A0A087WRD7_MOUSE Loading...

Sperm tail PG rich repeat containing 4

AlphaFold DB , UniProt , Accession A0A087WRD7, Species MOUSE (Mus musculus, Mouse), Gene Stpg4, Length 207 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
1M43.7Very low40.3Very low252 Ų252132.7 Ų132.7100%1.24179%0.792SS**  01430-108.7160.116100107.6
2A42.1Very low40.1Very low103 Ų103130.9 Ų130.985%0.85178%0.783SS**  trans-59.9146.8-159.800000116.7
3E42Very low39.8Very low157 Ų157131.1 Ų131.173%0.73479%0.785SS**  trans-50.2172.4151.6-73-98.4166.800112.4
4P49.3Very low40Very low111 Ų111129.3 Ų129.372%0.72178%0.778SS**  cis-145161.719.931.5-7.5000119.2
5T41.6Very low39.6Very low98 Ų98137.3 Ų137.360%0.60179%0.789SS**  trans-24.3141.2142.6-59.40000117.4V7T5-V7 HydrophobicContact CG2-CG2 4.2Å
6V41.3Very low39.3Very low124 Ų124138.2 Ų138.275%0.75278%0.784SS**  trans-138.3106.7149-179.10000110.5I8V6-I8 HydrophobicContact CG1-CD1 3.8Å; V6-I8 HydrophobicContact CG1-CG1 3.73Å
7V38.8Very low39Very low126 Ų126137.5 Ų137.576%0.76478%0.778SS**  trans-94.6131.8161170.70000107T5T5-V7 HydrophobicContact CG2-CG2 4.2Å
8I37.8Very low38.8Very low149 Ų149138.7 Ų138.776%0.76478%0.781SS**  trans-136.2117164.6-58176.4000109.2V6V6-I8 HydrophobicContact CG1-CD1 3.8Å; V6-I8 HydrophobicContact CG1-CG1 3.73Å
9A37.4Very low38.4Very low73 Ų73134.9 Ų134.960%0.60378%0.776SS**PPolyproline II helixtrans-80.9163171.200000111.3
10P36.4Very low38Very low128 Ų128138.2 Ų138.283%0.83178%0.783SS**PPolyproline II helixtrans-79.4128.6-17630.7-33.4000112.8
11T32.8Very low37.8Very low139 Ų139135.4 Ų135.485%0.85379%0.785SS**PPolyproline II helixtrans-87.3129.5173.6-56.50000110.4
12T37.4Very low37.7Very low111 Ų111132.5 Ų132.568%0.68177%0.768SS**  trans-108.1160.1170.746.30000110.6
13V36.5Very low37.9Very low133 Ų133132.2 Ų132.281%0.80676%0.758SS**  trans72.1159.5157.5-74.40000120.1
14P43.2Very low37.7Very low106 Ų106132.5 Ų132.569%0.68876%0.763SS**  cis-137.5173.9-32.232.5-14.1000112.8
15R33.2Very low37.7Very low250 Ų250133.4 Ų133.494%0.94376%0.762SS**  trans-153.3119.4148.4-151.4173.7179.6142.4-0.1112.2
16E35.7Very low37.6Very low151 Ų151136.7 Ų136.771%0.70677%0.772SS**  trans-79.9154171.5-46.5-177.9165.600107.5
17D34.3Very low37.7Very low127 Ų127136.3 Ų136.368%0.67977%0.77SS**  -176.9150.754.6-114.2-28.3000113
18L34.8Very low37.9Very low159 Ų159134.8 Ų134.883%0.83277%0.771SS**  trans55.9123.1138.1-68.2152.3000123.5
19G31.3Very low38.3Very low67 Ų67136.7 Ų136.769%0.69177%0.774SS**  trans147.977.3140.600000119.9
20H30.8Very low38.8Very low200 Ų200142.1 Ų142.193%0.92679%0.786SS**  trans60.2115.3145-65.8-54.2000123.7
21G33.8Very low39.2Very low79 Ų79141.1 Ų141.181%0.81478%0.778SS**  trans17798.6154.900000112.2
22E40.7Very low40.2Very low192 Ų192144.1 Ų144.190%0.89778%0.779SS**  trans-61.8169.3-179.3-90.3-87.7132.800115.2
23P46.4Very low40.7Very low97 Ų97147.8 Ų147.863%0.6379%0.785SS**  trans-105.3157.3-137.439.4-36.6000114.5
24L39.2Very low41.6Very low162 Ų162147.4 Ų147.485%0.84878%0.784SS**  trans-107.699.5162.5-117.3164.8000110M26L24-M26 PolarHBondContact O-N 3.32Å
25L48.2Very low42.1Very low131 Ų131148.5 Ų148.569%0.68679%0.79SS**  trans-51117166.6-117.6158.6000110.3T27L25-T27 HydrophobicContact CD2-CG2 3.77Å
26M39.8Very low43Very low166 Ų166138.7 Ų138.782%0.81877%0.768SS**  trans-133.397.1160.3-77.3-7994.400109.1L24 A28L24-M26 PolarHBondContact O-N 3.32Å; M26-A28 PolarHBondContact O-N 3.35Å
27T43Very low44.1Very low117 Ų117139.8 Ų139.872%0.71878%0.777SS**  trans-69.7109.4169.859.40000109L25L25-T27 HydrophobicContact CD2-CG2 3.77Å
28A43.4Very low45.4Very low93 Ų93140.3 Ų140.377%0.76978%0.776SS**  trans-87.3110.3168.800000109.5M26 Q30M26-A28 PolarHBondContact O-N 3.35Å; A28-Q30 PolarHBondContact O-N 3.27Å
29K46.2Very low46.7Very low190 Ų190143.8 Ų143.883%0.82678%0.778SS**  trans-53.9124.9175.3-76.1171.1174.6174.10110.7V31K29-V31 PolarHBondContact O-N 3.34Å
30Q48.7Very low48.3Very low186 Ų186144.4 Ų144.487%0.86976%0.763SS**  trans-70.595.3166.7-73-71.5-16.100109.1A28 K32A28-Q30 PolarHBondContact O-N 3.27Å; Q30-K32 PolarHBondContact O-N 3.02Å
31V43Very low50.1Low107 Ų107136.1 Ų136.165%0.64873%0.731SS**  trans-81105171.11770000107.8K29 K33K29-V31 PolarHBondContact O-N 3.34Å; V31-K33 HydrophobicContact CG1-CG 4.43Å; V31-K33 PolarHBondContact O-N 3.39Å
32K55.2Low51.8Low202 Ų202141.7 Ų141.788%0.87873%0.728SS**  trans-63.3102.8165.9-68.8179.9179.1179.50108Q30 T34Q30-K32 PolarHBondContact O-N 3.02Å; K32-T34 PolarHBondContact O-N 3.04Å
33K47.4Very low53.1Low189 Ų189137.5 Ų137.582%0.82270%0.704SS**  trans-76.2114.2170.2-68.8-177.4178.9-179.90108.2V31V31-K33 HydrophobicContact CG1-CG 4.43Å; V31-K33 PolarHBondContact O-N 3.39Å
34T56.3Low54.2Low125 Ų125139.4 Ų139.477%0.76770%0.698SS**  trans-56.3143.1162.743.40000109.2K32 G36K32-T34 PolarHBondContact O-N 3.04Å; T34-G36 VanDerWaalsContact C-N 3.29Å; T34-G36 PolarHBondContact O-N 3.19Å
35P53.3Low55.5Low128 Ų128137.7 Ų137.783%0.83169%0.69SS**  trans-74.492.9179.532.4-29.6000106.9L37P35-L37 PolarHBondContact O-N 3.47Å
36G51.1Low56.2Low45 Ų45135.4 Ų135.446%0.46468%0.681SS.*  trans-58.3105.2167.900000107.5T34 E38T34-G36 VanDerWaalsContact C-N 3.29Å; T34-G36 PolarHBondContact O-N 3.19Å; G36-E38 PolarHBondContact O-N 3.32Å
37L59.7Low57.3Low174 Ų174132.2 Ų132.291%0.91167%0.666SS**  trans-7148.2160.6-144120.4000108.1P35P35-L37 PolarHBondContact O-N 3.47Å
38E60.8Low58.2Low138 Ų138131.9 Ų131.965%0.64566%0.664SS**  trans-89.8129.2-176.4-70.6-178.7158.100106.8G36 E40 G41G36-E38 PolarHBondContact O-N 3.32Å; E38-E40 WeakPolarHBondContact O-CA 3.46Å; E38-E40 VanDerWaalsContact O-CG 3.25Å; E38-E40 WeakPolarHBondContact O-CG 3.35Å; E38-E40 PolarHBondContact O-N 3.09Å; E38-G41 PolarHBondContact O-N 3.01Å
39R62.3Low59.2Low232 Ų232133.9 Ų133.988%0.87566%0.662SS**THydrogen-bonded Turntrans35.3-37.3158.8-171.8177.2-77.9-119.90.4120.4W42R39-W42 PolarHBondContact O-NE1 3.41Å; R39-W42 VanDerWaalsContact O-NE1 3.13Å
40E64.3Low60.2Low80 Ų80129.1 Ų129.137%0.37465%0.649SS.*THydrogen-bonded Turntrans-98.1-2.5179.938.7-168.7140.700114.2E38 W42 W43 R44E38-E40 WeakPolarHBondContact O-CA 3.46Å; E38-E40 VanDerWaalsContact O-CG 3.25Å; E38-E40 WeakPolarHBondContact O-CG 3.35Å; E38-E40 PolarHBondContact O-N 3.09Å; E40-W42 PolarHBondContact O-N 2.92Å; E40-W43 HydrophobicContact CB-CZ2 3.88Å; E40-W43 VanDerWaalsContact CB-NE1 3.28Å; E40-W43 PolarHBondContact O-NE1 2.96Å; E40-R44 WeakPolarHBondContact O-CG 3.49Å; E40-R44 PolarHBondContact O-N 3.33Å; E40-R44 IonicContact OE2-CZ 3.3Å; E40-R44 VanDerWaalsContact OE2-CZ 3.3Å; E40-R44 IonicContact OE2-NH1 3.4Å; E40-R44 PolarHBondContact OE2-NH1 2.97Å; E40-R44 IonicContact OE2-NH2 2.77Å; E40-R44 PolarHBondContact OE2-NH2 2.98Å
41G68.9Low61.2Low26 Ų26123.1 Ų123.127%0.26863%0.626SS.*Hα-helixtrans-63.1-36.8174.600000114.3E38 W43 R44 L45E38-G41 PolarHBondContact O-N 3.01Å; G41-W43 PolarHBondContact O-N 3.01Å; G41-R44 PolarHBondContact O-N 3.32Å; G41-L45 WeakPolarHBondContact O-CG 3.43Å; G41-L45 PolarHBondContact O-N 2.98Å
42W70.6Confident62.8Low195 Ų195124 Ų12474%0.73963%0.626SS**Hα-helixtrans-70.3-33-173.271.5-85.1000113.7R39 E40R39-W42 PolarHBondContact O-NE1 3.41Å; R39-W42 VanDerWaalsContact O-NE1 3.13Å; E40-W42 PolarHBondContact O-N 2.92Å
43W67.9Low63.6Low105 Ų105120 Ų12040%0.39862%0.621SS.*Hα-helixtrans-90.7-19.2178.665.3-97.8000113.3E40 G41 T46 I47E40-W43 HydrophobicContact CB-CZ2 3.88Å; E40-W43 VanDerWaalsContact CB-NE1 3.28Å; E40-W43 PolarHBondContact O-NE1 2.96Å; G41-W43 PolarHBondContact O-N 3.01Å; W43-T46 WeakPolarHBondContact CA-OG1 3.42Å; W43-T46 PolarHBondContact O-OG1 2.94Å; W43-I47 HydrophobicContact CE3-CD1 3.47Å; W43-I47 VanDerWaalsContact CE3-CD1 3.47Å; W43-I47 HydrophobicContact CZ3-CD1 3.49Å; W43-I47 VanDerWaalsContact CZ3-CD1 3.49Å; W43-I47 WeakPolarHBondContact O-CG1 3.35Å; W43-I47 PolarHBondContact O-N 2.83Å
44R69.9Low64.8Low136 Ų136114.4 Ų114.451%0.51362%0.616SS.*Hα-helixtrans-74.5-35173-76.5-174.9174.414312112.8E40 G41 T46 I47E40-R44 WeakPolarHBondContact O-CG 3.49Å; E40-R44 PolarHBondContact O-N 3.33Å; E40-R44 IonicContact OE2-CZ 3.3Å; E40-R44 VanDerWaalsContact OE2-CZ 3.3Å; E40-R44 IonicContact OE2-NH1 3.4Å; E40-R44 PolarHBondContact OE2-NH1 2.97Å; E40-R44 IonicContact OE2-NH2 2.77Å; E40-R44 PolarHBondContact OE2-NH2 2.98Å; G41-R44 PolarHBondContact O-N 3.32Å; R44-T46 VanDerWaalsContact C-N 3.26Å; R44-T46 PolarHBondContact O-N 2.93Å; R44-I47 PolarHBondContact O-N 3.24Å
45L65.6Low65.8Low127 Ų127113 Ų11367%0.66561%0.608SS**Hα-helixtrans-63.8-32.7173.4-67.9170.3000111.9G41 T48G41-L45 WeakPolarHBondContact O-CG 3.43Å; G41-L45 PolarHBondContact O-N 2.98Å; L45-T48 PolarHBondContact O-OG1 2.74Å; L45-T48 VanDerWaalsContact O-OG1 3.09Å
46T62.6Low66.9Low82 Ų82112.2 Ų112.250%0.50359%0.589SS.*Hα-helixtrans-79.1-17179.753.20000114.2W43 R44 T48W43-T46 WeakPolarHBondContact CA-OG1 3.42Å; W43-T46 PolarHBondContact O-OG1 2.94Å; R44-T46 VanDerWaalsContact C-N 3.26Å; R44-T46 PolarHBondContact O-N 2.93Å; T46-T48 VanDerWaalsContact C-N 3.35Å
47I63.7Low68.5Low99 Ų99116.4 Ų116.451%0.50860%0.596SS.*Hα-helixtrans-73.9-28.3-180-74.6169.3000111.5W43 R44 T50W43-I47 HydrophobicContact CE3-CD1 3.47Å; W43-I47 VanDerWaalsContact CE3-CD1 3.47Å; W43-I47 HydrophobicContact CZ3-CD1 3.49Å; W43-I47 VanDerWaalsContact CZ3-CD1 3.49Å; W43-I47 WeakPolarHBondContact O-CG1 3.35Å; W43-I47 PolarHBondContact O-N 2.83Å; R44-I47 PolarHBondContact O-N 3.24Å; I47-T50 PolarHBondContact O-OG1 3.05Å
48T61.8Low69.6Low111 Ų111116.5 Ų116.568%0.68159%0.59SS**Hα-helixtrans-80.4-20.6178.952.60000113.4L45 T46 T50L45-T48 PolarHBondContact O-OG1 2.74Å; L45-T48 VanDerWaalsContact O-OG1 3.09Å; T46-T48 VanDerWaalsContact C-N 3.35Å; T48-T50 VanDerWaalsContact C-N 3.34Å
49D64.1Low70.9Confident135 Ų135116.9 Ų116.972%0.72259%0.585SS**THydrogen-bonded Turntrans-94.515.1-177-73-7.3000113.1P51D49-P51 WeakPolarHBondContact O-CD 3.3Å
50T66.5Low72.1Confident90 Ų90109.3 Ų109.355%0.55257%0.565SS**PPolyproline II helixtrans-75.3116.2171.157.30000108.6I47 T48I47-T50 PolarHBondContact O-OG1 3.05Å; T48-T50 VanDerWaalsContact C-N 3.34Å
51P70.4Confident73Confident60 Ų60113.8 Ų113.839%0.3958%0.583SS.*PPolyproline II helixtrans-63.5153.3177.929.2-34.2000109.3D49 Y56D49-P51 WeakPolarHBondContact O-CD 3.3Å; P51-Y56 HydrophobicContact CG-CD1 3.59Å; P51-Y56 HydrophobicContact CG-CE1 3.21Å; P51-Y56 HydrophobicContact CG-CE2 4.38Å; P51-Y56 HydrophobicContact CG-CG 4.34Å; P51-Y56 VanDerWaalsContact O-CZ 3.28Å; P51-Y56 PolarHBondContact O-OH 3.26Å
52I75.8Confident73.9Confident124 Ų124117.1 Ų117.164%0.63660%0.598SS**PPolyproline II helixtrans-50132.1-175.1-60.9165.5000109.3G54 T55I52-G54 PolarHBondContact O-N 2.87Å; I52-G54 VanDerWaalsContact O-N 3.08Å; I52-T55 WeakPolarHBondContact O-CB 3.04Å; I52-T55 PolarHBondContact O-N 2.93Å; I52-T55 PolarHBondContact O-OG1 2.83Å
53P71.7Confident74.8Confident120 Ų120111.5 Ų111.578%0.77958%0.581SS**THydrogen-bonded Turntrans-53.4119178.221.1-31.9000110.7
54G74.5Confident75.7Confident70 Ų70111.7 Ų111.772%0.72259%0.586SS**THydrogen-bonded Turntrans102.1-8.3-174.600000115.7I52I52-G54 PolarHBondContact O-N 2.87Å; I52-G54 VanDerWaalsContact O-N 3.08Å
55T76.6Confident76.2Confident96 Ų96107.6 Ų107.659%0.58958%0.581SS**  trans-951.5174.1-51.90000112.7I52 H57I52-T55 WeakPolarHBondContact O-CB 3.04Å; I52-T55 PolarHBondContact O-N 2.93Å; I52-T55 PolarHBondContact O-OG1 2.83Å; T55-H57 PolarHBondContact O-N 2.77Å
56Y76.9Confident77.2Confident111 Ų111108.1 Ų108.144%0.43558%0.584SS.*  trans-66.3126.1175.2-60.9-87.8000110.1P51 F58P51-Y56 HydrophobicContact CG-CD1 3.59Å; P51-Y56 HydrophobicContact CG-CE1 3.21Å; P51-Y56 HydrophobicContact CG-CE2 4.38Å; P51-Y56 HydrophobicContact CG-CG 4.34Å; P51-Y56 VanDerWaalsContact O-CZ 3.28Å; P51-Y56 PolarHBondContact O-OH 3.26Å; Y56-F58 PolarHBondContact O-N 3.09Å; Y56-F58 VanDerWaalsContact O-N 3.14Å
57H84.6Confident78.4Confident133 Ų133110.1 Ų110.162%0.61659%0.591SS**  trans-68.7108.6166.1-177.960.4000108.8T55 R59 E63T55-H57 PolarHBondContact O-N 2.77Å; H57-R59 PolarHBondContact O-N 3.35Å; H57-E63 IonicContact CD2-OE2 3.71Å; H57-E63 IonicContact CE1-OE2 2.77Å; H57-E63 IonicContact NE2-OE1 3.97Å; H57-E63 IonicContact NE2-OE2 2.78Å; H57-E63 PolarHBondContact NE2-OE2 3.23Å
58F83Confident79.3Confident176 Ų176111.1 Ų111.177%0.77260%0.597SS**  trans-72.898170.7-70.6-79.8000108.4Y56 T60Y56-F58 PolarHBondContact O-N 3.09Å; Y56-F58 VanDerWaalsContact O-N 3.14Å; F58-T60 PolarHBondContact O-N 3.4Å
59R86.7Confident80.3Confident146 Ų146110.2 Ų110.255%0.55159%0.593SS**  trans-60133.8177.4-71.7-176-72.1-127.10.6110.2H57 E63H57-R59 PolarHBondContact O-N 3.35Å; R59-E63 WeakPolarHBondContact CA-OE2 3.47Å; R59-E63 HydrophobicContact CB-CB 4.32Å
60T88.8Confident80.9Confident73 Ų73109.7 Ų109.745%0.44860%0.595SS.*  trans-71.6158.4169.462.60000110.1F58 T62 E63 E64F58-T60 PolarHBondContact O-N 3.4Å; T60-T62 PolarHBondContact O-N 3.28Å; T60-T62 VanDerWaalsContact O-N 3.09Å; T60-E63 PolarHBondContact N-OE2 2.56Å; T60-E63 PolarHBondContact O-N 3.23Å; T60-E63 WeakPolarHBondContact OG1-CG 3.25Å; T60-E63 PolarHBondContact OG1-N 3.42Å; T60-E64 PolarHBondContact O-N 3.48Å
61F83.1Confident81.4Confident175 Ų175114 Ų11477%0.76861%0.606SS**Hα-helixtrans-52.6-33.9176.8180-100000112.6A65F61-A65 WeakPolarHBondContact O-CB 3.42Å; F61-A65 PolarHBondContact O-N 3.48Å; F61-A65 VanDerWaalsContact O-N 3.12Å
62T87Confident81.5Confident95 Ų95117.3 Ų117.358%0.58362%0.619SS**Hα-helixtrans-68.7-46.4176.7-49.10000112.4T60 E64 A65 L66T60-T62 PolarHBondContact O-N 3.28Å; T60-T62 VanDerWaalsContact O-N 3.09Å; T62-E64 VanDerWaalsContact C-N 3.34Å; T62-E64 PolarHBondContact O-N 3.41Å; T62-A65 PolarHBondContact O-N 3.46Å; T62-L66 WeakPolarHBondContact O-CG 3.4Å; T62-L66 PolarHBondContact O-N 3.43Å; T62-L66 VanDerWaalsContact O-N 3.16Å
63E89.3Confident81.5Confident78 Ų78118 Ų11836%0.36463%0.629SS.*Hα-helixtrans-65.2-38.9179.8-72167-163.400112H57 R59 T60 L66 L67H57-E63 IonicContact CD2-OE2 3.71Å; H57-E63 IonicContact CE1-OE2 2.77Å; H57-E63 IonicContact NE2-OE1 3.97Å; H57-E63 IonicContact NE2-OE2 2.78Å; H57-E63 PolarHBondContact NE2-OE2 3.23Å; R59-E63 WeakPolarHBondContact CA-OE2 3.47Å; R59-E63 HydrophobicContact CB-CB 4.32Å; T60-E63 PolarHBondContact N-OE2 2.56Å; T60-E63 PolarHBondContact O-N 3.23Å; T60-E63 WeakPolarHBondContact OG1-CG 3.25Å; T60-E63 PolarHBondContact OG1-N 3.42Å; E63-L66 PolarHBondContact O-N 3.35Å; E63-L67 PolarHBondContact O-N 3.27Å
64E87Confident81.3Confident109 Ų109120.9 Ų120.951%0.50963%0.625SS.*Hα-helixtrans-65.4-41.8175.7-174.9172.2-156.900112T60 T62 L66 L67 N68T60-E64 PolarHBondContact O-N 3.48Å; T62-E64 VanDerWaalsContact C-N 3.34Å; T62-E64 PolarHBondContact O-N 3.41Å; E64-L66 VanDerWaalsContact C-N 3.28Å; E64-L66 PolarHBondContact O-N 2.98Å; E64-L67 PolarHBondContact O-N 3.13Å; E64-N68 PolarHBondContact O-N 3.49Å
65A81.1Confident81Confident49 Ų49123 Ų12341%0.40562%0.62SS.*Hα-helixtrans-64-31.2177.100000113.1F61 T62 N68 P69F61-A65 WeakPolarHBondContact O-CB 3.42Å; F61-A65 PolarHBondContact O-N 3.48Å; F61-A65 VanDerWaalsContact O-N 3.12Å; T62-A65 PolarHBondContact O-N 3.46Å; A65-N68 CarbonylContact O-C 3.56Å; A65-P69 WeakPolarHBondContact O-CA 3.32Å
66L86.8Confident80.7Confident138 Ų138125.3 Ų125.372%0.72362%0.622SS**Hα-helixtrans-73.4-34174.9-69.3176000112.6T62 E63 E64T62-L66 WeakPolarHBondContact O-CG 3.4Å; T62-L66 PolarHBondContact O-N 3.43Å; T62-L66 VanDerWaalsContact O-N 3.16Å; E63-L66 PolarHBondContact O-N 3.35Å; E64-L66 VanDerWaalsContact C-N 3.28Å; E64-L66 PolarHBondContact O-N 2.98Å
67L88.1Confident80.2Confident124 Ų124129.4 Ų129.465%0.64964%0.642SS**Hα-helixtrans-72.4-33.8-179.7-168.469.4000112.2E63 E64E63-L67 PolarHBondContact O-N 3.27Å; E64-L67 PolarHBondContact O-N 3.13Å
68N81.7Confident79.1Confident121 Ų121127.7 Ų127.765%0.64764%0.638SS**SBendtrans-13280.8175.1-173.721.9000110.7E64 A65 V70E64-N68 PolarHBondContact O-N 3.49Å; A65-N68 CarbonylContact O-C 3.56Å; N68-V70 PolarHBondContact O-N 2.8Å
69P82.9Confident78.2Confident91 Ų91126 Ų12659%0.59163%0.632SS**  trans-65.3109.7-178.226-33.2000109.9A65 K71A65-P69 WeakPolarHBondContact O-CA 3.32Å; P69-K71 PolarHBondContact O-N 3.35Å; P69-K71 VanDerWaalsContact O-N 3.12Å
70V77.6Confident77.3Confident125 Ų125121.8 Ų121.876%0.75863%0.634SS**  trans-66113.4174179.40000108.1N68 I72N68-V70 PolarHBondContact O-N 2.8Å; V70-I72 PolarHBondContact O-N 3.5Å; V70-I72 VanDerWaalsContact O-N 3.14Å
71K75Confident76.2Confident181 Ų181130 Ų13079%0.78766%0.657SS**  trans-60.3119.1176-63.4-176.2-176.8-178.90108.7P69 T73P69-K71 PolarHBondContact O-N 3.35Å; P69-K71 VanDerWaalsContact O-N 3.12Å; K71-T73 PolarHBondContact O-N 3.09Å
72I74.5Confident75.4Confident129 Ų129128.7 Ų128.766%0.66265%0.651SS**  trans-71104.8177.1-54.5170.9000107.6V70 N75V70-I72 PolarHBondContact O-N 3.5Å; V70-I72 VanDerWaalsContact O-N 3.14Å; I72-N75 WeakPolarHBondContact CG2-ND2 3.39Å; I72-N75 WeakPolarHBondContact CG2-OD1 3.37Å
73T74.6Confident74.1Confident138 Ų138133.5 Ų133.585%0.84766%0.664SS**  trans-88.7-15.1-173.4470000113.3K71K71-T73 PolarHBondContact O-N 3.09Å
74Y68.4Low72.8Confident180 Ų180135.5 Ų135.571%0.70668%0.677SS**  trans-168.5130.6178.3-176.7-107.5000109.9
75N67.4Low71.6Confident115 Ų115134.3 Ų134.362%0.61568%0.678SS**  trans-112.7143.6166.1-74.3-42.3000108.3I72 K77I72-N75 WeakPolarHBondContact CG2-ND2 3.39Å; I72-N75 WeakPolarHBondContact CG2-OD1 3.37Å; N75-K77 PolarHBondContact O-N 3.36Å
76F69.9Low70.4Confident145 Ų145137.1 Ų137.164%0.63669%0.686SS**  trans-56.9126.1165.9-170.7-122.2000107N78F76-N78 HydrophobicContact CD1-CB 3.75Å; F76-N78 WeakPolarHBondContact CD1-O 3.33Å; F76-N78 HydrophobicContact CE1-CB 3.57Å; F76-N78 WeakPolarHBondContact CE1-OD1 3.39Å; F76-N78 HydrophobicContact CZ-CB 4.44Å; F76-N78 WeakPolarHBondContact CZ-OD1 3.46Å; F76-N78 CarbonylContact O-C 3.45Å; F76-N78 PolarHBondContact O-N 3.04Å
77K67.8Low69.1Low197 Ų197136.1 Ų136.186%0.85769%0.685SS**SBendtrans-58.5-10.6-173.6-73.9-159.8177.3-1730113.8N75N75-K77 PolarHBondContact O-N 3.36Å
78N60Low67.7Low96 Ų96134.5 Ų134.551%0.51368%0.677SS.*SBendtrans-112.794.3177.5-29.148000103.4F76 G80F76-N78 HydrophobicContact CD1-CB 3.75Å; F76-N78 WeakPolarHBondContact CD1-O 3.33Å; F76-N78 HydrophobicContact CE1-CB 3.57Å; F76-N78 WeakPolarHBondContact CE1-OD1 3.39Å; F76-N78 HydrophobicContact CZ-CB 4.44Å; F76-N78 WeakPolarHBondContact CZ-OD1 3.46Å; F76-N78 CarbonylContact O-C 3.45Å; F76-N78 PolarHBondContact O-N 3.04Å; N78-G80 PolarHBondContact O-N 3.24Å
79E65.3Low66.5Low141 Ų141136.5 Ų136.566%0.65968%0.675SS**  trans-46.9115.7151.545.7-174.3172.800105.9K82E79-K82 WeakPolarHBondContact OE1-CE 3.45Å; E79-K82 IonicContact OE1-NZ 3.11Å; E79-K82 PolarHBondContact OE1-NZ 2.83Å; E79-K82 WeakPolarHBondContact OE2-CE 3.39Å; E79-K82 IonicContact OE2-NZ 2.72Å; E79-K82 PolarHBondContact OE2-NZ 3.37Å; E79-K82 VanDerWaalsContact OE2-NZ 3.11Å
80G67.3Low65.5Low58 Ų58137.5 Ų137.560%0.59868%0.676SS**  trans-54.4167.4-179.500000109.9N78 K82N78-G80 PolarHBondContact O-N 3.24Å; G80-K82 PolarHBondContact O-N 3.34Å
81R64.7Low64.6Low246 Ų246136 Ų13693%0.92866%0.663SS**  trans-32.5108.3-178.5-65.9177.9-178.9161.7-0.3111.8K83R81-K83 PolarHBondContact O-N 2.69Å
82K66.4Low64.1Low147 Ų147133.4 Ų133.464%0.63967%0.665SS**  trans-58110.1174.9-65.2-163.7-179.7-167.80107.4E79 G80 L84E79-K82 WeakPolarHBondContact OE1-CE 3.45Å; E79-K82 IonicContact OE1-NZ 3.11Å; E79-K82 PolarHBondContact OE1-NZ 2.83Å; E79-K82 WeakPolarHBondContact OE2-CE 3.39Å; E79-K82 IonicContact OE2-NZ 2.72Å; E79-K82 PolarHBondContact OE2-NZ 3.37Å; E79-K82 VanDerWaalsContact OE2-NZ 3.11Å; G80-K82 PolarHBondContact O-N 3.34Å; K82-L84 PolarHBondContact O-N 2.77Å
83K60.9Low63.6Low195 Ų195131.9 Ų131.985%0.84866%0.661SS**PPolyproline II helixtrans-72.3123.6170.3-67.2-151.7179.1-172.10107R81R81-K83 PolarHBondContact O-N 2.69Å
84L61Low62.8Low121 Ų121129.4 Ų129.463%0.63465%0.648SS**PPolyproline II helixtrans-56.3141.6174.4-65.3174.9000109.6K82 L88K82-L84 PolarHBondContact O-N 2.77Å; L84-L88 HydrophobicContact CB-CD2 4.15Å; L84-L88 HydrophobicContact CD1-CD2 3.92Å; L84-L88 HydrophobicContact CD2-CD2 4.1Å; L84-L88 HydrophobicContact CG-CD2 4.26Å
85P62.8Low62.4Low84 Ų84126 Ų12655%0.54565%0.646SS.*PPolyproline II helixtrans-59.6156.2-174.223.4-33.5000112.6V87 L88P85-V87 PolarHBondContact O-N 3.17Å; P85-L88 HydrophobicContact CG-CB 4.44Å; P85-L88 PolarHBondContact O-N 3.37Å; P85-L88 VanDerWaalsContact O-N 3.08Å
86L55.8Low62.3Low107 Ų107127.5 Ų127.556%0.5665%0.654SS**THydrogen-bonded Turntrans-57.7-23.3-173.5-164.7124.1000114.2R89L86-R89 VanDerWaalsContact CG-CZ 3.41Å; L86-R89 WeakPolarHBondContact O-CG 3.36Å
87V58.7Low62.2Low118 Ų118126.8 Ų126.872%0.71566%0.656SS**THydrogen-bonded Turntrans-77.6-33.6-176.9178.70000111.7P85 R89P85-V87 PolarHBondContact O-N 3.17Å; V87-R89 VanDerWaalsContact C-N 3.27Å; V87-R89 PolarHBondContact O-N 3.48Å
88L59.3Low62.4Low90 Ų90122.7 Ų122.747%0.47165%0.65SS.*THydrogen-bonded Turntrans-77.4-11-179-170.760.3000113.3L84 P85L84-L88 HydrophobicContact CB-CD2 4.15Å; L84-L88 HydrophobicContact CD1-CD2 3.92Å; L84-L88 HydrophobicContact CD2-CD2 4.1Å; L84-L88 HydrophobicContact CG-CD2 4.26Å; P85-L88 HydrophobicContact CG-CB 4.44Å; P85-L88 PolarHBondContact O-N 3.37Å; P85-L88 VanDerWaalsContact O-N 3.08Å
89R55.9Low63.3Low163 Ų163126.5 Ų126.562%0.61566%0.664SS**THydrogen-bonded Turntrans-91.70.517854.7170.8162.4-141.3-25.9114.2L86 V87L86-R89 VanDerWaalsContact CG-CZ 3.41Å; L86-R89 WeakPolarHBondContact O-CG 3.36Å; V87-R89 VanDerWaalsContact C-N 3.27Å; V87-R89 PolarHBondContact O-N 3.48Å
90N61.9Low63.9Low112 Ų112128.3 Ų128.360%0.59967%0.666SS**  trans-104.32.3-176.6-68.3-15.6000113.6P92N90-P92 WeakPolarHBondContact O-CD 3.41Å
91D60.3Low64.6Low93 Ų93130.3 Ų130.350%0.49767%0.671SS.*  trans-71122.7171.1-64.8-36.5000108.7V93D91-V93 PolarHBondContact O-N 2.87Å; D91-V93 VanDerWaalsContact O-N 3.12Å
92P63.3Low65.6Low126 Ų126122.4 Ų122.482%0.81865%0.652SS**SBendtrans-69.4-9.7-175.327.8-34.8000113.1N90N90-P92 WeakPolarHBondContact O-CD 3.41Å
93V63.8Low66.4Low97 Ų97117.3 Ų117.359%0.58863%0.634SS**SBendtrans-102.1113.9170-177.40000106.6D91 T95D91-V93 PolarHBondContact O-N 2.87Å; D91-V93 VanDerWaalsContact O-N 3.12Å; V93-T95 PolarHBondContact O-N 3.08Å; V93-T95 PolarHBondContact O-OG1 2.76Å; V93-T95 VanDerWaalsContact O-OG1 3.1Å
94P58.2Low67.8Low87 Ų87112.6 Ų112.657%0.56562%0.618SS**  trans-63.682.3165.7-19.732.7000109.1D96 L97P94-D96 PolarHBondContact O-N 3.2Å; P94-D96 VanDerWaalsContact O-N 3.12Å; P94-L97 HydrophobicContact CB-CB 4.19Å; P94-L97 HydrophobicContact CB-CD1 3.44Å; P94-L97 VanDerWaalsContact CB-CD1 3.44Å; P94-L97 HydrophobicContact CB-CG 3.8Å; P94-L97 HydrophobicContact CG-CD1 4.04Å; P94-L97 PolarHBondContact O-N 3.33Å
95T60.6Low69Low107 Ų107113.5 Ų113.566%0.65662%0.617SS**THydrogen-bonded Turntrans-65.9-17.5-170.1-52.60000112.9V93V93-T95 PolarHBondContact O-N 3.08Å; V93-T95 PolarHBondContact O-OG1 2.76Å; V93-T95 VanDerWaalsContact O-OG1 3.1Å
96D64.1Low70.1Confident147 Ų147114.4 Ų114.479%0.78662%0.616SS**THydrogen-bonded Turntrans-12414.5-176.3-67.1-28.6000114.3P94 P98P94-D96 PolarHBondContact O-N 3.2Å; P94-D96 VanDerWaalsContact O-N 3.12Å; D96-P98 VanDerWaalsContact O-CD 3.31Å; D96-P98 WeakPolarHBondContact O-CD 3.37Å
97L67.4Low71.3Confident130 Ų130114.4 Ų114.468%0.68161%0.614SS**SBendtrans-72.5118.5167-79.2174.2000107.4P94 Q99P94-L97 HydrophobicContact CB-CB 4.19Å; P94-L97 HydrophobicContact CB-CD1 3.44Å; P94-L97 VanDerWaalsContact CB-CD1 3.44Å; P94-L97 HydrophobicContact CB-CG 3.8Å; P94-L97 HydrophobicContact CG-CD1 4.04Å; P94-L97 PolarHBondContact O-N 3.33Å; L97-Q99 PolarHBondContact O-N 3.14Å; L97-Q99 VanDerWaalsContact O-N 3.17Å
98P71.9Confident72.5Confident112 Ų112113.1 Ų113.173%0.72760%0.602SS**PPolyproline II helixtrans-56.2130.6172.425-32.7000107.5D96 Y100D96-P98 VanDerWaalsContact O-CD 3.31Å; D96-P98 WeakPolarHBondContact O-CD 3.37Å; P98-Y100 PolarHBondContact O-N 3.15Å
99Q79.3Confident73.3Confident176 Ų176114.4 Ų114.482%0.82261%0.609SS**PPolyproline II helixtrans-48.2118.4172176.664.618.400107.7L97 S101L97-Q99 PolarHBondContact O-N 3.14Å; L97-Q99 VanDerWaalsContact O-N 3.17Å; Q99-S101 PolarHBondContact O-N 3.22Å
100Y78.2Confident74.2Confident178 Ų178114.9 Ų114.970%0.69862%0.616SS**  trans-64.1106-180178.2-99.9000108.3P98 P102P98-Y100 PolarHBondContact O-N 3.15Å; Y100-P102 HydrophobicContact CE1-CB 3.92Å
101S81.8Confident74.9Confident101 Ų101115.9 Ų115.971%0.70662%0.615SS**  trans-99.8111.2169.6-1650000106.4Q99Q99-S101 PolarHBondContact O-N 3.22Å
102P86.3Confident75Confident80 Ų80117.5 Ų117.552%0.51962%0.619SS.*PPolyproline II helixtrans-60.4142.6178.126.4-32.7000109Y100 D104Y100-P102 HydrophobicContact CE1-CB 3.92Å; P102-D104 PolarHBondContact O-N 3.06Å
103P83.8Confident75Confident40 Ų40117.6 Ų117.626%0.2662%0.618SS.*PPolyproline II helixtrans-59.1134.5-179.724.9-34.1000110.5E107 L108P103-E107 WeakPolarHBondContact CA-OE2 3.43Å; P103-E107 HydrophobicContact CB-CB 4.34Å; P103-L108 HydrophobicContact CB-CD2 4.04Å; P103-L108 HydrophobicContact CB-CG 4.24Å; P103-L108 HydrophobicContact CG-CD2 3.71Å; P103-L108 HydrophobicContact CG-CG 4.22Å
104D88.9Confident74.6Confident95 Ų95117 Ų11751%0.50862%0.623SS.*PPolyproline II helixtrans-66.5157.2178.2179.235.7000110.9P102 L106 E107 L108P102-D104 PolarHBondContact O-N 3.06Å; D104-L106 PolarHBondContact O-N 3.43Å; D104-E107 HydrophobicContact CB-CG 4.16Å; D104-E107 PolarHBondContact N-OE2 2.99Å; D104-E107 WeakPolarHBondContact O-CA 3.36Å; D104-E107 WeakPolarHBondContact O-CB 3.34Å; D104-E107 PolarHBondContact O-N 3.27Å; D104-L108 PolarHBondContact O-N 3.17Å
105F86.3Confident74.7Confident141 Ų141116.5 Ų116.562%0.61862%0.621SS**Hα-helixtrans-55.7-38.2-179.2-179.1-102.8000112.3E107 L108 L109F105-E107 VanDerWaalsContact C-N 3.33Å; F105-E107 PolarHBondContact O-N 3.26Å; F105-L108 PolarHBondContact O-N 3.12Å; F105-L109 HydrophobicContact CD1-CD1 3.95Å; F105-L109 HydrophobicContact CE1-CD1 3.48Å; F105-L109 VanDerWaalsContact CE1-CD1 3.48Å; F105-L109 HydrophobicContact CE1-CG 4.18Å; F105-L109 HydrophobicContact CZ-CD1 4.03Å; F105-L109 HydrophobicContact CZ-CG 4.34Å; F105-L109 WeakPolarHBondContact O-CG 3.49Å; F105-L109 PolarHBondContact O-N 3.35Å
106L86.3Confident74.7Confident102 Ų102120.8 Ų120.853%0.53463%0.627SS.*Hα-helixtrans-69.3-31.4175.8-61.4-177.1000112.6D104 L109 K110D104-L106 PolarHBondContact O-N 3.43Å; L106-L109 HydrophobicContact CD2-CD1 4.38Å; L106-L109 PolarHBondContact O-N 3.37Å; L106-K110 VanDerWaalsContact O-CG 3.32Å; L106-K110 WeakPolarHBondContact O-CG 3.33Å; L106-K110 PolarHBondContact O-N 3.2Å; L106-K110 VanDerWaalsContact O-N 3.08Å
107E81.4Confident74.4Confident108 Ų108116.5 Ų116.551%0.50561%0.609SS.*Hα-helixtrans-72.7-35.5175.3-63.4-174.1159.700111.8P103 D104 F105 K110 K111P103-E107 WeakPolarHBondContact CA-OE2 3.43Å; P103-E107 HydrophobicContact CB-CB 4.34Å; D104-E107 HydrophobicContact CB-CG 4.16Å; D104-E107 PolarHBondContact N-OE2 2.99Å; D104-E107 WeakPolarHBondContact O-CA 3.36Å; D104-E107 WeakPolarHBondContact O-CB 3.34Å; D104-E107 PolarHBondContact O-N 3.27Å; F105-E107 VanDerWaalsContact C-N 3.33Å; F105-E107 PolarHBondContact O-N 3.26Å; E107-K110 PolarHBondContact O-N 3.23Å; E107-K111 WeakPolarHBondContact O-CB 3.47Å; E107-K111 WeakPolarHBondContact O-CG 3.14Å; E107-K111 PolarHBondContact O-N 3.5Å
108L83Confident74.1Confident91 Ų91117.5 Ų117.548%0.47661%0.607SS.*Hα-helixtrans-65.3-40.1172.2-68.4176.3000111.5P103 D104 F105 K110 K111P103-L108 HydrophobicContact CB-CD2 4.04Å; P103-L108 HydrophobicContact CB-CG 4.24Å; P103-L108 HydrophobicContact CG-CD2 3.71Å; P103-L108 HydrophobicContact CG-CG 4.22Å; D104-L108 PolarHBondContact O-N 3.17Å; F105-L108 PolarHBondContact O-N 3.12Å; L108-K110 VanDerWaalsContact C-N 3.31Å; L108-K110 PolarHBondContact O-N 3.4Å; L108-K111 HydrophobicContact CD2-CD 4.37Å; L108-K111 WeakPolarHBondContact O-CB 3.39Å; L108-K111 PolarHBondContact O-N 3.03Å
109L75.9Confident73.1Confident117 Ų117121.2 Ų121.261%0.61361%0.612SS**Hα-helixtrans-65.2-34174-76.2174.2000112.8F105 L106F105-L109 HydrophobicContact CD1-CD1 3.95Å; F105-L109 HydrophobicContact CE1-CD1 3.48Å; F105-L109 VanDerWaalsContact CE1-CD1 3.48Å; F105-L109 HydrophobicContact CE1-CG 4.18Å; F105-L109 HydrophobicContact CZ-CD1 4.03Å; F105-L109 HydrophobicContact CZ-CG 4.34Å; F105-L109 WeakPolarHBondContact O-CG 3.49Å; F105-L109 PolarHBondContact O-N 3.35Å; L106-L109 HydrophobicContact CD2-CD1 4.38Å; L106-L109 PolarHBondContact O-N 3.37Å
110K76.3Confident72.2Confident172 Ų172119 Ų11975%0.74861%0.606SS**Hα-helixtrans-76.8-22.9175.2-73.4173.2-178.1176.50113.2L106 E107 L108 Q112L106-K110 VanDerWaalsContact O-CG 3.32Å; L106-K110 WeakPolarHBondContact O-CG 3.33Å; L106-K110 PolarHBondContact O-N 3.2Å; L106-K110 VanDerWaalsContact O-N 3.08Å; E107-K110 PolarHBondContact O-N 3.23Å; L108-K110 VanDerWaalsContact C-N 3.31Å; L108-K110 PolarHBondContact O-N 3.4Å; K110-Q112 PolarHBondContact O-N 3.02Å
111K74.9Confident71.4Confident133 Ų133118.9 Ų118.958%0.57861%0.609SS**SBendtrans-72.877.2172.3-85.3171.7164.2172.40109.7E107 L108 T113E107-K111 WeakPolarHBondContact O-CB 3.47Å; E107-K111 WeakPolarHBondContact O-CG 3.14Å; E107-K111 PolarHBondContact O-N 3.5Å; L108-K111 HydrophobicContact CD2-CD 4.37Å; L108-K111 WeakPolarHBondContact O-CB 3.39Å; L108-K111 PolarHBondContact O-N 3.03Å; K111-T113 PolarHBondContact O-N 3.09Å
112Q64.3Low70.4Confident128 Ų128119.8 Ų119.860%0.59861%0.613SS**  trans-50.7121.8167.1-173.6-179-54.400109.9K110 A114 P126K110-Q112 PolarHBondContact O-N 3.02Å; Q112-A114 PolarHBondContact O-N 3.47Å; Q112-P126 HydrophobicContact CG-CB 3.55Å; Q112-P126 HydrophobicContact CG-CG 3.82Å
113T62.1Low69.3Low128 Ų128121 Ų12179%0.78561%0.607SS**  trans-70.790.6177.842.30000109.5K111 S115K111-T113 PolarHBondContact O-N 3.09Å; T113-S115 VanDerWaalsContact C-N 3.33Å; T113-S115 PolarHBondContact O-N 2.75Å
114A56.5Low68.5Low85 Ų85123.7 Ų123.770%0.70263%0.633SS**  trans-72.889.7172.900000109.5Q112 Y116Q112-A114 PolarHBondContact O-N 3.47Å; A114-Y116 PolarHBondContact O-N 3.38Å; A114-Y116 VanDerWaalsContact O-N 3.16Å
115S58.5Low67.2Low75 Ų75123.8 Ų123.852%0.52463%0.633SS.*  trans-68.7107.5161.8-690000107.7T113T113-S115 VanDerWaalsContact C-N 3.33Å; T113-S115 PolarHBondContact O-N 2.75Å
116Y61.4Low66.1Low198 Ų198120.2 Ų120.278%0.77662%0.624SS**  trans36.997.7163-171.2-102.1000116.3A114A114-Y116 PolarHBondContact O-N 3.38Å; A114-Y116 VanDerWaalsContact O-N 3.16Å
117S57.5Low64.8Low57 Ų57120.4 Ų120.440%0.39963%0.634SS.*  trans-104138.216960.10000112.2
118F60.8Low63.8Low150 Ų150116.5 Ų116.566%0.65862%0.617SS**  trans-68132.8169.3-169.7-105.8000109.2D120F118-D120 HydrophobicContact CD1-CB 4.05Å; F118-D120 HydrophobicContact CE1-CB 4.02Å; F118-D120 VanDerWaalsContact CE1-OD2 3.3Å; F118-D120 WeakPolarHBondContact CE1-OD2 2.98Å; F118-D120 PolarHBondContact O-N 3.5Å
119K51.5Low62.5Low191 Ų191116.2 Ų116.283%0.8362%0.616SS**THydrogen-bonded Turntrans-68.8-6.1-160.8-67.5-65.7-176.3-1770115.7
120D60Low61.5Low129 Ų129116.4 Ų116.469%0.6962%0.622SS**THydrogen-bonded Turntrans-86.1-25-172.7-72.9-11.7000113.7F118F118-D120 HydrophobicContact CD1-CB 4.05Å; F118-D120 HydrophobicContact CE1-CB 4.02Å; F118-D120 VanDerWaalsContact CE1-OD2 3.3Å; F118-D120 WeakPolarHBondContact CE1-OD2 2.98Å; F118-D120 PolarHBondContact O-N 3.5Å
121K61.2Low60.4Low175 Ų175115 Ų11576%0.76162%0.622SS**  trans-153.1135.3171.6-63.8-174.4-177.4170.50112.2
122P61.7Low59.5Low120 Ų120115 Ų11578%0.77962%0.623SS**  trans-65.5142168.428.6-32.5000110.2
123R63.1Low59.1Low106 Ų106112 Ų11240%0.461%0.611SS.*  trans-62.2144.9171.5-77.4-176.4170.9146.1-10.3109.9D133R123-D133 IonicContact CZ-OD2 3.73Å; R123-D133 IonicContact NH2-OD2 2.8Å; R123-D133 PolarHBondContact NH2-OD2 3.12Å
124A66.4Low58.9Low97 Ų97113.8 Ų113.880%0.80261%0.61SS**SBendtrans-67.7-44.3178.300000111.5
125D62.1Low59Low96 Ų96117.5 Ų117.551%0.51361%0.612SS.*  trans-126.7134.4178.8-66.7-39.4000111.2T128D125-T128 HydrophobicContact CB-CG2 4.18Å; D125-T128 PolarHBondContact O-OG1 3.42Å
126P62.3Low59.4Low67 Ų67120 Ų12044%0.43562%0.616SS.*THydrogen-bonded Turntrans-78.6-15.2177.628.6-35.8000115.9Q112Q112-P126 HydrophobicContact CG-CB 3.55Å; Q112-P126 HydrophobicContact CG-CG 3.82Å
127S60.7Low59.7Low106 Ų106112.8 Ų112.874%0.74160%0.602SS**THydrogen-bonded Turntrans-90-6-169.954.20000113.6L129S127-L129 VanDerWaalsContact C-N 3.34Å; S127-L129 PolarHBondContact O-N 2.99Å
128T59.1Low60.5Low25 Ų25113.5 Ų113.515%0.15361%0.605CS.*  trans-93.317.2-171.552.10000114.3D125 V130 K132D125-T128 HydrophobicContact CB-CG2 4.18Å; D125-T128 PolarHBondContact O-OG1 3.42Å; T128-V130 PolarHBondContact O-N 3.04Å; T128-K132 HydrophobicContact CG2-CD 4.3Å
129L56Low61.3Low86 Ų86107.5 Ų107.545%0.4559%0.586SS.*THydrogen-bonded Turntrans-57.6-18.6-166.5-166.1148.5000115.6S127S127-L129 VanDerWaalsContact C-N 3.34Å; S127-L129 PolarHBondContact O-N 2.99Å
130V56.3Low62.6Low121 Ų121105 Ų10573%0.73359%0.589SS**THydrogen-bonded Turntrans-120-20.5-161.8-170.20000115.4T128T128-V130 PolarHBondContact O-N 3.04Å
131D53.2Low63.2Low141 Ų141102 Ų10275%0.75459%0.588SS**THydrogen-bonded Turntrans-139.3-5-170.3-103.7-18.9000116.2
132K55.4Low64.1Low135 Ų13599.4 Ų99.459%0.58758%0.583SS**SBendtrans-117.1-5.8-175.3-68.9-175.3179.5178.40115T128 E134 H135T128-K132 HydrophobicContact CG2-CD 4.3Å; K132-E134 PolarHBondContact O-N 3.14Å; K132-E134 VanDerWaalsContact O-N 3.16Å; K132-H135 PolarHBondContact O-N 3.16Å
133D55.3Low65Low65 Ų65100.8 Ų100.835%0.34857%0.573SS.*G310 helixtrans-67.6-11.5175.6-73.211.3000111.7R123 H135 E136R123-D133 IonicContact CZ-OD2 3.73Å; R123-D133 IonicContact NH2-OD2 2.8Å; R123-D133 PolarHBondContact NH2-OD2 3.12Å; D133-H135 PolarHBondContact O-N 3.05Å; D133-E136 PolarHBondContact O-N 2.73Å
134E57.3Low65.8Low164 Ų164102.7 Ų102.777%0.76659%0.587SS**G310 helixtrans-61.8-22.3173.9-71.6-165.5158.800113.8K132K132-E134 PolarHBondContact O-N 3.14Å; K132-E134 VanDerWaalsContact O-N 3.16Å
135H59.6Low66.3Low164 Ų164105.6 Ų105.676%0.75959%0.588SS**G310 helixtrans-113.2-1-177.3-60.6-46.3000114.2K132 D133 G137K132-H135 PolarHBondContact O-N 3.16Å; D133-H135 PolarHBondContact O-N 3.05Å; H135-G137 VanDerWaalsContact C-N 3.3Å; H135-G137 PolarHBondContact O-N 3.2Å
136E66.6Low67.1Low127 Ų127108.1 Ų108.159%0.59359%0.594SS**SBendtrans-86.56.5-174.7-68.8-163.8171.600114.3D133D133-E136 PolarHBondContact O-N 2.73Å
137G67.9Low67.7Low47 Ų47109.4 Ų109.449%0.48561%0.611SS.*SBendtrans-131.1158.2177.900000112.8H135 G139H135-G137 VanDerWaalsContact C-N 3.3Å; H135-G137 PolarHBondContact O-N 3.2Å; G137-G139 PolarHBondContact O-N 2.81Å
138P74.8Confident68Low71 Ų71109.2 Ų109.246%0.46161%0.61SS.*  trans-53.7138.7164.626-33.7000108.9D142 Y143P138-D142 HydrophobicContact CB-CB 3.83Å; P138-Y143 HydrophobicContact CB-CD1 4.46Å; P138-Y143 HydrophobicContact CG-CD1 3.63Å; P138-Y143 HydrophobicContact CG-CE1 3.51Å; P138-Y143 HydrophobicContact CG-CG 4.49Å
139G77.8Confident68.4Low25 Ų25112.7 Ų112.726%0.25863%0.632SS.*  trans-57.2162177.300000111.5G137 G141 D142G137-G139 PolarHBondContact O-N 2.81Å; G139-G141 PolarHBondContact O-N 3.33Å; G139-D142 PolarHBondContact N-OD2 3.21Å; G139-D142 PolarHBondContact O-N 3.12Å
140P77.3Confident69Low139 Ų139119.5 Ų119.590%0.90366%0.658SS**THydrogen-bonded Turntrans-58.8102.8176.625.2-33.3000109.8
141G73.1Confident69.5Low65 Ų65116 Ų11667%0.6765%0.646SS**THydrogen-bonded Turntrans115.7-13.4-176.800000115.4G139 Y143G139-G141 PolarHBondContact O-N 3.33Å; G141-Y143 PolarHBondContact O-N 3.15Å
142D79.6Confident70.1Confident120 Ų120114 Ų11464%0.64264%0.644SS**  trans-87.916.1-178.7-64.2-34.4000113.3P138 G139 E144P138-D142 HydrophobicContact CB-CB 3.83Å; G139-D142 PolarHBondContact N-OD2 3.21Å; G139-D142 PolarHBondContact O-N 3.12Å; D142-E144 PolarHBondContact O-N 2.92Å
143Y81.1Confident70.5Confident149 Ų149115.7 Ų115.758%0.58466%0.657SS**  trans-72.8118.1177.6-59.1-77.9000110.1P138 G141 L145P138-Y143 HydrophobicContact CB-CD1 4.46Å; P138-Y143 HydrophobicContact CG-CD1 3.63Å; P138-Y143 HydrophobicContact CG-CE1 3.51Å; P138-Y143 HydrophobicContact CG-CG 4.49Å; G141-Y143 PolarHBondContact O-N 3.15Å; Y143-L145 PolarHBondContact O-N 2.87Å
144E80.6Confident71.1Confident147 Ų147115.8 Ų115.869%0.68766%0.661SS**  trans-69.195.6170.1-162.5-167.4164.700109.1D142 K146D142-E144 PolarHBondContact O-N 2.92Å; E144-K146 VanDerWaalsContact C-N 3.33Å; E144-K146 PolarHBondContact O-N 3.3Å; E144-K146 IonicContact OE1-NZ 3.67Å; E144-K146 PolarHBondContact OE1-NZ 2.82Å; E144-K146 WeakPolarHBondContact OE2-CE 3.48Å; E144-K146 IonicContact OE2-NZ 2.75Å; E144-K146 PolarHBondContact OE2-NZ 2.85Å
145L76.5Confident71.8Confident158 Ų158111.6 Ų111.683%0.82765%0.65SS**  trans-68.291.8174.7-62179.2000108.8Y143 A147Y143-L145 PolarHBondContact O-N 2.87Å; L145-A147 PolarHBondContact O-N 2.92Å; L145-A147 VanDerWaalsContact O-N 3.12Å
146K77.8Confident72.2Confident148 Ų148110.7 Ų110.764%0.64366%0.66SS**PPolyproline II helixtrans-53.6123.6169-60.9-66.6174.4-166.70107.2E144 S148E144-K146 VanDerWaalsContact C-N 3.33Å; E144-K146 PolarHBondContact O-N 3.3Å; E144-K146 IonicContact OE1-NZ 3.67Å; E144-K146 PolarHBondContact OE1-NZ 2.82Å; E144-K146 WeakPolarHBondContact OE2-CE 3.48Å; E144-K146 IonicContact OE2-NZ 2.75Å; E144-K146 PolarHBondContact OE2-NZ 2.85Å; K146-S148 PolarHBondContact O-N 3.11Å; K146-S148 VanDerWaalsContact O-N 3.15Å
147A74.9Confident72.3Confident95 Ų95113.1 Ų113.179%0.78567%0.669SS**PPolyproline II helixtrans-50.1126.817700000108.7L145L145-A147 PolarHBondContact O-N 2.92Å; L145-A147 VanDerWaalsContact O-N 3.12Å
148S68.4Low72.1Confident102 Ų102120 Ų12071%0.71368%0.68SS**PPolyproline II helixtrans-49.7127.4-178.4-175.20000108.7K146 K150K146-S148 PolarHBondContact O-N 3.11Å; K146-S148 VanDerWaalsContact O-N 3.15Å; S148-K150 PolarHBondContact O-N 2.91Å
149P67.8Low72.2Confident97 Ų97119.5 Ų119.563%0.6368%0.678SS**PPolyproline II helixtrans-50.9132.1178.517.8-28.5000108.2G151P149-G151 PolarHBondContact O-N 2.78Å
150K67.2Low71.9Confident229 Ų229128.3 Ų128.3100%0.99671%0.71SS**SBendtrans-6517-176.1-64.9-174.7179.9177.40114S148S148-K150 PolarHBondContact O-N 2.91Å
151G66.7Low71.8Confident47 Ų47127 Ų12749%0.48570%0.699SS.*SBendtrans-126.5130.5171.400000109.8P149 I153P149-G151 PolarHBondContact O-N 2.78Å; G151-I153 PolarHBondContact O-N 2.77Å
152S67.2Low71.8Confident100 Ų100129.1 Ų129.170%0.69970%0.701SS**  trans-55.3132.8166.568.50000108.4T154S152-T154 VanDerWaalsContact C-N 3.35Å; S152-T154 WeakPolarHBondContact O-CG2 3.3Å; S152-T154 PolarHBondContact O-N 3.29Å
153I64Low71.4Confident170 Ų170132.8 Ų132.887%0.87271%0.705SS**  trans-55.4102.8168.8-64.6166.5000107G151G151-I153 PolarHBondContact O-N 2.77Å
154T66.8Low71.2Confident68 Ų68133.4 Ų133.442%0.41771%0.712SS.*  trans-91.5129.6177.1610000108.2S152 R158S152-T154 VanDerWaalsContact C-N 3.35Å; S152-T154 WeakPolarHBondContact O-CG2 3.3Å; S152-T154 PolarHBondContact O-N 3.29Å; T154-R158 HydrophobicContact CG2-CG 4.48Å; T154-R158 WeakPolarHBondContact OG1-CD 2.93Å
155S72.6Confident70.8Confident76 Ų76133.8 Ų133.853%0.53172%0.717SS.*  trans-38.9141.4161.71640000111.1F157 R158S155-F157 CarbonylContact O-C 3.42Å; S155-F157 PolarHBondContact O-N 3.31Å; S155-F157 PolarHBondContact OG-N 2.9Å; S155-F157 PolarHBondContact OG-O 2.72Å; S155-R158 WeakPolarHBondContact O-CG 2.86Å; S155-R158 PolarHBondContact O-N 2.97Å
156C68.6Low70.5Confident145 Ų145131.4 Ų131.498%0.9871%0.711SS**SBendtrans-56-19.6170.748.60000112.4
157F66.7Low70Confident177 Ų177131.5 Ų131.578%0.77672%0.724SS**SBendtrans-97.380.5169-157.6-101.9000110.5S155 S159S155-F157 CarbonylContact O-C 3.42Å; S155-F157 PolarHBondContact O-N 3.31Å; S155-F157 PolarHBondContact OG-N 2.9Å; S155-F157 PolarHBondContact OG-O 2.72Å; F157-S159 PolarHBondContact O-N 3.38Å
158R65.2Low69.6Low191 Ų191131.6 Ų131.672%0.72172%0.719SS**  trans-78.3102.4172.2-67.7-179.170.6-172.91.1109.2T154 S155 K160T154-R158 HydrophobicContact CG2-CG 4.48Å; T154-R158 WeakPolarHBondContact OG1-CD 2.93Å; S155-R158 WeakPolarHBondContact O-CG 2.86Å; S155-R158 PolarHBondContact O-N 2.97Å; R158-K160 PolarHBondContact O-N 3.37Å
159S75.7Confident69.7Low61 Ų61130.7 Ų130.743%0.42771%0.713SS.*  trans-62.3123.3167.859.80000109.1F157 V161F157-S159 PolarHBondContact O-N 3.38Å; S159-V161 PolarHBondContact O-N 3.08Å; S159-V161 VanDerWaalsContact O-N 3.15Å
160K72.2Confident69.8Low211 Ų211136.1 Ų136.192%0.91773%0.726SS**SBendtrans-67.6-5.3171.5-67.7-176.2179.8177.10113R158 P162R158-K160 PolarHBondContact O-N 3.37Å; K160-P162 WeakPolarHBondContact O-CD 3.49Å
161V75.1Confident70.2Confident111 Ų111129.6 Ų129.667%0.67371%0.706SS**SBendtrans-81.3118179.1-177.10000109.2S159 R163S159-V161 PolarHBondContact O-N 3.08Å; S159-V161 VanDerWaalsContact O-N 3.15Å; V161-R163 PolarHBondContact O-N 2.98Å
162P72.7Confident70.9Confident109 Ų109130.3 Ų130.371%0.70870%0.702SS**  trans-66117.5174.826.7-31.7000109.2K160 F164K160-P162 WeakPolarHBondContact O-CD 3.49Å; P162-F164 VanDerWaalsContact C-N 3.31Å
163R72.4Confident71.6Confident197 Ų197127.4 Ų127.474%0.74369%0.688SS**SBendtrans-73.1-27.3-178.3-160.3-177.4-63.6121.9-1112.5V161V161-R163 PolarHBondContact O-N 2.98Å
164F76.6Confident72.3Confident163 Ų163126 Ų12672%0.71569%0.69SS**SBendtrans-124.1135.4179.9-59.1-63.9000109.5P162P162-F164 VanDerWaalsContact C-N 3.31Å
165L71.6Confident72.7Confident154 Ų154126.4 Ų126.481%0.80671%0.707SS**  trans-64.4144.2170.3-62.6175.9000108.8V167L165-V167 PolarHBondContact O-N 3.42Å
166P70.9Confident73.1Confident108 Ų108125.8 Ų125.870%0.70171%0.707SS**  trans-55.4128.317223.8-32.2000108.4S168P166-S168 VanDerWaalsContact C-N 3.27Å; P166-S168 PolarHBondContact O-N 3.41Å; P166-S168 PolarHBondContact O-OG 3Å
167V67.1Low73.7Confident151 Ų151126.2 Ų126.292%0.91569%0.689SS**  trans-62.692.3179-179.70000107.7L165L165-V167 PolarHBondContact O-N 3.42Å
168S67.1Low74.1Confident96 Ų96124.3 Ų124.367%0.67169%0.692SS**  trans-119.688.2172.652.40000107P166 K170P166-S168 VanDerWaalsContact C-N 3.27Å; P166-S168 PolarHBondContact O-N 3.41Å; P166-S168 PolarHBondContact O-OG 3Å; S168-K170 PolarHBondContact O-N 3.23Å; S168-K170 VanDerWaalsContact O-N 3.17Å
169S69.6Low74.1Confident83 Ų83120.4 Ų120.458%0.5869%0.694SS**  trans-70.9106.4172.6173.30000108.1T171S169-T171 PolarHBondContact O-N 2.8Å; S169-T171 PolarHBondContact OG-N 3.16Å; S169-T171 PolarHBondContact OG-O 3.12Å; S169-T171 PolarHBondContact OG-OG1 3.45Å
170K70.1Confident73.7Confident212 Ų212122.5 Ų122.592%0.92271%0.709SS**  trans-67.6-14.3165.8-71.2178.7178.1178.80112S168S168-K170 PolarHBondContact O-N 3.23Å; S168-K170 VanDerWaalsContact O-N 3.17Å
171T76.4Confident73.3Confident92 Ų92122.7 Ų122.756%0.56470%0.704SS**SBendtrans-75.8120.8172.722.20000109.4S169S169-T171 PolarHBondContact O-N 2.8Å; S169-T171 PolarHBondContact OG-N 3.16Å; S169-T171 PolarHBondContact OG-O 3.12Å; S169-T171 PolarHBondContact OG-OG1 3.45Å
172P81.1Confident72.7Confident62 Ų62124.6 Ų124.640%0.40371%0.705SS.*PPolyproline II helixtrans-61.2143.7174.627.7-33.5000109.1A176 Y177P172-A176 HydrophobicContact CB-CB 3.78Å; P172-Y177 HydrophobicContact CG-CD1 4.21Å; P172-Y177 HydrophobicContact CG-CE1 3.56Å; P172-Y177 HydrophobicContact CG-CE2 4.11Å
173G80.4Confident72.2Confident39 Ų39126.5 Ų126.540%0.40270%0.702SS.*PPolyproline II helixtrans-60.5162.3-178.100000112.4G175 A176G173-G175 PolarHBondContact O-N 3.32Å; G173-A176 WeakPolarHBondContact O-CB 3.31Å; G173-A176 PolarHBondContact O-N 3.16Å
174P78.8Confident72Confident140 Ų140123 Ų12391%0.90971%0.705SS**THydrogen-bonded Turntrans-53.6129.2172.324.6-33.3000109.8
175G75.8Confident71.5Confident76 Ų76122.5 Ų122.578%0.78470%0.703SS**THydrogen-bonded Turntrans89.1-3.5-176.500000116.5G173G173-G175 PolarHBondContact O-N 3.32Å
176A81.8Confident71.6Confident64 Ų64118.3 Ų118.353%0.52968%0.679SS.*  trans-89.31.1177.100000114.2P172 G173P172-A176 HydrophobicContact CB-CB 3.78Å; G173-A176 WeakPolarHBondContact O-CB 3.31Å; G173-A176 PolarHBondContact O-N 3.16Å
177Y80Confident72Confident153 Ų153115.8 Ų115.860%0.666%0.664SS**SBendtrans-83.1133.4173.1-60.2-85.2000109.9P172P172-Y177 HydrophobicContact CG-CD1 4.21Å; P172-Y177 HydrophobicContact CG-CE1 3.56Å; P172-Y177 HydrophobicContact CG-CE2 4.11Å
178T76.1Confident72.6Confident138 Ų138112.7 Ų112.785%0.84765%0.649SS**PPolyproline II helixtrans-81.9130.217253.90000109.3S180T178-S180 PolarHBondContact O-N 2.92Å
179S65.3Low73.3Confident109 Ų109113 Ų11376%0.76265%0.647SS**PPolyproline II helixtrans-69.7120177.851.90000109.9R181S179-R181 PolarHBondContact O-N 3.43Å
180S65.8Low73.6Confident104 Ų104112.5 Ų112.573%0.72764%0.637SS**PPolyproline II helixtrans-65.4127.7175.868.60000109.5T178 Q182T178-S180 PolarHBondContact O-N 2.92Å; S180-Q182 PolarHBondContact O-N 2.93Å
181R64.8Low74.1Confident216 Ų216104 Ų10482%0.81561%0.607SS**  trans-71.295.2174.8-75.7-172.5177.6-141.3-1.8108.5S179 F183S179-R181 PolarHBondContact O-N 3.43Å; R181-F183 HydrophobicContact CB-CE2 4.49Å
182Q63.1Low74.3Confident151 Ų151106 Ų10671%0.70661%0.607SS**  trans-76.6127.1178.6-161.2169-21.300110.3S180S180-Q182 PolarHBondContact O-N 2.93Å
183F61.9Low74.4Confident148 Ų148107.2 Ų107.265%0.64961%0.609SS**SBendtrans-105.5146.8166.5-71.2-88.4000108R181R181-F183 HydrophobicContact CB-CE2 4.49Å
184P66.7Low74.6Confident123 Ų123105.5 Ų105.580%0.79959%0.591SS**SBendcis-87.7143.79.832.6-33.5000113.8Q186P184-Q186 PolarHBondContact O-N 3.44Å
185K67.3Low74.7Confident154 Ų154106.8 Ų106.867%0.6758%0.577SS**PPolyproline II helixtrans-65.5132.7168.1-71.8176.8178.6179.10108.8S187K185-S187 PolarHBondContact O-N 3.1Å
186Q73.4Confident75.2Confident65 Ų65110.4 Ų110.430%0.30457%0.574SS.*PPolyproline II helixtrans-52.8130.9173.6-175.4176.3-3100110P184 I190 N203P184-Q186 PolarHBondContact O-N 3.44Å; Q186-I190 HydrophobicContact CG-CB 3.99Å; Q186-I190 HydrophobicContact CG-CG2 3.9Å; Q186-N203 PolarHBondContact OE1-ND2 3.12Å
187S79.9Confident75.3Confident56 Ų56113.3 Ų113.339%0.39258%0.577SS.*PPolyproline II helixtrans-64.9148.1-179.272.60000110.6K185 T189 I190 A191K185-S187 PolarHBondContact O-N 3.1Å; S187-T189 PolarHBondContact O-N 3.25Å; S187-I190 PolarHBondContact O-N 3.17Å; S187-I190 VanDerWaalsContact O-N 3.09Å; S187-I190 WeakPolarHBondContact OG-CD1 3.43Å; S187-I190 WeakPolarHBondContact OG-CG1 3.35Å; S187-A191 PolarHBondContact O-N 2.75Å
188S78.4Confident75.3Confident85 Ų85110.2 Ų110.259%0.59458%0.577SS**Hα-helixtrans-59.4-31.6-177.560.20000112.5A191 K192S188-A191 PolarHBondContact O-N 3.31Å; S188-K192 WeakPolarHBondContact O-CB 3.49Å; S188-K192 WeakPolarHBondContact O-CG 3.5Å; S188-K192 PolarHBondContact O-N 2.92Å
189T82.7Confident75.5Confident104 Ų104108.1 Ų108.164%0.63856%0.56SS**Hα-helixtrans-61.9-48.1174.8-49.20000111.6S187 A191 K192 M193S187-T189 PolarHBondContact O-N 3.25Å; T189-A191 VanDerWaalsContact C-N 3.34Å; T189-K192 PolarHBondContact O-N 3.01Å; T189-M193 WeakPolarHBondContact O-CB 3.43Å; T189-M193 PolarHBondContact O-N 2.9Å
190I76.8Confident76Confident72 Ų72110.1 Ų110.137%0.36956%0.556SS.*Hα-helixtrans-68.4-37.3179-61.3170.4000110.1Q186 S187 G194 F201Q186-I190 HydrophobicContact CG-CB 3.99Å; Q186-I190 HydrophobicContact CG-CG2 3.9Å; S187-I190 PolarHBondContact O-N 3.17Å; S187-I190 VanDerWaalsContact O-N 3.09Å; S187-I190 WeakPolarHBondContact OG-CD1 3.43Å; S187-I190 WeakPolarHBondContact OG-CG1 3.35Å; I190-G194 PolarHBondContact O-N 2.84Å; I190-F201 HydrophobicContact CG2-CD2 4.3Å; I190-F201 HydrophobicContact CG2-CE2 4.09Å
191A78.9Confident76.1Confident34 Ų34110.3 Ų110.328%0.28154%0.543SS..Hα-helixtrans-67.7-31.3176.300000113.8S187 S188 T189 R195S187-A191 PolarHBondContact O-N 2.75Å; S188-A191 PolarHBondContact O-N 3.31Å; T189-A191 VanDerWaalsContact C-N 3.34Å; A191-R195 PolarHBondContact O-N 3.24Å
192K81.1Confident76.2Confident133 Ų133106.9 Ų106.958%0.57854%0.541SS*.Hα-helixtrans-71.2-51.2172.5-77.5177.7178.6-177.10110.7S188 T189 G194 R195 E196S188-K192 WeakPolarHBondContact O-CB 3.49Å; S188-K192 WeakPolarHBondContact O-CG 3.5Å; S188-K192 PolarHBondContact O-N 2.92Å; T189-K192 PolarHBondContact O-N 3.01Å; K192-G194 PolarHBondContact O-N 3.08Å; K192-R195 PolarHBondContact O-N 3.5Å; K192-E196 WeakPolarHBondContact O-CG 3.5Å; K192-E196 PolarHBondContact O-N 3.35Å
193M83.8Confident76.1Confident88 Ų88104.8 Ų104.843%0.43354%0.535SS..Hα-helixtrans-55.7-39.5177.7-172.9-108.2-8000111.9T189 H197T189-M193 WeakPolarHBondContact O-CB 3.43Å; T189-M193 PolarHBondContact O-N 2.9Å; M193-H197 PolarHBondContact O-CD2 3.46Å; M193-H197 VanDerWaalsContact O-CD2 3.26Å; M193-H197 PolarHBondContact O-N 2.94Å
194G83.7Confident75.7Confident2 Ų2103.3 Ų103.32%0.02154%0.538CS..Hα-helixtrans-62.2-41.917300000114.3I190 K192 S198 L199I190-G194 PolarHBondContact O-N 2.84Å; K192-G194 PolarHBondContact O-N 3.08Å; G194-S198 CarbonylContact O-C 3.38Å; G194-S198 VanDerWaalsContact O-CA 3.3Å; G194-S198 WeakPolarHBondContact O-CA 3.32Å; G194-S198 PolarHBondContact O-N 3.34Å; G194-L199 CarbonylContact C-O 3.41Å; G194-L199 WeakPolarHBondContact CA-O 3.38Å; G194-L199 PolarHBondContact O-N 3.02Å
195R81.6Confident74.9Confident167 Ų167104.6 Ų104.663%0.6354%0.537SS*.Hα-helixtrans-68.4-43.3176.7-83.9-174.1-81.9177.3-7.6112.6A191 K192 H197 S198 F200A191-R195 PolarHBondContact O-N 3.24Å; K192-R195 PolarHBondContact O-N 3.5Å; R195-H197 VanDerWaalsContact C-N 3.29Å; R195-H197 PolarHBondContact O-N 2.93Å; R195-S198 PolarHBondContact O-N 3.37Å; R195-F200 HydrophobicContact CG-CE1 4.35Å
196E85.5Confident74Confident153 Ų153100 Ų10072%0.71553%0.534SS*.Hα-helixtrans-61.3-39.4178.3-64.2-57.814800111.7K192K192-E196 WeakPolarHBondContact O-CG 3.5Å; K192-E196 PolarHBondContact O-N 3.35Å
197H85.6Confident72.8Confident125 Ų125109.2 Ų109.258%0.57957%0.573SS**THydrogen-bonded Turntrans-100.611.3-178.3-58.1-50.1000114M193 R195 L199M193-H197 PolarHBondContact O-CD2 3.46Å; M193-H197 VanDerWaalsContact O-CD2 3.26Å; M193-H197 PolarHBondContact O-N 2.94Å; R195-H197 VanDerWaalsContact C-N 3.29Å; R195-H197 PolarHBondContact O-N 2.93Å; H197-L199 HydrophobicContact CB-CD1 4.15Å; H197-L199 HydrophobicContact CB-CG 4.09Å; H197-L199 PolarHBondContact O-N 3.21Å; H197-L199 VanDerWaalsContact O-N 3.09Å
198S79.8Confident72.5Confident88 Ų88111.9 Ų111.962%0.61558%0.582SS**THydrogen-bonded Turntrans52.527.3-175.3-56.10000114.5G194 R195G194-S198 CarbonylContact O-C 3.38Å; G194-S198 VanDerWaalsContact O-CA 3.3Å; G194-S198 WeakPolarHBondContact O-CA 3.32Å; G194-S198 PolarHBondContact O-N 3.34Å; R195-S198 PolarHBondContact O-N 3.37Å
199L79.8Confident72.1Confident93 Ų93113.3 Ų113.349%0.48758%0.581SS.*  trans-92.896.3173.9-60.6176.1000109.3G194 H197G194-L199 CarbonylContact C-O 3.41Å; G194-L199 WeakPolarHBondContact CA-O 3.38Å; G194-L199 PolarHBondContact O-N 3.02Å; H197-L199 HydrophobicContact CB-CD1 4.15Å; H197-L199 HydrophobicContact CB-CG 4.09Å; H197-L199 PolarHBondContact O-N 3.21Å; H197-L199 VanDerWaalsContact O-N 3.09Å
200F75Confident71.6Confident152 Ų152113.8 Ų113.867%0.66758%0.578SS**  trans-91.9111.4175.9-59.7-79.2000110R195R195-F200 HydrophobicContact CG-CE1 4.35Å
201F69Low71.3Confident107 Ų107116.3 Ų116.347%0.46959%0.591SS.*  trans-82.4117.2171-60.6-77.7000109I190 N203I190-F201 HydrophobicContact CG2-CD2 4.3Å; I190-F201 HydrophobicContact CG2-CE2 4.09Å; F201-N203 PolarHBondContact O-N 3.37Å
202N65.7Low70.8Confident145 Ų145121.4 Ų121.478%0.77561%0.61SS**  trans-7472.6171.9-69.8-53.4000109.9T204N202-T204 PolarHBondContact O-N 2.92Å
203N61.6Low70.1Confident107 Ų107120.7 Ų120.757%0.57261%0.612SS**  trans-81.820.4171.7-78.1-53.9000113Q186 F201Q186-N203 PolarHBondContact OE1-ND2 3.12Å; F201-N203 PolarHBondContact O-N 3.37Å
204T54.3Low69.1Low116 Ų116123 Ų12371%0.71263%0.625SS**  trans-136.798174.713.10000106.3N202 G206N202-T204 PolarHBondContact O-N 2.92Å; T204-G206 PolarHBondContact O-N 3.5Å
205I49.9Very low68Low151 Ų151132.3 Ų132.377%0.77467%0.671SS**  trans-69.394.5156.4-73.4160.2000104.6F207I205-F207 HydrophobicContact CG2-CD2 4.46Å; I205-F207 HydrophobicContact CG2-CE2 4.23Å
206G47.9Very low66.9Low58 Ų58129.4 Ų129.460%0.59868%0.675SS**  trans-70.7131.4169.300000109.3T204T204-G206 PolarHBondContact O-N 3.5Å
207F48.3Very low65.2Low258 Ų258127.3 Ų127.3100%1.13267%0.671SS**  trans-119.80137.5-71.2-73000106.8I205I205-F207 HydrophobicContact CG2-CD2 4.46Å; I205-F207 HydrophobicContact CG2-CE2 4.23Å

Retrieved 207 of 207 residues in 108.6 ms (Link to these results)