A0A061INU4_CRIGR Loading...

Small ribosomal subunit protein bS18m

AlphaFold DB , UniProt , Accession A0A061INU4, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Mrps18c, Length 141 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
1M38Very low36.6Very low246 Ų246127.8 Ų127.8100%1.21283%0.834SS**  01330-88.7-173164.600108.9
2A36.2Very low36.3Very low105 Ų105122.3 Ų122.387%0.86882%0.817SS**  trans65.1103.816300000119.2
3A35.6Very low36.5Very low91 Ų91131.5 Ų131.575%0.75282%0.824SS**  trans-75.2157.3149.100000111.2
4L37.8Very low36.4Very low167 Ų167136.3 Ų136.387%0.87483%0.827SS**  trans166.7144.5146-90.5144.1000108.3
5V33.2Very low36Very low119 Ų119134.7 Ų134.772%0.72182%0.824SS**  cis-165.7151.1-27.9129.20000105.4
6T39.7Very low36Very low122 Ų122137.1 Ų137.175%0.74883%0.829SS**  trans-53.8163.2177.6-250000114.6
7V34.7Very low36Very low123 Ų123136.7 Ų136.775%0.74583%0.828SS**  179.2114.5113.7167.70000110.5A9V7-A9 HydrophobicContact CG1-CB 3.86Å
8C37.8Very low36.3Very low135 Ų135135.9 Ų135.991%0.91283%0.826SS**  trans-97.1130147.2-79.50000106.8
9A35.9Very low36.3Very low83 Ų83134.1 Ų134.169%0.68683%0.826SS**  trans-129.8109.8176.100000110.7V7V7-A9 HydrophobicContact CG1-CB 3.86Å
10G34.4Very low36.4Very low82 Ų82132 Ų13285%0.84582%0.823SS**  trans-72.7138.216400000110.8
11V39.3Very low36.2Very low133 Ų133132 Ų13281%0.80682%0.822SS**  trans-98.393.8177.5178.10000108.9
12G32.6Very low35.9Very low61 Ų61126.2 Ų126.263%0.62980%0.804SS**PPolyproline II helixtrans-79.2124.6158.900000109.8
13R39.3Very low35.9Very low243 Ų243128.7 Ų128.792%0.91780%0.802SS**PPolyproline II helixtrans-85.7118.2172.4-75.9-178.5176.4174.1-1.2109.4
14K35.4Very low36.3Very low198 Ų198128.9 Ų128.986%0.86180%0.804SS**PPolyproline II helixtrans-78.8134.4-176.7-58.1169.3-178179.40109.8
15S30.8Very low36.3Very low112 Ų112128.7 Ų128.778%0.78380%0.804SS**PPolyproline II helixtrans-70.1127.9166.750.60000110
16L35.3Very low36.8Very low174 Ų174135 Ų13591%0.91182%0.815SS**PPolyproline II helixtrans-84.8118.6173.1-72.7153.8000109.1
17T36Very low36.9Very low130 Ų130133 Ų13380%0.79882%0.818SS**PPolyproline II helixtrans-92.5129.5163.143.70000108.7
18P42.1Very low37.6Very low123 Ų123131.8 Ų131.880%0.79982%0.821SS**PPolyproline II helixtrans-90.2124.3164.322.9-11.3000109.6A20P18-A20 PolarHBondContact O-N 2.82Å
19A36.2Very low37.7Very low100 Ų100133.5 Ų133.583%0.82682%0.815SS**PPolyproline II helixtrans-68.2119.7164.100000108.7
20A37Very low38.1Very low93 Ų93135.6 Ų135.677%0.76982%0.82SS**PPolyproline II helixtrans-84.2119174.100000109.4P18P18-A20 PolarHBondContact O-N 2.82Å
21V33.5Very low38.8Very low131 Ų131136.3 Ų136.379%0.79481%0.808SS**  trans-80.4115.1169.2-179.80000107.4L23V21-L23 PolarHBondContact O-N 2.94Å
22C32.2Very low39.2Very low125 Ų125137.2 Ų137.285%0.84581%0.807SS**  trans-83.4106.8173.9-61.90000109.4
23L36.2Very low39.7Very low157 Ų157145.1 Ų145.182%0.82282%0.818SS**  trans-90.3124.2160.1-81.5161.1000108.2V21V21-L23 PolarHBondContact O-N 2.94Å
24A42.8Very low40.4Very low96 Ų96144.8 Ų144.879%0.79382%0.817SS**  trans-87.8125.4172.500000109
25D38.7Very low41.3Very low163 Ų163145.8 Ų145.887%0.87282%0.815SS**  trans-129.9134.9161.5-93.9-48.8000111.3
26R43.1Very low42.3Very low252 Ų252144.1 Ų144.195%0.95182%0.816SS**  trans-83.5140.7179.6-69.9174.7-179.2-169.3-0.9109.8
27G42.5Very low43.1Very low80 Ų80140.9 Ų140.983%0.82581%0.806SS**  trans158.4116.8160.800000113.3
28A47.6Very low43.9Very low97 Ų97140 Ų14080%0.80281%0.805SS**  trans-75.6152.5-166.500000115.6
29H40.4Very low44.6Very low170 Ų170142.5 Ų142.579%0.78781%0.807SS**  -170.195.1111.2-131.7-103.5000109.1V31H29-V31 PolarHBondContact O-N 2.88Å
30T45.2Very low45.5Very low128 Ų128146.1 Ų146.179%0.78580%0.8SS**  trans-77.591.3170.344.10000108.4L32T30-L32 VanDerWaalsContact C-N 3.25Å; T30-L32 PolarHBondContact O-N 3.09Å
31V49Very low46.3Very low97 Ų97149.9 Ų149.959%0.58880%0.799SS**  trans-72.290.7164.9-171.30000106.9H29 W33H29-V31 PolarHBondContact O-N 2.88Å; V31-W33 HydrophobicContact CG1-CG 4.45Å; V31-W33 PolarHBondContact O-N 2.8Å
32L46.8Very low47.5Very low152 Ų152151.3 Ų151.380%0.79680%0.797SS**  trans-66.483.4168.8-100.8152.6000108T30 R34T30-L32 VanDerWaalsContact C-N 3.25Å; T30-L32 PolarHBondContact O-N 3.09Å; L32-R34 PolarHBondContact O-N 2.81Å
33W44.7Very low48.5Very low226 Ų226151.1 Ų151.186%0.85679%0.792SS**  trans-62.989.3161.1-8392.4000107.5V31 R35V31-W33 HydrophobicContact CG1-CG 4.45Å; V31-W33 PolarHBondContact O-N 2.8Å; W33-R35 PolarHBondContact O-N 3.46Å
34R53.1Low49.6Very low236 Ų236147.8 Ų147.889%0.89179%0.787SS**  trans-72.775.9170.9-157.8-162.2-77.3-108.49.3107.5L32 G36L32-R34 PolarHBondContact O-N 2.81Å; R34-G36 PolarHBondContact O-N 3.04Å; R34-G36 VanDerWaalsContact O-N 3.07Å
35R55.1Low50.6Low219 Ų219146.4 Ų146.483%0.82677%0.772SS**  trans-76.693.4172.3-153.3175.3-163.3177.94106.9W33 C37W33-R35 PolarHBondContact O-N 3.46Å; R35-C37 PolarHBondContact O-N 3.07Å
36G51.6Low52Low77 Ų77144.6 Ų144.679%0.79476%0.762SS**  trans-63.687.917000000109.5R34 S38R34-G36 PolarHBondContact O-N 3.04Å; R34-G36 VanDerWaalsContact O-N 3.07Å; G36-S38 PolarHBondContact O-N 3.24Å
37C52Low53.6Low106 Ų106140.2 Ų140.272%0.71675%0.752SS**  trans-72.8106.3160.2-84.90000106.7R35 Q39R35-C37 PolarHBondContact O-N 3.07Å; C37-Q39 PolarHBondContact O-N 2.85Å; C37-Q39 VanDerWaalsContact O-N 3.07Å
38S52.8Low55.7Low111 Ų111143.5 Ų143.578%0.77675%0.751SS**  trans-44.2116.3158.1173.60000107.6G36 Y40G36-S38 PolarHBondContact O-N 3.24Å; S38-Y40 PolarHBondContact O-N 3.07Å
39Q56.5Low57.7Low177 Ų177144.3 Ų144.383%0.82774%0.741SS**  trans-71.671.8172.6-74.2-175.213.200108.3C37 K41C37-Q39 PolarHBondContact O-N 2.85Å; C37-Q39 VanDerWaalsContact O-N 3.07Å; Q39-K41 VanDerWaalsContact C-N 3.3Å; Q39-K41 PolarHBondContact O-N 3.04Å; Q39-K41 VanDerWaalsContact O-N 3.09Å
40Y54Low60Low175 Ų175142 Ų14269%0.68674%0.741SS**  trans-67.2102.6150.8176.7-102000105.7S38 Q42S38-Y40 PolarHBondContact O-N 3.07Å; Y40-Q42 VanDerWaalsContact C-N 3.31Å; Y40-Q42 HydrophobicContact CD1-CG 4.04Å; Y40-Q42 HydrophobicContact CE1-CG 4.18Å; Y40-Q42 PolarHBondContact O-N 3.24Å
41K54.5Low62.2Low172 Ų172141.9 Ų141.975%0.74873%0.734SS**  trans-58.899.6169-94.3176.5174.8173.40107Q39 V43Q39-K41 VanDerWaalsContact C-N 3.3Å; Q39-K41 PolarHBondContact O-N 3.04Å; Q39-K41 VanDerWaalsContact O-N 3.09Å; K41-V43 VanDerWaalsContact C-N 3.3Å; K41-V43 PolarHBondContact O-N 2.83Å
42Q59.3Low64.3Low162 Ų162143.5 Ų143.576%0.75775%0.747SS**  trans-60.799.7160.6-69.3-95.2-14.100105.7Y40 A44Y40-Q42 VanDerWaalsContact C-N 3.31Å; Y40-Q42 HydrophobicContact CD1-CG 4.04Å; Y40-Q42 HydrophobicContact CE1-CG 4.18Å; Y40-Q42 PolarHBondContact O-N 3.24Å; Q42-A44 VanDerWaalsContact C-N 3.27Å; Q42-A44 PolarHBondContact O-N 2.81Å
43V52.6Low66.5Low120 Ų120142.3 Ų142.373%0.72774%0.739SS**  trans-69.798.4163.1-175.30000103.9K41 S45K41-V43 VanDerWaalsContact C-N 3.3Å; K41-V43 PolarHBondContact O-N 2.83Å; V43-S45 PolarHBondContact O-N 3.16Å
44A59.8Low68.8Low87 Ų87139.9 Ų139.972%0.71974%0.737SS**  trans-66.586.6170.900000107.1Q42 N46Q42-A44 VanDerWaalsContact C-N 3.27Å; Q42-A44 PolarHBondContact O-N 2.81Å; A44-N46 PolarHBondContact O-N 3.46Å
45S62.8Low70.8Confident68 Ų68133.5 Ų133.548%0.47672%0.721SS.*  trans-57.4132.7162.1420000107V43 E47V43-S45 PolarHBondContact O-N 3.16Å; S45-E47 PolarHBondContact O-N 3.34Å
46N68.3Low72.7Confident125 Ų125127.5 Ų127.567%0.66871%0.71SS**G310 helixtrans-64.67.6-172-66-74.6000114.7A44 L49A44-N46 PolarHBondContact O-N 3.46Å; N46-L49 HydrophobicContact CB-CD1 4.43Å
47E77.9Confident74.9Confident159 Ų159133.5 Ų133.574%0.74371%0.71SS**G310 helixtrans-89-20.1-168-46.6-50132.200113.8S45S45-E47 PolarHBondContact O-N 3.34Å
48D85.9Confident77Confident150 Ų150135.9 Ų135.980%0.80271%0.708SS**G310 helixtrans-98.415-179.5-65.8-48.5000113.2
49L88.9Confident79Confident113 Ų113138 Ų13859%0.59271%0.706SS**SBendtrans-71.8141.5177.8-69173.4000110.6N46 I51N46-L49 HydrophobicContact CB-CD1 4.43Å; L49-I51 PolarHBondContact O-N 2.91Å
50P90.3Very high80.8Confident121 Ų121135.1 Ų135.179%0.78670%0.702SS**PPolyproline II helixtrans-64.3125177.426.3-33.1000110.2
51I90.9Very high82.7Confident126 Ų126134 Ų13465%0.64671%0.707SS**PPolyproline II helixtrans-78.6132175.4-55.8170000108.4L49 M53L49-I51 PolarHBondContact O-N 2.91Å; I51-M53 HydrophobicContact CB-CE 4.27Å; I51-M53 PolarHBondContact O-N 3.42Å
52P92.9Very high84.6Confident132 Ų132135.3 Ų135.386%0.85771%0.713SS**  trans-67.8105.5170.927.9-32.4000109.6
53M92.1Very high86.3Confident126 Ų126134.8 Ų134.862%0.62171%0.709SS**  trans-131.1156.4176.461174.959.700110.6I51I51-M53 HydrophobicContact CB-CE 4.27Å; I51-M53 PolarHBondContact O-N 3.42Å
54E93.4Very high88.3Confident175 Ų175130 Ų13082%0.81868%0.68SS**  trans-61.6145.5167.6-64.278.6-169.600110.4P56E54-P56 WeakPolarHBondContact O-CD 3.12Å
55N95.2Very high89.9Confident102 Ų102131.2 Ų131.255%0.54567%0.673SS.*  trans-60.4111.2-178.5180-4.4000111.2Y57 K58N55-Y57 VanDerWaalsContact C-N 3.28Å; N55-Y57 PolarHBondContact O-N 2.85Å; N55-Y57 WeakPolarHBondContact OD1-CA 3.28Å; N55-Y57 PolarHBondContact OD1-N 2.94Å; N55-K58 HydrophobicContact CB-CB 4.21Å; N55-K58 VanDerWaalsContact O-CB 3.28Å; N55-K58 WeakPolarHBondContact O-CB 3.47Å; N55-K58 PolarHBondContact O-N 2.65Å; N55-K58 PolarHBondContact OD1-N 3.32Å
56P96.1Very high91.5Very high93 Ų93128.6 Ų128.660%0.60465%0.654SS**THydrogen-bonded Turntrans-74.4-20.7-177.730.7-33.9000112.6E54 K58E54-P56 WeakPolarHBondContact O-CD 3.12Å; P56-K58 VanDerWaalsContact C-N 3.29Å
57Y96.2Very high92.6Very high203 Ų203124.7 Ų124.780%0.79664%0.636SS**THydrogen-bonded Turntrans-92.113.9178-53.1-71000112.6N55 E59N55-Y57 VanDerWaalsContact C-N 3.28Å; N55-Y57 PolarHBondContact O-N 2.85Å; N55-Y57 WeakPolarHBondContact OD1-CA 3.28Å; N55-Y57 PolarHBondContact OD1-N 2.94Å; Y57-E59 PolarHBondContact O-N 3.37Å; Y57-E59 VanDerWaalsContact O-N 3.16Å
58K96.1Very high93.3Very high156 Ų156123.8 Ų123.868%0.67863%0.632SS**  trans-72.6108.7179.3-173.7176.9-178.6179.60110.3N55 P56N55-K58 HydrophobicContact CB-CB 4.21Å; N55-K58 VanDerWaalsContact O-CB 3.28Å; N55-K58 WeakPolarHBondContact O-CB 3.47Å; N55-K58 PolarHBondContact O-N 2.65Å; N55-K58 PolarHBondContact OD1-N 3.32Å; P56-K58 VanDerWaalsContact C-N 3.29Å
59E95.8Very high93.7Very high156 Ų156123.3 Ų123.373%0.72962%0.622SS**PPolyproline II helixtrans-62.3146.4172.8-68.6-175.8179.800112Y57Y57-E59 PolarHBondContact O-N 3.37Å; Y57-E59 VanDerWaalsContact O-N 3.16Å
60P94.4Very high94Very high116 Ų116125 Ų12575%0.75363%0.628SS**PPolyproline II helixtrans-64.6148.317528.4-34.6000110.8K62P60-K62 PolarHBondContact O-N 3.07Å
61L93.7Very high94.3Very high151 Ų151120.3 Ų120.379%0.79160%0.596SS**PPolyproline II helixtrans-63132.7178.7-60.6179.5000110.9K63L61-K63 PolarHBondContact O-N 3.16Å
62K94.3Very high94.6Very high201 Ų201117.1 Ų117.187%0.87458%0.58SS**PPolyproline II helixtrans-60.7126.7176-63.6-178-178.4179.30110P60P60-K62 PolarHBondContact O-N 3.07Å
63K95.2Very high94.8Very high151 Ų151113.5 Ų113.566%0.65755%0.55SS**PPolyproline II helixtrans-94.3151177.8-64.2179.5-177.1175.80110.5L61 C67 E68L61-K63 PolarHBondContact O-N 3.16Å; K63-C67 HydrophobicContact CB-CB 4.32Å; K63-E68 WeakPolarHBondContact CD-OE1 3.39Å; K63-E68 WeakPolarHBondContact CE-OE1 3.09Å; K63-E68 IonicContact NZ-OE1 3.93Å; K63-E68 PolarHBondContact NZ-OE1 3.12Å
64C94.3Very high95Very high18 Ų18113.9 Ų113.912%0.12255%0.548CS..PPolyproline II helixtrans-77161.1169.970.60000111.4L66 C67 L98 C99C64-L66 PolarHBondContact O-N 3.13Å; C64-L66 VanDerWaalsContact O-N 3.09Å; C64-C67 HydrophobicContact CB-CB 4.38Å; C64-C67 WeakPolarHBondContact CB-SG 3.16Å; C64-C67 PolarHBondContact N-SG 2.77Å; C64-C67 WeakPolarHBondContact O-CB 3.49Å; C64-C67 PolarHBondContact O-N 3.19Å; C64-C67 WeakPolarHBondContact SG-CA 3.45Å; C64-C67 WeakPolarHBondContact SG-CB 3.44Å; C64-C67 PolarHBondContact SG-N 3.1Å; C64-C67 CovalentContact SG-SG 2.07Å; C64-C67 PolarHBondContact SG-SG 3.09Å; C64-L98 HydrophobicContact CB-CD2 4.25Å; C64-C99 HydrophobicContact CB-CB 4.46Å; C64-C99 VanDerWaalsContact SG-SG 3.62Å
65I93.4Very high95.2Very high114 Ų114109.3 Ų109.359%0.58553%0.529SS*.THydrogen-bonded Turntrans-56.3-32.6-176.7-52.5172.1000112.4V134I65-V134 HydrophobicContact CD1-CG1 3.4Å
66L95.5Very high95.3Very high13 Ų13105.9 Ų105.97%0.06851%0.511CS..THydrogen-bonded Turntrans-109.311.4-175.7-62.8180000114.7C64 E68 K69 V71 L78 F82 L98 K102 I106C64-L66 PolarHBondContact O-N 3.13Å; C64-L66 VanDerWaalsContact O-N 3.09Å; L66-E68 VanDerWaalsContact C-N 3.27Å; L66-E68 PolarHBondContact O-N 2.8Å; L66-E68 VanDerWaalsContact O-N 3.13Å; L66-K69 HydrophobicContact CD2-CB 4.48Å; L66-K69 PolarHBondContact O-N 3.27Å; L66-K69 VanDerWaalsContact O-N 3.16Å; L66-V71 HydrophobicContact CD1-CG2 4.25Å; L66-L78 HydrophobicContact CD1-CD2 4.46Å; L66-L78 HydrophobicContact CD2-CD1 4.07Å; L66-F82 HydrophobicContact CD1-CE2 3.8Å; L66-F82 HydrophobicContact CD1-CZ 3.6Å; L66-F82 HydrophobicContact CG-CZ 4.38Å; L66-L98 HydrophobicContact CB-CD2 4.2Å; L66-L98 HydrophobicContact CD1-CD1 4.13Å; L66-L98 HydrophobicContact CD1-CD2 4.23Å; L66-L98 HydrophobicContact CG-CD2 4.15Å; L66-K102 HydrophobicContact CB-CD 4.23Å; L66-K102 HydrophobicContact CB-CG 4.41Å; L66-K102 WeakPolarHBondContact O-CD 3.41Å; L66-K102 WeakPolarHBondContact O-CE 3.49Å; L66-I106 HydrophobicContact CD1-CD1 3.8Å; L66-I106 HydrophobicContact CD1-CG1 4.1Å
67C91.7Very high95.3Very high43 Ų43106.4 Ų106.429%0.29151%0.505SS..THydrogen-bonded Turntrans-61.9-29.8-165-89.60000114.8K63 C64 C99 K102K63-C67 HydrophobicContact CB-CB 4.32Å; C64-C67 HydrophobicContact CB-CB 4.38Å; C64-C67 WeakPolarHBondContact CB-SG 3.16Å; C64-C67 PolarHBondContact N-SG 2.77Å; C64-C67 WeakPolarHBondContact O-CB 3.49Å; C64-C67 PolarHBondContact O-N 3.19Å; C64-C67 WeakPolarHBondContact SG-CA 3.45Å; C64-C67 WeakPolarHBondContact SG-CB 3.44Å; C64-C67 PolarHBondContact SG-N 3.1Å; C64-C67 CovalentContact SG-SG 2.07Å; C64-C67 PolarHBondContact SG-SG 3.09Å; C67-C99 PolarHBondContact SG-SG 3.16Å; C67-K102 WeakPolarHBondContact O-CE 3.48Å
68E92.1Very high95.3Very high140 Ų14099 Ų9965%0.65448%0.479SS*.THydrogen-bonded Turntrans-112.14.6179.9-68167.4-164.100113K63 L66K63-E68 WeakPolarHBondContact CD-OE1 3.39Å; K63-E68 WeakPolarHBondContact CE-OE1 3.09Å; K63-E68 IonicContact NZ-OE1 3.93Å; K63-E68 PolarHBondContact NZ-OE1 3.12Å; L66-E68 VanDerWaalsContact C-N 3.27Å; L66-E68 PolarHBondContact O-N 2.8Å; L66-E68 VanDerWaalsContact O-N 3.13Å
69K94.8Very high95.4Very high139 Ų13991.5 Ų91.560%0.60445%0.447SS*.SBendtrans-100.5141-176.9-57.9-57.2-176.1-178.40110.6L66 K102L66-K69 HydrophobicContact CD2-CB 4.48Å; L66-K69 PolarHBondContact O-N 3.27Å; L66-K69 VanDerWaalsContact O-N 3.16Å; K69-K102 PolarHBondContact O-NZ 2.89Å
70Q95.1Very high95.4Very high150 Ų15084.2 Ų84.270%0.70141%0.413SS*.  trans-77.9137.3172.8-175.3173.4-1900109.8D72Q70-D72 PolarHBondContact NE2-OD1 2.07Å; Q70-D72 VanDerWaalsContact NE2-OD1 3.1Å
71V96.7Very high95.5Very high21 Ų2180.7 Ų80.713%0.12739%0.386CS..  trans-111.7113.1179.9176.60000108.4L66 L78 L79 I106 A109L66-V71 HydrophobicContact CD1-CG2 4.25Å; V71-L78 HydrophobicContact CG1-CD2 4.31Å; V71-L79 HydrophobicContact CG1-CD2 4.05Å; V71-I106 HydrophobicContact CB-CD1 4.41Å; V71-I106 HydrophobicContact CG1-CD1 3.49Å; V71-I106 VanDerWaalsContact CG1-CD1 3.49Å; V71-I106 HydrophobicContact CG1-CG1 4.22Å; V71-I106 HydrophobicContact CG2-CD1 3.99Å; V71-I106 HydrophobicContact CG2-CG1 4.42Å; V71-A109 HydrophobicContact CG1-CB 4.05Å
72D96.9Very high95.6Very high59 Ų5973.7 Ų73.732%0.31635%0.349SS..  trans-106.4146176-60.3-50000111Q70 K74 N75Q70-D72 PolarHBondContact NE2-OD1 2.07Å; Q70-D72 VanDerWaalsContact NE2-OD1 3.1Å; D72-K74 PolarHBondContact O-N 3.34Å; D72-N75 PolarHBondContact O-N 3.31Å
73Y97.9Very high95.7Very high56 Ų5664.4 Ų64.422%0.2231%0.309CS..THydrogen-bonded Turntrans-68.9-14.3178.368.3-86.7000113.5R112 A113 M116 F118Y73-R112 VanDerWaalsContact CD1-CD 3.47Å; Y73-R112 HydrophobicContact CD1-CG 4.47Å; Y73-R112 HydrophobicContact CD2-CG 4.25Å; Y73-R112 HydrophobicContact CG-CG 4.06Å; Y73-A113 WeakPolarHBondContact O-CB 3.41Å; Y73-M116 HydrophobicContact CD2-SD 3.76Å; Y73-M116 HydrophobicContact CE2-CE 4.35Å; Y73-M116 HydrophobicContact CE2-SD 3.35Å; Y73-M116 WeakPolarHBondContact CE2-SD 3.47Å; Y73-F118 HydrophobicContact CD2-CD2 4.27Å; Y73-F118 HydrophobicContact CD2-CE2 4.35Å; Y73-F118 HydrophobicContact CE2-CD2 4.3Å; Y73-F118 AromaticContact CE2-CE2 3.92Å; Y73-F118 HydrophobicContact CE2-CE2 3.92Å
74K97.1Very high95.8Very high134 Ų13457.6 Ų57.658%0.58328%0.281SS*.THydrogen-bonded Turntrans-77.6-24.6179.3-58.1177.6-175.5178.60112.1D72 I76D72-K74 PolarHBondContact O-N 3.34Å; K74-I76 VanDerWaalsContact C-N 3.32Å; K74-I76 PolarHBondContact O-N 3.21Å
75N97Very high95.8Very high79 Ų7958.1 Ų58.142%0.42228%0.284SS..  trans-84.874.5-175.1-64.3-21.4000110.4D72 Q77 L78 L79D72-N75 PolarHBondContact O-N 3.31Å; N75-Q77 VanDerWaalsContact C-N 3.28Å; N75-Q77 PolarHBondContact O-N 3.31Å; N75-L78 HydrophobicContact CB-CB 4.39Å; N75-L78 PolarHBondContact O-N 3.22Å; N75-L79 WeakPolarHBondContact O-CG 3.38Å; N75-L79 PolarHBondContact O-N 3.22Å
76I97.1Very high95.7Very high30 Ų3059.9 Ų59.915%0.15429%0.287CS..Hα-helixtrans-58.7-41-174.8-58153.5000111K74 L78 L79 S80 F118 M119 Y128K74-I76 VanDerWaalsContact C-N 3.32Å; K74-I76 PolarHBondContact O-N 3.21Å; I76-L78 VanDerWaalsContact C-N 3.32Å; I76-L78 PolarHBondContact O-N 3.29Å; I76-L79 PolarHBondContact O-N 3.24Å; I76-L79 VanDerWaalsContact O-N 3.15Å; I76-S80 WeakPolarHBondContact O-CB 3.2Å; I76-S80 PolarHBondContact O-N 2.99Å; I76-F118 HydrophobicContact CD1-CB 4.06Å; I76-F118 WeakPolarHBondContact CD1-O 3.24Å; I76-F118 HydrophobicContact CG1-CB 4.15Å; I76-M119 HydrophobicContact CG2-CB 4.33Å; I76-M119 HydrophobicContact CG2-CG 4.15Å; I76-M119 HydrophobicContact CG2-SD 4.36Å; I76-Y128 HydrophobicContact CB-CE2 4.29Å; I76-Y128 HydrophobicContact CG2-CD2 4.22Å; I76-Y128 HydrophobicContact CG2-CE2 3.64Å
77Q96.4Very high95.7Very high104 Ų10463.2 Ų63.249%0.48631%0.309SS..Hα-helixtrans-53.8-46178.9-171.7176.915.200112.6N75 Y128 D131N75-Q77 VanDerWaalsContact C-N 3.28Å; N75-Q77 PolarHBondContact O-N 3.31Å; Q77-Y128 HydrophobicContact CB-CD1 3.89Å; Q77-Y128 HydrophobicContact CB-CE1 3.71Å; Q77-Y128 HydrophobicContact CG-CD1 3.75Å; Q77-Y128 HydrophobicContact CG-CE1 3.99Å; Q77-D131 WeakPolarHBondContact CG-OD2 3.35Å; Q77-D131 PolarHBondContact NE2-OD1 3.4Å; Q77-D131 VanDerWaalsContact NE2-OD1 3.12Å
78L96.4Very high95.8Very high47 Ų4761.5 Ų61.525%0.24630%0.298CS..Hα-helixtrans-68.6-42.1179-179.6141.6000111.8L66 V71 N75 I76 S80 Q81 F82 I106L66-L78 HydrophobicContact CD1-CD2 4.46Å; L66-L78 HydrophobicContact CD2-CD1 4.07Å; V71-L78 HydrophobicContact CG1-CD2 4.31Å; N75-L78 HydrophobicContact CB-CB 4.39Å; N75-L78 PolarHBondContact O-N 3.22Å; I76-L78 VanDerWaalsContact C-N 3.32Å; I76-L78 PolarHBondContact O-N 3.29Å; L78-S80 VanDerWaalsContact C-N 3.34Å; L78-Q81 PolarHBondContact O-N 2.83Å; L78-F82 HydrophobicContact CD2-CE2 4.12Å; L78-F82 HydrophobicContact CG-CE2 4.39Å; L78-F82 VanDerWaalsContact O-CD2 3.25Å; L78-F82 WeakPolarHBondContact O-CD2 3.19Å; L78-F82 WeakPolarHBondContact O-CE2 3.36Å; L78-I106 HydrophobicContact CD2-CD1 3.7Å
79L97Very high96Very high0 Ų058.2 Ų58.20%029%0.29CS..Hα-helixtrans-67.4-37-179.6-61.1179.4000112.1V71 N75 I76 Q81 F82 I106 A109 I110 A113 M119V71-L79 HydrophobicContact CG1-CD2 4.05Å; N75-L79 WeakPolarHBondContact O-CG 3.38Å; N75-L79 PolarHBondContact O-N 3.22Å; I76-L79 PolarHBondContact O-N 3.24Å; I76-L79 VanDerWaalsContact O-N 3.15Å; L79-Q81 PolarHBondContact O-N 3.15Å; L79-F82 PolarHBondContact O-N 3.25Å; L79-F82 VanDerWaalsContact O-N 3.07Å; L79-I106 HydrophobicContact CD2-CD1 3.9Å; L79-A109 HydrophobicContact CD1-CB 4.23Å; L79-A109 HydrophobicContact CD2-CB 3.83Å; L79-I110 HydrophobicContact CB-CG1 3.97Å; L79-I110 HydrophobicContact CD1-CG1 4.47Å; L79-I110 HydrophobicContact CD2-CG1 4.1Å; L79-I110 HydrophobicContact CG-CG1 4.39Å; L79-A113 HydrophobicContact CD1-CB 4.12Å; L79-M119 HydrophobicContact CB-SD 4.11Å
80S96.9Very high96.1Very high2 Ų254.1 Ų54.11%0.01427%0.274CS..Hα-helixtrans-61.1-25.2179.7-164.40000112.7I76 L78 F82 K124 Y128I76-S80 WeakPolarHBondContact O-CB 3.2Å; I76-S80 PolarHBondContact O-N 2.99Å; L78-S80 VanDerWaalsContact C-N 3.34Å; S80-F82 VanDerWaalsContact C-N 3.3Å; S80-F82 PolarHBondContact O-N 3.31Å; S80-K124 WeakPolarHBondContact O-CE 3.29Å; S80-K124 WeakPolarHBondContact OG-CE 3.23Å; S80-K124 WeakPolarHBondContact OG-CG 3.46Å; S80-Y128 WeakPolarHBondContact OG-CB 3.45Å
81Q95.9Very high96.2Very high42 Ų4248.2 Ų48.220%0.19625%0.245CC..THydrogen-bonded Turntrans-71.3-21.6176-66.1172.114.700113.7L78 L79 D131L78-Q81 PolarHBondContact O-N 2.83Å; L79-Q81 PolarHBondContact O-N 3.15Å; Q81-D131 HydrophobicContact CG-CB 4.41Å
82F96.6Very high96.2Very high4 Ų448.6 Ų48.62%0.01825%0.253CS..THydrogen-bonded Turntrans-97.614.4-178.3-60.8-72.8000113.5L66 L78 L79 S80 Y91 T96 L98 I106 I110 V134L66-F82 HydrophobicContact CD1-CE2 3.8Å; L66-F82 HydrophobicContact CD1-CZ 3.6Å; L66-F82 HydrophobicContact CG-CZ 4.38Å; L78-F82 HydrophobicContact CD2-CE2 4.12Å; L78-F82 HydrophobicContact CG-CE2 4.39Å; L78-F82 VanDerWaalsContact O-CD2 3.25Å; L78-F82 WeakPolarHBondContact O-CD2 3.19Å; L78-F82 WeakPolarHBondContact O-CE2 3.36Å; L79-F82 PolarHBondContact O-N 3.25Å; L79-F82 VanDerWaalsContact O-N 3.07Å; S80-F82 VanDerWaalsContact C-N 3.3Å; S80-F82 PolarHBondContact O-N 3.31Å; F82-Y91 VanDerWaalsContact O-CD2 3.24Å; F82-Y91 WeakPolarHBondContact O-CD2 3.15Å; F82-Y91 PolarHBondContact O-N 3.43Å; F82-T96 HydrophobicContact CD1-CG2 3.7Å; F82-T96 HydrophobicContact CE1-CG2 4.42Å; F82-L98 HydrophobicContact CD1-CD1 4.21Å; F82-L98 HydrophobicContact CE1-CD1 3.71Å; F82-L98 HydrophobicContact CE1-CG 4.25Å; F82-L98 HydrophobicContact CZ-CD1 4.05Å; F82-I106 HydrophobicContact CB-CG2 4.07Å; F82-I106 HydrophobicContact CD2-CD1 3.87Å; F82-I106 HydrophobicContact CD2-CG2 4.05Å; F82-I106 HydrophobicContact CE2-CD1 3.81Å; F82-I106 HydrophobicContact CG-CG2 4.11Å; F82-I110 HydrophobicContact CB-CD1 4.46Å; F82-V134 HydrophobicContact CE1-CG1 4.28Å
83I96.5Very high96.1Very high7 Ų753.1 Ų53.14%0.03627%0.266CS..BIsolated β-bridgetrans-122.9147.5-174-63173.8000110.7G88 C89 Y91 I110 M119I83-G88 VanDerWaalsContact CG2-CA 3.43Å; I83-G88 WeakPolarHBondContact CG2-O 3.15Å; I83-C89 CarbonylContact C-O 3.58Å; I83-C89 WeakPolarHBondContact CA-O 3.41Å; I83-Y91 VanDerWaalsContact O-CE2 3.25Å; I83-Y91 WeakPolarHBondContact O-CE2 3.35Å; I83-Y91 PolarHBondContact O-OH 2.89Å; I83-I110 HydrophobicContact CD1-CD1 4.05Å; I83-I110 HydrophobicContact CD1-CG1 4.21Å; I83-I110 HydrophobicContact CD1-CG2 4.13Å; I83-I110 HydrophobicContact CG1-CD1 3.96Å; I83-M119 HydrophobicContact CD1-CE 3.35Å; I83-M119 HydrophobicContact CD1-SD 3.53Å; I83-M119 VanDerWaalsContact CD1-SD 3.53Å
84S95.5Very high96Very high8 Ų858.6 Ų58.66%0.05629%0.293CS..  trans-62.5125.4170.9-177.70000111.4F86 T87 G88 C89 Y91S84-F86 VanDerWaalsContact C-N 3.25Å; S84-F86 PolarHBondContact O-N 3.2Å; S84-T87 PolarHBondContact OG-N 3.46Å; S84-T87 PolarHBondContact OG-OG1 3.11Å; S84-G88 PolarHBondContact O-N 3.27Å; S84-C89 PolarHBondContact N-O 3.03Å; S84-Y91 VanDerWaalsContact CA-OH 3.31Å; S84-Y91 WeakPolarHBondContact CA-OH 3.43Å
85P94.2Very high95.9Very high28 Ų2854 Ų5418%0.18228%0.275CS..THydrogen-bonded Turntrans-59.2-38.1179.423.5-31.3000112.2Y91 K124 L129 Y139P85-Y91 WeakPolarHBondContact CD-OH 3.45Å; P85-K124 HydrophobicContact CB-CB 4.49Å; P85-K124 HydrophobicContact CB-CD 4.41Å; P85-K124 PolarHBondContact O-N 3.12Å; P85-L129 HydrophobicContact CB-CD1 3.77Å; P85-Y139 VanDerWaalsContact CD-OH 3.3Å; P85-Y139 WeakPolarHBondContact CD-OH 3.11Å; P85-Y139 HydrophobicContact CG-CE2 4.08Å
86F92.8Very high95.8Very high151 Ų15150.5 Ų50.566%0.66226%0.256SS*.THydrogen-bonded Turntrans-90.1-32.8-173.8-53.2-68.5000113.9S84 Y139S84-F86 VanDerWaalsContact C-N 3.25Å; S84-F86 PolarHBondContact O-N 3.2Å; F86-Y139 HydrophobicContact CD2-CD1 4.41Å; F86-Y139 HydrophobicContact CD2-CE1 4.17Å; F86-Y139 HydrophobicContact CE2-CD1 4.15Å; F86-Y139 HydrophobicContact CE2-CD2 4.23Å; F86-Y139 HydrophobicContact CE2-CE1 4.25Å; F86-Y139 HydrophobicContact CE2-CE2 4.33Å; F86-Y139 HydrophobicContact CE2-CG 4.14Å
87T94Very high95.7Very high84 Ų8451.7 Ų51.752%0.51528%0.275SS..THydrogen-bonded Turntrans-112.3-14.8-167.8-30.10000113.4S84 C89 T122S84-T87 PolarHBondContact OG-N 3.46Å; S84-T87 PolarHBondContact OG-OG1 3.11Å; T87-C89 WeakPolarHBondContact CG2-SG 3.42Å; T87-C89 PolarHBondContact O-N 3.42Å; T87-C89 VanDerWaalsContact O-N 3.1Å; T87-T122 CarbonylContact C-O 3.04Å; T87-T122 VanDerWaalsContact O-O 3.12Å
88G94.7Very high95.7Very high6 Ų646.8 Ų46.86%0.06225%0.253CS..  trans69.43.5-172.200000114.2I83 S84 V121 T122I83-G88 VanDerWaalsContact CG2-CA 3.43Å; I83-G88 WeakPolarHBondContact CG2-O 3.15Å; S84-G88 PolarHBondContact O-N 3.27Å; G88-V121 WeakPolarHBondContact CA-O 3.42Å; G88-T122 PolarHBondContact N-O 3.27Å
89C96.2Very high95.7Very high72 Ų7246.8 Ų46.849%0.48626%0.256SS..PPolyproline II helixtrans-66.9133.9177.1-69.10000111.7I83 S84 T87I83-C89 CarbonylContact C-O 3.58Å; I83-C89 WeakPolarHBondContact CA-O 3.41Å; S84-C89 PolarHBondContact N-O 3.03Å; T87-C89 WeakPolarHBondContact CG2-SG 3.42Å; T87-C89 PolarHBondContact O-N 3.42Å; T87-C89 VanDerWaalsContact O-N 3.1Å
90I97.3Very high95.7Very high52 Ų5248.5 Ų48.527%0.26727%0.273SS..BIsolated β-bridgetrans-75.9128.3175.9-50.4172.8000109T107 I110I90-T107 HydrophobicContact CD1-CG2 4.1Å; I90-I110 HydrophobicContact CD1-CB 4.11Å; I90-I110 HydrophobicContact CD1-CD1 4.26Å; I90-I110 HydrophobicContact CD1-CG2 3.47Å; I90-I110 VanDerWaalsContact CD1-CG2 3.47Å; I90-I110 HydrophobicContact CG1-CD1 4.15Å; I90-I110 HydrophobicContact CG1-CG2 3.84Å; I90-I110 HydrophobicContact CG2-CD1 3.84Å
91Y96.8Very high95.7Very high27 Ų2756.4 Ų56.411%0.10631%0.308CS..PPolyproline II helixtrans-69.2148.7179.4-61.2-51.8000113F82 I83 S84 P85 I95 Q103 C135 I137 Y139F82-Y91 VanDerWaalsContact O-CD2 3.24Å; F82-Y91 WeakPolarHBondContact O-CD2 3.15Å; F82-Y91 PolarHBondContact O-N 3.43Å; I83-Y91 VanDerWaalsContact O-CE2 3.25Å; I83-Y91 WeakPolarHBondContact O-CE2 3.35Å; I83-Y91 PolarHBondContact O-OH 2.89Å; S84-Y91 VanDerWaalsContact CA-OH 3.31Å; S84-Y91 WeakPolarHBondContact CA-OH 3.43Å; P85-Y91 WeakPolarHBondContact CD-OH 3.45Å; Y91-I95 HydrophobicContact CD1-CD1 4.02Å; Y91-I95 HydrophobicContact CG-CD1 4.43Å; Y91-I95 HydrophobicContact CG-CG2 4.4Å; Y91-Q103 PolarHBondContact O-NE2 3.47Å; Y91-C135 HydrophobicContact CD2-CB 4.02Å; Y91-C135 WeakPolarHBondContact CD2-SG 3.45Å; Y91-C135 HydrophobicContact CE2-CB 4Å; Y91-I137 HydrophobicContact CD1-CD1 3.43Å; Y91-I137 VanDerWaalsContact CD1-CD1 3.43Å; Y91-I137 HydrophobicContact CD2-CD1 4.46Å; Y91-I137 HydrophobicContact CE1-CD1 3.01Å; Y91-I137 HydrophobicContact CE1-CG1 4.46Å; Y91-I137 HydrophobicContact CE2-CD1 4.13Å; Y91-I137 HydrophobicContact CG-CD1 4.14Å; Y91-Y139 PolarHBondContact OH-OH 3.32Å
92G96.3Very high95.7Very high28 Ų2855.6 Ų55.629%0.28930%0.304SS..PPolyproline II helixtrans-78.4167.8175.200000113.4H94 I95 T96G92-H94 VanDerWaalsContact C-N 3.27Å; G92-H94 PolarHBondContact O-N 2.79Å; G92-I95 PolarHBondContact O-N 3.07Å; G92-T96 PolarHBondContact O-N 3.44Å; G92-T96 VanDerWaalsContact O-N 3.12Å; G92-T96 PolarHBondContact O-OG1 3.22Å
93R95.8Very high95.8Very high155 Ų15556.5 Ų56.559%0.58531%0.308SS*.Hα-helixtrans-59.1-34.1-178.6-173.5179.1176.9-132.1-4.5113.9I95 G97 L98R93-I95 PolarHBondContact O-N 3.07Å; R93-G97 PolarHBondContact O-N 2.89Å; R93-L98 VanDerWaalsContact CG-O 3.31Å; R93-L98 WeakPolarHBondContact CG-O 2.93Å; R93-L98 PolarHBondContact NE-O 3.12Å
94H94.5Very high95.8Very high170 Ų17063.2 Ų63.279%0.78734%0.337SS*.Hα-helixtrans-65.5-20.2179.662.7-88.2000112.7G92G92-H94 VanDerWaalsContact C-N 3.27Å; G92-H94 PolarHBondContact O-N 2.79Å
95I95.1Very high95.9Very high39 Ų3966.5 Ų66.520%0.235%0.351CS..Hα-helixtrans-96.1-50.7177.6-50.5-175.7000110.6Y91 G92 R93 G97 C135 I137Y91-I95 HydrophobicContact CD1-CD1 4.02Å; Y91-I95 HydrophobicContact CG-CD1 4.43Å; Y91-I95 HydrophobicContact CG-CG2 4.4Å; G92-I95 PolarHBondContact O-N 3.07Å; R93-I95 PolarHBondContact O-N 3.07Å; I95-G97 VanDerWaalsContact C-N 3.3Å; I95-G97 PolarHBondContact O-N 3.44Å; I95-C135 HydrophobicContact CG2-CB 3.79Å; I95-I137 HydrophobicContact CD1-CD1 3.79Å; I95-I137 HydrophobicContact CD1-CG1 4.24Å; I95-I137 HydrophobicContact CG2-CD1 3.67Å; I95-I137 HydrophobicContact CG2-CG1 3.38Å
96T95.8Very high96.1Very high4 Ų465.1 Ų65.13%0.02534%0.342CS..Hα-helixtrans-72.8-23.1-173.763.40000112.9F82 G92 L98 Q103F82-T96 HydrophobicContact CD1-CG2 3.7Å; F82-T96 HydrophobicContact CE1-CG2 4.42Å; G92-T96 PolarHBondContact O-N 3.44Å; G92-T96 VanDerWaalsContact O-N 3.12Å; G92-T96 PolarHBondContact O-OG1 3.22Å; T96-L98 PolarHBondContact O-N 3.42Å; T96-Q103 PolarHBondContact OG1-OE1 3.25Å
97G94.9Very high96.4Very high55 Ų5559.8 Ų59.857%0.56732%0.322SS*.  trans66.715.8-177.700000114R93 I95R93-G97 PolarHBondContact O-N 2.89Å; I95-G97 VanDerWaalsContact C-N 3.3Å; I95-G97 PolarHBondContact O-N 3.44Å
98L96.7Very high96.6Very high1 Ų163 Ų631%0.00533%0.329CS..  trans-80.4156.7-177.5-65-179.2000112.8C64 L66 F82 R93 T96 Q103 I106C64-L98 HydrophobicContact CB-CD2 4.25Å; L66-L98 HydrophobicContact CB-CD2 4.2Å; L66-L98 HydrophobicContact CD1-CD1 4.13Å; L66-L98 HydrophobicContact CD1-CD2 4.23Å; L66-L98 HydrophobicContact CG-CD2 4.15Å; F82-L98 HydrophobicContact CD1-CD1 4.21Å; F82-L98 HydrophobicContact CE1-CD1 3.71Å; F82-L98 HydrophobicContact CE1-CG 4.25Å; F82-L98 HydrophobicContact CZ-CD1 4.05Å; R93-L98 VanDerWaalsContact CG-O 3.31Å; R93-L98 WeakPolarHBondContact CG-O 2.93Å; R93-L98 PolarHBondContact NE-O 3.12Å; T96-L98 PolarHBondContact O-N 3.42Å; L98-Q103 HydrophobicContact CB-CB 4.47Å; L98-I106 HydrophobicContact CD1-CG1 4.15Å
99C96.4Very high96.7Very high48 Ų4863 Ų6332%0.32433%0.329SS..  trans-65150.6166.9-72.40000110.7C64 C67 K101 K102 Q103C64-C99 HydrophobicContact CB-CB 4.46Å; C64-C99 VanDerWaalsContact SG-SG 3.62Å; C67-C99 PolarHBondContact SG-SG 3.16Å; C99-K101 PolarHBondContact O-N 3.22Å; C99-K101 VanDerWaalsContact O-N 3.16Å; C99-K102 PolarHBondContact O-N 3.42Å; C99-K102 VanDerWaalsContact O-N 3.12Å; C99-Q103 PolarHBondContact O-N 2.83Å
100G96.9Very high96.8Very high35 Ų3559.6 Ų59.636%0.36131%0.306SS..Hα-helixtrans-58.6-32.5-178.100000114.1K104G100-K104 WeakPolarHBondContact O-CG 3.25Å; G100-K104 PolarHBondContact O-N 3.22Å
101K96.4Very high96.9Very high169 Ų16962.8 Ų62.874%0.73532%0.317SS*.Hα-helixtrans-63.9-53.3174.5-61.6-177.2-179-179.10111.1C99 Q103 K104 E105C99-K101 PolarHBondContact O-N 3.22Å; C99-K101 VanDerWaalsContact O-N 3.16Å; K101-Q103 PolarHBondContact O-N 2.79Å; K101-K104 PolarHBondContact O-N 2.92Å; K101-E105 PolarHBondContact O-N 2.99Å
102K97.2Very high97Very high25 Ų2567.8 Ų67.811%0.10934%0.336CS..Hα-helixtrans-65.8-37.1-179.8-68.3-69.3165.5-168.10113.1L66 C67 K69 C99 K104 E105 I106L66-K102 HydrophobicContact CB-CD 4.23Å; L66-K102 HydrophobicContact CB-CG 4.41Å; L66-K102 WeakPolarHBondContact O-CD 3.41Å; L66-K102 WeakPolarHBondContact O-CE 3.49Å; C67-K102 WeakPolarHBondContact O-CE 3.48Å; K69-K102 PolarHBondContact O-NZ 2.89Å; C99-K102 PolarHBondContact O-N 3.42Å; C99-K102 VanDerWaalsContact O-N 3.12Å; K102-K104 VanDerWaalsContact C-N 3.33Å; K102-K104 PolarHBondContact O-N 3.44Å; K102-E105 WeakPolarHBondContact CD-OE2 3.34Å; K102-E105 WeakPolarHBondContact CE-OE2 3.34Å; K102-E105 IonicContact NZ-OE1 2.8Å; K102-E105 IonicContact NZ-OE2 2.65Å; K102-E105 PolarHBondContact NZ-OE2 3.24Å; K102-E105 PolarHBondContact O-N 2.95Å; K102-I106 WeakPolarHBondContact O-CB 3.44Å; K102-I106 WeakPolarHBondContact O-CG1 3.31Å; K102-I106 PolarHBondContact O-N 3.5Å
103Q97.6Very high97.1Very high22 Ų2266.4 Ų66.410%0.10332%0.322CS..Hα-helixtrans-60.6-43.5173.9-171.97019.100111.4Y91 T96 L98 C99 K101 I106 T107Y91-Q103 PolarHBondContact O-NE2 3.47Å; T96-Q103 PolarHBondContact OG1-OE1 3.25Å; L98-Q103 HydrophobicContact CB-CB 4.47Å; C99-Q103 PolarHBondContact O-N 2.83Å; K101-Q103 PolarHBondContact O-N 2.79Å; Q103-I106 PolarHBondContact O-N 2.95Å; Q103-T107 PolarHBondContact O-N 3.18Å; Q103-T107 PolarHBondContact O-OG1 2.86Å
104K97.8Very high97.2Very high149 Ų14960.8 Ų60.865%0.64830%0.303SS*.Hα-helixtrans-64.9-40.8176.2-72.8175.7-178.2-177.30112G100 K101 K102 K108G100-K104 WeakPolarHBondContact O-CG 3.25Å; G100-K104 PolarHBondContact O-N 3.22Å; K101-K104 PolarHBondContact O-N 2.92Å; K102-K104 VanDerWaalsContact C-N 3.33Å; K102-K104 PolarHBondContact O-N 3.44Å; K104-K108 WeakPolarHBondContact O-CB 3.35Å; K104-K108 VanDerWaalsContact O-CG 3.3Å; K104-K108 WeakPolarHBondContact O-CG 3.37Å; K104-K108 PolarHBondContact O-N 2.95Å
105E97.6Very high97.3Very high76 Ų7661.6 Ų61.636%0.35530%0.304SS..Hα-helixtrans-59.4-49.7174.7-73.9168.6-14900111.2K101 K102 K108 A109K101-E105 PolarHBondContact O-N 2.99Å; K102-E105 WeakPolarHBondContact CD-OE2 3.34Å; K102-E105 WeakPolarHBondContact CE-OE2 3.34Å; K102-E105 IonicContact NZ-OE1 2.8Å; K102-E105 IonicContact NZ-OE2 2.65Å; K102-E105 PolarHBondContact NZ-OE2 3.24Å; K102-E105 PolarHBondContact O-N 2.95Å; E105-K108 PolarHBondContact O-N 3.32Å; E105-A109 WeakPolarHBondContact O-CB 3.45Å; E105-A109 PolarHBondContact O-N 3.26Å
106I97.8Very high97.4Very high0 Ų064.6 Ų64.60%032%0.318CS..Hα-helixtrans-59.4-49.9177.4-71.5-75.9000111.3L66 V71 L78 L79 F82 L98 K102 Q103 K108 A109 I110L66-I106 HydrophobicContact CD1-CD1 3.8Å; L66-I106 HydrophobicContact CD1-CG1 4.1Å; V71-I106 HydrophobicContact CB-CD1 4.41Å; V71-I106 HydrophobicContact CG1-CD1 3.49Å; V71-I106 VanDerWaalsContact CG1-CD1 3.49Å; V71-I106 HydrophobicContact CG1-CG1 4.22Å; V71-I106 HydrophobicContact CG2-CD1 3.99Å; V71-I106 HydrophobicContact CG2-CG1 4.42Å; L78-I106 HydrophobicContact CD2-CD1 3.7Å; L79-I106 HydrophobicContact CD2-CD1 3.9Å; F82-I106 HydrophobicContact CB-CG2 4.07Å; F82-I106 HydrophobicContact CD2-CD1 3.87Å; F82-I106 HydrophobicContact CD2-CG2 4.05Å; F82-I106 HydrophobicContact CE2-CD1 3.81Å; F82-I106 HydrophobicContact CG-CG2 4.11Å; L98-I106 HydrophobicContact CD1-CG1 4.15Å; K102-I106 WeakPolarHBondContact O-CB 3.44Å; K102-I106 WeakPolarHBondContact O-CG1 3.31Å; K102-I106 PolarHBondContact O-N 3.5Å; Q103-I106 PolarHBondContact O-N 2.95Å; I106-K108 VanDerWaalsContact C-N 3.29Å; I106-K108 PolarHBondContact O-N 2.85Å; I106-A109 PolarHBondContact O-N 3.01Å; I106-I110 HydrophobicContact CG2-CD1 3.59Å; I106-I110 HydrophobicContact CG2-CG1 4.31Å; I106-I110 WeakPolarHBondContact O-CB 3.3Å; I106-I110 VanDerWaalsContact O-CG1 3.32Å; I106-I110 WeakPolarHBondContact O-CG1 3.32Å; I106-I110 PolarHBondContact O-N 2.99Å
107T98.1Very high97.5Very high38 Ų3867.6 Ų67.623%0.23335%0.35CS..Hα-helixtrans-60.1-39.9178.9-57.60000112I90 Q103 K111I90-T107 HydrophobicContact CD1-CG2 4.1Å; Q103-T107 PolarHBondContact O-N 3.18Å; Q103-T107 PolarHBondContact O-OG1 2.86Å; T107-K111 HydrophobicContact CG2-CD 4.35Å; T107-K111 WeakPolarHBondContact O-CB 3.45Å; T107-K111 WeakPolarHBondContact O-CG 3.3Å; T107-K111 PolarHBondContact O-N 3.12Å; T107-K111 VanDerWaalsContact O-N 3.09Å
108K98.3Very high97.6Very high152 Ų15269.7 Ų69.766%0.66134%0.344SS*.Hα-helixtrans-67-43176.1-75.9179.1179-174.50111.6K104 E105 I106 K111 R112K104-K108 WeakPolarHBondContact O-CB 3.35Å; K104-K108 VanDerWaalsContact O-CG 3.3Å; K104-K108 WeakPolarHBondContact O-CG 3.37Å; K104-K108 PolarHBondContact O-N 2.95Å; E105-K108 PolarHBondContact O-N 3.32Å; I106-K108 VanDerWaalsContact C-N 3.29Å; I106-K108 PolarHBondContact O-N 2.85Å; K108-K111 PolarHBondContact O-N 3.27Å; K108-R112 VanDerWaalsContact O-CB 3.3Å; K108-R112 WeakPolarHBondContact O-CB 3.09Å; K108-R112 PolarHBondContact O-N 3.01Å
109A98.3Very high97.6Very high7 Ų770.2 Ų70.26%0.05835%0.346CS..Hα-helixtrans-63.5-46.1178.400000111.5V71 L79 E105 I106 R112 A113V71-A109 HydrophobicContact CG1-CB 4.05Å; L79-A109 HydrophobicContact CD1-CB 4.23Å; L79-A109 HydrophobicContact CD2-CB 3.83Å; E105-A109 WeakPolarHBondContact O-CB 3.45Å; E105-A109 PolarHBondContact O-N 3.26Å; I106-A109 PolarHBondContact O-N 3.01Å; A109-R112 PolarHBondContact O-N 3.36Å; A109-A113 WeakPolarHBondContact O-CB 3.17Å; A109-A113 PolarHBondContact O-N 2.82Å
110I98.2Very high97.6Very high0 Ų069.6 Ų69.60%034%0.341CS..Hα-helixtrans-56.6-53.5174.7-73.1169.3000110.8L79 F82 I83 I90 I106 R112 A113 Q114 M119L79-I110 HydrophobicContact CB-CG1 3.97Å; L79-I110 HydrophobicContact CD1-CG1 4.47Å; L79-I110 HydrophobicContact CD2-CG1 4.1Å; L79-I110 HydrophobicContact CG-CG1 4.39Å; F82-I110 HydrophobicContact CB-CD1 4.46Å; I83-I110 HydrophobicContact CD1-CD1 4.05Å; I83-I110 HydrophobicContact CD1-CG1 4.21Å; I83-I110 HydrophobicContact CD1-CG2 4.13Å; I83-I110 HydrophobicContact CG1-CD1 3.96Å; I90-I110 HydrophobicContact CD1-CB 4.11Å; I90-I110 HydrophobicContact CD1-CD1 4.26Å; I90-I110 HydrophobicContact CD1-CG2 3.47Å; I90-I110 VanDerWaalsContact CD1-CG2 3.47Å; I90-I110 HydrophobicContact CG1-CD1 4.15Å; I90-I110 HydrophobicContact CG1-CG2 3.84Å; I90-I110 HydrophobicContact CG2-CD1 3.84Å; I106-I110 HydrophobicContact CG2-CD1 3.59Å; I106-I110 HydrophobicContact CG2-CG1 4.31Å; I106-I110 WeakPolarHBondContact O-CB 3.3Å; I106-I110 VanDerWaalsContact O-CG1 3.32Å; I106-I110 WeakPolarHBondContact O-CG1 3.32Å; I106-I110 PolarHBondContact O-N 2.99Å; I110-R112 PolarHBondContact O-N 3.25Å; I110-A113 PolarHBondContact O-N 3.06Å; I110-Q114 HydrophobicContact CG2-CG 4.48Å; I110-Q114 WeakPolarHBondContact O-CB 3.3Å; I110-Q114 WeakPolarHBondContact O-CG 3.38Å; I110-Q114 PolarHBondContact O-N 2.81Å; I110-M119 HydrophobicContact CB-CE 3.94Å; I110-M119 HydrophobicContact CG1-CE 4.01Å; I110-M119 HydrophobicContact CG2-CE 3.45Å; I110-M119 VanDerWaalsContact CG2-CE 3.45Å
111K98.3Very high97.6Very high119 Ų11972 Ų7252%0.51735%0.349SS..Hα-helixtrans-62.3-34.4-179.5-73.2-176.6177.2-169.70112.2T107 K108 K115T107-K111 HydrophobicContact CG2-CD 4.35Å; T107-K111 WeakPolarHBondContact O-CB 3.45Å; T107-K111 WeakPolarHBondContact O-CG 3.3Å; T107-K111 PolarHBondContact O-N 3.12Å; T107-K111 VanDerWaalsContact O-N 3.09Å; K108-K111 PolarHBondContact O-N 3.27Å; K111-K115 VanDerWaalsContact O-CG 3.29Å; K111-K115 WeakPolarHBondContact O-CG 3.36Å; K111-K115 PolarHBondContact O-N 3.43Å; K111-K115 VanDerWaalsContact O-N 3.12Å
112R98.4Very high97.6Very high131 Ų13168.6 Ų68.649%0.49434%0.342SS..Hα-helixtrans-68.6-47.6175.2-176.4-177.1-67.6172.8-1111.1Y73 K108 A109 I110 Q114 K115 M116Y73-R112 VanDerWaalsContact CD1-CD 3.47Å; Y73-R112 HydrophobicContact CD1-CG 4.47Å; Y73-R112 HydrophobicContact CD2-CG 4.25Å; Y73-R112 HydrophobicContact CG-CG 4.06Å; K108-R112 VanDerWaalsContact O-CB 3.3Å; K108-R112 WeakPolarHBondContact O-CB 3.09Å; K108-R112 PolarHBondContact O-N 3.01Å; A109-R112 PolarHBondContact O-N 3.36Å; I110-R112 PolarHBondContact O-N 3.25Å; R112-Q114 VanDerWaalsContact C-N 3.3Å; R112-Q114 PolarHBondContact O-N 2.81Å; R112-K115 PolarHBondContact O-N 3.47Å; R112-M116 HydrophobicContact CG-CE 3.74Å; R112-M116 HydrophobicContact CG-CG 4.48Å; R112-M116 HydrophobicContact CG-SD 3.75Å; R112-M116 WeakPolarHBondContact O-CB 3.31Å; R112-M116 WeakPolarHBondContact O-CG 3.25Å; R112-M116 PolarHBondContact O-N 2.89Å
113A98.3Very high97.6Very high0 Ų073.5 Ų73.50%036%0.361CS..Hα-helixtrans-58.8-42.6177.400000111.5Y73 L79 A109 I110 M116 G117 F118 M119Y73-A113 WeakPolarHBondContact O-CB 3.41Å; L79-A113 HydrophobicContact CD1-CB 4.12Å; A109-A113 WeakPolarHBondContact O-CB 3.17Å; A109-A113 PolarHBondContact O-N 2.82Å; I110-A113 PolarHBondContact O-N 3.06Å; A113-M116 PolarHBondContact O-N 3.19Å; A113-G117 PolarHBondContact O-N 3.13Å; A113-G117 VanDerWaalsContact O-N 3.13Å; A113-F118 HydrophobicContact CB-CB 4.19Å; A113-F118 PolarHBondContact O-N 3.39Å; A113-M119 HydrophobicContact CB-CB 4.13Å; A113-M119 PolarHBondContact O-N 2.98Å
114Q97.8Very high97.5Very high37 Ų3773.9 Ų73.917%0.17336%0.362CS..Hα-helixtrans-61.6-48.4175.4-76.2174.2-18.400112.5I110 R112 M116 G117 M119 P120 V121I110-Q114 HydrophobicContact CG2-CG 4.48Å; I110-Q114 WeakPolarHBondContact O-CB 3.3Å; I110-Q114 WeakPolarHBondContact O-CG 3.38Å; I110-Q114 PolarHBondContact O-N 2.81Å; R112-Q114 VanDerWaalsContact C-N 3.3Å; R112-Q114 PolarHBondContact O-N 2.81Å; Q114-M116 VanDerWaalsContact C-N 3.29Å; Q114-M116 PolarHBondContact O-N 3.24Å; Q114-G117 PolarHBondContact O-N 3.38Å; Q114-M119 WeakPolarHBondContact CA-O 3.33Å; Q114-M119 HydrophobicContact CG-CE 3.83Å; Q114-P120 PolarHBondContact NE2-O 3.28Å; Q114-V121 HydrophobicContact CB-CG2 3.86Å; Q114-V121 HydrophobicContact CG-CG2 3.83Å
115K98.1Very high97.3Very high187 Ų18769.3 Ų69.381%0.81335%0.345SS*.Hα-helixtrans-64.9-32.3178.6-74.2179.8178.9-165.80113.4K111 R112 G117K111-K115 VanDerWaalsContact O-CG 3.29Å; K111-K115 WeakPolarHBondContact O-CG 3.36Å; K111-K115 PolarHBondContact O-N 3.43Å; K111-K115 VanDerWaalsContact O-N 3.12Å; R112-K115 PolarHBondContact O-N 3.47Å; K115-G117 VanDerWaalsContact C-N 3.3Å
116M97.5Very high97.2Very high102 Ų10270.2 Ų70.250%0.50236%0.357SS..THydrogen-bonded Turntrans-84.1-4.4178.5-70.9176.917200113.1Y73 R112 A113 Q114 F118Y73-M116 HydrophobicContact CD2-SD 3.76Å; Y73-M116 HydrophobicContact CE2-CE 4.35Å; Y73-M116 HydrophobicContact CE2-SD 3.35Å; Y73-M116 WeakPolarHBondContact CE2-SD 3.47Å; R112-M116 HydrophobicContact CG-CE 3.74Å; R112-M116 HydrophobicContact CG-CG 4.48Å; R112-M116 HydrophobicContact CG-SD 3.75Å; R112-M116 WeakPolarHBondContact O-CB 3.31Å; R112-M116 WeakPolarHBondContact O-CG 3.25Å; R112-M116 PolarHBondContact O-N 2.89Å; A113-M116 PolarHBondContact O-N 3.19Å; Q114-M116 VanDerWaalsContact C-N 3.29Å; Q114-M116 PolarHBondContact O-N 3.24Å; M116-F118 HydrophobicContact CB-CD2 3.54Å; M116-F118 HydrophobicContact CB-CE2 3.73Å; M116-F118 HydrophobicContact CG-CE2 4.49Å; M116-F118 HydrophobicContact SD-CD2 4.4Å; M116-F118 HydrophobicContact SD-CE2 4.09Å
117G96.7Very high97.1Very high67 Ų6773.7 Ų73.769%0.69139%0.386SS*.THydrogen-bonded Turntrans80.411.218000000115.1A113 Q114 K115A113-G117 PolarHBondContact O-N 3.13Å; A113-G117 VanDerWaalsContact O-N 3.13Å; Q114-G117 PolarHBondContact O-N 3.38Å; K115-G117 VanDerWaalsContact C-N 3.3Å
118F97.2Very high97Very high99 Ų9974.5 Ų74.543%0.43439%0.386SS..SBendtrans-76.7-25.2175.8-71.9-70.5000113.1Y73 I76 A113 M116Y73-F118 HydrophobicContact CD2-CD2 4.27Å; Y73-F118 HydrophobicContact CD2-CE2 4.35Å; Y73-F118 HydrophobicContact CE2-CD2 4.3Å; Y73-F118 AromaticContact CE2-CE2 3.92Å; Y73-F118 HydrophobicContact CE2-CE2 3.92Å; I76-F118 HydrophobicContact CD1-CB 4.06Å; I76-F118 WeakPolarHBondContact CD1-O 3.24Å; I76-F118 HydrophobicContact CG1-CB 4.15Å; A113-F118 HydrophobicContact CB-CB 4.19Å; A113-F118 PolarHBondContact O-N 3.39Å; M116-F118 HydrophobicContact CB-CD2 3.54Å; M116-F118 HydrophobicContact CB-CE2 3.73Å; M116-F118 HydrophobicContact CG-CE2 4.49Å; M116-F118 HydrophobicContact SD-CD2 4.4Å; M116-F118 HydrophobicContact SD-CE2 4.09Å
119M96.8Very high96.8Very high11 Ų1172.1 Ų72.15%0.05438%0.379CS..SBendtrans-140.8136.8-174.5-170.6174.566.800111.5I76 L79 I83 I110 A113 Q114I76-M119 HydrophobicContact CG2-CB 4.33Å; I76-M119 HydrophobicContact CG2-CG 4.15Å; I76-M119 HydrophobicContact CG2-SD 4.36Å; L79-M119 HydrophobicContact CB-SD 4.11Å; I83-M119 HydrophobicContact CD1-CE 3.35Å; I83-M119 HydrophobicContact CD1-SD 3.53Å; I83-M119 VanDerWaalsContact CD1-SD 3.53Å; I110-M119 HydrophobicContact CB-CE 3.94Å; I110-M119 HydrophobicContact CG1-CE 4.01Å; I110-M119 HydrophobicContact CG2-CE 3.45Å; I110-M119 VanDerWaalsContact CG2-CE 3.45Å; A113-M119 HydrophobicContact CB-CB 4.13Å; A113-M119 PolarHBondContact O-N 2.98Å; Q114-M119 WeakPolarHBondContact CA-O 3.33Å; Q114-M119 HydrophobicContact CG-CE 3.83Å
120P96.9Very high96.5Very high35 Ų3581.7 Ų81.723%0.22742%0.42CS..  trans-63.3152175.423.8-32.9000112.7Q114 Y123 D125Q114-P120 PolarHBondContact NE2-O 3.28Å; P120-Y123 HydrophobicContact CB-CD2 4.4Å; P120-Y123 HydrophobicContact CB-CE2 4.17Å; P120-Y123 WeakPolarHBondContact CB-O 3.43Å; P120-Y123 HydrophobicContact CG-CD2 4.35Å; P120-Y123 HydrophobicContact CG-CE2 4.2Å; P120-Y123 VanDerWaalsContact CG-O 3.23Å; P120-Y123 WeakPolarHBondContact CG-O 3.35Å; P120-D125 HydrophobicContact CG-CB 4.25Å
121V97.1Very high96.3Very high86 Ų8682.9 Ų82.952%0.52143%0.426SS..SBendtrans-93.1-39.2179.8-178.90000111.9G88 Q114G88-V121 WeakPolarHBondContact CA-O 3.42Å; Q114-V121 HydrophobicContact CB-CG2 3.86Å; Q114-V121 HydrophobicContact CG-CG2 3.83Å
122T96.5Very high96.1Very high97 Ų9781.9 Ų81.960%0.59543%0.432SS*.SBendtrans-88.9-25.2-167.745.20000113.9T87 G88T87-T122 CarbonylContact C-O 3.04Å; T87-T122 VanDerWaalsContact O-O 3.12Å; G88-T122 PolarHBondContact N-O 3.27Å
123Y95.4Very high95.7Very high128 Ų12884.2 Ų84.250%0.50245%0.445SS..SBendtrans-147.1165.8-178.458-92.3000110.3P120P120-Y123 HydrophobicContact CB-CD2 4.4Å; P120-Y123 HydrophobicContact CB-CE2 4.17Å; P120-Y123 WeakPolarHBondContact CB-O 3.43Å; P120-Y123 HydrophobicContact CG-CD2 4.35Å; P120-Y123 HydrophobicContact CG-CE2 4.2Å; P120-Y123 VanDerWaalsContact CG-O 3.23Å; P120-Y123 WeakPolarHBondContact CG-O 3.35Å
124K95.6Very high95.3Very high30 Ų3085.9 Ų85.913%0.1346%0.456CS..  trans-84.5134.7171.3-172.6-177.1176.1-1760109.6S80 P85 Y128S80-K124 WeakPolarHBondContact O-CE 3.29Å; S80-K124 WeakPolarHBondContact OG-CE 3.23Å; S80-K124 WeakPolarHBondContact OG-CG 3.46Å; P85-K124 HydrophobicContact CB-CB 4.49Å; P85-K124 HydrophobicContact CB-CD 4.41Å; P85-K124 PolarHBondContact O-N 3.12Å; K124-Y128 WeakPolarHBondContact CE-O 3.33Å; K124-Y128 PolarHBondContact NZ-O 3.09Å
125D95.4Very high94.9Very high53 Ų5384.7 Ų84.728%0.28345%0.451SS..  trans-56.1126.1177.1173-4.9000110.8P120 A127 Y128P120-D125 HydrophobicContact CG-CB 4.25Å; D125-A127 PolarHBondContact O-N 3.29Å; D125-A127 VanDerWaalsContact O-N 3.11Å; D125-A127 WeakPolarHBondContact OD1-CB 3.35Å; D125-A127 PolarHBondContact OD1-N 3.42Å; D125-Y128 HydrophobicContact CB-CD2 3.85Å; D125-Y128 HydrophobicContact CB-CE2 4.2Å; D125-Y128 PolarHBondContact O-N 3.46Å; D125-Y128 WeakPolarHBondContact OD2-CE2 3.46Å
126P95.3Very high94.3Very high95 Ų9583.1 Ų83.162%0.61745%0.452SS*.G310 helixtrans-52.9-29.2-179.2-27.934.9000114.7Y128 L129P126-Y128 PolarHBondContact O-N 2.89Å; P126-L129 WeakPolarHBondContact O-CB 3.48Å; P126-L129 PolarHBondContact O-N 3.2Å
127A95.7Very high93.9Very high73 Ų7380.4 Ų80.460%0.60344%0.439SS*.G310 helixtrans-59.1-34.6178.700000112.4D125D125-A127 PolarHBondContact O-N 3.29Å; D125-A127 VanDerWaalsContact O-N 3.11Å; D125-A127 WeakPolarHBondContact OD1-CB 3.35Å; D125-A127 PolarHBondContact OD1-N 3.42Å
128Y95.6Very high93.5Very high56 Ų5688.9 Ų88.922%0.2245%0.45CS..G310 helixtrans-99.49.3-175.4-54.6-61.5000113.4I76 Q77 S80 K124 D125 P126 K130 D131I76-Y128 HydrophobicContact CB-CE2 4.29Å; I76-Y128 HydrophobicContact CG2-CD2 4.22Å; I76-Y128 HydrophobicContact CG2-CE2 3.64Å; Q77-Y128 HydrophobicContact CB-CD1 3.89Å; Q77-Y128 HydrophobicContact CB-CE1 3.71Å; Q77-Y128 HydrophobicContact CG-CD1 3.75Å; Q77-Y128 HydrophobicContact CG-CE1 3.99Å; S80-Y128 WeakPolarHBondContact OG-CB 3.45Å; K124-Y128 WeakPolarHBondContact CE-O 3.33Å; K124-Y128 PolarHBondContact NZ-O 3.09Å; D125-Y128 HydrophobicContact CB-CD2 3.85Å; D125-Y128 HydrophobicContact CB-CE2 4.2Å; D125-Y128 PolarHBondContact O-N 3.46Å; D125-Y128 WeakPolarHBondContact OD2-CE2 3.46Å; P126-Y128 PolarHBondContact O-N 2.89Å; Y128-K130 VanDerWaalsContact C-N 3.28Å; Y128-K130 PolarHBondContact O-N 3.23Å; Y128-D131 WeakPolarHBondContact CB-OD2 3.47Å; Y128-D131 PolarHBondContact O-N 3.03Å
129L93.1Very high92.9Very high101 Ų10188.5 Ų88.553%0.52945%0.446SS..THydrogen-bonded Turntrans-69.1-29.8-177-170.262000112.4P85 P126 D131P85-L129 HydrophobicContact CB-CD1 3.77Å; P126-L129 WeakPolarHBondContact O-CB 3.48Å; P126-L129 PolarHBondContact O-N 3.2Å; L129-D131 VanDerWaalsContact C-N 3.34Å
130K93.4Very high92.1Very high208 Ų20899.9 Ų99.990%0.90449%0.488SS*.THydrogen-bonded Turntrans-86.4-0.3-178-60.7-179.2-177.9179.20114.1Y128Y128-K130 VanDerWaalsContact C-N 3.28Å; Y128-K130 PolarHBondContact O-N 3.23Å
131D93.7Very high90.5Very high26 Ų26110.5 Ų110.514%0.13954%0.535CS..SBendtrans-62.6152.9177.6-75.4-28.5000112.2Q77 Q81 Y128 L129 K133Q77-D131 WeakPolarHBondContact CG-OD2 3.35Å; Q77-D131 PolarHBondContact NE2-OD1 3.4Å; Q77-D131 VanDerWaalsContact NE2-OD1 3.12Å; Q81-D131 HydrophobicContact CG-CB 4.41Å; Y128-D131 WeakPolarHBondContact CB-OD2 3.47Å; Y128-D131 PolarHBondContact O-N 3.03Å; L129-D131 VanDerWaalsContact C-N 3.34Å; D131-K133 PolarHBondContact O-N 3.3Å
132P93.4Very high90.2Very high97 Ų97111.7 Ų111.763%0.6354%0.536SS*.  trans-57.6130.3176.724.2-34.1000111.1V134P132-V134 PolarHBondContact O-N 3.45Å
133K89.9Confident89.9Confident180 Ų180112.5 Ų112.578%0.78353%0.533SS*.  trans-78.3108.1-178.1-65.5-179.6-177.7176.30110D131D131-K133 PolarHBondContact O-N 3.3Å
134V90.9Very high89.6Confident36 Ų36111.6 Ų111.622%0.21853%0.534CS..  trans-78.4-30.2174.7178.70000112I65 F82 P132I65-V134 HydrophobicContact CD1-CG1 3.4Å; F82-V134 HydrophobicContact CE1-CG1 4.28Å; P132-V134 PolarHBondContact O-N 3.45Å
135C89.4Confident89.2Confident12 Ų12116.4 Ų116.48%0.08156%0.558CS.*SBendtrans-89.9128.5-175.9-63.50000110.9Y91 I95 I137Y91-C135 HydrophobicContact CD2-CB 4.02Å; Y91-C135 WeakPolarHBondContact CD2-SG 3.45Å; Y91-C135 HydrophobicContact CE2-CB 4Å; I95-C135 HydrophobicContact CG2-CB 3.79Å; C135-I137 HydrophobicContact CB-CG1 4.44Å; C135-I137 PolarHBondContact O-N 3.1Å
136N84.4Confident88.8Confident153 Ų153120.4 Ų120.482%0.81858%0.575SS**  trans-79.157.5-179.9-63.7-41000112.1
137I89Confident88.4Confident46 Ų46122.1 Ų122.124%0.23657%0.573CS.*PPolyproline II helixtrans-103.7126.7175-56.8-177.2000109.2Y91 I95 C135 Y139Y91-I137 HydrophobicContact CD1-CD1 3.43Å; Y91-I137 VanDerWaalsContact CD1-CD1 3.43Å; Y91-I137 HydrophobicContact CD2-CD1 4.46Å; Y91-I137 HydrophobicContact CE1-CD1 3.01Å; Y91-I137 HydrophobicContact CE1-CG1 4.46Å; Y91-I137 HydrophobicContact CE2-CD1 4.13Å; Y91-I137 HydrophobicContact CG-CD1 4.14Å; I95-I137 HydrophobicContact CD1-CD1 3.79Å; I95-I137 HydrophobicContact CD1-CG1 4.24Å; I95-I137 HydrophobicContact CG2-CD1 3.67Å; I95-I137 HydrophobicContact CG2-CG1 3.38Å; C135-I137 HydrophobicContact CB-CG1 4.44Å; C135-I137 PolarHBondContact O-N 3.1Å; I137-Y139 HydrophobicContact CB-CE2 4.48Å; I137-Y139 HydrophobicContact CG2-CD1 4.44Å; I137-Y139 HydrophobicContact CG2-CD2 4.28Å; I137-Y139 HydrophobicContact CG2-CE1 4.1Å; I137-Y139 HydrophobicContact CG2-CE2 3.92Å
138R88.3Confident87.9Confident244 Ų244125.6 Ų125.692%0.92157%0.57SS**PPolyproline II helixtrans-100.9117.5165.2-60.8-174.6-175.4-175.30.7107.3
139Y84.3Confident87.3Confident91 Ų91130.9 Ų130.936%0.35760%0.597SS.*PPolyproline II helixtrans-76.6149166.3-66.1-77.5000108P85 F86 Y91 I137 E141P85-Y139 VanDerWaalsContact CD-OH 3.3Å; P85-Y139 WeakPolarHBondContact CD-OH 3.11Å; P85-Y139 HydrophobicContact CG-CE2 4.08Å; F86-Y139 HydrophobicContact CD2-CD1 4.41Å; F86-Y139 HydrophobicContact CD2-CE1 4.17Å; F86-Y139 HydrophobicContact CE2-CD1 4.15Å; F86-Y139 HydrophobicContact CE2-CD2 4.23Å; F86-Y139 HydrophobicContact CE2-CE1 4.25Å; F86-Y139 HydrophobicContact CE2-CE2 4.33Å; F86-Y139 HydrophobicContact CE2-CG 4.14Å; Y91-Y139 PolarHBondContact OH-OH 3.32Å; I137-Y139 HydrophobicContact CB-CE2 4.48Å; I137-Y139 HydrophobicContact CG2-CD1 4.44Å; I137-Y139 HydrophobicContact CG2-CD2 4.28Å; I137-Y139 HydrophobicContact CG2-CE1 4.1Å; I137-Y139 HydrophobicContact CG2-CE2 3.92Å; Y139-E141 PolarHBondContact O-N 3.42Å
140R80.5Confident86.8Confident250 Ų250133.4 Ų133.494%0.94360%0.603SS**PPolyproline II helixtrans-67.9117.9170.6-169.9175-176.5172.91.1106.9
141E64.5Low86.2Confident258 Ų258126.6 Ų126.6100%1.20658%0.576SS**  trans-67.80172.1-65.7175.4178.200110.7Y139Y139-E141 PolarHBondContact O-N 3.42Å

Retrieved 141 of 141 residues in 106.8 ms (Link to these results)