A0A087XHY8_POEFO Loading...

Inhibitory synaptic factor 2A

AlphaFold DB , UniProt , Accession A0A087XHY8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 492 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
1M37.7Very low40.2Very low228 Ų228148.4 Ų148.4100%1.12383%0.826SS**  0139.10-84.9159.351.700107.4
2V36.1Very low39.6Very low138 Ų138146.7 Ų146.784%0.83682%0.822SS**  trans66.2131174-177.20000113.4
3S43.4Very low39.4Very low109 Ų109147.8 Ų147.876%0.76283%0.825SS**  cis-154.6179.9-14.5-113.70000111.5
4K49.6Very low39.3Very low175 Ų175145.2 Ų145.276%0.76182%0.822SS**  trans-52.6159.8154.2-71.7-179172.5-176.90110.8
5E45.5Very low39Very low173 Ų173148.1 Ų148.181%0.80883%0.826SS**  -150.8168.564.1-145.559.9-131.300113
6G41.7Very low38.9Very low68 Ų68145.9 Ų145.970%0.70182%0.824SS**  trans-138.6144.5170.900000111
7S35.3Very low38.6Very low128 Ų128146.5 Ų146.590%0.89582%0.824SS**  trans-140.1155.9177.157.60000111.1
8K44.1Very low38.7Very low180 Ų180143.8 Ų143.878%0.78382%0.817SS**  trans-123.5128.1-164.9167.1-169172.2-173.90109.6
9C32.7Very low38.4Very low127 Ų127146.3 Ų146.386%0.85882%0.821SS**  trans-122.5145.6165.6-66.40000110.4
10M39.3Very low38.4Very low148 Ų148143.1 Ų143.173%0.72981%0.813SS**  trans-140.9-170177.2-71.4-102.368.300107.5
11L36.4Very low39.1Very low158 Ų158142 Ų14283%0.82781%0.812SS**  trans82.4142.3175.9-47.9175.5000114.3
12T34Very low39.5Very low128 Ų128136.6 Ų136.679%0.78579%0.794SS**  cis-159171.4-22.29.80000109.2
13N36.3Very low39.5Very low161 Ų161137.6 Ų137.686%0.86179%0.794SS**  trans-95.3156.2175.5-59.1-33.4000113.4
14S38.3Very low39.8Very low112 Ų112137.5 Ų137.578%0.78379%0.791SS**  trans-145.7127.5159.1-65.60000106
15E35.1Very low38.9Very low189 Ų189134.4 Ų134.488%0.88379%0.791SS**  75.6138.579-162.7-179.8111.200113.5
16S37.4Very low38.6Very low112 Ų112132.1 Ų132.178%0.78379%0.789SS**  cis159.1111.4-45.9172.50000110.5
17D33.8Very low38.5Very low156 Ų156133.7 Ų133.783%0.83479%0.789SS**  trans-160.3-177.5158.4-148-11.8000113.8
18S40Very low39.1Very low99 Ų99135.7 Ų135.769%0.69279%0.789SS**  trans-82.4-177.4-161.2-51.10000114.5
19E33.1Very low39.1Very low191 Ų191132 Ų13289%0.89379%0.792SS**  cis-153.7-170.220.2-153.8177.9109.300111
20A37.8Very low39.7Very low81 Ų81133.2 Ų133.267%0.66979%0.789SS**  trans-150.6170.6-175.300000111.1
21P53.6Low40Very low120 Ų120134.2 Ų134.278%0.77979%0.792SS**  cis-129.4-145.71542.5-20.9000111.2
22P47Very low40.2Very low115 Ų115137.7 Ų137.775%0.74780%0.796SS**  cis-132.1-103.7-7.736.8-12.9000116.3
23L35.8Very low40.8Very low160 Ų160137.1 Ų137.184%0.83880%0.797SS**  trans-155.5171.9-159.5-63.4177.4000110.3
24P48.1Very low41.2Very low107 Ų107133.8 Ų133.870%0.69578%0.779SS**  cis-133.3177.71.640.6-23.9000116.7
25S32.7Very low41.3Very low109 Ų109134.8 Ų134.876%0.76277%0.771SS**  trans79.4152.8165.4-25.20000116.2
26T37.9Very low41.8Very low125 Ų125130 Ų13077%0.76776%0.764SS**  cis-136.2139.16.643.90000113.7
27S40.5Very low42.1Very low101 Ų101128 Ų12871%0.70675%0.75SS**  trans27.8147.5142.769.20000125.1
28L46.8Very low42.8Very low171 Ų171128.1 Ų128.190%0.89574%0.739SS**  trans82.472.3154.3-65.5167.5000120.1
29A43.5Very low43.3Very low102 Ų102131.8 Ų131.884%0.84375%0.745SS**SBendtrans-157.930.8157.400000116.2
30L46.3Very low44.1Very low153 Ų153127.3 Ų127.380%0.80173%0.731SS**  trans-148.443.6-171.6-138.5141000117
31E45.7Very low44.8Very low168 Ų168134.6 Ų134.679%0.78574%0.741SS**SBendtrans-129.154.6175-88.6-63.7176.500114
32Y40.9Very low45Very low231 Ų231138.3 Ų138.391%0.90675%0.745SS**SBendtrans-15128.6165-153.5-106.7000115.4
33S47.2Very low45.3Very low116 Ų116142.6 Ų142.681%0.81175%0.746SS**SBendtrans-147.126.7179.5-149.20000116.1
34L44.4Very low46.3Very low92 Ų92139.7 Ų139.748%0.48273%0.731SS.*SBendtrans-111.4-34172.2-91.6169.1000114.4A36 S37L34-A36 PolarHBondContact O-N 3.42Å; L34-S37 PolarHBondContact O-N 3.21Å; L34-S37 PolarHBondContact O-OG 3.42Å
35E40.9Very low46.5Very low132 Ų132143.2 Ų143.262%0.61774%0.736SS**Hα-helixtrans-74.1-31.2-169-156.650.1-139.400114.1S37 R38E35-S37 PolarHBondContact O-N 3.13Å; E35-S37 VanDerWaalsContact O-N 3.15Å; E35-R38 PolarHBondContact O-N 2.75Å; E35-R38 VanDerWaalsContact OE2-CD 3.3Å; E35-R38 WeakPolarHBondContact OE2-CD 3.46Å; E35-R38 IonicContact OE2-NE 3.41Å; E35-R38 PolarHBondContact OE2-NE 3.27Å
36A44.1Very low47.5Very low90 Ų90141.1 Ų141.174%0.74473%0.725SS**Hα-helixtrans-59.9-25.8173.800000113.4L34L34-A36 PolarHBondContact O-N 3.42Å
37S43.4Very low48.2Very low69 Ų69140 Ų14048%0.48371%0.714SS.*Hα-helixtrans-79.7-27.7-178.777.30000113.6L34 E35L34-S37 PolarHBondContact O-N 3.21Å; L34-S37 PolarHBondContact O-OG 3.42Å; E35-S37 PolarHBondContact O-N 3.13Å; E35-S37 VanDerWaalsContact O-N 3.15Å
38R49.8Very low48.8Very low158 Ų158143.4 Ų143.460%0.59672%0.718SS**Hα-helixtrans-71.8-36.1-172.3-64-169.6-173.7-93.9-1.3112.3E35E35-R38 PolarHBondContact O-N 2.75Å; E35-R38 VanDerWaalsContact OE2-CD 3.3Å; E35-R38 WeakPolarHBondContact OE2-CD 3.46Å; E35-R38 IonicContact OE2-NE 3.41Å; E35-R38 PolarHBondContact OE2-NE 3.27Å
39Q49.7Very low49.2Very low176 Ų176139 Ų13982%0.82270%0.699SS**THydrogen-bonded Turntrans-77-24.1-171-147.9173.43500114.1
40V49.8Very low50Low98 Ų98141.6 Ų141.659%0.59469%0.686SS**THydrogen-bonded Turntrans-81.7-26.5179.6-175.40000112.2K42V40-K42 PolarHBondContact O-N 3.13Å; V40-K42 VanDerWaalsContact O-N 3.17Å
41R52.7Low50.6Low234 Ų234141.9 Ų141.988%0.88368%0.681SS**THydrogen-bonded Turntrans-79.37-171.5-138.3174-170.4173.73.1115.2
42K58.1Low51.9Low198 Ų198140.3 Ų140.386%0.86167%0.672SS**  trans-103.341-179.4-154.8175.8-176.8177.70113.2V40V40-K42 PolarHBondContact O-N 3.13Å; V40-K42 VanDerWaalsContact O-N 3.17Å
43R53.4Low53.2Low204 Ų204133 Ų13377%0.7765%0.649SS**SBendtrans-122.5119.6174.8-68.4-172.7176113.7-1111.8
44N56Low54.3Low100 Ų100131.7 Ų131.754%0.53563%0.632SS.*  trans59.362161.4-142.7-25.2000119.1A46 L47N44-A46 PolarHBondContact O-N 3.19Å; N44-A46 VanDerWaalsContact O-N 3.12Å; N44-A46 PolarHBondContact OD1-N 3.21Å; N44-L47 HydrophobicContact CB-CD1 4.36Å; N44-L47 WeakPolarHBondContact ND2-CD1 3.27Å; N44-L47 PolarHBondContact O-N 3.19Å
45K52.3Low55.5Low181 Ų181130.8 Ų130.879%0.78763%0.632SS**THydrogen-bonded Turntrans-62-12.5168.6-162.8172.8-178.6-177.50113.7
46A55.2Low57.2Low64 Ų64129.4 Ų129.453%0.52963%0.626SS.*THydrogen-bonded Turntrans-81.6-13.3-179.600000114.8N44N44-A46 PolarHBondContact O-N 3.19Å; N44-A46 VanDerWaalsContact O-N 3.12Å; N44-A46 PolarHBondContact OD1-N 3.21Å
47L51.5Low58.7Low102 Ų102127.5 Ų127.553%0.53461%0.61SS.*Hα-helixtrans-91.4-30.2175-71.6174.3000113N44 V49 R50N44-L47 HydrophobicContact CB-CD1 4.36Å; N44-L47 WeakPolarHBondContact ND2-CD1 3.27Å; N44-L47 PolarHBondContact O-N 3.19Å; L47-V49 VanDerWaalsContact C-N 3.29Å; L47-V49 PolarHBondContact O-N 3.43Å; L47-R50 PolarHBondContact O-N 3.12Å
48Q54.1Low60.1Low173 Ų173130.2 Ų130.281%0.80862%0.615SS**Hα-helixtrans-78.1-12.5-175.3-165.6161.260.600113.7
49V55.2Low61.2Low79 Ų79126.8 Ų126.848%0.47961%0.608SS.*Hα-helixtrans-78.2-47170.5-1730000110.3L47 F51 K52 D53L47-V49 VanDerWaalsContact C-N 3.29Å; L47-V49 PolarHBondContact O-N 3.43Å; V49-F51 PolarHBondContact O-N 3.39Å; V49-K52 WeakPolarHBondContact O-CA 3.4Å; V49-K52 WeakPolarHBondContact O-CB 3.46Å; V49-K52 PolarHBondContact O-N 3.05Å; V49-D53 WeakPolarHBondContact CG1-OD1 3.43Å; V49-D53 PolarHBondContact O-N 2.63Å
50R60.3Low62.5Low156 Ų156124.5 Ų124.559%0.58960%0.598SS**Hα-helixtrans-55.6-29.4-172.9-63.1-172.6-174.5-154.6-1.7115.8L47 K52 D53 I54L47-R50 PolarHBondContact O-N 3.12Å; R50-K52 VanDerWaalsContact C-N 3.33Å; R50-D53 WeakPolarHBondContact CA-OD2 3.48Å; R50-D53 PolarHBondContact O-N 3.16Å; R50-I54 HydrophobicContact CB-CD1 4.49Å; R50-I54 WeakPolarHBondContact O-CB 3.36Å; R50-I54 WeakPolarHBondContact O-CD1 3.08Å; R50-I54 WeakPolarHBondContact O-CG1 3.39Å; R50-I54 PolarHBondContact O-N 3.41Å
51F58.5Low63.4Low158 Ų158125.6 Ų125.669%0.69360%0.596SS**Hα-helixtrans-71.5-26.2175.6-95.5-79.1000113.4V49 C55V49-F51 PolarHBondContact O-N 3.39Å; F51-C55 PolarHBondContact O-N 3.47Å; F51-C55 PolarHBondContact O-SG 3.13Å; F51-C55 VanDerWaalsContact O-SG 3.39Å
52K73Confident64.3Low136 Ų136122.4 Ų122.459%0.59158%0.584SS**Hα-helixtrans-69.3-56.7167.6173.454.361.4172.70108.7V49 R50 I54 C55 E56V49-K52 WeakPolarHBondContact O-CA 3.4Å; V49-K52 WeakPolarHBondContact O-CB 3.46Å; V49-K52 PolarHBondContact O-N 3.05Å; R50-K52 VanDerWaalsContact C-N 3.33Å; K52-I54 VanDerWaalsContact C-N 3.27Å; K52-I54 PolarHBondContact O-N 3.07Å; K52-C55 PolarHBondContact O-N 3.01Å; K52-E56 WeakPolarHBondContact CD-OE2 3.47Å; K52-E56 WeakPolarHBondContact CG-OE2 3.49Å; K52-E56 VanDerWaalsContact O-CB 3.28Å; K52-E56 WeakPolarHBondContact O-CB 3.33Å; K52-E56 PolarHBondContact O-N 3.33Å
53D67.1Low64.9Low77 Ų77117.6 Ų117.641%0.41257%0.565SS.*Hα-helixtrans-52.6-41.1-178.6-39.9-20.4000113V49 R50 A57V49-D53 WeakPolarHBondContact CG1-OD1 3.43Å; V49-D53 PolarHBondContact O-N 2.63Å; R50-D53 WeakPolarHBondContact CA-OD2 3.48Å; R50-D53 PolarHBondContact O-N 3.16Å; D53-A57 VanDerWaalsContact O-CB 3.28Å; D53-A57 WeakPolarHBondContact O-CB 3.44Å; D53-A57 PolarHBondContact O-N 3.23Å
54I70.4Confident65.6Low89 Ų89110.6 Ų110.646%0.45655%0.551SS.*Hα-helixtrans-69.5-44.3178.8-71.3164.1000111.8R50 K52 E56 Q58R50-I54 HydrophobicContact CB-CD1 4.49Å; R50-I54 WeakPolarHBondContact O-CB 3.36Å; R50-I54 WeakPolarHBondContact O-CD1 3.08Å; R50-I54 WeakPolarHBondContact O-CG1 3.39Å; R50-I54 PolarHBondContact O-N 3.41Å; K52-I54 VanDerWaalsContact C-N 3.27Å; K52-I54 PolarHBondContact O-N 3.07Å; I54-E56 VanDerWaalsContact C-N 3.31Å; I54-Q58 WeakPolarHBondContact O-CB 3.49Å; I54-Q58 VanDerWaalsContact O-CG 3.29Å; I54-Q58 WeakPolarHBondContact O-CG 3.43Å; I54-Q58 PolarHBondContact O-N 3.43Å
55C71.1Confident66.1Low73 Ų73111.5 Ų111.549%0.49355%0.552SS.*Hα-helixtrans-70.2-31.4177-70.80000112.1F51 K52 N59F51-C55 PolarHBondContact O-N 3.47Å; F51-C55 PolarHBondContact O-SG 3.13Å; F51-C55 VanDerWaalsContact O-SG 3.39Å; K52-C55 PolarHBondContact O-N 3.01Å; C55-N59 WeakPolarHBondContact O-CB 3.44Å; C55-N59 PolarHBondContact O-N 2.97Å
56E76.3Confident66.7Low103 Ų103108.4 Ų108.448%0.48154%0.543SS..Hα-helixtrans-70-50.1176.7-165.4150.4-153.300110.4K52 I54 Q58 N59 E60K52-E56 WeakPolarHBondContact CD-OE2 3.47Å; K52-E56 WeakPolarHBondContact CG-OE2 3.49Å; K52-E56 VanDerWaalsContact O-CB 3.28Å; K52-E56 WeakPolarHBondContact O-CB 3.33Å; K52-E56 PolarHBondContact O-N 3.33Å; I54-E56 VanDerWaalsContact C-N 3.31Å; E56-Q58 VanDerWaalsContact C-N 3.31Å; E56-Q58 PolarHBondContact O-N 3.48Å; E56-N59 CarbonylContact O-C 3.55Å; E56-N59 WeakPolarHBondContact O-CA 3.5Å; E56-N59 WeakPolarHBondContact O-CB 3.31Å; E56-N59 PolarHBondContact O-N 3.37Å; E56-E60 WeakPolarHBondContact O-CG 3.3Å; E56-E60 PolarHBondContact O-N 3.13Å
57A74Confident66.9Low49 Ų49111.1 Ų111.141%0.40555%0.545SS..Hα-helixtrans-60.3-35.8172.900000113.3D53 N59 Q61D53-A57 VanDerWaalsContact O-CB 3.28Å; D53-A57 WeakPolarHBondContact O-CB 3.44Å; D53-A57 PolarHBondContact O-N 3.23Å; A57-N59 VanDerWaalsContact C-N 3.32Å; A57-Q61 VanDerWaalsContact O-CB 3.32Å; A57-Q61 WeakPolarHBondContact O-CB 3.14Å; A57-Q61 PolarHBondContact O-N 2.77Å
58Q73.3Confident67.3Low127 Ų127109.6 Ų109.659%0.59355%0.547SS*.Hα-helixtrans-70.1-26.5172.7-76.9-178.9-6.800113.2I54 E56 R62I54-Q58 WeakPolarHBondContact O-CB 3.49Å; I54-Q58 VanDerWaalsContact O-CG 3.29Å; I54-Q58 WeakPolarHBondContact O-CG 3.43Å; I54-Q58 PolarHBondContact O-N 3.43Å; E56-Q58 VanDerWaalsContact C-N 3.31Å; E56-Q58 PolarHBondContact O-N 3.48Å; Q58-R62 WeakPolarHBondContact O-CB 3.32Å; Q58-R62 PolarHBondContact O-N 3.36Å
59N73.6Confident67.5Low86 Ų86105.3 Ų105.346%0.4654%0.541SS..Hα-helixtrans-78-47.4172.5-169.881.9000111C55 E56 A57 Q61 R62 E63C55-N59 WeakPolarHBondContact O-CB 3.44Å; C55-N59 PolarHBondContact O-N 2.97Å; E56-N59 CarbonylContact O-C 3.55Å; E56-N59 WeakPolarHBondContact O-CA 3.5Å; E56-N59 WeakPolarHBondContact O-CB 3.31Å; E56-N59 PolarHBondContact O-N 3.37Å; A57-N59 VanDerWaalsContact C-N 3.32Å; N59-Q61 VanDerWaalsContact C-N 3.32Å; N59-Q61 PolarHBondContact O-N 3.1Å; N59-R62 WeakPolarHBondContact O-CB 3.23Å; N59-R62 PolarHBondContact O-N 2.73Å; N59-E63 WeakPolarHBondContact O-CB 3.39Å; N59-E63 PolarHBondContact O-N 3.39Å
60E75.8Confident67.5Low128 Ų128104.7 Ų104.760%0.59855%0.551SS**Hα-helixtrans-56.9-42.6174.5-70.6-176.1142.500111.9E56 E63 A64E56-E60 WeakPolarHBondContact O-CG 3.3Å; E56-E60 PolarHBondContact O-N 3.13Å; E60-E63 PolarHBondContact O-N 3.19Å; E60-A64 VanDerWaalsContact O-CB 3.29Å; E60-A64 WeakPolarHBondContact O-CB 3.37Å; E60-A64 PolarHBondContact O-N 3.29Å
61Q68.9Low67.2Low121 Ų121105.5 Ų105.557%0.56556%0.559SS**Hα-helixtrans-64.5-43.1176.5-174.4179.3-25.700111.9A57 N59 E63 A64 E65A57-Q61 VanDerWaalsContact O-CB 3.32Å; A57-Q61 WeakPolarHBondContact O-CB 3.14Å; A57-Q61 PolarHBondContact O-N 2.77Å; N59-Q61 VanDerWaalsContact C-N 3.32Å; N59-Q61 PolarHBondContact O-N 3.1Å; Q61-E63 VanDerWaalsContact C-N 3.32Å; Q61-E63 PolarHBondContact O-N 3.3Å; Q61-A64 PolarHBondContact O-N 3.42Å; Q61-E65 PolarHBondContact NE2-OE1 3.48Å; Q61-E65 WeakPolarHBondContact O-CG 3.17Å; Q61-E65 PolarHBondContact O-N 3.07Å
62R72.9Confident67Low167 Ų167102.3 Ų102.363%0.6357%0.57SS**Hα-helixtrans-61.7-41.7174.2179.2-167.8-60.7-108-1.9111.3Q58 N59 E65 L66Q58-R62 WeakPolarHBondContact O-CB 3.32Å; Q58-R62 PolarHBondContact O-N 3.36Å; N59-R62 WeakPolarHBondContact O-CB 3.23Å; N59-R62 PolarHBondContact O-N 2.73Å; R62-E65 PolarHBondContact O-N 3.03Å; R62-L66 HydrophobicContact CG-CD1 4.21Å; R62-L66 VanDerWaalsContact O-CG 3.31Å; R62-L66 WeakPolarHBondContact O-CG 3.38Å; R62-L66 PolarHBondContact O-N 3.41Å
63E69.8Low65.8Low97 Ų9798.8 Ų98.845%0.45357%0.573SS.*Hα-helixtrans-70.1-38.4-179.7-158.1179.513900111.4N59 E60 Q61 L66 Q67N59-E63 WeakPolarHBondContact O-CB 3.39Å; N59-E63 PolarHBondContact O-N 3.39Å; E60-E63 PolarHBondContact O-N 3.19Å; Q61-E63 VanDerWaalsContact C-N 3.32Å; Q61-E63 PolarHBondContact O-N 3.3Å; E63-L66 PolarHBondContact O-N 2.98Å; E63-Q67 WeakPolarHBondContact O-CB 3.23Å; E63-Q67 VanDerWaalsContact O-CG 3.3Å; E63-Q67 WeakPolarHBondContact O-CG 3.18Å; E63-Q67 PolarHBondContact O-N 2.79Å; E63-Q67 PolarHBondContact OE1-NE2 3.34Å
64A68.7Low65.4Low57 Ų57104.5 Ų104.547%0.47159%0.594SS.*Hα-helixtrans-63.3-40.1171.800000112.3E60 Q61 Q67 A68E60-A64 VanDerWaalsContact O-CB 3.29Å; E60-A64 WeakPolarHBondContact O-CB 3.37Å; E60-A64 PolarHBondContact O-N 3.29Å; Q61-A64 PolarHBondContact O-N 3.42Å; A64-Q67 PolarHBondContact O-N 3.01Å; A64-A68 VanDerWaalsContact O-CB 3.27Å; A64-A68 WeakPolarHBondContact O-CB 3.31Å; A64-A68 PolarHBondContact O-N 2.96Å
65E65.6Low64.3Low119 Ų119106.4 Ų106.456%0.55661%0.612SS**Hα-helixtrans-63.8-40.4172.8-76.1175.3-174.800111.8Q61 R62 A68 A69Q61-E65 PolarHBondContact NE2-OE1 3.48Å; Q61-E65 WeakPolarHBondContact O-CG 3.17Å; Q61-E65 PolarHBondContact O-N 3.07Å; R62-E65 PolarHBondContact O-N 3.03Å; E65-A68 PolarHBondContact O-N 2.93Å; E65-A69 WeakPolarHBondContact O-CB 3.31Å; E65-A69 PolarHBondContact O-N 3.03Å
66L64.6Low63.1Low115 Ų115111.3 Ų111.360%0.60263%0.63SS**Hα-helixtrans-68.2-40.4174.8-71168.7000112.6R62 E63 A68 A69 G70R62-L66 HydrophobicContact CG-CD1 4.21Å; R62-L66 VanDerWaalsContact O-CG 3.31Å; R62-L66 WeakPolarHBondContact O-CG 3.38Å; R62-L66 PolarHBondContact O-N 3.41Å; E63-L66 PolarHBondContact O-N 2.98Å; L66-A68 VanDerWaalsContact C-N 3.34Å; L66-A69 PolarHBondContact O-N 2.99Å; L66-G70 PolarHBondContact O-N 3.2Å
67Q61.4Low61.8Low122 Ų122111.7 Ų111.757%0.5764%0.643SS**Hα-helixtrans-68.8-31.9175.3-71.2-17634.300112E63 A64E63-Q67 WeakPolarHBondContact O-CB 3.23Å; E63-Q67 VanDerWaalsContact O-CG 3.3Å; E63-Q67 WeakPolarHBondContact O-CG 3.18Å; E63-Q67 PolarHBondContact O-N 2.79Å; E63-Q67 PolarHBondContact OE1-NE2 3.34Å; A64-Q67 PolarHBondContact O-N 3.01Å
68A59.2Low60.3Low70 Ų70118.7 Ų118.758%0.57966%0.661SS**Hα-helixtrans-68.8-42.3170.900000111.9A64 E65 L66 G70 K71A64-A68 VanDerWaalsContact O-CB 3.27Å; A64-A68 WeakPolarHBondContact O-CB 3.31Å; A64-A68 PolarHBondContact O-N 2.96Å; E65-A68 PolarHBondContact O-N 2.93Å; L66-A68 VanDerWaalsContact C-N 3.34Å; A68-G70 VanDerWaalsContact C-N 3.33Å; A68-G70 PolarHBondContact O-N 3.09Å; A68-K71 PolarHBondContact O-N 2.93Å
69A58.1Low59Low82 Ų82121.6 Ų121.668%0.67867%0.671SS**Hα-helixtrans-67-31.7174.600000113E65 L66 K71E65-A69 WeakPolarHBondContact O-CB 3.31Å; E65-A69 PolarHBondContact O-N 3.03Å; L66-A69 PolarHBondContact O-N 2.99Å; A69-K71 VanDerWaalsContact C-N 3.29Å; A69-K71 PolarHBondContact O-N 2.9Å
70G55.5Low57.4Low67 Ų67122.6 Ų122.669%0.69168%0.681SS**THydrogen-bonded Turntrans-71-15.617900000115.2L66 A68L66-G70 PolarHBondContact O-N 3.2Å; A68-G70 VanDerWaalsContact C-N 3.33Å; A68-G70 PolarHBondContact O-N 3.09Å
71K53.7Low55.6Low173 Ų173120.3 Ų120.375%0.75268%0.683SS**SBendtrans-100.6107.1173.2-68.9-174.7-175.2-121.70109.4A68 A69 G73A68-K71 PolarHBondContact O-N 2.93Å; A69-K71 VanDerWaalsContact C-N 3.29Å; A69-K71 PolarHBondContact O-N 2.9Å; K71-G73 PolarHBondContact O-N 3.27Å
72G55Low54Low91 Ų91123.4 Ų123.494%0.93869%0.691SS**  trans-63.964.4-177.500000115.5
73G47.6Very low53Low62 Ų62126 Ų12664%0.63970%0.701SS**  trans-87.8137.2165.200000110.3K71K71-G73 PolarHBondContact O-N 3.27Å
74K58.9Low51.6Low196 Ų196128.5 Ų128.585%0.85271%0.71SS**  trans-51.2139.4175.6-61.1167.9-175.6174.30109.4M76K74-M76 PolarHBondContact O-N 2.82Å
75P46.2Very low50.4Low129 Ų129135.2 Ų135.284%0.83873%0.725SS**  trans-59.4105.3179.324.9-33.8000109S77P75-S77 PolarHBondContact O-N 3.4Å; P75-S77 VanDerWaalsContact O-N 3.07Å
76M45.5Very low49Very low177 Ų177136.3 Ų136.387%0.87273%0.732SS**  trans-60.8118172.6-130.1-172.8-176.900105.5K74 Y78K74-M76 PolarHBondContact O-N 2.82Å; M76-Y78 PolarHBondContact O-N 3.32Å
77S50.5Low48.4Very low110 Ų110136.7 Ų136.777%0.76974%0.739SS**  trans-70.779177.559.50000108.1P75 K79P75-S77 PolarHBondContact O-N 3.4Å; P75-S77 VanDerWaalsContact O-N 3.07Å; S77-K79 PolarHBondContact O-N 2.94Å
78Y40.5Very low47.6Very low196 Ų196136.4 Ų136.477%0.76975%0.746SS**  trans-62.996.8174.1-153.8-93.5000105.5M76 V80M76-Y78 PolarHBondContact O-N 3.32Å; Y78-V80 HydrophobicContact CD1-CG2 4.01Å; Y78-V80 PolarHBondContact O-N 3.39Å
79K47.2Very low46.7Very low188 Ų188137.8 Ų137.882%0.81775%0.749SS**  trans-62.284.8160-77.9-174.8176.6178.10104.9S77 A81S77-K79 PolarHBondContact O-N 2.94Å; K79-A81 PolarHBondContact O-N 3.04Å
80V38.9Very low46.1Very low108 Ų108138 Ų13866%0.65575%0.75SS**  trans-46.3101.8151.4174.10000103Y78 Y82Y78-V80 HydrophobicContact CD1-CG2 4.01Å; Y78-V80 PolarHBondContact O-N 3.39Å; V80-Y82 PolarHBondContact O-N 2.86Å
81A39.6Very low45.8Very low79 Ų79144.6 Ų144.665%0.65375%0.754SS**  trans-65.293.2174.400000103.3K79 R83K79-A81 PolarHBondContact O-N 3.04Å; A81-R83 PolarHBondContact O-N 3.33Å
82Y35.2Very low45.6Very low186 Ų186146.7 Ų146.773%0.72976%0.757SS**  trans-61.291.8178.2-173.3-93.4000104.2V80 K84V80-Y82 PolarHBondContact O-N 2.86Å; Y82-K84 HydrophobicContact CD1-CB 3.78Å; Y82-K84 HydrophobicContact CE1-CB 3.92Å; Y82-K84 HydrophobicContact CE1-CG 4.23Å; Y82-K84 PolarHBondContact O-N 3.3Å
83R51.1Low45.5Very low222 Ų222147.1 Ų147.184%0.83875%0.746SS**  trans-68.873.8167-73.9-163.8178.3-127.91.4104.1A81 Y85A81-R83 PolarHBondContact O-N 3.33Å; R83-Y85 VanDerWaalsContact C-N 3.3Å; R83-Y85 WeakPolarHBondContact O-CA 3.35Å; R83-Y85 PolarHBondContact O-N 2.93Å
84K40.9Very low45.9Very low149 Ų149148.7 Ų148.765%0.64874%0.738SS**  trans-39.3104.5167.1-179.1177.6-172.8176.20103.3Y82 M86Y82-K84 HydrophobicContact CD1-CB 3.78Å; Y82-K84 HydrophobicContact CE1-CB 3.92Å; Y82-K84 HydrophobicContact CE1-CG 4.23Å; Y82-K84 PolarHBondContact O-N 3.3Å; K84-M86 HydrophobicContact CD-CE 4.38Å; K84-M86 HydrophobicContact CG-CE 4.24Å; K84-M86 PolarHBondContact O-N 3.23Å
85Y43Very low45.3Very low198 Ų198144 Ų14478%0.77673%0.728SS**  trans-52.3114.9-171.6-77.5-97.3000104.7R83 T87R83-Y85 VanDerWaalsContact C-N 3.3Å; R83-Y85 WeakPolarHBondContact O-CA 3.35Å; R83-Y85 PolarHBondContact O-N 2.93Å; Y85-T87 PolarHBondContact O-N 3.16Å; Y85-T87 PolarHBondContact O-OG1 3.24Å
86M37.1Very low45.6Very low142 Ų142142 Ų14270%0.771%0.711SS**  trans-67.990.1162.9-71.4-66.297.600102K84 V88K84-M86 HydrophobicContact CD-CE 4.38Å; K84-M86 HydrophobicContact CG-CE 4.24Å; K84-M86 PolarHBondContact O-N 3.23Å; M86-V88 HydrophobicContact CB-CG2 4.16Å; M86-V88 WeakPolarHBondContact O-CG2 3.41Å; M86-V88 PolarHBondContact O-N 2.95Å
87T52.3Low46.1Very low124 Ų124135 Ų13576%0.76168%0.677SS**  trans-63.774.6160.9-34.90000103.9Y85 P89Y85-T87 PolarHBondContact O-N 3.16Å; Y85-T87 PolarHBondContact O-OG1 3.24Å; T87-P89 WeakPolarHBondContact O-CD 3.42Å
88V44.2Very low46.4Very low116 Ų116132.7 Ų132.770%0.70366%0.659SS**  trans-53.9116.1-177.1-178.40000103.7M86 A90M86-V88 HydrophobicContact CB-CG2 4.16Å; M86-V88 WeakPolarHBondContact O-CG2 3.41Å; M86-V88 PolarHBondContact O-N 2.95Å; V88-A90 PolarHBondContact O-N 3.2Å
89P39.5Very low47.3Very low99 Ų99130 Ų13064%0.64365%0.647SS**  trans-56.2118.7-175.7-26.635.2000107.1T87 R91T87-P89 WeakPolarHBondContact O-CD 3.42Å; P89-R91 HydrophobicContact CB-CB 4.48Å; P89-R91 HydrophobicContact CB-CG 4.42Å; P89-R91 PolarHBondContact O-N 2.53Å
90A46.3Very low48.1Very low85 Ų85123.1 Ų123.170%0.70262%0.623SS**  trans-68.420.4-178.700000112.7V88 R92V88-A90 PolarHBondContact O-N 3.2Å; A90-R92 PolarHBondContact O-N 2.79Å
91R47.6Very low49.2Very low207 Ų207122.9 Ų122.978%0.78162%0.621SS**  trans-67.959.9161.6-62.2-174.7174.3-123.2-9110P89 S93P89-R91 HydrophobicContact CB-CB 4.48Å; P89-R91 HydrophobicContact CB-CG 4.42Å; P89-R91 PolarHBondContact O-N 2.53Å; R91-S93 PolarHBondContact O-N 3.36Å
92R50.7Low50.5Low217 Ų217119.9 Ų119.982%0.81960%0.599SS**  trans-66.663.4143.5-65.9-174.5-173.6-123.47.5107.7A90 I94A90-R92 PolarHBondContact O-N 2.79Å; R92-I94 PolarHBondContact O-N 2.69Å
93S52.9Low52Low99 Ų99111.3 Ų111.369%0.69257%0.566SS**  trans-55107.7161.646.70000105.8R91 P95R91-S93 PolarHBondContact O-N 3.36Å; S93-P95 WeakPolarHBondContact O-CD 3.49Å
94I55.4Low52.5Low95 Ų95105.9 Ų105.949%0.48755%0.55SS..  trans-57.1107-156.2-62.8170.7000108.7R92 N96 V97R92-I94 PolarHBondContact O-N 2.69Å; I94-N96 PolarHBondContact O-N 3.3Å; I94-V97 HydrophobicContact CB-CG2 3.8Å; I94-V97 HydrophobicContact CG2-CG2 4.03Å; I94-V97 PolarHBondContact O-N 3.4Å
95P46.3Very low53.5Low98 Ų98102.7 Ų102.764%0.63654%0.543SS*.THydrogen-bonded Turntrans-65.8133.7175.329.1-31.3000106S93S93-P95 WeakPolarHBondContact O-CD 3.49Å
96N53.4Low54.5Low88 Ų8893.4 Ų93.447%0.47151%0.507SS..THydrogen-bonded Turntrans83.720.7-177-44.1-63.7000118I94 T98 R99 S100I94-N96 PolarHBondContact O-N 3.3Å; N96-T98 PolarHBondContact O-N 2.93Å; N96-R99 HydrophobicContact CB-CB 4.01Å; N96-R99 HydrophobicContact CB-CG 4.12Å; N96-R99 CarbonylContact O-C 3.58Å; N96-R99 WeakPolarHBondContact O-CA 3.39Å; N96-R99 PolarHBondContact O-N 3.35Å; N96-R99 VanDerWaalsContact OD1-CD 3.31Å; N96-R99 WeakPolarHBondContact OD1-CD 3.48Å; N96-S100 PolarHBondContact O-N 2.87Å; N96-S100 VanDerWaalsContact O-N 3.07Å
97V55.9Low55.7Low28 Ų2891.1 Ų91.117%0.1750%0.502CS..G310 helixtrans-51-43.7164175.10000110.8I94 R99 S100 V103 I429I94-V97 HydrophobicContact CB-CG2 3.8Å; I94-V97 HydrophobicContact CG2-CG2 4.03Å; I94-V97 PolarHBondContact O-N 3.4Å; V97-R99 PolarHBondContact O-N 2.95Å; V97-S100 WeakPolarHBondContact O-CB 3.25Å; V97-S100 PolarHBondContact O-N 3.36Å; V97-S100 VanDerWaalsContact O-N 3.11Å; V97-S100 PolarHBondContact O-OG 2.94Å; V97-V103 HydrophobicContact CG1-CG2 4.34Å; V97-I429 HydrophobicContact CG1-CD1 4.24Å; V97-I429 HydrophobicContact CG2-CD1 4.19Å
98T57.3Low56.4Low62 Ų6288 Ų8838%0.3848%0.481SS..G310 helixtrans-71.2-717653.10000115.2N96 Y113N96-T98 PolarHBondContact O-N 2.93Å; T98-Y113 VanDerWaalsContact CG2-O 3.23Å; T98-Y113 WeakPolarHBondContact CG2-O 3.45Å
99R58.8Low57.4Low140 Ų14082.6 Ų82.653%0.52845%0.448SS..G310 helixtrans-109.24.4168.2-42.4-174.2176.1-169.4-7.6113.4N96 V97 E119N96-R99 HydrophobicContact CB-CB 4.01Å; N96-R99 HydrophobicContact CB-CG 4.12Å; N96-R99 CarbonylContact O-C 3.58Å; N96-R99 WeakPolarHBondContact O-CA 3.39Å; N96-R99 PolarHBondContact O-N 3.35Å; N96-R99 VanDerWaalsContact OD1-CD 3.31Å; N96-R99 WeakPolarHBondContact OD1-CD 3.48Å; V97-R99 PolarHBondContact O-N 2.95Å; R99-E119 IonicContact CZ-OE1 3.3Å; R99-E119 IonicContact NH2-OE1 2.67Å; R99-E119 PolarHBondContact NH2-OE1 2.91Å
100S64Low58.7Low44 Ų4484 Ų8431%0.30845%0.445SS..SBendtrans-68.2137.9172.668.60000109.7N96 V97 G102 V103 Q104N96-S100 PolarHBondContact O-N 2.87Å; N96-S100 VanDerWaalsContact O-N 3.07Å; V97-S100 WeakPolarHBondContact O-CB 3.25Å; V97-S100 PolarHBondContact O-N 3.36Å; V97-S100 VanDerWaalsContact O-N 3.11Å; V97-S100 PolarHBondContact O-OG 2.94Å; S100-G102 PolarHBondContact O-N 2.88Å; S100-V103 PolarHBondContact O-N 3.31Å; S100-V103 WeakPolarHBondContact OG-CB 3.47Å; S100-V103 VanDerWaalsContact OG-CG2 3.25Å; S100-V103 WeakPolarHBondContact OG-CG2 3.29Å; S100-Q104 PolarHBondContact O-N 3.38Å
101T61.9Low59.7Low102 Ų10286.7 Ų86.763%0.62644%0.44SS*.Hα-helixtrans-56.1-40.9-174-430000111.6V103 Q104 T105T101-V103 PolarHBondContact O-N 3.47Å; T101-Q104 CarbonylContact O-C 3.48Å; T101-Q104 PolarHBondContact O-N 3.11Å; T101-Q104 VanDerWaalsContact O-N 3.07Å; T101-T105 HydrophobicContact CG2-CG2 4.13Å; T101-T105 WeakPolarHBondContact O-CG2 3.23Å; T101-T105 PolarHBondContact O-N 3.31Å; T101-T105 PolarHBondContact O-OG1 2.93Å
102G66.8Low60.5Low17 Ų1784.9 Ų84.918%0.17543%0.433CS..Hα-helixtrans-61.4-36.4176.800000114.5S100 Q104 S106S100-G102 PolarHBondContact O-N 2.88Å; G102-Q104 VanDerWaalsContact C-N 3.34Å; G102-S106 WeakPolarHBondContact O-CB 3.37Å; G102-S106 PolarHBondContact O-N 3.07Å
103V65.6Low60.9Low6 Ų677.9 Ų77.94%0.03641%0.407CS..Hα-helixtrans-78.2-20.9174.9177.70000111.8V97 S100 T101 L109 Y113V97-V103 HydrophobicContact CG1-CG2 4.34Å; S100-V103 PolarHBondContact O-N 3.31Å; S100-V103 WeakPolarHBondContact OG-CB 3.47Å; S100-V103 VanDerWaalsContact OG-CG2 3.25Å; S100-V103 WeakPolarHBondContact OG-CG2 3.29Å; T101-V103 PolarHBondContact O-N 3.47Å; V103-L109 HydrophobicContact CB-CB 4.42Å; V103-L109 HydrophobicContact CG1-CB 4.29Å; V103-L109 HydrophobicContact CG2-CB 4.11Å; V103-L109 HydrophobicContact CG2-CD1 4.25Å; V103-Y113 HydrophobicContact CG1-CD2 4.49Å; V103-Y113 HydrophobicContact CG2-CD2 4.44Å
104Q63.4Low61.2Low108 Ų10880.5 Ų80.551%0.50541%0.409SS..Hα-helixtrans-82.6-36.2173.9-68.7-176.2-19.300113S100 T101 G102S100-Q104 PolarHBondContact O-N 3.38Å; T101-Q104 CarbonylContact O-C 3.48Å; T101-Q104 PolarHBondContact O-N 3.11Å; T101-Q104 VanDerWaalsContact O-N 3.07Å; G102-Q104 VanDerWaalsContact C-N 3.34Å
105T60.4Low61.1Low82 Ų8281.7 Ų81.750%0.50342%0.421SS..Hα-helixtrans-87.3-30.7179.657.70000113.2T101 P107T101-T105 HydrophobicContact CG2-CG2 4.13Å; T101-T105 WeakPolarHBondContact O-CG2 3.23Å; T101-T105 PolarHBondContact O-N 3.31Å; T101-T105 PolarHBondContact O-OG1 2.93Å; T105-P107 VanDerWaalsContact O-CD 3.32Å; T105-P107 WeakPolarHBondContact O-CD 3.44Å
106S65.3Low60.7Low3 Ų384.9 Ų84.92%0.02143%0.425CS..  trans-74.4121.5172.3174.20000111.8G102 D108 L109 K110 D436G102-S106 WeakPolarHBondContact O-CB 3.37Å; G102-S106 PolarHBondContact O-N 3.07Å; S106-D108 PolarHBondContact O-N 3.11Å; S106-D108 PolarHBondContact OG-N 3.4Å; S106-L109 PolarHBondContact OG-N 3.04Å; S106-K110 VanDerWaalsContact O-CB 3.3Å; S106-K110 WeakPolarHBondContact O-CB 3.44Å; S106-K110 PolarHBondContact O-N 3.25Å; S106-D436 WeakPolarHBondContact CB-OD2 3.46Å; S106-D436 VanDerWaalsContact OG-CG 3.27Å; S106-D436 PolarHBondContact OG-OD2 3.21Å
107P62.4Low60.3Low93 Ų9385.6 Ų85.660%0.60443%0.434SS*.THydrogen-bonded Turntrans-69.5-15.7173.6-18.933.8000114.1T105 K111T105-P107 VanDerWaalsContact O-CD 3.32Å; T105-P107 WeakPolarHBondContact O-CD 3.44Å; P107-K111 WeakPolarHBondContact O-CE 3.23Å; P107-K111 WeakPolarHBondContact O-CG 3.48Å
108D67.1Low59.7Low59 Ų5993.1 Ų93.132%0.31647%0.465SS..THydrogen-bonded Turntrans-94-47.2-178.1-163.772.9000112.5S106 K110 K111 R112S106-D108 PolarHBondContact O-N 3.11Å; S106-D108 PolarHBondContact OG-N 3.4Å; D108-K110 PolarHBondContact O-N 3.43Å; D108-K111 WeakPolarHBondContact O-CA 3.43Å; D108-K111 WeakPolarHBondContact O-CB 3.44Å; D108-K111 PolarHBondContact O-N 2.74Å; D108-R112 PolarHBondContact O-N 3.07Å; D108-R112 IonicContact OD2-CZ 3.21Å; D108-R112 IonicContact OD2-NE 2.68Å; D108-R112 PolarHBondContact OD2-NE 3.02Å; D108-R112 IonicContact OD2-NH2 3.24Å; D108-R112 PolarHBondContact OD2-NH2 3.02Å
109L64.6Low59.1Low2 Ų296.3 Ų96.31%0.0148%0.476CS..Hα-helixtrans-60.1-34.3175.1-53.5178.9000111.2V103 S106 K111 R112 Y113 S432 V433 D436V103-L109 HydrophobicContact CB-CB 4.42Å; V103-L109 HydrophobicContact CG1-CB 4.29Å; V103-L109 HydrophobicContact CG2-CB 4.11Å; V103-L109 HydrophobicContact CG2-CD1 4.25Å; S106-L109 PolarHBondContact OG-N 3.04Å; L109-K111 PolarHBondContact O-N 3.2Å; L109-R112 PolarHBondContact O-N 2.83Å; L109-R112 VanDerWaalsContact O-N 3.16Å; L109-Y113 HydrophobicContact CB-CD2 4.17Å; L109-Y113 HydrophobicContact CB-CE2 4.46Å; L109-Y113 HydrophobicContact CD2-CE2 4.34Å; L109-Y113 WeakPolarHBondContact O-CD2 3.07Å; L109-Y113 PolarHBondContact O-N 2.86Å; L109-S432 WeakPolarHBondContact CD2-OG 3.31Å; L109-V433 HydrophobicContact CD1-CB 4.48Å; L109-V433 HydrophobicContact CD1-CG2 3.52Å; L109-D436 WeakPolarHBondContact CD1-OD2 3.37Å; L109-D436 VanDerWaalsContact CG-OD2 3.23Å; L109-D436 WeakPolarHBondContact CG-OD2 3.23Å
110K66.7Low58.6Low130 Ų130100.5 Ų100.557%0.56549%0.491SS*.Hα-helixtrans-59.8-29.6173.4-170.3171.8-177.9175.30113.9S106 D108S106-K110 VanDerWaalsContact O-CB 3.3Å; S106-K110 WeakPolarHBondContact O-CB 3.44Å; S106-K110 PolarHBondContact O-N 3.25Å; D108-K110 PolarHBondContact O-N 3.43Å
111K68Low57.8Low140 Ų140107.1 Ų107.161%0.60952%0.515SS*.Hα-helixtrans-80.9-44.5171.4-60167.5-172172.30110.7P107 D108 L109 Y113 Q114P107-K111 WeakPolarHBondContact O-CE 3.23Å; P107-K111 WeakPolarHBondContact O-CG 3.48Å; D108-K111 WeakPolarHBondContact O-CA 3.43Å; D108-K111 WeakPolarHBondContact O-CB 3.44Å; D108-K111 PolarHBondContact O-N 2.74Å; L109-K111 PolarHBondContact O-N 3.2Å; K111-Y113 VanDerWaalsContact C-N 3.28Å; K111-Y113 PolarHBondContact O-N 3.47Å; K111-Q114 WeakPolarHBondContact O-CB 3.24Å; K111-Q114 PolarHBondContact O-N 3.19Å
112R63.1Low57.2Low170 Ų170112.4 Ų112.464%0.64253%0.529SS*.Hα-helixtrans-67.2-26-175.8-140.5-179.8-67-156.93.1113.5D108 L109D108-R112 PolarHBondContact O-N 3.07Å; D108-R112 IonicContact OD2-CZ 3.21Å; D108-R112 IonicContact OD2-NE 2.68Å; D108-R112 PolarHBondContact OD2-NE 3.02Å; D108-R112 IonicContact OD2-NH2 3.24Å; D108-R112 PolarHBondContact OD2-NH2 3.02Å; L109-R112 PolarHBondContact O-N 2.83Å; L109-R112 VanDerWaalsContact O-N 3.16Å
113Y60.3Low56.2Low69 Ų69114.9 Ų114.927%0.27155%0.554SS.*THydrogen-bonded Turntrans-11732.3177.8-60.5-72.2000113.3T98 V103 L109 K111 T115T98-Y113 VanDerWaalsContact CG2-O 3.23Å; T98-Y113 WeakPolarHBondContact CG2-O 3.45Å; V103-Y113 HydrophobicContact CG1-CD2 4.49Å; V103-Y113 HydrophobicContact CG2-CD2 4.44Å; L109-Y113 HydrophobicContact CB-CD2 4.17Å; L109-Y113 HydrophobicContact CB-CE2 4.46Å; L109-Y113 HydrophobicContact CD2-CE2 4.34Å; L109-Y113 WeakPolarHBondContact O-CD2 3.07Å; L109-Y113 PolarHBondContact O-N 2.86Å; K111-Y113 VanDerWaalsContact C-N 3.28Å; K111-Y113 PolarHBondContact O-N 3.47Å; Y113-T115 PolarHBondContact O-N 3.01Å
114Q57.8Low54.7Low154 Ų154121.7 Ų121.772%0.7259%0.585SS**  trans-67.8-2.2-176.7-158.7177.14800114.7K111 F116K111-Q114 WeakPolarHBondContact O-CB 3.24Å; K111-Q114 PolarHBondContact O-N 3.19Å; Q114-F116 VanDerWaalsContact C-N 3.3Å; Q114-F116 PolarHBondContact O-N 2.8Å
115T53.2Low53.8Low121 Ų121123 Ų12374%0.74260%0.601SS**  trans-82.544.2-167440000116Y113Y113-T115 PolarHBondContact O-N 3.01Å
116F39Very low52.8Low165 Ų165127.6 Ų127.672%0.72461%0.614SS**SBendtrans-145.2125.2151.4-90.4-70.7000110.2Q114 F118Q114-F116 VanDerWaalsContact C-N 3.3Å; Q114-F116 PolarHBondContact O-N 2.8Å; F116-F118 PolarHBondContact O-N 2.91Å
117P45.7Very low51.7Low102 Ų102135.9 Ų135.966%0.66265%0.65SS**PPolyproline II helixtrans-56.1133.5173.5-2534.5000111
118F42.5Very low50.3Low187 Ų187139.2 Ų139.282%0.8266%0.657SS**PPolyproline II helixtrans-51.1142.9170.7-168-94.2000109.7F116 R120F116-F118 PolarHBondContact O-N 2.91Å; F118-R120 PolarHBondContact O-N 3.04Å; F118-R120 VanDerWaalsContact O-N 3.1Å
119E44.4Very low48.7Very low129 Ų129142.1 Ų142.160%0.60368%0.677SS**PPolyproline II helixtrans-46.9120.9-170.2-82.3-179.9-157.700111.7R99 K121R99-E119 IonicContact CZ-OE1 3.3Å; R99-E119 IonicContact NH2-OE1 2.67Å; R99-E119 PolarHBondContact NH2-OE1 2.91Å; E119-K121 PolarHBondContact O-N 3.21Å
120R47.6Very low47.3Very low227 Ų227146.6 Ų146.686%0.85771%0.714SS**  trans-66.587.3173.3-69.4-170.2-176.1117.2-2.7108.7F118 K122F118-R120 PolarHBondContact O-N 3.04Å; F118-R120 VanDerWaalsContact O-N 3.1Å; R120-K122 PolarHBondContact O-N 3.35Å
121K47.1Very low45.8Very low184 Ų184144.6 Ų144.680%0.872%0.722SS**  trans-51.3133.3167.9-74.6-170.6175.2-176.50108.4E119 G123E119-K121 PolarHBondContact O-N 3.21Å; K121-G123 PolarHBondContact O-N 2.91Å; K121-G123 VanDerWaalsContact O-N 3.16Å
122K51Low44.3Very low213 Ų213144.1 Ų144.193%0.92673%0.73SS**SBendtrans-57.8111.2-160.5-177.5-178.6177.5-176.40112.7R120R120-K122 PolarHBondContact O-N 3.35Å
123G44.6Very low42.8Very low68 Ų68144.2 Ų144.270%0.70174%0.738SS**  trans83.491156.800000117.5K121K121-G123 PolarHBondContact O-N 2.91Å; K121-G123 VanDerWaalsContact O-N 3.16Å
124H35Very low41.7Very low149 Ų149146.9 Ų146.969%0.6976%0.762SS**  trans-144.4124.7138.3-145.887.9000110.7F126H124-F126 HydrophobicContact CB-CD2 4.36Å; H124-F126 HydrophobicContact CB-CE2 4.49Å; H124-F126 AromaticContact CD2-CD2 3.46Å; H124-F126 VanDerWaalsContact CD2-CD2 3.46Å; H124-F126 WeakPolarHBondContact CD2-CD2 3.44Å; H124-F126 AromaticContact CD2-CE2 3.27Å; H124-F126 WeakPolarHBondContact CD2-CE2 3.17Å; H124-F126 AromaticContact CD2-CZ 3.8Å; H124-F126 AromaticContact CG-CE2 3.96Å; H124-F126 AromaticContact NE2-CE2 3.89Å; H124-F126 AromaticContact NE2-CZ 3.97Å; H124-F126 PolarHBondContact O-N 3.34Å
125T44.6Very low40.3Very low136 Ų136150.3 Ų150.383%0.83477%0.77SS**  trans-90.571.3-178.148.50000111K127T125-K127 PolarHBondContact O-N 3.18Å; T125-K127 VanDerWaalsContact O-N 3.13Å
126F39.5Very low39.3Very low179 Ų179154.2 Ų154.279%0.78578%0.776SS**  trans-72.3104.2168.7-85.7-68.3000110.5H124H124-F126 HydrophobicContact CB-CD2 4.36Å; H124-F126 HydrophobicContact CB-CE2 4.49Å; H124-F126 AromaticContact CD2-CD2 3.46Å; H124-F126 VanDerWaalsContact CD2-CD2 3.46Å; H124-F126 WeakPolarHBondContact CD2-CD2 3.44Å; H124-F126 AromaticContact CD2-CE2 3.27Å; H124-F126 WeakPolarHBondContact CD2-CE2 3.17Å; H124-F126 AromaticContact CD2-CZ 3.8Å; H124-F126 AromaticContact CG-CE2 3.96Å; H124-F126 AromaticContact NE2-CE2 3.89Å; H124-F126 AromaticContact NE2-CZ 3.97Å; H124-F126 PolarHBondContact O-N 3.34Å
127K42.4Very low39Very low176 Ų176149.5 Ų149.577%0.76578%0.775SS**  trans-67.4130.6156.8-58.9173.9-179.2177.40107.7T125T125-K127 PolarHBondContact O-N 3.18Å; T125-K127 VanDerWaalsContact O-N 3.13Å
128H32.3Very low38.4Very low163 Ų163153 Ų15376%0.75578%0.782SS**  172.1160.9112.1-106.4-86000113.8
129V32.8Very low38Very low120 Ų120151.8 Ų151.873%0.72778%0.784SS**  trans58.1111.8156.2174.30000117.2
130A36.1Very low37.5Very low97 Ų97152.7 Ų152.780%0.80279%0.792SS**  trans-74.1117.6152.400000108.6
131A33.9Very low37.1Very low87 Ų87145.4 Ų145.472%0.71979%0.788SS**  trans-76.9122166.600000108.9E133A131-E133 PolarHBondContact O-N 3.36Å
132V37.3Very low36.2Very low130 Ų130146.5 Ų146.579%0.78879%0.793SS**  trans-84.2104170.6174.80000107.8T134V132-T134 HydrophobicContact CG1-CG2 4.18Å
133E32.5Very low35.3Very low173 Ų173142.9 Ų142.981%0.80879%0.789SS**  trans-94.5114.2166.2-76.3-165134.500110.5A131 Y135A131-E133 PolarHBondContact O-N 3.36Å; E133-Y135 PolarHBondContact O-N 2.91Å
134T36.3Very low34.8Very low125 Ų125148.2 Ų148.277%0.76780%0.798SS**  trans-81.495.6-178.452.10000111V132 K136V132-T134 HydrophobicContact CG1-CG2 4.18Å; T134-K136 PolarHBondContact O-N 2.98Å
135Y28.5Very low34.4Very low226 Ų226149.1 Ų149.189%0.88680%0.802SS**PPolyproline II helixtrans-75.6120.4171.4-118.1-91.6000111.4E133E133-Y135 PolarHBondContact O-N 2.91Å
136K32.5Very low33.8Very low202 Ų202147.1 Ų147.188%0.87880%0.799SS**PPolyproline II helixtrans-83.5132.2-172.5-163.9176.1-177.4-179.40110.8T134T134-K136 PolarHBondContact O-N 2.98Å
137G32.5Very low33.5Very low67 Ų67147.9 Ų147.969%0.69180%0.802SS**PPolyproline II helixtrans-58.7156.9-160.900000118.1
138H33.7Very low33.1Very low175 Ų175148.7 Ų148.781%0.8181%0.809SS**  trans-128.7119.5157.2-136.270.8000108.8
139N32.4Very low33.1Very low162 Ų162146.6 Ų146.687%0.86681%0.813SS**  trans-93.4107-179-70-33.2000109.7
140N35.9Very low33.1Very low147 Ų147150.9 Ų150.979%0.78682%0.822SS**  trans-102.1103.7162.5-76.5-20.1000108.2
141G37.2Very low32.8Very low74 Ų74150.9 Ų150.976%0.76382%0.821SS**  trans-70.3132.9-177.300000112.2
142F30.1Very low32.7Very low207 Ų207150.3 Ų150.391%0.90882%0.817SS**  trans-113.198.3161.8-118.8-91.9000108.6M144F142-M144 PolarHBondContact O-N 3.29Å
143V31.5Very low32.5Very low138 Ų138151.5 Ų151.584%0.83681%0.813SS**  trans-73.1117.4168.81760000107.2
144M33.4Very low32.4Very low180 Ų180151.5 Ų151.589%0.88781%0.814SS**  trans-96.3104.9170.4-143.2-172.7-49.500107.8F142 A146F142-M144 PolarHBondContact O-N 3.29Å; M144-A146 PolarHBondContact O-N 3.39Å
145E27.8Very low32Very low167 Ų167148.4 Ų148.478%0.7881%0.806SS**  trans-67121.7179.9-171.1-171.7156.500110.2
146A31.8Very low32.2Very low94 Ų94145.2 Ų145.278%0.77780%0.804SS**  trans-84.8129.1176.100000110.6M144M144-A146 PolarHBondContact O-N 3.39Å
147K33.4Very low32.1Very low196 Ų196142.6 Ų142.685%0.85280%0.799SS**  trans-123.6104.2174.3-160.5164.2-170.2165.30110.9
148Q33.4Very low32.2Very low192 Ų192148.8 Ų148.890%0.89781%0.81SS**  trans-80.9155.4177.9-68.3-177.8-12.500112.5
149S31Very low32.2Very low120 Ų120149.4 Ų149.484%0.83981%0.814SS**  trans-147.8128.6153.956.80000111.2
150K33.2Very low32.2Very low210 Ų210149.7 Ų149.791%0.91381%0.81SS**  trans-48.2166.5168.6-71.8177.4175.3-176.80113.6
151A31.3Very low31.9Very low96 Ų96151.4 Ų151.479%0.79381%0.813SS**  cis-173.2-159.2-19.500000105.7
152A32.1Very low31.5Very low75 Ų75151.6 Ų151.662%0.6282%0.815SS**  cis-158.5-178.33.100000108.9
153E31.7Very low31.6Very low155 Ų155146.7 Ų146.772%0.72481%0.812SS**  trans63.8142.9174.7-45.5-56.210200115.6
154Q31.1Very low31.8Very low174 Ų174145.5 Ų145.581%0.81381%0.811SS**  cis-159.6171.4-9.6-103.7168.931.700105.9
155G28.1Very low31.8Very low59 Ų59148.9 Ų148.961%0.60881%0.813SS**  cis152.7141.2-1.500000110.6
156L31.7Very low32Very low159 Ų159144.1 Ų144.183%0.83281%0.809SS**  trans70.8112.7179.7-43.8177.4000114.3
157D30.3Very low32.1Very low147 Ų147151.7 Ų151.779%0.78682%0.817SS**  78.3148.665.5-57-37.7000111.8
158E35.5Very low32Very low197 Ų197145.8 Ų145.892%0.92181%0.812SS**  cis-126.3-120.623.6-59.6166.5120.900114.5
159E33.4Very low32.2Very low189 Ų189142.9 Ų142.988%0.88381%0.807SS**  trans-122.5175.9-158.4-64.1-165.911100118.7
160E31.4Very low32.7Very low167 Ų167145.1 Ų145.178%0.7881%0.809SS**  trans93155.1147-89.7-79.366.700123.8
161E30.2Very low32.9Very low183 Ų183146 Ų14686%0.85581%0.806SS**  trans-50.4151.4-164.7-81.3-159.3121.400119.3
162G29.3Very low33.1Very low78 Ų78148 Ų14880%0.80481%0.809SS**  trans175.5103.3163.100000115.1S164G162-S164 PolarHBondContact O-N 3.03Å
163A32.2Very low33.2Very low104 Ų104154.3 Ų154.386%0.8682%0.817SS**  trans-70.2128.9-172.300000115.6
164S35.9Very low33.4Very low114 Ų114150.8 Ų150.880%0.79781%0.814SS**  trans5488.2140.9-164.50000119.3G162G162-S164 PolarHBondContact O-N 3.03Å
165R33.5Very low33.6Very low251 Ų251148 Ų14895%0.94780%0.804SS**  trans-170.8127.1139.5-111.6168.7-177.3-1482116
166G32Very low33.9Very low66 Ų66152.6 Ų152.668%0.6881%0.814SS**  trans113.8151.7136.100000119
167R32.5Very low34.1Very low254 Ų254152.8 Ų152.896%0.95881%0.81SS**  trans68.3129.6-178.2-63175.6-77.5-113.50.8114.9
168G32.3Very low34.4Very low72 Ų72151.5 Ų151.574%0.74281%0.808SS**  cis-164.6116.1-8.200000112.5L170G168-L170 PolarHBondContact O-N 3.26Å
169V37.3Very low34.6Very low130 Ų130149 Ų14979%0.78880%0.801SS**  trans-88.8107.3-178.9-1790000110.6R171V169-R171 HydrophobicContact CG1-CG 4.1Å; V169-R171 PolarHBondContact O-N 2.9Å
170L40.8Very low34.5Very low167 Ų167148.3 Ų148.387%0.87480%0.798SS**  trans-68.797.3164.5-79.1168.3000109.4G168 T172G168-L170 PolarHBondContact O-N 3.26Å; L170-T172 PolarHBondContact O-N 3.28Å
171R39.1Very low34.5Very low228 Ų228146.1 Ų146.186%0.8680%0.8SS**  trans-74.491.2-179.2-75.3179.3167.8166.1-4.7111.9V169 R173V169-R171 HydrophobicContact CG1-CG 4.1Å; V169-R171 PolarHBondContact O-N 2.9Å; R171-R173 VanDerWaalsContact C-N 3.33Å; R171-R173 PolarHBondContact O-N 3.5Å
172T34.7Very low34.6Very low139 Ų139144.6 Ų144.685%0.85380%0.796SS**  trans-70.388.1165.5-47.90000110L170 A174L170-T172 PolarHBondContact O-N 3.28Å; T172-A174 PolarHBondContact O-N 2.78Å
173R34.1Very low34.8Very low207 Ų207145 Ų14578%0.78179%0.791SS**  trans-7194.5-179.5-176.1-171.7-179-169.41.1111R171 L175R171-R173 VanDerWaalsContact C-N 3.33Å; R171-R173 PolarHBondContact O-N 3.5Å; R173-L175 PolarHBondContact O-N 3.45Å
174A35.6Very low34.9Very low82 Ų82146.1 Ų146.168%0.67879%0.788SS**  trans-65.6117.4163.500000109.8T172 L176T172-A174 PolarHBondContact O-N 2.78Å; A174-L176 PolarHBondContact O-N 2.96Å
175L35.6Very low34.7Very low115 Ų115146.8 Ų146.860%0.60279%0.787SS**  trans-81.391.4173.2-80.3166.8000109.7R173 H177R173-L175 PolarHBondContact O-N 3.45Å; L175-H177 PolarHBondContact O-N 2.86Å
176L35.2Very low34.5Very low155 Ų155142.2 Ų142.281%0.81278%0.776SS**  trans-75.7112.1166.6-63.5179000109A174 T178A174-L176 PolarHBondContact O-N 2.96Å; L176-T178 PolarHBondContact O-N 3.46Å
177H35Very low34.3Very low163 Ų163147.6 Ų147.676%0.75578%0.784SS**  trans-79.6102171.5-78.4-95.1000109.9L175 N179L175-H177 PolarHBondContact O-N 2.86Å; H177-N179 PolarHBondContact O-N 3.33Å
178T37.5Very low34.2Very low120 Ų120142.8 Ų142.874%0.73677%0.772SS**  trans-78.9107.3169.147.10000109.8L176 E180L176-T178 PolarHBondContact O-N 3.46Å; T178-E180 PolarHBondContact O-N 2.87Å
179N38.7Very low34.1Very low146 Ų146144.8 Ų144.878%0.78177%0.774SS**  trans-81.3104.1167.2-73.1-26.3000108.9H177 C181H177-N179 PolarHBondContact O-N 3.33Å; N179-C181 PolarHBondContact O-N 3.5Å; N179-C181 VanDerWaalsContact O-N 3.13Å
180E32.4Very low33.9Very low173 Ų173143.1 Ų143.181%0.80877%0.774SS**  trans-73.998.5173.1-67.3-175.3133.900110.3T178 I182T178-E180 PolarHBondContact O-N 2.87Å; E180-I182 PolarHBondContact O-N 3.33Å; E180-I182 VanDerWaalsContact O-N 3.07Å
181C30.8Very low33.8Very low121 Ų121140.9 Ų140.982%0.81877%0.77SS**  trans-77.188.8172-69.40000110.2N179 A183N179-C181 PolarHBondContact O-N 3.5Å; N179-C181 VanDerWaalsContact O-N 3.13Å; C181-A183 PolarHBondContact O-N 2.88Å
182I32.9Very low33.5Very low152 Ų152138.1 Ų138.178%0.77977%0.772SS**  trans-64.9102.8170.1-59.9175.2000108.7E180E180-I182 PolarHBondContact O-N 3.33Å; E180-I182 VanDerWaalsContact O-N 3.07Å
183A33.1Very low33.3Very low85 Ų85135.2 Ų135.270%0.70277%0.77SS**  trans-88.8103.1173.500000109.7C181 V185C181-A183 PolarHBondContact O-N 2.88Å; A183-V185 PolarHBondContact O-N 2.9Å; A183-V185 VanDerWaalsContact O-N 3.13Å
184T33.1Very low33.2Very low129 Ų129133.7 Ų133.779%0.79178%0.776SS**  trans-70.3103.8170.749.70000109.7E186T184-E186 PolarHBondContact O-N 2.83Å
185V33.2Very low32.8Very low128 Ų128136 Ų13678%0.77679%0.786SS**  trans-76.9103.9171.7177.90000108.5A183 Q187A183-V185 PolarHBondContact O-N 2.9Å; A183-V185 VanDerWaalsContact O-N 3.13Å; V185-Q187 PolarHBondContact O-N 2.88Å
186E29.5Very low32.7Very low154 Ų154135.8 Ų135.872%0.7279%0.794SS**  trans-85.4103.7170.9-160.6-179.7148.300109.1T184 H188T184-E186 PolarHBondContact O-N 2.83Å; E186-H188 PolarHBondContact O-N 2.94Å; E186-H188 IonicContact OE1-CD2 3.71Å; E186-H188 IonicContact OE1-CE1 3.7Å; E186-H188 IonicContact OE1-NE2 2.75Å; E186-H188 PolarHBondContact OE1-NE2 2.82Å
187Q28Very low32.3Very low180 Ų180135.8 Ų135.884%0.84180%0.795SS**  trans-87.686.1-169.3-173175.9-0.100111.4V185 S189V185-Q187 PolarHBondContact O-N 2.88Å; Q187-S189 PolarHBondContact O-N 3.31Å
188H29.7Very low32Very low153 Ų153131.8 Ų131.871%0.70879%0.79SS**  trans-80112.2172.1-78.1-86.4000111E186E186-H188 PolarHBondContact O-N 2.94Å; E186-H188 IonicContact OE1-CD2 3.71Å; E186-H188 IonicContact OE1-CE1 3.7Å; E186-H188 IonicContact OE1-NE2 2.75Å; E186-H188 PolarHBondContact OE1-NE2 2.82Å
189S30.1Very low31.7Very low114 Ų114134.2 Ų134.280%0.79780%0.797SS**PPolyproline II helixtrans-76.4135.3174.6390000111.6Q187Q187-S189 PolarHBondContact O-N 3.31Å
190A33.5Very low31.3Very low95 Ų95134.1 Ų134.179%0.78580%0.796SS**PPolyproline II helixtrans-86141.6168.900000110.5
191P37.9Very low31.2Very low120 Ų120134.2 Ų134.278%0.77980%0.801SS**PPolyproline II helixtrans-94.7139.816034.4-29000111.2
192D32.8Very low31Very low170 Ų170133.3 Ų133.391%0.90980%0.796SS**PPolyproline II helixtrans-69.7152.4167.8-57-81.3000111.5
193G30.3Very low30.7Very low78 Ų78131.9 Ų131.980%0.80480%0.798SS**  trans-179.183.1-17800000115.7
194L33Very low30.5Very low174 Ų174134.8 Ų134.891%0.91181%0.807SS**  trans-35.5141.8169.4-61.1160.4000116
195C26.7Very low30.5Very low131 Ų131133.3 Ų133.389%0.88581%0.808SS**  -170140.6120.5-109.40000113.5
196S32.7Very low30.3Very low110 Ų110134.8 Ų134.877%0.76981%0.812SS**  trans-72.3175.3158.1-490000109.3
197D27.8Very low30.4Very low156 Ų156132.9 Ų132.983%0.83481%0.811SS**  cis-161.9-169.630-154.4-9.7000112.2
198A29.1Very low30.5Very low78 Ų78130.4 Ų130.465%0.64580%0.804SS**  trans-49.7152.7-177.300000117
199L31.6Very low30.5Very low172 Ų172127.8 Ų127.890%0.90180%0.801SS**  -143.4124.3127.2-113.3174.5000111.2
200L30.3Very low30.6Very low144 Ų144129.6 Ų129.675%0.75480%0.801SS**  trans-77.3148.6165.1-73.9157.2000109.4
201L28.9Very low30.5Very low175 Ų175129.7 Ų129.792%0.91680%0.802SS**  trans-152.4141.4137.5-139.570.4000110.9
202S28Very low30.1Very low102 Ų102127.6 Ų127.671%0.71380%0.802SS**  trans-105.2164.2-169.9-62.70000113.1
203C26.5Very low30.4Very low121 Ų121126.3 Ų126.382%0.81880%0.801SS**  trans-10.9139.1159.1-48.10000118.5
204T28.5Very low31.2Very low146 Ų146128.9 Ų128.990%0.89680%0.803SS**  trans-120.8120.9135.851.90000108.4
205A33.2Very low31.4Very low98 Ų98132.5 Ų132.581%0.8181%0.805SS**  trans-112.3145.1160.700000106.6
206D27.6Very low31.5Very low159 Ų159130 Ų13085%0.8580%0.8SS**  trans-133.7137.1173.5-123.9-35.6000111.5
207T32.3Very low31.6Very low114 Ų114130.8 Ų130.870%0.69981%0.806SS**  trans-70.7170172.3170000110.3
208D30Very low31.7Very low129 Ų129127.1 Ų127.169%0.6981%0.805SS**  cis-163.9164.427.3-133.4-25.8000112.6
209C30.9Very low31.8Very low98 Ų98128.4 Ų128.466%0.66282%0.816SS**  trans50.4154.2144.7-71.60000122.9
210L31.2Very low31.7Very low152 Ų152123.4 Ų123.480%0.79681%0.806SS**  cis-161.2150.6-4.1-120.3165.6000111.9
211A31.8Very low31.7Very low96 Ų96123.3 Ų123.379%0.79381%0.811SS**  trans32.2148.4150.800000123.9
212G29.1Very low31.8Very low76 Ų76124.6 Ų124.678%0.78481%0.813SS**  trans17813.4169.100000122
213T39.3Very low32Very low144 Ų144123.1 Ų123.188%0.88381%0.813SS**  trans-88.3147.817443.90000113.1
214P46.3Very low32Very low131 Ų131124.9 Ų124.985%0.85181%0.809SS**  trans-132.6160.4135.437.3-28.1000113.5
215R37.2Very low31.9Very low251 Ų251126.4 Ų126.495%0.94780%0.8SS**  trans-132.9133.1174.4-174.8-172.4-170.7-158.65.3108.3
216G29.6Very low31.6Very low77 Ų77130.1 Ų130.179%0.79480%0.801SS**  trans-154.8150.3178.600000111.7
217S34.1Very low31.7Very low128 Ų128130.3 Ų130.390%0.89580%0.801SS**  trans-121.4152.7-171.2-55.90000111.9
218G30Very low31.3Very low78 Ų78131.2 Ų131.280%0.80481%0.81SS**  trans159.2135.8162.400000115.1
219A31.1Very low31.2Very low106 Ų106129.7 Ų129.788%0.87681%0.81SS**  trans-56164.6-177.500000116.4
220G29.2Very low31.2Very low67 Ų67130.7 Ų130.769%0.69181%0.812SS**  cis129.9113.8-7.600000115.2
221T31.4Very low31.4Very low142 Ų142129.6 Ų129.687%0.87181%0.814SS**  trans-162.4136.3167.620.80000112.6
222Q30.8Very low31.3Very low202 Ų202130.1 Ų130.194%0.94481%0.813SS**  trans37.2154.2155-74.9-172.2-14.200123.9
223G31.7Very low31.6Very low70 Ų70136.9 Ų136.972%0.72282%0.82SS**  trans117.670.5-179.100000110.8
224E26.1Very low31.3Very low158 Ų158135 Ų13574%0.73882%0.82SS**  77.9161.183.8-151.2165.4-151.900112.6
225Y26.2Very low30.6Very low179 Ų179132.1 Ų132.170%0.70281%0.814SS**  trans-115166.2-13642.8-109.2000117.6
226Q26.9Very low30.3Very low176 Ų176127.4 Ų127.482%0.82281%0.813SS**  trans92.2140.3142.7-158.9160.984.700119
227L30.1Very low30.2Very low162 Ų162127 Ų12785%0.84881%0.809SS**  trans-80.8154.5173.2-53.587000110.4
228C24.1Very low30.1Very low133 Ų133128.6 Ų128.690%0.89981%0.806SS**  trans-150.2164.2148.4-143.40000112
229S28.9Very low30.1Very low97 Ų97132.9 Ų132.968%0.67881%0.806SS**  trans-126.2179.4-166.3-62.30000112.5
230V31.2Very low29.9Very low119 Ų119135.3 Ų135.372%0.72180%0.798SS**  trans70.2157.1169.3-129.30000114.4
231P34.7Very low29.8Very low129 Ų129141.8 Ų141.884%0.83880%0.802SS**  -139.1137.180.436.1-20000115.5
232S29.8Very low29.8Very low108 Ų108142.5 Ų142.576%0.75580%0.796SS**  trans-89.5142.9161.8-650000109.6
233K36.2Very low29.8Very low217 Ų217138.2 Ų138.294%0.94379%0.788SS**  trans-79.4154.3174.5-74.1-172.8174.1-177.40111.7
234A32.1Very low29.9Very low106 Ų106142.2 Ų142.288%0.87679%0.793SS**  trans-130.9167.3-166.100000114.3
235G31Very low30.2Very low70 Ų70141 Ų14172%0.72280%0.796SS**  trans97.7150.9167.700000115.4
236T31.8Very low30.5Very low151 Ų151139.8 Ų139.893%0.92680%0.801SS**  cis-162.3143.8-9.8-67.50000106.8
237G27.1Very low30.6Very low70 Ų70142 Ų14272%0.72280%0.802SS**  cis-179.3-138.42.300000112.7
238L32.1Very low30.8Very low160 Ų160141.7 Ų141.784%0.83880%0.801SS**  trans-64.4139.1-177.3-110.372.7000115.7
239Q30.2Very low31Very low169 Ų169139.8 Ų139.879%0.7980%0.795SS**  -171.5153.1100.4-98.8-62.911.300112.9
240H27.5Very low31.2Very low156 Ų156144.2 Ų144.272%0.72280%0.802SS**  trans-95.8140.9-175.2119.6-44.3000112.8
241R26.9Very low31.1Very low203 Ų203149.2 Ų149.277%0.76681%0.808SS**  -169.5153.9125-130.4-96.2155.9-173.21.6112.2
242E31.4Very low30.7Very low158 Ų158151.2 Ų151.274%0.73881%0.806SS**  trans-103.6133.8179.3171.8-172-157.900111.8
243S30.7Very low30.7Very low112 Ų112152.7 Ų152.778%0.78380%0.804SS**  trans-167.3138.8153.753.20000112.3
244D32.9Very low30.4Very low153 Ų153150.6 Ų150.682%0.81880%0.803SS**  trans-67.9167.5173.6-175.425.2000113.4
245V33.3Very low30.2Very low133 Ų133152.8 Ų152.881%0.80680%0.8SS**  trans154.4135.4143.9161.50000112.3
246D31.3Very low30.3Very low153 Ų153157.8 Ų157.882%0.81881%0.809SS**  trans-72.1178.5-176.1-133.6-35000116.4
247R29.9Very low30.2Very low222 Ų222159 Ų15984%0.83880%0.804SS**  trans105.282139.2-153.6172-175.2154-0.7122.9
248L33.8Very low30.4Very low157 Ų157164.9 Ų164.982%0.82281%0.813SS**  21.4106.5121.5-167.4147.5000120.2
249A28.6Very low30.3Very low93 Ų93160.5 Ų160.577%0.76981%0.806SS**  trans-163.8123.2148.800000108.9
250K32.6Very low30.1Very low190 Ų190158.6 Ų158.683%0.82681%0.812SS**  83.999.866.4-91.6-172.3177.5175.70116.9
251R29.3Very low30.2Very low223 Ų223156.3 Ų156.384%0.84281%0.813SS**  trans83.2157.1132.7-93-172.8167.3-148.5-4.4122.3
252Q27.2Very low30.4Very low171 Ų171158 Ų15880%0.79982%0.82SS**  trans72.9118.5170.8-72.3162-19.800115.6
253L29.3Very low30.4Very low139 Ų139156.5 Ų156.573%0.72882%0.821SS**  cis89.210226.4-160.5-179.4000113.7
254L29.2Very low30.4Very low174 Ų174158.6 Ų158.691%0.91182%0.823SS**  trans-136.3146.5149.9-74.2178.6000108.8
255N28Very low30.6Very low151 Ų151157.4 Ų157.481%0.80782%0.824SS**  trans-96.3156.6169.6-69.4-59.9000109.8
256L32.6Very low30.3Very low176 Ų176157 Ų15792%0.92182%0.817SS**  trans-138.6138.7148.2-17160.6000107.5
257E31.2Very low30.2Very low176 Ų176160.9 Ų160.982%0.82282%0.82SS**  trans-110.6170.9-172.1-164.3169.2139.500110.6
258E31.2Very low30.1Very low193 Ų193155 Ų15590%0.90281%0.809SS**  trans73.5131163.6-155165-138.500116.9
259G28.5Very low29.9Very low68 Ų68153.2 Ų153.270%0.70181%0.81SS**  cis169.1132.3-11.100000112.8
260S27Very low30.2Very low129 Ų129158 Ų15890%0.90281%0.813SS**  trans-162.6149.1161.1-149.30000112.4
261S28.7Very low30.1Very low109 Ų109156 Ų15676%0.76282%0.816SS**  trans-122.6135.5-161.5-58.10000113.5
262R31.6Very low30.4Very low237 Ų237151.6 Ų151.689%0.89482%0.815SS**  trans-164.1100154.5-108.8151-168.7-110.60.5114.9
263T31.8Very low31Very low127 Ų127146.1 Ų146.178%0.77980%0.804SS**  trans43.6110.1136.756.40000121.6
264L30.1Very low31.5Very low156 Ų156146 Ų14682%0.81781%0.812SS**  12.5143.1126.8-93.1167.7000119.8
265P37.4Very low31.9Very low128 Ų128144.3 Ų144.383%0.83180%0.802SS**  -139.4165.278.139.3-25.5000117.7
266D26.7Very low32.5Very low124 Ų124141.6 Ų141.666%0.66380%0.801SS**  trans-82.1153.3174.516643.8000112.8T268D266-T268 PolarHBondContact OD1-N 2.99Å
267R29.7Very low32.6Very low235 Ų235144 Ų14489%0.88780%0.798SS**  trans-155.882156-145.3175.7-168.3-166.73.3115.3
268T28.3Very low33Very low99 Ų99142.7 Ų142.761%0.60780%0.796SS**  trans6.2118.9147.263.40000118.1D266D266-T268 PolarHBondContact OD1-N 2.99Å
269S30Very low33.1Very low120 Ų120138.6 Ų138.684%0.83979%0.789SS**  trans-81.9147.7165.657.40000111.9
270K34.3Very low33.6Very low193 Ų193143 Ų14384%0.83980%0.796SS**  trans-109.3118177.3-70.5-171.1176.4-173.30111.1
271V30Very low34.2Very low147 Ų147143.6 Ų143.689%0.89179%0.794SS**  trans-73.7137.3167.41760000109.1
272T36.1Very low34.4Very low131 Ų131147.6 Ų147.680%0.80480%0.801SS**  trans-118.7151.2175.8-58.90000109.8
273G38.6Very low34.4Very low56 Ų56142.9 Ų142.958%0.57780%0.798SS**  trans-76.8-166.8-169.500000116.6
274P41.4Very low34.5Very low137 Ų137145.7 Ų145.789%0.8980%0.802SS**PPolyproline II helixtrans-72.1138.5-164.529-35.8000113.8
275I37.8Very low34.6Very low139 Ų139143.8 Ų143.871%0.71380%0.801SS**PPolyproline II helixtrans-89.1128.8175.4-62.9172000109.5
276A39Very low34.5Very low94 Ų94145.5 Ų145.578%0.77780%0.802SS**PPolyproline II helixtrans-87121.2172.700000110.5N278A276-N278 PolarHBondContact O-N 3.16Å; A276-N278 VanDerWaalsContact O-N 3.11Å
277W35.3Very low34.5Very low225 Ų225146.9 Ų146.985%0.85281%0.81SS**  trans-80.890.1-179.4-72.199000112.1
278N40.3Very low34.5Very low149 Ų149140.1 Ų140.180%0.79780%0.798SS**  trans-145.575.3163.4-174.210.9000111.7A276A276-N278 PolarHBondContact O-N 3.16Å; A276-N278 VanDerWaalsContact O-N 3.11Å
279S33.1Very low35Very low108 Ų108141.2 Ų141.276%0.75581%0.807SS**  trans-178.5100.3154.7-81.70000109.5
280L38.6Very low34.9Very low161 Ų161141 Ų14184%0.84381%0.805SS**  trans-149.355.4166.1-165.564000111.1
281T40.4Very low34.6Very low141 Ų141138.5 Ų138.587%0.86581%0.806SS**  trans-141.961.7170.841.50000110.3
282Q32.8Very low34.7Very low193 Ų193139.5 Ų139.590%0.90280%0.801SS**  trans-141.3122.3161.5-114.2162.551.700108.9
283V31.5Very low34.4Very low137 Ų137139 Ų13983%0.8380%0.803SS**  trans-98.1121.7170.2173.50000105.7
284E32.7Very low34.4Very low186 Ų186145 Ų14587%0.86981%0.813SS**  trans-100.4113.3-175.9-164.5164.4-146.300109.4
285C32.3Very low34.1Very low116 Ų116150.2 Ų150.278%0.78482%0.815SS**  trans-85.5142.3172.4-62.20000109.7
286L34.8Very low33.9Very low164 Ų164152.6 Ų152.686%0.85982%0.82SS**  trans-91166.7179.8-71.1173000112.6
287D28.1Very low33.8Very low154 Ų154158.1 Ų158.182%0.82483%0.827SS**  trans80.5129.6174.5-136.944.2000115.3
288S28.7Very low33.5Very low93 Ų93150.6 Ų150.665%0.6582%0.819SS**  cis-151.1172.7-3.2-133.20000111.2
289P39.1Very low33Very low121 Ų121152 Ų15279%0.78683%0.825SS**  trans-96.7161.7-157.237.7-37.9000116.8
290S27.4Very low32.9Very low115 Ų115154.8 Ų154.880%0.80483%0.827SS**  trans-149.7137.1158.1640000116.1
291V27.8Very low32.6Very low141 Ų141154.1 Ų154.186%0.85582%0.823SS**  trans41.594.1152.1-167.20000120.6
292Q32.4Very low32.2Very low169 Ų169154.8 Ų154.879%0.7982%0.822SS**  trans-22.2133.8143.4177.4-173.8103.400117.6
293S29.9Very low31.9Very low121 Ų121149.2 Ų149.285%0.84682%0.815SS**  trans-143.6138.3156.7-175.10000112.2
294K38.8Very low32Very low180 Ų180150.8 Ų150.878%0.78382%0.818SS**  trans-120.4121.2179.8-79.5179.5176.2171.90111.1
295R35.8Very low31.7Very low247 Ų247147.3 Ų147.393%0.93282%0.815SS**  trans-173.5164.9153.4-104.4163.4-168.8-144.85.1110.4
296K33.8Very low31.5Very low189 Ų189146.9 Ų146.982%0.82281%0.813SS**  -169.596.1-51.1177.5-177.4171.9-174.50108.6
297K36.1Very low31.2Very low211 Ų211147.4 Ų147.492%0.91781%0.811SS**  trans43.2115.1142.1-163176.8-172.9179.10120.1
298G28.5Very low31.1Very low67 Ų67145.9 Ų145.969%0.69181%0.807SS**  trans141145.4164.900000111.6
299L31Very low31.1Very low177 Ų177149 Ų14993%0.92782%0.816SS**  cis-137.3175.4-3.6-122.179.6000109.3
300Q30.3Very low31Very low168 Ų168148.2 Ų148.279%0.78581%0.811SS**  trans-98.4155.2167.2-63.3-17814.500110.9
301L32.4Very low31Very low147 Ų147154.4 Ų154.477%0.7782%0.817SS**  174.6159.2108.2-92.5168.6000115.1
302N31.1Very low31.1Very low155 Ų155152.7 Ų152.783%0.82982%0.817SS**  trans-33.9156.2177.3-55.9-27.7000120.6
303G27.7Very low30.9Very low75 Ų75157 Ų15777%0.77383%0.826SS**  trans178.2136.8157.100000112.9
304L32.6Very low30.9Very low170 Ų170162.8 Ų162.889%0.8983%0.83SS**  trans-127.5170.3177.4-79.3170.7000110.7
305S27.3Very low30.4Very low113 Ų113157.4 Ų157.479%0.7983%0.825SS**  trans74.2147.8-179.779.50000115.5
306S28.8Very low30Very low108 Ų108151 Ų15176%0.75582%0.817SS**  cis-162.1166.5-14.9-107.60000111.8
307E26.6Very low29.9Very low174 Ų174148.4 Ų148.481%0.81382%0.818SS**  trans72.8133.8153.6-92.4-172.16300124.4
308T27.5Very low29.8Very low122 Ų122144.8 Ų144.875%0.74881%0.813SS**  trans82.4137.9138.2-58.80000121.4
309L27.7Very low30Very low160 Ų160149.3 Ų149.384%0.83882%0.816SS**  trans-77.6174.7-176.9-117.367000112.2
310P37.7Very low30.2Very low104 Ų104145.3 Ų145.368%0.67581%0.808SS**  cis-141.3-174.85.139-18.1000117.6
311R27.4Very low30.2Very low245 Ų245145.3 Ų145.393%0.92581%0.808SS**  trans63.5101.7147.1-106.2-176.6175.9175.8-1.3119.3
312A29.8Very low30.1Very low105 Ų105144 Ų14487%0.86881%0.81SS**  trans-156.5111.8136.300000111.5
313R28.2Very low30.1Very low258 Ų258142.5 Ų142.597%0.97481%0.812SS**  trans-105.4104.4172.8-173.6-173.4-166-126.18.6108.7
314R30.4Very low30.2Very low243 Ų243145.3 Ų145.392%0.91782%0.815SS**  trans-133.591.3175.3-161.9-179.2-64.6-97.26110.4
315G27.1Very low30Very low67 Ų67140.6 Ų140.669%0.69181%0.807SS**  trans-74139.6167.200000109.9
316C27.1Very low30.4Very low114 Ų114144.3 Ų144.377%0.7781%0.812SS**  trans-88.7127.4174.1-169.40000109.8
317T33.2Very low30.5Very low134 Ų134147.6 Ų147.682%0.82282%0.82SS**  trans-116.689.817351.60000109.2Q319T317-Q319 PolarHBondContact O-N 3.35Å; T317-Q319 VanDerWaalsContact O-N 3.13Å
318T33Very low30.7Very low135 Ų135145.1 Ų145.183%0.82882%0.822SS**  trans-72101.5175.520.10000110.6A320T318-A320 PolarHBondContact O-N 2.8Å
319Q33.7Very low30.7Very low162 Ų162143.8 Ų143.876%0.75782%0.823SS**  trans-81106.2172.8-177.9-175.521.400109.7T317 Q321T317-Q319 PolarHBondContact O-N 3.35Å; T317-Q319 VanDerWaalsContact O-N 3.13Å; Q319-Q321 PolarHBondContact O-N 2.67Å
320A34.6Very low30.8Very low92 Ų92147.2 Ų147.276%0.7683%0.825SS**  trans-77.9118.1167.800000109.8T318T318-A320 PolarHBondContact O-N 2.8Å
321Q29.6Very low30.5Very low168 Ų168148.2 Ų148.279%0.78583%0.832SS**  trans-90.1127.6168.3-63.2-177.65.800109Q319Q319-Q321 PolarHBondContact O-N 2.67Å
322C30.6Very low30.6Very low120 Ų120145.1 Ų145.181%0.81183%0.83SS**  trans-111.9113.5170.7-640000108.8
323S31.1Very low30.7Very low124 Ų124151.2 Ų151.287%0.86783%0.83SS**PPolyproline II helixtrans-76120.2179.850.40000111.6G325S323-G325 PolarHBondContact O-N 3.24Å
324T29.9Very low30.6Very low134 Ų134142.1 Ų142.182%0.82282%0.817SS**PPolyproline II helixtrans-72.4117.5177.5-54.70000111.5
325G28.9Very low30.7Very low71 Ų71138 Ų13873%0.73281%0.81SS**PPolyproline II helixtrans-69.1133.9166.300000111.3S323S323-G325 PolarHBondContact O-N 3.24Å
326Q34.6Very low30.9Very low190 Ų190142.1 Ų142.189%0.88882%0.816SS**PPolyproline II helixtrans-85.7136.9177.4-60-178.620.400110.8
327L30.7Very low31.1Very low178 Ų178144.6 Ų144.693%0.93282%0.817SS**  trans-126.2129.1160.2-73.6175.8000108.6
328S30.9Very low31.4Very low122 Ų122143.7 Ų143.785%0.85381%0.813SS**  trans-92.2127.4-173.1-174.20000111.2
329A29Very low32.2Very low94 Ų94142.4 Ų142.478%0.77781%0.807SS**  trans-130.5113.3172.500000109.6
330R29.1Very low32Very low231 Ų231140.9 Ų140.987%0.87281%0.814SS**PPolyproline II helixtrans-76.3129.6174.3-70169.6105.5168.13.2109.2
331P32Very low31.7Very low125 Ų125139.5 Ų139.581%0.81281%0.808SS**PPolyproline II helixtrans-76.2126.4171.730.4-32.4000110.4
332M29.1Very low31.7Very low181 Ų181137.4 Ų137.489%0.89281%0.811SS**PPolyproline II helixtrans-79.3135.7165.7-73.3-66.9-75.100109.6
333R31.6Very low31.8Very low232 Ų232140.8 Ų140.888%0.87582%0.817SS**PPolyproline II helixtrans-74.4146.7172.5-79.5-178.1170.3-123.82.6110.5
334G26.6Very low31.8Very low67 Ų67139 Ų13969%0.69182%0.819SS**PPolyproline II helixtrans-83.8146.6155.100000111.1
335M32Very low31.9Very low158 Ų158136.8 Ų136.878%0.77882%0.822SS**  trans-131.4116.7152.7-59.8-115.456.500103.1
336D31.2Very low32.2Very low153 Ų153143 Ų14382%0.81883%0.832SS**  60.5126.976.2-95.8-60.8000114.1
337E31Very low32.1Very low166 Ų166138.7 Ų138.778%0.77683%0.829SS**  trans-105.2139.6-170.3178.3-167.6111.900111
338P41.1Very low32.3Very low115 Ų115138.5 Ų138.575%0.74783%0.829SS**  trans-120.7132157.835-23.8000112.8
339P48Very low32.3Very low108 Ų108136.5 Ų136.570%0.70183%0.828SS**  trans-87.9172.717235.3-35.6000113.3
340S31.4Very low32.6Very low130 Ų130136.7 Ų136.791%0.90983%0.83SS**  trans79.5138.2-177-158.10000114.7
341G28.2Very low33.3Very low62 Ų62131.7 Ų131.764%0.63983%0.827SS**  cis177.4-171.9-1.600000112.8
342C28.6Very low33.4Very low125 Ų125131.1 Ų131.185%0.84583%0.826SS**  trans7397.1170.9-64.90000120.3
343M33.8Very low34.2Very low191 Ų191129.4 Ų129.494%0.94182%0.821SS**  48.8123.8120.1-60.3-72.8-89.900121.7
344G30.4Very low34.7Very low87 Ų87126.9 Ų126.990%0.89782%0.818SS**  trans135.9117.3136.600000117.4
345G32.3Very low35.2Very low87 Ų87129.8 Ų129.890%0.89782%0.823SS**  trans137.1113.1165.800000114.8
346Q34Very low35.6Very low201 Ų201130.7 Ų130.794%0.93983%0.825SS**  trans-106.1141.4167-68.2174.1-7.500109.6
347A33.1Very low36.1Very low99 Ų99130 Ų13082%0.81882%0.817SS**  trans-168.2145.7146.900000109.8
348D34.7Very low36.4Very low174 Ų174126.3 Ų126.393%0.9382%0.815SS**  trans-75.5155.1-179.1-58.2-92.1000113.8
349G31.5Very low36.4Very low81 Ų81126.9 Ų126.984%0.83582%0.821SS**  trans160.8106.116700000114.5
350A35.1Very low36.2Very low98 Ų98128.6 Ų128.681%0.8182%0.817SS**  trans-147.3153.9168.900000111
351P43.3Very low36.4Very low125 Ų125131 Ų13181%0.81281%0.814SS**  cis-112.2174.9-2838.1-26.7000111.2
352S35.4Very low37.6Very low114 Ų114135.2 Ų135.280%0.79782%0.82SS**  trans-125.6115.8162.7-76.30000110Q354S352-Q354 PolarHBondContact O-N 3.38Å
353D44.5Very low38.5Very low145 Ų145134.3 Ų134.378%0.77581%0.81SS**  trans-7696.5-179.5-177.818.2000110.1
354Q42.9Very low39.2Very low178 Ų178129.6 Ų129.683%0.83279%0.794SS**  trans-163.549.3-179.4-124.9155.2109.500115.8S352S352-Q354 PolarHBondContact O-N 3.38Å
355T35.9Very low40.3Very low129 Ų129130.9 Ų130.979%0.79178%0.784SS**  trans-137.320.5172.2-260000114.9
356Q41.5Very low41.1Very low176 Ų176133.3 Ų133.382%0.82278%0.777SS**SBendtrans-95.57-180-146.4-175.61.500115.2
357E40.7Very low42.1Very low139 Ų139130.5 Ų130.565%0.6576%0.764SS**SBendtrans-101.1-7.1-177.8-74.9-859500114.3C359 K360E357-C359 PolarHBondContact O-N 3.03Å; E357-K360 WeakPolarHBondContact OE1-CE 3.47Å; E357-K360 IonicContact OE1-NZ 2.63Å; E357-K360 PolarHBondContact OE1-NZ 2.76Å; E357-K360 IonicContact OE2-NZ 3.87Å
358A37.6Very low43.3Very low89 Ų89130.9 Ų130.974%0.73675%0.752SS**THydrogen-bonded Turntrans-75.3-1.3-175.500000115.3
359C40.9Very low44.9Very low127 Ų127125.1 Ų125.186%0.85873%0.734SS**THydrogen-bonded Turntrans-104.728.3-174.8-660000114E357E357-C359 PolarHBondContact O-N 3.03Å
360K45.3Very low47.4Very low143 Ų143126.9 Ų126.962%0.62272%0.724SS**  trans-115.922.2-176.3-71.6178.5179.21680115.2E357 I362E357-K360 WeakPolarHBondContact OE1-CE 3.47Å; E357-K360 IonicContact OE1-NZ 2.63Å; E357-K360 PolarHBondContact OE1-NZ 2.76Å; E357-K360 IonicContact OE2-NZ 3.87Å; K360-I362 VanDerWaalsContact C-N 3.31Å; K360-I362 PolarHBondContact O-N 3.22Å
361Q34.2Very low50Low181 Ų181125.4 Ų125.485%0.84671%0.705SS**  trans-82.479.5167.9-167.2159.217.500111V363Q361-V363 HydrophobicContact CG-CG2 4.41Å; Q361-V363 PolarHBondContact O-N 3.18Å; Q361-V363 VanDerWaalsContact O-N 3.12Å
362I54Low52Low151 Ų151126.7 Ų126.777%0.77470%0.698SS**  trans-70.8102.6175.3-60.8168.6000108.8K360K360-I362 VanDerWaalsContact C-N 3.31Å; K360-I362 PolarHBondContact O-N 3.22Å
363V47.8Very low54.7Low105 Ų105124 Ų12464%0.63668%0.682SS**  trans-85.9142.5168.8179.40000108.5Q361Q361-V363 HydrophobicContact CG-CG2 4.41Å; Q361-V363 PolarHBondContact O-N 3.18Å; Q361-V363 VanDerWaalsContact O-N 3.12Å
364P48.3Very low57Low93 Ų93122.6 Ų122.660%0.60467%0.671SS**  trans-64.6137-156.9-27.536.9000117N366P364-N366 PolarHBondContact O-N 3.04Å
365V53.8Low59.4Low113 Ų113118.7 Ų118.769%0.68566%0.655SS**SBendtrans-6592.3166172.40000109.4D368V365-D368 WeakPolarHBondContact CG1-OD2 3.23Å
366N49.1Very low62.2Low139 Ų139116.9 Ų116.974%0.74364%0.638SS**  trans-145.5-3167.2-90.3-73.3000113.2P364P364-N366 PolarHBondContact O-N 3.04Å
367Q54.9Low64.7Low141 Ų141111.2 Ų111.266%0.65962%0.621SS**SBendtrans-81-20.4179.7-72.217873.800113.2G369 D370 V371Q367-G369 PolarHBondContact O-N 3.29Å; Q367-D370 PolarHBondContact O-N 2.96Å; Q367-V371 PolarHBondContact O-N 3.4Å
368D58Low67.3Low107 Ų107109.2 Ų109.257%0.57261%0.613SS**Hα-helixtrans-62.6-28.1-177.1-55.9-71.1000113.3V365 K372V365-D368 WeakPolarHBondContact CG1-OD2 3.23Å; D368-K372 WeakPolarHBondContact O-CB 3.5Å; D368-K372 PolarHBondContact O-N 3.14Å
369G68.1Low70Confident54 Ų54110 Ų11056%0.55760%0.602SS**Hα-helixtrans-66.3-40.717300000112.8Q367 A373Q367-G369 PolarHBondContact O-N 3.29Å; G369-A373 WeakPolarHBondContact O-CB 3.5Å; G369-A373 PolarHBondContact O-N 3.26Å
370D83.5Confident72.6Confident117 Ų117108.6 Ų108.663%0.62659%0.586SS**Hα-helixtrans-75-45.3179.3-170.237.3000111.2Q367 K372 A373 Q374Q367-D370 PolarHBondContact O-N 2.96Å; D370-K372 VanDerWaalsContact C-N 3.3Å; D370-K372 PolarHBondContact O-N 2.94Å; D370-A373 CarbonylContact O-C 3.58Å; D370-A373 WeakPolarHBondContact O-CB 3.32Å; D370-A373 PolarHBondContact O-N 3.05Å; D370-A373 VanDerWaalsContact O-N 3.09Å; D370-Q374 WeakPolarHBondContact O-CB 3.37Å; D370-Q374 PolarHBondContact O-N 3.25Å
371V89.3Confident75Confident67 Ų67107.6 Ų107.641%0.40659%0.586SS.*Hα-helixtrans-60.4-39.6174.1176.50000111.2Q367 Q374 L375Q367-V371 PolarHBondContact O-N 3.4Å; V371-Q374 PolarHBondContact O-N 2.89Å; V371-L375 HydrophobicContact CG1-CD1 4.25Å; V371-L375 WeakPolarHBondContact O-CB 3.26Å; V371-L375 WeakPolarHBondContact O-CG 3.29Å; V371-L375 PolarHBondContact O-N 3.3Å
372K86.4Confident77.9Confident153 Ų153103.9 Ų103.967%0.66557%0.571SS**Hα-helixtrans-66.8-39.6173.9-175176.2-179.4179.80112.2D368 D370 L375 Q376D368-K372 WeakPolarHBondContact O-CB 3.5Å; D368-K372 PolarHBondContact O-N 3.14Å; D370-K372 VanDerWaalsContact C-N 3.3Å; D370-K372 PolarHBondContact O-N 2.94Å; K372-L375 PolarHBondContact O-N 2.87Å; K372-Q376 WeakPolarHBondContact O-CB 3.41Å; K372-Q376 PolarHBondContact O-N 3.18Å
373A92.3Very high80Confident56 Ų5699.9 Ų99.946%0.46356%0.556SS.*Hα-helixtrans-65.1-39.8174.200000111.9G369 D370 Q376 A377G369-A373 WeakPolarHBondContact O-CB 3.5Å; G369-A373 PolarHBondContact O-N 3.26Å; D370-A373 CarbonylContact O-C 3.58Å; D370-A373 WeakPolarHBondContact O-CB 3.32Å; D370-A373 PolarHBondContact O-N 3.05Å; D370-A373 VanDerWaalsContact O-N 3.09Å; A373-Q376 PolarHBondContact O-N 2.87Å; A373-A377 WeakPolarHBondContact O-CB 3.45Å; A373-A377 PolarHBondContact O-N 2.76Å
374Q93.3Very high82.3Confident117 Ų11798.1 Ų98.155%0.54755%0.549SS..Hα-helixtrans-63.1-45.7174.8-174.7-176.72.300111.7D370 V371 A377 M378D370-Q374 WeakPolarHBondContact O-CB 3.37Å; D370-Q374 PolarHBondContact O-N 3.25Å; V371-Q374 PolarHBondContact O-N 2.89Å; Q374-A377 PolarHBondContact O-N 3.38Å; Q374-M378 WeakPolarHBondContact O-CG 3.41Å; Q374-M378 PolarHBondContact O-N 2.92Å
375L93.2Very high84.6Confident96 Ų9696.1 Ų96.150%0.50354%0.537SS..Hα-helixtrans-61-46.5174.4-73.6169.3000111.1V371 K372 A377 M378 E379V371-L375 HydrophobicContact CG1-CD1 4.25Å; V371-L375 WeakPolarHBondContact O-CB 3.26Å; V371-L375 WeakPolarHBondContact O-CG 3.29Å; V371-L375 PolarHBondContact O-N 3.3Å; K372-L375 PolarHBondContact O-N 2.87Å; L375-A377 VanDerWaalsContact C-N 3.3Å; L375-A377 PolarHBondContact O-N 2.94Å; L375-M378 WeakPolarHBondContact O-CB 3.46Å; L375-M378 PolarHBondContact O-N 3.49Å; L375-M378 VanDerWaalsContact O-N 3.11Å; L375-E379 WeakPolarHBondContact O-CG 3.44Å; L375-E379 PolarHBondContact O-N 2.87Å
376Q93.9Very high86.6Confident90 Ų9097.1 Ų97.142%0.42153%0.534SS..Hα-helixtrans-61.6-37.9177.1-167.26785.100112.3K372 A373 E379 N380K372-Q376 WeakPolarHBondContact O-CB 3.41Å; K372-Q376 PolarHBondContact O-N 3.18Å; A373-Q376 PolarHBondContact O-N 2.87Å; Q376-E379 PolarHBondContact NE2-OE2 2.85Å; Q376-E379 PolarHBondContact O-N 3.11Å; Q376-N380 WeakPolarHBondContact O-CB 3.36Å; Q376-N380 PolarHBondContact O-N 3.42Å; Q376-N380 PolarHBondContact O-ND2 3.2Å
377A94.3Very high88.9Confident57 Ų5797 Ų9747%0.47153%0.529SS..Hα-helixtrans-66.7-37.6174.600000112.2A373 Q374 L375 L381A373-A377 WeakPolarHBondContact O-CB 3.45Å; A373-A377 PolarHBondContact O-N 2.76Å; Q374-A377 PolarHBondContact O-N 3.38Å; L375-A377 VanDerWaalsContact C-N 3.3Å; L375-A377 PolarHBondContact O-N 2.94Å; A377-L381 VanDerWaalsContact O-CB 3.31Å; A377-L381 WeakPolarHBondContact O-CB 3.28Å; A377-L381 PolarHBondContact O-N 3.37Å
378M95.8Very high90.9Very high98 Ų9893.8 Ų93.848%0.48352%0.519SS..Hα-helixtrans-67-42.5173.2-73.5-178.462.400112.2Q374 L375 L381 I382Q374-M378 WeakPolarHBondContact O-CG 3.41Å; Q374-M378 PolarHBondContact O-N 2.92Å; L375-M378 WeakPolarHBondContact O-CB 3.46Å; L375-M378 PolarHBondContact O-N 3.49Å; L375-M378 VanDerWaalsContact O-N 3.11Å; M378-L381 PolarHBondContact O-N 3.48Å; M378-I382 WeakPolarHBondContact O-CB 3.29Å; M378-I382 WeakPolarHBondContact O-CD1 3.35Å; M378-I382 VanDerWaalsContact O-CG1 3.24Å; M378-I382 WeakPolarHBondContact O-CG1 3.46Å; M378-I382 PolarHBondContact O-N 2.91Å
379E93.9Very high92.6Very high106 Ų10693.2 Ų93.250%0.49552%0.515SS..Hα-helixtrans-59.9-45.9174-72.5174.7-179.900111.9L375 Q376 L381 I382 S383L375-E379 WeakPolarHBondContact O-CG 3.44Å; L375-E379 PolarHBondContact O-N 2.87Å; Q376-E379 PolarHBondContact NE2-OE2 2.85Å; Q376-E379 PolarHBondContact O-N 3.11Å; E379-L381 PolarHBondContact O-N 2.75Å; E379-I382 PolarHBondContact O-N 2.91Å; E379-S383 WeakPolarHBondContact O-CB 3.19Å; E379-S383 PolarHBondContact O-N 2.99Å; E379-S383 PolarHBondContact O-OG 3.22Å
380N95.5Very high93.9Very high97 Ų9798.1 Ų98.152%0.51952%0.521SS..Hα-helixtrans-62.8-41.8177-70.5-16.3000111.5Q376 S383 S384Q376-N380 WeakPolarHBondContact O-CB 3.36Å; Q376-N380 PolarHBondContact O-N 3.42Å; Q376-N380 PolarHBondContact O-ND2 3.2Å; N380-S383 PolarHBondContact O-N 2.87Å; N380-S384 VanDerWaalsContact O-CB 3.23Å; N380-S384 WeakPolarHBondContact O-CB 3.46Å; N380-S384 PolarHBondContact O-N 3.46Å
381L95.8Very high94.6Very high122 Ų12296.9 Ų96.964%0.63952%0.518SS*.Hα-helixtrans-64.8-43.3175.8178.561.8000111.9A377 M378 E379 S385A377-L381 VanDerWaalsContact O-CB 3.31Å; A377-L381 WeakPolarHBondContact O-CB 3.28Å; A377-L381 PolarHBondContact O-N 3.37Å; M378-L381 PolarHBondContact O-N 3.48Å; E379-L381 PolarHBondContact O-N 2.75Å; L381-S385 VanDerWaalsContact O-CB 3.31Å; L381-S385 WeakPolarHBondContact O-CB 3.38Å; L381-S385 PolarHBondContact O-N 2.78Å; L381-S385 PolarHBondContact O-OG 3.44Å
382I95.4Very high94.9Very high103 Ų10398.4 Ų98.453%0.52852%0.523SS..Hα-helixtrans-61.9-49.3176.5-71.8163.7000109.9M378 E379 S384 S385 Q386M378-I382 WeakPolarHBondContact O-CB 3.29Å; M378-I382 WeakPolarHBondContact O-CD1 3.35Å; M378-I382 VanDerWaalsContact O-CG1 3.24Å; M378-I382 WeakPolarHBondContact O-CG1 3.46Å; M378-I382 PolarHBondContact O-N 2.91Å; E379-I382 PolarHBondContact O-N 2.91Å; I382-S384 PolarHBondContact O-N 2.73Å; I382-S385 PolarHBondContact O-N 3.35Å; I382-S385 PolarHBondContact O-OG 2.71Å; I382-Q386 WeakPolarHBondContact O-CB 3.48Å; I382-Q386 PolarHBondContact O-N 3.5Å
383S96.8Very high95.1Very high66 Ų6695.4 Ų95.446%0.46251%0.514SS..Hα-helixtrans-61.6-45.2179.3-55.40000112.1E379 N380 S385 Q386 E387E379-S383 WeakPolarHBondContact O-CB 3.19Å; E379-S383 PolarHBondContact O-N 2.99Å; E379-S383 PolarHBondContact O-OG 3.22Å; N380-S383 PolarHBondContact O-N 2.87Å; S383-S385 VanDerWaalsContact C-N 3.35Å; S383-S385 PolarHBondContact O-N 2.88Å; S383-Q386 WeakPolarHBondContact O-CB 3.24Å; S383-Q386 PolarHBondContact O-N 2.97Å; S383-E387 PolarHBondContact O-N 3.1Å
384S96.7Very high95.2Very high68 Ų6894.1 Ų94.148%0.47651%0.506SS..Hα-helixtrans-62.9-39.3175.1-178.90000112.2N380 I382 E387 T388N380-S384 VanDerWaalsContact O-CB 3.23Å; N380-S384 WeakPolarHBondContact O-CB 3.46Å; N380-S384 PolarHBondContact O-N 3.46Å; I382-S384 PolarHBondContact O-N 2.73Å; S384-E387 PolarHBondContact O-N 3.14Å; S384-T388 WeakPolarHBondContact O-CB 3.34Å; S384-T388 PolarHBondContact O-N 3.15Å; S384-T388 PolarHBondContact O-OG1 3.25Å
385S95.8Very high95.4Very high51 Ų5192 Ų9236%0.35750%0.501SS..Hα-helixtrans-66.5-37.8174.680.80000112.1L381 I382 S383 T388 I389L381-S385 VanDerWaalsContact O-CB 3.31Å; L381-S385 WeakPolarHBondContact O-CB 3.38Å; L381-S385 PolarHBondContact O-N 2.78Å; L381-S385 PolarHBondContact O-OG 3.44Å; I382-S385 PolarHBondContact O-N 3.35Å; I382-S385 PolarHBondContact O-OG 2.71Å; S383-S385 VanDerWaalsContact C-N 3.35Å; S383-S385 PolarHBondContact O-N 2.88Å; S385-T388 PolarHBondContact O-N 2.78Å; S385-I389 WeakPolarHBondContact O-CB 3.22Å; S385-I389 WeakPolarHBondContact O-CD1 3.28Å; S385-I389 WeakPolarHBondContact O-CG1 3.49Å; S385-I389 PolarHBondContact O-N 2.82Å
386Q96.6Very high95.2Very high135 Ų13591.1 Ų91.163%0.63150%0.496SS*.Hα-helixtrans-65.2-43.7177.7-172.7-17322.300111.1I382 S383 K390I382-Q386 WeakPolarHBondContact O-CB 3.48Å; I382-Q386 PolarHBondContact O-N 3.5Å; S383-Q386 WeakPolarHBondContact O-CB 3.24Å; S383-Q386 PolarHBondContact O-N 2.97Å; Q386-K390 VanDerWaalsContact O-CB 3.27Å; Q386-K390 WeakPolarHBondContact O-CB 3.44Å; Q386-K390 PolarHBondContact O-N 3.49Å
387E96.8Very high95Very high135 Ų13591.3 Ų91.363%0.63150%0.497SS*.Hα-helixtrans-65.6-43.8174.2-177.4159.9-135.200111.8S383 S384 I389 K390 V391S383-E387 PolarHBondContact O-N 3.1Å; S384-E387 PolarHBondContact O-N 3.14Å; E387-I389 PolarHBondContact O-N 3.41Å; E387-K390 WeakPolarHBondContact O-CB 3.42Å; E387-K390 PolarHBondContact O-N 2.93Å; E387-K390 VanDerWaalsContact O-N 3.15Å; E387-V391 WeakPolarHBondContact O-CG2 3.5Å; E387-V391 PolarHBondContact O-N 3.35Å
388T97.1Very high94.8Very high74 Ų7495.6 Ų95.645%0.45451%0.507SS..Hα-helixtrans-58.2-46.3175.5-580000111.4S384 S385 V391 L392S384-T388 WeakPolarHBondContact O-CB 3.34Å; S384-T388 PolarHBondContact O-N 3.15Å; S384-T388 PolarHBondContact O-OG1 3.25Å; S385-T388 PolarHBondContact O-N 2.78Å; T388-V391 PolarHBondContact O-N 2.95Å; T388-L392 HydrophobicContact CG2-CD1 4.08Å; T388-L392 WeakPolarHBondContact O-CB 3.1Å; T388-L392 VanDerWaalsContact O-CG 3.29Å; T388-L392 WeakPolarHBondContact O-CG 3.41Å; T388-L392 PolarHBondContact O-N 2.93Å
389I93.4Very high94.5Very high96 Ų9696.7 Ų96.749%0.49251%0.514SS..Hα-helixtrans-62.9-42.4176-71.1163.5000110.7S385 E387 V391 L392 L393S385-I389 WeakPolarHBondContact O-CB 3.22Å; S385-I389 WeakPolarHBondContact O-CD1 3.28Å; S385-I389 WeakPolarHBondContact O-CG1 3.49Å; S385-I389 PolarHBondContact O-N 2.82Å; E387-I389 PolarHBondContact O-N 3.41Å; I389-V391 PolarHBondContact O-N 3.35Å; I389-L392 PolarHBondContact O-N 2.88Å; I389-L393 HydrophobicContact CG2-CD1 3.81Å; I389-L393 HydrophobicContact CG2-CG 4.29Å; I389-L393 WeakPolarHBondContact O-CB 3.42Å; I389-L393 VanDerWaalsContact O-CG 3.25Å; I389-L393 WeakPolarHBondContact O-CG 3.24Å; I389-L393 PolarHBondContact O-N 2.86Å
390K96.5Very high94.1Very high157 Ų15795.9 Ų95.968%0.68351%0.51SS*.Hα-helixtrans-61.6-42.4177.3-176.4-176178.5-173.20112.2Q386 E387 G394Q386-K390 VanDerWaalsContact O-CB 3.27Å; Q386-K390 WeakPolarHBondContact O-CB 3.44Å; Q386-K390 PolarHBondContact O-N 3.49Å; E387-K390 WeakPolarHBondContact O-CB 3.42Å; E387-K390 PolarHBondContact O-N 2.93Å; E387-K390 VanDerWaalsContact O-N 3.15Å; K390-G394 PolarHBondContact O-N 2.92Å
391V97.4Very high93.7Very high90 Ų9096.5 Ų96.555%0.54551%0.509SS..Hα-helixtrans-66-46.5175172.50000111E387 T388 I389 L393 G394 V395E387-V391 WeakPolarHBondContact O-CG2 3.5Å; E387-V391 PolarHBondContact O-N 3.35Å; T388-V391 PolarHBondContact O-N 2.95Å; I389-V391 PolarHBondContact O-N 3.35Å; V391-L393 PolarHBondContact O-N 2.95Å; V391-G394 WeakPolarHBondContact O-CA 3.49Å; V391-G394 PolarHBondContact O-N 3.12Å; V391-G394 VanDerWaalsContact O-N 3.12Å; V391-V395 WeakPolarHBondContact O-CG2 3.46Å; V391-V395 PolarHBondContact O-N 3.44Å
392L96Very high93.3Very high100 Ų10092.6 Ų92.652%0.52450%0.498SS..Hα-helixtrans-60.3-43.4177.3-72.7170.5000112.2T388 I389 G394 V395 I396T388-L392 HydrophobicContact CG2-CD1 4.08Å; T388-L392 WeakPolarHBondContact O-CB 3.1Å; T388-L392 VanDerWaalsContact O-CG 3.29Å; T388-L392 WeakPolarHBondContact O-CG 3.41Å; T388-L392 PolarHBondContact O-N 2.93Å; I389-L392 PolarHBondContact O-N 2.88Å; L392-G394 VanDerWaalsContact C-N 3.32Å; L392-G394 PolarHBondContact O-N 3.49Å; L392-V395 PolarHBondContact O-N 2.92Å; L392-I396 WeakPolarHBondContact O-CB 3.47Å; L392-I396 WeakPolarHBondContact O-CD1 3.24Å; L392-I396 VanDerWaalsContact O-CG1 3.24Å; L392-I396 WeakPolarHBondContact O-CG1 3.27Å; L392-I396 PolarHBondContact O-N 3.15Å
393L91.1Very high92.9Very high90 Ų9092.1 Ų92.147%0.47149%0.493SS..Hα-helixtrans-63-37.5174.4-72.4171.4000111.9I389 V391 Q397I389-L393 HydrophobicContact CG2-CD1 3.81Å; I389-L393 HydrophobicContact CG2-CG 4.29Å; I389-L393 WeakPolarHBondContact O-CB 3.42Å; I389-L393 VanDerWaalsContact O-CG 3.25Å; I389-L393 WeakPolarHBondContact O-CG 3.24Å; I389-L393 PolarHBondContact O-N 2.86Å; V391-L393 PolarHBondContact O-N 2.95Å; L393-Q397 WeakPolarHBondContact O-CB 3.31Å; L393-Q397 WeakPolarHBondContact O-CG 3.43Å; L393-Q397 PolarHBondContact O-N 3.02Å
394G94.8Very high92.2Very high29 Ų2989.6 Ų89.630%0.29948%0.476SS..Hα-helixtrans-60.5-51.9172.700000112.4K390 V391 L392 I396 Q397 E398K390-G394 PolarHBondContact O-N 2.92Å; V391-G394 WeakPolarHBondContact O-CA 3.49Å; V391-G394 PolarHBondContact O-N 3.12Å; V391-G394 VanDerWaalsContact O-N 3.12Å; L392-G394 VanDerWaalsContact C-N 3.32Å; L392-G394 PolarHBondContact O-N 3.49Å; G394-I396 VanDerWaalsContact C-N 3.33Å; G394-I396 PolarHBondContact O-N 3.47Å; G394-Q397 PolarHBondContact O-N 2.92Å; G394-E398 PolarHBondContact O-N 3.19Å
395V96.1Very high91.6Very high71 Ų7192.5 Ų92.543%0.4348%0.482SS..Hα-helixtrans-60.8-40.9178.3174.20000111.6V391 L392 E398 L399V391-V395 WeakPolarHBondContact O-CG2 3.46Å; V391-V395 PolarHBondContact O-N 3.44Å; L392-V395 PolarHBondContact O-N 2.92Å; V395-E398 PolarHBondContact O-N 2.82Å; V395-L399 HydrophobicContact CG1-CD1 3.97Å; V395-L399 HydrophobicContact CG1-CG 4.42Å; V395-L399 WeakPolarHBondContact O-CB 3.41Å; V395-L399 VanDerWaalsContact O-CG 3.29Å; V395-L399 WeakPolarHBondContact O-CG 3.29Å; V395-L399 PolarHBondContact O-N 2.72Å
396I89.6Confident91Very high78 Ų7897.8 Ų97.840%0.449%0.494SS..Hα-helixtrans-61.1-47.5174.8-70.1163.7000110.6L392 G394 E398 L399 E400L392-I396 WeakPolarHBondContact O-CB 3.47Å; L392-I396 WeakPolarHBondContact O-CD1 3.24Å; L392-I396 VanDerWaalsContact O-CG1 3.24Å; L392-I396 WeakPolarHBondContact O-CG1 3.27Å; L392-I396 PolarHBondContact O-N 3.15Å; G394-I396 VanDerWaalsContact C-N 3.33Å; G394-I396 PolarHBondContact O-N 3.47Å; I396-E398 VanDerWaalsContact C-N 3.31Å; I396-E398 PolarHBondContact O-N 2.69Å; I396-L399 PolarHBondContact O-N 2.66Å; I396-E400 HydrophobicContact CG2-CG 4.15Å; I396-E400 WeakPolarHBondContact CG2-OE1 3.49Å; I396-E400 WeakPolarHBondContact O-CB 3.25Å; I396-E400 WeakPolarHBondContact O-CG 3.38Å; I396-E400 PolarHBondContact O-N 2.78Å
397Q89.1Confident90.4Very high94 Ų9496.5 Ų96.544%0.43949%0.488SS..Hα-helixtrans-63.1-34.8178.1-70.6175.532.500112.7L393 G394 K401L393-Q397 WeakPolarHBondContact O-CB 3.31Å; L393-Q397 WeakPolarHBondContact O-CG 3.43Å; L393-Q397 PolarHBondContact O-N 3.02Å; G394-Q397 PolarHBondContact O-N 2.92Å; Q397-K401 WeakPolarHBondContact O-CB 3.31Å; Q397-K401 PolarHBondContact O-N 3.24Å
398E90.9Very high89.7Confident148 Ų14893.5 Ų93.569%0.69249%0.493SS*.Hα-helixtrans-68.6-41.2174.4-72.3-172.8167.300112.4G394 V395 I396 G402G394-E398 PolarHBondContact O-N 3.19Å; V395-E398 PolarHBondContact O-N 2.82Å; I396-E398 VanDerWaalsContact C-N 3.31Å; I396-E398 PolarHBondContact O-N 2.69Å; E398-G402 PolarHBondContact O-N 3.46Å
399L88.8Confident88.8Confident120 Ų12095.3 Ų95.363%0.62850%0.5SS*.Hα-helixtrans-66.1-51.2176.1-70.5170.8000111.9V395 I396 K401 G402 E403V395-L399 HydrophobicContact CG1-CD1 3.97Å; V395-L399 HydrophobicContact CG1-CG 4.42Å; V395-L399 WeakPolarHBondContact O-CB 3.41Å; V395-L399 VanDerWaalsContact O-CG 3.29Å; V395-L399 WeakPolarHBondContact O-CG 3.29Å; V395-L399 PolarHBondContact O-N 2.72Å; I396-L399 PolarHBondContact O-N 2.66Å; L399-K401 VanDerWaalsContact C-N 3.29Å; L399-K401 PolarHBondContact O-N 2.82Å; L399-G402 PolarHBondContact O-N 2.82Å; L399-G402 VanDerWaalsContact O-N 3.17Å; L399-E403 VanDerWaalsContact O-CB 3.31Å; L399-E403 WeakPolarHBondContact O-CB 3.21Å; L399-E403 PolarHBondContact O-N 3.42Å
400E86.4Confident88Confident90 Ų9095 Ų9542%0.42151%0.506SS..Hα-helixtrans-60.8-38177.4-69.8179173.500111.9I396 A404 Y411I396-E400 HydrophobicContact CG2-CG 4.15Å; I396-E400 WeakPolarHBondContact CG2-OE1 3.49Å; I396-E400 WeakPolarHBondContact O-CB 3.25Å; I396-E400 WeakPolarHBondContact O-CG 3.38Å; I396-E400 PolarHBondContact O-N 2.78Å; E400-A404 WeakPolarHBondContact O-CB 3.49Å; E400-A404 PolarHBondContact O-N 2.68Å; E400-Y411 HydrophobicContact CB-CD2 4.1Å; E400-Y411 HydrophobicContact CB-CE2 3.56Å
401K86.9Confident86.7Confident110 Ų11090.3 Ų90.348%0.47848%0.484SS..Hα-helixtrans-65.4-46.9173.7-179.3-176.2174.2-170.30111.3Q397 L399 E403 A404 H405 Y411Q397-K401 WeakPolarHBondContact O-CB 3.31Å; Q397-K401 PolarHBondContact O-N 3.24Å; L399-K401 VanDerWaalsContact C-N 3.29Å; L399-K401 PolarHBondContact O-N 2.82Å; K401-E403 VanDerWaalsContact C-N 3.34Å; K401-A404 PolarHBondContact O-N 3.32Å; K401-H405 PolarHBondContact O-N 3.14Å; K401-H405 PolarHBondContact O-ND1 2.88Å; K401-Y411 HydrophobicContact CB-CD1 4Å; K401-Y411 HydrophobicContact CB-CD2 4.4Å; K401-Y411 HydrophobicContact CB-CE1 4.36Å; K401-Y411 HydrophobicContact CB-CG 4.01Å; K401-Y411 HydrophobicContact CG-CD1 4.23Å; K401-Y411 HydrophobicContact CG-CG 4.37Å
402G88.1Confident85.4Confident40 Ų4093.7 Ų93.741%0.41249%0.487SS..Hα-helixtrans-62.3-40.1177.900000112.9E398 L399 H405 R406E398-G402 PolarHBondContact O-N 3.46Å; L399-G402 PolarHBondContact O-N 2.82Å; L399-G402 VanDerWaalsContact O-N 3.17Å; G402-H405 PolarHBondContact O-N 3.36Å; G402-R406 WeakPolarHBondContact O-CB 3.36Å; G402-R406 PolarHBondContact O-N 2.83Å
403E85.7Confident84.1Confident93 Ų9393 Ų9344%0.43549%0.487SS..Hα-helixtrans-59.1-52.9173-174.2126-79.500111.4L399 K401 H405 R406 E407L399-E403 VanDerWaalsContact O-CB 3.31Å; L399-E403 WeakPolarHBondContact O-CB 3.21Å; L399-E403 PolarHBondContact O-N 3.42Å; K401-E403 VanDerWaalsContact C-N 3.34Å; E403-H405 VanDerWaalsContact C-N 3.35Å; E403-H405 PolarHBondContact O-N 2.77Å; E403-R406 WeakPolarHBondContact O-CB 3.46Å; E403-R406 PolarHBondContact O-N 2.84Å; E403-R406 VanDerWaalsContact O-N 3.15Å; E403-R406 IonicContact OE1-CZ 3.89Å; E403-R406 IonicContact OE1-NH1 2.69Å; E403-R406 PolarHBondContact OE1-NH1 3.38Å; E403-R406 IonicContact OE1-NH2 2.73Å; E403-R406 PolarHBondContact OE1-NH2 2.86Å; E403-E407 PolarHBondContact O-N 3.22Å
404A83.4Confident82.8Confident12 Ų1292 Ų9210%0.09950%0.499CS..Hα-helixtrans-60.6-40.5177.700000112.8E400 K401 R406 E407 G408 L409E400-A404 WeakPolarHBondContact O-CB 3.49Å; E400-A404 PolarHBondContact O-N 2.68Å; K401-A404 PolarHBondContact O-N 3.32Å; A404-R406 VanDerWaalsContact C-N 3.34Å; A404-R406 PolarHBondContact O-N 3.17Å; A404-E407 CarbonylContact O-C 3.55Å; A404-E407 PolarHBondContact O-N 2.97Å; A404-G408 PolarHBondContact O-N 3.33Å; A404-L409 CarbonylContact C-O 3.41Å; A404-L409 HydrophobicContact CB-CB 4.46Å; A404-L409 PolarHBondContact O-N 2.82Å; A404-L409 VanDerWaalsContact O-O 3.09Å
405H83.6Confident81.2Confident129 Ų12997 Ų9760%0.59751%0.514SS*.Hα-helixtrans-65.1-36.9176.5-74.960000112.2K401 G402 E403 E407 G408K401-H405 PolarHBondContact O-N 3.14Å; K401-H405 PolarHBondContact O-ND1 2.88Å; G402-H405 PolarHBondContact O-N 3.36Å; E403-H405 VanDerWaalsContact C-N 3.35Å; E403-H405 PolarHBondContact O-N 2.77Å; H405-E407 VanDerWaalsContact C-N 3.29Å; H405-G408 PolarHBondContact O-N 2.94Å
406R83.5Confident79.7Confident162 Ų16296.7 Ų96.761%0.61151%0.511SS*.Hα-helixtrans-66.7-31.3175.1-176.1-168.271-138.13.1112.2G402 E403 A404G402-R406 WeakPolarHBondContact O-CB 3.36Å; G402-R406 PolarHBondContact O-N 2.83Å; E403-R406 WeakPolarHBondContact O-CB 3.46Å; E403-R406 PolarHBondContact O-N 2.84Å; E403-R406 VanDerWaalsContact O-N 3.15Å; E403-R406 IonicContact OE1-CZ 3.89Å; E403-R406 IonicContact OE1-NH1 2.69Å; E403-R406 PolarHBondContact OE1-NH1 3.38Å; E403-R406 IonicContact OE1-NH2 2.73Å; E403-R406 PolarHBondContact OE1-NH2 2.86Å; A404-R406 VanDerWaalsContact C-N 3.34Å; A404-R406 PolarHBondContact O-N 3.17Å
407E83.9Confident78.7Confident109 Ų10996.9 Ų96.951%0.50952%0.516SS..THydrogen-bonded Turntrans-93.41.3-179.3-71170.7-165.600113.5E403 A404 H405 L409E403-E407 PolarHBondContact O-N 3.22Å; A404-E407 CarbonylContact O-C 3.55Å; A404-E407 PolarHBondContact O-N 2.97Å; H405-E407 VanDerWaalsContact C-N 3.29Å; E407-L409 HydrophobicContact CB-CD1 4.31Å; E407-L409 HydrophobicContact CB-CG 4.25Å; E407-L409 PolarHBondContact O-N 3.37Å
408G81.1Confident77.9Confident72 Ų7296.1 Ų96.174%0.74253%0.525SS*.THydrogen-bonded Turntrans71.710.9-178.800000114.3A404 H405A404-G408 PolarHBondContact O-N 3.33Å; H405-G408 PolarHBondContact O-N 2.94Å
409L79.3Confident77.1Confident111 Ų11196 Ų9658%0.58153%0.529SS*.PPolyproline II helixtrans-93146.1-178.2-61.3178.2000111A404 E407 Y411A404-L409 CarbonylContact C-O 3.41Å; A404-L409 HydrophobicContact CB-CB 4.46Å; A404-L409 PolarHBondContact O-N 2.82Å; A404-L409 VanDerWaalsContact O-O 3.09Å; E407-L409 HydrophobicContact CB-CD1 4.31Å; E407-L409 HydrophobicContact CB-CG 4.25Å; E407-L409 PolarHBondContact O-N 3.37Å; L409-Y411 PolarHBondContact O-N 3.17Å
410S75.3Confident76.7Confident89 Ų8992 Ų9262%0.62251%0.511SS*.PPolyproline II helixtrans-73.8117.1171.170.30000109.7R412S410-R412 WeakPolarHBondContact O-CG 3.48Å; S410-R412 PolarHBondContact O-N 3.4Å
411Y69.8Low76.5Confident59 Ų5992.8 Ų92.823%0.23152%0.518CS..PPolyproline II helixtrans-56.2126.6172.4173.9-116.3000111.1E400 K401 L409 T413E400-Y411 HydrophobicContact CB-CD2 4.1Å; E400-Y411 HydrophobicContact CB-CE2 3.56Å; K401-Y411 HydrophobicContact CB-CD1 4Å; K401-Y411 HydrophobicContact CB-CD2 4.4Å; K401-Y411 HydrophobicContact CB-CE1 4.36Å; K401-Y411 HydrophobicContact CB-CG 4.01Å; K401-Y411 HydrophobicContact CG-CD1 4.23Å; K401-Y411 HydrophobicContact CG-CG 4.37Å; L409-Y411 PolarHBondContact O-N 3.17Å; Y411-T413 WeakPolarHBondContact CE1-OG1 3.22Å; Y411-T413 PolarHBondContact OH-OG1 2.99Å
412R69.8Low76.4Confident161 Ų16190.9 Ų90.961%0.60852%0.516SS*.  trans-144.386.7-171.2-77.4-68.5-178.1164.9-0.8111.3S410 Q415S410-R412 WeakPolarHBondContact O-CG 3.48Å; S410-R412 PolarHBondContact O-N 3.4Å; R412-Q415 HydrophobicContact CB-CG 4.07Å; R412-Q415 VanDerWaalsContact CD-OE1 3.31Å
413T68.3Low76.1Confident86 Ų8691.2 Ų91.253%0.52851%0.511SS..THydrogen-bonded Turntrans-59.3136.7178.1-30.20000111.7Y411 Q415Y411-T413 WeakPolarHBondContact CE1-OG1 3.22Å; Y411-T413 PolarHBondContact OH-OG1 2.99Å; T413-Q415 VanDerWaalsContact C-N 3.32Å; T413-Q415 PolarHBondContact O-N 2.87Å
414G64.5Low76.2Confident70 Ų7093.9 Ų93.972%0.72252%0.517SS*.THydrogen-bonded Turntrans69.411164.500000117.6D416G414-D416 PolarHBondContact O-N 3.27Å
415Q60.6Low76.3Confident132 Ų13298 Ų9862%0.61754%0.538SS*.  trans-73.5-21.3-175.4-74.9-154.9-80.300115.5R412 T413R412-Q415 HydrophobicContact CB-CG 4.07Å; R412-Q415 VanDerWaalsContact CD-OE1 3.31Å; T413-Q415 VanDerWaalsContact C-N 3.32Å; T413-Q415 PolarHBondContact O-N 2.87Å
416D64.5Low76.4Confident66 Ų6694 Ų9435%0.35352%0.524SS..  trans-116.339.8-160.9-156.98.2000115.6G414 A418 N419 C420 C423G414-D416 PolarHBondContact O-N 3.27Å; D416-A418 PolarHBondContact O-N 2.79Å; D416-N419 WeakPolarHBondContact OD1-CA 3.15Å; D416-N419 WeakPolarHBondContact OD1-CB 3.1Å; D416-N419 PolarHBondContact OD1-N 2.72Å; D416-C420 HydrophobicContact CB-CB 4.15Å; D416-C420 VanDerWaalsContact O-CB 3.31Å; D416-C420 WeakPolarHBondContact O-CB 3.39Å; D416-C420 PolarHBondContact O-N 3.07Å; D416-C420 PolarHBondContact OD1-N 2.83Å; D416-C420 VanDerWaalsContact OD1-N 3.14Å; D416-C420 WeakPolarHBondContact OD2-CB 3.4Å; D416-C423 VanDerWaalsContact O-CB 3.24Å; D416-C423 WeakPolarHBondContact O-CB 3.01Å
417T68.8Low76.5Confident82 Ų8287.2 Ų87.250%0.50350%0.503SS..THydrogen-bonded Turntrans-69.4-11.3169.750.70000113.5C423 A427T417-C423 HydrophobicContact CG2-CB 4.49Å; T417-A427 HydrophobicContact CG2-CB 4.48Å
418A72.4Confident76.7Confident77 Ų7785.2 Ų85.264%0.63650%0.5SS*.THydrogen-bonded Turntrans-94.9-43-179.200000113.8D416D416-A418 PolarHBondContact O-N 2.79Å
419N73.7Confident77.1Confident145 Ų14583.5 Ų83.578%0.77547%0.473SS*.THydrogen-bonded Turntrans-108.5-12.6-172.9-41-24.2000113D416D416-N419 WeakPolarHBondContact OD1-CA 3.15Å; D416-N419 WeakPolarHBondContact OD1-CB 3.1Å; D416-N419 PolarHBondContact OD1-N 2.72Å
420C80.4Confident77.5Confident37 Ų3783.2 Ų83.225%0.2547%0.472CS..  trans-101.7110.4171.7-178.50000111.8D416 T422 C423 R424D416-C420 HydrophobicContact CB-CB 4.15Å; D416-C420 VanDerWaalsContact O-CB 3.31Å; D416-C420 WeakPolarHBondContact O-CB 3.39Å; D416-C420 PolarHBondContact O-N 3.07Å; D416-C420 PolarHBondContact OD1-N 2.83Å; D416-C420 VanDerWaalsContact OD1-N 3.14Å; D416-C420 WeakPolarHBondContact OD2-CB 3.4Å; C420-T422 PolarHBondContact O-N 2.89Å; C420-T422 VanDerWaalsContact O-N 3.15Å; C420-C423 HydrophobicContact CB-CB 4.02Å; C420-C423 PolarHBondContact O-N 2.75Å; C420-C423 VanDerWaalsContact O-N 3.1Å; C420-C423 VanDerWaalsContact SG-SG 3.66Å; C420-R424 PolarHBondContact O-N 3.46Å
421D82.5Confident78.1Confident106 Ų10686.4 Ų86.457%0.56747%0.471SS*.Hα-helixtrans-52.1-36.3174.9-74.3-39.1000112.8R424 N425D421-R424 PolarHBondContact O-N 2.83Å; D421-N425 VanDerWaalsContact O-CB 3.32Å; D421-N425 WeakPolarHBondContact O-CB 3.41Å; D421-N425 VanDerWaalsContact O-CG 3.29Å; D421-N425 PolarHBondContact O-N 2.7Å; D421-N425 PolarHBondContact O-ND2 2.91Å
422T84.6Confident79Confident71 Ų7184.7 Ų84.744%0.43647%0.467SS..Hα-helixtrans-66-46.8179.4-49.30000111C420 N425 S426C420-T422 PolarHBondContact O-N 2.89Å; C420-T422 VanDerWaalsContact O-N 3.15Å; T422-N425 PolarHBondContact O-N 3.44Å; T422-S426 PolarHBondContact O-N 3.21Å; T422-S426 PolarHBondContact O-OG 2.67Å
423C82.6Confident79.9Confident47 Ų4778.4 Ų78.432%0.31845%0.447SS..Hα-helixtrans-63.2-42.2177-63.90000111.5D416 T417 C420 S426 A427D416-C423 VanDerWaalsContact O-CB 3.24Å; D416-C423 WeakPolarHBondContact O-CB 3.01Å; T417-C423 HydrophobicContact CG2-CB 4.49Å; C420-C423 HydrophobicContact CB-CB 4.02Å; C420-C423 PolarHBondContact O-N 2.75Å; C420-C423 VanDerWaalsContact O-N 3.1Å; C420-C423 VanDerWaalsContact SG-SG 3.66Å; C423-S426 WeakPolarHBondContact CA-OG 3.35Å; C423-S426 PolarHBondContact O-N 2.73Å; C423-S426 PolarHBondContact O-OG 3.39Å; C423-A427 WeakPolarHBondContact O-CB 3.37Å; C423-A427 PolarHBondContact O-N 3Å
424R87.6Confident80.9Confident148 Ų14879.9 Ų79.956%0.55845%0.448SS*.Hα-helixtrans-60.4-48.6174.7-174.3177.8175.6-178.40.1111.8C420 D421 S426 A427 C428C420-R424 PolarHBondContact O-N 3.46Å; D421-R424 PolarHBondContact O-N 2.83Å; R424-S426 PolarHBondContact O-N 3Å; R424-A427 PolarHBondContact O-N 3.04Å; R424-C428 PolarHBondContact O-N 3.22Å; R424-C428 PolarHBondContact O-SG 3.37Å; R424-C428 VanDerWaalsContact O-SG 3.35Å
425N86Confident82.2Confident100 Ų10081.5 Ų81.554%0.53544%0.44SS..Hα-helixtrans-62.7-41.8177.4-77.6-55.5000112D421 T422 C428 I429D421-N425 VanDerWaalsContact O-CB 3.32Å; D421-N425 WeakPolarHBondContact O-CB 3.41Å; D421-N425 VanDerWaalsContact O-CG 3.29Å; D421-N425 PolarHBondContact O-N 2.7Å; D421-N425 PolarHBondContact O-ND2 2.91Å; T422-N425 PolarHBondContact O-N 3.44Å; N425-C428 PolarHBondContact O-N 3.01Å; N425-I429 WeakPolarHBondContact O-CG1 3.27Å; N425-I429 PolarHBondContact O-N 2.9Å
426S85.8Confident83.6Confident43 Ų4376.6 Ų76.630%0.30142%0.417SS..Hα-helixtrans-64-39.3174.551.70000112.6T422 C423 R424 I429 I430T422-S426 PolarHBondContact O-N 3.21Å; T422-S426 PolarHBondContact O-OG 2.67Å; C423-S426 WeakPolarHBondContact CA-OG 3.35Å; C423-S426 PolarHBondContact O-N 2.73Å; C423-S426 PolarHBondContact O-OG 3.39Å; R424-S426 PolarHBondContact O-N 3Å; S426-I429 PolarHBondContact O-N 3Å; S426-I430 WeakPolarHBondContact O-CD1 3.32Å; S426-I430 VanDerWaalsContact O-CG1 3.28Å; S426-I430 WeakPolarHBondContact O-CG1 3.44Å; S426-I430 PolarHBondContact O-N 2.96Å
427A85.9Confident84.8Confident20 Ų2079 Ų7917%0.16543%0.425CS..Hα-helixtrans-63.7-44.1175.700000111.5T417 C423 R424 I429 I430 Y431T417-A427 HydrophobicContact CG2-CB 4.48Å; C423-A427 WeakPolarHBondContact O-CB 3.37Å; C423-A427 PolarHBondContact O-N 3Å; R424-A427 PolarHBondContact O-N 3.04Å; A427-I429 VanDerWaalsContact C-N 3.32Å; A427-I429 PolarHBondContact O-N 3.31Å; A427-I430 PolarHBondContact O-N 2.71Å; A427-Y431 HydrophobicContact CB-CD2 4.4Å; A427-Y431 HydrophobicContact CB-CE2 4.16Å; A427-Y431 WeakPolarHBondContact O-CD2 3.42Å; A427-Y431 PolarHBondContact O-N 3.44Å
428C87.8Confident85.9Confident67 Ų6779.4 Ų79.445%0.45342%0.42SS..Hα-helixtrans-59.7-40.1174.4-68.50000112.7R424 N425 S432R424-C428 PolarHBondContact O-N 3.22Å; R424-C428 PolarHBondContact O-SG 3.37Å; R424-C428 VanDerWaalsContact O-SG 3.35Å; N425-C428 PolarHBondContact O-N 3.01Å; C428-S432 VanDerWaalsContact O-CB 3.26Å; C428-S432 WeakPolarHBondContact O-CB 3.48Å; C428-S432 PolarHBondContact O-N 3.15Å; C428-S432 PolarHBondContact O-OG 3.06Å
429I88.3Confident86.7Confident36 Ų3679.5 Ų79.519%0.18541%0.409CS..Hα-helixtrans-63.3-50.1174.9-68.3165.5000110.3V97 N425 S426 A427 S432 V433V97-I429 HydrophobicContact CG1-CD1 4.24Å; V97-I429 HydrophobicContact CG2-CD1 4.19Å; N425-I429 WeakPolarHBondContact O-CG1 3.27Å; N425-I429 PolarHBondContact O-N 2.9Å; S426-I429 PolarHBondContact O-N 3Å; A427-I429 VanDerWaalsContact C-N 3.32Å; A427-I429 PolarHBondContact O-N 3.31Å; I429-S432 PolarHBondContact O-N 3.47Å; I429-S432 PolarHBondContact O-OG 3.33Å; I429-V433 WeakPolarHBondContact O-CG2 3.28Å; I429-V433 PolarHBondContact O-N 3.2Å
430I87.9Confident87.4Confident106 Ų10676.8 Ų76.854%0.54439%0.392SS..Hα-helixtrans-56.1-54.6179.4-68.6162.6000110.9S426 A427 S432 V433 E434S426-I430 WeakPolarHBondContact O-CD1 3.32Å; S426-I430 VanDerWaalsContact O-CG1 3.28Å; S426-I430 WeakPolarHBondContact O-CG1 3.44Å; S426-I430 PolarHBondContact O-N 2.96Å; A427-I430 PolarHBondContact O-N 2.71Å; I430-S432 VanDerWaalsContact C-N 3.27Å; I430-S432 PolarHBondContact O-N 3.43Å; I430-V433 PolarHBondContact O-N 3.29Å; I430-E434 WeakPolarHBondContact O-CB 3.29Å; I430-E434 PolarHBondContact O-N 3.17Å
431Y88.8Confident87.7Confident156 Ų15678.9 Ų78.961%0.61240%0.398SS*.Hα-helixtrans-63-32.1-179.5-67.8-51.7000113.1A427 E434 L435A427-Y431 HydrophobicContact CB-CD2 4.4Å; A427-Y431 HydrophobicContact CB-CE2 4.16Å; A427-Y431 WeakPolarHBondContact O-CD2 3.42Å; A427-Y431 PolarHBondContact O-N 3.44Å; Y431-E434 WeakPolarHBondContact CD1-OE2 3.3Å; Y431-L435 VanDerWaalsContact O-CB 3.29Å; Y431-L435 WeakPolarHBondContact O-CB 3.42Å; Y431-L435 PolarHBondContact O-N 2.69Å
432S87.5Confident88.1Confident22 Ų2277.5 Ų77.515%0.15439%0.391CS..Hα-helixtrans-69.8-37.6176.672.40000112.7L109 C428 I429 I430 D436L109-S432 WeakPolarHBondContact CD2-OG 3.31Å; C428-S432 VanDerWaalsContact O-CB 3.26Å; C428-S432 WeakPolarHBondContact O-CB 3.48Å; C428-S432 PolarHBondContact O-N 3.15Å; C428-S432 PolarHBondContact O-OG 3.06Å; I429-S432 PolarHBondContact O-N 3.47Å; I429-S432 PolarHBondContact O-OG 3.33Å; I430-S432 VanDerWaalsContact C-N 3.27Å; I430-S432 PolarHBondContact O-N 3.43Å; S432-D436 PolarHBondContact O-N 3.39Å; S432-D436 VanDerWaalsContact O-N 3.14Å
433V89.1Confident88.4Confident30 Ų3081.4 Ų81.418%0.18240%0.401CS..Hα-helixtrans-71.7-40.2174.2171.90000111.1L109 I429 I430 D436 F437L109-V433 HydrophobicContact CD1-CB 4.48Å; L109-V433 HydrophobicContact CD1-CG2 3.52Å; I429-V433 WeakPolarHBondContact O-CG2 3.28Å; I429-V433 PolarHBondContact O-N 3.2Å; I430-V433 PolarHBondContact O-N 3.29Å; V433-D436 PolarHBondContact O-N 2.9Å; V433-F437 HydrophobicContact CG1-CD2 3.73Å; V433-F437 HydrophobicContact CG1-CE2 3.49Å; V433-F437 VanDerWaalsContact CG1-CE2 3.49Å; V433-F437 VanDerWaalsContact O-CD2 3.23Å; V433-F437 WeakPolarHBondContact O-CD2 3.4Å; V433-F437 PolarHBondContact O-N 2.76Å
434E90.1Very high88.6Confident117 Ų11783.5 Ų83.555%0.54741%0.409SS..Hα-helixtrans-61.3-43.9175.2-174.1177.4-171.900111.6I430 Y431 F437 K438I430-E434 WeakPolarHBondContact O-CB 3.29Å; I430-E434 PolarHBondContact O-N 3.17Å; Y431-E434 WeakPolarHBondContact CD1-OE2 3.3Å; E434-F437 PolarHBondContact O-N 3.44Å; E434-K438 WeakPolarHBondContact O-CB 3.42Å; E434-K438 PolarHBondContact O-N 2.96Å
435L90.9Very high88.6Confident104 Ų10479.4 Ų79.455%0.54540%0.396SS..Hα-helixtrans-62.9-41175-179.261.8000112.2Y431 K438 L439Y431-L435 VanDerWaalsContact O-CB 3.29Å; Y431-L435 WeakPolarHBondContact O-CB 3.42Å; Y431-L435 PolarHBondContact O-N 2.69Å; L435-K438 WeakPolarHBondContact O-CB 3.29Å; L435-K438 PolarHBondContact O-N 3.4Å; L435-L439 HydrophobicContact CD1-CD1 4.31Å; L435-L439 HydrophobicContact CD1-CG 4.31Å; L435-L439 HydrophobicContact CG-CD1 4.06Å; L435-L439 HydrophobicContact CG-CG 4.49Å; L435-L439 WeakPolarHBondContact O-CB 3.39Å; L435-L439 VanDerWaalsContact O-CG 3.28Å; L435-L439 WeakPolarHBondContact O-CG 3.41Å; L435-L439 PolarHBondContact O-N 3.45Å
436D90.3Very high88.7Confident28 Ų2877.6 Ų77.615%0.1539%0.39CS..Hα-helixtrans-65.1-41175.8-82.5-32.6000112.6S106 L109 S432 V433 K438 L439 Q440S106-D436 WeakPolarHBondContact CB-OD2 3.46Å; S106-D436 VanDerWaalsContact OG-CG 3.27Å; S106-D436 PolarHBondContact OG-OD2 3.21Å; L109-D436 WeakPolarHBondContact CD1-OD2 3.37Å; L109-D436 VanDerWaalsContact CG-OD2 3.23Å; L109-D436 WeakPolarHBondContact CG-OD2 3.23Å; S432-D436 PolarHBondContact O-N 3.39Å; S432-D436 VanDerWaalsContact O-N 3.14Å; V433-D436 PolarHBondContact O-N 2.9Å; D436-K438 VanDerWaalsContact C-N 3.33Å; D436-L439 PolarHBondContact O-N 3.47Å; D436-Q440 VanDerWaalsContact O-CG 3.29Å; D436-Q440 WeakPolarHBondContact O-CG 3.15Å; D436-Q440 PolarHBondContact O-N 3.5Å
437F89.6Confident88.7Confident118 Ų11879.5 Ų79.552%0.51840%0.396SS..Hα-helixtrans-62.8-40.5172-79.6-59.2000111.5V433 E434 Q440 E441V433-F437 HydrophobicContact CG1-CD2 3.73Å; V433-F437 HydrophobicContact CG1-CE2 3.49Å; V433-F437 VanDerWaalsContact CG1-CE2 3.49Å; V433-F437 VanDerWaalsContact O-CD2 3.23Å; V433-F437 WeakPolarHBondContact O-CD2 3.4Å; V433-F437 PolarHBondContact O-N 2.76Å; E434-F437 PolarHBondContact O-N 3.44Å; F437-Q440 PolarHBondContact O-N 2.87Å; F437-Q440 VanDerWaalsContact O-N 3.16Å; F437-E441 WeakPolarHBondContact O-CB 3.46Å; F437-E441 PolarHBondContact O-N 3.33Å
438K91.4Very high88.6Confident90 Ų9083.7 Ų83.739%0.39141%0.414SS..Hα-helixtrans-60.5-46.3175-161.473.1-150.21590111.8E434 L435 D436 Q440 E441 D442E434-K438 WeakPolarHBondContact O-CB 3.42Å; E434-K438 PolarHBondContact O-N 2.96Å; L435-K438 WeakPolarHBondContact O-CB 3.29Å; L435-K438 PolarHBondContact O-N 3.4Å; D436-K438 VanDerWaalsContact C-N 3.33Å; K438-Q440 PolarHBondContact O-N 3.41Å; K438-E441 VanDerWaalsContact NZ-CD 3.26Å; K438-E441 IonicContact NZ-OE1 3.35Å; K438-E441 PolarHBondContact NZ-OE1 3.1Å; K438-E441 IonicContact NZ-OE2 2.82Å; K438-E441 PolarHBondContact NZ-OE2 3.21Å; K438-E441 WeakPolarHBondContact O-CB 3.33Å; K438-E441 PolarHBondContact O-N 3.47Å; K438-D442 WeakPolarHBondContact O-CB 3.36Å; K438-D442 VanDerWaalsContact O-CG 3.27Å; K438-D442 PolarHBondContact O-N 2.89Å
439L90.3Very high88.5Confident78 Ų7886.6 Ų86.641%0.40842%0.419SS..Hα-helixtrans-68.4-15.4176.5-69.7171000114.1L435 D436 K443L435-L439 HydrophobicContact CD1-CD1 4.31Å; L435-L439 HydrophobicContact CD1-CG 4.31Å; L435-L439 HydrophobicContact CG-CD1 4.06Å; L435-L439 HydrophobicContact CG-CG 4.49Å; L435-L439 WeakPolarHBondContact O-CB 3.39Å; L435-L439 VanDerWaalsContact O-CG 3.28Å; L435-L439 WeakPolarHBondContact O-CG 3.41Å; L435-L439 PolarHBondContact O-N 3.45Å; D436-L439 PolarHBondContact O-N 3.47Å; L439-K443 WeakPolarHBondContact O-CD 3.46Å; L439-K443 VanDerWaalsContact O-CE 3.23Å; L439-K443 WeakPolarHBondContact O-CE 3.45Å; L439-K443 VanDerWaalsContact O-CG 3.31Å; L439-K443 WeakPolarHBondContact O-CG 3.31Å
440Q87.6Confident88.3Confident89 Ų8993.2 Ų93.242%0.41644%0.441SS..Hα-helixtrans-86.6-44.2169-71.2171.629.700111D436 F437 K438 D442 K443 L444D436-Q440 VanDerWaalsContact O-CG 3.29Å; D436-Q440 WeakPolarHBondContact O-CG 3.15Å; D436-Q440 PolarHBondContact O-N 3.5Å; F437-Q440 PolarHBondContact O-N 2.87Å; F437-Q440 VanDerWaalsContact O-N 3.16Å; K438-Q440 PolarHBondContact O-N 3.41Å; Q440-D442 PolarHBondContact O-N 3.49Å; Q440-K443 PolarHBondContact O-N 2.87Å; Q440-L444 PolarHBondContact O-N 2.93Å
441E87.6Confident87.7Confident80 Ų8095 Ų9537%0.37445%0.451SS..Hα-helixtrans-57.2-47.4174.5-166-154.4138.100111.5F437 K438 K443 L444 Q445F437-E441 WeakPolarHBondContact O-CB 3.46Å; F437-E441 PolarHBondContact O-N 3.33Å; K438-E441 VanDerWaalsContact NZ-CD 3.26Å; K438-E441 IonicContact NZ-OE1 3.35Å; K438-E441 PolarHBondContact NZ-OE1 3.1Å; K438-E441 IonicContact NZ-OE2 2.82Å; K438-E441 PolarHBondContact NZ-OE2 3.21Å; K438-E441 WeakPolarHBondContact O-CB 3.33Å; K438-E441 PolarHBondContact O-N 3.47Å; E441-K443 PolarHBondContact O-N 3.28Å; E441-L444 CarbonylContact O-C 3.59Å; E441-L444 PolarHBondContact O-N 2.8Å; E441-Q445 HydrophobicContact CG-CG 4.45Å; E441-Q445 PolarHBondContact O-N 3.3Å; E441-Q445 PolarHBondContact OE1-NE2 3.32Å
442D90.7Very high86.7Confident78 Ų7892.2 Ų92.242%0.41745%0.454SS..Hα-helixtrans-65.3-22.3-179.3-68.6-24.4000113K438 Q440 P446K438-D442 WeakPolarHBondContact O-CB 3.36Å; K438-D442 VanDerWaalsContact O-CG 3.27Å; K438-D442 PolarHBondContact O-N 2.89Å; Q440-D442 PolarHBondContact O-N 3.49Å; D442-P446 WeakPolarHBondContact O-CD 3.34Å
443K91.1Very high85.4Confident152 Ų15294.9 Ų94.966%0.66147%0.471SS*.Hα-helixtrans-85.5-30.3172.3-68.9170.6-168.5162.40112.5L439 Q440 E441L439-K443 WeakPolarHBondContact O-CD 3.46Å; L439-K443 VanDerWaalsContact O-CE 3.23Å; L439-K443 WeakPolarHBondContact O-CE 3.45Å; L439-K443 VanDerWaalsContact O-CG 3.31Å; L439-K443 WeakPolarHBondContact O-CG 3.31Å; Q440-K443 PolarHBondContact O-N 2.87Å; E441-K443 PolarHBondContact O-N 3.28Å
444L86.6Confident84Confident92 Ų9299.3 Ų99.348%0.48250%0.5SS..Hα-helixtrans-80.1-35.5178-175.960.2000112.1Q440 E441 L447 M448Q440-L444 PolarHBondContact O-N 2.93Å; E441-L444 CarbonylContact O-C 3.59Å; E441-L444 PolarHBondContact O-N 2.8Å; L444-L447 WeakPolarHBondContact O-CA 3.37Å; L444-L447 WeakPolarHBondContact O-CB 3.48Å; L444-L447 PolarHBondContact O-N 2.81Å; L444-M448 HydrophobicContact CD1-CG 4.3Å; L444-M448 HydrophobicContact CD2-SD 4.16Å; L444-M448 HydrophobicContact CG-CG 4.02Å; L444-M448 HydrophobicContact CG-SD 3.92Å; L444-M448 PolarHBondContact O-N 3.26Å
445Q87.1Confident82.2Confident62 Ų6299.2 Ų99.229%0.2951%0.508SS..Hα-helixtrans-54-45.2179.5-83-160.729.100113.4E441 L447 M448 K449E441-Q445 HydrophobicContact CG-CG 4.45Å; E441-Q445 PolarHBondContact O-N 3.3Å; E441-Q445 PolarHBondContact OE1-NE2 3.32Å; Q445-L447 PolarHBondContact O-N 2.82Å; Q445-M448 PolarHBondContact O-N 3.39Å; Q445-K449 WeakPolarHBondContact O-CB 3.46Å; Q445-K449 VanDerWaalsContact O-CG 3.23Å; Q445-K449 WeakPolarHBondContact O-CG 3.28Å; Q445-K449 PolarHBondContact O-N 3.01Å
446P87.6Confident80.2Confident62 Ų62100.9 Ų100.940%0.40352%0.517SS..Hα-helixtrans-68.4-13.2175-22.134.5000115D442 R450D442-P446 WeakPolarHBondContact O-CD 3.34Å; P446-R450 PolarHBondContact O-NE 3.31Å; P446-R450 PolarHBondContact O-NH2 3.02Å
447L87.6Confident77.9Confident82 Ų82103.8 Ų103.843%0.42954%0.539SS..Hα-helixtrans-87.4-47.2170.2-67.6165.2000109.9L444 Q445 K449 R450 L451L444-L447 WeakPolarHBondContact O-CA 3.37Å; L444-L447 WeakPolarHBondContact O-CB 3.48Å; L444-L447 PolarHBondContact O-N 2.81Å; Q445-L447 PolarHBondContact O-N 2.82Å; L447-K449 VanDerWaalsContact C-N 3.32Å; L447-K449 PolarHBondContact O-N 2.95Å; L447-R450 PolarHBondContact O-N 3.18Å; L447-L451 WeakPolarHBondContact O-CG 3.42Å; L447-L451 PolarHBondContact O-N 3.36Å
448M82.6Confident75.7Confident108 Ų108106.6 Ų106.653%0.53255%0.554SS.*Hα-helixtrans-57-43.2175.1-66.51797500112L444 Q445 R450 L451 C452L444-M448 HydrophobicContact CD1-CG 4.3Å; L444-M448 HydrophobicContact CD2-SD 4.16Å; L444-M448 HydrophobicContact CG-CG 4.02Å; L444-M448 HydrophobicContact CG-SD 3.92Å; L444-M448 PolarHBondContact O-N 3.26Å; Q445-M448 PolarHBondContact O-N 3.39Å; M448-R450 PolarHBondContact O-N 2.92Å; M448-L451 PolarHBondContact O-N 2.8Å; M448-C452 PolarHBondContact O-N 2.9Å
449K85.9Confident73.4Confident129 Ų129110.5 Ų110.556%0.56157%0.571SS**Hα-helixtrans-67.4-10.4176.1-68.2167.6-170.91710114.6Q445 L447Q445-K449 WeakPolarHBondContact O-CB 3.46Å; Q445-K449 VanDerWaalsContact O-CG 3.23Å; Q445-K449 WeakPolarHBondContact O-CG 3.28Å; Q445-K449 PolarHBondContact O-N 3.01Å; L447-K449 VanDerWaalsContact C-N 3.32Å; L447-K449 PolarHBondContact O-N 2.95Å
450R83.4Confident71.2Confident174 Ų174112 Ų11266%0.65759%0.585SS**Hα-helixtrans-101.9-35.6173.4-80.4-175.9-75.3168.1-5.4112.6P446 L447 M448P446-R450 PolarHBondContact O-NE 3.31Å; P446-R450 PolarHBondContact O-NH2 3.02Å; L447-R450 PolarHBondContact O-N 3.18Å; M448-R450 PolarHBondContact O-N 2.92Å
451L76.9Confident69.2Low144 Ų144113.6 Ų113.675%0.75460%0.604SS**Hα-helixtrans-76.4-32.4176.3-65.9171.7000112.1L447 M448 P453L447-L451 WeakPolarHBondContact O-CG 3.42Å; L447-L451 PolarHBondContact O-N 3.36Å; M448-L451 PolarHBondContact O-N 2.8Å; L451-P453 WeakPolarHBondContact O-CD 3.33Å
452C67.4Low67.6Low98 Ų98117.2 Ų117.266%0.66262%0.624SS**SBendtrans-116.387.8167.5-580000108.2M448M448-C452 PolarHBondContact O-N 2.9Å
453P59.5Low65.3Low78 Ų78119.9 Ų119.951%0.50665%0.646SS.*  trans-56.8148.9169-21.533000110.5L451 T455L451-P453 WeakPolarHBondContact O-CD 3.33Å; P453-T455 PolarHBondContact O-N 2.98Å
454P59.9Low62.8Low122 Ų122121.8 Ų121.879%0.79265%0.651SS**  trans-74.366.4167.133.7-34.9000109.8
455T51.7Low61Low116 Ų116121.3 Ų121.371%0.71265%0.653SS**  trans-60.4131157-58.50000107.1P453 S457P453-T455 PolarHBondContact O-N 2.98Å; T455-S457 PolarHBondContact O-N 3.33Å
456D49.3Very low58.8Low138 Ų138127.2 Ų127.274%0.73868%0.681SS**  trans-57.197.5-176-76.3-68.4000111.7H458D456-H458 VanDerWaalsContact C-N 3.29Å; D456-H458 PolarHBondContact O-CD2 3.47Å; D456-H458 PolarHBondContact O-N 3.12Å
457S42.9Very low56.4Low89 Ų89130 Ų13062%0.62269%0.689SS**  trans-80.681.6-172.4-167.60000108.9T455 F459T455-S457 PolarHBondContact O-N 3.33Å; S457-F459 PolarHBondContact O-N 3.47Å; S457-F459 VanDerWaalsContact OG-CD2 3.24Å; S457-F459 WeakPolarHBondContact OG-CD2 3.45Å
458H43.8Very low53.9Low178 Ų178129.4 Ų129.482%0.82470%0.695SS**  trans-66.429.4169.7-75-83.4000113.1D456D456-H458 VanDerWaalsContact C-N 3.29Å; D456-H458 PolarHBondContact O-CD2 3.47Å; D456-H458 PolarHBondContact O-N 3.12Å
459F41.1Very low51.7Low172 Ų172132.6 Ų132.675%0.75471%0.706SS**PPolyproline II helixtrans-75132.4170.3-81.5-105.5000109.2S457S457-F459 PolarHBondContact O-N 3.47Å; S457-F459 VanDerWaalsContact OG-CD2 3.24Å; S457-F459 WeakPolarHBondContact OG-CD2 3.45Å
460P45.6Very low49.3Very low108 Ų108131.9 Ų131.970%0.70171%0.713SS**PPolyproline II helixtrans-55.7142.7169.1-23.433.7000110.4L462P460-L462 PolarHBondContact O-N 3.06Å
461P45.7Very low47Very low124 Ų124129.1 Ų129.181%0.80572%0.72SS**PPolyproline II helixtrans-53.6125.4174-25.934.6000110.7
462L52.4Low45.3Very low155 Ų155127.5 Ų127.581%0.81272%0.716SS**PPolyproline II helixtrans-55.3133.7174.3-86161.2000109.2P460 Y464P460-L462 PolarHBondContact O-N 3.06Å; L462-Y464 PolarHBondContact O-N 3.18Å
463P43.4Very low43.8Very low135 Ų135128.8 Ų128.888%0.87772%0.724SS**SBendtrans-77.428.7-169.433-38000113.8
464Y39.4Very low42.6Very low192 Ų192134.7 Ų134.775%0.75374%0.742SS**SBendtrans-113.7124.9179.2-165.9-96.1000110.4L462 Q466L462-Y464 PolarHBondContact O-N 3.18Å; Y464-Q466 PolarHBondContact O-N 2.83Å
465P47.3Very low41.7Very low82 Ų82140.2 Ų140.253%0.53275%0.747SS.*  trans-63.3124.4176.3-19.731.9000110.9E467P465-E467 PolarHBondContact O-N 2.83Å
466Q42.3Very low41Very low185 Ų185144.8 Ų144.886%0.86476%0.756SS**  trans-72.485.7165.5-172.8168.9-9.200108.4Y464 A468Y464-Q466 PolarHBondContact O-N 2.83Å; Q466-A468 PolarHBondContact O-N 3Å
467E37.1Very low40.5Very low122 Ų122143.7 Ų143.757%0.5776%0.76SS**  trans-61.979.1173.6-78-71.6130.300110.3P465 F469P465-E467 PolarHBondContact O-N 2.83Å; E467-F469 VanDerWaalsContact C-N 3.28Å; E467-F469 HydrophobicContact CB-CD2 4.19Å; E467-F469 HydrophobicContact CB-CE2 3.68Å; E467-F469 HydrophobicContact CB-CZ 3.9Å; E467-F469 HydrophobicContact CG-CZ 4.39Å; E467-F469 WeakPolarHBondContact O-CD2 3.3Å; E467-F469 PolarHBondContact O-N 3.38Å
468A34.4Very low40.3Very low69 Ų69149.4 Ų149.457%0.5777%0.773SS**  trans-69.288.3169.400000108.4Q466 T470Q466-A468 PolarHBondContact O-N 3Å; A468-T470 PolarHBondContact O-N 3.45Å; A468-T470 PolarHBondContact O-OG1 3.41Å
469F36.9Very low40.1Very low174 Ų174145.4 Ų145.476%0.76377%0.771SS**  trans-63.363.1179.3-73-74.2000113E467 S471E467-F469 VanDerWaalsContact C-N 3.28Å; E467-F469 HydrophobicContact CB-CD2 4.19Å; E467-F469 HydrophobicContact CB-CE2 3.68Å; E467-F469 HydrophobicContact CB-CZ 3.9Å; E467-F469 HydrophobicContact CG-CZ 4.39Å; E467-F469 WeakPolarHBondContact O-CD2 3.3Å; E467-F469 PolarHBondContact O-N 3.38Å; F469-S471 PolarHBondContact O-N 3.39Å
470T34.7Very low39.6Very low115 Ų115145 Ų14571%0.70677%0.771SS**  trans-75.276.3171.246.70000108.5A468 T472A468-T470 PolarHBondContact O-N 3.45Å; A468-T470 PolarHBondContact O-OG1 3.41Å; T470-T472 PolarHBondContact O-N 3.42Å
471S36.3Very low39.3Very low115 Ų115145.8 Ų145.880%0.80478%0.78SS**  trans-67.871.2-169.762.60000113.5F469F469-S471 PolarHBondContact O-N 3.39Å
472T39.3Very low39.5Very low110 Ų110148.6 Ų148.668%0.67578%0.779SS**  trans-125.2120.8171.858.70000109.1T470 K474T470-T472 PolarHBondContact O-N 3.42Å; T472-K474 PolarHBondContact O-N 3.17Å
473P36.7Very low39.2Very low126 Ų126150.2 Ų150.282%0.81878%0.78SS**  trans-71.1102.2-178.527.1-33000109.9R475P473-R475 VanDerWaalsContact C-N 3.28Å; P473-R475 PolarHBondContact O-N 3.24Å
474K34.6Very low39Very low202 Ų202152.3 Ų152.388%0.87878%0.777SS**  trans-66.776.5-172.4-153.1168.1-169.6169.50112.1T472 K476T472-K474 PolarHBondContact O-N 3.17Å; K474-K476 PolarHBondContact O-N 3.35Å
475R40.5Very low39.1Very low238 Ų238148.5 Ų148.590%0.89879%0.786SS**  trans-57123.1177.3-89.7-171162.8-156.4-5.2110.3P473 S477P473-R475 VanDerWaalsContact C-N 3.28Å; P473-R475 PolarHBondContact O-N 3.24Å; R475-S477 PolarHBondContact O-N 3.15Å; R475-S477 VanDerWaalsContact O-N 3.1Å
476K38.2Very low39.1Very low211 Ų211154.9 Ų154.992%0.91780%0.799SS**  trans-72.798.7176.5-61.2-174.2180-175.20110K474K474-K476 PolarHBondContact O-N 3.35Å
477S38.4Very low38.8Very low115 Ų115157.4 Ų157.480%0.80480%0.801SS**PPolyproline II helixtrans-76.7117.2172.951.30000110.9R475R475-S477 PolarHBondContact O-N 3.15Å; R475-S477 VanDerWaalsContact O-N 3.1Å
478K38.9Very low39.1Very low209 Ų209160 Ų16091%0.90981%0.81SS**PPolyproline II helixtrans-73.6165.4158.3-91.8-168.8171.7-172.60110.2
479A38.8Very low39.2Very low94 Ų94164.4 Ų164.478%0.77782%0.823SS**PPolyproline II helixtrans-72.3150.7-155.800000116.5
480E31.6Very low39.4Very low164 Ų164166.6 Ų166.677%0.76683%0.827SS**  trans60.1115.2142.5-160.1159.4157.400121.3
481S38.7Very low39.3Very low125 Ų125169.8 Ų169.887%0.87483%0.831SS**  trans-149.7101.9146.4-76.10000109.1K483S481-K483 PolarHBondContact O-N 2.75Å
482K50.1Low39.2Very low183 Ų183176.3 Ų176.380%0.79686%0.855SS**  trans-75.2106.2-172.4177.7-179.9-177.8173.90112.4
483K45.8Very low39.2Very low188 Ų188179.6 Ų179.682%0.81786%0.864SS**  trans-170.4142.7153.7-102.1141.5-165.6179.90114.2S481S481-K483 PolarHBondContact O-N 2.75Å
484H38.4Very low39.3Very low180 Ų180182.4 Ų182.483%0.83387%0.867SS**  trans48.785.6167.3-62-70.6000120R486H484-R486 PolarHBondContact O-N 3.24Å
485A42.9Very low39.6Very low112 Ų112181.3 Ų181.393%0.92687%0.866SS**  trans-77.9107.6157.200000111.1
486R46.5Very low39.5Very low216 Ų216178 Ų17882%0.81586%0.864SS**  trans-158.659.5165.3-156.2-174.6-171.7-104.28.4114.9H484H484-R486 PolarHBondContact O-N 3.24Å
487W35.1Very low39.6Very low237 Ų237175.9 Ų175.990%0.89886%0.861SS**  trans-121.1110.7158.6-71.387.9000108.3
488K44.8Very low39.7Very low178 Ų178180 Ų18077%0.77487%0.865SS**  trans-78.7157.6178.7-73.4-169.9173.7-1700110.1W490K488-W490 PolarHBondContact O-N 3.46Å
489L36.7Very low39.7Very low161 Ų161177.9 Ų177.984%0.84386%0.862SS**  trans-55.1131.3167.5-65.8158.5000109.8
490W39.8Very low39.8Very low220 Ų220184.4 Ų184.483%0.83387%0.868SS**  trans-94.893.7171.2-75.388.6000109.1K488K488-W490 PolarHBondContact O-N 3.46Å
491F33.6Very low40.5Very low182 Ų182186.1 Ų186.180%0.79888%0.877SS**  trans-142.3107.7166.9-80.5-74.7000108.8
492L33.5Very low40.7Very low251 Ų251191.6 Ų191.6100%1.31488%0.877SS**  trans-170.50161.1-106.8162.5000107.9

Retrieved 492 of 492 residues in 213 ms (Link to these results)