å; A92-R96 PolarHBondContact O-NH1 2.89Å; A92-L117 HydrophobicContact CB-CD1 3.71Å; A92-L117 HydrophobicContact CB-CD2 4.11Å
93R91.4Very high86.2Confident93 Ų9355.6 Ų55.635%0.35128%0.275SS..Hα-helixtrans-64.9-48.2173.6-78.7-177.6-75.3124.4-14.1111.9D89 L90 I91 L95 R96 E97D89-R93 WeakPolarHBondContact O-CB 3.19Å; D89-R93 VanDerWaalsContact O-CG 3.32Å; D89-R93 WeakPolarHBondContact O-CG 3.35Å; D89-R93 PolarHBondContact O-N 3.24Å; D89-R93 PolarHBondContact O-NE 2.78Å; L90-R93 VanDerWaalsContact CD2-NH1 3.31Å; L90-R93 VanDerWaalsContact CD2-NH2 3.31Å; L90-R93 VanDerWaalsContact CG-NH2 3.25Å; L90-R93 PolarHBondContact O-N 2.87Å; I91-R93 VanDerWaalsContact C-N 3.31Å; I91-R93 PolarHBondContact O-N 3.38Å; R93-L95 VanDerWaalsContact C-N 3.27Å; R93-L95 PolarHBondContact O-N 3.19Å; R93-R96 PolarHBondContact O-N 3.47Å; R93-E97 WeakPolarHBondContact O-CG 3.42Å; R93-E97 PolarHBondContact O-N 3.5Å
94S90.4Very high85.2Confident34 Ų3454.9 Ų54.924%0.23827%0.274CS..Hα-helixtrans-57.3-41.6-180-57.30000111.5L90 I91 R96 E97 A98L90-S94 WeakPolarHBondContact O-CB 3.46Å; L90-S94 PolarHBondContact O-N 3.3Å; L90-S94 PolarHBondContact O-OG 3.33Å; I91-S94 PolarHBondContact O-N 3.5Å; S94-R96 PolarHBondContact O-N 3.11Å; S94-E97 PolarHBondContact O-N 3.08Å; S94-A98 VanDerWaalsContact O-CB 3.32Å; S94-A98 WeakPolarHBondContact O-CB 2.7Å; S94-A98 PolarHBondContact O-N 2.76Å
95L90.5Very high84.4Confident0 Ų053.6 Ų53.60%027%0.267CS..Hα-helixtrans-64.3-39.9175.5-69.5167.7000113.1I91 R93 E97 A98 L110 I112 L142 V144 L172 L203I91-L95 HydrophobicContact CG2-CD1 3.94Å; I91-L95 WeakPolarHBondContact O-CG 3.09Å; I91-L95 PolarHBondContact O-N 2.99Å; R93-L95 VanDerWaalsContact C-N 3.27Å; R93-L95 PolarHBondContact O-N 3.19Å; L95-E97 VanDerWaalsContact C-N 3.34Å; L95-A98 PolarHBondContact O-N 2.87Å; L95-L110 HydrophobicContact CB-CD2 3.86Å; L95-L110 VanDerWaalsContact O-CD2 3.27Å; L95-L110 WeakPolarHBondContact O-CD2 3.4Å; L95-I112 HydrophobicContact CB-CD1 3.97Å; L95-I112 HydrophobicContact CD1-CD1 4.11Å; L95-L142 HydrophobicContact CD2-CD2 4.13Å; L95-L142 HydrophobicContact CG-CD2 4.18Å; L95-V144 HydrophobicContact CD2-CG2 4.18Å; L95-L172 HydrophobicContact CD1-CD1 3.65Å; L95-L172 HydrophobicContact CD2-CD1 3.59Å; L95-L172 HydrophobicContact CG-CD1 4.2Å; L95-L203 HydrophobicContact CD1-CD1 4Å
96R88.2Confident83.6Confident124 Ų12456.2 Ų56.247%0.46827%0.273SS..Hα-helixtrans-68.3-34.5178-74-175.4-66.6-93.47112.5A92 R93 S94 K99 I112A92-R96 VanDerWaalsContact C-CZ 3.5Å; A92-R96 WeakPolarHBondContact O-CG 3.07Å; A92-R96 VanDerWaalsContact O-CZ 3.25Å; A92-R96 PolarHBondContact O-N 3.15Å; A92-R96 PolarHBondContact O-NE 3.43Å; A92-R96 PolarHBondContact O-NH1 2.89Å; R93-R96 PolarHBondContact O-N 3.47Å; S94-R96 PolarHBondContact O-N 3.11Å; R96-K99 WeakPolarHBondContact O-CB 3.33Å; R96-I112 HydrophobicContact CG-CD1 4.42Å
97E85.7Confident82.8Confident107 Ų10751.9 Ų51.950%0.525%0.253SS..Hα-helixtrans-75.2-31.6176.5-68.8175.8-174.200111.8R93 S94 L95 K99 D100R93-E97 WeakPolarHBondContact O-CG 3.42Å; R93-E97 PolarHBondContact O-N 3.5Å; S94-E97 PolarHBondContact O-N 3.08Å; L95-E97 VanDerWaalsContact C-N 3.34Å; E97-K99 PolarHBondContact O-N 2.84Å; E97-D100 PolarHBondContact O-N 2.98Å
98A83.8Confident82Confident2 Ų255.3 Ų55.32%0.01727%0.274CS..THydrogen-bonded Turntrans-68.10.7179.800000115.7S94 L95 C103 L105 I153S94-A98 VanDerWaalsContact O-CB 3.32Å; S94-A98 WeakPolarHBondContact O-CB 2.7Å; S94-A98 PolarHBondContact O-N 2.76Å; L95-A98 PolarHBondContact O-N 2.87Å; A98-C103 VanDerWaalsContact CA-SG 3.52Å; A98-C103 WeakPolarHBondContact O-CB 3.38Å; A98-L105 HydrophobicContact CB-CD1 4.08Å; A98-L105 HydrophobicContact CB-CG 4.3Å; A98-L105 WeakPolarHBondContact O-CB 3.38Å; A98-L105 PolarHBondContact O-N 2.81Å; A98-I153 HydrophobicContact CB-CD1 4.12Å; A98-I153 HydrophobicContact CB-CG2 3.69Å
99K78.3Confident81.4Confident67 Ų6760 Ų6029%0.29129%0.293SS..THydrogen-bonded Turntrans-74.2-33.1-179.8178.7-17685.4-171.60113.3R96 E97 C107 T108R96-K99 WeakPolarHBondContact O-CB 3.33Å; E97-K99 PolarHBondContact O-N 2.84Å; K99-C107 WeakPolarHBondContact CG-O 3.46Å; K99-C107 PolarHBondContact O-N 2.97Å; K99-C107 VanDerWaalsContact O-N 3.14Å; K99-T108 WeakPolarHBondContact CD-O 3.35Å
100D70.4Confident81.1Confident99 Ų9958 Ų5853%0.52928%0.281SS..SBendtrans-64.5157-167.8-71.6-17.5000112.9E97 D102 C103E97-D100 PolarHBondContact O-N 2.98Å; D100-D102 PolarHBondContact O-N 2.86Å; D100-C103 WeakPolarHBondContact O-CA 3.27Å; D100-C103 WeakPolarHBondContact O-CB 3.46Å; D100-C103 PolarHBondContact O-N 2.87Å
101S54.4Low81Confident57 Ų5760.7 Ų60.740%0.39930%0.296SS..THydrogen-bonded Turntrans-61.3-21.4-16735.30000115.9C103S101-C103 VanDerWaalsContact C-N 3.35Å
102D63.7Low80.8Confident157 Ų15762.5 Ų62.584%0.8431%0.305SS*.THydrogen-bonded Turntrans-933.5176.9-62.4-42.4000112.8D100D100-D102 PolarHBondContact O-N 2.86Å
103C65.4Low80.8Confident27 Ų2763.4 Ų63.418%0.18231%0.311CS..SBendtrans-114.3175-174.7-151.80000112.9A98 D100 S101 L105 R106A98-C103 VanDerWaalsContact CA-SG 3.52Å; A98-C103 WeakPolarHBondContact O-CB 3.38Å; D100-C103 WeakPolarHBondContact O-CA 3.27Å; D100-C103 WeakPolarHBondContact O-CB 3.46Å; D100-C103 PolarHBondContact O-N 2.87Å; S101-C103 VanDerWaalsContact C-N 3.35Å; C103-L105 PolarHBondContact O-N 3.49Å; C103-R106 VanDerWaalsContact O-CG 3.25Å; C103-R106 WeakPolarHBondContact O-CG 3.26Å
104A72.3Confident80.5Confident15 Ų1567.6 Ų67.612%0.12433%0.334CS..THydrogen-bonded Turntrans-61.1-34.2-166.100000115.6Q146 E151 I153A104-Q146 PolarHBondContact O-NE2 3.47Å; A104-E151 HydrophobicContact CB-CB 4.03Å; A104-I153 HydrophobicContact CB-CD1 3.56Å
105L78.3Confident80.6Confident5 Ų572.5 Ų72.53%0.02635%0.351CS..THydrogen-bonded Turntrans-94.1-19.8-171-58.6179000114.3A98 C103 C107 L110 V144 I153 L201A98-L105 HydrophobicContact CB-CD1 4.08Å; A98-L105 HydrophobicContact CB-CG 4.3Å; A98-L105 WeakPolarHBondContact O-CB 3.38Å; A98-L105 PolarHBondContact O-N 2.81Å; C103-L105 PolarHBondContact O-N 3.49Å; L105-C107 VanDerWaalsContact C-N 3.26Å; L105-C107 PolarHBondContact O-N 2.77Å; L105-C107 VanDerWaalsContact O-N 3.1Å; L105-L110 HydrophobicContact CD1-CD1 4.24Å; L105-L110 HydrophobicContact CD1-CD2 3.88Å; L105-V144 HydrophobicContact CD2-CB 3.8Å; L105-V144 HydrophobicContact CD2-CG1 3.66Å; L105-V144 HydrophobicContact CD2-CG2 3.96Å; L105-I153 HydrophobicContact CD2-CD1 4.19Å; L105-I153 HydrophobicContact CG-CD1 4.18Å; L105-L201 HydrophobicContact CB-CD1 4.45Å; L105-L201 WeakPolarHBondContact O-CD1 3.46Å
106R76.6Confident80.8Confident187 Ų18772.5 Ų72.571%0.70635%0.352SS*.  trans4544.4175.6-57-175.5177.2174.72.1114.4C103C103-R106 VanDerWaalsContact O-CG 3.25Å; C103-R106 WeakPolarHBondContact O-CG 3.26Å
107C78.3Confident81.2Confident2 Ų268.2 Ų68.21%0.01434%0.338CS..  trans-117.9165.9-176.2650000112.3K99 L105 Q199 L201K99-C107 WeakPolarHBondContact CG-O 3.46Å; K99-C107 PolarHBondContact O-N 2.97Å; K99-C107 VanDerWaalsContact O-N 3.14Å; L105-C107 VanDerWaalsContact C-N 3.26Å; L105-C107 PolarHBondContact O-N 2.77Å; L105-C107 VanDerWaalsContact O-N 3.1Å; C107-Q199 WeakPolarHBondContact CB-O 3.28Å; C107-L201 HydrophobicContact CB-CB 4.28Å; C107-L201 HydrophobicContact CB-CD1 3.62Å; C107-L201 HydrophobicContact CB-CG 3.63Å
108T79.5Confident81.6Confident76 Ų7668.3 Ų68.347%0.46634%0.338SS..SBendtrans-92.5-26174.441.80000112.5K99 R198 Q199K99-T108 WeakPolarHBondContact CD-O 3.35Å; T108-R198 HydrophobicContact CG2-CB 3.43Å; T108-R198 VanDerWaalsContact CG2-CB 3.43Å; T108-R198 HydrophobicContact CG2-CG 4.32Å; T108-R198 PolarHBondContact OG1-O 3.06Å; T108-Q199 PolarHBondContact N-O 3.01Å
109K84.5Confident82.2Confident122 Ų12272 Ų7253%0.5336%0.355SS..EExtended strand (participates in β ladder)trans-148133.1-178.6-172174.6-172.4-178.60108.8L111 A200 L201K109-L111 HydrophobicContact CD-CD2 4.19Å; K109-L111 HydrophobicContact CG-CD2 4.29Å; K109-A200 HydrophobicContact CB-CB 4.01Å; K109-A200 CarbonylContact O-C 3.5Å; K109-A200 WeakPolarHBondContact O-CA 3.42Å; K109-L201 PolarHBondContact O-N 3.16Å
110L88.6Confident83.1Confident21 Ų2168.9 Ų68.911%0.1134%0.341CS..EExtended strand (participates in β ladder)trans-112126171-174.567000108.5L95 L105 I112 L201 L203L95-L110 HydrophobicContact CB-CD2 3.86Å; L95-L110 VanDerWaalsContact O-CD2 3.27Å; L95-L110 WeakPolarHBondContact O-CD2 3.4Å; L105-L110 HydrophobicContact CD1-CD1 4.24Å; L105-L110 HydrophobicContact CD1-CD2 3.88Å; L110-I112 HydrophobicContact CD2-CD1 4.38Å; L110-I112 HydrophobicContact CD2-CG1 4.25Å; L110-I112 HydrophobicContact CG-CG1 4.27Å; L110-L201 CarbonylContact C-O 3.53Å; L110-L201 WeakPolarHBondContact CA-O 3.33Å; L110-L201 HydrophobicContact CD1-CB 4.01Å; L110-L203 HydrophobicContact CD1-CD2 4.13Å; L110-L203 HydrophobicContact CD1-CG 4.16Å
111L91.2Very high84.3Confident72 Ų7264.3 Ų64.338%0.37732%0.317SS..EExtended strand (participates in β ladder)trans-100.1119.7173.8-58.1177.3000108.6K109 L201 K202 L203K109-L111 HydrophobicContact CD-CD2 4.19Å; K109-L111 HydrophobicContact CG-CD2 4.29Å; L111-L201 PolarHBondContact N-O 3.05Å; L111-K202 HydrophobicContact CB-CB 3.98Å; L111-K202 HydrophobicContact CB-CD 4.29Å; L111-K202 HydrophobicContact CB-CG 4Å; L111-K202 HydrophobicContact CD1-CB 4.29Å; L111-K202 HydrophobicContact CD1-CD 4.25Å; L111-K202 WeakPolarHBondContact O-CA 3.41Å; L111-L203 PolarHBondContact O-N 3.41Å
112I92.8Very high86.2Confident43 Ų4366.8 Ų66.822%0.22132%0.323CS..  trans-107.6117177.4-54.9178.8000106.8L95 R96 L110 L116 L117 L203L95-I112 HydrophobicContact CB-CD1 3.97Å; L95-I112 HydrophobicContact CD1-CD1 4.11Å; R96-I112 HydrophobicContact CG-CD1 4.42Å; L110-I112 HydrophobicContact CD2-CD1 4.38Å; L110-I112 HydrophobicContact CD2-CG1 4.25Å; L110-I112 HydrophobicContact CG-CG1 4.27Å; I112-L116 HydrophobicContact CG2-CD2 4.37Å; I112-L117 HydrophobicContact CG2-CD1 4.1Å; I112-L117 HydrophobicContact CG2-CD2 4.24Å; I112-L117 HydrophobicContact CG2-CG 3.93Å; I112-L203 HydrophobicContact CB-CD1 4.5Å; I112-L203 HydrophobicContact CG1-CD1 3.99Å; I112-L203 HydrophobicContact CG2-CD1 4.3Å
113P92.9Very high87.8Confident22 Ų2260.5 Ų60.514%0.14329%0.289CS..  trans-58.9137173.4-22.132.4000111.1K115 L116 L203 T205P113-K115 PolarHBondContact O-N 3.12Å; P113-L116 HydrophobicContact CB-CB 4.04Å; P113-L116 HydrophobicContact CG-CB 4.39Å; P113-L116 VanDerWaalsContact O-CB 3.3Å; P113-L116 WeakPolarHBondContact O-CB 3.17Å; P113-L116 PolarHBondContact O-N 2.75Å; P113-L116 VanDerWaalsContact O-N 3.12Å; P113-L203 VanDerWaalsContact CG-O 3.28Å; P113-L203 WeakPolarHBondContact CG-O 3.47Å; P113-T205 HydrophobicContact CB-CG2 3.94Å; P113-T205 HydrophobicContact CG-CG2 4.04Å
114E85.4Confident89.3Confident180 Ų18059.2 Ų59.284%0.84128%0.28SS*.Hα-helixtrans-58-48.5-176.3-173.1173.5-170.900112.1L116 L117E114-L116 PolarHBondContact O-N 3.19Å; E114-L117 PolarHBondContact O-N 3.33Å
115K92.1Very high90.4Very high137 Ų13759.8 Ų59.860%0.59628%0.281SS*.Hα-helixtrans-67.7-17.3178.9-61.2-166.6174.4-162.60114.7P113 H119P113-K115 PolarHBondContact O-N 3.12Å; K115-H119 VanDerWaalsContact O-CG 3.24Å; K115-H119 PolarHBondContact O-N 2.77Å; K115-H119 VanDerWaalsContact O-N 3.09Å; K115-H119 PolarHBondContact O-ND1 2.77Å
116L95Very high91.2Very high1 Ų165.1 Ų65.11%0.00531%0.305CS..Hα-helixtrans-64.7-45.1-179.6173.263.5000110.5I112 P113 E114 E118 H119 I120 L172 L203 S204 F207I112-L116 HydrophobicContact CG2-CD2 4.37Å; P113-L116 HydrophobicContact CB-CB 4.04Å; P113-L116 HydrophobicContact CG-CB 4.39Å; P113-L116 VanDerWaalsContact O-CB 3.3Å; P113-L116 WeakPolarHBondContact O-CB 3.17Å; P113-L116 PolarHBondContact O-N 2.75Å; P113-L116 VanDerWaalsContact O-N 3.12Å; E114-L116 PolarHBondContact O-N 3.19Å; L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 3.35Å; L116-H119 PolarHBondContact O-N 2.97Å; L116-I120 HydrophobicContact CD1-CD1 3.84Å; L116-I120 HydrophobicContact CD1-CG1 4.19Å; L116-I120 HydrophobicContact CD2-CD1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.73Å; L116-I120 HydrophobicContact CG-CG1 4.48Å; L116-I120 WeakPolarHBondContact O-CB 3.44Å; L116-I120 WeakPolarHBondContact O-CD1 3.38Å; L116-I120 WeakPolarHBondContact O-CG1 3.3Å; L116-I120 PolarHBondContact O-N 2.87Å; L116-L172 HydrophobicContact CD1-CD2 4.5Å; L116-L172 HydrophobicContact CD2-CD2 4.49Å; L116-L203 HydrophobicContact CD2-CB 3.8Å; L116-L203 HydrophobicContact CD2-CD1 3.86Å; L116-L203 HydrophobicContact CD2-CG 4.49Å; L116-S204 WeakPolarHBondContact CD2-O 3.37Å; L116-F207 HydrophobicContact CD1-CB 4.36Å; L116-F207 HydrophobicContact CD1-CD1 3.65Å; L116-F207 HydrophobicContact CD1-CE1 4.36Å; L116-F207 HydrophobicContact CD1-CG 4.28Å
117L95.3Very high92.1Very high33 Ų3356.5 Ų56.517%0.17327%0.273CS..Hα-helixtrans-67.4-36.2-178.5-68.4177000112.1V88 A92 I112 E114 I120 G121V88-L117 HydrophobicContact CG1-CB 3.77Å; V88-L117 HydrophobicContact CG1-CD2 4.3Å; V88-L117 HydrophobicContact CG1-CG 4.42Å; A92-L117 HydrophobicContact CB-CD1 3.71Å; A92-L117 HydrophobicContact CB-CD2 4.11Å; I112-L117 HydrophobicContact CG2-CD1 4.1Å; I112-L117 HydrophobicContact CG2-CD2 4.24Å; I112-L117 HydrophobicContact CG2-CG 3.93Å; E114-L117 PolarHBondContact O-N 3.33Å; L117-I120 HydrophobicContact CD2-CD1 4.45Å; L117-G121 PolarHBondContact O-N 3.5Å
118E94.5Very high92.9Very high109 Ų10956.4 Ų56.451%0.50927%0.272SS..Hα-helixtrans-61.5-52.4174.3-176-175.917300111.3L116 I120 G121 Q122L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 3.35Å; E118-I120 VanDerWaalsContact C-N 3.33Å; E118-I120 PolarHBondContact O-N 3.34Å; E118-G121 PolarHBondContact O-N 3.01Å; E118-G121 VanDerWaalsContact O-N 3.09Å; E118-Q122 PolarHBondContact O-N 3.31Å
119H96.2Very high93.5Very high80 Ų8056.4 Ų56.437%0.3728%0.28SS..Hα-helixtrans-64.5-37.5178.9-61.6164.4000112.3K115 L116 G121 Q122 E123 F207K115-H119 VanDerWaalsContact O-CG 3.24Å; K115-H119 PolarHBondContact O-N 2.77Å; K115-H119 VanDerWaalsContact O-N 3.09Å; K115-H119 PolarHBondContact O-ND1 2.77Å; L116-H119 PolarHBondContact O-N 2.97Å; H119-G121 VanDerWaalsContact C-N 3.29Å; H119-G121 PolarHBondContact O-N 2.89Å; H119-Q122 PolarHBondContact O-N 2.93Å; H119-E123 WeakPolarHBondContact O-CB 3.36Å; H119-E123 PolarHBondContact O-N 3.44Å; H119-F207 HydrophobicContact CB-CE1 3.77Å; H119-F207 HydrophobicContact CB-CZ 4.1Å
120I97Very high93.9Very high1 Ų154.8 Ų54.81%0.00528%0.284CS..Hα-helixtrans-57.8-47172.3-73.2163.6000109.7I91 L116 L117 E118 Q122 E123 L124 L170 L172 F207I91-I120 HydrophobicContact CD1-CG2 4.26Å; L116-I120 HydrophobicContact CD1-CD1 3.84Å; L116-I120 HydrophobicContact CD1-CG1 4.19Å; L116-I120 HydrophobicContact CD2-CD1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.73Å; L116-I120 HydrophobicContact CG-CG1 4.48Å; L116-I120 WeakPolarHBondContact O-CB 3.44Å; L116-I120 WeakPolarHBondContact O-CD1 3.38Å; L116-I120 WeakPolarHBondContact O-CG1 3.3Å; L116-I120 PolarHBondContact O-N 2.87Å; L117-I120 HydrophobicContact CD2-CD1 4.45Å; E118-I120 VanDerWaalsContact C-N 3.33Å; E118-I120 PolarHBondContact O-N 3.34Å; I120-Q122 PolarHBondContact O-N 3.25Å; I120-E123 PolarHBondContact O-N 3.44Å; I120-L124 HydrophobicContact CG2-CD1 3.84Å; I120-L124 HydrophobicContact CG2-CG 4.18Å; I120-L124 VanDerWaalsContact O-CG 3.23Å; I120-L124 WeakPolarHBondContact O-CG 3.16Å; I120-L124 PolarHBondContact O-N 3.45Å; I120-L170 HydrophobicContact CD1-CD1 4.42Å; I120-L170 HydrophobicContact CD1-CD2 4.31Å; I120-L170 HydrophobicContact CG1-CD1 4.14Å; I120-L170 HydrophobicContact CG2-CD1 4.36Å; I120-L170 HydrophobicContact CG2-CD2 3.71Å; I120-L172 HydrophobicContact CD1-CD2 3.65Å; I120-F207 HydrophobicContact CG1-CD1 4.13Å; I120-F207 HydrophobicContact CG1-CD2 3.95Å; I120-F207 HydrophobicContact CG1-CE1 4.12Å; I120-F207 HydrophobicContact CG1-CE2 3.92Å; I120-F207 HydrophobicContact CG1-CG 4.05Å; I120-F207 HydrophobicContact CG1-CZ 4.02Å
121G95.9Very high94.1Very high3 Ų355 Ų553%0.03128%0.284CS..Hα-helixtrans-58.3-49.4179.600000112.4L84 L117 E118 H119 E123 L124 I125L84-G121 WeakPolarHBondContact CD1-O 3.39Å; L117-G121 PolarHBondContact O-N 3.5Å; E118-G121 PolarHBondContact O-N 3.01Å; E118-G121 VanDerWaalsContact O-N 3.09Å; H119-G121 VanDerWaalsContact C-N 3.29Å; H119-G121 PolarHBondContact O-N 2.89Å; G121-E123 VanDerWaalsContact C-N 3.33Å; G121-E123 PolarHBondContact O-N 3.31Å; G121-L124 PolarHBondContact O-N 3.22Å; G121-I125 PolarHBondContact O-N 2.91Å; G121-I125 VanDerWaalsContact O-N 3.12Å
122Q95.4Very high94.1Very high110 Ų11055.2 Ų55.251%0.51429%0.29SS..Hα-helixtrans-57.1-45.9177.9-70.8169.7-13.500112E118 H119 I120 I125 H126E118-Q122 PolarHBondContact O-N 3.31Å; H119-Q122 PolarHBondContact O-N 2.93Å; I120-Q122 PolarHBondContact O-N 3.25Å; Q122-I125 PolarHBondContact O-N 3.23Å; Q122-H126 WeakPolarHBondContact O-CB 3.46Å; Q122-H126 PolarHBondContact O-N 3.46Å
123E96.5Very high94.1Very high25 Ų2557.1 Ų57.112%0.11731%0.306CS..Hα-helixtrans-64.8-41.2179.5-171.360.4-150.100112.3H119 I120 G121 I125 H126 L127 F207 V209 C225H119-E123 WeakPolarHBondContact O-CB 3.36Å; H119-E123 PolarHBondContact O-N 3.44Å; I120-E123 PolarHBondContact O-N 3.44Å; G121-E123 VanDerWaalsContact C-N 3.33Å; G121-E123 PolarHBondContact O-N 3.31Å; E123-I125 PolarHBondContact O-N 3.31Å; E123-H126 PolarHBondContact O-N 2.95Å; E123-L127 HydrophobicContact CG-CD1 4.09Å; E123-L127 WeakPolarHBondContact O-CB 3.28Å; E123-L127 WeakPolarHBondContact O-CG 3.34Å; E123-L127 PolarHBondContact O-N 3.37Å; E123-F207 HydrophobicContact CB-CE2 3.89Å; E123-F207 HydrophobicContact CB-CZ 4Å; E123-F207 HydrophobicContact CG-CE2 3.99Å; E123-F207 HydrophobicContact CG-CZ 4.41Å; E123-V209 HydrophobicContact CB-CG2 4.47Å; E123-V209 HydrophobicContact CG-CB 4.11Å; E123-V209 HydrophobicContact CG-CG2 3.74Å; E123-C225 PolarHBondContact OE1-SG 2.94Å; E123-C225 PolarHBondContact OE2-SG 3.09Å
124L96.7Very high94.2Very high0 Ų056.6 Ų56.60%031%0.305CS..Hα-helixtrans-62.3-42.5178-69.3176.7000111.8V87 I91 I120 G121 A128 L135 I140 L168 V209V87-L124 HydrophobicContact CG1-CD1 4.09Å; I91-L124 HydrophobicContact CD1-CD1 3.96Å; I120-L124 HydrophobicContact CG2-CD1 3.84Å; I120-L124 HydrophobicContact CG2-CG 4.18Å; I120-L124 VanDerWaalsContact O-CG 3.23Å; I120-L124 WeakPolarHBondContact O-CG 3.16Å; I120-L124 PolarHBondContact O-N 3.45Å; G121-L124 PolarHBondContact O-N 3.22Å; L124-A128 WeakPolarHBondContact O-CB 3.38Å; L124-A128 PolarHBondContact O-N 2.95Å; L124-A128 VanDerWaalsContact O-N 3.16Å; L124-L135 HydrophobicContact CB-CD1 4.07Å; L124-I140 HydrophobicContact CD1-CD1 4.18Å; L124-L168 HydrophobicContact CB-CD1 4.49Å; L124-L168 HydrophobicContact CD2-CB 4.21Å; L124-L168 HydrophobicContact CD2-CD1 3.59Å; L124-V209 HydrophobicContact CD2-CG1 4.2Å
125I95.4Very high94.7Very high27 Ų2748.2 Ų48.214%0.13827%0.266CS..Hα-helixtrans-64.4-48.7174.4-69-59.1000110.7E80 L84 G121 Q122 E123 L127 A128 A129 L135E80-I125 HydrophobicContact CG-CD1 3.59Å; L84-I125 HydrophobicContact CB-CD1 4.26Å; L84-I125 HydrophobicContact CB-CG1 4.47Å; L84-I125 HydrophobicContact CD1-CD1 4.1Å; L84-I125 HydrophobicContact CD1-CG1 3.77Å; L84-I125 HydrophobicContact CD2-CD1 4.41Å; L84-I125 HydrophobicContact CD2-CG1 3.75Å; L84-I125 HydrophobicContact CG-CD1 4.49Å; L84-I125 HydrophobicContact CG-CG1 4.19Å; G121-I125 PolarHBondContact O-N 2.91Å; G121-I125 VanDerWaalsContact O-N 3.12Å; Q122-I125 PolarHBondContact O-N 3.23Å; E123-I125 PolarHBondContact O-N 3.31Å; I125-L127 VanDerWaalsContact C-N 3.33Å; I125-L127 PolarHBondContact O-N 3.48Å; I125-A128 PolarHBondContact O-N 3.42Å; I125-A128 VanDerWaalsContact O-N 3.11Å; I125-A129 PolarHBondContact O-N 3.45Å; I125-L135 HydrophobicContact CD1-CB 4.12Å; I125-L135 HydrophobicContact CD1-CD2 3.79Å
126H94.9Very high94.8Very high116 Ų11645.8 Ų45.854%0.53725%0.253SS..Hα-helixtrans-54.7-49.8-178.5-176.467.5000111.9Q122 E123 A128 A129Q122-H126 WeakPolarHBondContact O-CB 3.46Å; Q122-H126 PolarHBondContact O-N 3.46Å; E123-H126 PolarHBondContact O-N 2.95Å; H126-A128 VanDerWaalsContact C-N 3.31Å; H126-A128 PolarHBondContact O-N 3.15Å; H126-A129 PolarHBondContact O-N 3.06Å
127L95.2Very high94.9Very high6 Ų645.9 Ų45.93%0.03125%0.254CS..Hα-helixtrans-66.5-33179.6-71.9174.2000113.2E123 I125 S130 L168 V209 K211 E223E123-L127 HydrophobicContact CG-CD1 4.09Å; E123-L127 WeakPolarHBondContact O-CB 3.28Å; E123-L127 WeakPolarHBondContact O-CG 3.34Å; E123-L127 PolarHBondContact O-N 3.37Å; I125-L127 VanDerWaalsContact C-N 3.33Å; I125-L127 PolarHBondContact O-N 3.48Å; L127-S130 PolarHBondContact O-OG 3.49Å; L127-L168 HydrophobicContact CB-CD2 3.93Å; L127-L168 HydrophobicContact CD1-CD2 4.08Å; L127-V209 HydrophobicContact CD1-CB 3.56Å; L127-V209 HydrophobicContact CD1-CG1 3.37Å; L127-K211 HydrophobicContact CB-CD 4.46Å; L127-K211 WeakPolarHBondContact O-CD 3.49Å; L127-K211 PolarHBondContact O-NZ 3.33Å; L127-E223 HydrophobicContact CD2-CB 4.42Å; L127-E223 WeakPolarHBondContact CD2-OE2 3.44Å
128A95.1Very high95Very high0 Ų044.3 Ų44.30%025%0.246CC..Hα-helixtrans-81.3-22.7-178.400000113.6L124 I125 H126 S130 E131 L135 F166L124-A128 WeakPolarHBondContact O-CB 3.38Å; L124-A128 PolarHBondContact O-N 2.95Å; L124-A128 VanDerWaalsContact O-N 3.16Å; I125-A128 PolarHBondContact O-N 3.42Å; I125-A128 VanDerWaalsContact O-N 3.11Å; H126-A128 VanDerWaalsContact C-N 3.31Å; H126-A128 PolarHBondContact O-N 3.15Å; A128-S130 PolarHBondContact O-N 3.49Å; A128-E131 WeakPolarHBondContact O-CB 3.46Å; A128-E131 PolarHBondContact O-N 3.22Å; A128-L135 HydrophobicContact CB-CB 4.17Å; A128-L135 HydrophobicContact CB-CD1 4.34Å; A128-F166 HydrophobicContact CB-CE2 4.16Å; A128-F166 HydrophobicContact CB-CZ 3.8Å
129A93.1Very high95.1Very high77 Ų7740.1 Ų40.164%0.63623%0.227SC*.THydrogen-bonded Turntrans-58.7-24-17700000114.1I125 H126I125-A129 PolarHBondContact O-N 3.45Å; H126-A129 PolarHBondContact O-N 3.06Å
130S91.9Very high95.2Very high87 Ų8736.4 Ų36.461%0.60821%0.21SC*.THydrogen-bonded Turntrans-91.91.117750.70000114.2L127 A128 K211L127-S130 PolarHBondContact O-OG 3.49Å; A128-S130 PolarHBondContact O-N 3.49Å; S130-K211 PolarHBondContact OG-NZ 3.26Å
131E94.3Very high95.2Very high25 Ų2537.8 Ų37.812%0.11722%0.217CC..SBendtrans-108.3150.7-175.3-60.6-62.2148.900111.8A128 C133 G134 F166 K211A128-E131 WeakPolarHBondContact O-CB 3.46Å; A128-E131 PolarHBondContact O-N 3.22Å; E131-C133 PolarHBondContact O-N 3.12Å; E131-G134 PolarHBondContact O-N 3.09Å; E131-G134 VanDerWaalsContact O-N 3.12Å; E131-F166 HydrophobicContact CB-CD1 3.58Å; E131-F166 HydrophobicContact CB-CE1 3.37Å; E131-F166 HydrophobicContact CB-CE2 4.4Å; E131-F166 HydrophobicContact CB-CG 4.21Å; E131-F166 HydrophobicContact CB-CZ 3.81Å; E131-F166 HydrophobicContact CG-CB 4.47Å; E131-F166 HydrophobicContact CG-CD1 3.72Å; E131-F166 HydrophobicContact CG-CD2 3.97Å; E131-F166 HydrophobicContact CG-CE1 3.82Å; E131-F166 HydrophobicContact CG-CE2 4.03Å; E131-F166 HydrophobicContact CG-CG 3.8Å; E131-F166 HydrophobicContact CG-CZ 3.96Å; E131-K211 HydrophobicContact CG-CD 3.99Å; E131-K211 WeakPolarHBondContact OE1-CE 3.48Å; E131-K211 IonicContact OE1-NZ 2.87Å; E131-K211 PolarHBondContact OE1-NZ 3.16Å
132P91.5Very high95.1Very high78 Ų7838 Ų3851%0.50622%0.218SC..THydrogen-bonded Turntrans-60.9136.6175.126.5-34.4000110.7G134P132-G134 PolarHBondContact O-N 3.41Å
133C92.1Very high95Very high82 Ų8233.2 Ų33.255%0.55420%0.196SC*.THydrogen-bonded Turntrans64.412.6-176.3-52.90000114.8E131 R136 L162E131-C133 PolarHBondContact O-N 3.12Å; C133-R136 WeakPolarHBondContact O-CB 3.36Å; C133-R136 PolarHBondContact O-N 3.33Å; C133-L162 HydrophobicContact CB-CD1 3.95Å
134G94.1Very high94.8Very high12 Ų1232 Ų3212%0.12419%0.191CC..G310 helixtrans55.1-143.1176.200000112.3E131 P132 R136 G137 F166E131-G134 PolarHBondContact O-N 3.09Å; E131-G134 VanDerWaalsContact O-N 3.12Å; P132-G134 PolarHBondContact O-N 3.41Å; G134-R136 PolarHBondContact O-N 3.29Å; G134-R136 VanDerWaalsContact O-N 3.13Å; G134-G137 PolarHBondContact O-N 3.44Å; G134-G137 VanDerWaalsContact O-N 3.1Å; G134-F166 WeakPolarHBondContact O-CE1 3.49Å; G134-F166 WeakPolarHBondContact O-CZ 3.02Å
135L95.8Very high94.5Very high3 Ų334.8 Ų34.82%0.01620%0.204CC..G310 helixtrans-59.3-28.4-178.1-173.561.3000113I83 L84 V87 L124 I125 A128 G137 A138 V158 L168I83-L135 HydrophobicContact CG2-CD2 4.27Å; L84-L135 HydrophobicContact CB-CD2 4.45Å; L84-L135 HydrophobicContact CD1-CD2 4.02Å; V87-L135 HydrophobicContact CG2-CD2 4.36Å; L124-L135 HydrophobicContact CB-CD1 4.07Å; I125-L135 HydrophobicContact CD1-CB 4.12Å; I125-L135 HydrophobicContact CD1-CD2 3.79Å; A128-L135 HydrophobicContact CB-CB 4.17Å; A128-L135 HydrophobicContact CB-CD1 4.34Å; L135-G137 PolarHBondContact O-N 2.9Å; L135-A138 HydrophobicContact CD1-CB 4.32Å; L135-A138 WeakPolarHBondContact O-CB 3.48Å; L135-A138 PolarHBondContact O-N 3.46Å; L135-V158 HydrophobicContact CD1-CG2 4.46Å; L135-V158 HydrophobicContact CG-CG1 4.25Å; L135-V158 HydrophobicContact CG-CG2 4.42Å; L135-V158 WeakPolarHBondContact O-CB 3.41Å; L135-V158 WeakPolarHBondContact O-CG1 3.37Å; L135-V158 WeakPolarHBondContact O-CG2 3.09Å; L135-L168 HydrophobicContact CD1-CD1 4.37Å
136R95.6Very high93.7Very high87 Ų8736.7 Ų36.733%0.32821%0.212SC..G310 helixtrans-62.2-29.5178.7-64.2173.460.7-153.9-2.7113.2I83 C133 G134 A138 D159 L162I83-R136 HydrophobicContact CD1-CG 3.5Å; I83-R136 HydrophobicContact CG2-CG 4.49Å; C133-R136 WeakPolarHBondContact O-CB 3.36Å; C133-R136 PolarHBondContact O-N 3.33Å; G134-R136 PolarHBondContact O-N 3.29Å; G134-R136 VanDerWaalsContact O-N 3.13Å; R136-A138 PolarHBondContact O-N 3.2Å; R136-D159 HydrophobicContact CB-CB 3.96Å; R136-D159 HydrophobicContact CG-CB 4.47Å; R136-D159 IonicContact CZ-OD2 3.12Å; R136-D159 IonicContact NE-OD2 2.75Å; R136-D159 PolarHBondContact NE-OD2 3.43Å; R136-D159 IonicContact NH2-OD2 2.66Å; R136-D159 PolarHBondContact NH2-OD2 3.4Å; R136-D159 WeakPolarHBondContact O-CB 3.38Å; R136-L162 HydrophobicContact CB-CD1 3.74Å
137G95.9Very high92.9Very high2 Ų234.5 Ų34.52%0.02122%0.221CC..G310 helixtrans-77.7-0.8177.300000114.4G134 L135 P164 T165 F166G134-G137 PolarHBondContact O-N 3.44Å; G134-G137 VanDerWaalsContact O-N 3.1Å; L135-G137 PolarHBondContact O-N 2.9Å; G137-P164 CarbonylContact O-C 3.55Å; G137-P164 VanDerWaalsContact O-CA 3.23Å; G137-P164 WeakPolarHBondContact O-CA 3.32Å; G137-T165 PolarHBondContact O-N 3.16Å; G137-F166 VanDerWaalsContact C-CE1 3.46Å
138A97.2Very high91.8Very high0 Ų039.7 Ų39.70%027%0.265CS..EExtended strand (participates in β ladder)trans-87.5141.9-17200000113.6L135 R136 I140 V158 F166 L168L135-A138 HydrophobicContact CD1-CB 4.32Å; L135-A138 WeakPolarHBondContact O-CB 3.48Å; L135-A138 PolarHBondContact O-N 3.46Å; R136-A138 PolarHBondContact O-N 3.2Å; A138-I140 HydrophobicContact CB-CG1 4.4Å; A138-V158 HydrophobicContact CB-CG2 3.99Å; A138-V158 PolarHBondContact O-N 3.48Å; A138-V158 VanDerWaalsContact O-N 3.15Å; A138-F166 HydrophobicContact CB-CD2 4.36Å; A138-F166 HydrophobicContact CB-CE1 4.18Å; A138-F166 HydrophobicContact CB-CE2 3.65Å; A138-F166 HydrophobicContact CB-CZ 3.53Å; A138-L168 HydrophobicContact CB-CD1 4.22Å; A138-L168 HydrophobicContact CB-CG 4.47Å
139L97.6Very high91.1Very high21 Ų2142 Ų4211%0.1128%0.284CS..EExtended strand (participates in β ladder)trans-102.5114.3157.4-174.764.4000108.5Q155 L156 S157 P164 F166 Q167 L168L139-Q155 HydrophobicContact CD1-CG 3.49Å; L139-Q155 VanDerWaalsContact CD1-CG 3.49Å; L139-Q155 HydrophobicContact CD2-CG 4.28Å; L139-Q155 HydrophobicContact CG-CG 3.76Å; L139-L156 CarbonylContact C-O 3.37Å; L139-S157 WeakPolarHBondContact CD1-OG 3.23Å; L139-P164 HydrophobicContact CB-CB 3.75Å; L139-P164 HydrophobicContact CB-CG 4.19Å; L139-P164 HydrophobicContact CD1-CG 4.42Å; L139-F166 PolarHBondContact N-O 3.34Å; L139-Q167 HydrophobicContact CB-CB 4.49Å; L139-Q167 CarbonylContact O-C 3.53Å; L139-Q167 WeakPolarHBondContact O-CA 3.4Å; L139-Q167 WeakPolarHBondContact O-CG 3.37Å; L139-L168 PolarHBondContact O-N 3.31Å
140I97.8Very high90.7Very high2 Ų242.2 Ų42.21%0.0128%0.279CS..EExtended strand (participates in β ladder)trans-95.2118.7-179.2-59.2174000108.9V87 L124 A138 Q155 L156 V158 L168V87-I140 HydrophobicContact CG1-CD1 3.47Å; V87-I140 VanDerWaalsContact CG1-CD1 3.47Å; L124-I140 HydrophobicContact CD1-CD1 4.18Å; A138-I140 HydrophobicContact CB-CG1 4.4Å; I140-Q155 CarbonylContact O-C 3.58Å; I140-Q155 WeakPolarHBondContact O-CA 3.18Å; I140-L156 HydrophobicContact CB-CB 4.37Å; I140-L156 PolarHBondContact N-O 2.81Å; I140-L156 PolarHBondContact O-N 2.86Å; I140-V158 HydrophobicContact CD1-CG2 3.65Å; I140-V158 HydrophobicContact CG1-CG2 4.04Å; I140-L168 CarbonylContact C-O 3.5Å; I140-L168 VanDerWaalsContact CA-O 3.3Å; I140-L168 WeakPolarHBondContact CA-O 3.39Å; I140-L168 HydrophobicContact CG1-CB 4.45Å
141D96.3Very high90.5Very high30 Ų3042 Ų4216%0.1627%0.269CS..EExtended strand (participates in β ladder)trans-97.8121.6169.1-173.626.5000109.1L168 T169 L170D141-L168 PolarHBondContact N-O 2.93Å; D141-T169 HydrophobicContact CB-CG2 4.26Å; D141-T169 CarbonylContact O-C 3.6Å; D141-T169 WeakPolarHBondContact O-CA 3.45Å; D141-L170 PolarHBondContact O-N 2.96Å
142L95.7Very high90.3Very high8 Ų843.9 Ų43.94%0.04228%0.284CS..EExtended strand (participates in β ladder)trans-104.9119.5-175.1178.964.8000109.7I91 L95 I153 G154 L170 L172I91-L142 HydrophobicContact CG2-CD1 4.23Å; I91-L142 HydrophobicContact CG2-CD2 4.32Å; L95-L142 HydrophobicContact CD2-CD2 4.13Å; L95-L142 HydrophobicContact CG-CD2 4.18Å; L142-I153 HydrophobicContact CB-CB 4.33Å; L142-I153 HydrophobicContact CD2-CB 3.98Å; L142-I153 HydrophobicContact CD2-CG2 3.84Å; L142-I153 HydrophobicContact CG-CB 3.91Å; L142-I153 HydrophobicContact CG-CG1 4.22Å; L142-I153 HydrophobicContact CG-CG2 4.35Å; L142-I153 WeakPolarHBondContact O-CA 3.4Å; L142-I153 WeakPolarHBondContact O-CB 3.19Å; L142-I153 PolarHBondContact O-N 2.94Å; L142-G154 WeakPolarHBondContact CB-O 3.23Å; L142-G154 PolarHBondContact N-O 3.27Å; L142-G154 PolarHBondContact O-N 3.33Å; L142-L170 HydrophobicContact CD1-CB 4.37Å; L142-L170 HydrophobicContact CD1-CD2 3.73Å; L142-L170 HydrophobicContact CD1-CG 3.94Å; L142-L172 HydrophobicContact CD1-CD1 3.79Å; L142-L172 HydrophobicContact CD1-CG 4.28Å
143C93.3Very high90.3Very high9 Ų940.7 Ų40.76%0.06126%0.263CS..EExtended strand (participates in β ladder)trans-130.2152.3-176.8-670000111.7C150 E151 L170 V171 L172C143-C150 VanDerWaalsContact CB-SG 3.52Å; C143-E151 CarbonylContact C-O 3.53Å; C143-E151 VanDerWaalsContact CA-O 3.28Å; C143-E151 WeakPolarHBondContact CA-O 3.31Å; C143-L170 PolarHBondContact N-O 3.47Å; C143-V171 HydrophobicContact CB-CG2 4.46Å; C143-L172 PolarHBondContact O-N 3.4Å
144V92.1Very high90.1Very high0 Ų037.7 Ų37.70%025%0.246CC..EExtended strand (participates in β ladder)trans-123.8122.1173179.90000110.3L95 L105 Q146 E151 I153 L172 L174L95-V144 HydrophobicContact CD2-CG2 4.18Å; L105-V144 HydrophobicContact CD2-CB 3.8Å; L105-V144 HydrophobicContact CD2-CG1 3.66Å; L105-V144 HydrophobicContact CD2-CG2 3.96Å; V144-Q146 HydrophobicContact CG1-CG 4.36Å; V144-E151 PolarHBondContact N-O 2.85Å; V144-E151 PolarHBondContact O-N 2.76Å; V144-I153 HydrophobicContact CB-CD1 4.25Å; V144-I153 HydrophobicContact CB-CG1 4.44Å; V144-I153 HydrophobicContact CG2-CD1 3.8Å; V144-I153 HydrophobicContact CG2-CG1 3.68Å; V144-L172 CarbonylContact C-O 3.56Å; V144-L172 WeakPolarHBondContact CA-O 3.16Å; V144-L172 HydrophobicContact CG2-CB 4.21Å; V144-L174 HydrophobicContact CG1-CD2 4.02Å; V144-L174 HydrophobicContact CG1-CG 4.08Å
145E89.4Confident90.1Very high59 Ų5940.4 Ų40.428%0.27626%0.255SS..EExtended strand (participates in β ladder)trans-79.4123.6176-170.7172.8-159.700110.5A149 V171 L172 R173E145-A149 WeakPolarHBondContact CA-O 3.3Å; E145-V171 HydrophobicContact CB-CG1 4.12Å; E145-L172 PolarHBondContact N-O 2.92Å; E145-R173 HydrophobicContact CB-CG 4.17Å; E145-R173 WeakPolarHBondContact OE2-CG 3.46Å; E145-R173 IonicContact OE2-CZ 3.73Å; E145-R173 IonicContact OE2-NE 2.85Å; E145-R173 PolarHBondContact OE2-NE 3.33Å; E145-R173 IonicContact OE2-NH2 3.71Å
146Q79.9Confident89.9Confident67 Ų6741.7 Ų41.731%0.31326%0.262SS..EExtended strand (participates in β ladder)trans-12789.7177.5-62.2-171.654.700109.4A104 V144 A148 A149 L174A104-Q146 PolarHBondContact O-NE2 3.47Å; V144-Q146 HydrophobicContact CG1-CG 4.36Å; Q146-A148 PolarHBondContact O-N 3.41Å; Q146-A149 PolarHBondContact N-O 3.43Å; Q146-A149 PolarHBondContact O-N 3.46Å; Q146-A149 VanDerWaalsContact O-N 3.17Å; Q146-L174 HydrophobicContact CG-CD1 3.72Å; Q146-L174 HydrophobicContact CG-CG 4.3Å
147G76.4Confident89.9Confident70 Ų7040 Ų4072%0.72226%0.264SS*.THydrogen-bonded Turntrans65.9-118.3-174.200000110.8
148A73.8Confident89.9Confident115 Ų11541 Ų4195%0.9527%0.269SS*.THydrogen-bonded Turntrans-90.5-4.3177.700000113.8Q146Q146-A148 PolarHBondContact O-N 3.41Å
149A80.3Confident89.7Confident49 Ų4941.8 Ų41.841%0.40527%0.273SS..EExtended strand (participates in β ladder)trans-99.5146-179.400000111E145 Q146E145-A149 WeakPolarHBondContact CA-O 3.3Å; Q146-A149 PolarHBondContact N-O 3.43Å; Q146-A149 PolarHBondContact O-N 3.46Å; Q146-A149 VanDerWaalsContact O-N 3.17Å
150C84.8Confident89.3Confident80 Ų8044.8 Ų44.854%0.54130%0.295SS..EExtended strand (participates in β ladder)trans-118.8112.7172.4-170.50000107.8C143C143-C150 VanDerWaalsContact CB-SG 3.52Å
151E87.6Confident89Confident83 Ų8353.1 Ų53.139%0.38833%0.327SS..EExtended strand (participates in β ladder)trans-96.3123.6-178.9-71.7-77.8161.600109.6A104 C143 V144A104-E151 HydrophobicContact CB-CB 4.03Å; C143-E151 CarbonylContact C-O 3.53Å; C143-E151 VanDerWaalsContact CA-O 3.28Å; C143-E151 WeakPolarHBondContact CA-O 3.31Å; V144-E151 PolarHBondContact N-O 2.85Å; V144-E151 PolarHBondContact O-N 2.76Å
152S89.9Confident88.8Confident64 Ų6454.2 Ų54.245%0.44833%0.333SS..EExtended strand (participates in β ladder)trans-75.3125.9173.8-179.80000109.9
153I90.8Very high88.8Confident12 Ų1259 Ų596%0.06236%0.362CS..EExtended strand (participates in β ladder)trans-90.2-39.4177.2-54.5-54.9000110.3A98 A104 L105 L142 V144A98-I153 HydrophobicContact CB-CD1 4.12Å; A98-I153 HydrophobicContact CB-CG2 3.69Å; A104-I153 HydrophobicContact CB-CD1 3.56Å; L105-I153 HydrophobicContact CD2-CD1 4.19Å; L105-I153 HydrophobicContact CG-CD1 4.18Å; L142-I153 HydrophobicContact CB-CB 4.33Å; L142-I153 HydrophobicContact CD2-CB 3.98Å; L142-I153 HydrophobicContact CD2-CG2 3.84Å; L142-I153 HydrophobicContact CG-CB 3.91Å; L142-I153 HydrophobicContact CG-CG1 4.22Å; L142-I153 HydrophobicContact CG-CG2 4.35Å; L142-I153 WeakPolarHBondContact O-CA 3.4Å; L142-I153 WeakPolarHBondContact O-CB 3.19Å; L142-I153 PolarHBondContact O-N 2.94Å; V144-I153 HydrophobicContact CB-CD1 4.25Å; V144-I153 HydrophobicContact CB-CG1 4.44Å; V144-I153 HydrophobicContact CG2-CD1 3.8Å; V144-I153 HydrophobicContact CG2-CG1 3.68Å
154G89Confident89Confident19 Ų1959.6 Ų59.620%0.19637%0.366CS..EExtended strand (participates in β ladder)trans165.7178.2-178.500000112.3L142L142-G154 WeakPolarHBondContact CB-O 3.23Å; L142-G154 PolarHBondContact N-O 3.27Å; L142-G154 PolarHBondContact O-N 3.33Å
155Q92.4Very high89.2Confident68 Ų6862 Ų6232%0.31838%0.38SS..EExtended strand (participates in β ladder)trans-138.1116.9-174.5178.7178.676.500111.6W27 L139 I140W27-Q155 HydrophobicContact CH2-CB 4.46Å; W27-Q155 WeakPolarHBondContact CH2-O 3.49Å; W27-Q155 HydrophobicContact CZ2-CB 4.01Å; W27-Q155 WeakPolarHBondContact CZ2-O 3.38Å; W27-Q155 WeakPolarHBondContact CZ3-O 3.5Å; L139-Q155 HydrophobicContact CD1-CG 3.49Å; L139-Q155 VanDerWaalsContact CD1-CG 3.49Å; L139-Q155 HydrophobicContact CD2-CG 4.28Å; L139-Q155 HydrophobicContact CG-CG 3.76Å; I140-Q155 CarbonylContact O-C 3.58Å; I140-Q155 WeakPolarHBondContact O-CA 3.18Å
156L92.8Very high89.5Confident31 Ų3159.1 Ų59.116%0.16237%0.367CS..EExtended strand (participates in β ladder)trans-103.6122.7-177.2172.464.8000110.9V87 L90 L139 I140V87-L156 HydrophobicContact CG1-CD2 4.26Å; V87-L156 HydrophobicContact CG2-CD2 4.38Å; L90-L156 HydrophobicContact CB-CD2 4.05Å; L90-L156 HydrophobicContact CD1-CD1 3.89Å; L90-L156 HydrophobicContact CD1-CD2 3.85Å; L139-L156 CarbonylContact C-O 3.37Å; I140-L156 HydrophobicContact CB-CB 4.37Å; I140-L156 PolarHBondContact N-O 2.81Å; I140-L156 PolarHBondContact O-N 2.86Å
157S95.4Very high90.3Very high51 Ų5157.5 Ų57.536%0.35736%0.359SS..EExtended strand (participates in β ladder)trans-80.7122.5159.5-57.60000108.1L139L139-S157 WeakPolarHBondContact CD1-OG 3.23Å
158V94.9Very high91.3Very high22 Ų2254.2 Ų54.213%0.13333%0.325CS..SBendtrans-66.5-44-172.6173.80000111.7I83 V87 L135 A138 I140I83-V158 HydrophobicContact CG2-CG1 3.58Å; V87-V158 HydrophobicContact CG2-CB 4.4Å; V87-V158 HydrophobicContact CG2-CG1 3.74Å; V87-V158 HydrophobicContact CG2-CG2 4Å; L135-V158 HydrophobicContact CD1-CG2 4.46Å; L135-V158 HydrophobicContact CG-CG1 4.25Å; L135-V158 HydrophobicContact CG-CG2 4.42Å; L135-V158 WeakPolarHBondContact O-CB 3.41Å; L135-V158 WeakPolarHBondContact O-CG1 3.37Å; L135-V158 WeakPolarHBondContact O-CG2 3.09Å; A138-V158 HydrophobicContact CB-CG2 3.99Å; A138-V158 PolarHBondContact O-N 3.48Å; A138-V158 VanDerWaalsContact O-N 3.15Å; I140-V158 HydrophobicContact CD1-CG2 3.65Å; I140-V158 HydrophobicContact CG1-CG2 4.04Å
159D92.7Very high92.5Very high17 Ų1749.9 Ų49.99%0.09129%0.287CS..  trans-118.9118.4178.6-171.3-29000110.4R136 Y161 L162R136-D159 HydrophobicContact CB-CB 3.96Å; R136-D159 HydrophobicContact CG-CB 4.47Å; R136-D159 IonicContact CZ-OD2 3.12Å; R136-D159 IonicContact NE-OD2 2.75Å; R136-D159 PolarHBondContact NE-OD2 3.43Å; R136-D159 IonicContact NH2-OD2 2.66Å; R136-D159 PolarHBondContact NH2-OD2 3.4Å; R136-D159 WeakPolarHBondContact O-CB 3.38Å; D159-Y161 PolarHBondContact O-N 3.42Å; D159-Y161 WeakPolarHBondContact OD1-CA 3.5Å; D159-Y161 WeakPolarHBondContact OD1-CB 3.43Å; D159-Y161 WeakPolarHBondContact OD1-CD2 3.38Å; D159-Y161 PolarHBondContact OD1-N 3.28Å; D159-L162 HydrophobicContact CB-CB 4.2Å; D159-L162 HydrophobicContact CB-CD1 4.16Å; D159-L162 HydrophobicContact CB-CG 4.14Å; D159-L162 PolarHBondContact O-N 2.89Å
160P89.5Confident93.3Very high85 Ų8547.6 Ų47.655%0.55227%0.268SS*.THydrogen-bonded Turntrans-70.2-14.8-179.829.9-35.5000113.9
161Y91.5Very high93.8Very high176 Ų17644.3 Ų44.369%0.6925%0.245SC*.THydrogen-bonded Turntrans-92.9-6.5179-56.3-74.6000113D159D159-Y161 PolarHBondContact O-N 3.42Å; D159-Y161 WeakPolarHBondContact OD1-CA 3.5Å; D159-Y161 WeakPolarHBondContact OD1-CB 3.43Å; D159-Y161 WeakPolarHBondContact OD1-CD2 3.38Å; D159-Y161 PolarHBondContact OD1-N 3.28Å
162L92.8Very high94.1Very high54 Ų5440.4 Ų40.428%0.28323%0.227SC..SBendtrans-112.5148.4176.9-61.1-178000111.1C133 R136 D159 P164C133-L162 HydrophobicContact CB-CD1 3.95Å; R136-L162 HydrophobicContact CB-CD1 3.74Å; D159-L162 HydrophobicContact CB-CB 4.2Å; D159-L162 HydrophobicContact CB-CD1 4.16Å; D159-L162 HydrophobicContact CB-CG 4.14Å; D159-L162 PolarHBondContact O-N 2.89Å; L162-P164 WeakPolarHBondContact O-CD 3.32Å
163V96.4Very high94.2Very high107 Ų10741.5 Ų41.565%0.64822%0.221SC*.  trans-83123166.4179.30000107.5T165V163-T165 PolarHBondContact O-N 3.11Å
164P96.8Very high94.1Very high22 Ų2242.6 Ų42.614%0.14323%0.227CC..  trans-60.1137.7177.9-24.233.8000112G137 L139 L162 L214 Y215G137-P164 CarbonylContact O-C 3.55Å; G137-P164 VanDerWaalsContact O-CA 3.23Å; G137-P164 WeakPolarHBondContact O-CA 3.32Å; L139-P164 HydrophobicContact CB-CB 3.75Å; L139-P164 HydrophobicContact CB-CG 4.19Å; L139-P164 HydrophobicContact CD1-CG 4.42Å; L162-P164 WeakPolarHBondContact O-CD 3.32Å; P164-L214 HydrophobicContact CB-CD1 4.1Å; P164-Y215 WeakPolarHBondContact O-CE2 3.38Å
165T95.9Very high94Very high50 Ų5046.3 Ų46.331%0.30724%0.239SC..  trans-111.6-18.5-17858.70000113G137 V163 L214G137-T165 PolarHBondContact O-N 3.16Å; V163-T165 PolarHBondContact O-N 3.11Å; T165-L214 WeakPolarHBondContact O-CB 3.33Å; T165-L214 PolarHBondContact O-N 3.06Å
166F96.6Very high93Very high0 Ų048.4 Ų48.40%026%0.262CS..EExtended strand (participates in β ladder)trans-140159.7173.567.9-77.8000110.5A128 E131 G134 G137 A138 L139 L168 K211 K212A128-F166 HydrophobicContact CB-CE2 4.16Å; A128-F166 HydrophobicContact CB-CZ 3.8Å; E131-F166 HydrophobicContact CB-CD1 3.58Å; E131-F166 HydrophobicContact CB-CE1 3.37Å; E131-F166 HydrophobicContact CB-CE2 4.4Å; E131-F166 HydrophobicContact CB-CG 4.21Å; E131-F166 HydrophobicContact CB-CZ 3.81Å; E131-F166 HydrophobicContact CG-CB 4.47Å; E131-F166 HydrophobicContact CG-CD1 3.72Å; E131-F166 HydrophobicContact CG-CD2 3.97Å; E131-F166 HydrophobicContact CG-CE1 3.82Å; E131-F166 HydrophobicContact CG-CE2 4.03Å; E131-F166 HydrophobicContact CG-CG 3.8Å; E131-F166 HydrophobicContact CG-CZ 3.96Å; G134-F166 WeakPolarHBondContact O-CE1 3.49Å; G134-F166 WeakPolarHBondContact O-CZ 3.02Å; G137-F166 VanDerWaalsContact C-CE1 3.46Å; A138-F166 HydrophobicContact CB-CD2 4.36Å; A138-F166 HydrophobicContact CB-CE1 4.18Å; A138-F166 HydrophobicContact CB-CE2 3.65Å; A138-F166 HydrophobicContact CB-CZ 3.53Å; L139-F166 PolarHBondContact N-O 3.34Å; F166-L168 HydrophobicContact CD2-CD2 4.02Å; F166-L168 HydrophobicContact CD2-CG 4.01Å; F166-L168 HydrophobicContact CE2-CD1 3.91Å; F166-L168 HydrophobicContact CE2-CD2 3.93Å; F166-L168 HydrophobicContact CE2-CG 3.73Å; F166-K211 HydrophobicContact CD2-CD 4.13Å; F166-K211 HydrophobicContact CD2-CG 4.17Å; F166-K212 CarbonylContact C-O 3.52Å; F166-K212 VanDerWaalsContact CA-O 3.28Å; F166-K212 WeakPolarHBondContact CA-O 3.42Å
167Q96.9Very high91.4Very high33 Ų3349.7 Ų49.715%0.15428%0.282CS..EExtended strand (participates in β ladder)trans-115.6137.3177.2176.4177.5-28.100109.8L139 T169 K211 K212 L214L139-Q167 HydrophobicContact CB-CB 4.49Å; L139-Q167 CarbonylContact O-C 3.53Å; L139-Q167 WeakPolarHBondContact O-CA 3.4Å; L139-Q167 WeakPolarHBondContact O-CG 3.37Å; Q167-T169 PolarHBondContact NE2-OG1 2.97Å; Q167-K211 CarbonylContact O-C 3.52Å; Q167-K211 WeakPolarHBondContact O-CA 3.28Å; Q167-K212 PolarHBondContact N-O 3.06Å; Q167-K212 PolarHBondContact O-N 2.96Å; Q167-L214 HydrophobicContact CB-CD2 3.94Å; Q167-L214 HydrophobicContact CB-CG 4.41Å
168L97.5Very high89.4Confident0 Ų051 Ų510%030%0.304CS..EExtended strand (participates in β ladder)trans-111.8110.9168.7-62.5179000108.1L124 L127 L135 A138 L139 I140 D141 F166 L170 V209 I210 K211L124-L168 HydrophobicContact CB-CD1 4.49Å; L124-L168 HydrophobicContact CD2-CB 4.21Å; L124-L168 HydrophobicContact CD2-CD1 3.59Å; L127-L168 HydrophobicContact CB-CD2 3.93Å; L127-L168 HydrophobicContact CD1-CD2 4.08Å; L135-L168 HydrophobicContact CD1-CD1 4.37Å; A138-L168 HydrophobicContact CB-CD1 4.22Å; A138-L168 HydrophobicContact CB-CG 4.47Å; L139-L168 PolarHBondContact O-N 3.31Å; I140-L168 CarbonylContact C-O 3.5Å; I140-L168 VanDerWaalsContact CA-O 3.3Å; I140-L168 WeakPolarHBondContact CA-O 3.39Å; I140-L168 HydrophobicContact CG1-CB 4.45Å; D141-L168 PolarHBondContact N-O 2.93Å; F166-L168 HydrophobicContact CD2-CD2 4.02Å; F166-L168 HydrophobicContact CD2-CG 4.01Å; F166-L168 HydrophobicContact CE2-CD1 3.91Å; F166-L168 HydrophobicContact CE2-CD2 3.93Å; F166-L168 HydrophobicContact CE2-CG 3.73Å; L168-L170 PolarHBondContact O-N 3.27Å; L168-V209 HydrophobicContact CB-CG1 4Å; L168-V209 HydrophobicContact CD2-CG1 4.2Å; L168-I210 WeakPolarHBondContact CA-O 3.37Å; L168-K211 HydrophobicContact CD2-CB 3.78Å; L168-K211 HydrophobicContact CD2-CD 4.18Å; L168-K211 HydrophobicContact CD2-CG 3.84Å
169T97.3Very high87.3Confident25 Ų2555.4 Ų55.415%0.15333%0.326CS..EExtended strand (participates in β ladder)trans-93101.7176.7-50.10000108.7D141 Q167 V171 V209 I210D141-T169 HydrophobicContact CB-CG2 4.26Å; D141-T169 CarbonylContact O-C 3.6Å; D141-T169 WeakPolarHBondContact O-CA 3.45Å; Q167-T169 PolarHBondContact NE2-OG1 2.97Å; T169-V171 HydrophobicContact CG2-CG2 4.13Å; T169-V209 WeakPolarHBondContact O-CA 3.44Å; T169-I210 PolarHBondContact N-O 2.89Å; T169-I210 PolarHBondContact O-N 3.11Å
170L97.6Very high85.6Confident0 Ų063.5 Ų63.50%036%0.356CS..EExtended strand (participates in β ladder)trans-86.1110.4178.3172.958.8000109.7I91 I120 D141 L142 C143 L168 L172 F207 V209I91-L170 HydrophobicContact CD1-CD2 4Å; I91-L170 HydrophobicContact CG2-CD2 4.29Å; I120-L170 HydrophobicContact CD1-CD1 4.42Å; I120-L170 HydrophobicContact CD1-CD2 4.31Å; I120-L170 HydrophobicContact CG1-CD1 4.14Å; I120-L170 HydrophobicContact CG2-CD1 4.36Å; I120-L170 HydrophobicContact CG2-CD2 3.71Å; D141-L170 PolarHBondContact O-N 2.96Å; L142-L170 HydrophobicContact CD1-CB 4.37Å; L142-L170 HydrophobicContact CD1-CD2 3.73Å; L142-L170 HydrophobicContact CD1-CG 3.94Å; C143-L170 PolarHBondContact N-O 3.47Å; L168-L170 PolarHBondContact O-N 3.27Å; L170-L172 HydrophobicContact CD1-CD2 3.94Å; L170-L172 HydrophobicContact CG-CD2 4.2Å; L170-L172 HydrophobicContact CG-CG 4.32Å; L170-F207 HydrophobicContact CD1-CB 4.37Å; L170-F207 HydrophobicContact CD1-CD2 3.67Å; L170-F207 HydrophobicContact CD1-CE2 4.42Å; L170-F207 HydrophobicContact CD1-CG 4.36Å; L170-V209 HydrophobicContact CD1-CG2 3.81Å
171V95.7Very high84Confident11 Ų1164.7 Ų64.77%0.06736%0.364CS..EExtended strand (participates in β ladder)trans-106.5109.2179.6-172.80000109.5C143 E145 T169 F207 R208 I210C143-V171 HydrophobicContact CB-CG2 4.46Å; E145-V171 HydrophobicContact CB-CG1 4.12Å; T169-V171 HydrophobicContact CG2-CG2 4.13Å; V171-F207 WeakPolarHBondContact O-CA 3.48Å; V171-R208 HydrophobicContact CB-CB 4.46Å; V171-R208 PolarHBondContact N-O 3.47Å; V171-R208 PolarHBondContact O-N 3.1Å; V171-I210 HydrophobicContact CG2-CD1 3.91Å
172L94.6Very high82.2Confident1 Ų165.2 Ų65.21%0.00537%0.369CS..EExtended strand (participates in β ladder)trans-92.7149.3176.4-58.8174000110.5L95 L116 I120 L142 C143 V144 E145 L170 L203 F207L95-L172 HydrophobicContact CD1-CD1 3.65Å; L95-L172 HydrophobicContact CD2-CD1 3.59Å; L95-L172 HydrophobicContact CG-CD1 4.2Å; L116-L172 HydrophobicContact CD1-CD2 4.5Å; L116-L172 HydrophobicContact CD2-CD2 4.49Å; I120-L172 HydrophobicContact CD1-CD2 3.65Å; L142-L172 HydrophobicContact CD1-CD1 3.79Å; L142-L172 HydrophobicContact CD1-CG 4.28Å; C143-L172 PolarHBondContact O-N 3.4Å; V144-L172 CarbonylContact C-O 3.56Å; V144-L172 WeakPolarHBondContact CA-O 3.16Å; V144-L172 HydrophobicContact CG2-CB 4.21Å; E145-L172 PolarHBondContact N-O 2.92Å; L170-L172 HydrophobicContact CD1-CD2 3.94Å; L170-L172 HydrophobicContact CG-CD2 4.2Å; L170-L172 HydrophobicContact CG-CG 4.32Å; L172-L203 HydrophobicContact CD1-CD1 4.17Å; L172-F207 HydrophobicContact CD2-CB 3.88Å
173R91.9Very high80.5Confident87 Ų8765.5 Ų65.533%0.32837%0.371SS..EExtended strand (participates in β ladder)trans-111.8143.5178.8-70170.6169.4166.8-2.9110.5E145 L203 S204 R208E145-R173 HydrophobicContact CB-CG 4.17Å; E145-R173 WeakPolarHBondContact OE2-CG 3.46Å; E145-R173 IonicContact OE2-CZ 3.73Å; E145-R173 IonicContact OE2-NE 2.85Å; E145-R173 PolarHBondContact OE2-NE 3.33Å; E145-R173 IonicContact OE2-NH2 3.71Å; R173-L203 WeakPolarHBondContact O-CA 3.34Å; R173-S204 WeakPolarHBondContact O-CB 3.34Å; R173-S204 PolarHBondContact O-N 2.89Å; R173-R208 VanDerWaalsContact NH2-CD 3.29Å
174L89Confident78.5Confident36 Ų3665.2 Ų65.219%0.18836%0.362CS..EExtended strand (participates in β ladder)trans-74.1143.9164.6-63.8-175.5000109.9V144 Q146 S176 L201 L203V144-L174 HydrophobicContact CG1-CD2 4.02Å; V144-L174 HydrophobicContact CG1-CG 4.08Å; Q146-L174 HydrophobicContact CG-CD1 3.72Å; Q146-L174 HydrophobicContact CG-CG 4.3Å; L174-S176 PolarHBondContact O-N 3Å; L174-L201 HydrophobicContact CD1-CD1 3.91Å; L174-L201 HydrophobicContact CD1-CD2 4.26Å; L174-L201 HydrophobicContact CD2-CB 4.26Å; L174-L201 HydrophobicContact CD2-CD1 4.23Å; L174-L203 HydrophobicContact CD2-CD2 3.86Å
175E86.3Confident76.5Confident96 Ų9666.5 Ų66.545%0.44938%0.379SS..  trans-65.1108.4170-173.8170.7-111.800108.3G177 K202E175-G177 VanDerWaalsContact C-N 3.3Å; E175-G177 PolarHBondContact O-N 3.45Å; E175-K202 HydrophobicContact CB-CB 4.19Å; E175-K202 HydrophobicContact CB-CG 4.25Å; E175-K202 WeakPolarHBondContact CB-O 3.42Å; E175-K202 PolarHBondContact N-O 3.12Å; E175-K202 IonicContact OE1-NZ 3.85Å; E175-K202 PolarHBondContact OE1-NZ 3.39Å; E175-K202 WeakPolarHBondContact OE2-CD 3.44Å; E175-K202 WeakPolarHBondContact OE2-CE 3.47Å; E175-K202 IonicContact OE2-NZ 2.73Å; E175-K202 PolarHBondContact OE2-NZ 3.4Å
176S70.8Confident74.7Confident112 Ų11270.8 Ų70.878%0.78340%0.399SS*.  trans-70.690.5171.446.90000108.3L174 G178L174-S176 PolarHBondContact O-N 3Å; S176-G178 PolarHBondContact O-N 3.43Å
177G60.3Low72.7Confident58 Ų5879 Ų7960%0.59844%0.435SS*.  trans-53.2125.717200000109.5E175 L179E175-G177 VanDerWaalsContact C-N 3.3Å; E175-G177 PolarHBondContact O-N 3.45Å; G177-L179 PolarHBondContact O-N 3.26Å
178G52Low70.6Confident79 Ų7980.9 Ų80.981%0.81445%0.453SS*.SBendtrans-65.428.9-169.800000117S176S176-G178 PolarHBondContact O-N 3.43Å
179L52.3Low68.2Low115 Ų11586.6 Ų86.660%0.60249%0.492SS*.SBendtrans-104.7101.6172-88.7144.9000108.9G177G177-L179 PolarHBondContact O-N 3.26Å
180W56.8Low65.7Low187 Ų18794.1 Ų94.171%0.70852%0.523SS*.  trans-30.3128.5171.8-58.579.2000112.7K182 I183W180-K182 PolarHBondContact O-N 3.1Å; W180-I183 HydrophobicContact CB-CD1 3.86Å; W180-I183 HydrophobicContact CB-CG1 3.97Å; W180-I183 HydrophobicContact CG-CD1 4.12Å; W180-I183 PolarHBondContact O-N 3.13Å
181P56Low63.3Low110 Ų11096.9 Ų96.971%0.71454%0.542SS*.Hα-helixtrans-51.5-30.2177.7-27.132.5000113.5I183P181-I183 VanDerWaalsContact C-N 3.27Å; P181-I183 PolarHBondContact O-N 3.28Å
182K53Low61.2Low186 Ų186103 Ų10381%0.80958%0.582SS**Hα-helixtrans-65.9-23.4179.7-65.2-175.4177.6179.40114.1W180W180-K182 PolarHBondContact O-N 3.1Å
183I57.2Low59.2Low61 Ų61107.7 Ų107.731%0.31362%0.615SS.*Hα-helixtrans-99.7-23.8-175.2-43.6171.3000111W180 P181 G185 L186 F187W180-I183 HydrophobicContact CB-CD1 3.86Å; W180-I183 HydrophobicContact CB-CG1 3.97Å; W180-I183 HydrophobicContact CG-CD1 4.12Å; W180-I183 PolarHBondContact O-N 3.13Å; P181-I183 VanDerWaalsContact C-N 3.27Å; P181-I183 PolarHBondContact O-N 3.28Å; I183-G185 PolarHBondContact O-N 3.09Å; I183-L186 HydrophobicContact CG2-CD1 4.4Å; I183-L186 WeakPolarHBondContact O-CB 3.42Å; I183-L186 PolarHBondContact O-N 2.99Å; I183-F187 HydrophobicContact CG2-CD2 4.15Å; I183-F187 HydrophobicContact CG2-CE2 3.7Å; I183-F187 WeakPolarHBondContact O-CD2 3.37Å
184Q55Low57.1Low101 Ų101108.1 Ų108.147%0.47263%0.628SS.*Hα-helixtrans-59.1-30.7172-71.3-172.6-24.200112.6L186 F187 S188Q184-L186 PolarHBondContact O-N 2.66Å; Q184-F187 PolarHBondContact O-N 3.12Å; Q184-S188 WeakPolarHBondContact O-CB 3.42Å; Q184-S188 PolarHBondContact O-N 3.04Å; Q184-S188 VanDerWaalsContact O-N 3.13Å; Q184-S188 PolarHBondContact O-OG 2.91Å
185G54.7Low55.4Low48 Ų48111.9 Ų111.950%0.49565%0.654SS.*Hα-helixtrans-67.6-17175.100000114.8I183I183-G185 PolarHBondContact O-N 3.09Å
186L58Low54Low140 Ų140111.4 Ų111.473%0.73367%0.667SS**Hα-helixtrans-92.1-22.2-179.5-61177.5000113.1I183 Q184I183-L186 HydrophobicContact CG2-CD1 4.4Å; I183-L186 WeakPolarHBondContact O-CB 3.42Å; I183-L186 PolarHBondContact O-N 2.99Å; Q184-L186 PolarHBondContact O-N 2.66Å
187F54.5Low53.4Low172 Ų172112 Ų11275%0.75467%0.668SS**Hα-helixtrans-106.2-9.7178.7-63-71.6000113.7I183 Q184 S189I183-F187 HydrophobicContact CG2-CD2 4.15Å; I183-F187 HydrophobicContact CG2-CE2 3.7Å; I183-F187 WeakPolarHBondContact O-CD2 3.37Å; Q184-F187 PolarHBondContact O-N 3.12Å; F187-S189 PolarHBondContact O-N 3.27Å; F187-S189 VanDerWaalsContact O-N 3.16Å
188S51.4Low53.5Low74 Ų74115.7 Ų115.752%0.51766%0.663SS.*SBendtrans-80.194.6172-61.40000109.4Q184 K190Q184-S188 WeakPolarHBondContact O-CB 3.42Å; Q184-S188 PolarHBondContact O-N 3.04Å; Q184-S188 VanDerWaalsContact O-N 3.13Å; Q184-S188 PolarHBondContact O-OG 2.91Å; S188-K190 PolarHBondContact O-N 2.75Å
189S46.7Very low54.5Low119 Ų119118.4 Ų118.483%0.83266%0.655SS**  trans-55.398.4167.1177.80000109.3F187 S191F187-S189 PolarHBondContact O-N 3.27Å; F187-S189 VanDerWaalsContact O-N 3.16Å; S189-S191 PolarHBondContact O-N 2.88Å; S189-S191 VanDerWaalsContact O-N 3.1Å
190K46.8Very low56Low184 Ų184115.4 Ų115.480%0.865%0.647SS**  trans-76.891.7177.1-74.3179178.4179.50108.8S188S188-K190 PolarHBondContact O-N 2.75Å
191S46.7Very low57.4Low57 Ų57108.2 Ų108.240%0.39962%0.622SS.*  trans-84.3124.7154.2-178.60000108.3S189 S193 T194S189-S191 PolarHBondContact O-N 2.88Å; S189-S191 VanDerWaalsContact O-N 3.1Å; S191-S193 PolarHBondContact O-N 3.36Å; S191-S193 PolarHBondContact OG-OG 3.41Å; S191-T194 PolarHBondContact O-N 3.23Å
192P51.4Low59Low139 Ų139106.7 Ų106.790%0.90360%0.604SS**THydrogen-bonded Turntrans-68.72.2-176.226.2-32.9000114.7
193S51.3Low60.9Low101 Ų10197.9 Ų97.971%0.70657%0.566SS**THydrogen-bonded Turntrans-119.33.6-176.263.10000115.1S191S191-S193 PolarHBondContact O-N 3.36Å; S191-S193 PolarHBondContact OG-OG 3.41Å
194T48.6Very low62.5Low96 Ų9696.5 Ų96.559%0.58956%0.562SS**SBendtrans-113.6121.8-175.1-30.20000110.7S191 A196S191-T194 PolarHBondContact O-N 3.23Å; T194-A196 PolarHBondContact O-N 2.98Å
195P53.6Low64.3Low115 Ų11596 Ų9675%0.74757%0.566SS**PPolyproline II helixtrans-57.3134173.321.9-29.7000109.1
196A57.7Low66.1Low86 Ų8694.9 Ų94.971%0.71155%0.554SS**PPolyproline II helixtrans-51.2133-178.800000110T194 R198T194-A196 PolarHBondContact O-N 2.98Å; A196-R198 PolarHBondContact O-N 3.42Å
197P57Low67.8Low124 Ų12488.9 Ų88.981%0.80552%0.522SS*.PPolyproline II helixtrans-60.6118.3179.423.7-31.6000108.8Q199P197-Q199 PolarHBondContact O-N 3.39Å; P197-Q199 VanDerWaalsContact O-N 3.07Å
198R63.6Low69.8Low135 Ų13583.2 Ų83.251%0.50950%0.496SS..  trans-60.7113.1176.2-67.6-175-155.7173.54.7108.5T108 A196T108-R198 HydrophobicContact CG2-CB 3.43Å; T108-R198 VanDerWaalsContact CG2-CB 3.43Å; T108-R198 HydrophobicContact CG2-CG 4.32Å; T108-R198 PolarHBondContact OG1-O 3.06Å; A196-R198 PolarHBondContact O-N 3.42Å
199Q73.1Confident72Confident136 Ų13679.7 Ų79.764%0.63647%0.472SS*.PPolyproline II helixtrans-77.6154.2-173.7-161.9171.60.200111.4C107 T108 P197C107-Q199 WeakPolarHBondContact CB-O 3.28Å; T108-Q199 PolarHBondContact N-O 3.01Å; P197-Q199 PolarHBondContact O-N 3.39Å; P197-Q199 VanDerWaalsContact O-N 3.07Å
200A82.9Confident74.3Confident52 Ų5275.2 Ų75.243%0.4344%0.438SS..EExtended strand (participates in β ladder)trans-71.9126.5163.900000109K109K109-A200 HydrophobicContact CB-CB 4.01Å; K109-A200 CarbonylContact O-C 3.5Å; K109-A200 WeakPolarHBondContact O-CA 3.42Å
201L86.6Confident76.6Confident36 Ų3667.5 Ų67.519%0.18840%0.404CS..EExtended strand (participates in β ladder)trans-100.3145.8175.2-63.1-178.4000109.6L105 C107 K109 L110 L111 L174L105-L201 HydrophobicContact CB-CD1 4.45Å; L105-L201 WeakPolarHBondContact O-CD1 3.46Å; C107-L201 HydrophobicContact CB-CB 4.28Å; C107-L201 HydrophobicContact CB-CD1 3.62Å; C107-L201 HydrophobicContact CB-CG 3.63Å; K109-L201 PolarHBondContact O-N 3.16Å; L110-L201 CarbonylContact C-O 3.53Å; L110-L201 WeakPolarHBondContact CA-O 3.33Å; L110-L201 HydrophobicContact CD1-CB 4.01Å; L111-L201 PolarHBondContact N-O 3.05Å; L174-L201 HydrophobicContact CD1-CD1 3.91Å; L174-L201 HydrophobicContact CD1-CD2 4.26Å; L174-L201 HydrophobicContact CD2-CB 4.26Å; L174-L201 HydrophobicContact CD2-CD1 4.23Å
202K90.1Very high78.9Confident78 Ų7869.5 Ų69.534%0.33941%0.406SS..EExtended strand (participates in β ladder)trans-120.4135171.5178.1158.8162.6-121.90108.8L111 E175L111-K202 HydrophobicContact CB-CB 3.98Å; L111-K202 HydrophobicContact CB-CD 4.29Å; L111-K202 HydrophobicContact CB-CG 4Å; L111-K202 HydrophobicContact CD1-CB 4.29Å; L111-K202 HydrophobicContact CD1-CD 4.25Å; L111-K202 WeakPolarHBondContact O-CA 3.41Å; E175-K202 HydrophobicContact CB-CB 4.19Å; E175-K202 HydrophobicContact CB-CG 4.25Å; E175-K202 WeakPolarHBondContact CB-O 3.42Å; E175-K202 PolarHBondContact N-O 3.12Å; E175-K202 IonicContact OE1-NZ 3.85Å; E175-K202 PolarHBondContact OE1-NZ 3.39Å; E175-K202 WeakPolarHBondContact OE2-CD 3.44Å; E175-K202 WeakPolarHBondContact OE2-CE 3.47Å; E175-K202 IonicContact OE2-NZ 2.73Å; E175-K202 PolarHBondContact OE2-NZ 3.4Å
203L91.8Very high81Confident1 Ų167.2 Ų67.21%0.00538%0.382CS..EExtended strand (participates in β ladder)trans-73.5140.7170.1-62.6-178.3000109.5L95 L110 L111 I112 P113 L116 L172 R173 L174L95-L203 HydrophobicContact CD1-CD1 4Å; L110-L203 HydrophobicContact CD1-CD2 4.13Å; L110-L203 HydrophobicContact CD1-CG 4.16Å; L111-L203 PolarHBondContact O-N 3.41Å; I112-L203 HydrophobicContact CB-CD1 4.5Å; I112-L203 HydrophobicContact CG1-CD1 3.99Å; I112-L203 HydrophobicContact CG2-CD1 4.3Å; P113-L203 VanDerWaalsContact CG-O 3.28Å; P113-L203 WeakPolarHBondContact CG-O 3.47Å; L116-L203 HydrophobicContact CD2-CB 3.8Å; L116-L203 HydrophobicContact CD2-CD1 3.86Å; L116-L203 HydrophobicContact CD2-CG 4.49Å; L172-L203 HydrophobicContact CD1-CD1 4.17Å; R173-L203 WeakPolarHBondContact O-CA 3.34Å; L174-L203 HydrophobicContact CD2-CD2 3.86Å
204S91.8Very high82.9Confident33 Ų3365 Ų6523%0.23136%0.361CS..EExtended strand (participates in β ladder)trans-64.8152.6164.9-176.30000109.5L116 R173 G206L116-S204 WeakPolarHBondContact CD2-O 3.37Å; R173-S204 WeakPolarHBondContact O-CB 3.34Å; R173-S204 PolarHBondContact O-N 2.89Å; S204-G206 PolarHBondContact OG-N 3.39Å; S204-G206 VanDerWaalsContact OG-N 3.12Å
205T92.1Very high84.9Confident90 Ų9068.8 Ų68.855%0.55237%0.366SS*.EExtended strand (participates in β ladder)trans-73.8-17.4168.252.70000112.3P113P113-T205 HydrophobicContact CB-CG2 3.94Å; P113-T205 HydrophobicContact CG-CG2 4.04Å
206G91.7Very high86.1Confident25 Ų2565.6 Ų65.626%0.25835%0.347SS..EExtended strand (participates in β ladder)trans-82.5133.4174.700000111.7S204S204-G206 PolarHBondContact OG-N 3.39Å; S204-G206 VanDerWaalsContact OG-N 3.12Å
207F95.3Very high86.9Confident13 Ų1367.8 Ų67.86%0.05736%0.357CS..EExtended strand (participates in β ladder)trans-144.3169.9177.767-81000109.3L116 H119 I120 E123 L170 V171 L172 V209L116-F207 HydrophobicContact CD1-CB 4.36Å; L116-F207 HydrophobicContact CD1-CD1 3.65Å; L116-F207 HydrophobicContact CD1-CE1 4.36Å; L116-F207 HydrophobicContact CD1-CG 4.28Å; H119-F207 HydrophobicContact CB-CE1 3.77Å; H119-F207 HydrophobicContact CB-CZ 4.1Å; I120-F207 HydrophobicContact CG1-CD1 4.13Å; I120-F207 HydrophobicContact CG1-CD2 3.95Å; I120-F207 HydrophobicContact CG1-CE1 4.12Å; I120-F207 HydrophobicContact CG1-CE2 3.92Å; I120-F207 HydrophobicContact CG1-CG 4.05Å; I120-F207 HydrophobicContact CG1-CZ 4.02Å; E123-F207 HydrophobicContact CB-CE2 3.89Å; E123-F207 HydrophobicContact CB-CZ 4Å; E123-F207 HydrophobicContact CG-CE2 3.99Å; E123-F207 HydrophobicContact CG-CZ 4.41Å; L170-F207 HydrophobicContact CD1-CB 4.37Å; L170-F207 HydrophobicContact CD1-CD2 3.67Å; L170-F207 HydrophobicContact CD1-CE2 4.42Å; L170-F207 HydrophobicContact CD1-CG 4.36Å; V171-F207 WeakPolarHBondContact O-CA 3.48Å; L172-F207 HydrophobicContact CD2-CB 3.88Å; F207-V209 HydrophobicContact CD2-CG2 3.78Å; F207-V209 HydrophobicContact CE2-CG2 3.68Å
208R95.4Very high87.4Confident53 Ų5368 Ų6820%0.235%0.347CS..EExtended strand (participates in β ladder)trans-133.1144.8174.6-69.2166.762.5-140.63.2109.2V171 R173 I210 E224V171-R208 HydrophobicContact CB-CB 4.46Å; V171-R208 PolarHBondContact N-O 3.47Å; V171-R208 PolarHBondContact O-N 3.1Å; R173-R208 VanDerWaalsContact NH2-CD 3.29Å; R208-I210 HydrophobicContact CB-CD1 4.47Å; R208-E224 IonicContact NE-OE1 2.94Å
209V97.4Very high87.3Confident1 Ų164.9 Ų64.91%0.00636%0.357CS..EExtended strand (participates in β ladder)trans-124.7123.7171.7-169.50000108.5E123 L124 L127 L168 T169 L170 F207E123-V209 HydrophobicContact CB-CG2 4.47Å; E123-V209 HydrophobicContact CG-CB 4.11Å; E123-V209 HydrophobicContact CG-CG2 3.74Å; L124-V209 HydrophobicContact CD2-CG1 4.2Å; L127-V209 HydrophobicContact CD1-CB 3.56Å; L127-V209 HydrophobicContact CD1-CG1 3.37Å; L168-V209 HydrophobicContact CB-CG1 4Å; L168-V209 HydrophobicContact CD2-CG1 4.2Å; T169-V209 WeakPolarHBondContact O-CA 3.44Å; L170-V209 HydrophobicContact CD1-CG2 3.81Å; F207-V209 HydrophobicContact CD2-CG2 3.78Å; F207-V209 HydrophobicContact CE2-CG2 3.68Å
210I95.4Very high86.8Confident25 Ų2563.5 Ų63.513%0.12835%0.353CS..EExtended strand (participates in β ladder)trans-108120178.4-58.394.9000108.8L168 T169 V171 R208 I222L168-I210 WeakPolarHBondContact CA-O 3.37Å; T169-I210 PolarHBondContact N-O 2.89Å; T169-I210 PolarHBondContact O-N 3.11Å; V171-I210 HydrophobicContact CG2-CD1 3.91Å; R208-I210 HydrophobicContact CB-CD1 4.47Å; I210-I222 HydrophobicContact CG1-CG1 4.39Å; I210-I222 HydrophobicContact CG1-CG2 4.25Å; I210-I222 HydrophobicContact CG2-CG1 4.1Å
211K96.1Very high85.9Confident21 Ų2166.7 Ų66.79%0.09136%0.362CS..EExtended strand (participates in β ladder)trans-91.8131.8175.5-174.6170.665.21640111.5L127 S130 E131 F166 Q167 L168 L221L127-K211 HydrophobicContact CB-CD 4.46Å; L127-K211 WeakPolarHBondContact O-CD 3.49Å; L127-K211 PolarHBondContact O-NZ 3.33Å; S130-K211 PolarHBondContact OG-NZ 3.26Å; E131-K211 HydrophobicContact CG-CD 3.99Å; E131-K211 WeakPolarHBondContact OE1-CE 3.48Å; E131-K211 IonicContact OE1-NZ 2.87Å; E131-K211 PolarHBondContact OE1-NZ 3.16Å; F166-K211 HydrophobicContact CD2-CD 4.13Å; F166-K211 HydrophobicContact CD2-CG 4.17Å; Q167-K211 CarbonylContact O-C 3.52Å; Q167-K211 WeakPolarHBondContact O-CA 3.28Å; L168-K211 HydrophobicContact CD2-CB 3.78Å; L168-K211 HydrophobicContact CD2-CD 4.18Å; L168-K211 HydrophobicContact CD2-CG 3.84Å; K211-L221 PolarHBondContact N-O 2.94Å; K211-L221 PolarHBondContact O-N 2.72Å
212K94.4Very high84.8Confident99 Ų9970 Ų7043%0.4338%0.379SS..EExtended strand (participates in β ladder)trans-134.8123.6175.8176.4-175.2-171.7-178.50110.6F166 Q167 L214 L220F166-K212 CarbonylContact C-O 3.52Å; F166-K212 VanDerWaalsContact CA-O 3.28Å; F166-K212 WeakPolarHBondContact CA-O 3.42Å; Q167-K212 PolarHBondContact N-O 3.06Å; Q167-K212 PolarHBondContact O-N 2.96Å; K212-L214 PolarHBondContact O-N 2.94Å; K212-L220 HydrophobicContact CB-CD2 3.58Å; K212-L220 HydrophobicContact CD-CD2 3.5Å; K212-L220 VanDerWaalsContact CD-CD2 3.5Å; K212-L220 HydrophobicContact CG-CD2 3.42Å; K212-L220 VanDerWaalsContact CG-CD2 3.42Å
213K94.1Very high83.4Confident91 Ų9170.3 Ų70.340%0.39638%0.382SS..EExtended strand (participates in β ladder)trans-67131.7166.7-68.2-178.4-176.7168.30109.9E218K213-E218 IonicContact NZ-OE2 2.76Å; K213-E218 PolarHBondContact NZ-OE2 3.07Å
214L92.9Very high81.6Confident54 Ų5477.2 Ų77.228%0.28341%0.414SS..THydrogen-bonded Turntrans-79.6-27.8-176.2-68.8173.8000112.8P164 T165 Q167 K212P164-L214 HydrophobicContact CB-CD1 4.1Å; T165-L214 WeakPolarHBondContact O-CB 3.33Å; T165-L214 PolarHBondContact O-N 3.06Å; Q167-L214 HydrophobicContact CB-CD2 3.94Å; Q167-L214 HydrophobicContact CB-CG 4.41Å; K212-L214 PolarHBondContact O-N 2.94Å
215Y89.1Confident79.3Confident176 Ų17681 Ų8169%0.6944%0.439SS*.THydrogen-bonded Turntrans-125.241.1-174.7-49.8-73.4000112.2P164P164-Y215 WeakPolarHBondContact O-CE2 3.38Å
216S79.8Confident78.7Confident49 Ų4980.6 Ų80.634%0.34343%0.434SS..  trans-125.3153.9175-172.40000111.2E218S216-E218 VanDerWaalsContact C-N 3.34Å; S216-E218 WeakPolarHBondContact OG-CB 3.28Å; S216-E218 PolarHBondContact OG-N 3.38Å; S216-E218 VanDerWaalsContact OG-N 3.15Å
217S73.9Confident78Confident131 Ų13183.5 Ų83.592%0.91644%0.443SS*.SBendtrans-88-4.316953.10000113
218E67.3Low77Confident130 Ų13087.4 Ų87.461%0.60746%0.464SS*.SBendtrans-70.5144.7174.6-65.317615200111.7K213 S216K213-E218 IonicContact NZ-OE2 2.76Å; K213-E218 PolarHBondContact NZ-OE2 3.07Å; S216-E218 VanDerWaalsContact C-N 3.34Å; S216-E218 WeakPolarHBondContact OG-CB 3.28Å; S216-E218 PolarHBondContact OG-N 3.38Å; S216-E218 VanDerWaalsContact OG-N 3.15Å
219G62.8Low75.9Confident68 Ų6889.4 Ų89.470%0.70148%0.48SS*.PPolyproline II helixtrans-70.9169.7-177.200000115.1
220L62.9Low74.6Confident107 Ų10794.9 Ų94.956%0.5651%0.509SS*.PPolyproline II helixtrans-65.1134.1179.8-62.9173000112K212K212-L220 HydrophobicContact CB-CD2 3.58Å; K212-L220 HydrophobicContact CD-CD2 3.5Å; K212-L220 VanDerWaalsContact CD-CD2 3.5Å; K212-L220 HydrophobicContact CG-CD2 3.42Å; K212-L220 VanDerWaalsContact CG-CD2 3.42Å
221L62.9Low73.2Confident120 Ų12099.6 Ų99.663%0.62854%0.535SS*.EExtended strand (participates in β ladder)trans-99.3120.5169-62176.9000108.5K211K211-L221 PolarHBondContact N-O 2.94Å; K211-L221 PolarHBondContact O-N 2.72Å
222I62.9Low71.6Confident105 Ų105105.2 Ų105.254%0.53857%0.567SS.*EExtended strand (participates in β ladder)trans-107.1115.4176.1-58.4174.6000107.1I210I210-I222 HydrophobicContact CG1-CG1 4.39Å; I210-I222 HydrophobicContact CG1-CG2 4.25Å; I210-I222 HydrophobicContact CG2-CG1 4.1Å
223E61.6Low69.8Low85 Ų85105.7 Ų105.740%0.39758%0.577SS.*EExtended strand (participates in β ladder)trans-100.8122.9171.6-160.2147.1-168.500107.7L127L127-E223 HydrophobicContact CD2-CB 4.42Å; L127-E223 WeakPolarHBondContact CD2-OE2 3.44Å
224E53.9Low67.8Low145 Ų145106.9 Ų106.968%0.67859%0.592SS**  trans-101.7116.6174.6-82.1-165.2134.300108.8R208R208-E224 IonicContact NE-OE1 2.94Å
225C43.6Very low65.5Low113 Ų113111.7 Ų111.776%0.76462%0.62SS**  trans-105.10174.6-52.50000111.3E123E123-C225 PolarHBondContact OE1-SG 2.94Å; E123-C225 PolarHBondContact OE2-SG 3.09Å

Retrieved 225 of 225 residues in 52.6 ms (Link to these results)