A0A096N4B6_PAPAN Loading...

Cilia and flagella associated protein 68

Microtubule inner protein (MIP) part of the dynein-decorated doublet microtubules (DMTs) in cilia axoneme, which is required for motile cilia beating.

AlphaFold DB , UniProt , Accession A0A096N4B6, Species PAPAN (Papio anubis, Olive baboon), Gene CFAP68, Length 190 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
1M41.8Very low37.1Very low238 Ų238154 Ų154100%1.17284%0.84SS**  0122.40-79151.46600107.8
2V31.3Very low36.9Very low132 Ų132157.3 Ų157.380%0.885%0.845SS**PPolyproline II helixtrans-102.8118.9179.9178.10000107.4
3I44.1Very low36.5Very low162 Ų162159 Ų15983%0.83185%0.852SS**PPolyproline II helixtrans-87.4124.2175.9-63.8174.3000107.7
4W37.2Very low36.2Very low234 Ų234152.3 Ų152.389%0.88684%0.839SS**PPolyproline II helixtrans-76.7147.3177.7-90.948.6000111.9
5V38.8Very low35.9Very low115 Ų115151.6 Ų151.670%0.69784%0.841SS**PPolyproline II helixtrans-72.1144.7175.5173.30000110.3L7V5-L7 HydrophobicContact CG1-CB 3.93Å
6N38Very low35.7Very low166 Ų166149.6 Ų149.689%0.88884%0.841SS**  trans-124.9109.1151.6-99.5-54.8000109.4
7L34.6Very low35.4Very low144 Ų144145.2 Ų145.275%0.75484%0.837SS**  trans-107.5103.6178-179.676.2000106.9V5V5-L7 HydrophobicContact CG1-CB 3.93Å
8S39.3Very low35.3Very low119 Ų119147.5 Ų147.583%0.83285%0.845SS**  trans-96.6101.7174.4-63.80000109.8
9L36.6Very low35.2Very low144 Ų144145.8 Ų145.875%0.75484%0.843SS**  trans-92.5164.9167.6-151.191.4000109.7
10L34.6Very low35.1Very low168 Ų168143.2 Ų143.288%0.8884%0.839SS**  trans102.3132.5155.8-138.675.5000118.7
11G31.4Very low34.9Very low72 Ų72141.2 Ų141.274%0.74283%0.833SS**  trans115.1112.3174.200000113.7
12E34.4Very low34.6Very low193 Ų193136.8 Ų136.890%0.90281%0.814SS**  cis-159.4161.8-16.8-136.4171.4-160.200109.5
13L32.8Very low34.9Very low180 Ų180139.4 Ų139.494%0.94281%0.814SS**  trans-78137.3174.9-110.972.8000110.6
14G31.2Very low34.5Very low65 Ų65138.3 Ų138.367%0.6781%0.81SS**  trans-16773.6-177.600000118.2
15T32.8Very low34.4Very low142 Ų142136.4 Ų136.487%0.87181%0.813SS**  trans54.5129.7147.552.60000122.6
16S32.9Very low34.2Very low119 Ų119139.8 Ų139.883%0.83282%0.821SS**  trans-49.1140.2162.951.20000116.1
17G30.5Very low34.2Very low75 Ų75140.9 Ų140.977%0.77382%0.821SS**  trans-147.188.1167.400000112.2S19G17-S19 PolarHBondContact O-N 3.21Å
18L33.9Very low34.5Very low187 Ų187139.2 Ų139.298%0.97982%0.819SS**  trans-67.8118.4167.9-74165.7000109.1
19S32.9Very low34.4Very low116 Ų116138.6 Ų138.681%0.81181%0.814SS**  trans-12890.2168.8-168.10000110.1G17 S21G17-S19 PolarHBondContact O-N 3.21Å; S19-S21 PolarHBondContact O-N 3.21Å
20A32.3Very low34.5Very low93 Ų93140.4 Ų140.477%0.76982%0.816SS**  trans-73.7105.7170.200000109L22A20-L22 VanDerWaalsContact C-N 3.32Å; A20-L22 PolarHBondContact O-N 3.37Å
21S30.6Very low34.4Very low101 Ų101139.7 Ų139.771%0.70681%0.814SS**  trans-80.480.6175.5-159.90000110.8S19 K23S19-S21 PolarHBondContact O-N 3.21Å; S21-K23 PolarHBondContact O-N 3.32Å; S21-K23 VanDerWaalsContact O-N 3.14Å
22L36.8Very low34.5Very low146 Ų146143.9 Ų143.976%0.76481%0.812SS**  trans-66.6103.4165.9-89.2165000109.6A20A20-L22 VanDerWaalsContact C-N 3.32Å; A20-L22 PolarHBondContact O-N 3.37Å
23K36.7Very low34.4Very low187 Ų187141 Ų14181%0.81381%0.811SS**  trans-98.585.4165.5-77.4-170.3176.6-178.60110.6S21S21-K23 PolarHBondContact O-N 3.32Å; S21-K23 VanDerWaalsContact O-N 3.14Å
24N37.3Very low34.4Very low138 Ų138140.1 Ų140.174%0.73880%0.802SS**  trans-73.3121.4157.7-66.5-31.6000108.4
25M33.1Very low34.6Very low194 Ų194142.6 Ų142.696%0.95681%0.809SS**  trans-144.595.4156.8-86.8-147.3176.400110
26E36.1Very low34.6Very low187 Ų187144 Ų14487%0.87481%0.805SS**  trans-105.8122.6161.9179.9-178.1-152.400107.2
27Q38.5Very low34.8Very low189 Ų189147.9 Ų147.988%0.88381%0.807SS**  trans-167.5151145.4-108-18037.700111
28P39.1Very low35Very low108 Ų108153.8 Ų153.870%0.70181%0.812SS**  trans-92.7151.2-158.935.5-36.4000114.7K30P28-K30 PolarHBondContact O-N 3.08Å
29S37.8Very low35.1Very low106 Ų106150.4 Ų150.474%0.74180%0.803SS**  trans-71.1113.9170.247.30000111.6N31S29-N31 PolarHBondContact O-N 3.08Å
30K39.1Very low35.2Very low182 Ų182150.5 Ų150.579%0.79180%0.804SS**  trans-79.2109.3170.5-75.2174.7177.7169.90110.1P28 F32P28-K30 PolarHBondContact O-N 3.08Å; K30-F32 PolarHBondContact O-N 2.93Å
31N32.8Very low35.6Very low154 Ų154154.1 Ų154.182%0.82481%0.81SS**  trans-71.7111.6173-68.7-35.7000110.9S29S29-N31 PolarHBondContact O-N 3.08Å
32F32.9Very low35.7Very low160 Ų160153.1 Ų153.170%0.70282%0.816SS**  trans-106.2110.9165.5-98.8-91000109.5K30 H34K30-F32 PolarHBondContact O-N 2.93Å; F32-H34 AromaticContact CD1-NE2 3.83Å
33C32.1Very low35.4Very low132 Ų132151.2 Ų151.289%0.89282%0.815SS**  trans-125.7104.5166-83.60000109.6
34H33.3Very low35.3Very low161 Ų161147.5 Ų147.575%0.74581%0.808SS**  trans-76.3124172.5-71.6-74000110.6F32 H36F32-H34 AromaticContact CD1-NE2 3.83Å; H34-H36 PolarHBondContact O-N 3.13Å
35S35.3Very low35.1Very low117 Ų117151 Ų15182%0.81881%0.812SS**  trans-83.7104.5168.252.40000110.5K37S35-K37 PolarHBondContact O-N 2.98Å
36H32.6Very low35.2Very low172 Ų172147.6 Ų147.680%0.79681%0.808SS**  trans-72.7113.5175.9-124.1-69.4000110.4H34 K38H34-H36 PolarHBondContact O-N 3.13Å; H36-K38 PolarHBondContact O-N 3.29Å
37K37.3Very low35.2Very low201 Ų201143.5 Ų143.587%0.87481%0.806SS**  trans-67.8127.5165.3-79.1-178.6175.4176.30109.7S35S35-K37 PolarHBondContact O-N 2.98Å
38K33.8Very low35.1Very low199 Ų199140 Ų14087%0.86580%0.802SS**  trans-138131.4153.7-76.5-170.9176179.10109.1H36H36-K38 PolarHBondContact O-N 3.29Å
39S36.1Very low35.3Very low115 Ų115140.2 Ų140.280%0.80481%0.806SS**  trans-99.6154.1172.249.80000110.5
40S36.7Very low35.2Very low119 Ų119145.7 Ų145.783%0.83281%0.813SS**  trans-152.4135.416254.20000109.1
41N40.3Very low35.3Very low168 Ų168142.6 Ų142.690%0.89881%0.814SS**  trans-96.2158.6-167.5-64.2-24000113.5
42G32.4Very low35.4Very low80 Ų80140.3 Ų140.383%0.82581%0.81SS**  trans142.6133.317000000109.9
43S31.2Very low36.3Very low106 Ų106138.5 Ų138.574%0.74182%0.817SS**  cis-151.3159.52.2169.70000109.4
44T34.4Very low37.1Very low110 Ų110135.3 Ų135.368%0.67581%0.807SS**  trans-19.4137.3154.1-11.40000113.1
45Y32.3Very low37.8Very low210 Ų210138 Ų13882%0.82482%0.816SS**  cis-165.517231.620.4-111.1000107.6
46S35.8Very low38.6Very low124 Ų124144.4 Ų144.487%0.86782%0.822SS**  cis-156.3-172.11.9-121.80000109.9
47A36.4Very low39.6Very low100 Ų100145 Ų14583%0.82683%0.825SS**  trans-94.5146.9-173.400000116.7
48S34.7Very low40.4Very low115 Ų115142.2 Ų142.280%0.80482%0.82SS**  trans-154.7131.6142.2720000110.9
49S43.9Very low41.3Very low113 Ų113139.8 Ų139.879%0.7982%0.816SS**  trans-114.7119.8-171.753.20000112.9
50Y35.8Very low42Very low222 Ų222138.1 Ų138.187%0.87181%0.809SS**  trans-161144.6146.647-93000111.9
51S40.8Very low42.5Very low117 Ų117137.5 Ų137.582%0.81880%0.803SS**  trans-93.7142.2177.3177.20000110.2
52S35.6Very low43Very low106 Ų106138 Ų13874%0.74180%0.798SS**  trans-175.7136.7138.7-168.80000112.7
53S52.3Low44.1Very low121 Ų121141.8 Ų141.885%0.84680%0.798SS**  trans31.8104.5144.3-161.70000119.9
54G48.9Very low45Very low66 Ų66142.4 Ų142.468%0.6880%0.798SS**  trans164.6140.7160.800000112.6
55K47.2Very low45.6Very low218 Ų218142 Ų14295%0.94879%0.792SS**  trans73.345.2174.1-49.3175.5-178.9177.60117.4
56R52.9Low46.7Very low250 Ų250137.5 Ų137.594%0.94379%0.788SS**  trans-112.937.5158-82.4-167.1176.7147.2-0.4113.5
57Q52.9Low47.5Very low184 Ų184139.4 Ų139.486%0.8678%0.783SS**  trans-142.365.5179.2-65.3-178.14.600110.9
58N53.7Low48.2Very low144 Ų144139.6 Ų139.677%0.7778%0.777SS**SBendtrans-159.218.5168.2-129-41.2000116.5
59L54Low49Very low148 Ų148137 Ų13778%0.77577%0.768SS**SBendtrans-130.81.7178.5-65174.5000113.6
60A50.2Low49.6Very low79 Ų79136.5 Ų136.565%0.65377%0.765SS**THydrogen-bonded Turntrans-90.65.8-176.200000114.3
61C47.3Very low50.6Low106 Ų106132.8 Ų132.872%0.71676%0.759SS**THydrogen-bonded Turntrans-99.6-3.8-175.6-61.10000114.6
62F51Low51.6Low180 Ų180134 Ų13479%0.78976%0.755SS**SBendtrans-99.2-0.3-178.7-67.5-69.7000114.6
63L55Low52.7Low158 Ų158134.8 Ų134.883%0.82775%0.75SS**SBendtrans-109.2-0.5-173.2-71170.9000114.5
64T49.9Very low53Low120 Ų120133.7 Ų133.774%0.73675%0.749SS**SBendtrans-111.515.1-169.341.20000115
65N47.7Very low53.5Low101 Ų101135.9 Ų135.954%0.5475%0.745SS.*  trans-139.4102.2173.6-163.2-20.9000112.4H67 C68N65-H67 PolarHBondContact O-N 3.25Å; N65-H67 WeakPolarHBondContact OD1-CA 3.41Å; N65-H67 WeakPolarHBondContact OD1-CB 3.37Å; N65-H67 PolarHBondContact OD1-N 3.4Å; N65-C68 PolarHBondContact O-SG 3.03Å
66P54.5Low54Low116 Ų116129.3 Ų129.375%0.75374%0.739SS**THydrogen-bonded Turntrans-79.75.6175.734.9-35.8000113.4
67H52Low54.4Low163 Ų163125 Ų12576%0.75573%0.73SS**THydrogen-bonded Turntrans-106.534.4169.3-64-65.9000111.8N65 G69N65-H67 PolarHBondContact O-N 3.25Å; N65-H67 WeakPolarHBondContact OD1-CA 3.41Å; N65-H67 WeakPolarHBondContact OD1-CB 3.37Å; N65-H67 PolarHBondContact OD1-N 3.4Å; H67-G69 PolarHBondContact O-N 3.11Å
68C51Low55Low104 Ų104118.8 Ų118.870%0.70372%0.715SS**  trans-6391.1156.244.80000108.8N65 S70N65-C68 PolarHBondContact O-SG 3.03Å; C68-S70 PolarHBondContact O-N 3.04Å
69G51.7Low55.7Low60 Ų60116.3 Ų116.362%0.61970%0.699SS**  trans-49.2137.8172.500000109.8H67 I71H67-G69 PolarHBondContact O-N 3.11Å; G69-I71 PolarHBondContact O-N 3.07Å
70S56.3Low56.6Low103 Ų103114.7 Ų114.772%0.7270%0.695SS**  trans-51.7116.9-17944.20000108.9C68 I72C68-S70 PolarHBondContact O-N 3.04Å; S70-I72 PolarHBondContact O-N 3.15Å
71I58.7Low57.8Low145 Ų145116.7 Ų116.774%0.74469%0.685SS**  trans-69.988.8168.3-58.3172.3000104.5G69 N73G69-I71 PolarHBondContact O-N 3.07Å; I71-N73 PolarHBondContact O-N 3.05Å
72I60.6Low59Low142 Ų142114.9 Ų114.973%0.72867%0.671SS**  trans-64.691.2165.6-58172.5000103.8S70 A74S70-I72 PolarHBondContact O-N 3.15Å; I72-A74 PolarHBondContact O-N 3.33Å; I72-A74 VanDerWaalsContact O-N 3.16Å
73N58.9Low60.1Low122 Ų122113.5 Ų113.565%0.65267%0.672SS**  trans-54.1123.3163.1-62-50.7000105I71 D75I71-N73 PolarHBondContact O-N 3.05Å; N73-D75 PolarHBondContact O-N 3.06Å
74A58.2Low61.2Low98 Ų98117.8 Ų117.881%0.8168%0.677SS**  trans-68.788.7165.200000106.3I72 G76I72-A74 PolarHBondContact O-N 3.33Å; I72-A74 VanDerWaalsContact O-N 3.16Å; A74-G76 PolarHBondContact O-N 3.4Å; A74-G76 VanDerWaalsContact O-N 3.1Å
75D60.5Low62.5Low112 Ų112116.1 Ų116.160%0.59966%0.664SS**  trans-53.9116.8162.943-47.9000106.8N73 H77N73-D75 PolarHBondContact O-N 3.06Å; D75-H77 PolarHBondContact O-N 3.2Å
76G57Low63.8Low81 Ų81116 Ų11684%0.83566%0.663SS**SBendtrans-6613-171.100000114.6A74 G78A74-G76 PolarHBondContact O-N 3.4Å; A74-G76 VanDerWaalsContact O-N 3.1Å; G76-G78 PolarHBondContact O-N 3.28Å
77H60.5Low65Low159 Ų159115.3 Ų115.374%0.73665%0.651SS**  trans-7080166.9-62.2-54.8000109.2D75D75-H77 PolarHBondContact O-N 3.2Å
78G66.1Low66.3Low53 Ų53109.1 Ų109.155%0.54663%0.626SS.*  trans-53.6156.9160.500000110.8G76 V80G76-G78 PolarHBondContact O-N 3.28Å; G78-V80 WeakPolarHBondContact O-CG2 3.26Å; G78-V80 PolarHBondContact O-N 2.72Å
79E69.8Low67.7Low93 Ų93107.9 Ų107.944%0.43561%0.609SS.*  trans-49.6107.717641.8-176.5-134.700112W81E79-W81 VanDerWaalsContact CD-NE1 3.27Å; E79-W81 VanDerWaalsContact O-CD1 3.25Å; E79-W81 PolarHBondContact O-N 2.87Å; E79-W81 VanDerWaalsContact O-N 3.1Å; E79-W81 WeakPolarHBondContact OE1-CZ2 3.42Å; E79-W81 PolarHBondContact OE1-NE1 3.3Å
80V72.3Confident69.1Low114 Ų114106 Ų10669%0.69158%0.584SS**  trans-80.691.2179.7-177.90000108.9G78 Q92G78-V80 WeakPolarHBondContact O-CG2 3.26Å; G78-V80 PolarHBondContact O-N 2.72Å; V80-Q92 PolarHBondContact O-NE2 2.73Å
81W74.3Confident70.2Confident120 Ų120106.7 Ų106.746%0.45557%0.574SS.*  trans-69.5137.6175.9-65.298.3000111.8E79 Q92E79-W81 VanDerWaalsContact CD-NE1 3.27Å; E79-W81 VanDerWaalsContact O-CD1 3.25Å; E79-W81 PolarHBondContact O-N 2.87Å; E79-W81 VanDerWaalsContact O-N 3.1Å; E79-W81 WeakPolarHBondContact OE1-CZ2 3.42Å; E79-W81 PolarHBondContact OE1-NE1 3.3Å; W81-Q92 HydrophobicContact CE3-CB 4.02Å; W81-Q92 HydrophobicContact CE3-CG 3.7Å; W81-Q92 HydrophobicContact CZ3-CB 3.83Å; W81-Q92 HydrophobicContact CZ3-CG 3.66Å; W81-Q92 WeakPolarHBondContact CZ3-O 3.31Å
82T74.3Confident71.3Confident68 Ų68102.2 Ų102.242%0.41755%0.55SS..  trans-98.695-17952.30000110.8S88 Q92T82-S88 PolarHBondContact O-OG 2.91Å; T82-Q92 PolarHBondContact OG1-OE1 3.17Å
83D73.3Confident72.2Confident151 Ų15198.9 Ų98.981%0.80753%0.529SS*.  trans-85.9-7.9-175.368-24.3000114.6N85D83-N85 PolarHBondContact O-N 2.86Å
84W77.5Confident73.1Confident248 Ų24893.7 Ų93.794%0.93950%0.504SS*.SBendtrans-50.3-30.7-178-177.1-99.2000114.8
85N78.4Confident73.8Confident85 Ų8597.7 Ų97.746%0.45550%0.498SS..SBendtrans-133.2132.4175.1-177.6-1.5000110.1D83 M87 S88D83-N85 PolarHBondContact O-N 2.86Å; N85-M87 PolarHBondContact O-N 3.09Å; N85-M87 PolarHBondContact OD1-N 3.04Å; N85-S88 PolarHBondContact N-OG 2.78Å; N85-S88 PolarHBondContact O-N 2.76Å; N85-S88 PolarHBondContact O-OG 3.35Å
86N73.8Confident74.2Confident98 Ų98101.2 Ų101.252%0.52450%0.503SS..THydrogen-bonded Turntrans-59.9-15.5174.9-165.116.7000112.8K89 F90 N106N86-K89 VanDerWaalsContact O-CE 3.31Å; N86-K89 WeakPolarHBondContact O-CE 3.23Å; N86-K89 WeakPolarHBondContact O-CG 3.04Å; N86-K89 VanDerWaalsContact OD1-CE 3.31Å; N86-K89 WeakPolarHBondContact OD1-CE 3.28Å; N86-K89 PolarHBondContact OD1-NZ 3.46Å; N86-F90 WeakPolarHBondContact O-CE2 3.43Å; N86-N106 PolarHBondContact ND2-ND2 3.34Å; N86-N106 PolarHBondContact OD1-ND2 3.25Å
87M80Confident74.9Confident102 Ų102100.7 Ų100.750%0.50249%0.486SS..THydrogen-bonded Turntrans-90.2-29.8171.6-156.170.372.900114.4N85 K89 F90 F91N85-M87 PolarHBondContact O-N 3.09Å; N85-M87 PolarHBondContact OD1-N 3.04Å; M87-K89 VanDerWaalsContact C-N 3.29Å; M87-K89 PolarHBondContact O-N 3.23Å; M87-F90 HydrophobicContact CG-CD2 4.44Å; M87-F90 WeakPolarHBondContact O-CD2 3.32Å; M87-F90 PolarHBondContact O-N 2.77Å; M87-F90 HydrophobicContact SD-CD2 3.81Å; M87-F90 HydrophobicContact SD-CE2 4.05Å; M87-F91 HydrophobicContact CG-CE2 3.83Å; M87-F91 WeakPolarHBondContact O-CD2 2.84Å
88S80.1Confident75.6Confident33 Ų3399.8 Ų99.823%0.23149%0.492CS..G310 helixtrans-65.8-33.5-175.750.40000112.4T82 N85 F90 F91T82-S88 PolarHBondContact O-OG 2.91Å; N85-S88 PolarHBondContact N-OG 2.78Å; N85-S88 PolarHBondContact O-N 2.76Å; N85-S88 PolarHBondContact O-OG 3.35Å; S88-F90 PolarHBondContact O-N 3.47Å; S88-F90 VanDerWaalsContact O-N 3.08Å; S88-F91 PolarHBondContact O-N 2.89Å; S88-F91 VanDerWaalsContact O-N 3.08Å
89K79.9Confident76.2Confident79 Ų79100.6 Ų100.634%0.34349%0.486SS..G310 helixtrans-54.9-26.3176.776.6-173.9-168.9-178.30114.4N86 M87 N106N86-K89 VanDerWaalsContact O-CE 3.31Å; N86-K89 WeakPolarHBondContact O-CE 3.23Å; N86-K89 WeakPolarHBondContact O-CG 3.04Å; N86-K89 VanDerWaalsContact OD1-CE 3.31Å; N86-K89 WeakPolarHBondContact OD1-CE 3.28Å; N86-K89 PolarHBondContact OD1-NZ 3.46Å; M87-K89 VanDerWaalsContact C-N 3.29Å; M87-K89 PolarHBondContact O-N 3.23Å; K89-N106 PolarHBondContact NZ-OD1 3.03Å
90F81.3Confident76.7Confident21 Ų21102.8 Ų102.89%0.09250%0.501CS..G310 helixtrans-83-19.5-178.4-58.1-62.4000114N86 M87 S88 A103 Y104 N106N86-F90 WeakPolarHBondContact O-CE2 3.43Å; M87-F90 HydrophobicContact CG-CD2 4.44Å; M87-F90 WeakPolarHBondContact O-CD2 3.32Å; M87-F90 PolarHBondContact O-N 2.77Å; M87-F90 HydrophobicContact SD-CD2 3.81Å; M87-F90 HydrophobicContact SD-CE2 4.05Å; S88-F90 PolarHBondContact O-N 3.47Å; S88-F90 VanDerWaalsContact O-N 3.08Å; F90-A103 HydrophobicContact CB-CB 4.37Å; F90-A103 HydrophobicContact CD1-CB 4.01Å; F90-A103 PolarHBondContact O-N 3.14Å; F90-Y104 VanDerWaalsContact CD1-O 3.3Å; F90-Y104 WeakPolarHBondContact CD1-O 3.44Å; F90-Y104 WeakPolarHBondContact CE1-O 3.47Å; F90-N106 WeakPolarHBondContact CZ-OD1 3.42Å
91F79.6Confident77.2Confident117 Ų117103.6 Ų103.651%0.51350%0.497SS..G310 helixtrans-98.75178.7-59.8-70.3000112.2M87 S88 Y93 N102M87-F91 HydrophobicContact CG-CE2 3.83Å; M87-F91 WeakPolarHBondContact O-CD2 2.84Å; S88-F91 PolarHBondContact O-N 2.89Å; S88-F91 VanDerWaalsContact O-N 3.08Å; F91-Y93 WeakPolarHBondContact O-CD2 3.49Å; F91-Y93 WeakPolarHBondContact O-CE2 3.48Å; F91-N102 HydrophobicContact CD1-CB 4.36Å; F91-N102 VanDerWaalsContact CD1-OD1 3.25Å; F91-N102 WeakPolarHBondContact CD1-OD1 3.35Å; F91-N102 HydrophobicContact CE1-CB 4.42Å
92Q81.3Confident77.6Confident50 Ų50102 Ų10223%0.23450%0.498CS..PPolyproline II helixtrans-98.4119.9-177.5-175.1161.61000110.9V80 W81 T82V80-Q92 PolarHBondContact O-NE2 2.73Å; W81-Q92 HydrophobicContact CE3-CB 4.02Å; W81-Q92 HydrophobicContact CE3-CG 3.7Å; W81-Q92 HydrophobicContact CZ3-CB 3.83Å; W81-Q92 HydrophobicContact CZ3-CG 3.66Å; W81-Q92 WeakPolarHBondContact CZ3-O 3.31Å; T82-Q92 PolarHBondContact OG1-OE1 3.17Å
93Y79.9Confident77.8Confident73 Ų73101.6 Ų101.629%0.28650%0.501SS..PPolyproline II helixtrans-100.9125.5-178.6-63-83.6000110.2F91 C97 N100 E101 N102F91-Y93 WeakPolarHBondContact O-CD2 3.49Å; F91-Y93 WeakPolarHBondContact O-CE2 3.48Å; Y93-C97 HydrophobicContact CD1-CB 4.12Å; Y93-N100 WeakPolarHBondContact CE2-OD1 3.29Å; Y93-N100 VanDerWaalsContact OH-C 3.27Å; Y93-N100 PolarHBondContact OH-O 3.09Å; Y93-N100 PolarHBondContact OH-OD1 2.85Å; Y93-E101 WeakPolarHBondContact CE1-O 3.21Å; Y93-E101 PolarHBondContact OH-N 2.81Å; Y93-E101 PolarHBondContact OH-O 2.81Å; Y93-N102 VanDerWaalsContact OH-CA 3.31Å; Y93-N102 WeakPolarHBondContact OH-CA 3.5Å; Y93-N102 PolarHBondContact OH-N 2.97Å; Y93-N102 PolarHBondContact OH-OD1 3.11Å
94G77.1Confident78.1Confident13 Ų13101.8 Ų101.813%0.13449%0.491CS..PPolyproline II helixtrans-70.6157.6169.100000110.9R96 C97G94-R96 PolarHBondContact O-N 3.5Å; G94-C97 PolarHBondContact N-SG 3.29Å; G94-C97 VanDerWaalsContact N-SG 3.42Å; G94-C97 VanDerWaalsContact O-CB 3.31Å; G94-C97 WeakPolarHBondContact O-CB 3.11Å; G94-C97 PolarHBondContact O-N 2.95Å
95W73Confident78.1Confident181 Ų18192.1 Ų92.169%0.68646%0.461SS*.THydrogen-bonded Turntrans-61.7-6.5175.554.3-85.7000114.5
96R69.3Low77.9Confident186 Ų18691 Ų9170%0.70246%0.455SS*.THydrogen-bonded Turntrans-98-7.1172.9-63.7-174.2172.6119.1-8.9114G94 T98G94-R96 PolarHBondContact O-N 3.5Å; R96-T98 PolarHBondContact O-N 2.75Å
97C72.3Confident77.9Confident70 Ų7094.5 Ų94.547%0.47347%0.469SS..  trans-73.1120.2178.7-650000110Y93 G94Y93-C97 HydrophobicContact CD1-CB 4.12Å; G94-C97 PolarHBondContact N-SG 3.29Å; G94-C97 VanDerWaalsContact N-SG 3.42Å; G94-C97 VanDerWaalsContact O-CB 3.31Å; G94-C97 WeakPolarHBondContact O-CB 3.11Å; G94-C97 PolarHBondContact O-N 2.95Å
98T74.9Confident78Confident141 Ų14192.1 Ų92.187%0.86546%0.46SS*.  trans-89.6-14.7175.5510000113R96R96-T98 PolarHBondContact O-N 2.75Å
99T78.6Confident77.9Confident69 Ų6996 Ų9642%0.42348%0.477SS..SBendtrans-121.2144.5-177.443.20000110.6E101T99-E101 VanDerWaalsContact C-N 3.25Å; T99-E101 VanDerWaalsContact CB-OE1 3.27Å; T99-E101 WeakPolarHBondContact CB-OE1 3.29Å; T99-E101 PolarHBondContact O-N 3.4Å; T99-E101 PolarHBondContact OG1-OE1 3.46Å
100N79.1Confident77.9Confident139 Ų13997.5 Ų97.574%0.74349%0.487SS*.  trans-93.650.2174.5-17116.4000110.1Y93Y93-N100 WeakPolarHBondContact CE2-OD1 3.29Å; Y93-N100 VanDerWaalsContact OH-C 3.27Å; Y93-N100 PolarHBondContact OH-O 3.09Å; Y93-N100 PolarHBondContact OH-OD1 2.85Å
101E82.5Confident78Confident132 Ų132100.5 Ų100.562%0.61752%0.523SS*.PPolyproline II helixtrans-102.8118.6179.768.2-164139.200110.8Y93 T99Y93-E101 WeakPolarHBondContact CE1-O 3.21Å; Y93-E101 PolarHBondContact OH-N 2.81Å; Y93-E101 PolarHBondContact OH-O 2.81Å; T99-E101 VanDerWaalsContact C-N 3.25Å; T99-E101 VanDerWaalsContact CB-OE1 3.27Å; T99-E101 WeakPolarHBondContact CB-OE1 3.29Å; T99-E101 PolarHBondContact O-N 3.4Å; T99-E101 PolarHBondContact OG1-OE1 3.46Å
102N83.3Confident77.9Confident87 Ų8798.9 Ų98.947%0.46552%0.52SS..PPolyproline II helixtrans-63.4140.9-175.4-59.5-44.8000110.2F91 Y93F91-N102 HydrophobicContact CD1-CB 4.36Å; F91-N102 VanDerWaalsContact CD1-OD1 3.25Å; F91-N102 WeakPolarHBondContact CD1-OD1 3.35Å; F91-N102 HydrophobicContact CE1-CB 4.42Å; Y93-N102 VanDerWaalsContact OH-CA 3.31Å; Y93-N102 WeakPolarHBondContact OH-CA 3.5Å; Y93-N102 PolarHBondContact OH-N 2.97Å; Y93-N102 PolarHBondContact OH-OD1 3.11Å
103A78.6Confident77.9Confident58 Ų58100.9 Ų100.948%0.47953%0.526SS..PPolyproline II helixtrans-64.4144.1173.800000110.8F90F90-A103 HydrophobicContact CB-CB 4.37Å; F90-A103 HydrophobicContact CD1-CB 4.01Å; F90-A103 PolarHBondContact O-N 3.14Å
104Y78.9Confident77.9Confident155 Ų155102.2 Ų102.261%0.60854%0.538SS*.PPolyproline II helixtrans-64.3145.5-179.7-65.2-73000112.4F90 T108 M110F90-Y104 VanDerWaalsContact CD1-O 3.3Å; F90-Y104 WeakPolarHBondContact CD1-O 3.44Å; F90-Y104 WeakPolarHBondContact CE1-O 3.47Å; Y104-T108 HydrophobicContact CD1-CG2 3.9Å; Y104-T108 HydrophobicContact CG-CG2 3.96Å; Y104-M110 HydrophobicContact CD2-CG 3.9Å; Y104-M110 HydrophobicContact CD2-SD 3.67Å; Y104-M110 HydrophobicContact CE2-SD 3.81Å; Y104-M110 HydrophobicContact CG-CG 4.19Å; Y104-M110 HydrophobicContact CG-SD 4.47Å
105S77.6Confident78.1Confident45 Ų45107.8 Ų107.832%0.31556%0.561SS.*PPolyproline II helixtrans-61.3159.5178.475.80000112.9H107 T108S105-H107 PolarHBondContact O-N 2.93Å; S105-H107 PolarHBondContact OG-N 3.3Å; S105-T108 WeakPolarHBondContact O-CB 3.42Å; S105-T108 PolarHBondContact O-N 3.29Å; S105-T108 PolarHBondContact O-OG1 2.99Å; S105-T108 PolarHBondContact OG-N 3.18Å; S105-T108 PolarHBondContact OG-OG1 3.49Å; S105-T108 VanDerWaalsContact OG-OG1 3.13Å
106N74.8Confident78.5Confident61 Ų61102.8 Ų102.833%0.32655%0.545SS..THydrogen-bonded Turntrans-61.5-9.3172.7-45.2-60.7000113.4N86 K89 F90N86-N106 PolarHBondContact ND2-ND2 3.34Å; N86-N106 PolarHBondContact OD1-ND2 3.25Å; K89-N106 PolarHBondContact NZ-OD1 3.03Å; F90-N106 WeakPolarHBondContact CZ-OD1 3.42Å
107H73.4Confident78.9Confident173 Ų173100.5 Ų100.580%0.80154%0.536SS*.THydrogen-bonded Turntrans-88.9-14.1174.2-62.7-57.4000113.1S105S105-H107 PolarHBondContact O-N 2.93Å; S105-H107 PolarHBondContact OG-N 3.3Å
108T81.7Confident79.2Confident51 Ų51104.2 Ų104.231%0.31354%0.541SS..SBendtrans-80.2137178.6-49.50000109.3Y104 S105 M110Y104-T108 HydrophobicContact CD1-CG2 3.9Å; Y104-T108 HydrophobicContact CG-CG2 3.96Å; S105-T108 WeakPolarHBondContact O-CB 3.42Å; S105-T108 PolarHBondContact O-N 3.29Å; S105-T108 PolarHBondContact O-OG1 2.99Å; S105-T108 PolarHBondContact OG-N 3.18Å; S105-T108 PolarHBondContact OG-OG1 3.49Å; S105-T108 VanDerWaalsContact OG-OG1 3.13Å; T108-M110 HydrophobicContact CG2-CG 3.73Å; T108-M110 PolarHBondContact O-N 3.3Å
109L77.9Confident79.5Confident116 Ų116100.5 Ų100.561%0.60752%0.516SS*.  trans-76.862.8-173.2-41.8-176.4000111.9W113L109-W113 HydrophobicContact CB-CD2 4.4Å; L109-W113 HydrophobicContact CB-CG 4.21Å; L109-W113 HydrophobicContact CD2-CD2 3.96Å; L109-W113 HydrophobicContact CD2-CG 3.95Å; L109-W113 HydrophobicContact CD2-CZ2 4.1Å; L109-W113 VanDerWaalsContact CD2-NE1 3.28Å
110M80.1Confident79.5Confident109 Ų109103.2 Ų103.254%0.53753%0.527SS..  trans-118137.9-173.7-68.7-96.567.200111Y104 T108 N112Y104-M110 HydrophobicContact CD2-CG 3.9Å; Y104-M110 HydrophobicContact CD2-SD 3.67Å; Y104-M110 HydrophobicContact CE2-SD 3.81Å; Y104-M110 HydrophobicContact CG-CG 4.19Å; Y104-M110 HydrophobicContact CG-SD 4.47Å; T108-M110 HydrophobicContact CG2-CG 3.73Å; T108-M110 PolarHBondContact O-N 3.3Å; M110-N112 PolarHBondContact O-N 2.89Å; M110-N112 VanDerWaalsContact O-N 3.09Å
111G83.1Confident79.6Confident84 Ų84106 Ų10687%0.86653%0.528SS*.SBendtrans60.3-111.8177.600000113.1W113G111-W113 PolarHBondContact O-N 3.26Å
112N78.6Confident79.4Confident84 Ų84103.5 Ų103.545%0.44952%0.518SS..SBendtrans-84.117.2-166.6-156.421.9000115.5M110 N114 Q115 E116M110-N112 PolarHBondContact O-N 2.89Å; M110-N112 VanDerWaalsContact O-N 3.09Å; N112-N114 PolarHBondContact O-N 3.1Å; N112-Q115 PolarHBondContact ND2-OE1 3.07Å; N112-Q115 PolarHBondContact O-N 3.23Å; N112-Q115 WeakPolarHBondContact OD1-CB 3.45Å; N112-Q115 PolarHBondContact OD1-OE1 3.21Å; N112-E116 PolarHBondContact O-N 3.44Å
113W81Confident79.2Confident92 Ų92104.3 Ų104.335%0.34852%0.521SS..Hα-helixtrans-49.4-37.1-174.1172.672.8000114.6L109 G111 Q115 E116 R117L109-W113 HydrophobicContact CB-CD2 4.4Å; L109-W113 HydrophobicContact CB-CG 4.21Å; L109-W113 HydrophobicContact CD2-CD2 3.96Å; L109-W113 HydrophobicContact CD2-CG 3.95Å; L109-W113 HydrophobicContact CD2-CZ2 4.1Å; L109-W113 VanDerWaalsContact CD2-NE1 3.28Å; G111-W113 PolarHBondContact O-N 3.26Å; W113-Q115 PolarHBondContact O-N 3.09Å; W113-E116 PolarHBondContact O-N 3.11Å; W113-R117 WeakPolarHBondContact O-CB 3.35Å; W113-R117 PolarHBondContact O-N 3.01Å
114N80.6Confident79.3Confident100 Ų100107.1 Ų107.154%0.53553%0.532SS..Hα-helixtrans-65.7-37.8-179.9-171.555.2000112.4N112 Y118N112-N114 PolarHBondContact O-N 3.1Å; N114-Y118 WeakPolarHBondContact O-CD2 3.4Å; N114-Y118 WeakPolarHBondContact OD1-CE2 3.18Å
115Q81.2Confident79.3Confident131 Ų131105.6 Ų105.661%0.61253%0.531SS*.Hα-helixtrans-70.4-41.3174.9-173.6-178.5-21.600110.8N112 W113 R117 Y118 D119N112-Q115 PolarHBondContact ND2-OE1 3.07Å; N112-Q115 PolarHBondContact O-N 3.23Å; N112-Q115 WeakPolarHBondContact OD1-CB 3.45Å; N112-Q115 PolarHBondContact OD1-OE1 3.21Å; W113-Q115 PolarHBondContact O-N 3.09Å; Q115-R117 VanDerWaalsContact C-N 3.31Å; Q115-R117 PolarHBondContact O-N 3.29Å; Q115-Y118 CarbonylContact O-C 3.43Å; Q115-Y118 PolarHBondContact O-N 2.88Å; Q115-Y118 VanDerWaalsContact O-N 3.14Å; Q115-D119 PolarHBondContact O-N 3.32Å
116E80.7Confident79.4Confident75 Ų75109.1 Ų109.135%0.3555%0.553SS.*Hα-helixtrans-61.1-40177-64.9179.516700111.7N112 W113 Y118 D119 N122N112-E116 PolarHBondContact O-N 3.44Å; W113-E116 PolarHBondContact O-N 3.11Å; E116-Y118 PolarHBondContact O-N 3.13Å; E116-D119 WeakPolarHBondContact O-CB 3.43Å; E116-D119 PolarHBondContact O-N 2.98Å; E116-D119 VanDerWaalsContact O-N 3.16Å; E116-N122 PolarHBondContact O-ND2 3.32Å
117R77Confident79.7Confident138 Ų138115.5 Ų115.552%0.52158%0.578SS.*Hα-helixtrans-57.4-34.5175.1-179.3175.9-176.577.31113.2W113 Q115W113-R117 WeakPolarHBondContact O-CB 3.35Å; W113-R117 PolarHBondContact O-N 3.01Å; Q115-R117 VanDerWaalsContact C-N 3.31Å; Q115-R117 PolarHBondContact O-N 3.29Å
118Y78.6Confident80.3Confident149 Ų149113 Ų11358%0.58458%0.577SS**THydrogen-bonded Turntrans-104.213.7-180-60.9-64.7000113.4N114 Q115 E116 I123N114-Y118 WeakPolarHBondContact O-CD2 3.4Å; N114-Y118 WeakPolarHBondContact OD1-CE2 3.18Å; Q115-Y118 CarbonylContact O-C 3.43Å; Q115-Y118 PolarHBondContact O-N 2.88Å; Q115-Y118 VanDerWaalsContact O-N 3.14Å; E116-Y118 PolarHBondContact O-N 3.13Å; Y118-I123 VanDerWaalsContact O-CD1 3.29Å; Y118-I123 WeakPolarHBondContact O-CD1 3.31Å
119D82.9Confident80.6Confident62 Ų62118.5 Ų118.533%0.33260%0.603SS.*  trans-62.7138.3170.4-175.86.5000109.9Q115 E116 R121 N122 I123Q115-D119 PolarHBondContact O-N 3.32Å; E116-D119 WeakPolarHBondContact O-CB 3.43Å; E116-D119 PolarHBondContact O-N 2.98Å; E116-D119 VanDerWaalsContact O-N 3.16Å; D119-R121 PolarHBondContact O-N 2.89Å; D119-R121 VanDerWaalsContact O-N 3.13Å; D119-R121 PolarHBondContact OD1-N 3.01Å; D119-R121 WeakPolarHBondContact OD2-CD 3.49Å; D119-R121 WeakPolarHBondContact OD2-CG 3.31Å; D119-N122 WeakPolarHBondContact O-CA 3.1Å; D119-N122 PolarHBondContact O-N 2.69Å; D119-I123 PolarHBondContact O-N 3.01Å
120L78Confident81Confident127 Ų127118.9 Ų118.967%0.66561%0.612SS**Hα-helixtrans-54.1-33.3176.5-64.7175.5000111.5N122 I123 V124L120-N122 PolarHBondContact O-N 3.16Å; L120-I123 PolarHBondContact O-N 3.25Å; L120-V124 WeakPolarHBondContact O-CB 3.22Å; L120-V124 WeakPolarHBondContact O-CG2 3.49Å; L120-V124 PolarHBondContact O-N 3.14Å
121R81.2Confident81.5Confident198 Ų198117.5 Ų117.575%0.74761%0.614SS**Hα-helixtrans-60.4-30.4175.3-60.2-178.6179.5-174-0.6113.4D119 Q125D119-R121 PolarHBondContact O-N 2.89Å; D119-R121 VanDerWaalsContact O-N 3.13Å; D119-R121 PolarHBondContact OD1-N 3.01Å; D119-R121 WeakPolarHBondContact OD2-CD 3.49Å; D119-R121 WeakPolarHBondContact OD2-CG 3.31Å; R121-Q125 WeakPolarHBondContact O-CG 3.39Å; R121-Q125 PolarHBondContact O-NE2 2.9Å
122N78.8Confident81.8Confident78 Ų78120.8 Ų120.842%0.41761%0.607SS.*Hα-helixtrans-93.3-30.5178.8-69.3-30.7000111.9E116 D119 L120 Q125E116-N122 PolarHBondContact O-ND2 3.32Å; D119-N122 WeakPolarHBondContact O-CA 3.1Å; D119-N122 PolarHBondContact O-N 2.69Å; L120-N122 PolarHBondContact O-N 3.16Å; N122-Q125 PolarHBondContact OD1-NE2 2.78Å
123I78Confident82.5Confident105 Ų105122.6 Ų122.654%0.53861%0.61SS.*Hα-helixtrans-69.9-35.5174.5-64.3169.3000111.9Y118 D119 L120 Q125Y118-I123 VanDerWaalsContact O-CD1 3.29Å; Y118-I123 WeakPolarHBondContact O-CD1 3.31Å; D119-I123 PolarHBondContact O-N 3.01Å; L120-I123 PolarHBondContact O-N 3.25Å; I123-Q125 VanDerWaalsContact C-N 3.3Å; I123-Q125 PolarHBondContact O-N 3.41Å
124V80.5Confident82.6Confident117 Ų117119.4 Ų119.471%0.70961%0.607SS**SBendtrans-77.2-14.2-179.71720000112.6L120 P126L120-V124 WeakPolarHBondContact O-CB 3.22Å; L120-V124 WeakPolarHBondContact O-CG2 3.49Å; L120-V124 PolarHBondContact O-N 3.14Å; V124-P126 WeakPolarHBondContact O-CD 3.42Å
125Q80.1Confident82.8Confident123 Ų123119.5 Ų119.558%0.57560%0.604SS**SBendtrans-66.5121.8176.4-80168.355.400110.6R121 N122 I123R121-Q125 WeakPolarHBondContact O-CG 3.39Å; R121-Q125 PolarHBondContact O-NE2 2.9Å; N122-Q125 PolarHBondContact OD1-NE2 2.78Å; I123-Q125 VanDerWaalsContact C-N 3.3Å; I123-Q125 PolarHBondContact O-N 3.41Å
126P79.8Confident83.1Confident119 Ų119120.7 Ų120.777%0.77360%0.603SS**PPolyproline II helixtrans-65.5147.2176.128.6-34.2000109.9V124V124-P126 WeakPolarHBondContact O-CD 3.42Å
127K80.6Confident83.5Confident195 Ų195125.6 Ų125.685%0.84862%0.624SS**PPolyproline II helixtrans-58.5144.4171.3-67.4177.8-178.3175.80109.5
128P85.7Confident83.9Confident121 Ų121124.9 Ų124.979%0.78663%0.627SS**PPolyproline II helixtrans-58.7155.2174.626.9-35.4000110.6
129L87.3Confident84.3Confident165 Ų165121.5 Ų121.586%0.86462%0.621SS**PPolyproline II helixtrans-56.1144.3175.1-67.5174.2000110.5S131L129-S131 PolarHBondContact O-N 3.34Å
130P88Confident84.3Confident124 Ų124124.7 Ų124.781%0.80564%0.644SS**PPolyproline II helixtrans-59138.8178.325.4-34.2000110.5Q132P130-Q132 PolarHBondContact O-N 3.2Å
131S88.7Confident84.6Confident80 Ų80126.2 Ų126.256%0.55964%0.641SS**PPolyproline II helixtrans-63.5127.1-179.5175.50000110.9L129 F133 G134L129-S131 PolarHBondContact O-N 3.34Å; S131-F133 PolarHBondContact O-N 3.48Å; S131-F133 PolarHBondContact OG-N 2.93Å; S131-G134 PolarHBondContact O-N 2.95Å; S131-G134 VanDerWaalsContact O-N 3.15Å; S131-G134 PolarHBondContact OG-N 3.47Å
132Q90.7Very high84.6Confident154 Ų154120.4 Ų120.472%0.7263%0.625SS**THydrogen-bonded Turntrans-56.7-22.3174.6-175.6176.66.500112.9P130 H135P130-Q132 PolarHBondContact O-N 3.2Å; Q132-H135 PolarHBondContact O-CE1 3.03Å
133F92.4Very high84.6Confident121 Ų121121.2 Ų121.253%0.53163%0.633SS.*THydrogen-bonded Turntrans-116-0.5-178.8-58.8-89.7000113.6S131 H135 Y136S131-F133 PolarHBondContact O-N 3.48Å; S131-F133 PolarHBondContact OG-N 2.93Å; F133-H135 VanDerWaalsContact C-N 3.35Å; F133-H135 PolarHBondContact O-N 2.97Å; F133-Y136 HydrophobicContact CB-CD2 3.94Å; F133-Y136 HydrophobicContact CB-CE2 4.21Å; F133-Y136 AromaticContact CD1-CD2 3.95Å; F133-Y136 HydrophobicContact CD1-CD2 3.95Å; F133-Y136 AromaticContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CE1-CE2 4.31Å; F133-Y136 HydrophobicContact CG-CD2 4.41Å; F133-Y136 HydrophobicContact CG-CE2 4.24Å; F133-Y136 WeakPolarHBondContact O-CD2 3.05Å; F133-Y136 PolarHBondContact O-N 2.82Å
134G83.7Confident84.6Confident26 Ų26119.6 Ų119.627%0.26863%0.631SS.*G310 helixtrans-63.1-40.4-174.100000113.1S131 Y136 F137S131-G134 PolarHBondContact O-N 2.95Å; S131-G134 VanDerWaalsContact O-N 3.15Å; S131-G134 PolarHBondContact OG-N 3.47Å; G134-Y136 PolarHBondContact O-N 3.38Å; G134-F137 PolarHBondContact O-N 3.3Å
135H84.8Confident84.5Confident102 Ų102121.5 Ų121.547%0.47263%0.627SS.*G310 helixtrans-66.7-16.9-177.162-95000114.4Q132 F133 F137 E138Q132-H135 PolarHBondContact O-CE1 3.03Å; F133-H135 VanDerWaalsContact C-N 3.35Å; F133-H135 PolarHBondContact O-N 2.97Å; H135-F137 PolarHBondContact O-N 3.27Å; H135-E138 PolarHBondContact O-N 3.13Å
136Y88.6Confident84.1Confident155 Ų155119.2 Ų119.261%0.60862%0.619SS**G310 helixtrans-67.5-18.3177.1-66.5-61.7000113.5F133 G134F133-Y136 HydrophobicContact CB-CD2 3.94Å; F133-Y136 HydrophobicContact CB-CE2 4.21Å; F133-Y136 AromaticContact CD1-CD2 3.95Å; F133-Y136 HydrophobicContact CD1-CD2 3.95Å; F133-Y136 AromaticContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CD1-CE2 3.55Å; F133-Y136 HydrophobicContact CE1-CE2 4.31Å; F133-Y136 HydrophobicContact CG-CD2 4.41Å; F133-Y136 HydrophobicContact CG-CE2 4.24Å; F133-Y136 WeakPolarHBondContact O-CD2 3.05Å; F133-Y136 PolarHBondContact O-N 2.82Å; G134-Y136 PolarHBondContact O-N 3.38Å
137F87.8Confident83.2Confident179 Ų179120.3 Ų120.379%0.78562%0.618SS**G310 helixtrans-106.6-2.8179.2-51.4-75.5000112.7G134 H135G134-F137 PolarHBondContact O-N 3.3Å; H135-F137 PolarHBondContact O-N 3.27Å
138E86.1Confident82.6Confident123 Ų123119 Ų11958%0.57561%0.612SS**  trans-84.1126.8175.8-66.5-178.7-178.400109.4H135H135-E138 PolarHBondContact O-N 3.13Å
139T86Confident81.5Confident77 Ų77120.9 Ų120.947%0.47261%0.612SS.*  trans-97.7144.4174.469.90000109.8Y141 D142 T143T139-Y141 PolarHBondContact O-N 2.98Å; T139-Y141 VanDerWaalsContact O-N 3.13Å; T139-D142 PolarHBondContact O-N 2.98Å; T139-D142 WeakPolarHBondContact OG1-CB 3.3Å; T139-D142 PolarHBondContact OG1-N 3.29Å; T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.09Å; T139-T143 VanDerWaalsContact O-OG1 3.08Å
140T82.8Confident80.4Confident130 Ų130118.2 Ų118.280%0.79861%0.605SS**Hα-helixtrans-57.3-27.1173.8260000113.1S144T140-S144 VanDerWaalsContact O-CB 3.26Å; T140-S144 WeakPolarHBondContact O-CB 3.32Å; T140-S144 PolarHBondContact O-N 2.79Å; T140-S144 VanDerWaalsContact O-N 3.08Å; T140-S144 PolarHBondContact O-OG 3.43Å
141Y84.9Confident79.2Confident158 Ų158120.6 Ų120.662%0.6261%0.61SS**Hα-helixtrans-67.7-48.1171.6-174.9-87.3000111.7T139 S144 Y145T139-Y141 PolarHBondContact O-N 2.98Å; T139-Y141 VanDerWaalsContact O-N 3.13Å; Y141-S144 PolarHBondContact O-N 3.4Å; Y141-S144 PolarHBondContact O-OG 2.83Å; Y141-S144 VanDerWaalsContact O-OG 3.11Å; Y141-Y145 HydrophobicContact CD1-CD2 4.19Å; Y141-Y145 AromaticContact CD2-CD2 3.68Å; Y141-Y145 HydrophobicContact CD2-CD2 3.68Å; Y141-Y145 AromaticContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CE1-CD2 4.03Å; Y141-Y145 AromaticContact CE2-CD2 3.5Å; Y141-Y145 HydrophobicContact CE2-CD2 3.5Å; Y141-Y145 VanDerWaalsContact CE2-CD2 3.5Å; Y141-Y145 AromaticContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CG 4.47Å; Y141-Y145 HydrophobicContact CG-CD2 4.02Å; Y141-Y145 HydrophobicContact CG-CE2 4.45Å; Y141-Y145 AromaticContact CZ-CD2 3.68Å; Y141-Y145 AromaticContact CZ-CE2 3.95Å; Y141-Y145 WeakPolarHBondContact O-CD2 3.25Å; Y141-Y145 PolarHBondContact O-N 3.35Å
142D81.9Confident77.7Confident77 Ų77120.9 Ų120.941%0.41261%0.612SS.*Hα-helixtrans-62-47.7175.9-170.144.8000110.4T139 S144 Y145 N146T139-D142 PolarHBondContact O-N 2.98Å; T139-D142 WeakPolarHBondContact OG1-CB 3.3Å; T139-D142 PolarHBondContact OG1-N 3.29Å; D142-S144 VanDerWaalsContact C-N 3.27Å; D142-S144 PolarHBondContact O-N 3Å; D142-Y145 PolarHBondContact O-N 2.86Å; D142-N146 WeakPolarHBondContact O-CB 3.31Å; D142-N146 PolarHBondContact O-N 2.97Å; D142-N146 PolarHBondContact OD1-ND2 2.86Å
143T78.2Confident76.1Confident94 Ų94120.5 Ų120.558%0.57762%0.62SS**Hα-helixtrans-60-33.1178.1-39.30000113.4T139T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.09Å; T139-T143 VanDerWaalsContact O-OG1 3.08Å
144S78.4Confident74.4Confident72 Ų72121.9 Ų121.950%0.50363%0.628SS.*Hα-helixtrans-84.2-31.5-177.7690000114.3T140 Y141 D142T140-S144 VanDerWaalsContact O-CB 3.26Å; T140-S144 WeakPolarHBondContact O-CB 3.32Å; T140-S144 PolarHBondContact O-N 2.79Å; T140-S144 VanDerWaalsContact O-N 3.08Å; T140-S144 PolarHBondContact O-OG 3.43Å; Y141-S144 PolarHBondContact O-N 3.4Å; Y141-S144 PolarHBondContact O-OG 2.83Å; Y141-S144 VanDerWaalsContact O-OG 3.11Å; D142-S144 VanDerWaalsContact C-N 3.27Å; D142-S144 PolarHBondContact O-N 3Å
145Y77.3Confident73.4Confident156 Ų156131.1 Ų131.161%0.61266%0.655SS**Hα-helixtrans-99.7-22.6-178.5-74.5-79.1000114.1Y141 D142 N147Y141-Y145 HydrophobicContact CD1-CD2 4.19Å; Y141-Y145 AromaticContact CD2-CD2 3.68Å; Y141-Y145 HydrophobicContact CD2-CD2 3.68Å; Y141-Y145 AromaticContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CD2-CE2 3.66Å; Y141-Y145 HydrophobicContact CE1-CD2 4.03Å; Y141-Y145 AromaticContact CE2-CD2 3.5Å; Y141-Y145 HydrophobicContact CE2-CD2 3.5Å; Y141-Y145 VanDerWaalsContact CE2-CD2 3.5Å; Y141-Y145 AromaticContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CE2 3.37Å; Y141-Y145 HydrophobicContact CE2-CG 4.47Å; Y141-Y145 HydrophobicContact CG-CD2 4.02Å; Y141-Y145 HydrophobicContact CG-CE2 4.45Å; Y141-Y145 AromaticContact CZ-CD2 3.68Å; Y141-Y145 AromaticContact CZ-CE2 3.95Å; Y141-Y145 WeakPolarHBondContact O-CD2 3.25Å; Y141-Y145 PolarHBondContact O-N 3.35Å; D142-Y145 PolarHBondContact O-N 2.86Å; Y145-N147 PolarHBondContact O-N 3.08Å
146N71.8Confident72.4Confident76 Ų76135.7 Ų135.741%0.40667%0.674SS.*  trans-7975.3177-137.1-41.4000109.9D142 K148D142-N146 WeakPolarHBondContact O-CB 3.31Å; D142-N146 PolarHBondContact O-N 2.97Å; D142-N146 PolarHBondContact OD1-ND2 2.86Å; N146-K148 PolarHBondContact O-N 3.08Å
147N62Low71.2Confident141 Ų141137.3 Ų137.375%0.75468%0.684SS**  trans-65.264.7173.3-82.4-62000111.8Y145 M149Y145-N147 PolarHBondContact O-N 3.08Å; N147-M149 PolarHBondContact O-N 2.96Å
148K68.4Low70.2Confident169 Ų169137.7 Ų137.774%0.73568%0.68SS**  trans-71.669.8160-66.2179.5-173166.70107.4N146N146-K148 PolarHBondContact O-N 3.08Å
149M62.6Low69.7Low159 Ų159139.6 Ų139.678%0.78369%0.689SS**  trans-51.2118.3-177.4-171.7138.881.400107.4N147 L151N147-M149 PolarHBondContact O-N 2.96Å; M149-L151 PolarHBondContact O-N 3.02Å; M149-L151 VanDerWaalsContact O-N 3.09Å
150P64.1Low69.1Low110 Ų110141.5 Ų141.571%0.71470%0.703SS**  trans-56.5125.1-177.221.5-32.3000107.5S152P150-S152 VanDerWaalsContact C-N 3.33Å; P150-S152 PolarHBondContact O-N 3.27Å
151L62.6Low68.6Low174 Ų174139.9 Ų139.991%0.91169%0.686SS**  trans-57101.8-178.9-80.5171.7000107.9M149 T153M149-L151 PolarHBondContact O-N 3.02Å; M149-L151 VanDerWaalsContact O-N 3.09Å; L151-T153 PolarHBondContact O-N 2.69Å
152S56.3Low67.8Low85 Ų85143.5 Ų143.559%0.59470%0.699SS**  trans-67.2109.7-167.3159.60000109.1P150 H154P150-S152 VanDerWaalsContact C-N 3.33Å; P150-S152 PolarHBondContact O-N 3.27Å; S152-H154 PolarHBondContact O-N 3.34Å; S152-H154 VanDerWaalsContact O-N 3.09Å; S152-H154 VanDerWaalsContact OG-CB 3.23Å; S152-H154 WeakPolarHBondContact OG-CB 3.48Å; S152-H154 PolarHBondContact OG-N 2.91Å; S152-H154 PolarHBondContact OG-O 3.48Å
153T57.9Low67.2Low146 Ų146147 Ų14790%0.89671%0.71SS**  trans-62.4-11.8169.8-29.60000112L151 R155L151-T153 PolarHBondContact O-N 2.69Å; T153-R155 PolarHBondContact O-N 3.03Å
154H57.2Low66.9Low151 Ų151148 Ų14870%0.69972%0.718SS**SBendtrans-63.6124169.6-170.8-68.7000110.1S152S152-H154 PolarHBondContact O-N 3.34Å; S152-H154 VanDerWaalsContact O-N 3.09Å; S152-H154 VanDerWaalsContact OG-CB 3.23Å; S152-H154 WeakPolarHBondContact OG-CB 3.48Å; S152-H154 PolarHBondContact OG-N 2.91Å; S152-H154 PolarHBondContact OG-O 3.48Å
155R61.8Low66.6Low220 Ų220148.6 Ų148.683%0.8374%0.736SS**  trans-38144-179.1-60.8170.5-174.6161.21.7113.2T153 K157T153-R155 PolarHBondContact O-N 3.03Å; R155-K157 PolarHBondContact O-N 3.19Å
156F64.7Low66.4Low198 Ų198147 Ų14787%0.86873%0.734SS**  trans-26.9122.4169.9-169.4-90.5000111.6R158F156-R158 PolarHBondContact O-N 3.46Å
157K62.3Low66.9Low188 Ų188149 Ų14982%0.81774%0.741SS**  trans-6097.1179.3-70.8-94.3-174.4171.10108.1R155 E159R155-K157 PolarHBondContact O-N 3.19Å; K157-E159 PolarHBondContact O-N 3.39Å; K157-E159 VanDerWaalsContact O-N 3.17Å
158R67.2Low67.4Low188 Ų188146 Ų14671%0.70973%0.729SS**  trans-64.3116.6172-174.5174.9179.9153.6-2.5106.6F156 H161F156-R158 PolarHBondContact O-N 3.46Å; R158-H161 PolarHBondContact NH2-CD2 3Å; R158-H161 PolarHBondContact NH2-NE2 2.6Å
159E74.8Confident67.9Low162 Ų162145.7 Ų145.776%0.75773%0.73SS**  trans-55.6150.6172.7-67.5-174.415500109.8K157 H161K157-E159 PolarHBondContact O-N 3.39Å; K157-E159 VanDerWaalsContact O-N 3.17Å; E159-H161 PolarHBondContact O-N 3.26Å
160P74.3Confident68.6Low118 Ų118144.4 Ų144.477%0.76673%0.726SS**  trans-67.483.1176.827.7-33.1000110.2W162P160-W162 PolarHBondContact O-N 3.33Å; P160-W162 VanDerWaalsContact O-N 3.14Å
161H72Confident69.4Low95 Ų95141.6 Ų141.644%0.4471%0.705SS.*  trans-65.1113.217570.3-29.3000109.5R158 E159 F163R158-H161 PolarHBondContact NH2-CD2 3Å; R158-H161 PolarHBondContact NH2-NE2 2.6Å; E159-H161 PolarHBondContact O-N 3.26Å; H161-F163 AromaticContact CD2-CE2 3.76Å; H161-F163 AromaticContact NE2-CD2 3.96Å; H161-F163 AromaticContact NE2-CE2 3.28Å; H161-F163 VanDerWaalsContact NE2-CE2 3.28Å; H161-F163 WeakPolarHBondContact NE2-CE2 3.35Å; H161-F163 AromaticContact NE2-CZ 3.86Å
162W68.3Low70.3Confident234 Ų234136.6 Ų136.689%0.88668%0.683SS**  trans-78119156.6-116.6-93.7000106.8P160P160-W162 PolarHBondContact O-N 3.33Å; P160-W162 VanDerWaalsContact O-N 3.14Å
163F68.3Low71.2Confident150 Ų150138 Ų13866%0.65869%0.69SS**  trans-58.8142.5162-82.6-86.4000108.2H161 G165H161-F163 AromaticContact CD2-CE2 3.76Å; H161-F163 AromaticContact NE2-CD2 3.96Å; H161-F163 AromaticContact NE2-CE2 3.28Å; H161-F163 VanDerWaalsContact NE2-CE2 3.28Å; H161-F163 WeakPolarHBondContact NE2-CE2 3.35Å; H161-F163 AromaticContact NE2-CZ 3.86Å; F163-G165 VanDerWaalsContact C-N 3.28Å; F163-G165 PolarHBondContact O-N 2.83Å
164P73.1Confident71.9Confident115 Ų115142.1 Ų142.175%0.74769%0.689SS**  trans-64.791.5173.926.4-33000109.1H166P164-H166 PolarHBondContact O-N 3.1Å
165G70.8Confident72.6Confident85 Ų85143.8 Ų143.888%0.87669%0.69SS**  trans-76.214.2-168.400000115.4F163F163-G165 VanDerWaalsContact C-N 3.28Å; F163-G165 PolarHBondContact O-N 2.83Å
166H74.3Confident73.4Confident122 Ų122137.6 Ų137.657%0.56567%0.67SS**  trans-141.5123.2178.8-177.739.3000109.1P164 D171P164-H166 PolarHBondContact O-N 3.1Å; H166-D171 IonicContact CE1-OD1 3.57Å; H166-D171 IonicContact CE1-OD2 3.23Å; H166-D171 PolarHBondContact CE1-OD2 2.92Å; H166-D171 VanDerWaalsContact CE1-OD2 3.23Å; H166-D171 IonicContact NE2-OD2 3.89Å
167Q80.9Confident73.9Confident120 Ų120134.5 Ų134.556%0.56167%0.671SS**  trans-115.797.5173.9-68.1-176.4-62.400107.9E169 L170Q167-E169 PolarHBondContact O-N 2.78Å; Q167-L170 HydrophobicContact CB-CD1 4.19Å; Q167-L170 HydrophobicContact CB-CG 4.18Å; Q167-L170 PolarHBondContact O-N 3.42Å
168P73.9Confident74.4Confident76 Ų76131.5 Ų131.549%0.49467%0.668SS.*THydrogen-bonded Turntrans-58.9-17.5-176.7-25.935.1000114.3L170 D171P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 PolarHBondContact O-N 3.14Å; P168-D171 WeakPolarHBondContact CA-OD2 3.35Å
169E77.9Confident75Confident163 Ų163131 Ų13176%0.76267%0.674SS**THydrogen-bonded Turntrans-65.2-32.2174.2-63.9178.3-174.300112.7Q167 K176Q167-E169 PolarHBondContact O-N 2.78Å; E169-K176 PolarHBondContact O-NZ 2.98Å
170L77.4Confident75.3Confident132 Ų132129.7 Ų129.769%0.69167%0.666SS**SBendtrans-85.3-10.3-178.8-62.2-177.6000114Q167 P168Q167-L170 HydrophobicContact CB-CD1 4.19Å; Q167-L170 HydrophobicContact CB-CG 4.18Å; Q167-L170 PolarHBondContact O-N 3.42Å; P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 PolarHBondContact O-N 3.14Å
171D81Confident75.8Confident52 Ų52127.1 Ų127.128%0.27865%0.651SS.*SBendtrans-62.9138.5-179.4-67.1-31.2000111.1H166 P168 K176H166-D171 IonicContact CE1-OD1 3.57Å; H166-D171 IonicContact CE1-OD2 3.23Å; H166-D171 PolarHBondContact CE1-OD2 2.92Å; H166-D171 VanDerWaalsContact CE1-OD2 3.23Å; H166-D171 IonicContact NE2-OD2 3.89Å; P168-D171 WeakPolarHBondContact CA-OD2 3.35Å; D171-K176 WeakPolarHBondContact O-CE 3.35Å
172P81.8Confident76.2Confident69 Ų69128.4 Ų128.445%0.44867%0.665SS.*  trans-57.4145.8176.9-2633000112.2R174 Y175P172-R174 PolarHBondContact O-N 2.94Å; P172-Y175 HydrophobicContact CB-CD2 3.99Å; P172-Y175 HydrophobicContact CB-CE2 4.33Å; P172-Y175 HydrophobicContact CG-CD2 4.09Å; P172-Y175 HydrophobicContact CG-CE2 4.27Å; P172-Y175 PolarHBondContact O-N 3.4Å
173P74.9Confident76.9Confident113 Ų113124.8 Ų124.873%0.73465%0.653SS**THydrogen-bonded Turntrans-54-23.1-177.2-28.635000115.4Y175 K176P173-Y175 PolarHBondContact O-N 3.1Å; P173-K176 PolarHBondContact O-N 2.96Å
174R74Confident77.6Confident234 Ų234123.3 Ų123.388%0.88365%0.649SS**THydrogen-bonded Turntrans-67-19.3176.5-62.6-175179.6-165.7-0.3114.3P172P172-R174 PolarHBondContact O-N 2.94Å
175Y71Confident77.9Confident186 Ų186121.8 Ų121.873%0.72964%0.635SS**THydrogen-bonded Turntrans-109.6-7.1-179.7-57.2-70.2000113P172 P173P172-Y175 HydrophobicContact CB-CD2 3.99Å; P172-Y175 HydrophobicContact CB-CE2 4.33Å; P172-Y175 HydrophobicContact CG-CD2 4.09Å; P172-Y175 HydrophobicContact CG-CE2 4.27Å; P172-Y175 PolarHBondContact O-N 3.4Å; P173-Y175 PolarHBondContact O-N 3.1Å
176K78.5Confident78.5Confident90 Ų90121.6 Ų121.639%0.39162%0.62SS.*SBendtrans-75.5141.2175.4-60.2-160.4-176.6-162.70109.9E169 D171 P173 T178E169-K176 PolarHBondContact O-NZ 2.98Å; D171-K176 WeakPolarHBondContact O-CE 3.35Å; P173-K176 PolarHBondContact O-N 2.96Å; K176-T178 PolarHBondContact O-N 2.76Å; K176-T178 VanDerWaalsContact O-N 3.11Å
177C74.6Confident78.7Confident133 Ų133123.8 Ų123.890%0.89963%0.625SS**  trans-64112.8171.6-171.50000108.9
178T73.7Confident78.4Confident124 Ų124121.3 Ų121.376%0.76162%0.62SS**PPolyproline II helixtrans-70134.7174.2-53.20000109.4K176K176-T178 PolarHBondContact O-N 2.76Å; K176-T178 VanDerWaalsContact O-N 3.11Å
179E79.7Confident78.2Confident177 Ų177127.2 Ų127.283%0.82764%0.638SS**PPolyproline II helixtrans-59.2144.5177-168.6171.7-171.200111.5S181E179-S181 PolarHBondContact O-N 3.16Å
180K81.7Confident77.4Confident136 Ų136128.2 Ų128.259%0.59166%0.664SS**PPolyproline II helixtrans-62.4126.6179.7-69.4-179.6-179.51780109.9M184 N185K180-M184 HydrophobicContact CB-CB 4.27Å; K180-N185 WeakPolarHBondContact CB-OD1 3.16Å; K180-N185 VanDerWaalsContact CD-OD1 3.31Å; K180-N185 WeakPolarHBondContact CD-OD1 3.27Å; K180-N185 PolarHBondContact O-ND2 3.33Å
181S83.9Confident77.4Confident64 Ų64128.1 Ų128.145%0.44866%0.662SS.*PPolyproline II helixtrans-61.8156.7176.171.90000111.7E179 Y183 M184 N185E179-S181 PolarHBondContact O-N 3.16Å; S181-Y183 PolarHBondContact O-N 2.84Å; S181-Y183 VanDerWaalsContact O-N 3.09Å; S181-M184 WeakPolarHBondContact O-CA 3.44Å; S181-M184 PolarHBondContact O-N 2.9Å; S181-M184 PolarHBondContact OG-N 3.28Å; S181-N185 PolarHBondContact O-N 3.27Å
182T81.9Confident77.2Confident121 Ų121132.1 Ų132.174%0.74268%0.682SS**Hα-helixtrans-53.7-32.5176.7-390000112.4S186T182-S186 WeakPolarHBondContact O-CB 3.48Å; T182-S186 PolarHBondContact O-N 3.38Å; T182-S186 PolarHBondContact O-OG 2.83Å
183Y82.1Confident76.9Confident159 Ų159135.6 Ų135.662%0.62470%0.695SS**Hα-helixtrans-66.3-48.4172.4-178.5-94.7000111.8S181 N185 S186 Y187S181-Y183 PolarHBondContact O-N 2.84Å; S181-Y183 VanDerWaalsContact O-N 3.09Å; Y183-N185 VanDerWaalsContact C-N 3.25Å; Y183-N185 PolarHBondContact O-N 3.47Å; Y183-S186 WeakPolarHBondContact CA-OG 3.31Å; Y183-S186 PolarHBondContact O-N 2.77Å; Y183-S186 PolarHBondContact O-OG 2.99Å; Y183-Y187 HydrophobicContact CD1-CD2 4.42Å; Y183-Y187 AromaticContact CD2-CD2 3.62Å; Y183-Y187 HydrophobicContact CD2-CD2 3.62Å; Y183-Y187 AromaticContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CE1-CD2 4.31Å; Y183-Y187 AromaticContact CE2-CD2 3.48Å; Y183-Y187 HydrophobicContact CE2-CD2 3.48Å; Y183-Y187 VanDerWaalsContact CE2-CD2 3.48Å; Y183-Y187 AromaticContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CG-CD2 4.1Å; Y183-Y187 HydrophobicContact CG-CE2 4.43Å; Y183-Y187 AromaticContact CZ-CD2 3.84Å; Y183-Y187 WeakPolarHBondContact O-CD2 3.48Å; Y183-Y187 PolarHBondContact O-N 3.41Å; Y183-Y187 VanDerWaalsContact O-N 3.1Å
184M82.3Confident77Confident119 Ų119136.9 Ų136.959%0.58669%0.693SS**Hα-helixtrans-64.1-29.4177.6-68-138.174.800113.4K180 S181 S188K180-M184 HydrophobicContact CB-CB 4.27Å; S181-M184 WeakPolarHBondContact O-CA 3.44Å; S181-M184 PolarHBondContact O-N 2.9Å; S181-M184 PolarHBondContact OG-N 3.28Å; M184-S188 VanDerWaalsContact O-CB 3.29Å; M184-S188 WeakPolarHBondContact O-CB 3.48Å; M184-S188 PolarHBondContact O-N 3.34Å; M184-S188 VanDerWaalsContact O-N 3.07Å; M184-S188 PolarHBondContact O-OG 3.4Å
185N80.4Confident77.2Confident82 Ų82130.8 Ų130.844%0.43968%0.681SS.*Hα-helixtrans-79.9-31.5175.7-67-26000113.4K180 S181 Y183 S188K180-N185 WeakPolarHBondContact CB-OD1 3.16Å; K180-N185 VanDerWaalsContact CD-OD1 3.31Å; K180-N185 WeakPolarHBondContact CD-OD1 3.27Å; K180-N185 PolarHBondContact O-ND2 3.33Å; S181-N185 PolarHBondContact O-N 3.27Å; Y183-N185 VanDerWaalsContact C-N 3.25Å; Y183-N185 PolarHBondContact O-N 3.47Å; N185-S188 PolarHBondContact O-OG 3.46Å; N185-S188 VanDerWaalsContact O-OG 3.11Å
186S82.4Confident77.6Confident82 Ų82127.1 Ų127.157%0.57368%0.678SS**Hα-helixtrans-81-20.4178.245.90000113.6T182 Y183T182-S186 WeakPolarHBondContact O-CB 3.48Å; T182-S186 PolarHBondContact O-N 3.38Å; T182-S186 PolarHBondContact O-OG 2.83Å; Y183-S186 WeakPolarHBondContact CA-OG 3.31Å; Y183-S186 PolarHBondContact O-N 2.77Å; Y183-S186 PolarHBondContact O-OG 2.99Å
187Y78.6Confident77.6Confident168 Ų168129.8 Ų129.866%0.65970%0.699SS**SBendtrans-113.75.2175.9-62.4-75000114.6Y183 K189Y183-Y187 HydrophobicContact CD1-CD2 4.42Å; Y183-Y187 AromaticContact CD2-CD2 3.62Å; Y183-Y187 HydrophobicContact CD2-CD2 3.62Å; Y183-Y187 AromaticContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CD2-CE2 3.54Å; Y183-Y187 HydrophobicContact CE1-CD2 4.31Å; Y183-Y187 AromaticContact CE2-CD2 3.48Å; Y183-Y187 HydrophobicContact CE2-CD2 3.48Å; Y183-Y187 VanDerWaalsContact CE2-CD2 3.48Å; Y183-Y187 AromaticContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CE2-CE2 3.36Å; Y183-Y187 HydrophobicContact CG-CD2 4.1Å; Y183-Y187 HydrophobicContact CG-CE2 4.43Å; Y183-Y187 AromaticContact CZ-CD2 3.84Å; Y183-Y187 WeakPolarHBondContact O-CD2 3.48Å; Y183-Y187 PolarHBondContact O-N 3.41Å; Y183-Y187 VanDerWaalsContact O-N 3.1Å; Y187-K189 PolarHBondContact O-N 2.93Å
188S73.9Confident77.8Confident67 Ų67129.5 Ų129.547%0.46968%0.683SS.*SBendtrans-66.6116.316553.90000109M184 N185M184-S188 VanDerWaalsContact O-CB 3.29Å; M184-S188 WeakPolarHBondContact O-CB 3.48Å; M184-S188 PolarHBondContact O-N 3.34Å; M184-S188 VanDerWaalsContact O-N 3.07Å; M184-S188 PolarHBondContact O-OG 3.4Å; N185-S188 PolarHBondContact O-OG 3.46Å; N185-S188 VanDerWaalsContact O-OG 3.11Å
189K69.6Low78.2Confident200 Ų200130 Ų13087%0.8768%0.677SS**  trans-54.6141.8-178.9-66.8176175.6178.60111.7Y187Y187-K189 PolarHBondContact O-N 2.93Å
190S61.4Low78Confident185 Ų185125.7 Ų125.7100%1.29466%0.663SS**  trans-65.70158.9-179.70000111.6

Retrieved 190 of 190 residues in 178.9 ms (Link to these results)