A0A096MQW1_PAPAN Loading...

Pancreas/duodenum homeobox protein 1

AlphaFold DB , UniProt , Accession A0A096MQW1, Species PAPAN (Papio anubis, Olive baboon), Gene PDX1, Length 281 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
1M40Very low44.9Very low229 Ų229157.5 Ų157.5100%1.12884%0.835SS**  083.20-74.7154.9143.600105.8
2N38.3Very low45.6Very low167 Ų167157.8 Ų157.889%0.89383%0.828SS**  64.3117.598.3-62.4-9.2000109.6
3G41.8Very low46.2Very low64 Ų64159.3 Ų159.366%0.6684%0.836SS**  cis152.9114.810.800000107.3
4E48.3Very low46.3Very low177 Ų177162.9 Ų162.983%0.82784%0.835SS**  trans56.4108.2134.9-27.8-167.415400118Q6E4-Q6 PolarHBondContact O-N 2.73Å
5E52.9Low46.4Very low203 Ų203165.3 Ų165.395%0.94984%0.837SS**  trans-52.4105161.8-78.4173.697.100110.6Y7E5-Y7 VanDerWaalsContact C-N 3.29Å; E5-Y7 PolarHBondContact O-N 2.9Å
6Q48Very low46.3Very low170 Ų170162.9 Ų162.979%0.79483%0.827SS**  trans-74.283.3171.4-78.3-89.8-28.200110E4 Y8E4-Q6 PolarHBondContact O-N 2.73Å; Q6-Y8 PolarHBondContact O-N 3.41Å
7Y48.9Very low46.4Very low201 Ų201159.8 Ų159.879%0.78882%0.82SS**  trans-6598.7150.9-161.2-90.9000107.5E5E5-Y7 VanDerWaalsContact C-N 3.29Å; E5-Y7 PolarHBondContact O-N 2.9Å
8Y39.6Very low46Very low202 Ų202158 Ų15879%0.79282%0.823SS**  trans173.6139.4147.3-103.8-73000113.5Q6Q6-Y8 PolarHBondContact O-N 3.41Å
9A39.7Very low46.2Very low92 Ų92154.6 Ų154.676%0.7682%0.82SS**  trans90.7135.9133.500000121.4
10A45.1Very low46Very low93 Ų93156.5 Ų156.577%0.76982%0.821SS**  trans94.558.1154.100000118.5Q12A10-Q12 VanDerWaalsContact C-N 3.29Å; A10-Q12 PolarHBondContact O-N 3.19Å; A10-Q12 VanDerWaalsContact O-N 3.11Å
11T51.3Low46.1Very low135 Ų135158.3 Ų158.383%0.82883%0.825SS**  trans-63.387.5137.4400000110.2
12Q53.1Low46.4Very low160 Ų160159.1 Ų159.175%0.74882%0.816SS**  trans178.498.5158.4-83.2-38.8-52.200108.8A10A10-Q12 VanDerWaalsContact C-N 3.29Å; A10-Q12 PolarHBondContact O-N 3.19Å; A10-Q12 VanDerWaalsContact O-N 3.11Å
13L53.3Low47.2Very low178 Ų178154 Ų15493%0.93280%0.803SS**  trans178.355.5152.8-101.3153.6000114.6
14Y48.6Very low47.6Very low209 Ų209157.3 Ų157.382%0.8281%0.812SS**  trans-149.482.9150.7-149.3-101.1000110.4
15K46.5Very low47.8Very low200 Ų200153.2 Ų153.287%0.8781%0.809SS**  trans-140.678.1167.5-140.5167.3-174.7-177.90107.3P17K15-P17 WeakPolarHBondContact O-CD 3.44Å
16D45.4Very low47.7Very low126 Ų126149.5 Ų149.567%0.67480%0.803SS**  trans-64.8119161-112.9-62.2000107.8C18D16-C18 PolarHBondContact O-N 2.83Å; D16-C18 VanDerWaalsContact O-N 3.16Å
17P48.8Very low47.5Very low110 Ų110150.5 Ų150.571%0.71481%0.807SS**  trans-72.8107.7172.427.9-28.4000108.3K15 A19K15-P17 WeakPolarHBondContact O-CD 3.44Å; P17-A19 PolarHBondContact O-N 2.85Å
18C39.3Very low47.4Very low128 Ų128150.4 Ų150.487%0.86581%0.811SS**  trans-59.1106.7170.3-1560000108.8D16 F20D16-C18 PolarHBondContact O-N 2.83Å; D16-C18 VanDerWaalsContact O-N 3.16Å; C18-F20 PolarHBondContact O-N 3.46Å
19A48.7Very low48Very low93 Ų93145.3 Ų145.377%0.76981%0.805SS**  trans-74.267.9-179.500000111.6P17P17-A19 PolarHBondContact O-N 2.85Å
20F41.9Very low48.8Very low192 Ų192145.4 Ų145.484%0.84281%0.806SS**  trans-136.675.4160.5-113.1-87.4000109.3C18 R22C18-F20 PolarHBondContact O-N 3.46Å; F20-R22 PolarHBondContact O-N 3.32Å; F20-R22 VanDerWaalsContact O-N 3.08Å
21Q48.4Very low49.3Very low195 Ų195145 Ų14591%0.91180%0.798SS**  trans-58.7105.7169.5-143.415166.900107.8G23Q21-G23 PolarHBondContact O-N 3.48Å
22R46.2Very low49.8Very low247 Ų247144.2 Ų144.293%0.93280%0.795SS**PPolyproline II helixtrans-64.6120166.8-82.3-172.6179.6128.6-0.6107.5F20F20-R22 PolarHBondContact O-N 3.32Å; F20-R22 VanDerWaalsContact O-N 3.08Å
23G56.2Low50.1Low60 Ų60142.3 Ų142.362%0.61980%0.796SS**PPolyproline II helixtrans-60.5166.2170.100000112.4Q21Q21-G23 PolarHBondContact O-N 3.48Å
24P50.4Low50.1Low132 Ų132137.9 Ų137.986%0.85779%0.785SS**PPolyproline II helixtrans-62.2138.9-179.426.6-32.6000110.8
25A50.4Low50.5Low92 Ų92134 Ų13476%0.7679%0.787SS**PPolyproline II helixtrans-57.9134-178.700000111.6
26P51.2Low50.9Low125 Ų125131.2 Ų131.281%0.81278%0.781SS**PPolyproline II helixtrans-70.7139.8161.830.5-30.1000108.6F28P26-F28 PolarHBondContact O-N 3.06Å
27E44Very low51.2Low191 Ų191134.4 Ų134.489%0.89379%0.785SS**PPolyproline II helixtrans-46.7130.9-175.3-65.2168.2120.100112.5S29E27-S29 PolarHBondContact O-N 2.64Å
28F48Very low51.6Low198 Ų198136.1 Ų136.187%0.86879%0.785SS**  trans-67.592.3174.7-171-94.7000108.8P26 A30P26-F28 PolarHBondContact O-N 3.06Å; F28-A30 PolarHBondContact O-N 3.2Å; F28-A30 VanDerWaalsContact O-N 3.13Å
29S51.6Low51.9Low96 Ų96132.4 Ų132.467%0.67177%0.769SS**  trans-61.6111.7166.1178.80000108.5E27 S31E27-S29 PolarHBondContact O-N 2.64Å; S29-S31 PolarHBondContact O-N 3.46Å
30A56.1Low51.9Low93 Ų93138.9 Ų138.977%0.76977%0.773SS**SBendtrans-71.972.3170.300000109.6F28F28-A30 PolarHBondContact O-N 3.2Å; F28-A30 VanDerWaalsContact O-N 3.13Å
31S55.6Low52.5Low86 Ų86138 Ų13860%0.60177%0.772SS**  trans-155.1107.4165.7-156.50000108.8S29S29-S31 PolarHBondContact O-N 3.46Å
32P62.5Low53.3Low118 Ų118133.4 Ų133.477%0.76676%0.759SS**PPolyproline II helixtrans-62.5133.2175.825.9-31.1000108.2A34P32-A34 PolarHBondContact O-N 2.91Å
33P58.1Low54.6Low119 Ų119127.1 Ų127.177%0.77375%0.75SS**PPolyproline II helixtrans-58.7128.3175.424.4-31.9000108.2C35P33-C35 PolarHBondContact O-N 2.69Å; P33-C35 VanDerWaalsContact O-N 3.17Å
34A55Low55.4Low85 Ų85129.9 Ų129.970%0.70276%0.757SS**PPolyproline II helixtrans-47.2126.9169.100000107.6P32 L36P32-A34 PolarHBondContact O-N 2.91Å; A34-L36 VanDerWaalsContact C-N 3.29Å; A34-L36 PolarHBondContact O-N 3.16Å
35C55.9Low56.7Low128 Ų128129.2 Ų129.287%0.86575%0.753SS**  trans-57.197.8177-610000108.1P33 Y37P33-C35 PolarHBondContact O-N 2.69Å; P33-C35 VanDerWaalsContact O-N 3.17Å; C35-Y37 PolarHBondContact O-N 3.48Å
36L55.1Low57.8Low141 Ų141130.4 Ų130.474%0.73875%0.753SS**  trans-66.988.7165.9-70.3178.6000105.7A34 M38A34-L36 VanDerWaalsContact C-N 3.29Å; A34-L36 PolarHBondContact O-N 3.16Å; L36-M38 HydrophobicContact CB-CE 4.17Å; L36-M38 HydrophobicContact CB-CG 4.46Å; L36-M38 HydrophobicContact CD1-CE 4.44Å; L36-M38 HydrophobicContact CD2-CE 4.4Å; L36-M38 PolarHBondContact O-N 3.4Å
37Y50.8Low58.9Low193 Ų193129.6 Ų129.676%0.75775%0.748SS**  trans-61.779156.2-172.4-98.4000106.3C35 G39C35-Y37 PolarHBondContact O-N 3.48Å; Y37-G39 PolarHBondContact O-N 2.81Å
38M57.7Low60.3Low146 Ų146125.5 Ų125.572%0.71974%0.738SS**  trans-57.9109.4165.3-76.3-72.7103.300105.7L36L36-M38 HydrophobicContact CB-CE 4.17Å; L36-M38 HydrophobicContact CB-CG 4.46Å; L36-M38 HydrophobicContact CD1-CE 4.44Å; L36-M38 HydrophobicContact CD2-CE 4.4Å; L36-M38 PolarHBondContact O-N 3.4Å
39G45.2Very low60.9Low50 Ų50122.1 Ų122.152%0.51574%0.735SS.*  trans-50.3147.3-178.900000111Y37 Q41Y37-G39 PolarHBondContact O-N 2.81Å; G39-Q41 PolarHBondContact O-N 3.38Å
40R48.7Very low61.3Low229 Ų229126.8 Ų126.886%0.86474%0.744SS**  trans-49.7103.8163.8-83.9-172.9161.3-103.21.4109P42R40-P42 WeakPolarHBondContact O-CD 2.98Å
41Q56.2Low61Low173 Ų173128.2 Ų128.281%0.80875%0.746SS**PPolyproline II helixtrans-62.5122.6157-77.1-74.7-15.500107G39G39-Q41 PolarHBondContact O-N 3.38Å
42P65.4Low60.8Low100 Ų100128 Ų12865%0.64976%0.756SS**PPolyproline II helixtrans-62.9147.7169.126.3-30.7000109.4R40R40-P42 WeakPolarHBondContact O-CD 2.98Å
43P72.6Confident59.6Low115 Ų115126.7 Ų126.775%0.74776%0.756SS**PPolyproline II helixtrans-60.5146.9175.926.7-33.6000110.5
44P73.8Confident58.8Low118 Ų118129.3 Ų129.377%0.76676%0.762SS**PPolyproline II helixtrans-62.1146.9177.626.5-33.8000111
45P76.4Confident57.8Low117 Ų117128.8 Ų128.876%0.7677%0.765SS**PPolyproline II helixtrans-65.3153.2176.427.9-34000111.5
46P73.8Confident56.9Low118 Ų118127.3 Ų127.377%0.76676%0.762SS**PPolyproline II helixtrans-63.5147.8174.727.6-33.8000111
47P73.9Confident56Low108 Ų108128.4 Ų128.470%0.70177%0.768SS**PPolyproline II helixtrans-64.9149.4178.327.8-34.1000111.3
48P74.5Confident55.4Low105 Ų105126.1 Ų126.168%0.68276%0.764SS**PPolyproline II helixtrans-66.3153.4176.728.6-34000111.1F50P48-F50 PolarHBondContact O-N 2.8Å
49P60.1Low54.5Low126 Ų126127.3 Ų127.382%0.81877%0.768SS**PPolyproline II helixtrans-64.1123.6169.727.5-31.6000108.7
50F59.4Low54.1Low194 Ų194129 Ų12985%0.85179%0.785SS**PPolyproline II helixtrans-57128.9176.6-69.4-85.3000110.3P48 G52P48-F50 PolarHBondContact O-N 2.8Å; F50-G52 PolarHBondContact O-N 3.35Å
51P50.3Low53.8Low124 Ų124123.4 Ų123.481%0.80578%0.781SS**PPolyproline II helixtrans-72.5118.4163.827.6-27.2000108.1A53P51-A53 PolarHBondContact O-N 3.27Å
52G51.1Low54.2Low80 Ų80120.4 Ų120.483%0.82578%0.777SS**PPolyproline II helixtrans-64.9127.8169.500000111F50F50-G52 PolarHBondContact O-N 3.35Å
53A38.3Very low53.8Low92 Ų92121.2 Ų121.276%0.7678%0.782SS**  trans-172.3144.5158.400000107.6P51P51-A53 PolarHBondContact O-N 3.27Å
54L40.4Very low52.2Low174 Ų174122.5 Ų122.591%0.91178%0.783SS**  cis-168.7146.8-24.6-120.8172.6000103.9
55G34.1Very low50.6Low73 Ų73125 Ų12575%0.75379%0.788SS**  trans93.9136.9164.700000115.3
56A36.7Very low49.2Very low98 Ų98124.4 Ų124.481%0.8179%0.786SS**  cis-168.5136.55.600000107.5
57L37Very low48.1Very low163 Ų163124.5 Ų124.585%0.85379%0.787SS**  trans177.5117.1132.7-152.179.1000110.3
58E38.1Very low46.7Very low146 Ų146130 Ų13068%0.68280%0.795SS**  trans48.8131.9147.6-79.1-138.896.700125.2
59Q39Very low45.3Very low170 Ų170132.7 Ų132.779%0.79480%0.799SS**  trans88.6106.1136.6-81172.3500120.8
60G36.6Very low45.1Very low85 Ų85132.9 Ų132.988%0.87680%0.797SS**  trans139.898.5150.500000114.3
61S42.5Very low44.6Very low113 Ų113128 Ų12879%0.7979%0.785SS**  trans-114.7174.9168.7-163.70000108.3
62P63.9Low44.6Very low109 Ų109128.3 Ų128.371%0.70879%0.787SS**  cis-128.2-159.6-21.713.915.2000110.1
63P57.4Low44Very low118 Ų118132.9 Ų132.977%0.76679%0.791SS**  cis-140.6158.614.240.5-18.6000119.7
64D38.8Very low44.3Very low142 Ų142133.1 Ų133.176%0.75979%0.794SS**  trans63.7102.2131.1-160.325.7000119.6
65I39.6Very low44.4Very low171 Ų171132 Ų13288%0.87779%0.788SS**  -160.6130119.131.2167.5000110.9
66S47.3Very low44.7Very low103 Ų103134.7 Ų134.772%0.7279%0.786SS**  trans-55.6154.2-178.3-173.50000116.2
67P51.3Low45.4Very low120 Ų120134.9 Ų134.978%0.77978%0.779SS**  trans-79.7134.7174.733.2-33.4000111.1
68Y43.3Very low45.2Very low225 Ų225131.2 Ų131.288%0.88277%0.772SS**  trans-115.1115.6163.1-142.8-95.2000110.5
69E46.1Very low45.2Very low161 Ų161131.1 Ų131.175%0.75278%0.781SS**  trans-65.8138.3173.1-146-177.7125.300110.3
70V56.4Low45.3Very low130 Ų130126.7 Ų126.779%0.78877%0.773SS**  trans-133.2110162-177.30000108.4
71P49.2Very low45.6Very low90 Ų90130.8 Ų130.858%0.58477%0.769SS**  trans-69.9149.3171.7-21.133.7000112.8
72P50.2Low45.5Very low131 Ų131132.6 Ų132.685%0.85177%0.769SS**  trans-81.2135.3175.533.6-30.3000110.1
73L38.7Very low44.5Very low176 Ų176134.5 Ų134.592%0.92177%0.769SS**  trans-106.5132.3173.4-90.4165.2000111.3
74A43.3Very low43.8Very low98 Ų98137.1 Ų137.181%0.8177%0.77SS**  trans9392.6158.800000119.2
75D42.3Very low43.9Very low149 Ų149137.5 Ų137.580%0.79777%0.767SS**  trans-47149.4138.5-141.5-131.5000110.4
76D40Very low44.3Very low130 Ų130137 Ų13770%0.69577%0.765SS**  cis-173.1-17142.9-163.2-138.1000107.9
77P52.3Low44.3Very low102 Ų102138 Ų13866%0.66277%0.769SS**  -125.7164.7-95.141-23.3000114.6
78A34Very low43.7Very low87 Ų87136.9 Ų136.972%0.71977%0.77SS**  trans155.1110.7131.700000113.2
79V38.1Very low43.7Very low144 Ų144134.5 Ų134.587%0.87377%0.767SS**  trans58.8124.1130.4-169.60000117.5
80A40.7Very low43.6Very low76 Ų76135 Ų13563%0.62877%0.774SS**  cis-164.714113.400000111.8
81H42.9Very low42.8Very low172 Ų172133 Ų13380%0.79677%0.772SS**  trans26.3105.7133.4-76.275.5000119.9
82L39.9Very low42.6Very low150 Ų150136.1 Ų136.179%0.78578%0.783SS**  trans-101.481.6160.7-141.7158.7000109.8H84L82-H84 VanDerWaalsContact CD2-CE1 3.46Å; L82-H84 WeakPolarHBondContact CD2-CE1 2.9Å; L82-H84 WeakPolarHBondContact CD2-ND1 3.43Å
83H41.9Very low42.5Very low150 Ų150135 Ų13569%0.69478%0.775SS**  trans-93.696.6177.6-139.5-109.7000109H85H83-H85 PolarHBondContact O-N 2.85Å; H83-H85 PolarHBondContact O-ND1 3Å
84H43.3Very low43Very low172 Ų172133.8 Ų133.880%0.79677%0.765SS**  trans-80.1100.3171.2-95.380.1000109.9L82L82-H84 VanDerWaalsContact CD2-CE1 3.46Å; L82-H84 WeakPolarHBondContact CD2-CE1 2.9Å; L82-H84 WeakPolarHBondContact CD2-ND1 3.43Å
85H41.6Very low43.3Very low150 Ų150135 Ų13569%0.69476%0.764SS**  trans-84.1138174.246-77.7000110H83H83-H85 PolarHBondContact O-N 2.85Å; H83-H85 PolarHBondContact O-ND1 3Å
86L47.6Very low43.7Very low161 Ų161133.7 Ų133.784%0.84376%0.764SS**  trans-60.5148.5161.7-87.290.5000109.9
87P46.8Very low44Very low124 Ų124133.5 Ų133.581%0.80577%0.773SS**  trans-96114.7154.231.4-22.2000109.9
88A38.3Very low43.5Very low96 Ų96132.2 Ų132.279%0.79378%0.777SS**  trans-74.3150.915600000109.8
89Q45Very low44.4Very low175 Ų175133.5 Ų133.582%0.81878%0.779SS**  trans-39.4142.2174.7-56.2-86.71900114.6
90L43.5Very low44.3Very low171 Ų171136.3 Ų136.390%0.89578%0.78SS**  170.3146.9116.9-89.9167.4000112.4
91A38.4Very low45Very low90 Ų90138.5 Ų138.574%0.74479%0.787SS**  trans84.6111.2159.100000119.2
92L45.3Very low44.9Very low155 Ų155139.9 Ų139.981%0.81279%0.794SS**  trans-57.9142.9160.7-153.382.3000110.8
93P49.1Very low44.8Very low108 Ų108135.9 Ų135.970%0.70179%0.789SS**  trans-131.6143.3136.833.3-19.3000113.2
94H48.4Very low44.8Very low150 Ų150133.1 Ų133.169%0.69479%0.793SS**PPolyproline II helixtrans-47.1151.8175.1-15.182.4000114.2
95P50.1Low45Very low124 Ų124133.4 Ų133.481%0.80579%0.794SS**PPolyproline II helixtrans-87.4135.9171.734.1-29.4000110.9
96P50.8Low45.3Very low121 Ų121131.6 Ų131.679%0.78680%0.796SS**PPolyproline II helixtrans-92126.3151.331.2-26000109.7
97S46.8Very low45.3Very low126 Ų126127.3 Ų127.388%0.88179%0.791SS**PPolyproline II helixtrans-49.5127.9161.110.90000111
98G40Very low44.9Very low74 Ų74127.6 Ų127.676%0.76379%0.79SS**  trans-119.4135.9165.500000110.2
99P53.5Low45.4Very low115 Ų115130.8 Ų130.875%0.74779%0.793SS**  trans-104.1144.9167.336.7-26.8000112
100F37Very low45.3Very low203 Ų203130.4 Ų130.489%0.8979%0.791SS**  trans79.9127.7164.2-85.9-89.3000121
101P55.2Low45.3Very low121 Ų121130 Ų13079%0.78678%0.784SS**  trans-103.9144.2163.937-26.1000112
102E39.8Very low45.8Very low201 Ų201130.9 Ų130.994%0.93978%0.782SS**  trans-140.7133.7167.6-166.215913400110.6
103G38.3Very low46Very low67 Ų67129.6 Ų129.669%0.69178%0.777SS**  trans101.799.6170.300000114.9
104A42.9Very low46.4Very low92 Ų92136.2 Ų136.276%0.7679%0.787SS**  69.1111.984.300000110.9
105E46.8Very low47.1Very low177 Ų177133.7 Ų133.783%0.82778%0.782SS**  -179.7-177.552.3-104.9-45.188.900109
106P48.7Very low47.8Very low112 Ų112136.8 Ų136.873%0.72779%0.786SS**  -112.2168.4-127.942.9-36.5000116.9
107G46.5Very low49.2Very low72 Ų72133.1 Ų133.174%0.74276%0.76SS**  trans98.474.1139.300000118.5
108V39.4Very low51Low129 Ų129131.9 Ų131.978%0.78275%0.749SS**  trans-134.3118144.5-178.90000107.5E110V108-E110 VanDerWaalsContact C-N 3.27Å; V108-E110 HydrophobicContact CG1-CG 4.37Å; V108-E110 PolarHBondContact O-N 2.9Å
109L46.9Very low53Low164 Ų164133.7 Ų133.786%0.85974%0.736SS**  trans-64.888.2170.2-166.9-177.8000107.5
110E43.9Very low54.2Low167 Ų167132.8 Ų132.878%0.7873%0.73SS**  trans-95.2116.1169.6-101-93.9103.600108.5V108V108-E110 VanDerWaalsContact C-N 3.27Å; V108-E110 HydrophobicContact CG1-CG 4.37Å; V108-E110 PolarHBondContact O-N 2.9Å
111E43.3Very low56.3Low162 Ų162132 Ų13276%0.75772%0.721SS**  trans-30.4120.5172.6-101.5-97.3110.100113.9N113E111-N113 PolarHBondContact O-N 3.46Å
112P47.9Very low57.6Low108 Ų108129.2 Ų129.270%0.70170%0.698SS**SBendtrans-75.7125.4175.529.7-28.4000109.4
113N49.7Very low59.2Low129 Ų129126.3 Ų126.369%0.6968%0.683SS**  trans100.458140.5-146.811.4000118E111 V115E111-N113 PolarHBondContact O-N 3.46Å; N113-V115 PolarHBondContact O-N 3.28Å; N113-V115 WeakPolarHBondContact OD1-CG2 3.31Å
114R58.7Low60.5Low246 Ų246127 Ų12793%0.92868%0.677SS**  trans-86.184.6140.8-76.1-167.6171.3178.61.1108.8Q116R114-Q116 PolarHBondContact O-N 2.71Å
115V62.1Low61.2Low97 Ų97127.7 Ų127.759%0.58867%0.672SS**  trans-51.1111.7164.6-169.90000106.8N113 L117N113-V115 PolarHBondContact O-N 3.28Å; N113-V115 WeakPolarHBondContact OD1-CG2 3.31Å; V115-L117 VanDerWaalsContact C-N 3.27Å; V115-L117 HydrophobicContact CG1-CD2 4.31Å; V115-L117 PolarHBondContact O-N 3.21Å
116Q66Low61.6Low189 Ų189125.4 Ų125.488%0.88366%0.659SS**  trans-66.495.9171.1-67.6-172.142.900106.5R114R114-Q116 PolarHBondContact O-N 2.71Å
117L79.9Confident61.9Low45 Ų45122.6 Ų122.624%0.23665%0.645CS.*  trans-62.8135.1-179-68.1171.2000108.8V115 F119 M122V115-L117 VanDerWaalsContact C-N 3.27Å; V115-L117 HydrophobicContact CG1-CD2 4.31Å; V115-L117 PolarHBondContact O-N 3.21Å; L117-F119 PolarHBondContact O-N 3.36Å; L117-M122 HydrophobicContact CB-CB 4.06Å; L117-M122 HydrophobicContact CB-CG 4.37Å; L117-M122 HydrophobicContact CB-SD 4.33Å; L117-M122 HydrophobicContact CD1-CB 4.27Å; L117-M122 HydrophobicContact CD1-CG 4.12Å; L117-M122 WeakPolarHBondContact CD1-O 3.22Å; L117-M122 HydrophobicContact CD2-SD 4.23Å
118P83.4Confident62.2Low99 Ų99124.8 Ų124.864%0.64364%0.636SS**SBendtrans-58.6-18.7-169-27.433.9000115.6
119F83.6Confident62.8Low113 Ų113120.9 Ų120.950%0.49662%0.617SS.*SBendtrans-128.6136.6-176.2-60-72.5000113.4L117 W121 M122 K123L117-F119 PolarHBondContact O-N 3.36Å; F119-W121 VanDerWaalsContact CB-CD1 3.49Å; F119-W121 HydrophobicContact CB-CG 4.29Å; F119-W121 AromaticContact CG-NE1 3.68Å; F119-W121 PolarHBondContact O-N 2.96Å; F119-M122 HydrophobicContact CB-CB 4.43Å; F119-M122 HydrophobicContact CD2-CE 3.87Å; F119-M122 WeakPolarHBondContact O-CA 3.11Å; F119-M122 VanDerWaalsContact O-CB 3.3Å; F119-M122 WeakPolarHBondContact O-CB 3.43Å; F119-M122 PolarHBondContact O-N 3.31Å; F119-K123 PolarHBondContact O-N 3.05Å
120P78.8Confident63Low96 Ų96121.5 Ų121.562%0.62361%0.608SS**THydrogen-bonded Turntrans-57.7-15.6176.9-30.537.1000117.1K123P120-K123 VanDerWaalsContact CA-CE 3.46Å; P120-K123 HydrophobicContact CB-CD 4.44Å; P120-K123 WeakPolarHBondContact O-CE 3.37Å; P120-K123 WeakPolarHBondContact O-CG 3.2Å
121W80.9Confident63.3Low185 Ų185121.8 Ų121.870%0.70161%0.607SS**THydrogen-bonded Turntrans-85.1-22.8172.562.1-95.5000112.2F119F119-W121 VanDerWaalsContact CB-CD1 3.49Å; F119-W121 HydrophobicContact CB-CG 4.29Å; F119-W121 AromaticContact CG-NE1 3.68Å; F119-W121 PolarHBondContact O-N 2.96Å
122M82.6Confident63.7Low63 Ų63116.7 Ų116.731%0.3160%0.598SS.*THydrogen-bonded Turntrans-84.3-24.3-175.6-147.9-176.2-7600111.7L117 F119 S124L117-M122 HydrophobicContact CB-CB 4.06Å; L117-M122 HydrophobicContact CB-CG 4.37Å; L117-M122 HydrophobicContact CB-SD 4.33Å; L117-M122 HydrophobicContact CD1-CB 4.27Å; L117-M122 HydrophobicContact CD1-CG 4.12Å; L117-M122 WeakPolarHBondContact CD1-O 3.22Å; L117-M122 HydrophobicContact CD2-SD 4.23Å; F119-M122 HydrophobicContact CB-CB 4.43Å; F119-M122 HydrophobicContact CD2-CE 3.87Å; F119-M122 WeakPolarHBondContact O-CA 3.11Å; F119-M122 VanDerWaalsContact O-CB 3.3Å; F119-M122 WeakPolarHBondContact O-CB 3.43Å; F119-M122 PolarHBondContact O-N 3.31Å; M122-S124 PolarHBondContact O-N 3.44Å
123K72.3Confident63.8Low141 Ų141119 Ų11961%0.61360%0.599SS**THydrogen-bonded Turntrans-64.22.3171.158.5174.6179.7-169.40115.2F119 P120 T125F119-K123 PolarHBondContact O-N 3.05Å; P120-K123 VanDerWaalsContact CA-CE 3.46Å; P120-K123 HydrophobicContact CB-CD 4.44Å; P120-K123 WeakPolarHBondContact O-CE 3.37Å; P120-K123 WeakPolarHBondContact O-CG 3.2Å; K123-T125 PolarHBondContact O-N 3.27Å
124S65.7Low63.8Low82 Ų82124 Ų12457%0.57361%0.608SS**  trans-73.383.5163.7-167.50000108.1M122 K126 A127M122-S124 PolarHBondContact O-N 3.44Å; S124-K126 PolarHBondContact O-N 3.09Å; S124-A127 PolarHBondContact O-N 3.49Å
125T57Low63.5Low106 Ų106115.3 Ų115.365%0.6559%0.59SS**THydrogen-bonded Turntrans-67.761.9172.3-55.90000110.1K123 H128K123-T125 PolarHBondContact O-N 3.27Å; T125-H128 HydrophobicContact CG2-CB 4.36Å
126K56.4Low62.9Low129 Ų129115.3 Ų115.356%0.56161%0.609SS**THydrogen-bonded Turntrans-109.6-11.6152-166.1172.1178.467.90109.9S124 H128S124-K126 PolarHBondContact O-N 3.09Å; K126-H128 VanDerWaalsContact C-N 3.31Å; K126-H128 PolarHBondContact O-N 3.22Å
127A54Low61.7Low52 Ų52109 Ų10943%0.4360%0.595SS.*SBendtrans-77.1-10.6177.800000114.3S124 W130S124-A127 PolarHBondContact O-N 3.49Å; A127-W130 PolarHBondContact O-NE1 3.17Å
128H52.7Low60.3Low118 Ų118111.8 Ų111.855%0.54662%0.624SS.*SBendtrans-99.6-13.9175.7-65.2-67.8000113.6T125 K126T125-H128 HydrophobicContact CG2-CB 4.36Å; K126-H128 VanDerWaalsContact C-N 3.31Å; K126-H128 PolarHBondContact O-N 3.22Å
129A53.4Low58.5Low48 Ų48117.2 Ų117.240%0.39763%0.634SS.*SBendtrans-79.3-18.4-176.800000114.9
130W51.1Low56.7Low177 Ų177116.1 Ų116.167%0.6765%0.645SS**SBendtrans-89.2-15.6179.751.9-71.7000113.2A127 G132 Q133A127-W130 PolarHBondContact O-NE1 3.17Å; W130-G132 VanDerWaalsContact C-N 3.3Å; W130-G132 PolarHBondContact O-N 3.08Å; W130-Q133 PolarHBondContact O-N 3.16Å
131K49.3Very low55.3Low173 Ų173116.5 Ų116.575%0.75266%0.657SS**THydrogen-bonded Turntrans-76.2-16.5177.6-166.4163.7179.5-177.90113.2
132G52.3Low54.1Low54 Ų54115.1 Ų115.156%0.55766%0.658SS**THydrogen-bonded Turntrans-83.2-12.5173.300000115W130W130-G132 VanDerWaalsContact C-N 3.3Å; W130-G132 PolarHBondContact O-N 3.08Å
133Q48.9Very low52.6Low157 Ų157116.3 Ų116.373%0.73467%0.67SS**THydrogen-bonded Turntrans-82.1-21.9-176.7-173.266.975.300113.2W130W130-Q133 PolarHBondContact O-N 3.16Å
134W50.4Low52Low233 Ų233115.2 Ų115.288%0.88367%0.667SS**THydrogen-bonded Turntrans-108.1-14.8-177.9-64.1105.9000114.2
135A53Low51.5Low65 Ų65118.9 Ų118.954%0.53768%0.675SS.*THydrogen-bonded Turntrans-102.5104.7172.600000107.2G137A135-G137 VanDerWaalsContact C-N 3.3Å; A135-G137 PolarHBondContact O-N 3.3Å
136G48.1Very low51.3Low97 Ų97121.4 Ų121.4100%169%0.685SS**THydrogen-bonded Turntrans-58.282.4-17500000114
137G40.8Very low51.7Low56 Ų56119.3 Ų119.358%0.57768%0.676SS**  trans-121.398.2171.900000109.4A135 Y139A135-G137 VanDerWaalsContact C-N 3.3Å; A135-G137 PolarHBondContact O-N 3.3Å; G137-Y139 PolarHBondContact O-N 2.98Å
138A52.2Low52.7Low104 Ų104128.2 Ų128.286%0.8670%0.698SS**  trans-81101.4169.500000109.2
139Y45.2Very low54.1Low213 Ų213128.5 Ų128.584%0.83571%0.708SS**  trans-165.1139.3147.256.1-85.3000110.2G137G137-Y139 PolarHBondContact O-N 2.98Å
140A45.6Very low55.7Low89 Ų89137.6 Ų137.674%0.73673%0.732SS**  trans71.373.5175.500000116.8E142A140-E142 VanDerWaalsContact C-N 3.26Å; A140-E142 PolarHBondContact O-N 3.27Å
141A49Very low57.6Low105 Ų105134 Ų13487%0.86873%0.731SS**  trans-77.980.5152.400000108.9
142E57Low59.7Low156 Ų156130 Ų13073%0.72973%0.73SS**  trans-66.5143.4154.4-79.9-66.6109.900108A140 E144A140-E142 VanDerWaalsContact C-N 3.26Å; A140-E142 PolarHBondContact O-N 3.27Å; E142-E144 PolarHBondContact O-N 3.46Å
143P51Low61.9Low87 Ų87130.4 Ų130.457%0.56572%0.715SS**  trans-67.399.8-176.127.8-31000109E145P143-E145 HydrophobicContact CB-CG 4.02Å; P143-E145 WeakPolarHBondContact CB-OE1 3.18Å; P143-E145 PolarHBondContact O-N 2.97Å
144E58.5Low64.2Low119 Ų119126.7 Ų126.756%0.55670%0.703SS**  trans-79.765.2-176.8-155168.416600110.4E142 N146 K147E142-E144 PolarHBondContact O-N 3.46Å; E144-N146 PolarHBondContact O-N 3.22Å; E144-K147 HydrophobicContact CB-CD 4.47Å; E144-K147 HydrophobicContact CG-CD 4.02Å; E144-K147 HydrophobicContact CG-CG 4.34Å; E144-K147 WeakPolarHBondContact OE1-CE 3.33Å; E144-K147 IonicContact OE1-NZ 2.99Å; E144-K147 PolarHBondContact OE1-NZ 3.05Å; E144-K147 WeakPolarHBondContact OE2-CE 3.42Å; E144-K147 IonicContact OE2-NZ 3.06Å; E144-K147 PolarHBondContact OE2-NZ 3.04Å
145E55.6Low66.5Low158 Ų158125.4 Ų125.474%0.73870%0.698SS**THydrogen-bonded Turntrans-72.6-7.5-170.1-65.7169.3-168.700113.6P143P143-E145 HydrophobicContact CB-CG 4.02Å; P143-E145 WeakPolarHBondContact CB-OE1 3.18Å; P143-E145 PolarHBondContact O-N 2.97Å
146N52.5Low68.6Low159 Ų159125.4 Ų125.485%0.8570%0.698SS**THydrogen-bonded Turntrans-96.52.3-176.5-54.2108.2000114.5E144 R148E144-N146 PolarHBondContact O-N 3.22Å; N146-R148 PolarHBondContact O-N 2.87Å; N146-R148 VanDerWaalsContact O-N 3.16Å
147K65.7Low71Confident85 Ų85122.2 Ų122.237%0.3766%0.657SS.*SBendtrans-75.9101.6170.2-75.4168.4166.1162.80108.6E144 T149E144-K147 HydrophobicContact CB-CD 4.47Å; E144-K147 HydrophobicContact CG-CD 4.02Å; E144-K147 HydrophobicContact CG-CG 4.34Å; E144-K147 WeakPolarHBondContact OE1-CE 3.33Å; E144-K147 IonicContact OE1-NZ 2.99Å; E144-K147 PolarHBondContact OE1-NZ 3.05Å; E144-K147 WeakPolarHBondContact OE2-CE 3.42Å; E144-K147 IonicContact OE2-NZ 3.06Å; E144-K147 PolarHBondContact OE2-NZ 3.04Å; K147-T149 PolarHBondContact O-N 2.92Å
148R73.9Confident73.8Confident239 Ų239122.5 Ų122.590%0.90265%0.645SS**  trans-54.9101.3166.8-70.1-178.1-176.4173.41.3108.9N146 R150N146-R148 PolarHBondContact O-N 2.87Å; N146-R148 VanDerWaalsContact O-N 3.16Å; R148-R150 PolarHBondContact O-N 3.45Å
149T82.7Confident76Confident124 Ų124122.1 Ų122.176%0.76163%0.628SS**PPolyproline II helixtrans-60.8129.6178.3-59.60000109.4K147 T151K147-T149 PolarHBondContact O-N 2.92Å; T149-T151 PolarHBondContact O-N 2.87Å
150R87.3Confident78.5Confident239 Ų239114.8 Ų114.890%0.90260%0.601SS**PPolyproline II helixtrans-71.4122.8173.3-81.2178.4168.7-100.92.4108.7R148R148-R150 PolarHBondContact O-N 3.45Å
151T89.7Confident81.1Confident103 Ų103110.6 Ų110.663%0.63257%0.567SS**PPolyproline II helixtrans-83.2131.2168.9-44.90000109.4T149T149-T151 PolarHBondContact O-N 2.87Å
152A94.1Very high83.4Confident89 Ų89109.9 Ų109.974%0.73655%0.545SS*.PPolyproline II helixtrans-91.2142.317100000110.1
153Y97.8Very high85.4Confident61 Ų61107.9 Ų107.924%0.23953%0.534CS..PPolyproline II helixtrans-86.5144.9172.3-57-51.2000110.2L158 L185 H189 W193Y153-L158 HydrophobicContact CD2-CD2 4.08Å; Y153-L158 HydrophobicContact CG-CD2 4.44Å; Y153-L185 HydrophobicContact CD1-CD1 3.98Å; Y153-L185 HydrophobicContact CD1-CD2 3.86Å; Y153-L185 HydrophobicContact CE1-CD1 3.91Å; Y153-L185 HydrophobicContact CE1-CD2 3.75Å; Y153-H189 HydrophobicContact CE1-CB 4.47Å; Y153-W193 AromaticContact CD2-CD1 3.87Å; Y153-W193 AromaticContact CE2-CD1 3.61Å
154T98.4Very high87.7Confident79 Ų79104.5 Ų104.549%0.48551%0.511SS..PPolyproline II helixtrans-71.2160.9174.673.10000110.7A156 Q157 L158T154-A156 VanDerWaalsContact C-N 3.29Å; T154-A156 PolarHBondContact O-N 3.35Å; T154-Q157 PolarHBondContact O-N 2.88Å; T154-Q157 VanDerWaalsContact OG1-CG 3.31Å; T154-Q157 WeakPolarHBondContact OG1-CG 3.49Å; T154-Q157 PolarHBondContact OG1-N 3.3Å; T154-L158 WeakPolarHBondContact O-CG 2.99Å; T154-L158 PolarHBondContact O-N 2.88Å; T154-L158 VanDerWaalsContact O-N 3.09Å
155R98.3Very high89.6Confident207 Ų20799 Ų9978%0.78149%0.485SS*.Hα-helixtrans-57-43.2176.4-173.2176.7-178.3-174.20.4111.9Q157 L158 L159R155-Q157 PolarHBondContact O-N 3.33Å; R155-L158 PolarHBondContact O-N 3.41Å; R155-L159 HydrophobicContact CG-CD1 4.36Å; R155-L159 WeakPolarHBondContact O-CG 3.28Å; R155-L159 PolarHBondContact O-N 3.12Å
156A98.3Very high91.6Very high65 Ų6597.4 Ų97.454%0.53748%0.481SS..Hα-helixtrans-62-42.7178.600000112.2T154 L158 L159 E160T154-A156 VanDerWaalsContact C-N 3.29Å; T154-A156 PolarHBondContact O-N 3.35Å; A156-L158 VanDerWaalsContact C-N 3.33Å; A156-L158 PolarHBondContact O-N 3.16Å; A156-L159 PolarHBondContact O-N 3.38Å; A156-E160 PolarHBondContact O-N 3.45Å
157Q98.5Very high93.8Very high29 Ų2998.1 Ų98.114%0.13648%0.477CS..Hα-helixtrans-60.7-43.1175.7-72.2171.7-26.900111.8T154 R155 L161 L183T154-Q157 PolarHBondContact O-N 2.88Å; T154-Q157 VanDerWaalsContact OG1-CG 3.31Å; T154-Q157 WeakPolarHBondContact OG1-CG 3.49Å; T154-Q157 PolarHBondContact OG1-N 3.3Å; R155-Q157 PolarHBondContact O-N 3.33Å; Q157-L161 WeakPolarHBondContact O-CB 3.3Å; Q157-L161 WeakPolarHBondContact O-CD1 3.3Å; Q157-L161 WeakPolarHBondContact O-CG 3.49Å; Q157-L161 PolarHBondContact O-N 2.92Å; Q157-L161 VanDerWaalsContact O-N 3.08Å; Q157-L183 HydrophobicContact CG-CB 4.29Å; Q157-L183 PolarHBondContact NE2-O 3.06Å
158L98.4Very high95.3Very high63 Ų6397.9 Ų97.933%0.3348%0.48SS..Hα-helixtrans-62.9-42.8178.2-66.6175000111.9Y153 T154 R155 A156 L161 E162Y153-L158 HydrophobicContact CD2-CD2 4.08Å; Y153-L158 HydrophobicContact CG-CD2 4.44Å; T154-L158 WeakPolarHBondContact O-CG 2.99Å; T154-L158 PolarHBondContact O-N 2.88Å; T154-L158 VanDerWaalsContact O-N 3.09Å; R155-L158 PolarHBondContact O-N 3.41Å; A156-L158 VanDerWaalsContact C-N 3.33Å; A156-L158 PolarHBondContact O-N 3.16Å; L158-L161 PolarHBondContact O-N 3.11Å; L158-E162 WeakPolarHBondContact O-CB 3.34Å; L158-E162 WeakPolarHBondContact O-CG 3.47Å; L158-E162 PolarHBondContact O-N 3.03Å
159L98.6Very high96.5Very high96 Ų9689 Ų8950%0.50345%0.447SS..Hα-helixtrans-62.3-46.9-179.9-70.6173.4000112.2R155 A156 L161 E162 K163R155-L159 HydrophobicContact CG-CD1 4.36Å; R155-L159 WeakPolarHBondContact O-CG 3.28Å; R155-L159 PolarHBondContact O-N 3.12Å; A156-L159 PolarHBondContact O-N 3.38Å; L159-L161 PolarHBondContact O-N 3.49Å; L159-E162 PolarHBondContact O-N 3.43Å; L159-K163 WeakPolarHBondContact O-CB 3.37Å; L159-K163 PolarHBondContact O-N 2.88Å
160E98.6Very high97.2Very high59 Ų5989.8 Ų89.828%0.27644%0.437SS..Hα-helixtrans-65.5-38.9177.4-72.1-59.7138.600111.8A156 E162 K163 E164 L183A156-E160 PolarHBondContact O-N 3.45Å; E160-E162 VanDerWaalsContact C-N 3.34Å; E160-E162 PolarHBondContact O-N 2.99Å; E160-K163 PolarHBondContact O-N 3.29Å; E160-K163 IonicContact OE1-NZ 3.43Å; E160-K163 IonicContact OE2-NZ 3.92Å; E160-K163 PolarHBondContact OE2-NZ 3.34Å; E160-E164 VanDerWaalsContact O-CG 3.3Å; E160-E164 WeakPolarHBondContact O-CG 3Å; E160-E164 PolarHBondContact O-N 3.46Å; E160-L183 HydrophobicContact CB-CD1 4.22Å; E160-L183 HydrophobicContact CB-CD2 3.69Å; E160-L183 HydrophobicContact CG-CD2 3.98Å
161L98.7Very high97.8Very high1 Ų179.7 Ų79.71%0.00540%0.401CS..Hα-helixtrans-63.1-39.6174.6-72167.4000112.3Q157 L158 L159 F165 L183 L185 I190 W193 F194Q157-L161 WeakPolarHBondContact O-CB 3.3Å; Q157-L161 WeakPolarHBondContact O-CD1 3.3Å; Q157-L161 WeakPolarHBondContact O-CG 3.49Å; Q157-L161 PolarHBondContact O-N 2.92Å; Q157-L161 VanDerWaalsContact O-N 3.08Å; L158-L161 PolarHBondContact O-N 3.11Å; L159-L161 PolarHBondContact O-N 3.49Å; L161-F165 WeakPolarHBondContact O-CB 3.3Å; L161-F165 PolarHBondContact O-N 3.14Å; L161-L183 HydrophobicContact CD1-CD1 4.44Å; L161-L183 HydrophobicContact CD2-CD1 3.87Å; L161-L183 HydrophobicContact CG-CD1 3.73Å; L161-L185 HydrophobicContact CD1-CD1 4.34Å; L161-I190 HydrophobicContact CD2-CD1 3.79Å; L161-W193 HydrophobicContact CB-CD2 3.95Å; L161-W193 HydrophobicContact CB-CE3 3.92Å; L161-W193 HydrophobicContact CB-CH2 3.62Å; L161-W193 HydrophobicContact CB-CZ2 3.62Å; L161-W193 HydrophobicContact CB-CZ3 3.77Å; L161-W193 HydrophobicContact CD1-CD2 3.87Å; L161-W193 HydrophobicContact CD1-CG 3.84Å; L161-W193 HydrophobicContact CD2-CD2 4.35Å; L161-W193 HydrophobicContact CD2-CE3 4.24Å; L161-W193 HydrophobicContact CG-CD2 4.28Å; L161-W193 HydrophobicContact CG-CE3 4.46Å; L161-W193 WeakPolarHBondContact O-CH2 3.46Å; L161-W193 WeakPolarHBondContact O-CZ3 3.07Å; L161-F194 HydrophobicContact CD2-CE2 4.22Å
162E98.6Very high98.2Very high89 Ų8977.8 Ų77.842%0.41639%0.392SS..Hα-helixtrans-68.2-44.6176.5-76.4-170.7174.100112.3L158 L159 E160 E164 F165 L166 W193L158-E162 WeakPolarHBondContact O-CB 3.34Å; L158-E162 WeakPolarHBondContact O-CG 3.47Å; L158-E162 PolarHBondContact O-N 3.03Å; L159-E162 PolarHBondContact O-N 3.43Å; E160-E162 VanDerWaalsContact C-N 3.34Å; E160-E162 PolarHBondContact O-N 2.99Å; E162-E164 VanDerWaalsContact C-N 3.3Å; E162-E164 PolarHBondContact O-N 3.45Å; E162-F165 WeakPolarHBondContact O-CB 3.36Å; E162-F165 PolarHBondContact O-N 3.35Å; E162-F165 VanDerWaalsContact O-N 3.14Å; E162-L166 WeakPolarHBondContact O-CG 3.44Å; E162-L166 PolarHBondContact O-N 2.89Å; E162-W193 HydrophobicContact CG-CH2 3.95Å; E162-W193 HydrophobicContact CG-CZ2 4.01Å
163K98.6Very high98.4Very high115 Ų11582.6 Ų82.650%0.539%0.391SS..Hα-helixtrans-54-48174.3171.2179.2155.1-154.60111.3L159 E160 L166 F167L159-K163 WeakPolarHBondContact O-CB 3.37Å; L159-K163 PolarHBondContact O-N 2.88Å; E160-K163 PolarHBondContact O-N 3.29Å; E160-K163 IonicContact OE1-NZ 3.43Å; E160-K163 IonicContact OE2-NZ 3.92Å; E160-K163 PolarHBondContact OE2-NZ 3.34Å; K163-L166 PolarHBondContact O-N 2.89Å; K163-F167 PolarHBondContact O-N 3.27Å; K163-F167 VanDerWaalsContact O-N 3.1Å
164E98.6Very high98.4Very high16 Ų1683.8 Ų83.88%0.07541%0.406CS..Hα-helixtrans-66.5-38177.6-70-65.7133.700112.9E160 E162 L166 F167 N168 R175 L179 F194E160-E164 VanDerWaalsContact O-CG 3.3Å; E160-E164 WeakPolarHBondContact O-CG 3Å; E160-E164 PolarHBondContact O-N 3.46Å; E162-E164 VanDerWaalsContact C-N 3.3Å; E162-E164 PolarHBondContact O-N 3.45Å; E164-L166 VanDerWaalsContact C-N 3.28Å; E164-L166 PolarHBondContact O-N 3.08Å; E164-F167 WeakPolarHBondContact O-CB 3.39Å; E164-F167 PolarHBondContact O-N 3.46Å; E164-N168 PolarHBondContact O-N 3.04Å; E164-R175 IonicContact OE1-CZ 2.66Å; E164-R175 IonicContact OE1-NE 2.77Å; E164-R175 IonicContact OE1-NH2 3.11Å; E164-R175 PolarHBondContact OE1-NH2 3.47Å; E164-R175 IonicContact OE2-CZ 3.66Å; E164-R175 IonicContact OE2-NE 3.88Å; E164-R175 PolarHBondContact OE2-NE 3.33Å; E164-R175 IonicContact OE2-NH2 2.68Å; E164-R175 PolarHBondContact OE2-NH2 3.15Å; E164-L179 HydrophobicContact CB-CD1 3.93Å; E164-L179 HydrophobicContact CG-CD1 3.66Å; E164-L179 HydrophobicContact CG-CD2 3.73Å; E164-L179 HydrophobicContact CG-CG 4.29Å; E164-F194 HydrophobicContact CB-CZ 4.14Å
165F98.7Very high98.4Very high2 Ų283.4 Ų83.41%0.00940%0.396CS..Hα-helixtrans-64.9-34.1175.5-176.4-101.3000112.6L161 E162 N168 K169 W193 F194 R197 R198 W201L161-F165 WeakPolarHBondContact O-CB 3.3Å; L161-F165 PolarHBondContact O-N 3.14Å; E162-F165 WeakPolarHBondContact O-CB 3.36Å; E162-F165 PolarHBondContact O-N 3.35Å; E162-F165 VanDerWaalsContact O-N 3.14Å; F165-N168 WeakPolarHBondContact CA-O 3.45Å; F165-N168 CarbonylContact O-C 3.31Å; F165-N168 VanDerWaalsContact O-C 3.31Å; F165-K169 HydrophobicContact CD1-CD 3.99Å; F165-K169 HydrophobicContact CD2-CD 4.38Å; F165-K169 HydrophobicContact CE1-CD 3.41Å; F165-K169 VanDerWaalsContact CE1-CD 3.41Å; F165-K169 HydrophobicContact CE2-CB 4.19Å; F165-K169 HydrophobicContact CE2-CD 3.85Å; F165-K169 WeakPolarHBondContact CE2-O 3.46Å; F165-K169 HydrophobicContact CG-CD 4.45Å; F165-K169 HydrophobicContact CZ-CB 4.39Å; F165-K169 HydrophobicContact CZ-CD 3.33Å; F165-K169 HydrophobicContact CZ-CG 4.45Å; F165-K169 WeakPolarHBondContact O-CD 3.3Å; F165-K169 PolarHBondContact O-NZ 3.37Å; F165-W193 HydrophobicContact CB-CH2 4.32Å; F165-W193 HydrophobicContact CB-CZ3 4.07Å; F165-F194 HydrophobicContact CB-CE1 4.34Å; F165-F194 HydrophobicContact CD2-CD1 4.03Å; F165-F194 HydrophobicContact CD2-CE1 4Å; F165-R197 HydrophobicContact CB-CG 4.44Å; F165-R197 HydrophobicContact CD1-CG 3.65Å; F165-R197 HydrophobicContact CD2-CB 4.26Å; F165-R197 HydrophobicContact CD2-CG 3.68Å; F165-R197 HydrophobicContact CE1-CG 3.69Å; F165-R197 HydrophobicContact CE2-CB 4.22Å; F165-R197 HydrophobicContact CE2-CG 3.73Å; F165-R197 HydrophobicContact CG-CG 3.63Å; F165-R197 HydrophobicContact CZ-CG 3.73Å; F165-R198 HydrophobicContact CE2-CG 3.71Å; F165-R198 HydrophobicContact CZ-CG 4.24Å; F165-W201 HydrophobicContact CE1-CB 4.07Å; F165-W201 HydrophobicContact CE1-CG 4.12Å; F165-W201 HydrophobicContact CZ-CB 3.87Å; F165-W201 HydrophobicContact CZ-CG 4.05Å
166L98.1Very high98.4Very high125 Ų12576.2 Ų76.265%0.65437%0.369SS*.Hα-helixtrans-66.2-43.8173.8-70.3175.5000110.8E162 K163 E164 K169E162-L166 WeakPolarHBondContact O-CG 3.44Å; E162-L166 PolarHBondContact O-N 2.89Å; K163-L166 PolarHBondContact O-N 2.89Å; E164-L166 VanDerWaalsContact C-N 3.28Å; E164-L166 PolarHBondContact O-N 3.08Å; L166-K169 PolarHBondContact O-NZ 3.17Å; L166-K169 VanDerWaalsContact O-NZ 3.1Å
167F98.3Very high98.5Very high175 Ų17576.1 Ų76.177%0.76836%0.362SS*.Hα-helixtrans-61.8-48.1175-177.4-103.4000112.6K163 E164K163-F167 PolarHBondContact O-N 3.27Å; K163-F167 VanDerWaalsContact O-N 3.1Å; E164-F167 WeakPolarHBondContact O-CB 3.39Å; E164-F167 PolarHBondContact O-N 3.46Å
168N97.9Very high98.5Very high80 Ų8079.2 Ų79.243%0.42838%0.376SS..  trans-145124.5175.6-168.5-15.8000111.3E164 F165 Y170E164-N168 PolarHBondContact O-N 3.04Å; F165-N168 WeakPolarHBondContact CA-O 3.45Å; F165-N168 CarbonylContact O-C 3.31Å; F165-N168 VanDerWaalsContact O-C 3.31Å; N168-Y170 PolarHBondContact ND2-O 3.49Å; N168-Y170 VanDerWaalsContact ND2-O 3.07Å; N168-Y170 PolarHBondContact O-N 3.09Å; N168-Y170 VanDerWaalsContact O-N 3.12Å; N168-Y170 PolarHBondContact OD1-N 3.27Å; N168-Y170 PolarHBondContact OD1-O 2.8Å
169K98Very high98.5Very high52 Ų5276.2 Ų76.223%0.22636%0.36CS..SBendtrans-66-15.6179.8-58-68.9168.3-77.30112.7F165 L166 R198F165-K169 HydrophobicContact CD1-CD 3.99Å; F165-K169 HydrophobicContact CD2-CD 4.38Å; F165-K169 HydrophobicContact CE1-CD 3.41Å; F165-K169 VanDerWaalsContact CE1-CD 3.41Å; F165-K169 HydrophobicContact CE2-CB 4.19Å; F165-K169 HydrophobicContact CE2-CD 3.85Å; F165-K169 WeakPolarHBondContact CE2-O 3.46Å; F165-K169 HydrophobicContact CG-CD 4.45Å; F165-K169 HydrophobicContact CZ-CB 4.39Å; F165-K169 HydrophobicContact CZ-CD 3.33Å; F165-K169 HydrophobicContact CZ-CG 4.45Å; F165-K169 WeakPolarHBondContact O-CD 3.3Å; F165-K169 PolarHBondContact O-NZ 3.37Å; L166-K169 PolarHBondContact O-NZ 3.17Å; L166-K169 VanDerWaalsContact O-NZ 3.1Å; K169-R198 WeakPolarHBondContact O-CD 3.45Å; K169-R198 WeakPolarHBondContact O-CG 3.32Å
170Y98.5Very high98.5Very high140 Ų14072.2 Ų72.255%0.54934%0.341SS..SBendtrans-128.8131178.3-65.5-102.7000109.9N168N168-Y170 PolarHBondContact ND2-O 3.49Å; N168-Y170 VanDerWaalsContact ND2-O 3.07Å; N168-Y170 PolarHBondContact O-N 3.09Å; N168-Y170 VanDerWaalsContact O-N 3.12Å; N168-Y170 PolarHBondContact OD1-N 3.27Å; N168-Y170 PolarHBondContact OD1-O 2.8Å
171I98.3Very high98.5Very high27 Ų2774.5 Ų74.514%0.13836%0.359CS..  trans-93.5130.4179.5-162.7166.5000111.7R175 R176 L179 I190 F194I171-R175 HydrophobicContact CD1-CB 4.42Å; I171-R175 HydrophobicContact CD1-CG 4.14Å; I171-R175 HydrophobicContact CG1-CB 3.95Å; I171-R175 HydrophobicContact CG1-CG 4.02Å; I171-R176 HydrophobicContact CD1-CB 4.12Å; I171-R176 HydrophobicContact CG1-CB 4.24Å; I171-R176 HydrophobicContact CG2-CB 4.41Å; I171-L179 HydrophobicContact CD1-CD1 3.36Å; I171-L179 HydrophobicContact CD1-CG 4.2Å; I171-I190 HydrophobicContact CD1-CG2 3.89Å; I171-F194 HydrophobicContact CB-CD1 3.97Å; I171-F194 HydrophobicContact CB-CD2 4.36Å; I171-F194 HydrophobicContact CB-CE1 3.81Å; I171-F194 HydrophobicContact CB-CE2 4.22Å; I171-F194 HydrophobicContact CB-CG 4.25Å; I171-F194 HydrophobicContact CB-CZ 3.95Å; I171-F194 HydrophobicContact CD1-CD2 4.45Å; I171-F194 HydrophobicContact CD1-CE2 3.83Å; I171-F194 HydrophobicContact CD1-CZ 3.95Å; I171-F194 HydrophobicContact CG1-CZ 4.4Å; I171-F194 HydrophobicContact CG2-CB 4.44Å; I171-F194 HydrophobicContact CG2-CD1 4.12Å; I171-F194 HydrophobicContact CG2-CD2 4.1Å; I171-F194 HydrophobicContact CG2-CE1 4.43Å; I171-F194 HydrophobicContact CG2-CE2 4.42Å; I171-F194 HydrophobicContact CG2-CG 3.95Å
172S98.6Very high98.4Very high64 Ų6479.8 Ų79.845%0.44839%0.385SS..  trans-71.8164.3172.369.30000111.1R175 R176S172-R175 WeakPolarHBondContact OG-CB 3.48Å; S172-R176 WeakPolarHBondContact O-CB 3.3Å; S172-R176 PolarHBondContact O-N 3.45Å
173R98.4Very high98.4Very high190 Ų19076.3 Ų76.372%0.71737%0.369SS*.Hα-helixtrans-62.6-48.7178.9-176.8174.2-175.5166.2-1.3112.7R175 R176 V177R173-R175 PolarHBondContact O-N 3.22Å; R173-R176 WeakPolarHBondContact O-CB 3.36Å; R173-R176 PolarHBondContact O-N 2.91Å; R173-V177 PolarHBondContact O-N 3.34Å
174P98.4Very high98.4Very high85 Ų8577.7 Ų77.755%0.55238%0.382SS*.Hα-helixtrans-59.7-47.3179.1-23.234.4000112.1R176 V177 E178P174-R176 VanDerWaalsContact C-N 3.27Å; P174-R176 PolarHBondContact O-N 3.45Å; P174-V177 WeakPolarHBondContact O-CB 3.45Å; P174-V177 PolarHBondContact O-N 2.93Å; P174-E178 PolarHBondContact O-N 2.99Å; P174-E178 VanDerWaalsContact O-N 3.14Å
175R98.6Very high98.4Very high71 Ų7178 Ų7827%0.26838%0.384SS..Hα-helixtrans-63.1-34.2-179.9-170.856.5176.7163.60.7112.7E164 I171 S172 R173 V177 E178 L179E164-R175 IonicContact OE1-CZ 2.66Å; E164-R175 IonicContact OE1-NE 2.77Å; E164-R175 IonicContact OE1-NH2 3.11Å; E164-R175 PolarHBondContact OE1-NH2 3.47Å; E164-R175 IonicContact OE2-CZ 3.66Å; E164-R175 IonicContact OE2-NE 3.88Å; E164-R175 PolarHBondContact OE2-NE 3.33Å; E164-R175 IonicContact OE2-NH2 2.68Å; E164-R175 PolarHBondContact OE2-NH2 3.15Å; I171-R175 HydrophobicContact CD1-CB 4.42Å; I171-R175 HydrophobicContact CD1-CG 4.14Å; I171-R175 HydrophobicContact CG1-CB 3.95Å; I171-R175 HydrophobicContact CG1-CG 4.02Å; S172-R175 WeakPolarHBondContact OG-CB 3.48Å; R173-R175 PolarHBondContact O-N 3.22Å; R175-V177 VanDerWaalsContact C-N 3.33Å; R175-V177 PolarHBondContact O-N 3.21Å; R175-E178 VanDerWaalsContact CD-OE2 3.23Å; R175-E178 WeakPolarHBondContact CD-OE2 3.49Å; R175-E178 IonicContact CZ-OE2 2.64Å; R175-E178 IonicContact NE-OE2 3.54Å; R175-E178 IonicContact NH1-OE2 2.89Å; R175-E178 PolarHBondContact NH1-OE2 3.05Å; R175-E178 PolarHBondContact O-N 2.89Å; R175-L179 WeakPolarHBondContact O-CG 2.97Å; R175-L179 PolarHBondContact O-N 2.97Å
176R98.7Very high98.4Very high56 Ų5681.4 Ų81.421%0.21141%0.405CS..Hα-helixtrans-61.4-41.6174.5-173.5-166.7-59161.15.9112I171 S172 R173 P174 A180 E187 I190I171-R176 HydrophobicContact CD1-CB 4.12Å; I171-R176 HydrophobicContact CG1-CB 4.24Å; I171-R176 HydrophobicContact CG2-CB 4.41Å; S172-R176 WeakPolarHBondContact O-CB 3.3Å; S172-R176 PolarHBondContact O-N 3.45Å; R173-R176 WeakPolarHBondContact O-CB 3.36Å; R173-R176 PolarHBondContact O-N 2.91Å; P174-R176 VanDerWaalsContact C-N 3.27Å; P174-R176 PolarHBondContact O-N 3.45Å; R176-A180 VanDerWaalsContact O-CB 3.3Å; R176-A180 WeakPolarHBondContact O-CB 3.3Å; R176-A180 PolarHBondContact O-N 3.25Å; R176-E187 HydrophobicContact CG-CB 4.21Å; R176-E187 HydrophobicContact CG-CG 4.26Å; R176-I190 HydrophobicContact CG-CB 3.96Å; R176-I190 HydrophobicContact CG-CG2 3.85Å
177V98.8Very high98.4Very high64 Ų6479.2 Ų79.239%0.38839%0.391SS..Hα-helixtrans-64.3-44.3177.9177.30000109.9R173 P174 R175 L179 A180 V181 E187R173-V177 PolarHBondContact O-N 3.34Å; P174-V177 WeakPolarHBondContact O-CB 3.45Å; P174-V177 PolarHBondContact O-N 2.93Å; R175-V177 VanDerWaalsContact C-N 3.33Å; R175-V177 PolarHBondContact O-N 3.21Å; V177-L179 PolarHBondContact O-N 3.26Å; V177-A180 WeakPolarHBondContact O-CB 3.39Å; V177-A180 PolarHBondContact O-N 2.89Å; V177-V181 WeakPolarHBondContact O-CG2 3.44Å; V177-V181 PolarHBondContact O-N 3.43Å; V177-V181 VanDerWaalsContact O-N 3.15Å; V177-E187 HydrophobicContact CG2-CG 4.39Å
178E98.6Very high98.4Very high93 Ų9378.4 Ų78.444%0.43538%0.383SS..Hα-helixtrans-58.1-49.4177.1-67.3165.8-156.200112.1P174 R175 A180 V181 M182P174-E178 PolarHBondContact O-N 2.99Å; P174-E178 VanDerWaalsContact O-N 3.14Å; R175-E178 VanDerWaalsContact CD-OE2 3.23Å; R175-E178 WeakPolarHBondContact CD-OE2 3.49Å; R175-E178 IonicContact CZ-OE2 2.64Å; R175-E178 IonicContact NE-OE2 3.54Å; R175-E178 IonicContact NH1-OE2 2.89Å; R175-E178 PolarHBondContact NH1-OE2 3.05Å; R175-E178 PolarHBondContact O-N 2.89Å; E178-A180 VanDerWaalsContact C-N 3.35Å; E178-A180 PolarHBondContact O-N 3.27Å; E178-V181 PolarHBondContact O-N 3.14Å; E178-M182 VanDerWaalsContact O-CG 3.3Å; E178-M182 WeakPolarHBondContact O-CG 3.36Å; E178-M182 PolarHBondContact O-N 2.98Å
179L98.6Very high98.4Very high1 Ų177.1 Ų77.11%0.00537%0.374CS..Hα-helixtrans-66.6-35178.4-65-175.1000113.3E164 I171 R175 V177 V181 M182 L183 I190 F194E164-L179 HydrophobicContact CB-CD1 3.93Å; E164-L179 HydrophobicContact CG-CD1 3.66Å; E164-L179 HydrophobicContact CG-CD2 3.73Å; E164-L179 HydrophobicContact CG-CG 4.29Å; I171-L179 HydrophobicContact CD1-CD1 3.36Å; I171-L179 HydrophobicContact CD1-CG 4.2Å; R175-L179 WeakPolarHBondContact O-CG 2.97Å; R175-L179 PolarHBondContact O-N 2.97Å; V177-L179 PolarHBondContact O-N 3.26Å; L179-V181 VanDerWaalsContact C-N 3.3Å; L179-V181 PolarHBondContact O-N 3.46Å; L179-M182 PolarHBondContact O-N 3.39Å; L179-L183 VanDerWaalsContact O-CB 3.28Å; L179-L183 WeakPolarHBondContact O-CB 3.47Å; L179-L183 WeakPolarHBondContact O-CG 3.45Å; L179-L183 PolarHBondContact O-N 3.27Å; L179-I190 HydrophobicContact CB-CD1 4.27Å; L179-F194 HydrophobicContact CD1-CE2 4.38Å
180A98.6Very high98.4Very high11 Ų1174.6 Ų74.69%0.09136%0.364CS..Hα-helixtrans-58.5-45.7176.400000110.8R176 V177 E178 N184 L185 E187 I190R176-A180 VanDerWaalsContact O-CB 3.3Å; R176-A180 WeakPolarHBondContact O-CB 3.3Å; R176-A180 PolarHBondContact O-N 3.25Å; V177-A180 WeakPolarHBondContact O-CB 3.39Å; V177-A180 PolarHBondContact O-N 2.89Å; E178-A180 VanDerWaalsContact C-N 3.35Å; E178-A180 PolarHBondContact O-N 3.27Å; A180-N184 WeakPolarHBondContact O-CA 3.35Å; A180-N184 PolarHBondContact O-N 3.05Å; A180-N184 VanDerWaalsContact O-N 3.16Å; A180-L185 CarbonylContact C-O 3.36Å; A180-L185 WeakPolarHBondContact CA-O 3.42Å; A180-L185 WeakPolarHBondContact CB-O 3.48Å; A180-L185 PolarHBondContact O-N 3.26Å; A180-E187 HydrophobicContact CB-CG 4.09Å; A180-I190 HydrophobicContact CB-CG1 4.24Å
181V98.6Very high98.4Very high107 Ų10773.7 Ų73.765%0.64836%0.362SS*.Hα-helixtrans-67.7-50.9177.2177.10000111.1V177 E178 L179 L183 N184V177-V181 WeakPolarHBondContact O-CG2 3.44Å; V177-V181 PolarHBondContact O-N 3.43Å; V177-V181 VanDerWaalsContact O-N 3.15Å; E178-V181 PolarHBondContact O-N 3.14Å; L179-V181 VanDerWaalsContact C-N 3.3Å; L179-V181 PolarHBondContact O-N 3.46Å; V181-L183 VanDerWaalsContact C-N 3.27Å; V181-L183 PolarHBondContact O-N 3.48Å; V181-N184 PolarHBondContact O-N 3.1Å
182M98.2Very high98.4Very high113 Ų11374.7 Ų74.756%0.55737%0.367SS*.Hα-helixtrans-61.3-33.7-176.3-71.5175.863.500113.6E178 L179E178-M182 VanDerWaalsContact O-CG 3.3Å; E178-M182 WeakPolarHBondContact O-CG 3.36Å; E178-M182 PolarHBondContact O-N 2.98Å; L179-M182 PolarHBondContact O-N 3.39Å
183L98.2Very high98.4Very high15 Ų1572.9 Ų72.98%0.07935%0.351CS..THydrogen-bonded Turntrans-101.20.9-175.3-57.1-177.3000113.3Q157 E160 L161 L179 V181 L185 I190Q157-L183 HydrophobicContact CG-CB 4.29Å; Q157-L183 PolarHBondContact NE2-O 3.06Å; E160-L183 HydrophobicContact CB-CD1 4.22Å; E160-L183 HydrophobicContact CB-CD2 3.69Å; E160-L183 HydrophobicContact CG-CD2 3.98Å; L161-L183 HydrophobicContact CD1-CD1 4.44Å; L161-L183 HydrophobicContact CD2-CD1 3.87Å; L161-L183 HydrophobicContact CG-CD1 3.73Å; L179-L183 VanDerWaalsContact O-CB 3.28Å; L179-L183 WeakPolarHBondContact O-CB 3.47Å; L179-L183 WeakPolarHBondContact O-CG 3.45Å; L179-L183 PolarHBondContact O-N 3.27Å; V181-L183 VanDerWaalsContact C-N 3.27Å; V181-L183 PolarHBondContact O-N 3.48Å; L183-L185 VanDerWaalsContact C-N 3.26Å; L183-L185 HydrophobicContact CB-CD1 4.23Å; L183-L185 HydrophobicContact CB-CG 4.17Å; L183-L185 PolarHBondContact O-N 2.78Å; L183-I190 HydrophobicContact CD1-CD1 4.41Å
184N98.3Very high98.4Very high145 Ų14564.1 Ų64.178%0.77532%0.318SS*.THydrogen-bonded Turntrans51.744.1-172.2-59.396.2000112.6A180 V181A180-N184 WeakPolarHBondContact O-CA 3.35Å; A180-N184 PolarHBondContact O-N 3.05Å; A180-N184 VanDerWaalsContact O-N 3.16Å; V181-N184 PolarHBondContact O-N 3.1Å
185L97.7Very high98.4Very high22 Ų2264.5 Ų64.512%0.11531%0.312CS..  trans-118.4155.5176.5-65.7-179.8000110Y153 L161 A180 L183 H189 I190Y153-L185 HydrophobicContact CD1-CD1 3.98Å; Y153-L185 HydrophobicContact CD1-CD2 3.86Å; Y153-L185 HydrophobicContact CE1-CD1 3.91Å; Y153-L185 HydrophobicContact CE1-CD2 3.75Å; L161-L185 HydrophobicContact CD1-CD1 4.34Å; A180-L185 CarbonylContact C-O 3.36Å; A180-L185 WeakPolarHBondContact CA-O 3.42Å; A180-L185 WeakPolarHBondContact CB-O 3.48Å; A180-L185 PolarHBondContact O-N 3.26Å; L183-L185 VanDerWaalsContact C-N 3.26Å; L183-L185 HydrophobicContact CB-CD1 4.23Å; L183-L185 HydrophobicContact CB-CG 4.17Å; L183-L185 PolarHBondContact O-N 2.78Å; L185-H189 HydrophobicContact CB-CB 4.32Å; L185-I190 HydrophobicContact CB-CD1 3.94Å; L185-I190 HydrophobicContact CB-CG1 4.45Å; L185-I190 HydrophobicContact CD1-CD1 3.92Å
186T98.3Very high98.4Very high74 Ų7465.9 Ų65.945%0.45433%0.325SS..  trans-74.7150.2172.466.80000110.6R188 H189 I190T186-R188 PolarHBondContact O-N 3.44Å; T186-H189 WeakPolarHBondContact O-CA 3.45Å; T186-H189 WeakPolarHBondContact O-CB 3.37Å; T186-H189 PolarHBondContact O-N 3.2Å; T186-H189 PolarHBondContact OG1-N 2.66Å; T186-H189 PolarHBondContact OG1-ND1 3.43Å; T186-I190 PolarHBondContact O-N 2.94Å; T186-I190 VanDerWaalsContact O-N 3.11Å
187E98.5Very high98.4Very high79 Ų7965.4 Ų65.437%0.36932%0.323SS..Hα-helixtrans-51.3-34.2172.2-73.5-172.6-101.500112.3R176 V177 A180 I190 K191R176-E187 HydrophobicContact CG-CB 4.21Å; R176-E187 HydrophobicContact CG-CG 4.26Å; V177-E187 HydrophobicContact CG2-CG 4.39Å; A180-E187 HydrophobicContact CB-CG 4.09Å; E187-I190 PolarHBondContact O-N 2.68Å; E187-K191 WeakPolarHBondContact O-CB 3.37Å; E187-K191 PolarHBondContact O-N 2.91Å
188R97.9Very high98.4Very high158 Ų15865.7 Ų65.760%0.59632%0.318SS*.Hα-helixtrans-62.1-44.7175.1-177.5179.4-178.7-80.6-3.8111.6T186 K191 I192T186-R188 PolarHBondContact O-N 3.44Å; R188-K191 PolarHBondContact O-N 3.19Å; R188-I192 HydrophobicContact CG-CD1 3.91Å; R188-I192 VanDerWaalsContact NH1-CD1 3.3Å; R188-I192 VanDerWaalsContact O-CG1 3.3Å; R188-I192 WeakPolarHBondContact O-CG1 3.44Å; R188-I192 PolarHBondContact O-N 3.22Å
189H98.1Very high98.3Very high52 Ų5266.5 Ų66.524%0.24132%0.323CS..Hα-helixtrans-63.7-42.8176.5-71.1152.4000111.7Y153 L185 T186 K191 I192 W193Y153-H189 HydrophobicContact CE1-CB 4.47Å; L185-H189 HydrophobicContact CB-CB 4.32Å; T186-H189 WeakPolarHBondContact O-CA 3.45Å; T186-H189 WeakPolarHBondContact O-CB 3.37Å; T186-H189 PolarHBondContact O-N 3.2Å; T186-H189 PolarHBondContact OG1-N 2.66Å; T186-H189 PolarHBondContact OG1-ND1 3.43Å; H189-K191 VanDerWaalsContact C-N 3.35Å; H189-K191 PolarHBondContact O-N 3.41Å; H189-I192 PolarHBondContact O-N 3.27Å; H189-W193 WeakPolarHBondContact O-CB 3.42Å; H189-W193 PolarHBondContact O-N 3.31Å
190I98.5Very high98.3Very high0 Ų072.3 Ų72.30%035%0.348CS..Hα-helixtrans-59.3-47173.9-53.5-61.8000110.5L161 I171 R176 L179 A180 L183 L185 T186 E187 I192 W193 F194L161-I190 HydrophobicContact CD2-CD1 3.79Å; I171-I190 HydrophobicContact CD1-CG2 3.89Å; R176-I190 HydrophobicContact CG-CB 3.96Å; R176-I190 HydrophobicContact CG-CG2 3.85Å; L179-I190 HydrophobicContact CB-CD1 4.27Å; A180-I190 HydrophobicContact CB-CG1 4.24Å; L183-I190 HydrophobicContact CD1-CD1 4.41Å; L185-I190 HydrophobicContact CB-CD1 3.94Å; L185-I190 HydrophobicContact CB-CG1 4.45Å; L185-I190 HydrophobicContact CD1-CD1 3.92Å; T186-I190 PolarHBondContact O-N 2.94Å; T186-I190 VanDerWaalsContact O-N 3.11Å; E187-I190 PolarHBondContact O-N 2.68Å; I190-I192 PolarHBondContact O-N 3.5Å; I190-W193 PolarHBondContact O-N 3.37Å; I190-F194 HydrophobicContact CG2-CD2 3.98Å; I190-F194 HydrophobicContact CG2-CE2 4.13Å; I190-F194 WeakPolarHBondContact O-CD2 3.34Å; I190-F194 PolarHBondContact O-N 3.4Å
191K98.3Very high98.2Very high120 Ų12075.7 Ų75.752%0.52236%0.358SS..Hα-helixtrans-58.9-47.4178.3-177.9-178.3177.8-177.30112.1E187 R188 H189 Q195E187-K191 WeakPolarHBondContact O-CB 3.37Å; E187-K191 PolarHBondContact O-N 2.91Å; R188-K191 PolarHBondContact O-N 3.19Å; H189-K191 VanDerWaalsContact C-N 3.35Å; H189-K191 PolarHBondContact O-N 3.41Å; K191-Q195 PolarHBondContact O-N 3.4Å
192I98.3Very high98.1Very high48 Ų4876.1 Ų76.125%0.24635%0.352CS..Hα-helixtrans-65-42.7179.3-70168.7000110.4R188 H189 I190 Q195 N196R188-I192 HydrophobicContact CG-CD1 3.91Å; R188-I192 VanDerWaalsContact NH1-CD1 3.3Å; R188-I192 VanDerWaalsContact O-CG1 3.3Å; R188-I192 WeakPolarHBondContact O-CG1 3.44Å; R188-I192 PolarHBondContact O-N 3.22Å; H189-I192 PolarHBondContact O-N 3.27Å; I190-I192 PolarHBondContact O-N 3.5Å; I192-Q195 PolarHBondContact O-N 2.86Å; I192-N196 VanDerWaalsContact O-CG 3.3Å; I192-N196 PolarHBondContact O-N 3.16Å
193W98.4Very high98Very high26 Ų2678.5 Ų78.510%0.09836%0.359CS..Hα-helixtrans-60.8-47.8178.6-169.8101.1000111.4Y153 L161 E162 F165 H189 I190 Q195 N196 R197Y153-W193 AromaticContact CD2-CD1 3.87Å; Y153-W193 AromaticContact CE2-CD1 3.61Å; L161-W193 HydrophobicContact CB-CD2 3.95Å; L161-W193 HydrophobicContact CB-CE3 3.92Å; L161-W193 HydrophobicContact CB-CH2 3.62Å; L161-W193 HydrophobicContact CB-CZ2 3.62Å; L161-W193 HydrophobicContact CB-CZ3 3.77Å; L161-W193 HydrophobicContact CD1-CD2 3.87Å; L161-W193 HydrophobicContact CD1-CG 3.84Å; L161-W193 HydrophobicContact CD2-CD2 4.35Å; L161-W193 HydrophobicContact CD2-CE3 4.24Å; L161-W193 HydrophobicContact CG-CD2 4.28Å; L161-W193 HydrophobicContact CG-CE3 4.46Å; L161-W193 WeakPolarHBondContact O-CH2 3.46Å; L161-W193 WeakPolarHBondContact O-CZ3 3.07Å; E162-W193 HydrophobicContact CG-CH2 3.95Å; E162-W193 HydrophobicContact CG-CZ2 4.01Å; F165-W193 HydrophobicContact CB-CH2 4.32Å; F165-W193 HydrophobicContact CB-CZ3 4.07Å; H189-W193 WeakPolarHBondContact O-CB 3.42Å; H189-W193 PolarHBondContact O-N 3.31Å; I190-W193 PolarHBondContact O-N 3.37Å; W193-Q195 VanDerWaalsContact C-N 3.28Å; W193-Q195 PolarHBondContact O-N 3.21Å; W193-N196 PolarHBondContact O-N 3.01Å; W193-R197 HydrophobicContact CD2-CB 4.48Å; W193-R197 HydrophobicContact CE3-CB 3.97Å; W193-R197 HydrophobicContact CH2-CB 4.01Å; W193-R197 HydrophobicContact CH2-CG 3.75Å; W193-R197 HydrophobicContact CZ2-CG 4.48Å; W193-R197 HydrophobicContact CZ3-CB 3.7Å; W193-R197 HydrophobicContact CZ3-CG 3.78Å; W193-R197 WeakPolarHBondContact O-CB 3.23Å; W193-R197 PolarHBondContact O-N 3.1Å
194F98.8Very high97.8Very high6 Ų681.4 Ų81.43%0.02637%0.372CS..Hα-helixtrans-63.1-33176.5-93.2-100.3000112.9L161 E164 F165 I171 L179 I190 R198L161-F194 HydrophobicContact CD2-CE2 4.22Å; E164-F194 HydrophobicContact CB-CZ 4.14Å; F165-F194 HydrophobicContact CB-CE1 4.34Å; F165-F194 HydrophobicContact CD2-CD1 4.03Å; F165-F194 HydrophobicContact CD2-CE1 4Å; I171-F194 HydrophobicContact CB-CD1 3.97Å; I171-F194 HydrophobicContact CB-CD2 4.36Å; I171-F194 HydrophobicContact CB-CE1 3.81Å; I171-F194 HydrophobicContact CB-CE2 4.22Å; I171-F194 HydrophobicContact CB-CG 4.25Å; I171-F194 HydrophobicContact CB-CZ 3.95Å; I171-F194 HydrophobicContact CD1-CD2 4.45Å; I171-F194 HydrophobicContact CD1-CE2 3.83Å; I171-F194 HydrophobicContact CD1-CZ 3.95Å; I171-F194 HydrophobicContact CG1-CZ 4.4Å; I171-F194 HydrophobicContact CG2-CB 4.44Å; I171-F194 HydrophobicContact CG2-CD1 4.12Å; I171-F194 HydrophobicContact CG2-CD2 4.1Å; I171-F194 HydrophobicContact CG2-CE1 4.43Å; I171-F194 HydrophobicContact CG2-CE2 4.42Å; I171-F194 HydrophobicContact CG2-CG 3.95Å; L179-F194 HydrophobicContact CD1-CE2 4.38Å; I190-F194 HydrophobicContact CG2-CD2 3.98Å; I190-F194 HydrophobicContact CG2-CE2 4.13Å; I190-F194 WeakPolarHBondContact O-CD2 3.34Å; I190-F194 PolarHBondContact O-N 3.4Å; F194-R198 WeakPolarHBondContact O-CG 3.42Å; F194-R198 PolarHBondContact O-N 2.84Å; F194-R198 VanDerWaalsContact O-N 3.14Å; F194-R198 PolarHBondContact O-NE 3.14Å
195Q98.7Very high97.5Very high93 Ų9376.8 Ų76.844%0.43535%0.345SS..Hα-helixtrans-66.9-49173.8-17116934.100111.1K191 I192 W193 R197 R198 M199K191-Q195 PolarHBondContact O-N 3.4Å; I192-Q195 PolarHBondContact O-N 2.86Å; W193-Q195 VanDerWaalsContact C-N 3.28Å; W193-Q195 PolarHBondContact O-N 3.21Å; Q195-R197 VanDerWaalsContact C-N 3.33Å; Q195-R197 PolarHBondContact O-N 2.96Å; Q195-R198 PolarHBondContact O-N 3.25Å; Q195-M199 WeakPolarHBondContact O-CG 3.45Å; Q195-M199 PolarHBondContact O-N 3.21Å
196N98.3Very high97Very high101 Ų10180 Ų8054%0.5436%0.363SS..Hα-helixtrans-61.3-42.7177.3-68.9-15.5000111.5I192 W193 R198 M199 K200I192-N196 VanDerWaalsContact O-CG 3.3Å; I192-N196 PolarHBondContact O-N 3.16Å; W193-N196 PolarHBondContact O-N 3.01Å; N196-R198 PolarHBondContact O-N 3.12Å; N196-M199 PolarHBondContact O-N 3.03Å; N196-K200 PolarHBondContact O-N 2.79Å; N196-K200 VanDerWaalsContact O-N 3.09Å
197R98.5Very high96.6Very high45 Ų4584.8 Ų84.817%0.1738%0.377CS..Hα-helixtrans-63.9-42-179.2-17562.3-173.5115.7-11.2112F165 W193 Q195 K200 W201 E204F165-R197 HydrophobicContact CB-CG 4.44Å; F165-R197 HydrophobicContact CD1-CG 3.65Å; F165-R197 HydrophobicContact CD2-CB 4.26Å; F165-R197 HydrophobicContact CD2-CG 3.68Å; F165-R197 HydrophobicContact CE1-CG 3.69Å; F165-R197 HydrophobicContact CE2-CB 4.22Å; F165-R197 HydrophobicContact CE2-CG 3.73Å; F165-R197 HydrophobicContact CG-CG 3.63Å; F165-R197 HydrophobicContact CZ-CG 3.73Å; W193-R197 HydrophobicContact CD2-CB 4.48Å; W193-R197 HydrophobicContact CE3-CB 3.97Å; W193-R197 HydrophobicContact CH2-CB 4.01Å; W193-R197 HydrophobicContact CH2-CG 3.75Å; W193-R197 HydrophobicContact CZ2-CG 4.48Å; W193-R197 HydrophobicContact CZ3-CB 3.7Å; W193-R197 HydrophobicContact CZ3-CG 3.78Å; W193-R197 WeakPolarHBondContact O-CB 3.23Å; W193-R197 PolarHBondContact O-N 3.1Å; Q195-R197 VanDerWaalsContact C-N 3.33Å; Q195-R197 PolarHBondContact O-N 2.96Å; R197-K200 PolarHBondContact O-N 3.41Å; R197-W201 WeakPolarHBondContact O-CB 3.35Å; R197-W201 PolarHBondContact O-N 3.07Å; R197-E204 IonicContact CZ-OE2 3.26Å; R197-E204 IonicContact NH1-OE1 3.76Å; R197-E204 IonicContact NH1-OE2 3.61Å; R197-E204 PolarHBondContact NH1-OE2 2.76Å; R197-E204 IonicContact NH2-OE2 2.78Å
198R98.4Very high96Very high71 Ų7189.6 Ų89.627%0.26840%0.397SS..Hα-helixtrans-62-40.5174.7-76.7-174.4-68.7146.9-4.2112.7F165 K169 F194 Q195 N196 K200 W201 K202F165-R198 HydrophobicContact CE2-CG 3.71Å; F165-R198 HydrophobicContact CZ-CG 4.24Å; K169-R198 WeakPolarHBondContact O-CD 3.45Å; K169-R198 WeakPolarHBondContact O-CG 3.32Å; F194-R198 WeakPolarHBondContact O-CG 3.42Å; F194-R198 PolarHBondContact O-N 2.84Å; F194-R198 VanDerWaalsContact O-N 3.14Å; F194-R198 PolarHBondContact O-NE 3.14Å; Q195-R198 PolarHBondContact O-N 3.25Å; N196-R198 PolarHBondContact O-N 3.12Å; R198-K200 VanDerWaalsContact C-N 3.34Å; R198-K200 PolarHBondContact O-N 3.48Å; R198-W201 PolarHBondContact O-N 2.94Å; R198-K202 PolarHBondContact O-N 2.93Å
199M98.3Very high95.1Very high109 Ų10989.5 Ų89.554%0.53740%0.397SS..Hα-helixtrans-62.1-44176.5-65.4-57.8170.200111.5Q195 N196 K203Q195-M199 WeakPolarHBondContact O-CG 3.45Å; Q195-M199 PolarHBondContact O-N 3.21Å; N196-M199 PolarHBondContact O-N 3.03Å; M199-K203 PolarHBondContact O-N 2.85Å
200K97.2Very high93.3Very high124 Ų12489.1 Ų89.154%0.53941%0.407SS..Hα-helixtrans-63-47.1176-162.7-166.4-176-145.40111.5N196 R197 R198 K202 K203 E204N196-K200 PolarHBondContact O-N 2.79Å; N196-K200 VanDerWaalsContact O-N 3.09Å; R197-K200 PolarHBondContact O-N 3.41Å; R198-K200 VanDerWaalsContact C-N 3.34Å; R198-K200 PolarHBondContact O-N 3.48Å; K200-K202 PolarHBondContact O-N 2.88Å; K200-K203 PolarHBondContact O-N 3.08Å; K200-E204 VanDerWaalsContact CD-OE1 3.3Å; K200-E204 WeakPolarHBondContact CD-OE1 2.96Å; K200-E204 WeakPolarHBondContact CE-OE1 3.28Å; K200-E204 HydrophobicContact CG-CG 4.48Å; K200-E204 WeakPolarHBondContact CG-OE1 3.48Å; K200-E204 IonicContact NZ-OE1 2.66Å; K200-E204 PolarHBondContact NZ-OE1 2.72Å; K200-E204 WeakPolarHBondContact O-CG 3.48Å; K200-E204 PolarHBondContact O-N 3.08Å
201W97Very high91.4Very high82 Ų8292.6 Ų92.631%0.31144%0.443SS..Hα-helixtrans-59.2-44.2179.517374.4000112.3F165 R197 R198 K203 E204 E205F165-W201 HydrophobicContact CE1-CB 4.07Å; F165-W201 HydrophobicContact CE1-CG 4.12Å; F165-W201 HydrophobicContact CZ-CB 3.87Å; F165-W201 HydrophobicContact CZ-CG 4.05Å; R197-W201 WeakPolarHBondContact O-CB 3.35Å; R197-W201 PolarHBondContact O-N 3.07Å; R198-W201 PolarHBondContact O-N 2.94Å; W201-K203 VanDerWaalsContact C-N 3.34Å; W201-K203 PolarHBondContact O-N 2.66Å; W201-E204 PolarHBondContact O-N 3.08Å; W201-E205 HydrophobicContact CD2-CG 4.27Å; W201-E205 VanDerWaalsContact CH2-OE2 3.28Å; W201-E205 WeakPolarHBondContact CH2-OE2 3.46Å; W201-E205 HydrophobicContact CZ2-CG 3.95Å; W201-E205 WeakPolarHBondContact CZ2-OE2 3.32Å; W201-E205 PolarHBondContact O-N 2.86Å
202K96.5Very high89.4Confident116 Ų11690 Ų9050%0.50445%0.45SS..Hα-helixtrans-57.2-47.9175.8-170.5-174.568.6165.50111.3R198 K200 E204 E205 D206R198-K202 PolarHBondContact O-N 2.93Å; K200-K202 PolarHBondContact O-N 2.88Å; K202-E204 VanDerWaalsContact C-N 3.34Å; K202-E204 PolarHBondContact O-N 2.79Å; K202-E205 PolarHBondContact O-N 3.28Å; K202-D206 PolarHBondContact O-N 3.27Å
203K95.3Very high87.2Confident163 Ų16394.5 Ų94.571%0.70948%0.48SS*.Hα-helixtrans-62.2-39.9177.3-174.4178.1179.8179.50112.5M199 K200 W201 K207M199-K203 PolarHBondContact O-N 2.85Å; K200-K203 PolarHBondContact O-N 3.08Å; W201-K203 VanDerWaalsContact C-N 3.34Å; W201-K203 PolarHBondContact O-N 2.66Å; K203-K207 PolarHBondContact O-N 2.77Å
204E94.4Very high84.9Confident75 Ų7597.9 Ų97.935%0.3551%0.513SS..Hα-helixtrans-64.6-41.9176.4-72.7166.6172.800111.3R197 K200 W201 K202 K207 K208R197-E204 IonicContact CZ-OE2 3.26Å; R197-E204 IonicContact NH1-OE1 3.76Å; R197-E204 IonicContact NH1-OE2 3.61Å; R197-E204 PolarHBondContact NH1-OE2 2.76Å; R197-E204 IonicContact NH2-OE2 2.78Å; K200-E204 VanDerWaalsContact CD-OE1 3.3Å; K200-E204 WeakPolarHBondContact CD-OE1 2.96Å; K200-E204 WeakPolarHBondContact CE-OE1 3.28Å; K200-E204 HydrophobicContact CG-CG 4.48Å; K200-E204 WeakPolarHBondContact CG-OE1 3.48Å; K200-E204 IonicContact NZ-OE1 2.66Å; K200-E204 PolarHBondContact NZ-OE1 2.72Å; K200-E204 WeakPolarHBondContact O-CG 3.48Å; K200-E204 PolarHBondContact O-N 3.08Å; W201-E204 PolarHBondContact O-N 3.08Å; K202-E204 VanDerWaalsContact C-N 3.34Å; K202-E204 PolarHBondContact O-N 2.79Å; E204-K207 PolarHBondContact O-N 2.87Å; E204-K208 PolarHBondContact O-N 3Å; E204-K208 VanDerWaalsContact O-N 3.16Å
205E91.9Very high82.7Confident48 Ų48104.9 Ų104.922%0.22456%0.556CS.*Hα-helixtrans-71.7-36.5177.4-71.4-136.8106.700113.6W201 K202 K207 K208 R209W201-E205 HydrophobicContact CD2-CG 4.27Å; W201-E205 VanDerWaalsContact CH2-OE2 3.28Å; W201-E205 WeakPolarHBondContact CH2-OE2 3.46Å; W201-E205 HydrophobicContact CZ2-CG 3.95Å; W201-E205 WeakPolarHBondContact CZ2-OE2 3.32Å; W201-E205 PolarHBondContact O-N 2.86Å; K202-E205 PolarHBondContact O-N 3.28Å; E205-K207 VanDerWaalsContact C-N 3.26Å; E205-K207 PolarHBondContact O-N 3.17Å; E205-K208 PolarHBondContact O-N 3.48Å; E205-K208 VanDerWaalsContact O-N 3.08Å; E205-R209 VanDerWaalsContact CD-CZ 3.5Å; E205-R209 VanDerWaalsContact CD-NH2 3.3Å; E205-R209 PolarHBondContact O-N 3.13Å; E205-R209 IonicContact OE1-CZ 3.68Å; E205-R209 IonicContact OE1-NH1 2.93Å; E205-R209 PolarHBondContact OE1-NH1 2.91Å; E205-R209 VanDerWaalsContact OE1-NH1 3.08Å; E205-R209 IonicContact OE2-CZ 3.82Å; E205-R209 IonicContact OE2-NH1 3.08Å; E205-R209 PolarHBondContact OE2-NH1 3.17Å; E205-R209 IonicContact OE2-NH2 3.8Å; E205-R209 PolarHBondContact OE2-NH2 3.46Å
206D88.4Confident80.1Confident89 Ų89104.2 Ų104.248%0.47657%0.574SS.*Hα-helixtrans-61.8-38.1175.8-66.4-20.4000110.5K202 G210K202-D206 PolarHBondContact O-N 3.27Å; D206-G210 PolarHBondContact O-N 3.34Å
207K88.7Confident77.3Confident176 Ų176103.4 Ų103.477%0.76559%0.59SS**Hα-helixtrans-64.6-37.9172.3177.8175.8164.8169.20112.2K203 E204 E205K203-K207 PolarHBondContact O-N 2.77Å; E204-K207 PolarHBondContact O-N 2.87Å; E205-K207 VanDerWaalsContact C-N 3.26Å; E205-K207 PolarHBondContact O-N 3.17Å
208K86.1Confident74.4Confident180 Ų180104.7 Ų104.778%0.78362%0.617SS**Hα-helixtrans-72.9-37.4179.3-176.5174174.7169.70112.5E204 E205E204-K208 PolarHBondContact O-N 3Å; E204-K208 VanDerWaalsContact O-N 3.16Å; E205-K208 PolarHBondContact O-N 3.48Å; E205-K208 VanDerWaalsContact O-N 3.08Å
209R78.2Confident71.6Confident155 Ų155105.3 Ų105.359%0.58565%0.645SS**Hα-helixtrans-83.8-29.2-179.5-72.9-174-81.4-111.67.3113.4E205E205-R209 VanDerWaalsContact CD-CZ 3.5Å; E205-R209 VanDerWaalsContact CD-NH2 3.3Å; E205-R209 PolarHBondContact O-N 3.13Å; E205-R209 IonicContact OE1-CZ 3.68Å; E205-R209 IonicContact OE1-NH1 2.93Å; E205-R209 PolarHBondContact OE1-NH1 2.91Å; E205-R209 VanDerWaalsContact OE1-NH1 3.08Å; E205-R209 IonicContact OE2-CZ 3.82Å; E205-R209 IonicContact OE2-NH1 3.08Å; E205-R209 PolarHBondContact OE2-NH1 3.17Å; E205-R209 IonicContact OE2-NH2 3.8Å; E205-R209 PolarHBondContact OE2-NH2 3.46Å
210G61.8Low69.2Low45 Ų45106.5 Ų106.546%0.46466%0.659SS.*SBendtrans-85.3-1.4-179.300000115.7D206 G212D206-G210 PolarHBondContact O-N 3.34Å; G210-G212 PolarHBondContact O-N 2.96Å; G210-G212 VanDerWaalsContact O-N 3.08Å
211G57.6Low67Low72 Ų72105.2 Ų105.274%0.74267%0.671SS**THydrogen-bonded Turntrans-69.52.5-179.900000115.9
212G56.2Low64.7Low65 Ų65109.2 Ų109.267%0.6769%0.693SS**THydrogen-bonded Turntrans-110.3-10.1-178.700000116G210G210-G212 PolarHBondContact O-N 2.96Å; G210-G212 VanDerWaalsContact O-N 3.08Å
213T52.3Low62.4Low143 Ų143107.7 Ų107.788%0.87770%0.695SS**SBendtrans-158.460.9-176-29.80000113.2
214A50.4Low60Low97 Ų97109.5 Ų109.580%0.80271%0.706SS**  trans-155.5124.2155.300000109.7
215V52.8Low57.6Low154 Ų154113.6 Ų113.693%0.93373%0.725SS**  trans-62143.5-172.7124.10000113.3
216G44.4Very low55Low79 Ų79117.9 Ų117.981%0.81475%0.749SS**  trans89.3113.7147.500000117.6
217G38.9Very low52.4Low83 Ų83120 Ų12086%0.85677%0.77SS**  trans131.888.4148.400000116.3
218G38.4Very low50.2Low73 Ų73116.2 Ų116.275%0.75377%0.772SS**  trans73.369.6142.600000116.8V220G218-V220 PolarHBondContact O-N 3.29Å; G218-V220 VanDerWaalsContact O-N 3.17Å
219G39.1Very low48Very low83 Ų83114.4 Ų114.486%0.85678%0.775SS**  trans-66106.1155.700000109.7
220V48Very low46.1Very low135 Ų135112.9 Ų112.982%0.81878%0.783SS**  trans-92.492.1149.3-163.90000104.5G218 E222G218-V220 PolarHBondContact O-N 3.29Å; G218-V220 VanDerWaalsContact O-N 3.17Å; V220-E222 PolarHBondContact O-N 3.02Å; V220-E222 VanDerWaalsContact O-N 3.16Å
221A49.8Very low45.4Very low96 Ų96116.3 Ų116.379%0.79380%0.8SS**  trans-68.9101.9163.700000106.4
222E49.2Very low44.7Very low166 Ų166116.1 Ų116.178%0.77680%0.798SS**  trans-68.1129.8166.5-108.1-88.1113.300108.2V220 E224V220-E222 PolarHBondContact O-N 3.02Å; V220-E222 VanDerWaalsContact O-N 3.16Å; E222-E224 PolarHBondContact O-N 3.3Å
223P47.8Very low44.1Very low85 Ų85121.4 Ų121.455%0.55281%0.805SS**  trans-69.7126.7-175.627.8-31.8000110.5Q225P223-Q225 PolarHBondContact O-N 3.08Å; P223-Q225 VanDerWaalsContact O-N 3.12Å
224E45.2Very low43.6Very low200 Ų200122.8 Ų122.894%0.93580%0.802SS**  trans-50.9115161.9-83.1-175.3102.700109.3E222E222-E224 PolarHBondContact O-N 3.3Å
225Q43.3Very low43.1Very low162 Ų162124.6 Ų124.676%0.75780%0.797SS**  trans-112.1110.5160.4-77.7177.865.300107.8P223P223-Q225 PolarHBondContact O-N 3.08Å; P223-Q225 VanDerWaalsContact O-N 3.12Å
226D38.2Very low42.8Very low137 Ų137124.9 Ų124.973%0.73379%0.793SS**  trans50.5101.4144.6-62.3-63.7000119
227C34.2Very low42.6Very low135 Ų135126 Ų12691%0.91280%0.795SS**  trans-143.354.8139.6-73.10000109.8V229C227-V229 VanDerWaalsContact C-N 3.28Å; C227-V229 PolarHBondContact O-N 2.88Å; C227-V229 VanDerWaalsContact O-N 3.08Å
228A41.8Very low43.4Very low96 Ų96130 Ų13079%0.79380%0.796SS**  trans-74.685.7160.300000108.1T230A228-T230 PolarHBondContact O-N 2.95Å
229V39.4Very low44.4Very low142 Ų142132 Ų13286%0.86180%0.795SS**  trans-82.894.4164850000107C227 S231C227-V229 VanDerWaalsContact C-N 3.28Å; C227-V229 PolarHBondContact O-N 2.88Å; C227-V229 VanDerWaalsContact O-N 3.08Å; V229-S231 PolarHBondContact O-N 3.16Å
230T39.4Very low45.2Very low123 Ų123133.9 Ų133.976%0.75579%0.792SS**  trans-58.9125.4162.1-179.40000107.9A228 G232A228-T230 PolarHBondContact O-N 2.95Å; T230-G232 PolarHBondContact O-N 3.11Å
231S46.1Very low45.8Very low116 Ų116133.1 Ų133.181%0.81179%0.79SS**  trans-69.699.4170.6-156.70000106.6V229V229-S231 PolarHBondContact O-N 3.16Å
232G43.4Very low45.7Very low69 Ų69134.7 Ų134.771%0.71179%0.793SS**  trans-11798.817500000109T230T230-G232 PolarHBondContact O-N 3.11Å
233E44Very low45.1Very low175 Ų175130.7 Ų130.782%0.81880%0.796SS**  trans-64.2145.2164.959-154.680.900111.9
234E41.7Very low44.6Very low173 Ų173129.8 Ų129.881%0.80880%0.802SS**  trans88.9130.6156.8-134.5-178.989.800121.3
235L40.8Very low44.3Very low134 Ų134127.1 Ų127.170%0.70280%0.799SS**  trans92.594.9150.9-115119.7000121
236L45.9Very low44.4Very low160 Ų160125.8 Ų125.884%0.83880%0.802SS**  trans24.1112.4130.4-55.6173.4000118.7
237A40.2Very low45.2Very low104 Ų104124.9 Ų124.986%0.8680%0.803SS**  trans-176.5126.9137.400000112.8
238L56.3Low46.3Very low167 Ų167124.1 Ų124.187%0.87480%0.797SS**PPolyproline II helixtrans-75.2152.9166.4-76.2157000111
239P58.3Low46.1Very low113 Ų113124.3 Ų124.373%0.73480%0.799SS**PPolyproline II helixtrans-78.8149.9178.931.8-34.4000113.1
240P55.8Low46.2Very low123 Ų123122.4 Ų122.480%0.79980%0.798SS**PPolyproline II helixtrans-86146.6179.533.5-34000113.4
241P60Low47Very low120 Ų120122.1 Ų122.178%0.77980%0.798SS**PPolyproline II helixtrans-87151.5160.933.7-31.8000111.8
242P49.5Very low46.8Very low129 Ų129123.1 Ų123.184%0.83880%0.799SS**PPolyproline II helixtrans-86.2133.5178.533-30.9000112.5
243G35.6Very low46.8Very low82 Ų82123.8 Ų123.885%0.84580%0.798SS**  trans81.2119.3139.500000118.4
244G37.5Very low46.5Very low66 Ų66119.8 Ų119.868%0.6879%0.794SS**  trans149.980154.600000116.2
245T38.7Very low46.7Very low143 Ų143122.8 Ų122.888%0.87780%0.798SS**  trans52.9106.6142.5510000120.1
246V46.3Very low46.7Very low134 Ų134125.3 Ų125.381%0.81281%0.807SS**  trans-92.1158.7142.8-70.70000107.7
247P53.8Low46.3Very low118 Ų118121.1 Ų121.177%0.76680%0.802SS**  -155.9-156.760.446.1-21000114.5
248P57Low46.3Very low120 Ų120128 Ų12878%0.77981%0.806SS**  -133.9165.3-9639.2-19.7000114.4
249A37.5Very low45.7Very low100 Ų100127.4 Ų127.483%0.82680%0.803SS**  trans-160.499.9155.300000112.5
250A42.7Very low45.8Very low101 Ų101127.2 Ų127.284%0.83580%0.801SS**  trans40151.8131.500000122.9
251P56.4Low45.9Very low117 Ų117126.7 Ų126.776%0.7680%0.798SS**  trans-102.1179.7-15241-32.2000112.9
252V41.6Very low44.9Very low137 Ų137124.1 Ų124.183%0.8379%0.794SS**  trans170142.7134.8152.70000112.7
253A42.4Very low44.8Very low84 Ų84126.2 Ų126.269%0.69480%0.797SS**  trans74.8107.1157.900000117.9
254A39.4Very low45.4Very low90 Ų90128 Ų12874%0.74480%0.796SS**  59103.672.300000113.4
255R45.6Very low45.8Very low236 Ų236129.2 Ų129.289%0.89180%0.8SS**  -161.6134.6124.2-150.4123.876.3-1374.1112.3
256E39.2Very low46.2Very low188 Ų188127.8 Ų127.888%0.87980%0.796SS**  trans-49.4155.1166.5-65.1153.491.800113.6
257G38.8Very low46.8Very low72 Ų72127.3 Ų127.374%0.74280%0.795SS**  trans167.789.1159.900000116
258R40.3Very low46.5Very low247 Ų247130.2 Ų130.293%0.93280%0.799SS**  trans91.5106134.8-144.3157-173.8-93.4-0.7118.8
259L44.1Very low46.5Very low156 Ų156129.9 Ų129.982%0.81780%0.796SS**  trans-90.1-179.6151.4-75.4176.1000109.3
260P59.8Low47Very low108 Ų108130.4 Ų130.470%0.70179%0.794SS**  cis-137.6-136.5-43.439.6-19.3000109.2
261P57.3Low47.3Very low112 Ų112130.9 Ų130.973%0.72779%0.792SS**  cis-128.4177.7-45.333-15.3000114.3
262G38.9Very low47.4Very low67 Ų67132.1 Ų132.169%0.69180%0.796SS**  trans87148149.700000115.1
263L47.1Very low48.3Very low173 Ų173129.6 Ų129.691%0.90679%0.79SS**  cis-156.414049.7-21.4167.5000110.3
264S49.7Very low49.4Very low119 Ų119131.8 Ų131.883%0.83280%0.797SS**  trans-74.1150.2161.8173.20000110.9
265A45.4Very low50.3Low92 Ų92139.2 Ų139.276%0.7681%0.806SS**  trans-178.2119139.600000113.1
266S46.8Very low51Low112 Ų112139.3 Ų139.378%0.78381%0.806SS**  trans-60.9163145.6-68.80000110.7
267P58.8Low52.2Low124 Ų124136.1 Ų136.181%0.80580%0.802SS**  -149.1154.9102.933.7-15.2000115.7
268Q47.5Very low53.1Low179 Ų179142 Ų14284%0.83681%0.81SS**  trans-77164.2154.6-69.8-136.422.700110.4
269P57.7Low53.9Low113 Ų113139 Ų13973%0.73481%0.806SS**  -156.9155.5100.836.3-15.5000118.8
270S48.2Very low55.1Low111 Ų111137 Ų13778%0.77680%0.803SS**  trans80.5118.4130.8-63.80000125
271S47.5Very low54.9Low112 Ų112147.4 Ų147.478%0.78383%0.828SS**  trans-35134.6151.4-175.20000117.7
272V59.6Low54.8Low142 Ų142149.2 Ų149.286%0.86183%0.833SS**  trans-142.1122.8153.5166.70000109.2
273A61.1Low55.6Low84 Ų84153.5 Ų153.569%0.69484%0.841SS**PPolyproline II helixtrans-93.3145.6171.200000111
274P65.5Low56.1Low130 Ų130152.4 Ų152.484%0.84484%0.837SS**PPolyproline II helixtrans-93.2137170.732.7-29.2000112.7
275R58.5Low56.4Low246 Ų246154.4 Ų154.493%0.92884%0.837SS**PPolyproline II helixtrans-79.7150.1174.8-78176.2169.4-100.90.9112.1
276R58.9Low57.1Low239 Ų239158.3 Ų158.390%0.90284%0.842SS**PPolyproline II helixtrans-54.1142.5174-152.2-174.1-147.2-145.65114.2
277P65.2Low57.8Low120 Ų120161.3 Ų161.378%0.77985%0.846SS**PPolyproline II helixtrans-87.4141.7160.1-8.927.5000112
278Q57.2Low57.7Low196 Ų196164 Ų16492%0.91685%0.849SS**PPolyproline II helixtrans-79.8147.5168.8-70.4-16628.600110.9
279E57.7Low58.5Low184 Ų184162.8 Ų162.886%0.8685%0.85SS**PPolyproline II helixtrans-103.5143.2167.8-160.3-178.5120.800109.2
280P69.3Low58.6Low115 Ų115167 Ų16775%0.74786%0.86SS**PPolyproline II helixtrans-98.7135178.534.4-28000113.8
281R54.4Low59.5Low325 Ų325172.1 Ų172.1100%1.22687%0.867SS**  trans67.90158-95.2-170.7178.9-132.30.9120.7

Retrieved 281 of 281 residues in 82.6 ms (Link to these results)