A0A077ZMH2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZMH2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 132 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
1M38.6Very low44.1Very low245 Ų245169.9 Ų169.9100%1.20782%0.822SS**  0128.10-73.2-178.3167.500106.8
2H42.8Very low43.9Very low180 Ų180168 Ų16883%0.83382%0.819SS**  trans-80.5119.3-179.7-80.854.9000108.5
3E47.3Very low44.2Very low192 Ų192169.6 Ų169.690%0.89781%0.813SS**  trans-11591.1152.7-90179.3166.900106.1Q5E3-Q5 PolarHBondContact O-N 2.86Å
4T44.4Very low44Very low121 Ų121166.2 Ų166.274%0.74281%0.808SS**  trans-64.989.8165.333.60000107.4E6T4-E6 PolarHBondContact O-N 2.62Å; T4-E6 VanDerWaalsContact O-N 3.07Å
5Q43.9Very low44.3Very low175 Ų175166.9 Ų166.982%0.81881%0.805SS**  trans-67.9101.3169.6-167.1165.611.800107E3 V7E3-Q5 PolarHBondContact O-N 2.86Å; Q5-V7 VanDerWaalsContact C-N 3.31Å; Q5-V7 PolarHBondContact O-N 2.81Å
6E41.7Very low43.9Very low172 Ų172166.8 Ų166.880%0.80480%0.803SS**  trans-60.796.4170.2-74.6-175.9153.300108.1T4 I8T4-E6 PolarHBondContact O-N 2.62Å; T4-E6 VanDerWaalsContact O-N 3.07Å; E6-I8 VanDerWaalsContact C-N 3.34Å; E6-I8 PolarHBondContact O-N 3.1Å
7V45.7Very low44Very low111 Ų111168 Ų16867%0.67381%0.808SS**  trans-71.997167.2-177.30000105.7Q5 E9Q5-V7 VanDerWaalsContact C-N 3.31Å; Q5-V7 PolarHBondContact O-N 2.81Å; V7-E9 HydrophobicContact CG1-CG 3.93Å; V7-E9 PolarHBondContact O-N 3.16Å
8I43.7Very low43.8Very low136 Ų136165.9 Ų165.970%0.69780%0.802SS**  trans-70.787.9171.2-59.3173.1000106.8E6 L10E6-I8 VanDerWaalsContact C-N 3.34Å; E6-I8 PolarHBondContact O-N 3.1Å; I8-L10 VanDerWaalsContact C-N 3.29Å; I8-L10 HydrophobicContact CG2-CB 4.38Å; I8-L10 HydrophobicContact CG2-CD1 4.03Å; I8-L10 PolarHBondContact O-N 3.45Å
9E42.7Very low43.6Very low177 Ų177163.1 Ų163.183%0.82780%0.801SS**  trans-70.583.4169.4-70-174.116800109.5V7V7-E9 HydrophobicContact CG1-CG 3.93Å; V7-E9 PolarHBondContact O-N 3.16Å
10L48.2Very low43.6Very low126 Ų126161.2 Ų161.266%0.6679%0.792SS**  trans-134.159.8166.3-91.7146.4000108.7I8 Y13I8-L10 VanDerWaalsContact C-N 3.29Å; I8-L10 HydrophobicContact CG2-CB 4.38Å; I8-L10 HydrophobicContact CG2-CD1 4.03Å; I8-L10 PolarHBondContact O-N 3.45Å; L10-Y13 HydrophobicContact CD2-CD2 4.33Å; L10-Y13 HydrophobicContact CD2-CE2 4.26Å
11R46.4Very low43.6Very low234 Ų234158.8 Ų158.888%0.88379%0.792SS**  trans-117.4112.9158.1-67.8-171.3-176.1-158.31.5105.7
12D41.9Very low43.9Very low147 Ų147153.7 Ų153.779%0.78677%0.765SS**  trans149.425.7158.9-71.4-7.6000113.2V14D12-V14 PolarHBondContact O-N 3.34Å
13Y47.1Very low43.9Very low189 Ų189154 Ų15474%0.74176%0.764SS**  trans-75.882.2153.6-85.8-82.4000109.2L10 F15L10-Y13 HydrophobicContact CD2-CD2 4.33Å; L10-Y13 HydrophobicContact CD2-CE2 4.26Å; Y13-F15 HydrophobicContact CD1-CD2 4.38Å; Y13-F15 AromaticContact CD1-CE2 3.7Å; Y13-F15 HydrophobicContact CD1-CE2 3.7Å; Y13-F15 HydrophobicContact CD1-CZ 4.3Å; Y13-F15 HydrophobicContact CG-CE2 4.18Å; Y13-F15 PolarHBondContact O-N 3.15Å
14V41.2Very low44Very low122 Ų122149.1 Ų149.174%0.73976%0.757SS**  trans-65.587.5160.5-177.90000106.7D12 E16D12-V14 PolarHBondContact O-N 3.34Å; V14-E16 PolarHBondContact O-N 3.44Å
15F48.4Very low44Very low176 Ų176151.8 Ų151.877%0.77275%0.753SS**  trans-77103.4160.3-85-85.6000106.6Y13 E17Y13-F15 HydrophobicContact CD1-CD2 4.38Å; Y13-F15 AromaticContact CD1-CE2 3.7Å; Y13-F15 HydrophobicContact CD1-CE2 3.7Å; Y13-F15 HydrophobicContact CD1-CZ 4.3Å; Y13-F15 HydrophobicContact CG-CE2 4.18Å; Y13-F15 PolarHBondContact O-N 3.15Å; F15-E17 PolarHBondContact O-N 3.34Å
16E38.7Very low44Very low165 Ų165151 Ų15177%0.77176%0.755SS**  trans-48.7108.6165.4-76-179.7146.200108.3V14 N18V14-E16 PolarHBondContact O-N 3.44Å; E16-N18 PolarHBondContact O-N 2.93Å
17E45.2Very low44.2Very low188 Ų188152.4 Ų152.488%0.87975%0.753SS**  trans-67.686.9170.1-167.3178.1-15700106.4F15 S19F15-E17 PolarHBondContact O-N 3.34Å; E17-S19 VanDerWaalsContact C-N 3.29Å; E17-S19 PolarHBondContact O-N 2.85Å
18N41.2Very low44Very low131 Ų131151.6 Ų151.670%0.70175%0.752SS**  trans-57.8102.9169.6-89.6-13.1000107E16 I20E16-N18 PolarHBondContact O-N 2.93Å; N18-I20 VanDerWaalsContact C-N 3.28Å; N18-I20 PolarHBondContact O-N 2.93Å
19S39.7Very low44.1Very low112 Ų112150.9 Ų150.978%0.78376%0.756SS**  trans-47.390167.6175.10000109.7E17E17-S19 VanDerWaalsContact C-N 3.29Å; E17-S19 PolarHBondContact O-N 2.85Å
20I43Very low44.4Very low124 Ų124150.8 Ų150.864%0.63676%0.756SS**  trans-103.392.5158.8-51.2177000104.1N18 E22N18-I20 VanDerWaalsContact C-N 3.28Å; N18-I20 PolarHBondContact O-N 2.93Å; I20-E22 HydrophobicContact CG2-CB 3.82Å; I20-E22 HydrophobicContact CG2-CG 3.55Å; I20-E22 PolarHBondContact O-N 2.86Å
21S44.2Very low44.3Very low111 Ų111154.8 Ų154.878%0.77677%0.768SS**  trans-62.858.8160.262.60000109.6K23S21-K23 PolarHBondContact O-N 2.79Å
22E44.9Very low44.4Very low138 Ų138148.1 Ų148.165%0.64575%0.753SS**  trans-82101.3166.9-98.7-179.5178.800105.7I20 A24I20-E22 HydrophobicContact CG2-CB 3.82Å; I20-E22 HydrophobicContact CG2-CG 3.55Å; I20-E22 PolarHBondContact O-N 2.86Å; E22-A24 PolarHBondContact O-N 2.89Å; E22-A24 VanDerWaalsContact O-N 3.14Å
23K42.4Very low44.5Very low186 Ų186147.1 Ų147.181%0.80975%0.748SS**  trans-18.3118.5157.2-74.1172.6172.9177.30109.1S21 W25S21-K23 PolarHBondContact O-N 2.79Å; K23-W25 VanDerWaalsContact C-N 3.33Å; K23-W25 VanDerWaalsContact O-CD1 3.22Å; K23-W25 PolarHBondContact O-N 3.24Å
24A48.5Very low44.7Very low91 Ų91145.8 Ų145.875%0.75275%0.754SS**  trans-41.8107.6164.800000106.5E22 D26E22-A24 PolarHBondContact O-N 2.89Å; E22-A24 VanDerWaalsContact O-N 3.14Å; A24-D26 PolarHBondContact O-N 2.89Å
25W46.1Very low45Very low176 Ų176144.9 Ų144.967%0.66775%0.749SS**  trans-61.7112.9179.3-78.952.4000103.5K23 R27K23-W25 VanDerWaalsContact C-N 3.33Å; K23-W25 VanDerWaalsContact O-CD1 3.22Å; K23-W25 PolarHBondContact O-N 3.24Å; W25-R27 HydrophobicContact CB-CG 4.23Å; W25-R27 PolarHBondContact O-N 3Å
26D43.1Very low45Very low158 Ų158145.2 Ų145.285%0.84575%0.746SS**  trans-60.970.1167.8-84.7-38.5000108A24 S28A24-D26 PolarHBondContact O-N 2.89Å; D26-S28 PolarHBondContact O-N 2.94Å
27R45.3Very low45.5Very low202 Ų202142.3 Ų142.376%0.76274%0.744SS**  trans-8076.6163.9-70.1-164.5-175.9-171.13.2105.4W25W25-R27 HydrophobicContact CB-CG 4.23Å; W25-R27 PolarHBondContact O-N 3Å
28S41.7Very low45.8Very low95 Ų95143.1 Ų143.166%0.66475%0.745SS**  trans-43.2131.7150.7-69.50000107.2D26 Q30D26-S28 PolarHBondContact O-N 2.94Å; S28-Q30 PolarHBondContact O-N 2.97Å
29P46.5Very low46.4Very low121 Ų121142.3 Ų142.379%0.78674%0.744SS**  trans-57.7111.4-171.421.4-30.8000107.6F31P29-F31 PolarHBondContact O-N 3.41Å
30Q49.3Very low46.7Very low174 Ų174141.3 Ų141.381%0.81374%0.743SS**  trans-55.8116.7162.3-83.7-179.4-19.700104.2S28 V32S28-Q30 PolarHBondContact O-N 2.97Å; Q30-V32 WeakPolarHBondContact O-CG2 3.29Å; Q30-V32 PolarHBondContact O-N 2.89Å
31F45.8Very low47Very low211 Ų211143.6 Ų143.693%0.92575%0.748SS**  trans-45.196.5163.5-100.2-103.2000106P29 D33P29-F31 PolarHBondContact O-N 3.41Å; F31-D33 PolarHBondContact O-N 2.97Å
32V49Very low47.4Very low94 Ų94143.9 Ų143.957%0.5775%0.747SS**  trans-74.698.4171.7-166.40000102.1Q30 D34 Y36Q30-V32 WeakPolarHBondContact O-CG2 3.29Å; Q30-V32 PolarHBondContact O-N 2.89Å; V32-D34 PolarHBondContact O-N 2.98Å; V32-Y36 HydrophobicContact CB-CE2 4.36Å; V32-Y36 HydrophobicContact CG1-CE2 3.55Å
33D43.7Very low47.3Very low126 Ų126146.2 Ų146.267%0.67476%0.758SS**  trans-35.7132.6170.8-146.1-21.1000108.3F31 T35F31-D33 PolarHBondContact O-N 2.97Å; D33-T35 PolarHBondContact O-N 3.24Å
34D50.3Low47.7Very low160 Ų160146.2 Ų146.286%0.85676%0.761SS**SBendtrans-66.732.9-177.6-83.9-36.2000112.2V32 Y36V32-D34 PolarHBondContact O-N 2.98Å; D34-Y36 PolarHBondContact O-N 2.72Å
35T48.5Very low47.6Very low104 Ų104147.6 Ų147.664%0.63876%0.76SS**  trans-83.416173.2-25.20000112.2D33 S37D33-T35 PolarHBondContact O-N 3.24Å; T35-S37 PolarHBondContact O-N 2.83Å
36Y47.4Very low47.8Very low183 Ų183144.6 Ų144.672%0.71876%0.763SS**SBendtrans-65.893.6158.6-72.6-76.1000107.1V32 D34 K38V32-Y36 HydrophobicContact CB-CE2 4.36Å; V32-Y36 HydrophobicContact CG1-CE2 3.55Å; D34-Y36 PolarHBondContact O-N 2.72Å; Y36-K38 PolarHBondContact O-N 2.73Å
37S49.3Very low47.9Very low104 Ų104144.7 Ų144.773%0.72776%0.764SS**  trans-41112172.4-68.30000107.5T35 V39T35-S37 PolarHBondContact O-N 2.83Å; S37-V39 PolarHBondContact O-N 2.94Å
38K51.9Low47.8Very low205 Ų205139.2 Ų139.289%0.89176%0.761SS**  trans-47.5109.7-178.9-75.7178.5177.31770107.3Y36 A40Y36-K38 PolarHBondContact O-N 2.73Å; K38-A40 VanDerWaalsContact C-N 3.27Å; K38-A40 PolarHBondContact O-N 2.87Å
39V53.9Low47.8Very low113 Ų113141.6 Ų141.669%0.68577%0.767SS**  trans-63.198.7174.2179.10000105.1S37 F41S37-V39 PolarHBondContact O-N 2.94Å; V39-F41 HydrophobicContact CG1-CE2 4.47Å; V39-F41 HydrophobicContact CG1-CZ 4.47Å; V39-F41 WeakPolarHBondContact O-CD2 3.46Å; V39-F41 PolarHBondContact O-N 3.07Å; V39-F41 VanDerWaalsContact O-N 3.14Å
40A45.7Very low47.5Very low92 Ų92141 Ų14176%0.7677%0.765SS**  trans-72.7106.5176.400000106.8K38K38-A40 VanDerWaalsContact C-N 3.27Å; K38-A40 PolarHBondContact O-N 2.87Å
41F50.1Low47.2Very low172 Ų172144 Ų14475%0.75477%0.771SS**PPolyproline II helixtrans-66.3133.9169.6-70.2-86000108.2V39 E43V39-F41 HydrophobicContact CG1-CE2 4.47Å; V39-F41 HydrophobicContact CG1-CZ 4.47Å; V39-F41 WeakPolarHBondContact O-CD2 3.46Å; V39-F41 PolarHBondContact O-N 3.07Å; V39-F41 VanDerWaalsContact O-N 3.14Å; F41-E43 PolarHBondContact O-N 3.05Å
42P52.5Low46.6Very low116 Ų116138.7 Ų138.775%0.75376%0.757SS**PPolyproline II helixtrans-59.7130.5175.724.1-31.3000108.9E44P42-E44 PolarHBondContact O-N 2.99Å
43E43.2Very low46Very low188 Ų188144.9 Ų144.988%0.87977%0.771SS**PPolyproline II helixtrans-58.7119.8179-146170.7-172.700108.5F41 V45F41-E43 PolarHBondContact O-N 3.05Å; E43-V45 PolarHBondContact O-N 2.91Å
44E49.9Very low45.4Very low186 Ų186145 Ų14587%0.86978%0.775SS**  trans-63.2103.8179.4-75.8-176161.700108.5P42 P46P42-E44 PolarHBondContact O-N 2.99Å; E44-P46 VanDerWaalsContact O-CD 3.28Å; E44-P46 WeakPolarHBondContact O-CD 3.42Å
45V47.2Very low44.4Very low120 Ų120141 Ų14173%0.72776%0.759SS**  trans-61.4119.4169.4-174.10000106.5E43 N47E43-V45 PolarHBondContact O-N 2.91Å; V45-N47 PolarHBondContact O-N 2.02Å
46P48.6Very low43.6Very low112 Ų112142.7 Ų142.773%0.72776%0.764SS**  trans-63.7114175.523.9-29.6000106.8E44 A48E44-P46 VanDerWaalsContact O-CD 3.28Å; E44-P46 WeakPolarHBondContact O-CD 3.42Å; P46-A48 PolarHBondContact O-N 2.73Å
47N46.9Very low43.4Very low161 Ų161139.8 Ų139.886%0.86177%0.767SS**  trans-60.690.3170.2-84-34.1000107.7V45 D49V45-N47 PolarHBondContact O-N 2.02Å; N47-D49 PolarHBondContact O-N 2.95Å
48A42.2Very low42.6Very low86 Ų86142.7 Ų142.771%0.71178%0.775SS**  trans-63.888.2156.600000105.8P46P46-A48 PolarHBondContact O-N 2.73Å
49D42Very low41.4Very low146 Ų146135.6 Ų135.678%0.78176%0.76SS**SBendtrans162.8125.6133.6-77.2-28.9000111.4N47N47-D49 PolarHBondContact O-N 2.95Å
50S39.9Very low40.4Very low107 Ų107138.2 Ų138.275%0.74877%0.769SS**  trans73.295.3153.774.80000119.4
51Y42.5Very low39.7Very low238 Ų238138 Ų13893%0.93376%0.758SS**  -82.1127.5123.8-75.4-92.4000106.3
52P35Very low39.2Very low99 Ų99136 Ų13664%0.64375%0.754SS**  -150.6134.699.234.4-14.7000116.9
53R34.4Very low38.5Very low225 Ų225139.5 Ų139.585%0.84976%0.758SS**  65.6106.2126.1-58.1-178.6-170.4-170.53.1120.5
54V31.1Very low38.5Very low127 Ų127136.3 Ų136.377%0.7775%0.747SS**  37.2106.5125.4-1690000116.1
55C30.2Very low38Very low77 Ų77135.4 Ų135.452%0.5275%0.748SS.*  trans-114.8123.7162.7-85.90000111.6
56L31.9Very low37.9Very low139 Ų139133.8 Ų133.873%0.72875%0.747SS**  trans-82.5165.7-173.8-85.4160.9000112.6N58L56-N58 VanDerWaalsContact C-N 3.26Å; L56-N58 PolarHBondContact O-N 3.09Å
57P42.6Very low37.9Very low122 Ų122134.9 Ų134.979%0.79274%0.743SS**SBendtrans-70.4-0-159.924.3-34.2000117.6
58N32Very low38.2Very low165 Ų165130.8 Ų130.888%0.88273%0.725SS**SBendtrans-114.793.8176.1-74.3-6.9000110.6L56L56-N58 VanDerWaalsContact C-N 3.26Å; L56-N58 PolarHBondContact O-N 3.09Å
59G28.2Very low38.8Very low57 Ų57128.7 Ų128.759%0.58870%0.704SS**SBendtrans10499.2170.400000113.5T61G59-T61 PolarHBondContact O-N 2.92Å
60L31.5Very low39.3Very low168 Ų168123.3 Ų123.388%0.8868%0.677SS**  trans2.7112.7152.7-7592.2000115.9
61T32.4Very low40.3Very low86 Ų86121.9 Ų121.953%0.52866%0.658SS.*  -179100.3104.744.60000108.4G59 K63G59-T61 PolarHBondContact O-N 2.92Å; T61-K63 VanDerWaalsContact C-N 3.29Å
62I39.6Very low41.3Very low131 Ų131113.8 Ų113.867%0.67263%0.634SS**  trans-94.282.9144.6-60.8178000104.1D64I62-D64 HydrophobicContact CG2-CB 3.66Å; I62-D64 WeakPolarHBondContact CG2-OD2 3.33Å; I62-D64 PolarHBondContact O-N 2.99Å
63K38.2Very low42.6Very low189 Ų189114.4 Ų114.482%0.82262%0.624SS**  trans-71.468.6154.4-84.5-172.7173.4-178.40106.4T61T61-K63 VanDerWaalsContact C-N 3.29Å
64D42.4Very low44.3Very low122 Ų122111.7 Ų111.765%0.65261%0.614SS**  trans-112.6123.3156.4-71-41.1000104I62 A66I62-D64 HydrophobicContact CG2-CB 3.66Å; I62-D64 WeakPolarHBondContact CG2-OD2 3.33Å; I62-D64 PolarHBondContact O-N 2.99Å; D64-A66 PolarHBondContact O-N 2.81Å
65N39.2Very low46Very low166 Ų166108.2 Ų108.289%0.88859%0.592SS**  trans-5573.9153.1-70.9-32.9000106.6Q67N65-Q67 PolarHBondContact O-N 2.79Å
66A45.5Very low47.7Very low86 Ų86110.8 Ų110.871%0.71160%0.597SS**  trans-61.384.9164.800000102.8D64D64-A66 PolarHBondContact O-N 2.81Å
67Q48.6Very low49.1Very low136 Ų136106.8 Ų106.864%0.63658%0.576SS**  trans-52.7118.7-178.6-165.9169.611.300103N65 C69N65-Q67 PolarHBondContact O-N 2.79Å; Q67-C69 PolarHBondContact O-N 2.75Å
68P53.5Low50.4Low75 Ų75110.6 Ų110.649%0.48758%0.583SS.*  trans-50.9123.3-166.216.1-29.9000107.3T70P68-T70 CarbonylContact O-C 3.57Å; P68-T70 PolarHBondContact O-N 2.99Å
69C53.9Low52.4Low42 Ų42108.5 Ų108.528%0.28458%0.577SS.*SBendtrans-53.5-18.2176.5-82.90000111.6Q67 E90 K91 C95Q67-C69 PolarHBondContact O-N 2.75Å; C69-E90 CarbonylContact O-C 3.58Å; C69-E90 WeakPolarHBondContact O-CA 3.35Å; C69-K91 PolarHBondContact O-N 3.23Å; C69-C95 HydrophobicContact CB-CB 4.43Å; C69-C95 WeakPolarHBondContact CB-SG 3.47Å; C69-C95 WeakPolarHBondContact SG-CA 3.27Å; C69-C95 WeakPolarHBondContact SG-CB 3.34Å; C69-C95 CovalentContact SG-SG 2.02Å; C69-C95 PolarHBondContact SG-SG 2.63Å
70T53.1Low54.5Low33 Ų33110.2 Ų110.220%0.20258%0.576CS.*EExtended strand (participates in β ladder)trans-80.6121.7172.660.20000111.9P68 R88 R89 E90P68-T70 CarbonylContact O-C 3.57Å; P68-T70 PolarHBondContact O-N 2.99Å; T70-R88 HydrophobicContact CG2-CB 4.33Å; T70-R88 PolarHBondContact OG1-NE 3.22Å; T70-R88 PolarHBondContact OG1-NH2 3.11Å; T70-R89 CarbonylContact C-O 3.55Å; T70-R89 VanDerWaalsContact CA-O 3.27Å; T70-R89 WeakPolarHBondContact CA-O 3.28Å; T70-E90 HydrophobicContact CG2-CG 4.08Å
71E60.6Low56.1Low77 Ų77104.4 Ų104.436%0.3656%0.557SS.*EExtended strand (participates in β ladder)trans-91.8129.7159.8-172.3158.4-113.700107.9R89 K91 K94E71-R89 PolarHBondContact N-O 3.42Å; E71-R89 PolarHBondContact O-N 3.05Å; E71-K91 IonicContact OE1-NZ 3.37Å; E71-K91 WeakPolarHBondContact OE2-CD 3.04Å; E71-K91 WeakPolarHBondContact OE2-CE 3.49Å; E71-K91 IonicContact OE2-NZ 3.39Å; E71-K91 PolarHBondContact OE2-NZ 2.81Å; E71-K94 IonicContact OE1-NZ 2.7Å; E71-K94 PolarHBondContact OE1-NZ 3.09Å
72T63.3Low57.8Low68 Ų68106.8 Ų106.842%0.41756%0.562SS.*EExtended strand (participates in β ladder)trans-77.9130.2166.936.80000109E86 V87 R88T72-E86 WeakPolarHBondContact CB-OE1 3.27Å; T72-E86 HydrophobicContact CG2-CG 3.75Å; T72-E86 VanDerWaalsContact CG2-OE1 3.28Å; T72-E86 WeakPolarHBondContact CG2-OE1 3.43Å; T72-E86 PolarHBondContact OG1-OE1 3.41Å; T72-V87 CarbonylContact C-O 3.59Å; T72-V87 WeakPolarHBondContact CA-O 3.35Å; T72-R88 HydrophobicContact CG2-CG 3.48Å; T72-R88 VanDerWaalsContact CG2-CG 3.48Å
73Y63.5Low59.1Low111 Ų111104 Ų10444%0.43555%0.552SS.*EExtended strand (participates in β ladder)trans-122.9145.1168.568.4-76.9000108.8V75 V87 R89Y73-V75 HydrophobicContact CD2-CG2 4.15Å; Y73-V75 HydrophobicContact CE2-CG2 3.61Å; Y73-V87 HydrophobicContact CD1-CB 4.36Å; Y73-V87 VanDerWaalsContact CD1-O 3.27Å; Y73-V87 WeakPolarHBondContact CD1-O 3.35Å; Y73-V87 HydrophobicContact CE1-CB 3.75Å; Y73-V87 HydrophobicContact CE1-CG1 3.74Å; Y73-V87 HydrophobicContact CE2-CB 4.33Å; Y73-V87 PolarHBondContact N-O 3.23Å; Y73-V87 PolarHBondContact O-N 3.02Å; Y73-R89 HydrophobicContact CD1-CB 3.98Å; Y73-R89 HydrophobicContact CE1-CB 3.55Å
74R68.5Low60.6Low169 Ų16998.4 Ų98.464%0.63854%0.537SS*.EExtended strand (participates in β ladder)trans-87.2123.3176.4-68.2179.4176.1-176.7-1.9108.1P83 Q85R74-P83 HydrophobicContact CB-CB 3.94Å; R74-P83 HydrophobicContact CG-CB 4.25Å; R74-Q85 WeakPolarHBondContact CA-O 3.34Å
75V68.4Low62.1Low53 Ų5398.6 Ų98.632%0.32153%0.534SS..EExtended strand (participates in β ladder)trans-82115.2166.4-179.80000106Y73 S84 Q85 V87Y73-V75 HydrophobicContact CD2-CG2 4.15Å; Y73-V75 HydrophobicContact CE2-CG2 3.61Å; V75-S84 PolarHBondContact O-N 3.37Å; V75-S84 PolarHBondContact O-OG 3.46Å; V75-Q85 PolarHBondContact N-O 3.49Å; V75-Q85 PolarHBondContact O-N 2.99Å; V75-V87 HydrophobicContact CG2-CB 4.26Å; V75-V87 HydrophobicContact CG2-CG2 3.59Å
76E64.1Low63.4Low131 Ų13196.2 Ų96.261%0.61252%0.518SS*.EExtended strand (participates in β ladder)trans-75136.4169.6-67.9176.7175.300108.7Q78 E82E76-Q78 PolarHBondContact O-N 2.64Å; E76-E82 WeakPolarHBondContact CA-O 3.05Å
77D62.9Low64.5Low56 Ų5693.9 Ų93.930%0.29950%0.495SS..  trans-65.1122.7168.1-167.7-35.4000108.6T79 T80 G81 E82 S84D77-T79 VanDerWaalsContact CG-OG1 3.29Å; D77-T79 PolarHBondContact O-N 3.01Å; D77-T79 VanDerWaalsContact O-N 3.1Å; D77-T79 WeakPolarHBondContact OD1-CB 3.42Å; D77-T79 PolarHBondContact OD1-N 3.29Å; D77-T79 PolarHBondContact OD1-OG1 3.24Å; D77-T80 VanDerWaalsContact CB-OG1 3.29Å; D77-T80 WeakPolarHBondContact CB-OG1 2.86Å; D77-T80 PolarHBondContact O-N 2.95Å; D77-G81 WeakPolarHBondContact O-CA 3.34Å; D77-G81 PolarHBondContact O-N 2.76Å; D77-E82 PolarHBondContact N-O 2.91Å; D77-S84 PolarHBondContact N-OG 3.28Å
78Q68.2Low65.2Low201 Ų20195.3 Ų95.394%0.93949%0.494SS*.THydrogen-bonded Turntrans-63-17.7179.8-65.3-174.629.600112.7E76E76-Q78 PolarHBondContact O-N 2.64Å
79T74.9Confident65.5Low122 Ų122100.2 Ų100.275%0.74850%0.503SS*.THydrogen-bonded Turntrans-92.3-35.6-178.461.10000114D77D77-T79 VanDerWaalsContact CG-OG1 3.29Å; D77-T79 PolarHBondContact O-N 3.01Å; D77-T79 VanDerWaalsContact O-N 3.1Å; D77-T79 WeakPolarHBondContact OD1-CB 3.42Å; D77-T79 PolarHBondContact OD1-N 3.29Å; D77-T79 PolarHBondContact OD1-OG1 3.24Å
80T73.1Confident65.6Low92 Ų92105 Ų10556%0.56452%0.521SS*.THydrogen-bonded Turntrans-109.4-14.4-178.437.40000113.9D77 E82D77-T80 VanDerWaalsContact CB-OG1 3.29Å; D77-T80 WeakPolarHBondContact CB-OG1 2.86Å; D77-T80 PolarHBondContact O-N 2.95Å; T80-E82 PolarHBondContact O-N 3.14Å; T80-E82 VanDerWaalsContact O-N 3.16Å
81G65.3Low65.8Low47 Ų47107.2 Ų107.249%0.48553%0.528SS..  trans67.64.3-175.100000113.9D77D77-G81 WeakPolarHBondContact O-CA 3.34Å; D77-G81 PolarHBondContact O-N 2.76Å
82E67.8Low65.4Low136 Ų136107.1 Ų107.164%0.63653%0.534SS*.SBendtrans-88.2146.6176.9-66.1-157.8134.800110.4E76 D77 T80 S84E76-E82 WeakPolarHBondContact CA-O 3.05Å; D77-E82 PolarHBondContact N-O 2.91Å; T80-E82 PolarHBondContact O-N 3.14Å; T80-E82 VanDerWaalsContact O-N 3.16Å; E82-S84 PolarHBondContact O-N 2.98Å
83P66.2Low65Low71 Ų71106.5 Ų106.546%0.46153%0.532SS..EExtended strand (participates in β ladder)trans-63.2104.317426.8-33.5000109.3R74R74-P83 HydrophobicContact CB-CB 3.94Å; R74-P83 HydrophobicContact CG-CB 4.25Å
84S70.3Confident64.4Low72 Ų72104.9 Ų104.950%0.50353%0.528SS..EExtended strand (participates in β ladder)trans-83.6-30.5-178.649.40000112.3V75 D77 E82V75-S84 PolarHBondContact O-N 3.37Å; V75-S84 PolarHBondContact O-OG 3.46Å; D77-S84 PolarHBondContact N-OG 3.28Å; E82-S84 PolarHBondContact O-N 2.98Å
85Q73Confident63.7Low127 Ų12797.4 Ų97.459%0.59350%0.501SS*.EExtended strand (participates in β ladder)trans-151.6133.8-173.8-163.7171.87.500112.6R74 V75 V87R74-Q85 WeakPolarHBondContact CA-O 3.34Å; V75-Q85 PolarHBondContact N-O 3.49Å; V75-Q85 PolarHBondContact O-N 2.99Å; Q85-V87 HydrophobicContact CB-CG2 4.48Å; Q85-V87 HydrophobicContact CG-CG2 4.08Å
86E66.5Low63Low115 Ų115102.5 Ų102.554%0.53752%0.521SS..EExtended strand (participates in β ladder)trans-90.4114.5169-167.9168.8175.900109T72T72-E86 WeakPolarHBondContact CB-OE1 3.27Å; T72-E86 HydrophobicContact CG2-CG 3.75Å; T72-E86 VanDerWaalsContact CG2-OE1 3.28Å; T72-E86 WeakPolarHBondContact CG2-OE1 3.43Å; T72-E86 PolarHBondContact OG1-OE1 3.41Å
87V69Low62.4Low38 Ų38100.4 Ų100.423%0.2352%0.521CS..EExtended strand (participates in β ladder)trans-109.3136.6-177.6-177.90000109.2T72 Y73 V75 Q85T72-V87 CarbonylContact C-O 3.59Å; T72-V87 WeakPolarHBondContact CA-O 3.35Å; Y73-V87 HydrophobicContact CD1-CB 4.36Å; Y73-V87 VanDerWaalsContact CD1-O 3.27Å; Y73-V87 WeakPolarHBondContact CD1-O 3.35Å; Y73-V87 HydrophobicContact CE1-CB 3.75Å; Y73-V87 HydrophobicContact CE1-CG1 3.74Å; Y73-V87 HydrophobicContact CE2-CB 4.33Å; Y73-V87 PolarHBondContact N-O 3.23Å; Y73-V87 PolarHBondContact O-N 3.02Å; V75-V87 HydrophobicContact CG2-CB 4.26Å; V75-V87 HydrophobicContact CG2-CG2 3.59Å; Q85-V87 HydrophobicContact CB-CG2 4.48Å; Q85-V87 HydrophobicContact CG-CG2 4.08Å
88R63.7Low61.7Low165 Ų16598.2 Ų98.262%0.62351%0.511SS*.EExtended strand (participates in β ladder)trans-91.6121174.5-68.9-17985.5164.53109T70 T72T70-R88 HydrophobicContact CG2-CB 4.33Å; T70-R88 PolarHBondContact OG1-NE 3.22Å; T70-R88 PolarHBondContact OG1-NH2 3.11Å; T72-R88 HydrophobicContact CG2-CG 3.48Å; T72-R88 VanDerWaalsContact CG2-CG 3.48Å
89R59.3Low60.9Low178 Ų17894.5 Ų94.567%0.67249%0.492SS*.EExtended strand (participates in β ladder)trans-117135.2170.2175.6173.9-174.8-171.73.8110.4T70 E71 Y73 K91T70-R89 CarbonylContact C-O 3.55Å; T70-R89 VanDerWaalsContact CA-O 3.27Å; T70-R89 WeakPolarHBondContact CA-O 3.28Å; E71-R89 PolarHBondContact N-O 3.42Å; E71-R89 PolarHBondContact O-N 3.05Å; Y73-R89 HydrophobicContact CD1-CB 3.98Å; Y73-R89 HydrophobicContact CE1-CB 3.55Å; R89-K91 PolarHBondContact O-N 3.1Å
90E56.8Low59.9Low143 Ų14393.2 Ų93.267%0.66848%0.478SS*.EExtended strand (participates in β ladder)trans-67.9125.7172.2-63.5-170.517000110.3C69 T70 P92C69-E90 CarbonylContact O-C 3.58Å; C69-E90 WeakPolarHBondContact O-CA 3.35Å; T70-E90 HydrophobicContact CG2-CG 4.08Å; E90-P92 WeakPolarHBondContact O-CD 3.46Å
91K56.5Low59Low80 Ų8091.9 Ų91.935%0.34847%0.467SS..  trans-106.495.3175-156.4179.9-160.5161.80107.6C69 E71 R89 S93 K94C69-K91 PolarHBondContact O-N 3.23Å; E71-K91 IonicContact OE1-NZ 3.37Å; E71-K91 WeakPolarHBondContact OE2-CD 3.04Å; E71-K91 WeakPolarHBondContact OE2-CE 3.49Å; E71-K91 IonicContact OE2-NZ 3.39Å; E71-K91 PolarHBondContact OE2-NZ 2.81Å; R89-K91 PolarHBondContact O-N 3.1Å; K91-S93 PolarHBondContact O-N 3.39Å; K91-S93 VanDerWaalsContact O-N 3.09Å; K91-K94 HydrophobicContact CB-CD 4.47Å; K91-K94 HydrophobicContact CB-CG 4.44Å; K91-K94 HydrophobicContact CD-CD 4.12Å; K91-K94 HydrophobicContact CD-CG 4.17Å; K91-K94 PolarHBondContact O-N 3.13Å
92P52.8Low58.6Low74 Ų7493.6 Ų93.648%0.48146%0.464SS..G310 helixtrans-59.8-27-174.219-30.1000112.9E90 K94 C95 G98E90-P92 WeakPolarHBondContact O-CD 3.46Å; P92-K94 PolarHBondContact O-N 3.45Å; P92-C95 WeakPolarHBondContact O-CB 3.17Å; P92-C95 PolarHBondContact O-N 3Å; P92-G98 CarbonylContact O-C 3.43Å; P92-G98 WeakPolarHBondContact O-CA 3.47Å
93S53.2Low58.2Low55 Ų5593.3 Ų93.339%0.38546%0.464SS..G310 helixtrans-66.2-17.3174.862.20000114.7K91 K99K91-S93 PolarHBondContact O-N 3.39Å; K91-S93 VanDerWaalsContact O-N 3.09Å; S93-K99 WeakPolarHBondContact O-CE 3.45Å; S93-K99 VanDerWaalsContact O-CG 3.28Å; S93-K99 WeakPolarHBondContact O-CG 3.21Å
94K53Low57.8Low78 Ų7897.2 Ų97.234%0.33947%0.47SS..G310 helixtrans-89.6-17.9171.1-68.3-175.1-178.3174.70112.2E71 K91 P92E71-K94 IonicContact OE1-NZ 2.7Å; E71-K94 PolarHBondContact OE1-NZ 3.09Å; K91-K94 HydrophobicContact CB-CD 4.47Å; K91-K94 HydrophobicContact CB-CG 4.44Å; K91-K94 HydrophobicContact CD-CD 4.12Å; K91-K94 HydrophobicContact CD-CG 4.17Å; K91-K94 PolarHBondContact O-N 3.13Å; P92-K94 PolarHBondContact O-N 3.45Å
95C52.4Low57.3Low12 Ų1296 Ų968%0.08146%0.46CS..SBendtrans-82.6139.8175.7-53.70000111C69 P92 S97 G98 K99C69-C95 HydrophobicContact CB-CB 4.43Å; C69-C95 WeakPolarHBondContact CB-SG 3.47Å; C69-C95 WeakPolarHBondContact SG-CA 3.27Å; C69-C95 WeakPolarHBondContact SG-CB 3.34Å; C69-C95 CovalentContact SG-SG 2.02Å; C69-C95 PolarHBondContact SG-SG 2.63Å; P92-C95 WeakPolarHBondContact O-CB 3.17Å; P92-C95 PolarHBondContact O-N 3Å; C95-S97 VanDerWaalsContact C-N 3.26Å; C95-S97 PolarHBondContact O-N 2.9Å; C95-G98 PolarHBondContact O-N 2.93Å; C95-K99 WeakPolarHBondContact O-CG 3.43Å; C95-K99 PolarHBondContact O-N 2.92Å
96H53.5Low56.6Low160 Ų16097.2 Ų97.274%0.74146%0.46SS*.Hα-helixtrans-58-42171.7-168.663.6000111.5K99 E100H96-K99 PolarHBondContact O-N 3.47Å; H96-E100 PolarHBondContact O-N 3.36Å; H96-E100 VanDerWaalsContact O-N 3.13Å
97S52.6Low56.5Low86 Ų8695.6 Ų95.660%0.60146%0.457SS*.Hα-helixtrans-62.4-44.7175.850.90000113.2C95 E100 L101C95-S97 VanDerWaalsContact C-N 3.26Å; C95-S97 PolarHBondContact O-N 2.9Å; S97-E100 PolarHBondContact O-N 3.43Å; S97-L101 WeakPolarHBondContact O-CB 3.38Å; S97-L101 PolarHBondContact O-N 2.92Å; S97-L101 VanDerWaalsContact O-N 3.1Å
98G47.1Very low56Low10 Ų1095.3 Ų95.310%0.10346%0.455CS..Hα-helixtrans-70.8-34179.500000112.9P92 C95 L101 I102P92-G98 CarbonylContact O-C 3.43Å; P92-G98 WeakPolarHBondContact O-CA 3.47Å; C95-G98 PolarHBondContact O-N 2.93Å; G98-L101 PolarHBondContact O-N 3.32Å; G98-I102 WeakPolarHBondContact O-CB 3.38Å; G98-I102 WeakPolarHBondContact O-CD1 3.42Å; G98-I102 WeakPolarHBondContact O-CG1 3.38Å; G98-I102 PolarHBondContact O-N 2.82Å
99K52Low55.8Low123 Ų12390 Ų9054%0.53545%0.446SS..Hα-helixtrans-62.5-45.5171.3-75.5-173.7-179.4-176.10112.2S93 C95 H96 L101 I102 M103S93-K99 WeakPolarHBondContact O-CE 3.45Å; S93-K99 VanDerWaalsContact O-CG 3.28Å; S93-K99 WeakPolarHBondContact O-CG 3.21Å; C95-K99 WeakPolarHBondContact O-CG 3.43Å; C95-K99 PolarHBondContact O-N 2.92Å; H96-K99 PolarHBondContact O-N 3.47Å; K99-L101 VanDerWaalsContact C-N 3.3Å; K99-L101 PolarHBondContact O-N 3.45Å; K99-I102 PolarHBondContact O-N 2.83Å; K99-M103 WeakPolarHBondContact O-CB 2.89Å; K99-M103 WeakPolarHBondContact O-CG 3.28Å; K99-M103 PolarHBondContact O-N 2.93Å
100E54.4Low55.9Low96 Ų9687 Ų8745%0.44944%0.438SS..Hα-helixtrans-62.1-41.3178.6-164.3-174164.800111.2H96 S97 M103 R104H96-E100 PolarHBondContact O-N 3.36Å; H96-E100 VanDerWaalsContact O-N 3.13Å; S97-E100 PolarHBondContact O-N 3.43Å; E100-M103 PolarHBondContact O-N 2.9Å; E100-R104 WeakPolarHBondContact O-CG 3.42Å; E100-R104 PolarHBondContact O-N 2.67Å; E100-R104 IonicContact OE1-CZ 2.72Å; E100-R104 IonicContact OE1-NE 3.74Å; E100-R104 PolarHBondContact OE1-NE 3.26Å; E100-R104 IonicContact OE1-NH2 2.73Å; E100-R104 PolarHBondContact OE1-NH2 3.5Å
101L53.4Low56Low63 Ų6381.2 Ų81.233%0.3341%0.413SS..Hα-helixtrans-69.3-41.7179.2-157.3149.6000112.3S97 G98 K99 M103 R104 T105 V130S97-L101 WeakPolarHBondContact O-CB 3.38Å; S97-L101 PolarHBondContact O-N 2.92Å; S97-L101 VanDerWaalsContact O-N 3.1Å; G98-L101 PolarHBondContact O-N 3.32Å; K99-L101 VanDerWaalsContact C-N 3.3Å; K99-L101 PolarHBondContact O-N 3.45Å; L101-M103 VanDerWaalsContact C-N 3.33Å; L101-M103 PolarHBondContact O-N 2.65Å; L101-R104 PolarHBondContact O-N 3.45Å; L101-T105 HydrophobicContact CD2-CG2 4.07Å; L101-T105 WeakPolarHBondContact O-CG2 3.36Å; L101-T105 PolarHBondContact O-N 2.9Å; L101-T105 PolarHBondContact O-OG1 2.7Å; L101-V130 HydrophobicContact CD1-CG2 4.23Å; L101-V130 HydrophobicContact CD2-CG2 3.31Å; L101-V130 HydrophobicContact CG-CG2 4.4Å
102I57.7Low55.9Low84 Ų8481 Ų8143%0.43142%0.415SS..Hα-helixtrans-61.7-41.6172.8-67.9164.7000110.7G98 K99 T105 Y106G98-I102 WeakPolarHBondContact O-CB 3.38Å; G98-I102 WeakPolarHBondContact O-CD1 3.42Å; G98-I102 WeakPolarHBondContact O-CG1 3.38Å; G98-I102 PolarHBondContact O-N 2.82Å; K99-I102 PolarHBondContact O-N 2.83Å; I102-T105 WeakPolarHBondContact CA-OG1 3.36Å; I102-T105 PolarHBondContact O-N 2.91Å; I102-T105 PolarHBondContact O-OG1 3.37Å; I102-Y106 WeakPolarHBondContact O-CB 3.5Å; I102-Y106 PolarHBondContact O-N 2.81Å
103M59.4Low56.2Low129 Ų12982.4 Ų82.464%0.63543%0.427SS*.Hα-helixtrans-64-42.8176.2-81.5-87.9-7600112.2K99 E100 L101 Y106 T107K99-M103 WeakPolarHBondContact O-CB 2.89Å; K99-M103 WeakPolarHBondContact O-CG 3.28Å; K99-M103 PolarHBondContact O-N 2.93Å; E100-M103 PolarHBondContact O-N 2.9Å; L101-M103 VanDerWaalsContact C-N 3.33Å; L101-M103 PolarHBondContact O-N 2.65Å; M103-Y106 PolarHBondContact O-N 2.87Å; M103-T107 WeakPolarHBondContact O-CB 3.37Å; M103-T107 PolarHBondContact O-N 2.99Å; M103-T107 PolarHBondContact O-OG1 2.71Å
104R57.6Low56.8Low154 Ų15485.3 Ų85.358%0.58144%0.438SS*.Hα-helixtrans-62.6-48176-75-178.1-172.7-162.54.5111.7E100 L101 Y106 T107 L108E100-R104 WeakPolarHBondContact O-CG 3.42Å; E100-R104 PolarHBondContact O-N 2.67Å; E100-R104 IonicContact OE1-CZ 2.72Å; E100-R104 IonicContact OE1-NE 3.74Å; E100-R104 PolarHBondContact OE1-NE 3.26Å; E100-R104 IonicContact OE1-NH2 2.73Å; E100-R104 PolarHBondContact OE1-NH2 3.5Å; L101-R104 PolarHBondContact O-N 3.45Å; R104-Y106 PolarHBondContact O-N 2.94Å; R104-T107 PolarHBondContact O-N 3.37Å; R104-L108 WeakPolarHBondContact O-CB 3.33Å; R104-L108 WeakPolarHBondContact O-CG 3.35Å; R104-L108 PolarHBondContact O-N 2.9Å
105T58.6Low56.9Low47 Ų4784.3 Ų84.329%0.28845%0.45SS..Hα-helixtrans-63.4-40.4177.652.10000112.2L101 I102 L108 A109L101-T105 HydrophobicContact CD2-CG2 4.07Å; L101-T105 WeakPolarHBondContact O-CG2 3.36Å; L101-T105 PolarHBondContact O-N 2.9Å; L101-T105 PolarHBondContact O-OG1 2.7Å; I102-T105 WeakPolarHBondContact CA-OG1 3.36Å; I102-T105 PolarHBondContact O-N 2.91Å; I102-T105 PolarHBondContact O-OG1 3.37Å; T105-L108 PolarHBondContact O-N 2.92Å; T105-A109 VanDerWaalsContact O-CB 3.3Å; T105-A109 WeakPolarHBondContact O-CB 3.42Å; T105-A109 PolarHBondContact O-N 2.9Å
106Y59.9Low57Low152 Ų15289.2 Ų89.260%0.59647%0.471SS*.Hα-helixtrans-66-41175.7-172.9-100000112.4I102 M103 R104 A109 K110I102-Y106 WeakPolarHBondContact O-CB 3.5Å; I102-Y106 PolarHBondContact O-N 2.81Å; M103-Y106 PolarHBondContact O-N 2.87Å; R104-Y106 PolarHBondContact O-N 2.94Å; Y106-A109 PolarHBondContact O-N 2.74Å; Y106-K110 HydrophobicContact CE1-CD 4.23Å; Y106-K110 VanDerWaalsContact O-CB 3.25Å; Y106-K110 WeakPolarHBondContact O-CB 3.32Å; Y106-K110 PolarHBondContact O-N 3.47Å
107T63.4Low56.9Low80 Ų8090.3 Ų90.349%0.49148%0.477SS..Hα-helixtrans-64.2-44.7177-54.40000110.4M103 R104 K110 S111M103-T107 WeakPolarHBondContact O-CB 3.37Å; M103-T107 PolarHBondContact O-N 2.99Å; M103-T107 PolarHBondContact O-OG1 2.71Å; R104-T107 PolarHBondContact O-N 3.37Å; T107-K110 PolarHBondContact O-N 2.94Å; T107-S111 WeakPolarHBondContact O-CB 3.38Å; T107-S111 PolarHBondContact O-N 2.93Å; T107-S111 PolarHBondContact O-OG 2.84Å
108L58Low56.9Low33 Ų3390.3 Ų90.317%0.17347%0.467CS..Hα-helixtrans-60.7-46.5174.2-78.8161.9000112.1R104 T105 K110 S111 L112 L123R104-L108 WeakPolarHBondContact O-CB 3.33Å; R104-L108 WeakPolarHBondContact O-CG 3.35Å; R104-L108 PolarHBondContact O-N 2.9Å; T105-L108 PolarHBondContact O-N 2.92Å; L108-K110 VanDerWaalsContact C-N 3.34Å; L108-K110 PolarHBondContact O-N 3.33Å; L108-S111 PolarHBondContact O-N 3.5Å; L108-L112 WeakPolarHBondContact O-CG 3.37Å; L108-L112 PolarHBondContact O-N 3.49Å; L108-L123 HydrophobicContact CB-CD1 4.2Å
109A60.5Low57.1Low53 Ų5395.9 Ų95.944%0.43849%0.494SS..Hα-helixtrans-63.7-38.9177.500000112.1T105 Y106 L112 S113T105-A109 VanDerWaalsContact O-CB 3.3Å; T105-A109 WeakPolarHBondContact O-CB 3.42Å; T105-A109 PolarHBondContact O-N 2.9Å; Y106-A109 PolarHBondContact O-N 2.74Å; A109-L112 PolarHBondContact O-N 3.34Å; A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 2.92Å
110K61.5Low57.1Low116 Ų11696 Ų9650%0.50450%0.501SS..Hα-helixtrans-68.6-40.2176-169.1174.2-177.2179.90111.9Y106 T107 L108 S113 N114Y106-K110 HydrophobicContact CE1-CD 4.23Å; Y106-K110 VanDerWaalsContact O-CB 3.25Å; Y106-K110 WeakPolarHBondContact O-CB 3.32Å; Y106-K110 PolarHBondContact O-N 3.47Å; T107-K110 PolarHBondContact O-N 2.94Å; L108-K110 VanDerWaalsContact C-N 3.34Å; L108-K110 PolarHBondContact O-N 3.33Å; K110-S113 PolarHBondContact O-N 3.39Å; K110-N114 WeakPolarHBondContact O-CB 3.39Å; K110-N114 VanDerWaalsContact O-CG 3.23Å; K110-N114 PolarHBondContact O-N 2.85Å; K110-N114 PolarHBondContact O-ND2 2.72Å
111S58.2Low57Low21 Ų2195 Ų9515%0.14750%0.504CS..Hα-helixtrans-62.8-41.3173.1-67.20000111.9T107 L108 N114 G115 Q116T107-S111 WeakPolarHBondContact O-CB 3.38Å; T107-S111 PolarHBondContact O-N 2.93Å; T107-S111 PolarHBondContact O-OG 2.84Å; L108-S111 PolarHBondContact O-N 3.5Å; S111-N114 CarbonylContact O-C 3.47Å; S111-N114 PolarHBondContact O-N 3.33Å; S111-G115 PolarHBondContact O-N 3.46Å; S111-Q116 WeakPolarHBondContact O-CB 3.4Å; S111-Q116 PolarHBondContact O-N 2.94Å
112L54.7Low56.8Low75 Ų7597.9 Ų97.939%0.39352%0.516SS..Hα-helixtrans-63.4-44.1173.5-76.7169.5000112.3L108 A109 N114 G115 L123L108-L112 WeakPolarHBondContact O-CG 3.37Å; L108-L112 PolarHBondContact O-N 3.49Å; A109-L112 PolarHBondContact O-N 3.34Å; L112-N114 PolarHBondContact O-N 3.44Å; L112-G115 PolarHBondContact O-N 2.99Å; L112-L123 HydrophobicContact CD1-CD1 3.47Å; L112-L123 VanDerWaalsContact CD1-CD1 3.47Å; L112-L123 HydrophobicContact CD1-CD2 4Å; L112-L123 HydrophobicContact CD1-CG 4.36Å
113S59Low56.5Low103 Ų10396.1 Ų96.172%0.7251%0.507SS*.Hα-helixtrans-61.4-30.5174-177.60000112.3A109 K110 G115A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 2.92Å; K110-S113 PolarHBondContact O-N 3.39Å; S113-G115 PolarHBondContact O-N 2.88Å
114N66.1Low56.3Low116 Ų11693.9 Ų93.962%0.6250%0.497SS*.THydrogen-bonded Turntrans-83.17.7174.8-70.7-15.7000113K110 S111 L112 Q116K110-N114 WeakPolarHBondContact O-CB 3.39Å; K110-N114 VanDerWaalsContact O-CG 3.23Å; K110-N114 PolarHBondContact O-N 2.85Å; K110-N114 PolarHBondContact O-ND2 2.72Å; S111-N114 CarbonylContact O-C 3.47Å; S111-N114 PolarHBondContact O-N 3.33Å; L112-N114 PolarHBondContact O-N 3.44Å; N114-Q116 VanDerWaalsContact C-N 3.28Å; N114-Q116 PolarHBondContact O-N 3.21Å
115G54.3Low56.2Low57 Ų5791.7 Ų91.759%0.58850%0.5SS*.THydrogen-bonded Turntrans74.212.9177.800000114.7S111 L112 S113 H117S111-G115 PolarHBondContact O-N 3.46Å; L112-G115 PolarHBondContact O-N 2.99Å; S113-G115 PolarHBondContact O-N 2.88Å; G115-H117 PolarHBondContact O-N 3.29Å
116Q55.3Low55.8Low115 Ų11590.4 Ų90.454%0.53750%0.497SS..  trans-82.9102.7172-70.4-166.7-27.500109.6S111 N114 H118S111-Q116 WeakPolarHBondContact O-CB 3.4Å; S111-Q116 PolarHBondContact O-N 2.94Å; N114-Q116 VanDerWaalsContact C-N 3.28Å; N114-Q116 PolarHBondContact O-N 3.21Å; Q116-H118 VanDerWaalsContact C-N 3.32Å; Q116-H118 PolarHBondContact O-N 3.14Å
117H51.5Low55.5Low184 Ų18487.6 Ų87.685%0.85249%0.491SS*.  trans-65.688.2168.8-84.3-90.7000110G115G115-H117 PolarHBondContact O-N 3.29Å
118H51.5Low54.7Low85 Ų8590 Ų9039%0.39450%0.495SS..  trans-75.1147.3156.7-70.7-72000109.3Q116 L120Q116-H118 VanDerWaalsContact C-N 3.32Å; Q116-H118 PolarHBondContact O-N 3.14Å; H118-L120 PolarHBondContact O-N 2.98Å; H118-L120 VanDerWaalsContact O-N 3.15Å
119N52.5Low54.2Low127 Ų12790.6 Ų90.668%0.67951%0.509SS*.  trans-51.1123.1179.6-74.7-35.4000109.8S121 E122N119-S121 PolarHBondContact O-N 2.92Å; N119-E122 PolarHBondContact O-N 3.3Å
120L52.1Low53.4Low127 Ų12792.1 Ų92.167%0.66551%0.513SS*.Hα-helixtrans-50-25.8-179.9-151.4101.3000112.5H118 E122 L123 I124H118-L120 PolarHBondContact O-N 2.98Å; H118-L120 VanDerWaalsContact O-N 3.15Å; L120-E122 PolarHBondContact O-N 3.4Å; L120-L123 WeakPolarHBondContact O-CB 3.3Å; L120-L123 PolarHBondContact O-N 3.15Å; L120-I124 HydrophobicContact CD2-CD1 3.98Å; L120-I124 WeakPolarHBondContact O-CG1 3.25Å; L120-I124 PolarHBondContact O-N 2.92Å
121S51.1Low52.3Low75 Ų7592.8 Ų92.852%0.52452%0.52SS..Hα-helixtrans-60.4-38.5174.957.70000113.9N119 L123 V125N119-S121 PolarHBondContact O-N 2.92Å; S121-L123 VanDerWaalsContact C-N 3.34Å; S121-V125 WeakPolarHBondContact O-CG2 3.45Å; S121-V125 PolarHBondContact O-N 3.38Å
122E51Low51.5Low122 Ų122102.2 Ų102.257%0.5757%0.567SS**Hα-helixtrans-72.5-31.5176.8-69.8-159.5159.100111.9N119 L120 G126N119-E122 PolarHBondContact O-N 3.3Å; L120-E122 PolarHBondContact O-N 3.4Å; E122-G126 PolarHBondContact O-N 3.43Å
123L51.3Low51.3Low48 Ų48103.6 Ų103.625%0.25158%0.575SS.*Hα-helixtrans-67.2-45.1176.4-164.380.6000111.6L108 L112 L120 S121 G126 I127L108-L123 HydrophobicContact CB-CD1 4.2Å; L112-L123 HydrophobicContact CD1-CD1 3.47Å; L112-L123 VanDerWaalsContact CD1-CD1 3.47Å; L112-L123 HydrophobicContact CD1-CD2 4Å; L112-L123 HydrophobicContact CD1-CG 4.36Å; L120-L123 WeakPolarHBondContact O-CB 3.3Å; L120-L123 PolarHBondContact O-N 3.15Å; S121-L123 VanDerWaalsContact C-N 3.34Å; L123-G126 PolarHBondContact O-N 3.29Å; L123-I127 HydrophobicContact CD2-CD1 4.33Å; L123-I127 HydrophobicContact CG-CD1 4.05Å; L123-I127 WeakPolarHBondContact O-CG1 3.5Å; L123-I127 PolarHBondContact O-N 3.15Å
124I53.6Low50.9Low81 Ų81103.6 Ų103.642%0.41557%0.568SS.*Hα-helixtrans-62.3-44.2177.9-68.7171.2000109.8L120 G126 I127 F128L120-I124 HydrophobicContact CD2-CD1 3.98Å; L120-I124 WeakPolarHBondContact O-CG1 3.25Å; L120-I124 PolarHBondContact O-N 2.92Å; I124-G126 VanDerWaalsContact C-N 3.32Å; I124-G126 PolarHBondContact O-N 3.19Å; I124-I127 PolarHBondContact O-N 2.87Å; I124-F128 HydrophobicContact CB-CD2 4.39Å; I124-F128 HydrophobicContact CG2-CD2 3.52Å; I124-F128 HydrophobicContact CG2-CE2 3.94Å; I124-F128 HydrophobicContact CG2-CG 4.44Å; I124-F128 WeakPolarHBondContact O-CB 3.48Å; I124-F128 WeakPolarHBondContact O-CD2 3.48Å; I124-F128 PolarHBondContact O-N 3.31Å
125V56.2Low50.1Low108 Ų108102.9 Ų102.966%0.65557%0.565SS**Hα-helixtrans-63.5-38.7176.7175.50000111.5S121 I127 G129S121-V125 WeakPolarHBondContact O-CG2 3.45Å; S121-V125 PolarHBondContact O-N 3.38Å; V125-I127 PolarHBondContact O-N 3.44Å; V125-G129 WeakPolarHBondContact O-CA 3.4Å; V125-G129 PolarHBondContact O-N 3.44Å
126G50.3Low49.8Very low21 Ų21105.6 Ų105.622%0.21656%0.563CS.*Hα-helixtrans-65.9-33.7176.800000114.4E122 L123 I124E122-G126 PolarHBondContact O-N 3.43Å; L123-G126 PolarHBondContact O-N 3.29Å; I124-G126 VanDerWaalsContact C-N 3.32Å; I124-G126 PolarHBondContact O-N 3.19Å
127I52.9Low49.5Very low92 Ų92105 Ų10547%0.47257%0.565SS.*Hα-helixtrans-85-45.9179-64.4170.3000111.2L123 I124 V125 V130L123-I127 HydrophobicContact CD2-CD1 4.33Å; L123-I127 HydrophobicContact CG-CD1 4.05Å; L123-I127 WeakPolarHBondContact O-CG1 3.5Å; L123-I127 PolarHBondContact O-N 3.15Å; I124-I127 PolarHBondContact O-N 2.87Å; V125-I127 PolarHBondContact O-N 3.44Å; I127-V130 WeakPolarHBondContact O-CB 3.28Å; I127-V130 PolarHBondContact O-N 2.96Å
128F48Very low49.4Very low131 Ų13199.7 Ų99.758%0.57555%0.546SS*.Hα-helixtrans-80.3-20.6-177-76.6-87.4000113.6I124 V130 I131I124-F128 HydrophobicContact CB-CD2 4.39Å; I124-F128 HydrophobicContact CG2-CD2 3.52Å; I124-F128 HydrophobicContact CG2-CE2 3.94Å; I124-F128 HydrophobicContact CG2-CG 4.44Å; I124-F128 WeakPolarHBondContact O-CB 3.48Å; I124-F128 WeakPolarHBondContact O-CD2 3.48Å; I124-F128 PolarHBondContact O-N 3.31Å; F128-V130 PolarHBondContact O-N 2.93Å; F128-V130 VanDerWaalsContact O-N 3.09Å; F128-I131 HydrophobicContact CD1-CD1 4.08Å; F128-I131 HydrophobicContact CE1-CD1 4.39Å; F128-I131 PolarHBondContact O-N 3.35Å; F128-I131 VanDerWaalsContact O-N 3.11Å
129G46.5Very low49.2Very low46 Ų46100.8 Ų100.847%0.47456%0.557SS.*THydrogen-bonded Turntrans-63.3-8.1168.300000114.1V125V125-G129 WeakPolarHBondContact O-CA 3.4Å; V125-G129 PolarHBondContact O-N 3.44Å
130V44.8Very low49Very low85 Ų8598.8 Ų98.852%0.51555%0.548SS..THydrogen-bonded Turntrans-90.7-11.8176.1-174.20000112.6L101 I127 F128L101-V130 HydrophobicContact CD1-CG2 4.23Å; L101-V130 HydrophobicContact CD2-CG2 3.31Å; L101-V130 HydrophobicContact CG-CG2 4.4Å; I127-V130 WeakPolarHBondContact O-CB 3.28Å; I127-V130 PolarHBondContact O-N 2.96Å; F128-V130 PolarHBondContact O-N 2.93Å; F128-V130 VanDerWaalsContact O-N 3.09Å
131I37.9Very low48.7Very low129 Ų12996.4 Ų96.466%0.66254%0.538SS*.  trans-99.423.4-174.3-49.7178.6000112F128F128-I131 HydrophobicContact CD1-CD1 4.08Å; F128-I131 HydrophobicContact CE1-CD1 4.39Å; F128-I131 PolarHBondContact O-N 3.35Å; F128-I131 VanDerWaalsContact O-N 3.11Å
132I41Very low48.5Very low219 Ų21998.4 Ų98.4100%1.12354%0.539SS*.  trans-120.90165.7-56.2177000107.8

Retrieved 132 of 132 residues in 46.9 ms (Link to these results)