A0A087YJ14_POEFO Loading...

5-azacytidine induced 2

AlphaFold DB , UniProt , Accession A0A087YJ14, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 402 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M42.2Very low57.7Low242 Ų242143 Ų143100%1.19280%0.799SS**  01040-159.8162.4-165.500105.5
2E40.9Very low58.4Low171 Ų171143.5 Ų143.580%0.79980%0.796SS**  trans-52.8150.6-177.9-91.998.9162.800113.4L4E2-L4 PolarHBondContact O-N 3.41Å
3P52.1Low58.7Low123 Ų123144.6 Ų144.680%0.79980%0.799SS**  trans-71.2125.4165.2-219.4000109.8A5P3-A5 PolarHBondContact O-N 2.82Å; P3-A5 VanDerWaalsContact O-N 3.08Å
4L56.8Low58.9Low163 Ų163146.3 Ų146.385%0.85379%0.794SS**  trans-61.1104.4167.9-80154.6000109.3E2 V6E2-L4 PolarHBondContact O-N 3.41Å; L4-V6 PolarHBondContact O-N 3.11Å; L4-V6 VanDerWaalsContact O-N 3.13Å
5A60Low58.4Low90 Ų90148.4 Ų148.474%0.74480%0.796SS**  trans-66.8103.1160.800000107.4P3 D7P3-A5 PolarHBondContact O-N 2.82Å; P3-A5 VanDerWaalsContact O-N 3.08Å; A5-D7 PolarHBondContact O-N 2.61Å
6V60.4Low58.4Low114 Ų114150.1 Ų150.169%0.69180%0.797SS**  trans-83.797.2165.8-177.80000105.1L4 D8L4-V6 PolarHBondContact O-N 3.11Å; L4-V6 VanDerWaalsContact O-N 3.13Å; V6-D8 PolarHBondContact O-N 3.19Å; V6-D8 VanDerWaalsContact O-N 3.11Å
7D54.4Low58.1Low132 Ų132149.2 Ų149.271%0.70680%0.799SS**  trans-65.5102.2167.3-90.5-45.6000107.9A5 D9A5-D7 PolarHBondContact O-N 2.61Å; D7-D9 PolarHBondContact O-N 3.38Å
8D61.8Low57.7Low142 Ų142145.2 Ų145.276%0.75979%0.79SS**  trans-74.574.7166.3-83.6-31.2000108.8V6 I10V6-D8 PolarHBondContact O-N 3.19Å; V6-D8 VanDerWaalsContact O-N 3.11Å; D8-I10 PolarHBondContact O-N 3.31Å
9D71.7Confident57Low130 Ų130149.3 Ų149.370%0.69580%0.795SS**  trans-68.292.8172.6-81.1-29.7000110.1D7 C11D7-D9 PolarHBondContact O-N 3.38Å; D9-C11 PolarHBondContact O-N 3.31Å
10I65.4Low56.5Low151 Ų151148.5 Ų148.577%0.77480%0.796SS**  trans-67.295.5169.2-57.6174.2000108D8 I12D8-I10 PolarHBondContact O-N 3.31Å; I10-I12 PolarHBondContact O-N 2.75Å
11C68.9Low56.2Low115 Ų115146.9 Ų146.978%0.77779%0.793SS**  trans-66.998.4171.8-68.20000109.5D9 L13D9-C11 PolarHBondContact O-N 3.31Å; C11-L13 PolarHBondContact O-N 3.32Å
12I65.9Low56.6Low149 Ų149140.5 Ų140.576%0.76478%0.779SS**  trans-67103171.1-58.4176.4000107.8I10 K14I10-I12 PolarHBondContact O-N 2.75Å; I12-K14 PolarHBondContact O-N 2.89Å; I12-K14 VanDerWaalsContact O-N 3.11Å
13L62.9Low56.8Low158 Ų158136 Ų13683%0.82778%0.779SS**  trans-61111.8175.8-157.180.2000108.9C11 H15C11-L13 PolarHBondContact O-N 3.32Å; L13-H15 PolarHBondContact O-N 3.47Å
14K61.1Low56.9Low168 Ų168139.7 Ų139.773%0.7379%0.785SS**  trans-66.7129.6177.2-68.4-160.8174.6-1740110I12 E16I12-K14 PolarHBondContact O-N 2.89Å; I12-K14 VanDerWaalsContact O-N 3.11Å; K14-E16 PolarHBondContact O-N 3.31Å
15H51.8Low56.2Low178 Ų178137.4 Ų137.482%0.82478%0.783SS**THydrogen-bonded Turntrans-68.111.6-177.1-111.8-91.9000115.3L13L13-H15 PolarHBondContact O-N 3.47Å
16E57.7Low55.7Low176 Ų176137.9 Ų137.982%0.82278%0.779SS**THydrogen-bonded Turntrans-91.5-9-171.2-127.1179.6177.500114.1K14K14-E16 PolarHBondContact O-N 3.31Å
17T54.2Low55.4Low134 Ų134139.8 Ų139.882%0.82279%0.79SS**SBendtrans-109.58.9-179.36.80000114.8
18A50.6Low55.3Low78 Ų78138 Ų13865%0.64579%0.788SS**  trans-95.417.9178.200000114.1
19Y44.3Very low54.8Low223 Ų223137.2 Ų137.288%0.87579%0.788SS**  trans-99.484.6166.4-103.2-88.4000109.5P21Y19-P21 WeakPolarHBondContact O-CD 3.41Å
20T47.6Very low53.8Low133 Ų133134.5 Ų134.582%0.81678%0.779SS**  trans-76.5116153.928.20000108.4
21P49.8Very low53.4Low114 Ų114132.2 Ų132.274%0.7478%0.782SS**  trans-85.4134.5169.726.6-15.3000110Y19Y19-P21 WeakPolarHBondContact O-CD 3.41Å
22A49.3Very low52.7Low109 Ų109129 Ų12990%0.90177%0.769SS**  trans71.7107.4162.200000117.8
23G45.8Very low52.3Low77 Ų77127.2 Ų127.279%0.79476%0.761SS**  trans-165.174.1161.200000107.6S25G23-S25 PolarHBondContact O-N 2.89Å
24E53.8Low52.1Low199 Ų199126.5 Ų126.593%0.9375%0.753SS**  trans-47.2131.5170.6-63.8171.2149.900110.6
25S41.9Very low52.3Low115 Ų115122.5 Ų122.580%0.80475%0.746SS**  trans165.8137.2144.6-177.10000111.7G23G23-S25 PolarHBondContact O-N 2.89Å
26P50.8Low53.4Low101 Ų101118.1 Ų118.166%0.65673%0.732SS**  cis-116.3139.9-45.531.7-17.3000109.5S28P26-S28 PolarHBondContact O-N 3.5Å
27V54.2Low54.4Low153 Ų153112.7 Ų112.793%0.92772%0.717SS**  trans-65.387.7150.8173.10000105.9
28S51.8Low55.8Low94 Ų94110.2 Ų110.266%0.65771%0.705SS**  trans-94.988.4165.8171.40000107.4P26 C30P26-S28 PolarHBondContact O-N 3.5Å; S28-C30 PolarHBondContact O-N 2.73Å; S28-C30 VanDerWaalsContact O-N 3.17Å
29V52Low57.8Low126 Ų126112.3 Ų112.376%0.76470%0.701SS**SBendtrans28.381.3140.2-171.60000114.5
30C51Low60.1Low74 Ų74108.6 Ų108.650%0.569%0.69SS.*  trans-155.749.4144-95.70000109.5S28 G32 D33S28-C30 PolarHBondContact O-N 2.73Å; S28-C30 VanDerWaalsContact O-N 3.17Å; C30-G32 PolarHBondContact O-N 3.28Å; C30-D33 PolarHBondContact O-N 3.18Å
31A55.1Low62.3Low103 Ų103105 Ų10585%0.85167%0.673SS**THydrogen-bonded Turntrans-65.614.2178.100000114.7
32G56.2Low64.5Low48 Ų48105.1 Ų105.150%0.49567%0.668SS.*THydrogen-bonded Turntrans-108.9-35.2172.400000113.5C30 V36C30-G32 PolarHBondContact O-N 3.28Å; G32-V36 WeakPolarHBondContact O-CG2 3.01Å
33D56Low66.7Low111 Ų111103 Ų10359%0.59464%0.643SS**Hα-helixtrans-90.2-25.8-172.2-85.1-9.3000113.7C30 V36 A37C30-D33 PolarHBondContact O-N 3.18Å; D33-V36 PolarHBondContact O-N 3.14Å; D33-A37 WeakPolarHBondContact O-CB 3.39Å; D33-A37 PolarHBondContact O-N 2.73Å
34E60Low69.2Low142 Ų142102.8 Ų102.866%0.66463%0.626SS**Hα-helixtrans-67.7-36.9175.7-65.5174.8179.800111.8V36 A37 S38E34-V36 VanDerWaalsContact C-N 3.29Å; E34-V36 PolarHBondContact O-N 2.71Å; E34-A37 PolarHBondContact O-N 3.4Å; E34-S38 WeakPolarHBondContact O-CB 3.4Å; E34-S38 PolarHBondContact O-N 2.88Å
35S65.2Low71.2Confident84 Ų8495.5 Ų95.559%0.58760%0.6SS**Hα-helixtrans-64.8-35.9171.9-1760000111.2H39S35-H39 WeakPolarHBondContact O-CB 3.36Å; S35-H39 PolarHBondContact O-N 3.38Å
36V75.1Confident73.9Confident87 Ų8797.2 Ų97.253%0.52759%0.59SS.*Hα-helixtrans-75.2-40.6178.5176.10000110.9G32 D33 E34 H39 F40G32-V36 WeakPolarHBondContact O-CG2 3.01Å; D33-V36 PolarHBondContact O-N 3.14Å; E34-V36 VanDerWaalsContact C-N 3.29Å; E34-V36 PolarHBondContact O-N 2.71Å; V36-H39 PolarHBondContact O-N 2.95Å; V36-F40 WeakPolarHBondContact O-CB 3.37Å; V36-F40 PolarHBondContact O-N 3.41Å
37A77.8Confident76.1Confident61 Ų6196.5 Ų96.550%0.50458%0.578SS.*Hα-helixtrans-66.3-44.4175.600000112D33 E34 F40 A41D33-A37 WeakPolarHBondContact O-CB 3.39Å; D33-A37 PolarHBondContact O-N 2.73Å; E34-A37 PolarHBondContact O-N 3.4Å; A37-F40 PolarHBondContact O-N 3.38Å; A37-A41 WeakPolarHBondContact O-CB 3.41Å; A37-A41 PolarHBondContact O-N 2.96Å
38S83.9Confident78.2Confident82 Ų8292.7 Ų92.757%0.57355%0.552SS**Hα-helixtrans-65.5-39173.9-1750000111.8E34 L42E34-S38 WeakPolarHBondContact O-CB 3.4Å; E34-S38 PolarHBondContact O-N 2.88Å; S38-L42 WeakPolarHBondContact O-CB 3.24Å; S38-L42 PolarHBondContact O-N 2.67Å
39H91.8Very high80.4Confident122 Ų12292.6 Ų92.657%0.56554%0.544SS*.Hα-helixtrans-65.2-45.1174.6-179.272000111.3S35 V36 A41 L42 V43S35-H39 WeakPolarHBondContact O-CB 3.36Å; S35-H39 PolarHBondContact O-N 3.38Å; V36-H39 PolarHBondContact O-N 2.95Å; H39-A41 PolarHBondContact O-N 3.47Å; H39-L42 PolarHBondContact O-N 2.77Å; H39-V43 WeakPolarHBondContact O-CB 3.44Å; H39-V43 VanDerWaalsContact O-CG2 3.27Å; H39-V43 WeakPolarHBondContact O-CG2 3.31Å; H39-V43 PolarHBondContact O-N 2.94Å
40F93.9Very high82.6Confident145 Ų14590.3 Ų90.364%0.63652%0.524SS*.Hα-helixtrans-61.6-42.2176.8179.5-100000112.2V36 A37 V43 T44V36-F40 WeakPolarHBondContact O-CB 3.37Å; V36-F40 PolarHBondContact O-N 3.41Å; A37-F40 PolarHBondContact O-N 3.38Å; F40-V43 PolarHBondContact O-N 3.29Å; F40-T44 WeakPolarHBondContact O-CB 3.38Å; F40-T44 PolarHBondContact O-N 3.33Å; F40-T44 PolarHBondContact O-OG1 3.35Å
41A93.8Very high84.9Confident57 Ų5792.3 Ų92.347%0.47152%0.524SS..Hα-helixtrans-61.9-43.717400000111.6A37 H39 T44 A45A37-A41 WeakPolarHBondContact O-CB 3.41Å; A37-A41 PolarHBondContact O-N 2.96Å; H39-A41 PolarHBondContact O-N 3.47Å; A41-T44 PolarHBondContact O-N 2.7Å; A41-A45 VanDerWaalsContact O-CB 3.3Å; A41-A45 WeakPolarHBondContact O-CB 3.25Å; A41-A45 PolarHBondContact O-N 3.09Å
42L95.3Very high86.9Confident118 Ų11894 Ų9462%0.61851%0.508SS*.Hα-helixtrans-64.9-43.7176.9-176.663.5000112.1S38 H39 T44 A45 Y46S38-L42 WeakPolarHBondContact O-CB 3.24Å; S38-L42 PolarHBondContact O-N 2.67Å; H39-L42 PolarHBondContact O-N 2.77Å; L42-T44 VanDerWaalsContact C-N 3.33Å; L42-T44 PolarHBondContact O-N 2.64Å; L42-A45 PolarHBondContact O-N 3.39Å; L42-Y46 VanDerWaalsContact O-CB 3.24Å; L42-Y46 WeakPolarHBondContact O-CB 3.47Å; L42-Y46 PolarHBondContact O-N 3.35Å
43V96.4Very high88.9Confident65 Ų6596.5 Ų96.539%0.39451%0.509SS..Hα-helixtrans-61.5-43.2176169.70000110.6H39 F40 Y46 E47H39-V43 WeakPolarHBondContact O-CB 3.44Å; H39-V43 VanDerWaalsContact O-CG2 3.27Å; H39-V43 WeakPolarHBondContact O-CG2 3.31Å; H39-V43 PolarHBondContact O-N 2.94Å; F40-V43 PolarHBondContact O-N 3.29Å; V43-Y46 PolarHBondContact O-N 3.48Å; V43-E47 PolarHBondContact O-N 3.31Å
44T96.6Very high90.9Very high71 Ų7196.1 Ų96.144%0.43650%0.5SS..Hα-helixtrans-65.3-45.7177.8-57.90000111.5F40 A41 L42 Y46 E47 D48F40-T44 WeakPolarHBondContact O-CB 3.38Å; F40-T44 PolarHBondContact O-N 3.33Å; F40-T44 PolarHBondContact O-OG1 3.35Å; A41-T44 PolarHBondContact O-N 2.7Å; L42-T44 VanDerWaalsContact C-N 3.33Å; L42-T44 PolarHBondContact O-N 2.64Å; T44-Y46 VanDerWaalsContact C-N 3.33Å; T44-Y46 PolarHBondContact O-N 3.43Å; T44-E47 PolarHBondContact O-N 3.21Å; T44-D48 WeakPolarHBondContact O-CB 3.35Å; T44-D48 PolarHBondContact O-N 3.07Å
45A97Very high92.7Very high46 Ų4692.2 Ų92.238%0.3848%0.483SS..Hα-helixtrans-63.7-39.7176.300000111.7A41 L42 D48 I49A41-A45 VanDerWaalsContact O-CB 3.3Å; A41-A45 WeakPolarHBondContact O-CB 3.25Å; A41-A45 PolarHBondContact O-N 3.09Å; L42-A45 PolarHBondContact O-N 3.39Å; A45-D48 PolarHBondContact O-N 3.34Å; A45-I49 WeakPolarHBondContact O-CB 3.42Å; A45-I49 WeakPolarHBondContact O-CD1 3.47Å; A45-I49 VanDerWaalsContact O-CG1 3.23Å; A45-I49 WeakPolarHBondContact O-CG1 3.49Å; A45-I49 PolarHBondContact O-N 3.05Å
46Y97.9Very high94.3Very high151 Ų15192 Ų9259%0.59248%0.479SS*.Hα-helixtrans-63.7-46.4177-176.3-99.7000111.6L42 V43 T44 D48 I49 K50L42-Y46 VanDerWaalsContact O-CB 3.24Å; L42-Y46 WeakPolarHBondContact O-CB 3.47Å; L42-Y46 PolarHBondContact O-N 3.35Å; V43-Y46 PolarHBondContact O-N 3.48Å; T44-Y46 VanDerWaalsContact C-N 3.33Å; T44-Y46 PolarHBondContact O-N 3.43Å; Y46-D48 PolarHBondContact O-N 3.41Å; Y46-I49 PolarHBondContact O-N 3.49Å; Y46-K50 HydrophobicContact CE1-CD 4.38Å; Y46-K50 WeakPolarHBondContact O-CB 3.5Å; Y46-K50 PolarHBondContact O-N 3.47Å
47E98.1Very high95.4Very high86 Ų8693 Ų9340%0.40248%0.477SS..Hα-helixtrans-67-34.4176.6-74.4-60.3148.600112.6V43 T44 K50 K51V43-E47 PolarHBondContact O-N 3.31Å; T44-E47 PolarHBondContact O-N 3.21Å; E47-K50 IonicContact OE1-NZ 2.93Å; E47-K50 PolarHBondContact OE1-NZ 3.39Å; E47-K50 WeakPolarHBondContact OE2-CD 3.43Å; E47-K50 IonicContact OE2-NZ 3.34Å; E47-K50 PolarHBondContact OE2-NZ 2.97Å; E47-K51 WeakPolarHBondContact O-CB 3.46Å; E47-K51 PolarHBondContact O-N 3.01Å
48D98.3Very high96.3Very high73 Ų7396.4 Ų96.439%0.3948%0.478SS..Hα-helixtrans-64.9-49.1172.2178.669.7000112.3T44 A45 Y46 K50 K51 R52T44-D48 WeakPolarHBondContact O-CB 3.35Å; T44-D48 PolarHBondContact O-N 3.07Å; A45-D48 PolarHBondContact O-N 3.34Å; Y46-D48 PolarHBondContact O-N 3.41Å; D48-K50 VanDerWaalsContact C-N 3.29Å; D48-K50 PolarHBondContact O-N 3.44Å; D48-K51 WeakPolarHBondContact O-CB 3.38Å; D48-K51 PolarHBondContact O-N 3.22Å; D48-K51 VanDerWaalsContact O-N 3.11Å; D48-R52 PolarHBondContact O-N 2.92Å; D48-R52 IonicContact OD2-CZ 3.4Å; D48-R52 IonicContact OD2-NE 2.8Å; D48-R52 PolarHBondContact OD2-NE 2.94Å; D48-R52 IonicContact OD2-NH2 3.12Å; D48-R52 PolarHBondContact OD2-NH2 2.96Å; D48-R52 VanDerWaalsContact OD2-NH2 3.12Å
49I98.1Very high97Very high92 Ų9298.1 Ų98.147%0.47248%0.476SS..Hα-helixtrans-58.4-45.6176.7-71.5164.9000110.1A45 Y46 K51 R52 L53A45-I49 WeakPolarHBondContact O-CB 3.42Å; A45-I49 WeakPolarHBondContact O-CD1 3.47Å; A45-I49 VanDerWaalsContact O-CG1 3.23Å; A45-I49 WeakPolarHBondContact O-CG1 3.49Å; A45-I49 PolarHBondContact O-N 3.05Å; Y46-I49 PolarHBondContact O-N 3.49Å; I49-K51 VanDerWaalsContact C-N 3.29Å; I49-K51 PolarHBondContact O-N 3.31Å; I49-R52 PolarHBondContact O-N 2.97Å; I49-L53 WeakPolarHBondContact O-CB 3.46Å; I49-L53 PolarHBondContact O-N 3.27Å
50K97.9Very high97.2Very high79 Ų7995.9 Ų95.934%0.34347%0.468SS..Hα-helixtrans-62.4-37.1177.9-170.2-165-178.4-177.40111.6Y46 E47 D48 R54Y46-K50 HydrophobicContact CE1-CD 4.38Å; Y46-K50 WeakPolarHBondContact O-CB 3.5Å; Y46-K50 PolarHBondContact O-N 3.47Å; E47-K50 IonicContact OE1-NZ 2.93Å; E47-K50 PolarHBondContact OE1-NZ 3.39Å; E47-K50 WeakPolarHBondContact OE2-CD 3.43Å; E47-K50 IonicContact OE2-NZ 3.34Å; E47-K50 PolarHBondContact OE2-NZ 2.97Å; D48-K50 VanDerWaalsContact C-N 3.29Å; D48-K50 PolarHBondContact O-N 3.44Å; K50-R54 WeakPolarHBondContact O-CG 3.4Å; K50-R54 PolarHBondContact O-N 3.41Å
51K98.2Very high97.4Very high116 Ų11692.5 Ų92.550%0.50446%0.46SS..Hα-helixtrans-65.9-51.1173-176.8-175.6174.1-170.60111.1E47 D48 I49 L53 R54 D55E47-K51 WeakPolarHBondContact O-CB 3.46Å; E47-K51 PolarHBondContact O-N 3.01Å; D48-K51 WeakPolarHBondContact O-CB 3.38Å; D48-K51 PolarHBondContact O-N 3.22Å; D48-K51 VanDerWaalsContact O-N 3.11Å; I49-K51 VanDerWaalsContact C-N 3.29Å; I49-K51 PolarHBondContact O-N 3.31Å; K51-L53 VanDerWaalsContact C-N 3.27Å; K51-L53 PolarHBondContact O-N 3.36Å; K51-R54 PolarHBondContact O-N 3.26Å; K51-D55 VanDerWaalsContact O-CG 3.26Å; K51-D55 PolarHBondContact O-N 3.43Å
52R98.2Very high97.6Very high137 Ų13795.2 Ų95.252%0.51747%0.466SS..Hα-helixtrans-58.5-37.7177.8-75.8-168.6-75136.7-4.5112.6D48 I49 D55 T56D48-R52 PolarHBondContact O-N 2.92Å; D48-R52 IonicContact OD2-CZ 3.4Å; D48-R52 IonicContact OD2-NE 2.8Å; D48-R52 PolarHBondContact OD2-NE 2.94Å; D48-R52 IonicContact OD2-NH2 3.12Å; D48-R52 PolarHBondContact OD2-NH2 2.96Å; D48-R52 VanDerWaalsContact OD2-NH2 3.12Å; I49-R52 PolarHBondContact O-N 2.97Å; R52-D55 PolarHBondContact O-N 2.9Å; R52-T56 WeakPolarHBondContact O-CB 3.31Å; R52-T56 PolarHBondContact O-N 3.44Å; R52-T56 PolarHBondContact O-OG1 3.48Å
53L98.3Very high97.7Very high101 Ų10193.7 Ų93.753%0.52946%0.458SS..Hα-helixtrans-62.6-50.6176.1-17466.3000111I49 K51 D55 T56 E57I49-L53 WeakPolarHBondContact O-CB 3.46Å; I49-L53 PolarHBondContact O-N 3.27Å; K51-L53 VanDerWaalsContact C-N 3.27Å; K51-L53 PolarHBondContact O-N 3.36Å; L53-D55 VanDerWaalsContact C-N 3.28Å; L53-D55 PolarHBondContact O-N 3.25Å; L53-T56 PolarHBondContact O-N 3.04Å; L53-E57 WeakPolarHBondContact O-CG 3.41Å; L53-E57 PolarHBondContact O-N 3.26Å
54R97.6Very high97.7Very high103 Ų10397 Ų9739%0.38947%0.467SS..Hα-helixtrans-61.3-37.4176.7-69.2-170.4-57.1-1020.6112.6K50 K51 R58K50-R54 WeakPolarHBondContact O-CG 3.4Å; K50-R54 PolarHBondContact O-N 3.41Å; K51-R54 PolarHBondContact O-N 3.26Å; R54-R58 WeakPolarHBondContact O-CG 3.47Å; R54-R58 PolarHBondContact O-N 2.94Å; R54-R58 VanDerWaalsContact O-N 3.11Å
55D97.9Very high97.7Very high60 Ų60100.5 Ų100.532%0.32148%0.476SS..Hα-helixtrans-66-43.7177.5-66.4-14.6000110.8K51 R52 L53 R58 E59K51-D55 VanDerWaalsContact O-CG 3.26Å; K51-D55 PolarHBondContact O-N 3.43Å; R52-D55 PolarHBondContact O-N 2.9Å; L53-D55 VanDerWaalsContact C-N 3.28Å; L53-D55 PolarHBondContact O-N 3.25Å; D55-R58 PolarHBondContact O-N 2.91Å; D55-R58 IonicContact OD1-CZ 3.15Å; D55-R58 IonicContact OD1-NH1 2.66Å; D55-R58 PolarHBondContact OD1-NH1 2.9Å; D55-R58 IonicContact OD1-NH2 2.76Å; D55-R58 PolarHBondContact OD1-NH2 3Å; D55-E59 PolarHBondContact O-N 3.25Å
56T97.6Very high97.7Very high80 Ų80103.2 Ų103.249%0.49148%0.477SS..Hα-helixtrans-64.2-41.1175.4-54.70000112R52 L53 R58 E59 N60R52-T56 WeakPolarHBondContact O-CB 3.31Å; R52-T56 PolarHBondContact O-N 3.44Å; R52-T56 PolarHBondContact O-OG1 3.48Å; L53-T56 PolarHBondContact O-N 3.04Å; T56-R58 VanDerWaalsContact C-N 3.34Å; T56-R58 PolarHBondContact O-N 2.98Å; T56-E59 PolarHBondContact O-N 3.1Å; T56-N60 WeakPolarHBondContact O-CB 3.33Å; T56-N60 PolarHBondContact O-N 3.39Å
57E98Very high97.5Very high107 Ų10799.5 Ų99.550%0.547%0.47SS..Hα-helixtrans-60.2-44.4175.4-74.6170.8165.200111.3L53 N60 T61L53-E57 WeakPolarHBondContact O-CG 3.41Å; L53-E57 PolarHBondContact O-N 3.26Å; E57-N60 PolarHBondContact O-N 3.44Å; E57-T61 WeakPolarHBondContact O-CG2 3.4Å; E57-T61 PolarHBondContact O-N 2.99Å
58R97.8Very high97.3Very high134 Ų134101.3 Ų101.351%0.50648%0.476SS..Hα-helixtrans-62.8-45.5176-76.4-173.4-109.397.24.1111.6R54 D55 T56 N60 T61 L62R54-R58 WeakPolarHBondContact O-CG 3.47Å; R54-R58 PolarHBondContact O-N 2.94Å; R54-R58 VanDerWaalsContact O-N 3.11Å; D55-R58 PolarHBondContact O-N 2.91Å; D55-R58 IonicContact OD1-CZ 3.15Å; D55-R58 IonicContact OD1-NH1 2.66Å; D55-R58 PolarHBondContact OD1-NH1 2.9Å; D55-R58 IonicContact OD1-NH2 2.76Å; D55-R58 PolarHBondContact OD1-NH2 3Å; T56-R58 VanDerWaalsContact C-N 3.34Å; T56-R58 PolarHBondContact O-N 2.98Å; R58-N60 PolarHBondContact O-N 2.94Å; R58-T61 PolarHBondContact O-N 3.3Å; R58-T61 PolarHBondContact O-OG1 3.47Å; R58-L62 PolarHBondContact O-N 3.25Å; R58-L62 VanDerWaalsContact O-N 3.13Å
59E97.6Very high97Very high117 Ų117102.2 Ų102.255%0.54748%0.478SS..Hα-helixtrans-60.2-44175-173179.6-178.700112D55 T56 T61 L62 L63D55-E59 PolarHBondContact O-N 3.25Å; T56-E59 PolarHBondContact O-N 3.1Å; E59-T61 VanDerWaalsContact C-N 3.3Å; E59-T61 PolarHBondContact O-N 3.03Å; E59-L62 CarbonylContact O-C 3.56Å; E59-L62 WeakPolarHBondContact O-CA 3.37Å; E59-L62 WeakPolarHBondContact O-CB 3.3Å; E59-L62 PolarHBondContact O-N 3.34Å; E59-L63 HydrophobicContact CG-CD1 4.23Å; E59-L63 HydrophobicContact CG-CG 4.43Å; E59-L63 WeakPolarHBondContact O-CG 3.33Å; E59-L63 PolarHBondContact O-N 3.44Å
60N97.1Very high96.6Very high75 Ų75101.9 Ų101.940%0.40148%0.477SS..Hα-helixtrans-59.9-39.7177.8-165.8-79.6000111.9T56 E57 R58 L62 L63 K64T56-N60 WeakPolarHBondContact O-CB 3.33Å; T56-N60 PolarHBondContact O-N 3.39Å; E57-N60 PolarHBondContact O-N 3.44Å; R58-N60 PolarHBondContact O-N 2.94Å; N60-L62 VanDerWaalsContact C-N 3.32Å; N60-L62 PolarHBondContact O-N 2.94Å; N60-L63 PolarHBondContact O-N 3.02Å; N60-K64 WeakPolarHBondContact O-CB 3.26Å; N60-K64 WeakPolarHBondContact O-CG 3.33Å; N60-K64 PolarHBondContact O-N 3.31Å; N60-K64 WeakPolarHBondContact OD1-CE 3.43Å; N60-K64 PolarHBondContact OD1-NZ 3.42Å
61T97.6Very high96.2Very high74 Ų74102.9 Ų102.945%0.45448%0.483SS..Hα-helixtrans-65-36.317466.10000112.5E57 R58 E59 K65E57-T61 WeakPolarHBondContact O-CG2 3.4Å; E57-T61 PolarHBondContact O-N 2.99Å; R58-T61 PolarHBondContact O-N 3.3Å; R58-T61 PolarHBondContact O-OG1 3.47Å; E59-T61 VanDerWaalsContact C-N 3.3Å; E59-T61 PolarHBondContact O-N 3.03Å; T61-K65 WeakPolarHBondContact O-CG 3.49Å; T61-K65 PolarHBondContact O-N 2.78Å; T61-K65 VanDerWaalsContact O-N 3.09Å
62L97.6Very high95.6Very high114 Ų114102.7 Ų102.760%0.59748%0.484SS*.Hα-helixtrans-68.5-43.1176.2-172.9146.8000111R58 E59 N60 K65 R66R58-L62 PolarHBondContact O-N 3.25Å; R58-L62 VanDerWaalsContact O-N 3.13Å; E59-L62 CarbonylContact O-C 3.56Å; E59-L62 WeakPolarHBondContact O-CA 3.37Å; E59-L62 WeakPolarHBondContact O-CB 3.3Å; E59-L62 PolarHBondContact O-N 3.34Å; N60-L62 VanDerWaalsContact C-N 3.32Å; N60-L62 PolarHBondContact O-N 2.94Å; L62-K65 WeakPolarHBondContact O-CB 3.47Å; L62-K65 PolarHBondContact O-N 2.81Å; L62-R66 PolarHBondContact O-N 3.1Å
63L97.7Very high94.7Very high87 Ų87102.7 Ų102.746%0.45549%0.487SS..Hα-helixtrans-61.5-44.8174.7-71.1173.4000111.5E59 N60 K65 R66 V67E59-L63 HydrophobicContact CG-CD1 4.23Å; E59-L63 HydrophobicContact CG-CG 4.43Å; E59-L63 WeakPolarHBondContact O-CG 3.33Å; E59-L63 PolarHBondContact O-N 3.44Å; N60-L63 PolarHBondContact O-N 3.02Å; L63-K65 VanDerWaalsContact C-N 3.32Å; L63-K65 PolarHBondContact O-N 2.8Å; L63-R66 CarbonylContact O-C 3.59Å; L63-R66 WeakPolarHBondContact O-CB 3.47Å; L63-R66 PolarHBondContact O-N 3.32Å; L63-V67 WeakPolarHBondContact O-CG2 3.49Å; L63-V67 PolarHBondContact O-N 2.87Å
64K97.2Very high93.4Very high135 Ų135105 Ų10559%0.58750%0.499SS*.Hα-helixtrans-56.8-44173.8-78.6170.9173.7159.70112.3N60 R66 K68N60-K64 WeakPolarHBondContact O-CB 3.26Å; N60-K64 WeakPolarHBondContact O-CG 3.33Å; N60-K64 PolarHBondContact O-N 3.31Å; N60-K64 WeakPolarHBondContact OD1-CE 3.43Å; N60-K64 PolarHBondContact OD1-NZ 3.42Å; K64-R66 VanDerWaalsContact C-N 3.34Å; K64-K68 WeakPolarHBondContact O-CB 3.29Å; K64-K68 PolarHBondContact O-N 3.47Å
65K96.9Very high91.9Very high143 Ų143108.1 Ų108.162%0.62252%0.516SS*.Hα-helixtrans-63-40.8174.2-72.3174.9-178.61780111.6T61 L62 L63 K68 Q69T61-K65 WeakPolarHBondContact O-CG 3.49Å; T61-K65 PolarHBondContact O-N 2.78Å; T61-K65 VanDerWaalsContact O-N 3.09Å; L62-K65 WeakPolarHBondContact O-CB 3.47Å; L62-K65 PolarHBondContact O-N 2.81Å; L63-K65 VanDerWaalsContact C-N 3.32Å; L63-K65 PolarHBondContact O-N 2.8Å; K65-K68 PolarHBondContact O-N 3.14Å; K65-Q69 VanDerWaalsContact O-CG 3.31Å; K65-Q69 WeakPolarHBondContact O-CG 3.47Å; K65-Q69 PolarHBondContact O-N 2.82Å
66R96.2Very high90Very high104 Ų104114.6 Ų114.639%0.39254%0.536SS..Hα-helixtrans-67.8-41.6179.3-170.467.8-179.1106.38.7112.1L62 L63 K64 Q69 L70L62-R66 PolarHBondContact O-N 3.1Å; L63-R66 CarbonylContact O-C 3.59Å; L63-R66 WeakPolarHBondContact O-CB 3.47Å; L63-R66 PolarHBondContact O-N 3.32Å; K64-R66 VanDerWaalsContact C-N 3.34Å; R66-Q69 PolarHBondContact O-N 3.33Å; R66-L70 HydrophobicContact CG-CD1 4.38Å; R66-L70 VanDerWaalsContact O-CG 3.3Å; R66-L70 WeakPolarHBondContact O-CG 3.35Å; R66-L70 PolarHBondContact O-N 3.11Å
67V94.7Very high88.2Confident73 Ų73115.8 Ų115.844%0.44255%0.545SS..Hα-helixtrans-58.7-51.1172.9169.20000109.5L63 Q69 L70 E71L63-V67 WeakPolarHBondContact O-CG2 3.49Å; L63-V67 PolarHBondContact O-N 2.87Å; V67-Q69 VanDerWaalsContact C-N 3.3Å; V67-Q69 PolarHBondContact O-N 3.03Å; V67-L70 CarbonylContact O-C 3.58Å; V67-L70 WeakPolarHBondContact O-CA 3.43Å; V67-L70 WeakPolarHBondContact O-CB 3.32Å; V67-L70 PolarHBondContact O-N 3.06Å; V67-E71 HydrophobicContact CG1-CG 4.27Å; V67-E71 WeakPolarHBondContact O-CG 3.25Å; V67-E71 PolarHBondContact O-N 2.89Å
68K93.6Very high86.2Confident124 Ų124120.1 Ų120.154%0.53957%0.565SS.*Hα-helixtrans-56.5-42.8176.8-169.4-177-179.4-170.20112.7K64 K65 L70 E71 E72K64-K68 WeakPolarHBondContact O-CB 3.29Å; K64-K68 PolarHBondContact O-N 3.47Å; K65-K68 PolarHBondContact O-N 3.14Å; K68-L70 VanDerWaalsContact C-N 3.3Å; K68-L70 PolarHBondContact O-N 3.4Å; K68-E71 PolarHBondContact O-N 3.36Å; K68-E72 VanDerWaalsContact CE-OE1 3.24Å; K68-E72 WeakPolarHBondContact CE-OE1 3.39Å; K68-E72 IonicContact NZ-OE1 3.95Å; K68-E72 WeakPolarHBondContact O-CB 3.42Å; K68-E72 VanDerWaalsContact O-CG 3.29Å; K68-E72 WeakPolarHBondContact O-CG 3.35Å; K68-E72 PolarHBondContact O-N 2.98Å
69Q91.9Very high84.4Confident92 Ų92117 Ų11743%0.4357%0.568SS.*Hα-helixtrans-64.9-33.3175-74.1172.75.200113.2K65 R66 V67 K73K65-Q69 VanDerWaalsContact O-CG 3.31Å; K65-Q69 WeakPolarHBondContact O-CG 3.47Å; K65-Q69 PolarHBondContact O-N 2.82Å; R66-Q69 PolarHBondContact O-N 3.33Å; V67-Q69 VanDerWaalsContact C-N 3.3Å; V67-Q69 PolarHBondContact O-N 3.03Å; Q69-K73 WeakPolarHBondContact O-CB 3.39Å; Q69-K73 VanDerWaalsContact O-CG 3.22Å; Q69-K73 WeakPolarHBondContact O-CG 3.33Å; Q69-K73 PolarHBondContact O-N 3.41Å
70L90Very high82.8Confident85 Ų85116.6 Ų116.645%0.44558%0.575SS.*Hα-helixtrans-74.4-40.3176.8-72.5172000110.8R66 V67 K68 K73 L74R66-L70 HydrophobicContact CG-CD1 4.38Å; R66-L70 VanDerWaalsContact O-CG 3.3Å; R66-L70 WeakPolarHBondContact O-CG 3.35Å; R66-L70 PolarHBondContact O-N 3.11Å; V67-L70 CarbonylContact O-C 3.58Å; V67-L70 WeakPolarHBondContact O-CA 3.43Å; V67-L70 WeakPolarHBondContact O-CB 3.32Å; V67-L70 PolarHBondContact O-N 3.06Å; K68-L70 VanDerWaalsContact C-N 3.3Å; K68-L70 PolarHBondContact O-N 3.4Å; L70-K73 CarbonylContact O-C 3.5Å; L70-K73 PolarHBondContact O-N 3.4Å; L70-L74 WeakPolarHBondContact O-CB 3.46Å; L70-L74 PolarHBondContact O-N 2.92Å
71E88.3Confident81.1Confident100 Ų100118.3 Ų118.347%0.46759%0.591SS.*Hα-helixtrans-58.5-48.4170.1-69.1170.816500110.2V67 K68 K73 L74 F75V67-E71 HydrophobicContact CG1-CG 4.27Å; V67-E71 WeakPolarHBondContact O-CG 3.25Å; V67-E71 PolarHBondContact O-N 2.89Å; K68-E71 PolarHBondContact O-N 3.36Å; E71-K73 VanDerWaalsContact C-N 3.26Å; E71-K73 PolarHBondContact O-N 3.46Å; E71-L74 CarbonylContact O-C 3.55Å; E71-L74 PolarHBondContact O-N 2.9Å; E71-L74 VanDerWaalsContact O-N 3.08Å; E71-F75 HydrophobicContact CB-CD2 4.41Å; E71-F75 WeakPolarHBondContact O-CB 3.31Å; E71-F75 VanDerWaalsContact O-CD2 3.26Å; E71-F75 WeakPolarHBondContact O-CD2 3.43Å; E71-F75 PolarHBondContact O-N 2.73Å
72E85.3Confident79.6Confident112 Ų112118.4 Ų118.452%0.52360%0.595SS.*Hα-helixtrans-61-32.3175.7-75.2169.8-171.100113K68 R76K68-E72 VanDerWaalsContact CE-OE1 3.24Å; K68-E72 WeakPolarHBondContact CE-OE1 3.39Å; K68-E72 IonicContact NZ-OE1 3.95Å; K68-E72 WeakPolarHBondContact O-CB 3.42Å; K68-E72 VanDerWaalsContact O-CG 3.29Å; K68-E72 WeakPolarHBondContact O-CG 3.35Å; K68-E72 PolarHBondContact O-N 2.98Å; E72-R76 PolarHBondContact O-N 2.84Å
73K80.1Confident78.3Confident137 Ų137118.9 Ų118.960%0.59659%0.594SS**Hα-helixtrans-75.9-32.1174.1-77175.3-179.9-1710112.9Q69 L70 E71Q69-K73 WeakPolarHBondContact O-CB 3.39Å; Q69-K73 VanDerWaalsContact O-CG 3.22Å; Q69-K73 WeakPolarHBondContact O-CG 3.33Å; Q69-K73 PolarHBondContact O-N 3.41Å; L70-K73 CarbonylContact O-C 3.5Å; L70-K73 PolarHBondContact O-N 3.4Å; E71-K73 VanDerWaalsContact C-N 3.26Å; E71-K73 PolarHBondContact O-N 3.46Å
74L71.9Confident77.4Confident149 Ų149116.5 Ų116.578%0.7859%0.59SS**Hα-helixtrans-78.2-32.5177-165.974.7000111.6L70 E71L70-L74 WeakPolarHBondContact O-CB 3.46Å; L70-L74 PolarHBondContact O-N 2.92Å; E71-L74 CarbonylContact O-C 3.55Å; E71-L74 PolarHBondContact O-N 2.9Å; E71-L74 VanDerWaalsContact O-N 3.08Å
75F65.6Low77Confident169 Ų169114 Ų11474%0.74159%0.588SS**SBendtrans-89.4-4.8174.4-79.7-74.8000113.5E71 P77E71-F75 HydrophobicContact CB-CD2 4.41Å; E71-F75 WeakPolarHBondContact O-CB 3.31Å; E71-F75 VanDerWaalsContact O-CD2 3.26Å; E71-F75 WeakPolarHBondContact O-CD2 3.43Å; E71-F75 PolarHBondContact O-N 2.73Å; F75-P77 WeakPolarHBondContact O-CD 3.27Å; F75-P77 VanDerWaalsContact O-N 3.15Å
76R58Low76.5Confident195 Ų195113.5 Ų113.574%0.73659%0.587SS**SBendtrans-62.2116.1158.9-178.8-173-88.6-161.7-6.1104.9E72 E78E72-R76 PolarHBondContact O-N 2.84Å; R76-E78 PolarHBondContact O-N 2.9Å
77P59.6Low76.3Confident106 Ų106115.3 Ų115.369%0.68860%0.595SS**  trans-50.1120175.2-24.134.4000107.6F75 A79F75-P77 WeakPolarHBondContact O-CD 3.27Å; F75-P77 VanDerWaalsContact O-N 3.15Å; P77-A79 PolarHBondContact O-N 2.88Å
78E55.5Low76.2Confident198 Ų198116.7 Ų116.793%0.92560%0.603SS**SBendtrans-58.4109.4178.4-168.4164.1168.400107.4R76R76-E78 PolarHBondContact O-N 2.9Å
79A61Low76.3Confident67 Ų67115.5 Ų115.555%0.55460%0.603SS**SBendtrans66.2156.5-174.600000116.1P77P77-A79 PolarHBondContact O-N 2.88Å
80P62.5Low76.6Confident109 Ų109118.5 Ų118.571%0.70862%0.615SS**SBendtrans-45.3148.4161.7-23.233000109.6S82P80-S82 WeakPolarHBondContact O-CA 3.33Å; P80-S82 PolarHBondContact O-N 3.48Å
81P62.9Low76.9Confident111 Ų111117.4 Ų117.472%0.72162%0.618SS**SBendtrans-44.1112.8-176.417.8-30.7000108.5E83P81-E83 PolarHBondContact O-N 3.45Å
82S65.9Low77.4Confident77 Ų77119.1 Ų119.154%0.53862%0.624SS.*  trans-51.5122-168.765.90000107P80 G84 P85P80-S82 WeakPolarHBondContact O-CA 3.33Å; P80-S82 PolarHBondContact O-N 3.48Å; S82-G84 PolarHBondContact O-N 2.93Å; S82-P85 VanDerWaalsContact O-CD 3.27Å; S82-P85 WeakPolarHBondContact O-CD 3.42Å; S82-P85 WeakPolarHBondContact OG-CD 3.48Å
83E70Confident78Confident124 Ų124117 Ų11758%0.57962%0.622SS**SBendtrans-67.4-9.8-175.7-66.8171.9149.400111.5P81 H86 Y87P81-E83 PolarHBondContact O-N 3.45Å; E83-H86 WeakPolarHBondContact O-CB 3.32Å; E83-H86 PolarHBondContact O-N 2.95Å; E83-Y87 HydrophobicContact CB-CD2 3.65Å; E83-Y87 HydrophobicContact CB-CE2 3.28Å; E83-Y87 HydrophobicContact CG-CE2 4.28Å; E83-Y87 WeakPolarHBondContact O-CD2 3.46Å; E83-Y87 PolarHBondContact O-N 3.41Å
84G78.7Confident78.8Confident36 Ų36113 Ų11337%0.37161%0.614SS.*Hα-helixtrans-47.1-61.5179.200000114.2S82 H86 Y87 V88S82-G84 PolarHBondContact O-N 2.93Å; G84-H86 VanDerWaalsContact C-N 3.26Å; G84-H86 PolarHBondContact O-N 3.48Å; G84-Y87 PolarHBondContact O-N 3.33Å; G84-Y87 VanDerWaalsContact O-N 3.14Å; G84-V88 WeakPolarHBondContact O-CG2 3.37Å; G84-V88 PolarHBondContact O-N 3.06Å
85P87.8Confident80.1Confident84 Ų84112.7 Ų112.755%0.54560%0.604SS.*Hα-helixtrans-53.7-37.2175-30.935.9000114.7S82 N89S82-P85 VanDerWaalsContact O-CD 3.27Å; S82-P85 WeakPolarHBondContact O-CD 3.42Å; S82-P85 WeakPolarHBondContact OG-CD 3.48Å; P85-N89 WeakPolarHBondContact O-CB 3.32Å; P85-N89 PolarHBondContact O-N 3Å
86H87.2Confident81.7Confident132 Ų132112.4 Ų112.461%0.61160%0.598SS**Hα-helixtrans-69.3-41.5177.2-71-69000112.1E83 G84 N89 K90E83-H86 WeakPolarHBondContact O-CB 3.32Å; E83-H86 PolarHBondContact O-N 2.95Å; G84-H86 VanDerWaalsContact C-N 3.26Å; G84-H86 PolarHBondContact O-N 3.48Å; H86-N89 PolarHBondContact O-N 3.39Å; H86-K90 WeakPolarHBondContact O-CB 3.31Å; H86-K90 PolarHBondContact O-N 3.07Å
87Y91.6Very high83.6Confident141 Ų141104.9 Ų104.955%0.55358%0.581SS**Hα-helixtrans-64.7-41174.6-73.4-60.3000112.3E83 G84 K90 A91E83-Y87 HydrophobicContact CB-CD2 3.65Å; E83-Y87 HydrophobicContact CB-CE2 3.28Å; E83-Y87 HydrophobicContact CG-CE2 4.28Å; E83-Y87 WeakPolarHBondContact O-CD2 3.46Å; E83-Y87 PolarHBondContact O-N 3.41Å; G84-Y87 PolarHBondContact O-N 3.33Å; G84-Y87 VanDerWaalsContact O-N 3.14Å; Y87-K90 PolarHBondContact O-N 3.17Å; Y87-A91 WeakPolarHBondContact O-CB 3.24Å; Y87-A91 PolarHBondContact O-N 2.88Å
88V93.8Very high85.5Confident102 Ų102105.1 Ų105.162%0.61858%0.575SS**Hα-helixtrans-63.2-45.5176.7172.80000110.7G84 K90 A91 F92G84-V88 WeakPolarHBondContact O-CG2 3.37Å; G84-V88 PolarHBondContact O-N 3.06Å; V88-K90 PolarHBondContact O-N 3.45Å; V88-A91 PolarHBondContact O-N 3.48Å; V88-F92 WeakPolarHBondContact O-CB 3.28Å; V88-F92 PolarHBondContact O-N 3.26Å
89N95.1Very high87.5Confident100 Ų100101.8 Ų101.854%0.53556%0.555SS.*Hα-helixtrans-64.1-40.8177.5-168.9-11.7000111.8P85 H86 F92 S93P85-N89 WeakPolarHBondContact O-CB 3.32Å; P85-N89 PolarHBondContact O-N 3Å; H86-N89 PolarHBondContact O-N 3.39Å; N89-F92 PolarHBondContact O-N 3.42Å; N89-S93 WeakPolarHBondContact O-CB 3.3Å; N89-S93 PolarHBondContact O-N 2.97Å; N89-S93 PolarHBondContact O-OG 3.31Å; N89-S93 PolarHBondContact OD1-OG 2.8Å
90K96.7Very high89.3Confident154 Ų154102 Ų10267%0.6755%0.546SS*.Hα-helixtrans-62.9-44.2175-171.9175.2-178.5-179.60111.9H86 Y87 V88 S93 A94H86-K90 WeakPolarHBondContact O-CB 3.31Å; H86-K90 PolarHBondContact O-N 3.07Å; Y87-K90 PolarHBondContact O-N 3.17Å; V88-K90 PolarHBondContact O-N 3.45Å; K90-S93 PolarHBondContact O-N 3.46Å; K90-A94 WeakPolarHBondContact O-CB 3.3Å; K90-A94 PolarHBondContact O-N 2.89Å
91A97.1Very high91Very high63 Ų63102.2 Ų102.252%0.52154%0.538SS..Hα-helixtrans-63.5-41.7176.300000111.6Y87 V88 A94 Y95Y87-A91 WeakPolarHBondContact O-CB 3.24Å; Y87-A91 PolarHBondContact O-N 2.88Å; V88-A91 PolarHBondContact O-N 3.48Å; A91-A94 PolarHBondContact O-N 3.01Å; A91-Y95 WeakPolarHBondContact O-CB 3.02Å; A91-Y95 PolarHBondContact O-N 3.1Å
92F98Very high92.7Very high136 Ų136103.4 Ų103.460%0.59653%0.531SS*.Hα-helixtrans-64.7-44.1177.2-170.8-96.3000112.1V88 N89 A94 Y95 R96V88-F92 WeakPolarHBondContact O-CB 3.28Å; V88-F92 PolarHBondContact O-N 3.26Å; N89-F92 PolarHBondContact O-N 3.42Å; F92-A94 PolarHBondContact O-N 2.92Å; F92-Y95 PolarHBondContact O-N 3.29Å; F92-R96 WeakPolarHBondContact O-CB 3.12Å; F92-R96 PolarHBondContact O-N 3.28Å
93S98.2Very high94.2Very high67 Ų67105.2 Ų105.247%0.46953%0.531SS..Hα-helixtrans-63.2-41.5176.5-62.40000111.8N89 K90 R96 G97N89-S93 WeakPolarHBondContact O-CB 3.3Å; N89-S93 PolarHBondContact O-N 2.97Å; N89-S93 PolarHBondContact O-OG 3.31Å; N89-S93 PolarHBondContact OD1-OG 2.8Å; K90-S93 PolarHBondContact O-N 3.46Å; S93-R96 PolarHBondContact O-N 3.2Å; S93-G97 PolarHBondContact O-N 3.01Å
94A98.4Very high95.6Very high53 Ų53103.3 Ų103.344%0.43853%0.525SS..Hα-helixtrans-64.3-45.7175.100000111.8K90 A91 F92 R96 G97 I98K90-A94 WeakPolarHBondContact O-CB 3.3Å; K90-A94 PolarHBondContact O-N 2.89Å; A91-A94 PolarHBondContact O-N 3.01Å; F92-A94 PolarHBondContact O-N 2.92Å; A94-R96 VanDerWaalsContact C-N 3.34Å; A94-R96 PolarHBondContact O-N 2.97Å; A94-G97 PolarHBondContact O-N 3.46Å; A94-I98 WeakPolarHBondContact O-CG1 3.25Å; A94-I98 PolarHBondContact O-N 2.69Å
95Y98.4Very high96.6Very high143 Ų143106 Ų10656%0.56153%0.53SS*.Hα-helixtrans-58.1-46.2176.2174.7-97.8000111.7A91 F92 G97 I98 Y99A91-Y95 WeakPolarHBondContact O-CB 3.02Å; A91-Y95 PolarHBondContact O-N 3.1Å; F92-Y95 PolarHBondContact O-N 3.29Å; Y95-G97 VanDerWaalsContact C-N 3.32Å; Y95-G97 PolarHBondContact O-N 3.39Å; Y95-I98 PolarHBondContact O-N 3.49Å; Y95-Y99 WeakPolarHBondContact O-CB 3.31Å; Y95-Y99 PolarHBondContact O-N 3.38Å
96R98.5Very high97.1Very high163 Ų163106.2 Ų106.262%0.61552%0.524SS*.Hα-helixtrans-61.1-41.7176.5-172.6177.2-177.4-103.3-0.8111.7F92 S93 A94 Y99 I100F92-R96 WeakPolarHBondContact O-CB 3.12Å; F92-R96 PolarHBondContact O-N 3.28Å; S93-R96 PolarHBondContact O-N 3.2Å; A94-R96 VanDerWaalsContact C-N 3.34Å; A94-R96 PolarHBondContact O-N 2.97Å; R96-Y99 PolarHBondContact O-N 2.94Å; R96-I100 HydrophobicContact CG-CD1 4.31Å; R96-I100 WeakPolarHBondContact O-CG1 3.49Å; R96-I100 PolarHBondContact O-N 3.38Å
97G98.6Very high97.6Very high37 Ų37105 Ų10538%0.38152%0.52SS..Hα-helixtrans-60.4-50.5175.800000112.5S93 A94 Y95 Y99 I100 E101S93-G97 PolarHBondContact O-N 3.01Å; A94-G97 PolarHBondContact O-N 3.46Å; Y95-G97 VanDerWaalsContact C-N 3.32Å; Y95-G97 PolarHBondContact O-N 3.39Å; G97-Y99 VanDerWaalsContact C-N 3.26Å; G97-Y99 PolarHBondContact O-N 3.28Å; G97-I100 PolarHBondContact O-N 2.86Å; G97-E101 PolarHBondContact O-N 3.22Å
98I98.5Very high98Very high110 Ų110103.8 Ų103.856%0.56452%0.519SS*.Hα-helixtrans-59.5-38.2177.9-67.9164.6000111.2A94 Y95 E101 K102A94-I98 WeakPolarHBondContact O-CG1 3.25Å; A94-I98 PolarHBondContact O-N 2.69Å; Y95-I98 PolarHBondContact O-N 3.49Å; I98-E101 PolarHBondContact O-N 3.37Å; I98-K102 WeakPolarHBondContact O-CB 3.31Å; I98-K102 PolarHBondContact O-N 2.9Å
99Y98.5Very high98.2Very high129 Ų129102.7 Ų102.751%0.50651%0.51SS..Hα-helixtrans-66.1-40.6-179.8-164-86.1000112.4Y95 R96 G97 K102 E103Y95-Y99 WeakPolarHBondContact O-CB 3.31Å; Y95-Y99 PolarHBondContact O-N 3.38Å; R96-Y99 PolarHBondContact O-N 2.94Å; G97-Y99 VanDerWaalsContact C-N 3.26Å; G97-Y99 PolarHBondContact O-N 3.28Å; Y99-K102 PolarHBondContact O-N 2.88Å; Y99-E103 PolarHBondContact O-N 3.35Å
100I98.5Very high98.4Very high72 Ų72101.9 Ų101.937%0.36951%0.505SS..Hα-helixtrans-65.7-48.6175.3-65164.9000109.8R96 G97 K102 E103 D104R96-I100 HydrophobicContact CG-CD1 4.31Å; R96-I100 WeakPolarHBondContact O-CG1 3.49Å; R96-I100 PolarHBondContact O-N 3.38Å; G97-I100 PolarHBondContact O-N 2.86Å; I100-K102 VanDerWaalsContact C-N 3.26Å; I100-K102 PolarHBondContact O-N 3.23Å; I100-E103 WeakPolarHBondContact O-CA 3.43Å; I100-E103 WeakPolarHBondContact O-CB 3.33Å; I100-E103 PolarHBondContact O-N 3.47Å; I100-D104 PolarHBondContact O-N 2.87Å
101E98.4Very high98.5Very high113 Ų113100.5 Ų100.553%0.52850%0.499SS..Hα-helixtrans-58.6-39.1178.3-177178.6-169.400112G97 I98 E103 D104 L105G97-E101 PolarHBondContact O-N 3.22Å; I98-E101 PolarHBondContact O-N 3.37Å; E101-E103 VanDerWaalsContact C-N 3.33Å; E101-E103 PolarHBondContact O-N 3.44Å; E101-D104 PolarHBondContact O-N 2.93Å; E101-L105 HydrophobicContact CG-CD1 4.02Å; E101-L105 HydrophobicContact CG-CG 4.33Å; E101-L105 WeakPolarHBondContact O-CB 3.39Å; E101-L105 VanDerWaalsContact O-CG 3.27Å; E101-L105 WeakPolarHBondContact O-CG 3.43Å; E101-L105 PolarHBondContact O-N 2.92Å
102K98.4Very high98.5Very high136 Ų136102.1 Ų102.159%0.59150%0.499SS*.Hα-helixtrans-59.8-43.3174179.6-170.4171.9-171.30111.7I98 Y99 I100 Q106I98-K102 WeakPolarHBondContact O-CB 3.31Å; I98-K102 PolarHBondContact O-N 2.9Å; Y99-K102 PolarHBondContact O-N 2.88Å; I100-K102 VanDerWaalsContact C-N 3.26Å; I100-K102 PolarHBondContact O-N 3.23Å; K102-Q106 VanDerWaalsContact O-CB 3.23Å; K102-Q106 WeakPolarHBondContact O-CB 3.46Å; K102-Q106 PolarHBondContact O-N 3.19Å
103E98.4Very high98.6Very high115 Ų115101.5 Ų101.554%0.53750%0.496SS..Hα-helixtrans-65-44.2177.6-174169.4-137.800111Y99 I100 E101 Q106 M107Y99-E103 PolarHBondContact O-N 3.35Å; I100-E103 WeakPolarHBondContact O-CA 3.43Å; I100-E103 WeakPolarHBondContact O-CB 3.33Å; I100-E103 PolarHBondContact O-N 3.47Å; E101-E103 VanDerWaalsContact C-N 3.33Å; E101-E103 PolarHBondContact O-N 3.44Å; E103-Q106 WeakPolarHBondContact O-CB 3.22Å; E103-Q106 PolarHBondContact O-N 3.41Å; E103-M107 HydrophobicContact CG-CE 4.5Å; E103-M107 WeakPolarHBondContact O-CG 3.45Å; E103-M107 PolarHBondContact O-N 3.4Å
104D98.7Very high98.6Very high83 Ų83104.4 Ų104.444%0.44450%0.5SS..Hα-helixtrans-60.1-49.1176.3-69.7-25000112.1I100 E101 Q106 M107 E108I100-D104 PolarHBondContact O-N 2.87Å; E101-D104 PolarHBondContact O-N 2.93Å; D104-Q106 VanDerWaalsContact C-N 3.28Å; D104-Q106 PolarHBondContact O-N 3.11Å; D104-M107 HydrophobicContact CB-CE 4.47Å; D104-M107 WeakPolarHBondContact O-CB 3.41Å; D104-M107 PolarHBondContact O-N 2.85Å; D104-M107 VanDerWaalsContact O-N 3.16Å; D104-M107 WeakPolarHBondContact OD1-CE 3.38Å; D104-E108 PolarHBondContact O-N 3.18Å
105L98.8Very high98.6Very high93 Ų93106 Ų10649%0.48750%0.498SS..Hα-helixtrans-62.9-35.6176.3-71.3174.7000112E101 M107 E108 L109E101-L105 HydrophobicContact CG-CD1 4.02Å; E101-L105 HydrophobicContact CG-CG 4.33Å; E101-L105 WeakPolarHBondContact O-CB 3.39Å; E101-L105 VanDerWaalsContact O-CG 3.27Å; E101-L105 WeakPolarHBondContact O-CG 3.43Å; E101-L105 PolarHBondContact O-N 2.92Å; L105-M107 VanDerWaalsContact C-N 3.35Å; L105-E108 PolarHBondContact O-N 2.68Å; L105-L109 VanDerWaalsContact O-CB 3.29Å; L105-L109 WeakPolarHBondContact O-CB 3.42Å; L105-L109 PolarHBondContact O-N 2.99Å
106Q98.7Very high98.6Very high88 Ų88106.1 Ų106.141%0.41150%0.502SS..Hα-helixtrans-66.5-38.7175.9-174.660.874.400111.5K102 E103 D104 N110K102-Q106 VanDerWaalsContact O-CB 3.23Å; K102-Q106 WeakPolarHBondContact O-CB 3.46Å; K102-Q106 PolarHBondContact O-N 3.19Å; E103-Q106 WeakPolarHBondContact O-CB 3.22Å; E103-Q106 PolarHBondContact O-N 3.41Å; D104-Q106 VanDerWaalsContact C-N 3.28Å; D104-Q106 PolarHBondContact O-N 3.11Å; Q106-N110 PolarHBondContact NE2-OD1 3.31Å; Q106-N110 WeakPolarHBondContact O-CB 3.25Å; Q106-N110 PolarHBondContact O-N 2.87Å; Q106-N110 VanDerWaalsContact O-N 3.1Å; Q106-N110 PolarHBondContact O-ND2 2.99Å
107M98.7Very high98.6Very high108 Ų108101.5 Ų101.553%0.53249%0.494SS..Hα-helixtrans-65-45.5172.9-69.9-172.1-69.700111.5E103 D104 L105 N110 K111E103-M107 HydrophobicContact CG-CE 4.5Å; E103-M107 WeakPolarHBondContact O-CG 3.45Å; E103-M107 PolarHBondContact O-N 3.4Å; D104-M107 HydrophobicContact CB-CE 4.47Å; D104-M107 WeakPolarHBondContact O-CB 3.41Å; D104-M107 PolarHBondContact O-N 2.85Å; D104-M107 VanDerWaalsContact O-N 3.16Å; D104-M107 WeakPolarHBondContact OD1-CE 3.38Å; L105-M107 VanDerWaalsContact C-N 3.35Å; M107-N110 PolarHBondContact O-N 3.02Å; M107-K111 WeakPolarHBondContact O-CB 3.37Å; M107-K111 PolarHBondContact O-N 3.27Å
108E98.8Very high98.7Very high114 Ų114103.6 Ų103.653%0.53349%0.494SS..Hα-helixtrans-63.5-41.3178.2-170.5166.8-158.500112D104 L105 N110 K111 L112D104-E108 PolarHBondContact O-N 3.18Å; L105-E108 PolarHBondContact O-N 2.68Å; E108-N110 VanDerWaalsContact C-N 3.35Å; E108-N110 PolarHBondContact O-N 3.04Å; E108-K111 WeakPolarHBondContact O-CB 3.49Å; E108-K111 PolarHBondContact O-N 2.91Å; E108-L112 HydrophobicContact CG-CD1 4.39Å; E108-L112 WeakPolarHBondContact O-CB 3.45Å; E108-L112 WeakPolarHBondContact O-CG 3.3Å; E108-L112 PolarHBondContact O-N 3.5Å
109L98.8Very high98.7Very high80 Ų80101.7 Ų101.742%0.41949%0.49SS..Hα-helixtrans-60-44.2173.7177.561.7000111.9L105 K111 L112 K113L105-L109 VanDerWaalsContact O-CB 3.29Å; L105-L109 WeakPolarHBondContact O-CB 3.42Å; L105-L109 PolarHBondContact O-N 2.99Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-L112 PolarHBondContact O-N 3.27Å; L109-K113 HydrophobicContact CG-CD 4.47Å; L109-K113 WeakPolarHBondContact O-CG 3.34Å; L109-K113 PolarHBondContact O-N 3.42Å
110N98.8Very high98.7Very high82 Ų82101.3 Ų101.344%0.43949%0.494SS..Hα-helixtrans-66.3-39.2178.6-71.9-20.8000111.5Q106 M107 E108 K113 K114Q106-N110 PolarHBondContact NE2-OD1 3.31Å; Q106-N110 WeakPolarHBondContact O-CB 3.25Å; Q106-N110 PolarHBondContact O-N 2.87Å; Q106-N110 VanDerWaalsContact O-N 3.1Å; Q106-N110 PolarHBondContact O-ND2 2.99Å; M107-N110 PolarHBondContact O-N 3.02Å; E108-N110 VanDerWaalsContact C-N 3.35Å; E108-N110 PolarHBondContact O-N 3.04Å; N110-K113 PolarHBondContact O-N 3.48Å; N110-K114 PolarHBondContact O-N 3.29Å; N110-K114 VanDerWaalsContact O-N 3.09Å
111K98.8Very high98.7Very high126 Ų126103.6 Ų103.655%0.54850%0.497SS..Hα-helixtrans-60.8-50.4173.6-180-178.1169.6-172.20111.3M107 E108 L109 K113 K114 E115M107-K111 WeakPolarHBondContact O-CB 3.37Å; M107-K111 PolarHBondContact O-N 3.27Å; E108-K111 WeakPolarHBondContact O-CB 3.49Å; E108-K111 PolarHBondContact O-N 2.91Å; L109-K111 VanDerWaalsContact C-N 3.34Å; K111-K113 VanDerWaalsContact C-N 3.33Å; K111-K113 PolarHBondContact O-N 3.37Å; K111-K114 WeakPolarHBondContact O-CB 3.47Å; K111-K114 PolarHBondContact O-N 3.32Å; K111-K114 VanDerWaalsContact O-N 3.1Å; K111-E115 WeakPolarHBondContact CE-OE1 3.27Å; K111-E115 IonicContact NZ-OE1 3.88Å; K111-E115 PolarHBondContact O-N 3.06Å
112L98.8Very high98.7Very high97 Ų97102.5 Ų102.551%0.50850%0.495SS..Hα-helixtrans-61.8-39178.5-76172.7000112.5E108 L109 K114 E115 K116E108-L112 HydrophobicContact CG-CD1 4.39Å; E108-L112 WeakPolarHBondContact O-CB 3.45Å; E108-L112 WeakPolarHBondContact O-CG 3.3Å; E108-L112 PolarHBondContact O-N 3.5Å; L109-L112 PolarHBondContact O-N 3.27Å; L112-K114 VanDerWaalsContact C-N 3.31Å; L112-K114 PolarHBondContact O-N 3.13Å; L112-E115 PolarHBondContact O-N 3.44Å; L112-K116 VanDerWaalsContact O-CB 3.23Å; L112-K116 WeakPolarHBondContact O-CB 3.37Å; L112-K116 PolarHBondContact O-N 2.95Å
113K98.8Very high98.7Very high123 Ų123101.5 Ų101.554%0.53550%0.495SS..Hα-helixtrans-59.4-43.4173.6-78.1176.2177.7179.60111.7L109 N110 K111 S117L109-K113 HydrophobicContact CG-CD 4.47Å; L109-K113 WeakPolarHBondContact O-CG 3.34Å; L109-K113 PolarHBondContact O-N 3.42Å; N110-K113 PolarHBondContact O-N 3.48Å; K111-K113 VanDerWaalsContact C-N 3.33Å; K111-K113 PolarHBondContact O-N 3.37Å; K113-S117 PolarHBondContact O-N 2.7Å; K113-S117 PolarHBondContact O-OG 2.84Å
114K98.8Very high98.7Very high128 Ų12899.1 Ų99.156%0.55749%0.488SS*.Hα-helixtrans-64.5-52.4177.4-178.1177.1171.8-179.80111.3N110 K111 L112 K116 S117 E118N110-K114 PolarHBondContact O-N 3.29Å; N110-K114 VanDerWaalsContact O-N 3.09Å; K111-K114 WeakPolarHBondContact O-CB 3.47Å; K111-K114 PolarHBondContact O-N 3.32Å; K111-K114 VanDerWaalsContact O-N 3.1Å; L112-K114 VanDerWaalsContact C-N 3.31Å; L112-K114 PolarHBondContact O-N 3.13Å; K114-K116 VanDerWaalsContact C-N 3.28Å; K114-K116 PolarHBondContact O-N 3.07Å; K114-S117 PolarHBondContact O-N 3.09Å; K114-S117 VanDerWaalsContact O-N 3.09Å; K114-S117 PolarHBondContact O-OG 3.41Å; K114-E118 WeakPolarHBondContact CE-OE1 3.4Å; K114-E118 HydrophobicContact CG-CG 4.43Å; K114-E118 IonicContact NZ-OE1 3.85Å; K114-E118 WeakPolarHBondContact O-CG 3.35Å; K114-E118 PolarHBondContact O-N 2.85Å
115E98.8Very high98.7Very high86 Ų8699.2 Ų99.240%0.40249%0.486SS..Hα-helixtrans-58.9-38.6178.3-71175.3174.900112.2K111 L112 E118 S119K111-E115 WeakPolarHBondContact CE-OE1 3.27Å; K111-E115 IonicContact NZ-OE1 3.88Å; K111-E115 PolarHBondContact O-N 3.06Å; L112-E115 PolarHBondContact O-N 3.44Å; E115-E118 PolarHBondContact O-N 3.11Å; E115-S119 WeakPolarHBondContact O-CB 3.38Å; E115-S119 PolarHBondContact O-N 2.88Å; E115-S119 PolarHBondContact O-OG 3.36Å
116K98.6Very high98.7Very high146 Ų146101.1 Ų101.164%0.63549%0.493SS*.Hα-helixtrans-60.6-50172.8-175.1-173.7176.4-171.40111.5L112 K114 E118 S119 E120L112-K116 VanDerWaalsContact O-CB 3.23Å; L112-K116 WeakPolarHBondContact O-CB 3.37Å; L112-K116 PolarHBondContact O-N 2.95Å; K114-K116 VanDerWaalsContact C-N 3.28Å; K114-K116 PolarHBondContact O-N 3.07Å; K116-E118 VanDerWaalsContact C-N 3.31Å; K116-E118 PolarHBondContact O-N 3.42Å; K116-S119 WeakPolarHBondContact CA-OG 3.31Å; K116-S119 PolarHBondContact O-N 3.37Å; K116-S119 PolarHBondContact O-OG 2.94Å; K116-E120 WeakPolarHBondContact O-CB 3.32Å; K116-E120 PolarHBondContact O-N 3.3Å
117S98.7Very high98.7Very high65 Ų65101.7 Ų101.746%0.45550%0.498SS..Hα-helixtrans-64.7-34.917966.10000112.9K113 K114 R121K113-S117 PolarHBondContact O-N 2.7Å; K113-S117 PolarHBondContact O-OG 2.84Å; K114-S117 PolarHBondContact O-N 3.09Å; K114-S117 VanDerWaalsContact O-N 3.09Å; K114-S117 PolarHBondContact O-OG 3.41Å; S117-R121 WeakPolarHBondContact O-CB 3.45Å; S117-R121 PolarHBondContact O-N 3.34Å
118E98.8Very high98.7Very high82 Ų82101.6 Ų101.638%0.38350%0.496SS..Hα-helixtrans-71.2-42.1177.5-74176.5174.100111.9K114 E115 K116 R121 L122K114-E118 WeakPolarHBondContact CE-OE1 3.4Å; K114-E118 HydrophobicContact CG-CG 4.43Å; K114-E118 IonicContact NZ-OE1 3.85Å; K114-E118 WeakPolarHBondContact O-CG 3.35Å; K114-E118 PolarHBondContact O-N 2.85Å; E115-E118 PolarHBondContact O-N 3.11Å; K116-E118 VanDerWaalsContact C-N 3.31Å; K116-E118 PolarHBondContact O-N 3.42Å; E118-R121 PolarHBondContact O-N 2.91Å; E118-L122 WeakPolarHBondContact O-CG 3.46Å; E118-L122 PolarHBondContact O-N 3.45Å
119S98.6Very high98.7Very high69 Ų6998.9 Ų98.948%0.48349%0.493SS..Hα-helixtrans-65.8-39.4175.454.70000112.2E115 K116 L122 L123E115-S119 WeakPolarHBondContact O-CB 3.38Å; E115-S119 PolarHBondContact O-N 2.88Å; E115-S119 PolarHBondContact O-OG 3.36Å; K116-S119 WeakPolarHBondContact CA-OG 3.31Å; K116-S119 PolarHBondContact O-N 3.37Å; K116-S119 PolarHBondContact O-OG 2.94Å; S119-L122 PolarHBondContact O-N 2.86Å; S119-L123 WeakPolarHBondContact O-CB 3.36Å; S119-L123 PolarHBondContact O-N 2.76Å
120E98.7Very high98.7Very high122 Ų122100.8 Ų100.857%0.5750%0.498SS*.Hα-helixtrans-62.6-44.4173.2-177.4173.2-169.800111.9K116 L123 T124K116-E120 WeakPolarHBondContact O-CB 3.32Å; K116-E120 PolarHBondContact O-N 3.3Å; E120-L123 PolarHBondContact O-N 3.48Å; E120-T124 PolarHBondContact O-N 3.05Å; E120-T124 PolarHBondContact O-OG1 3.32Å
121R98.8Very high98.7Very high119 Ų119102.1 Ų102.145%0.44950%0.502SS..Hα-helixtrans-58.6-48.3174.1-175.5-169.362.376.89.8111.4S117 E118 L123 T124 E125S117-R121 WeakPolarHBondContact O-CB 3.45Å; S117-R121 PolarHBondContact O-N 3.34Å; E118-R121 PolarHBondContact O-N 2.91Å; R121-L123 PolarHBondContact O-N 2.84Å; R121-T124 WeakPolarHBondContact O-CB 3.34Å; R121-T124 PolarHBondContact O-N 3.36Å; R121-E125 IonicContact CZ-OE1 3.69Å; R121-E125 IonicContact CZ-OE2 3.79Å; R121-E125 IonicContact NH1-OE1 2.59Å; R121-E125 PolarHBondContact NH1-OE1 3.27Å; R121-E125 IonicContact NH1-OE2 2.81Å; R121-E125 PolarHBondContact NH1-OE2 3.12Å; R121-E125 WeakPolarHBondContact O-CG 3.49Å; R121-E125 PolarHBondContact O-N 3.33Å
122L98.8Very high98.7Very high90 Ų90101.5 Ų101.547%0.47150%0.504SS..Hα-helixtrans-63.1-39.8179.6-74.1172000112.7E118 S119 T124 E125 Q126E118-L122 WeakPolarHBondContact O-CG 3.46Å; E118-L122 PolarHBondContact O-N 3.45Å; S119-L122 PolarHBondContact O-N 2.86Å; L122-T124 VanDerWaalsContact C-N 3.32Å; L122-E125 PolarHBondContact O-N 3.46Å; L122-Q126 PolarHBondContact O-N 2.96Å
123L98.8Very high98.7Very high116 Ų116101 Ų10161%0.60750%0.499SS*.Hα-helixtrans-64.4-40.6176.5-175.864.1000111.2S119 E120 R121 Q126 L127S119-L123 WeakPolarHBondContact O-CB 3.36Å; S119-L123 PolarHBondContact O-N 2.76Å; E120-L123 PolarHBondContact O-N 3.48Å; R121-L123 PolarHBondContact O-N 2.84Å; L123-Q126 PolarHBondContact O-N 2.98Å; L123-L127 WeakPolarHBondContact O-CB 3.48Å; L123-L127 PolarHBondContact O-N 2.82Å
124T98.7Very high98.7Very high64 Ų6499.6 Ų99.639%0.39350%0.497SS..Hα-helixtrans-63.4-42.4175.8-52.90000111.2E120 R121 L122 L127 Q128E120-T124 PolarHBondContact O-N 3.05Å; E120-T124 PolarHBondContact O-OG1 3.32Å; R121-T124 WeakPolarHBondContact O-CB 3.34Å; R121-T124 PolarHBondContact O-N 3.36Å; L122-T124 VanDerWaalsContact C-N 3.32Å; T124-L127 PolarHBondContact O-N 3.35Å; T124-Q128 WeakPolarHBondContact O-CG 3.42Å; T124-Q128 PolarHBondContact O-N 3.12Å
125E98.8Very high98.7Very high86 Ų8698.5 Ų98.540%0.40250%0.496SS..Hα-helixtrans-63.5-41.7175.5-74.7170.8-178.200112.3R121 L122 L127 Q128 A129R121-E125 IonicContact CZ-OE1 3.69Å; R121-E125 IonicContact CZ-OE2 3.79Å; R121-E125 IonicContact NH1-OE1 2.59Å; R121-E125 PolarHBondContact NH1-OE1 3.27Å; R121-E125 IonicContact NH1-OE2 2.81Å; R121-E125 PolarHBondContact NH1-OE2 3.12Å; R121-E125 WeakPolarHBondContact O-CG 3.49Å; R121-E125 PolarHBondContact O-N 3.33Å; L122-E125 PolarHBondContact O-N 3.46Å; E125-L127 VanDerWaalsContact C-N 3.35Å; E125-Q128 PolarHBondContact O-N 3.33Å; E125-A129 WeakPolarHBondContact O-CB 3.47Å; E125-A129 PolarHBondContact O-N 2.73Å
126Q98.8Very high98.7Very high133 Ų133100 Ų10062%0.62150%0.503SS*.Hα-helixtrans-62.8-41.8174-79.9-172.43.700112.2L122 L123 A129 K130L122-Q126 PolarHBondContact O-N 2.96Å; L123-Q126 PolarHBondContact O-N 2.98Å; Q126-A129 PolarHBondContact O-N 2.72Å; Q126-K130 WeakPolarHBondContact O-CB 3.49Å; Q126-K130 VanDerWaalsContact O-CG 3.3Å; Q126-K130 WeakPolarHBondContact O-CG 3.43Å; Q126-K130 PolarHBondContact O-N 2.93Å
127L98.7Very high98.7Very high99 Ų9997.7 Ų97.752%0.51850%0.497SS..Hα-helixtrans-60.5-51.2176.9178.663.6000110.7L123 T124 E125 A129 K130 E131L123-L127 WeakPolarHBondContact O-CB 3.48Å; L123-L127 PolarHBondContact O-N 2.82Å; T124-L127 PolarHBondContact O-N 3.35Å; E125-L127 VanDerWaalsContact C-N 3.35Å; L127-A129 VanDerWaalsContact C-N 3.32Å; L127-A129 PolarHBondContact O-N 2.95Å; L127-K130 PolarHBondContact O-N 3.25Å; L127-K130 VanDerWaalsContact O-N 3.1Å; L127-E131 HydrophobicContact CD1-CG 4.49Å; L127-E131 WeakPolarHBondContact O-CG 3.45Å; L127-E131 PolarHBondContact O-N 2.99Å
128Q98.8Very high98.7Very high106 Ų106102.4 Ų102.450%0.49551%0.505SS..Hα-helixtrans-59.6-41.4177.7-71.7176.4-4.100112.1T124 E125 K130 E131 L132T124-Q128 WeakPolarHBondContact O-CG 3.42Å; T124-Q128 PolarHBondContact O-N 3.12Å; E125-Q128 PolarHBondContact O-N 3.33Å; Q128-K130 VanDerWaalsContact C-N 3.32Å; Q128-K130 PolarHBondContact O-N 2.89Å; Q128-E131 PolarHBondContact O-N 3.37Å; Q128-L132 WeakPolarHBondContact O-CG 3.33Å; Q128-L132 PolarHBondContact O-N 2.87Å
129A98.8Very high98.7Very high57 Ų57101.9 Ų101.947%0.47151%0.507SS..Hα-helixtrans-61.7-40.4175.800000112E125 Q126 L127 L132 E133E125-A129 WeakPolarHBondContact O-CB 3.47Å; E125-A129 PolarHBondContact O-N 2.73Å; Q126-A129 PolarHBondContact O-N 2.72Å; L127-A129 VanDerWaalsContact C-N 3.32Å; L127-A129 PolarHBondContact O-N 2.95Å; A129-L132 PolarHBondContact O-N 3.36Å; A129-E133 WeakPolarHBondContact O-CB 3.3Å; A129-E133 PolarHBondContact O-N 3.5Å
130K98.7Very high98.7Very high120 Ų120102.9 Ų102.952%0.52251%0.505SS..Hα-helixtrans-70.2-37.5176.9-71.8-73.2162.4-160.50112.7Q126 L127 Q128 L132 E133 I134Q126-K130 WeakPolarHBondContact O-CB 3.49Å; Q126-K130 VanDerWaalsContact O-CG 3.3Å; Q126-K130 WeakPolarHBondContact O-CG 3.43Å; Q126-K130 PolarHBondContact O-N 2.93Å; L127-K130 PolarHBondContact O-N 3.25Å; L127-K130 VanDerWaalsContact O-N 3.1Å; Q128-K130 VanDerWaalsContact C-N 3.32Å; Q128-K130 PolarHBondContact O-N 2.89Å; K130-L132 VanDerWaalsContact C-N 3.34Å; K130-E133 WeakPolarHBondContact CD-OE2 3.36Å; K130-E133 IonicContact NZ-OE1 3.93Å; K130-E133 IonicContact NZ-OE2 2.69Å; K130-E133 PolarHBondContact NZ-OE2 3.4Å; K130-E133 PolarHBondContact O-N 2.97Å; K130-I134 VanDerWaalsContact O-CG1 3.31Å; K130-I134 WeakPolarHBondContact O-CG1 3.38Å; K130-I134 PolarHBondContact O-N 3.46Å
131E98.6Very high98.6Very high110 Ų110103 Ų10351%0.51451%0.507SS..Hα-helixtrans-61.2-43.6173.2-72.1172.2162.900111.4L127 Q128 I134 L135L127-E131 HydrophobicContact CD1-CG 4.49Å; L127-E131 WeakPolarHBondContact O-CG 3.45Å; L127-E131 PolarHBondContact O-N 2.99Å; Q128-E131 PolarHBondContact O-N 3.37Å; E131-I134 PolarHBondContact O-N 3.45Å; E131-L135 WeakPolarHBondContact O-CB 3.37Å; E131-L135 PolarHBondContact O-N 2.98Å
132L98.8Very high98.6Very high114 Ų114103.2 Ų103.260%0.59751%0.513SS*.Hα-helixtrans-65.5-42.4175.6-71.9174.6000112.5Q128 A129 K130 I134 L135 Q136Q128-L132 WeakPolarHBondContact O-CG 3.33Å; Q128-L132 PolarHBondContact O-N 2.87Å; A129-L132 PolarHBondContact O-N 3.36Å; K130-L132 VanDerWaalsContact C-N 3.34Å; L132-I134 VanDerWaalsContact C-N 3.35Å; L132-I134 PolarHBondContact O-N 3.25Å; L132-L135 PolarHBondContact O-N 2.91Å; L132-Q136 WeakPolarHBondContact O-CB 3.44Å; L132-Q136 PolarHBondContact O-N 3Å
133E98.6Very high98.5Very high86 Ų86102.2 Ų102.240%0.40251%0.511SS..Hα-helixtrans-59.9-44.6175.9-176.4-178.9-174.600111.4A129 K130 L135 Q136 L137A129-E133 WeakPolarHBondContact O-CB 3.3Å; A129-E133 PolarHBondContact O-N 3.5Å; K130-E133 WeakPolarHBondContact CD-OE2 3.36Å; K130-E133 IonicContact NZ-OE1 3.93Å; K130-E133 IonicContact NZ-OE2 2.69Å; K130-E133 PolarHBondContact NZ-OE2 3.4Å; K130-E133 PolarHBondContact O-N 2.97Å; E133-L135 PolarHBondContact O-N 3.43Å; E133-Q136 PolarHBondContact O-N 3.5Å; E133-L137 HydrophobicContact CG-CD1 4.28Å; E133-L137 WeakPolarHBondContact O-CB 3.33Å; E133-L137 VanDerWaalsContact O-CG 3.32Å; E133-L137 WeakPolarHBondContact O-CG 3.23Å; E133-L137 PolarHBondContact O-N 2.95Å
134I98.8Very high98.4Very high94 Ų9499.3 Ų99.348%0.48250%0.498SS..Hα-helixtrans-63.7-42.5176.4-69.7167000111K130 E131 L132 Q136 L137 R138K130-I134 VanDerWaalsContact O-CG1 3.31Å; K130-I134 WeakPolarHBondContact O-CG1 3.38Å; K130-I134 PolarHBondContact O-N 3.46Å; E131-I134 PolarHBondContact O-N 3.45Å; L132-I134 VanDerWaalsContact C-N 3.35Å; L132-I134 PolarHBondContact O-N 3.25Å; I134-Q136 VanDerWaalsContact C-N 3.35Å; I134-L137 PolarHBondContact O-N 2.91Å; I134-R138 WeakPolarHBondContact O-CB 3.46Å; I134-R138 WeakPolarHBondContact O-CG 3.46Å; I134-R138 PolarHBondContact O-N 3.47Å
135L98.8Very high98.3Very high105 Ų105102.6 Ų102.655%0.5551%0.508SS..Hα-helixtrans-61.2-46.2177.5-173.766.5000110.7E131 L132 E133 R138 T139E131-L135 WeakPolarHBondContact O-CB 3.37Å; E131-L135 PolarHBondContact O-N 2.98Å; L132-L135 PolarHBondContact O-N 2.91Å; E133-L135 PolarHBondContact O-N 3.43Å; L135-R138 WeakPolarHBondContact O-CB 3.48Å; L135-R138 PolarHBondContact O-N 3.31Å; L135-T139 PolarHBondContact O-N 2.82Å; L135-T139 PolarHBondContact O-OG1 2.88Å; L135-T139 VanDerWaalsContact O-OG1 3.12Å
136Q98.8Very high98.1Very high117 Ų117101.9 Ų101.955%0.54751%0.51SS..Hα-helixtrans-59.4-50.3176.2-179.8177.7-11.200111.6L132 E133 I134 R138 T139 E140L132-Q136 WeakPolarHBondContact O-CB 3.44Å; L132-Q136 PolarHBondContact O-N 3Å; E133-Q136 PolarHBondContact O-N 3.5Å; I134-Q136 VanDerWaalsContact C-N 3.35Å; Q136-R138 VanDerWaalsContact C-N 3.27Å; Q136-R138 PolarHBondContact O-N 3.45Å; Q136-T139 PolarHBondContact O-N 3.29Å; Q136-T139 VanDerWaalsContact O-N 3.12Å; Q136-E140 HydrophobicContact CG-CG 4.36Å; Q136-E140 WeakPolarHBondContact CG-OE1 2.83Å; Q136-E140 PolarHBondContact NE2-OE1 3.44Å; Q136-E140 WeakPolarHBondContact O-CG 3.42Å; Q136-E140 PolarHBondContact O-N 3.38Å
137L98.7Very high97.8Very high97 Ų97100.3 Ų100.351%0.50850%0.504SS..Hα-helixtrans-59.9-36.8178.4-72.1173.1000112.2E133 I134 M141E133-L137 HydrophobicContact CG-CD1 4.28Å; E133-L137 WeakPolarHBondContact O-CB 3.33Å; E133-L137 VanDerWaalsContact O-CG 3.32Å; E133-L137 WeakPolarHBondContact O-CG 3.23Å; E133-L137 PolarHBondContact O-N 2.95Å; I134-L137 PolarHBondContact O-N 2.91Å; L137-M141 VanDerWaalsContact O-CB 3.27Å; L137-M141 WeakPolarHBondContact O-CB 3.29Å; L137-M141 PolarHBondContact O-N 3.35Å
138R98.4Very high97.4Very high164 Ų164102.7 Ų102.762%0.61951%0.51SS*.Hα-helixtrans-64.7-46.4173.9-77.6179.2176-136.82111.7I134 L135 Q136 M141 E142I134-R138 WeakPolarHBondContact O-CB 3.46Å; I134-R138 WeakPolarHBondContact O-CG 3.46Å; I134-R138 PolarHBondContact O-N 3.47Å; L135-R138 WeakPolarHBondContact O-CB 3.48Å; L135-R138 PolarHBondContact O-N 3.31Å; Q136-R138 VanDerWaalsContact C-N 3.27Å; Q136-R138 PolarHBondContact O-N 3.45Å; R138-M141 PolarHBondContact O-N 2.95Å; R138-E142 WeakPolarHBondContact O-CB 3.5Å; R138-E142 PolarHBondContact O-N 3.34Å
139T98.4Very high97Very high71 Ų71101.2 Ų101.244%0.43651%0.512SS..Hα-helixtrans-63.5-41.3177-58.40000111.7L135 Q136 E142 T143L135-T139 PolarHBondContact O-N 2.82Å; L135-T139 PolarHBondContact O-OG1 2.88Å; L135-T139 VanDerWaalsContact O-OG1 3.12Å; Q136-T139 PolarHBondContact O-N 3.29Å; Q136-T139 VanDerWaalsContact O-N 3.12Å; T139-E142 PolarHBondContact O-N 2.81Å; T139-T143 VanDerWaalsContact O-CB 3.3Å; T139-T143 WeakPolarHBondContact O-CB 3.41Å; T139-T143 PolarHBondContact O-N 3.1Å; T139-T143 PolarHBondContact O-OG1 2.97Å
140E98.1Very high96.4Very high91 Ų91104.9 Ų104.943%0.42552%0.523SS..Hα-helixtrans-62.7-43.6175.1-74.5177.8-166.500111.5Q136 T144Q136-E140 HydrophobicContact CG-CG 4.36Å; Q136-E140 WeakPolarHBondContact CG-OE1 2.83Å; Q136-E140 PolarHBondContact NE2-OE1 3.44Å; Q136-E140 WeakPolarHBondContact O-CG 3.42Å; Q136-E140 PolarHBondContact O-N 3.38Å; E140-T144 VanDerWaalsContact O-CB 3.25Å; E140-T144 WeakPolarHBondContact O-CB 3.44Å; E140-T144 PolarHBondContact O-N 2.69Å; E140-T144 PolarHBondContact O-OG1 3.4Å
141M98.1Very high95.5Very high125 Ų125104.5 Ų104.562%0.61653%0.526SS*.Hα-helixtrans-61.8-47.6175.3-180-176.766.400111.7L137 R138 T144 Q145L137-M141 VanDerWaalsContact O-CB 3.27Å; L137-M141 WeakPolarHBondContact O-CB 3.29Å; L137-M141 PolarHBondContact O-N 3.35Å; R138-M141 PolarHBondContact O-N 2.95Å; M141-T144 PolarHBondContact O-N 3.25Å; M141-Q145 WeakPolarHBondContact O-CB 3.45Å; M141-Q145 PolarHBondContact O-N 2.98Å
142E97.5Very high93.7Very high123 Ų123101.3 Ų101.358%0.57552%0.516SS*.Hα-helixtrans-63.4-46.5178.6-177.8173.4-160.200111.5R138 T139 T144 Q145 V146R138-E142 WeakPolarHBondContact O-CB 3.5Å; R138-E142 PolarHBondContact O-N 3.34Å; T139-E142 PolarHBondContact O-N 2.81Å; E142-T144 VanDerWaalsContact C-N 3.32Å; E142-T144 PolarHBondContact O-N 3Å; E142-Q145 WeakPolarHBondContact O-CB 2.88Å; E142-Q145 PolarHBondContact O-N 2.94Å; E142-Q145 VanDerWaalsContact O-N 3.11Å; E142-V146 WeakPolarHBondContact O-CG2 3.44Å; E142-V146 PolarHBondContact O-N 3.35Å
143T97.3Very high91.8Very high69 Ų6999.3 Ų99.342%0.42351%0.51SS..Hα-helixtrans-60.8-43.5176.6-54.70000110.6T139 Q145 V146 M147T139-T143 VanDerWaalsContact O-CB 3.3Å; T139-T143 WeakPolarHBondContact O-CB 3.41Å; T139-T143 PolarHBondContact O-N 3.1Å; T139-T143 PolarHBondContact O-OG1 2.97Å; T143-Q145 VanDerWaalsContact C-N 3.32Å; T143-Q145 PolarHBondContact O-N 2.8Å; T143-V146 PolarHBondContact O-N 3.21Å; T143-M147 HydrophobicContact CG2-CE 4.13Å; T143-M147 WeakPolarHBondContact O-CB 3.49Å; T143-M147 WeakPolarHBondContact O-CG 3.46Å; T143-M147 PolarHBondContact O-N 2.59Å
144T96.3Very high89.8Confident55 Ų55101.1 Ų101.134%0.33752%0.518SS..Hα-helixtrans-62.8-39.7175.4-59.20000111.5E140 M141 E142 K148E140-T144 VanDerWaalsContact O-CB 3.25Å; E140-T144 WeakPolarHBondContact O-CB 3.44Å; E140-T144 PolarHBondContact O-N 2.69Å; E140-T144 PolarHBondContact O-OG1 3.4Å; M141-T144 PolarHBondContact O-N 3.25Å; E142-T144 VanDerWaalsContact C-N 3.32Å; E142-T144 PolarHBondContact O-N 3Å; T144-K148 HydrophobicContact CG2-CD 4.08Å; T144-K148 WeakPolarHBondContact O-CB 3.23Å; T144-K148 VanDerWaalsContact O-CG 3.22Å; T144-K148 WeakPolarHBondContact O-CG 3.34Å; T144-K148 PolarHBondContact O-N 2.99Å
145Q96.1Very high87.7Confident132 Ų132102.1 Ų102.162%0.61752%0.524SS*.Hα-helixtrans-65.3-44.6176.8-179177.9-6.900111.8M141 E142 T143 K148 S149M141-Q145 WeakPolarHBondContact O-CB 3.45Å; M141-Q145 PolarHBondContact O-N 2.98Å; E142-Q145 WeakPolarHBondContact O-CB 2.88Å; E142-Q145 PolarHBondContact O-N 2.94Å; E142-Q145 VanDerWaalsContact O-N 3.11Å; T143-Q145 VanDerWaalsContact C-N 3.32Å; T143-Q145 PolarHBondContact O-N 2.8Å; Q145-K148 PolarHBondContact O-N 2.95Å; Q145-S149 PolarHBondContact O-N 3.46Å
146V95.4Very high85.7Confident72 Ų72100.8 Ų100.844%0.43652%0.523SS..Hα-helixtrans-63.3-46175.5172.20000110.5E142 T143 K148 S149 L150E142-V146 WeakPolarHBondContact O-CG2 3.44Å; E142-V146 PolarHBondContact O-N 3.35Å; T143-V146 PolarHBondContact O-N 3.21Å; V146-K148 VanDerWaalsContact C-N 3.3Å; V146-K148 PolarHBondContact O-N 3.38Å; V146-S149 PolarHBondContact O-N 3.24Å; V146-S149 PolarHBondContact O-OG 3.39Å; V146-L150 HydrophobicContact CG1-CD1 4.01Å; V146-L150 HydrophobicContact CG1-CG 4.35Å; V146-L150 VanDerWaalsContact O-CG 3.3Å; V146-L150 WeakPolarHBondContact O-CG 3.27Å; V146-L150 PolarHBondContact O-N 2.81Å
147M92.6Very high83.8Confident99 Ų99102.6 Ų102.649%0.48853%0.525SS..Hα-helixtrans-59.9-41.4175.3-73.9-170.5-61.300111.5T143 L150 N151T143-M147 HydrophobicContact CG2-CE 4.13Å; T143-M147 WeakPolarHBondContact O-CB 3.49Å; T143-M147 WeakPolarHBondContact O-CG 3.46Å; T143-M147 PolarHBondContact O-N 2.59Å; M147-L150 PolarHBondContact O-N 2.97Å; M147-N151 WeakPolarHBondContact O-CB 3.37Å; M147-N151 PolarHBondContact O-N 2.9Å; M147-N151 PolarHBondContact O-ND2 3.38Å
148K90.8Very high82.3Confident149 Ų149102.3 Ų102.365%0.64852%0.521SS*.Hα-helixtrans-65.3-36.5176.2-76.6171.6179.5174.90112.9T144 Q145 V146 N151 S152T144-K148 HydrophobicContact CG2-CD 4.08Å; T144-K148 WeakPolarHBondContact O-CB 3.23Å; T144-K148 VanDerWaalsContact O-CG 3.22Å; T144-K148 WeakPolarHBondContact O-CG 3.34Å; T144-K148 PolarHBondContact O-N 2.99Å; Q145-K148 PolarHBondContact O-N 2.95Å; V146-K148 VanDerWaalsContact C-N 3.3Å; V146-K148 PolarHBondContact O-N 3.38Å; K148-N151 CarbonylContact O-C 3.59Å; K148-N151 PolarHBondContact O-N 3.42Å; K148-S152 PolarHBondContact O-N 2.95Å
149S89.2Confident81Confident76 Ų76101.8 Ų101.853%0.53153%0.527SS..Hα-helixtrans-73.8-33.1177.968.80000112.6Q145 V146 S152Q145-S149 PolarHBondContact O-N 3.46Å; V146-S149 PolarHBondContact O-N 3.24Å; V146-S149 PolarHBondContact O-OG 3.39Å; S149-S152 VanDerWaalsContact O-CB 3.24Å; S149-S152 WeakPolarHBondContact O-CB 3.48Å; S149-S152 PolarHBondContact O-N 2.94Å
150L85.6Confident79.9Confident134 Ų134103.2 Ų103.270%0.70253%0.529SS*.Hα-helixtrans-68.6-36.7171.7-66.2176.1000111.7V146 M147 S152V146-L150 HydrophobicContact CG1-CD1 4.01Å; V146-L150 HydrophobicContact CG1-CG 4.35Å; V146-L150 VanDerWaalsContact O-CG 3.3Å; V146-L150 WeakPolarHBondContact O-CG 3.27Å; V146-L150 PolarHBondContact O-N 2.81Å; M147-L150 PolarHBondContact O-N 2.97Å; L150-S152 PolarHBondContact O-N 2.99Å
151N79.8Confident79Confident112 Ų112105.4 Ų105.460%0.59953%0.534SS*.THydrogen-bonded Turntrans-84.432.8172.1-64.8-67.3000112.8M147 K148M147-N151 WeakPolarHBondContact O-CB 3.37Å; M147-N151 PolarHBondContact O-N 2.9Å; M147-N151 PolarHBondContact O-ND2 3.38Å; K148-N151 CarbonylContact O-C 3.59Å; K148-N151 PolarHBondContact O-N 3.42Å
152S62.5Low78.3Confident43 Ų43104.2 Ų104.230%0.30153%0.533SS..  trans-52.2154.2175.4168.70000111.4K148 S149 L150 Q154K148-S152 PolarHBondContact O-N 2.95Å; S149-S152 VanDerWaalsContact O-CB 3.24Å; S149-S152 WeakPolarHBondContact O-CB 3.48Å; S149-S152 PolarHBondContact O-N 2.94Å; L150-S152 PolarHBondContact O-N 2.99Å; S152-Q154 PolarHBondContact O-N 3.11Å; S152-Q154 PolarHBondContact OG-OE1 2.73Å
153P57.7Low77.6Confident72 Ų72103.7 Ų103.747%0.46853%0.534SS..THydrogen-bonded Turntrans-52-5.2-172.3-29.236000117.8D155 C156 W157P153-D155 PolarHBondContact O-N 2.88Å; P153-D155 VanDerWaalsContact O-N 3.11Å; P153-C156 PolarHBondContact O-N 3.42Å; P153-C156 PolarHBondContact O-SG 3.09Å; P153-W157 VanDerWaalsContact CB-CD1 3.47Å; P153-W157 PolarHBondContact O-N 3.32Å
154Q56.4Low77.2Confident124 Ų124103.8 Ų103.858%0.57954%0.535SS*.Hα-helixtrans-42.8-41170-97.277.213.900112.6S152 Q158S152-Q154 PolarHBondContact O-N 3.11Å; S152-Q154 PolarHBondContact OG-OE1 2.73Å; Q154-Q158 WeakPolarHBondContact O-CB 3.41Å; Q154-Q158 WeakPolarHBondContact O-CG 3.2Å; Q154-Q158 PolarHBondContact O-N 3.39Å
155D56Low77Confident114 Ų114105.8 Ų105.861%0.6154%0.541SS*.Hα-helixtrans-76.1-29.8179.8-71.1-29.1000113.8P153 M159P153-D155 PolarHBondContact O-N 2.88Å; P153-D155 VanDerWaalsContact O-N 3.11Å; D155-M159 PolarHBondContact O-N 3.42Å
156C55.4Low76.9Confident77 Ų77104.4 Ų104.452%0.5254%0.537SS..Hα-helixtrans-76.4-39.6174.893.80000111.7P153 E160P153-C156 PolarHBondContact O-N 3.42Å; P153-C156 PolarHBondContact O-SG 3.09Å; C156-E160 PolarHBondContact O-N 3.1Å
157W59Low76.8Confident156 Ų156105.9 Ų105.959%0.59154%0.539SS*.Hα-helixtrans-73.2-28.6175.7-66.9112.6000112.4P153 E160 R161P153-W157 VanDerWaalsContact CB-CD1 3.47Å; P153-W157 PolarHBondContact O-N 3.32Å; W157-E160 VanDerWaalsContact CE3-OE2 3.24Å; W157-E160 VanDerWaalsContact CZ3-OE2 3.25Å; W157-E160 WeakPolarHBondContact CZ3-OE2 3.38Å; W157-R161 WeakPolarHBondContact O-CB 3.38Å; W157-R161 PolarHBondContact O-N 3.04Å
158Q68.3Low76.9Confident90 Ų90105.4 Ų105.442%0.42154%0.537SS..Hα-helixtrans-65.7-41.3174.5-85.3-73.974.600111.8Q154 R161 V162Q154-Q158 WeakPolarHBondContact O-CB 3.41Å; Q154-Q158 WeakPolarHBondContact O-CG 3.2Å; Q154-Q158 PolarHBondContact O-N 3.39Å; Q158-R161 PolarHBondContact O-N 3.39Å; Q158-V162 VanDerWaalsContact O-CG2 3.3Å; Q158-V162 WeakPolarHBondContact O-CG2 3.34Å; Q158-V162 PolarHBondContact O-N 3.45Å
159M70.4Confident77.1Confident153 Ų153105.1 Ų105.175%0.75453%0.532SS*.Hα-helixtrans-67.6-42.4177.7-163.9156.8-161.200111.8D155 R161 V162 D163D155-M159 PolarHBondContact O-N 3.42Å; M159-R161 VanDerWaalsContact C-N 3.35Å; M159-R161 PolarHBondContact O-N 2.96Å; M159-V162 PolarHBondContact O-N 2.88Å; M159-D163 PolarHBondContact O-N 3.4Å
160E74.6Confident77.4Confident102 Ų102107.1 Ų107.148%0.47753%0.531SS..Hα-helixtrans-65.7-35.7174.9-168.5171.9-16600112.3C156 W157 D163 T164C156-E160 PolarHBondContact O-N 3.1Å; W157-E160 VanDerWaalsContact CE3-OE2 3.24Å; W157-E160 VanDerWaalsContact CZ3-OE2 3.25Å; W157-E160 WeakPolarHBondContact CZ3-OE2 3.38Å; E160-D163 PolarHBondContact O-N 3.2Å; E160-T164 WeakPolarHBondContact O-CB 3.36Å; E160-T164 VanDerWaalsContact O-CG2 3.31Å; E160-T164 WeakPolarHBondContact O-CG2 3.34Å; E160-T164 PolarHBondContact O-N 3.34Å; E160-T164 PolarHBondContact O-OG1 3.09Å
161R79.4Confident77.9Confident137 Ų137105.5 Ų105.552%0.51752%0.523SS..Hα-helixtrans-61.9-45.9171.4-118.6-163.3-54.4-138.6-3.2112.2W157 Q158 M159 D163 T164 E165W157-R161 WeakPolarHBondContact O-CB 3.38Å; W157-R161 PolarHBondContact O-N 3.04Å; Q158-R161 PolarHBondContact O-N 3.39Å; M159-R161 VanDerWaalsContact C-N 3.35Å; M159-R161 PolarHBondContact O-N 2.96Å; R161-D163 VanDerWaalsContact C-N 3.31Å; R161-D163 PolarHBondContact O-N 3.48Å; R161-T164 WeakPolarHBondContact CA-OG1 3.33Å; R161-T164 PolarHBondContact O-N 2.87Å; R161-T164 PolarHBondContact O-OG1 2.85Å; R161-E165 VanDerWaalsContact O-CB 3.25Å; R161-E165 WeakPolarHBondContact O-CB 3.38Å; R161-E165 PolarHBondContact O-N 3.45Å
162V83.3Confident78.6Confident100 Ų100105.2 Ų105.261%0.60652%0.518SS*.Hα-helixtrans-66.3-36.9-178.7172.50000111Q158 M159 L166Q158-V162 VanDerWaalsContact O-CG2 3.3Å; Q158-V162 WeakPolarHBondContact O-CG2 3.34Å; Q158-V162 PolarHBondContact O-N 3.45Å; M159-V162 PolarHBondContact O-N 2.88Å; V162-L166 WeakPolarHBondContact O-CB 3.48Å; V162-L166 PolarHBondContact O-N 3.41Å
163D84Confident80.2Confident112 Ų112108.6 Ų108.660%0.59953%0.529SS*.Hα-helixtrans-68.6-44.5176.7-162.240.6000112M159 E160 R161 L166 Q167M159-D163 PolarHBondContact O-N 3.4Å; E160-D163 PolarHBondContact O-N 3.2Å; R161-D163 VanDerWaalsContact C-N 3.31Å; R161-D163 PolarHBondContact O-N 3.48Å; D163-L166 PolarHBondContact O-N 2.86Å; D163-Q167 PolarHBondContact O-N 3.27Å
164T87.9Confident82Confident71 Ų71108.2 Ų108.244%0.43652%0.523SS..Hα-helixtrans-65.5-37.9174.850.50000112.6E160 R161 Q167 I168E160-T164 WeakPolarHBondContact O-CB 3.36Å; E160-T164 VanDerWaalsContact O-CG2 3.31Å; E160-T164 WeakPolarHBondContact O-CG2 3.34Å; E160-T164 PolarHBondContact O-N 3.34Å; E160-T164 PolarHBondContact O-OG1 3.09Å; R161-T164 WeakPolarHBondContact CA-OG1 3.33Å; R161-T164 PolarHBondContact O-N 2.87Å; R161-T164 PolarHBondContact O-OG1 2.85Å; T164-Q167 PolarHBondContact O-N 2.91Å; T164-I168 VanDerWaalsContact O-CG1 3.27Å; T164-I168 WeakPolarHBondContact O-CG1 3.39Å; T164-I168 PolarHBondContact O-N 3.45Å
165E92Very high83.8Confident97 Ų97106.7 Ų106.745%0.45352%0.519SS..Hα-helixtrans-63.4-40.8174.9-163.681.8-141.600111.8R161 I168 R169R161-E165 VanDerWaalsContact O-CB 3.25Å; R161-E165 WeakPolarHBondContact O-CB 3.38Å; R161-E165 PolarHBondContact O-N 3.45Å; E165-I168 PolarHBondContact O-N 3.25Å; E165-R169 PolarHBondContact O-N 3.1Å
166L93.6Very high85.7Confident103 Ų103105.8 Ų105.854%0.53951%0.514SS..Hα-helixtrans-64.6-43.2175.2-178.266.5000111.4V162 D163 I168 R169 K170V162-L166 WeakPolarHBondContact O-CB 3.48Å; V162-L166 PolarHBondContact O-N 3.41Å; D163-L166 PolarHBondContact O-N 2.86Å; L166-I168 VanDerWaalsContact C-N 3.33Å; L166-I168 PolarHBondContact O-N 3.44Å; L166-R169 PolarHBondContact O-N 2.87Å; L166-K170 PolarHBondContact O-N 3Å
167Q95.3Very high87.7Confident102 Ų102109.4 Ų109.448%0.47752%0.516SS..Hα-helixtrans-61.7-40.9176.6-171.968.910.800111.6D163 T164 K170 L171D163-Q167 PolarHBondContact O-N 3.27Å; T164-Q167 PolarHBondContact O-N 2.91Å; Q167-K170 PolarHBondContact O-N 3.2Å; Q167-L171 HydrophobicContact CG-CD1 4.33Å; Q167-L171 WeakPolarHBondContact O-CG 3.38Å; Q167-L171 PolarHBondContact O-N 2.95Å
168I94.3Very high89.3Confident90 Ų90105.9 Ų105.946%0.46251%0.512SS..Hα-helixtrans-60.8-48.8174.8-70.8164.4000110.3T164 E165 L166 K170 L171 Q172T164-I168 VanDerWaalsContact O-CG1 3.27Å; T164-I168 WeakPolarHBondContact O-CG1 3.39Å; T164-I168 PolarHBondContact O-N 3.45Å; E165-I168 PolarHBondContact O-N 3.25Å; L166-I168 VanDerWaalsContact C-N 3.33Å; L166-I168 PolarHBondContact O-N 3.44Å; I168-K170 VanDerWaalsContact C-N 3.34Å; I168-K170 PolarHBondContact O-N 3.45Å; I168-L171 PolarHBondContact O-N 3.16Å; I168-Q172 WeakPolarHBondContact O-CB 3.27Å; I168-Q172 PolarHBondContact O-N 3.37Å
169R94.6Very high90.4Very high142 Ų142106.8 Ų106.854%0.53652%0.517SS..Hα-helixtrans-60-43.3178.7-68-155.7-149.51017112.6E165 L166 L171 Q172 E173E165-R169 PolarHBondContact O-N 3.1Å; L166-R169 PolarHBondContact O-N 2.87Å; R169-L171 PolarHBondContact O-N 2.94Å; R169-Q172 VanDerWaalsContact O-CB 3.31Å; R169-Q172 WeakPolarHBondContact O-CB 3.35Å; R169-Q172 PolarHBondContact O-N 3.2Å; R169-Q172 VanDerWaalsContact O-N 3.17Å; R169-E173 WeakPolarHBondContact O-CG 3.09Å; R169-E173 PolarHBondContact O-N 2.91Å
170K96Very high91.5Very high118 Ų118104.7 Ų104.751%0.51351%0.509SS..Hα-helixtrans-60.8-45.1177.7-175.6-178.1176.9-175.80111.8L166 Q167 I168 Q172 E173 D174L166-K170 PolarHBondContact O-N 3Å; Q167-K170 PolarHBondContact O-N 3.2Å; I168-K170 VanDerWaalsContact C-N 3.34Å; I168-K170 PolarHBondContact O-N 3.45Å; K170-Q172 VanDerWaalsContact C-N 3.28Å; K170-Q172 PolarHBondContact O-N 2.91Å; K170-E173 PolarHBondContact O-N 2.93Å; K170-D174 PolarHBondContact O-N 3.22Å
171L95.8Very high92.2Very high101 Ų101105.3 Ų105.353%0.52951%0.512SS..Hα-helixtrans-64.3-35.4175.9-71.6172.7000112Q167 I168 R169 D174 L175Q167-L171 HydrophobicContact CG-CD1 4.33Å; Q167-L171 WeakPolarHBondContact O-CG 3.38Å; Q167-L171 PolarHBondContact O-N 2.95Å; I168-L171 PolarHBondContact O-N 3.16Å; R169-L171 PolarHBondContact O-N 2.94Å; L171-D174 PolarHBondContact O-N 3.19Å; L171-L175 VanDerWaalsContact O-CB 3.3Å; L171-L175 WeakPolarHBondContact O-CB 3.45Å; L171-L175 PolarHBondContact O-N 3.5Å
172Q94.8Very high92.6Very high106 Ų106103.5 Ų103.550%0.49551%0.512SS..Hα-helixtrans-63.1-46.5174.4-146.5811400111.2I168 R169 K170 D174 L175 D176I168-Q172 WeakPolarHBondContact O-CB 3.27Å; I168-Q172 PolarHBondContact O-N 3.37Å; R169-Q172 VanDerWaalsContact O-CB 3.31Å; R169-Q172 WeakPolarHBondContact O-CB 3.35Å; R169-Q172 PolarHBondContact O-N 3.2Å; R169-Q172 VanDerWaalsContact O-N 3.17Å; K170-Q172 VanDerWaalsContact C-N 3.28Å; K170-Q172 PolarHBondContact O-N 2.91Å; Q172-D174 PolarHBondContact O-N 2.89Å; Q172-L175 PolarHBondContact O-N 2.86Å; Q172-D176 PolarHBondContact O-N 3.28Å
173E95.6Very high92.9Very high113 Ų113101.7 Ų101.753%0.52850%0.504SS..Hα-helixtrans-62.4-40.9176.8-72.2173.3-168.700112.3R169 K170 R177R169-E173 WeakPolarHBondContact O-CG 3.09Å; R169-E173 PolarHBondContact O-N 2.91Å; K170-E173 PolarHBondContact O-N 2.93Å; E173-R177 WeakPolarHBondContact O-CB 3.5Å; E173-R177 PolarHBondContact O-N 2.88Å
174D95.3Very high93.1Very high65 Ų65104.6 Ų104.635%0.34851%0.507SS..Hα-helixtrans-67.8-38.4176.3-74.6-20.4000111.4K170 L171 Q172 R177 V178K170-D174 PolarHBondContact O-N 3.22Å; L171-D174 PolarHBondContact O-N 3.19Å; Q172-D174 PolarHBondContact O-N 2.89Å; D174-R177 WeakPolarHBondContact O-CB 3.34Å; D174-R177 PolarHBondContact O-N 2.97Å; D174-R177 IonicContact OD1-NE 3.93Å; D174-V178 VanDerWaalsContact O-CG2 3.32Å; D174-V178 WeakPolarHBondContact O-CG2 3.34Å; D174-V178 PolarHBondContact O-N 3.37Å
175L95.3Very high93Very high92 Ų92105.8 Ų105.848%0.48251%0.51SS..Hα-helixtrans-63.2-46.4175.1-175.765.5000111.5L171 Q172 R177 V178 M179L171-L175 VanDerWaalsContact O-CB 3.3Å; L171-L175 WeakPolarHBondContact O-CB 3.45Å; L171-L175 PolarHBondContact O-N 3.5Å; Q172-L175 PolarHBondContact O-N 2.86Å; L175-R177 VanDerWaalsContact C-N 3.28Å; L175-R177 PolarHBondContact O-N 3.31Å; L175-V178 PolarHBondContact O-N 2.92Å; L175-M179 HydrophobicContact CG-SD 4.45Å; L175-M179 WeakPolarHBondContact O-CB 3.3Å; L175-M179 WeakPolarHBondContact O-CG 3.45Å; L175-M179 PolarHBondContact O-N 3.44Å
176D95.6Very high92.6Very high95 Ų95106 Ų10651%0.50851%0.514SS..Hα-helixtrans-61.5-38.8176.9-73.2-19.3000111.4Q172 M179 L180Q172-D176 PolarHBondContact O-N 3.28Å; D176-M179 PolarHBondContact O-N 3.32Å; D176-L180 WeakPolarHBondContact O-CB 3.38Å; D176-L180 PolarHBondContact O-N 3.35Å
177R95.7Very high91.9Very high152 Ų152107.3 Ų107.357%0.57452%0.517SS*.Hα-helixtrans-63.4-47.3175.3-167.9-170.2-47.9-71.9-6.6111.7E173 D174 L175 L180 E181E173-R177 WeakPolarHBondContact O-CB 3.5Å; E173-R177 PolarHBondContact O-N 2.88Å; D174-R177 WeakPolarHBondContact O-CB 3.34Å; D174-R177 PolarHBondContact O-N 2.97Å; D174-R177 IonicContact OD1-NE 3.93Å; L175-R177 VanDerWaalsContact C-N 3.28Å; L175-R177 PolarHBondContact O-N 3.31Å; R177-L180 PolarHBondContact O-N 3.46Å; R177-E181 PolarHBondContact O-N 3.47Å
178V94.1Very high91Very high82 Ų82110 Ų11050%0.49752%0.522SS..Hα-helixtrans-65-40.3177.51690000110.8D174 L175 L180 E181 N182D174-V178 VanDerWaalsContact O-CG2 3.32Å; D174-V178 WeakPolarHBondContact O-CG2 3.34Å; D174-V178 PolarHBondContact O-N 3.37Å; L175-V178 PolarHBondContact O-N 2.92Å; V178-L180 VanDerWaalsContact C-N 3.33Å; V178-L180 PolarHBondContact O-N 3Å; V178-E181 PolarHBondContact O-N 3.32Å; V178-N182 VanDerWaalsContact O-CB 3.26Å; V178-N182 WeakPolarHBondContact O-CB 3.22Å; V178-N182 PolarHBondContact O-N 2.86Å
179M91.7Very high89.5Confident109 Ų109107.6 Ų107.654%0.53751%0.514SS..Hα-helixtrans-61.6-41.3175-80-174.851.100111.9L175 D176 N182 S183L175-M179 HydrophobicContact CG-SD 4.45Å; L175-M179 WeakPolarHBondContact O-CB 3.3Å; L175-M179 WeakPolarHBondContact O-CG 3.45Å; L175-M179 PolarHBondContact O-N 3.44Å; D176-M179 PolarHBondContact O-N 3.32Å; M179-N182 PolarHBondContact O-N 3.18Å; M179-S183 WeakPolarHBondContact O-CB 3.43Å; M179-S183 PolarHBondContact O-N 3.44Å; M179-S183 PolarHBondContact O-OG 3.34Å
180L92.9Very high87.7Confident110 Ų110105.1 Ų105.158%0.57651%0.514SS*.Hα-helixtrans-66-42.2176.2-167.574.9000111.5D176 R177 V178 S183 R184D176-L180 WeakPolarHBondContact O-CB 3.38Å; D176-L180 PolarHBondContact O-N 3.35Å; R177-L180 PolarHBondContact O-N 3.46Å; V178-L180 VanDerWaalsContact C-N 3.33Å; V178-L180 PolarHBondContact O-N 3Å; L180-S183 PolarHBondContact O-N 3.48Å; L180-R184 WeakPolarHBondContact O-CG 3.44Å; L180-R184 PolarHBondContact O-N 3.39Å
181E89.9Confident85.7Confident115 Ų115106.6 Ų106.654%0.53752%0.523SS..Hα-helixtrans-65.2-42.3175.7-171.7176.5-175.100111.8R177 V178 S183 R184 L185R177-E181 PolarHBondContact O-N 3.47Å; V178-E181 PolarHBondContact O-N 3.32Å; E181-S183 PolarHBondContact O-N 3.44Å; E181-R184 WeakPolarHBondContact O-CB 3.36Å; E181-R184 PolarHBondContact O-N 3.4Å; E181-L185 HydrophobicContact CG-CD1 4.24Å; E181-L185 WeakPolarHBondContact O-CB 3.26Å; E181-L185 WeakPolarHBondContact O-CG 3.49Å; E181-L185 PolarHBondContact O-N 2.95Å
182N86.4Confident83.5Confident99 Ų99108.6 Ų108.653%0.52953%0.53SS..Hα-helixtrans-63.7-41.8175.9-163.4-50.9000110.9V178 M179 R184 L185 L186V178-N182 VanDerWaalsContact O-CB 3.26Å; V178-N182 WeakPolarHBondContact O-CB 3.22Å; V178-N182 PolarHBondContact O-N 2.86Å; M179-N182 PolarHBondContact O-N 3.18Å; N182-R184 VanDerWaalsContact C-N 3.34Å; N182-R184 PolarHBondContact O-N 2.99Å; N182-L185 CarbonylContact O-C 3.52Å; N182-L185 PolarHBondContact O-N 2.88Å; N182-L186 VanDerWaalsContact O-CB 3.24Å; N182-L186 WeakPolarHBondContact O-CB 3.41Å; N182-L186 PolarHBondContact O-N 2.86Å
183S89.6Confident81.1Confident61 Ų61107.1 Ų107.143%0.42753%0.532SS..Hα-helixtrans-61.5-42.4174.7-560000111.7M179 L180 E181 L186 E187M179-S183 WeakPolarHBondContact O-CB 3.43Å; M179-S183 PolarHBondContact O-N 3.44Å; M179-S183 PolarHBondContact O-OG 3.34Å; L180-S183 PolarHBondContact O-N 3.48Å; E181-S183 PolarHBondContact O-N 3.44Å; S183-L186 PolarHBondContact O-N 2.93Å; S183-E187 WeakPolarHBondContact O-CG 3.18Å; S183-E187 PolarHBondContact O-N 3.5Å
184R89.6Confident78.7Confident174 Ų174110.8 Ų110.866%0.65755%0.549SS*.Hα-helixtrans-65-41.6174.8-76.7174.5150.1-164.1-6.1112.9L180 E181 N182 L186 R188L180-R184 WeakPolarHBondContact O-CG 3.44Å; L180-R184 PolarHBondContact O-N 3.39Å; E181-R184 WeakPolarHBondContact O-CB 3.36Å; E181-R184 PolarHBondContact O-N 3.4Å; N182-R184 VanDerWaalsContact C-N 3.34Å; N182-R184 PolarHBondContact O-N 2.99Å; R184-L186 VanDerWaalsContact C-N 3.32Å; R184-R188 WeakPolarHBondContact O-CB 3.42Å; R184-R188 PolarHBondContact O-N 3.46Å
185L85.2Confident76.3Confident96 Ų96109.9 Ų109.950%0.50356%0.555SS.*Hα-helixtrans-67.5-35.9174.8-73.7173.7000111.1E181 N182 R188 S189E181-L185 HydrophobicContact CG-CD1 4.24Å; E181-L185 WeakPolarHBondContact O-CB 3.26Å; E181-L185 WeakPolarHBondContact O-CG 3.49Å; E181-L185 PolarHBondContact O-N 2.95Å; N182-L185 CarbonylContact O-C 3.52Å; N182-L185 PolarHBondContact O-N 2.88Å; L185-R188 CarbonylContact O-C 3.58Å; L185-R188 PolarHBondContact O-N 3.45Å; L185-S189 VanDerWaalsContact O-CB 3.25Å; L185-S189 WeakPolarHBondContact O-CB 3.47Å; L185-S189 PolarHBondContact O-N 3.43Å; L185-S189 PolarHBondContact O-OG 3.36Å
186L82.9Confident73.9Confident102 Ų102113.5 Ų113.553%0.53457%0.573SS.*Hα-helixtrans-67-46.8176.6-168.472.4000110.2N182 S183 R184 R188 S189 T190N182-L186 VanDerWaalsContact O-CB 3.24Å; N182-L186 WeakPolarHBondContact O-CB 3.41Å; N182-L186 PolarHBondContact O-N 2.86Å; S183-L186 PolarHBondContact O-N 2.93Å; R184-L186 VanDerWaalsContact C-N 3.32Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 2.99Å; L186-S189 WeakPolarHBondContact CA-OG 3.29Å; L186-S189 CarbonylContact O-C 3.41Å; L186-S189 PolarHBondContact O-N 2.95Å; L186-S189 VanDerWaalsContact O-N 3.14Å; L186-S189 PolarHBondContact O-OG 3.08Å; L186-T190 WeakPolarHBondContact O-CB 3.36Å; L186-T190 PolarHBondContact O-N 3.25Å; L186-T190 PolarHBondContact O-OG1 2.89Å
187E79.2Confident71.2Confident129 Ų129117 Ų11760%0.60359%0.592SS**Hα-helixtrans-54-49.2171.7-76.3176173.500110.5S183 S189 T190 E191S183-E187 WeakPolarHBondContact O-CG 3.18Å; S183-E187 PolarHBondContact O-N 3.5Å; E187-S189 PolarHBondContact O-N 2.91Å; E187-T190 PolarHBondContact O-N 3.03Å; E187-E191 VanDerWaalsContact O-CG 3.31Å; E187-E191 WeakPolarHBondContact O-CG 3.4Å; E187-E191 PolarHBondContact O-N 3.13Å
188R76.8Confident68.5Low158 Ų158113 Ų11360%0.59660%0.599SS**Hα-helixtrans-63.3-36.6176.4-160.7178.4-158.4-165.42.7113.6R184 L185 L186 E191 E192R184-R188 WeakPolarHBondContact O-CB 3.42Å; R184-R188 PolarHBondContact O-N 3.46Å; L185-R188 CarbonylContact O-C 3.58Å; L185-R188 PolarHBondContact O-N 3.45Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 2.99Å; R188-E191 WeakPolarHBondContact O-CB 3.47Å; R188-E191 PolarHBondContact O-N 3.06Å; R188-E192 WeakPolarHBondContact O-CG 3.31Å; R188-E192 PolarHBondContact O-N 2.95Å
189S62.4Low66.8Low40 Ų40115.7 Ų115.728%0.2862%0.618SS.*Hα-helixtrans-77.4-24.8176.877.50000112.2L185 L186 E187 E191 E192 S193L185-S189 VanDerWaalsContact O-CB 3.25Å; L185-S189 WeakPolarHBondContact O-CB 3.47Å; L185-S189 PolarHBondContact O-N 3.43Å; L185-S189 PolarHBondContact O-OG 3.36Å; L186-S189 WeakPolarHBondContact CA-OG 3.29Å; L186-S189 CarbonylContact O-C 3.41Å; L186-S189 PolarHBondContact O-N 2.95Å; L186-S189 VanDerWaalsContact O-N 3.14Å; L186-S189 PolarHBondContact O-OG 3.08Å; E187-S189 PolarHBondContact O-N 2.91Å; S189-E191 VanDerWaalsContact C-N 3.33Å; S189-E192 CarbonylContact O-C 3.59Å; S189-E192 PolarHBondContact O-N 3Å; S189-S193 WeakPolarHBondContact O-CA 3.46Å; S189-S193 WeakPolarHBondContact O-CB 3.47Å; S189-S193 PolarHBondContact O-N 3.14Å; S189-S193 PolarHBondContact O-OG 3.05Å
190T56Low64.5Low90 Ų90117.9 Ų117.955%0.55263%0.632SS**Hα-helixtrans-75.9-32.5173.9-43.50000109.1L186 E187L186-T190 WeakPolarHBondContact O-CB 3.36Å; L186-T190 PolarHBondContact O-N 3.25Å; L186-T190 PolarHBondContact O-OG1 2.89Å; E187-T190 PolarHBondContact O-N 3.03Å
191E54.3Low62.5Low149 Ų149119.5 Ų119.570%0.69664%0.64SS**Hα-helixtrans-66.7-35.3166.3-67.6167.8171.400112.1E187 R188 S189E187-E191 VanDerWaalsContact O-CG 3.31Å; E187-E191 WeakPolarHBondContact O-CG 3.4Å; E187-E191 PolarHBondContact O-N 3.13Å; R188-E191 WeakPolarHBondContact O-CB 3.47Å; R188-E191 PolarHBondContact O-N 3.06Å; S189-E191 VanDerWaalsContact C-N 3.33Å
192E49.5Very low60.3Low143 Ų143121.3 Ų121.367%0.66865%0.653SS**Hα-helixtrans-85.9-25.1176.4-74.6176.8163.300114.5R188 S189 G195R188-E192 WeakPolarHBondContact O-CG 3.31Å; R188-E192 PolarHBondContact O-N 2.95Å; S189-E192 CarbonylContact O-C 3.59Å; S189-E192 PolarHBondContact O-N 3Å; E192-G195 PolarHBondContact O-N 3.35Å
193S45.4Very low58.6Low76 Ų76125.1 Ų125.153%0.53167%0.668SS.*THydrogen-bonded Turntrans-96.914.2-174.8-54.40000114.2S189 G195S189-S193 WeakPolarHBondContact O-CA 3.46Å; S189-S193 WeakPolarHBondContact O-CB 3.47Å; S189-S193 PolarHBondContact O-N 3.14Å; S189-S193 PolarHBondContact O-OG 3.05Å; S193-G195 PolarHBondContact O-N 3.36Å
194Q44.9Very low56.6Low190 Ų190128.4 Ų128.489%0.88869%0.686SS**THydrogen-bonded Turntrans-62.7-2.3147.7-85.2-178.2-15.800112.2
195G45.6Very low54.9Low46 Ų46125.7 Ų125.747%0.47469%0.692SS.*SBendtrans-115.8100.9160.600000114E192 S193E192-G195 PolarHBondContact O-N 3.35Å; S193-G195 PolarHBondContact O-N 3.36Å
196L44.8Very low53.3Low167 Ų167128.2 Ų128.287%0.87471%0.706SS**  trans89.3131.8150.8-50.3174000119.9
197N38.5Very low52.1Low168 Ų168126.6 Ų126.690%0.89872%0.715SS**  trans-76.5157-172.8-79.2-83.4000115.3
198G39.8Very low51.1Low70 Ų70129.7 Ų129.772%0.72273%0.726SS**  trans-69.8-160.4172.400000116.1
199P56.8Low50.1Low137 Ų137129 Ų12989%0.8973%0.729SS**  cis-147.6-17742.740.5-18000118.8
200D43.1Very low50.1Low156 Ų156129.3 Ų129.383%0.83473%0.732SS**  trans-82151.6-176.4-178.928000115.3
201L51.5Low50.7Low144 Ų144128.7 Ų128.775%0.75473%0.731SS**  trans-152.1115.1179.7-99.8161.5000109.7
202N43.5Very low51.7Low152 Ų152131 Ų13181%0.81373%0.733SS**  170.6134114.5-95.4-29.5000115.4
203Q51Low53.1Low179 Ų179130.2 Ų130.284%0.83673%0.729SS**  trans-128114.4170.3178.317895.300106.1
204T48.6Very low54.7Low130 Ų130133.8 Ų133.880%0.79873%0.731SS**  trans160111.2151.829.90000112.4
205C52.3Low56.5Low117 Ų117129.3 Ų129.379%0.79171%0.713SS**  trans-17416151.2-99.60000118.3
206D53.4Low58.4Low149 Ų149131.3 Ų131.380%0.79772%0.716SS**  trans-84.5-12.3-166.2-84.2-43.6000118.7
207G57Low60.3Low69 Ų69129.5 Ų129.571%0.71170%0.703SS**THydrogen-bonded Turntrans-74-34.2-165.900000116.7
208K57.4Low62.7Low194 Ų194128.2 Ų128.284%0.84369%0.692SS**THydrogen-bonded Turntrans-91-23.8-171-78.9178.8177.8175.30114.1
209H56.8Low65Low143 Ų143128.7 Ų128.766%0.66268%0.681SS**Hα-helixtrans-71.3-38.5179.2-81.2-61.1000112.4S211 R212 E213H209-S211 VanDerWaalsContact C-N 3.34Å; H209-S211 PolarHBondContact O-N 2.94Å; H209-R212 PolarHBondContact O-N 3.11Å; H209-E213 PolarHBondContact O-N 3.01Å
210S61.8Low66.5Low47 Ų47129.6 Ų129.633%0.32967%0.667SS.*Hα-helixtrans-64.5-29.6-175.5-1710000114.7R214S210-R214 PolarHBondContact O-N 2.99Å; S210-R214 PolarHBondContact O-NE 2.9Å; S210-R214 VanDerWaalsContact O-NE 3.11Å; S210-R214 PolarHBondContact OG-NE 2.98Å; S210-R214 PolarHBondContact OG-NH2 2.92Å
211S68.8Low68.8Low76 Ų76124.7 Ų124.753%0.53165%0.649SS.*Hα-helixtrans-80.6-35.2-178.5-170.50000113.4H209 N215H209-S211 VanDerWaalsContact C-N 3.34Å; H209-S211 PolarHBondContact O-N 2.94Å; S211-N215 PolarHBondContact O-N 2.94Å
212R75.7Confident70.7Confident199 Ų199120.6 Ų120.675%0.75164%0.636SS**Hα-helixtrans-70.8-41.4177.5-179.1176.8174.9-176.5-2.3110.4H209 N215 V216H209-R212 PolarHBondContact O-N 3.11Å; R212-N215 PolarHBondContact O-N 3.29Å; R212-V216 WeakPolarHBondContact O-CG2 3.24Å; R212-V216 PolarHBondContact O-N 2.75Å; R212-V216 VanDerWaalsContact O-N 3.1Å
213E77.6Confident73.1Confident126 Ų126118.4 Ų118.459%0.58962%0.623SS**Hα-helixtrans-60.7-46.4177.1-168.8168.5-154.300111.7H209 N215 V216 Q217H209-E213 PolarHBondContact O-N 3.01Å; E213-N215 PolarHBondContact O-N 2.97Å; E213-V216 PolarHBondContact O-N 2.85Å; E213-Q217 WeakPolarHBondContact O-CB 3.39Å; E213-Q217 PolarHBondContact O-N 3.05Å
214R79.6Confident75.1Confident150 Ų150112.2 Ų112.257%0.56660%0.6SS**Hα-helixtrans-59.9-38.9175.5-85.8-179.7-91.3142.2-11114.1S210 Q217 Q218S210-R214 PolarHBondContact O-N 2.99Å; S210-R214 PolarHBondContact O-NE 2.9Å; S210-R214 VanDerWaalsContact O-NE 3.11Å; S210-R214 PolarHBondContact OG-NE 2.98Å; S210-R214 PolarHBondContact OG-NH2 2.92Å; R214-Q217 PolarHBondContact O-N 3.08Å; R214-Q218 WeakPolarHBondContact O-CB 3.49Å; R214-Q218 PolarHBondContact O-N 2.96Å
215N83.9Confident77.2Confident96 Ų96110.1 Ų110.151%0.51359%0.589SS.*Hα-helixtrans-68.5-41.8178.3-168-54.5000111.6S211 R212 E213 Q217 Q218 T219S211-N215 PolarHBondContact O-N 2.94Å; R212-N215 PolarHBondContact O-N 3.29Å; E213-N215 PolarHBondContact O-N 2.97Å; N215-Q217 VanDerWaalsContact C-N 3.33Å; N215-Q217 PolarHBondContact O-N 3.27Å; N215-Q218 PolarHBondContact O-N 3.01Å; N215-T219 WeakPolarHBondContact O-CG2 3.08Å; N215-T219 PolarHBondContact O-N 3.49Å; N215-T219 PolarHBondContact O-OG1 2.79Å; N215-T219 VanDerWaalsContact O-OG1 3.04Å
216V84.1Confident79.2Confident88 Ų88109 Ų10953%0.53357%0.572SS.*Hα-helixtrans-63.8-40.1174.8175.20000111R212 E213 Q218 T219 Y220R212-V216 WeakPolarHBondContact O-CG2 3.24Å; R212-V216 PolarHBondContact O-N 2.75Å; R212-V216 VanDerWaalsContact O-N 3.1Å; E213-V216 PolarHBondContact O-N 2.85Å; V216-Q218 PolarHBondContact O-N 2.97Å; V216-T219 WeakPolarHBondContact CA-OG1 3.39Å; V216-T219 PolarHBondContact O-N 2.83Å; V216-T219 PolarHBondContact O-OG1 3.18Å; V216-Y220 WeakPolarHBondContact O-CB 3.34Å; V216-Y220 PolarHBondContact O-N 3.05Å
217Q84.9Confident81.1Confident129 Ų129105.1 Ų105.160%0.60355%0.554SS**Hα-helixtrans-66.2-37.8176.9-130.4159.213.900112.4E213 R214 N215 A221E213-Q217 WeakPolarHBondContact O-CB 3.39Å; E213-Q217 PolarHBondContact O-N 3.05Å; R214-Q217 PolarHBondContact O-N 3.08Å; N215-Q217 VanDerWaalsContact C-N 3.33Å; N215-Q217 PolarHBondContact O-N 3.27Å; Q217-A221 WeakPolarHBondContact O-CB 3.35Å; Q217-A221 PolarHBondContact O-N 3.38Å
218Q89Confident82.8Confident141 Ų141106 Ų10666%0.65955%0.546SS*.Hα-helixtrans-68.3-41.2176.7-172.6174.217.500112.5R214 N215 V216 A221 A222R214-Q218 WeakPolarHBondContact O-CB 3.49Å; R214-Q218 PolarHBondContact O-N 2.96Å; N215-Q218 PolarHBondContact O-N 3.01Å; V216-Q218 PolarHBondContact O-N 2.97Å; Q218-A221 PolarHBondContact O-N 2.8Å; Q218-A222 PolarHBondContact O-N 2.94Å
219T87.4Confident84.6Confident80 Ų80103.2 Ų103.249%0.49153%0.53SS..Hα-helixtrans-68.2-38.1176.349.30000111.9N215 V216 A222 L223N215-T219 WeakPolarHBondContact O-CG2 3.08Å; N215-T219 PolarHBondContact O-N 3.49Å; N215-T219 PolarHBondContact O-OG1 2.79Å; N215-T219 VanDerWaalsContact O-OG1 3.04Å; V216-T219 WeakPolarHBondContact CA-OG1 3.39Å; V216-T219 PolarHBondContact O-N 2.83Å; V216-T219 PolarHBondContact O-OG1 3.18Å; T219-A222 PolarHBondContact O-N 3.28Å; T219-L223 WeakPolarHBondContact O-CB 3.37Å; T219-L223 PolarHBondContact O-N 2.97Å
220Y89.1Confident86.5Confident156 Ų156101.9 Ų101.961%0.61253%0.527SS*.Hα-helixtrans-61.1-46.2171.6-178.4-100.1000111.8V216 A222 L223 C224V216-Y220 WeakPolarHBondContact O-CB 3.34Å; V216-Y220 PolarHBondContact O-N 3.05Å; Y220-A222 PolarHBondContact O-N 3.32Å; Y220-L223 PolarHBondContact O-N 2.88Å; Y220-C224 VanDerWaalsContact CE1-SG 3.59Å; Y220-C224 PolarHBondContact O-N 3.37Å; Y220-C224 PolarHBondContact O-SG 3.44Å; Y220-C224 VanDerWaalsContact O-SG 3.32Å
221A91.7Very high88Confident53 Ų53104 Ų10444%0.43853%0.532SS..Hα-helixtrans-61-42.7177.200000112.4Q217 Q218 L223 C224 C225Q217-A221 WeakPolarHBondContact O-CB 3.35Å; Q217-A221 PolarHBondContact O-N 3.38Å; Q218-A221 PolarHBondContact O-N 2.8Å; A221-L223 VanDerWaalsContact C-N 3.35Å; A221-L223 PolarHBondContact O-N 3.43Å; A221-C224 PolarHBondContact O-N 2.94Å; A221-C225 PolarHBondContact O-N 2.99Å; A221-C225 VanDerWaalsContact O-N 3.09Å; A221-C225 PolarHBondContact O-SG 2.84Å; A221-C225 VanDerWaalsContact O-SG 3.35Å
222A91.8Very high89.2Confident59 Ų59103.4 Ų103.449%0.48853%0.527SS..Hα-helixtrans-62.3-41.4175.700000112.2Q218 T219 Y220 C225 E226Q218-A222 PolarHBondContact O-N 2.94Å; T219-A222 PolarHBondContact O-N 3.28Å; Y220-A222 PolarHBondContact O-N 3.32Å; A222-C225 PolarHBondContact O-N 3.11Å; A222-E226 PolarHBondContact O-N 3.48Å; A222-E226 VanDerWaalsContact O-N 3.07Å
223L94.3Very high90.2Very high105 Ų10597.9 Ų97.955%0.5551%0.51SS..Hα-helixtrans-63.7-44176.2-178.663.3000111.8T219 Y220 A221 C225 E226 V227T219-L223 WeakPolarHBondContact O-CB 3.37Å; T219-L223 PolarHBondContact O-N 2.97Å; Y220-L223 PolarHBondContact O-N 2.88Å; A221-L223 VanDerWaalsContact C-N 3.35Å; A221-L223 PolarHBondContact O-N 3.43Å; L223-C225 VanDerWaalsContact C-N 3.3Å; L223-C225 PolarHBondContact O-N 3.41Å; L223-E226 PolarHBondContact O-N 2.89Å; L223-V227 HydrophobicContact CD1-CG2 4.32Å; L223-V227 HydrophobicContact CG-CG2 4.44Å; L223-V227 WeakPolarHBondContact O-CG2 3.47Å; L223-V227 PolarHBondContact O-N 3.34Å
224C91.6Very high91Very high50 Ų5097 Ų9734%0.33851%0.507SS..Hα-helixtrans-59.6-40.4176.3-700000112.1Y220 A221 T228Y220-C224 VanDerWaalsContact CE1-SG 3.59Å; Y220-C224 PolarHBondContact O-N 3.37Å; Y220-C224 PolarHBondContact O-SG 3.44Å; Y220-C224 VanDerWaalsContact O-SG 3.32Å; A221-C224 PolarHBondContact O-N 2.94Å; C224-T228 WeakPolarHBondContact O-CB 3.38Å; C224-T228 PolarHBondContact O-N 2.84Å; C224-T228 PolarHBondContact O-OG1 2.84Å
225C92.9Very high91.6Very high85 Ų8598.7 Ų98.757%0.57451%0.514SS*.Hα-helixtrans-62.3-45.8174.6-700000112A221 A222 L223 T228 R229A221-C225 PolarHBondContact O-N 2.99Å; A221-C225 VanDerWaalsContact O-N 3.09Å; A221-C225 PolarHBondContact O-SG 2.84Å; A221-C225 VanDerWaalsContact O-SG 3.35Å; A222-C225 PolarHBondContact O-N 3.11Å; L223-C225 VanDerWaalsContact C-N 3.3Å; L223-C225 PolarHBondContact O-N 3.41Å; C225-T228 PolarHBondContact O-N 3.4Å; C225-R229 WeakPolarHBondContact O-CB 3.5Å; C225-R229 PolarHBondContact O-N 3.32Å
226E94.9Very high92.2Very high95 Ų9599.5 Ų99.544%0.44452%0.518SS..Hα-helixtrans-66.4-39.4178.9-77.9-57.3132.400113A222 L223 T228 R229 L230A222-E226 PolarHBondContact O-N 3.48Å; A222-E226 VanDerWaalsContact O-N 3.07Å; L223-E226 PolarHBondContact O-N 2.89Å; E226-T228 VanDerWaalsContact C-N 3.32Å; E226-T228 PolarHBondContact O-N 3.47Å; E226-R229 PolarHBondContact O-N 3Å; E226-R229 IonicContact OE1-NE 3.43Å; E226-R229 PolarHBondContact OE1-NE 3.25Å; E226-R229 IonicContact OE2-CZ 3.25Å; E226-R229 VanDerWaalsContact OE2-CZ 3.25Å; E226-R229 IonicContact OE2-NE 2.9Å; E226-R229 PolarHBondContact OE2-NE 3.09Å; E226-R229 IonicContact OE2-NH2 2.73Å; E226-R229 PolarHBondContact OE2-NH2 3.13Å; E226-L230 WeakPolarHBondContact O-CB 3.23Å; E226-L230 PolarHBondContact O-N 2.94Å
227V92.8Very high92.6Very high66 Ų66101.3 Ų101.340%0.452%0.52SS..Hα-helixtrans-62.3-42.5174.9170.70000110.6L223 L230 Q231L223-V227 HydrophobicContact CD1-CG2 4.32Å; L223-V227 HydrophobicContact CG-CG2 4.44Å; L223-V227 WeakPolarHBondContact O-CG2 3.47Å; L223-V227 PolarHBondContact O-N 3.34Å; V227-L230 PolarHBondContact O-N 3.02Å; V227-Q231 WeakPolarHBondContact O-CB 3.3Å; V227-Q231 VanDerWaalsContact O-CG 3.28Å; V227-Q231 WeakPolarHBondContact O-CG 3.37Å; V227-Q231 PolarHBondContact O-N 2.8Å
228T93.3Very high93Very high89 Ų8998.4 Ų98.455%0.54651%0.511SS..Hα-helixtrans-64.9-41.3177.6-52.50000111.2C224 C225 E226 Q231 S232C224-T228 WeakPolarHBondContact O-CB 3.38Å; C224-T228 PolarHBondContact O-N 2.84Å; C224-T228 PolarHBondContact O-OG1 2.84Å; C225-T228 PolarHBondContact O-N 3.4Å; E226-T228 VanDerWaalsContact C-N 3.32Å; E226-T228 PolarHBondContact O-N 3.47Å; T228-Q231 PolarHBondContact O-N 2.76Å; T228-S232 PolarHBondContact O-N 2.88Å
229R95.6Very high93.2Very high134 Ų13493.5 Ų93.551%0.50649%0.492SS..Hα-helixtrans-61-48.5174.3-169-178.970.583.81.1111.3C225 E226 Q231 S232 E233C225-R229 WeakPolarHBondContact O-CB 3.5Å; C225-R229 PolarHBondContact O-N 3.32Å; E226-R229 PolarHBondContact O-N 3Å; E226-R229 IonicContact OE1-NE 3.43Å; E226-R229 PolarHBondContact OE1-NE 3.25Å; E226-R229 IonicContact OE2-CZ 3.25Å; E226-R229 VanDerWaalsContact OE2-CZ 3.25Å; E226-R229 IonicContact OE2-NE 2.9Å; E226-R229 PolarHBondContact OE2-NE 3.09Å; E226-R229 IonicContact OE2-NH2 2.73Å; E226-R229 PolarHBondContact OE2-NH2 3.13Å; R229-Q231 VanDerWaalsContact C-N 3.34Å; R229-Q231 PolarHBondContact O-N 3.38Å; R229-S232 PolarHBondContact O-N 3.33Å; R229-S232 VanDerWaalsContact O-N 3.11Å; R229-S232 PolarHBondContact O-OG 3.21Å; R229-E233 PolarHBondContact O-N 3.35Å
230L96.3Very high93.5Very high115 Ų11594.4 Ų94.460%0.60249%0.494SS*.Hα-helixtrans-60.4-42.1178-176.465000112.1E226 V227 S232 E233 M234E226-L230 WeakPolarHBondContact O-CB 3.23Å; E226-L230 PolarHBondContact O-N 2.94Å; V227-L230 PolarHBondContact O-N 3.02Å; L230-S232 VanDerWaalsContact C-N 3.29Å; L230-S232 PolarHBondContact O-N 3.47Å; L230-E233 PolarHBondContact O-N 3.03Å; L230-M234 WeakPolarHBondContact O-CB 3.43Å; L230-M234 PolarHBondContact O-N 3.12Å
231Q93.3Very high93.5Very high93 Ų9390.8 Ų90.844%0.43549%0.488SS..Hα-helixtrans-61.8-37.6175.6-74.6176.92.800112.1V227 T228 R229 R235V227-Q231 WeakPolarHBondContact O-CB 3.3Å; V227-Q231 VanDerWaalsContact O-CG 3.28Å; V227-Q231 WeakPolarHBondContact O-CG 3.37Å; V227-Q231 PolarHBondContact O-N 2.8Å; T228-Q231 PolarHBondContact O-N 2.76Å; R229-Q231 VanDerWaalsContact C-N 3.34Å; R229-Q231 PolarHBondContact O-N 3.38Å; Q231-R235 VanDerWaalsContact O-CG 3.29Å; Q231-R235 WeakPolarHBondContact O-CG 3.42Å; Q231-R235 PolarHBondContact O-N 2.89Å; Q231-R235 VanDerWaalsContact O-N 3.1Å
232S94.3Very high93.4Very high63 Ų6395.6 Ų95.644%0.44149%0.494SS..Hα-helixtrans-67.1-43.7176.275.20000112.4T228 R229 L230 R235 L236T228-S232 PolarHBondContact O-N 2.88Å; R229-S232 PolarHBondContact O-N 3.33Å; R229-S232 VanDerWaalsContact O-N 3.11Å; R229-S232 PolarHBondContact O-OG 3.21Å; L230-S232 VanDerWaalsContact C-N 3.29Å; L230-S232 PolarHBondContact O-N 3.47Å; S232-R235 PolarHBondContact O-N 2.76Å; S232-L236 PolarHBondContact O-N 2.99Å
233E95.1Very high93.4Very high83 Ų83100.1 Ų100.139%0.38850%0.503SS..Hα-helixtrans-64.9-43.3176.8-72.5-62.7160.300111.9R229 L230 R235 L236 Q237R229-E233 PolarHBondContact O-N 3.35Å; L230-E233 PolarHBondContact O-N 3.03Å; E233-R235 VanDerWaalsContact C-N 3.3Å; E233-R235 PolarHBondContact O-N 2.66Å; E233-L236 WeakPolarHBondContact O-CB 3.35Å; E233-L236 PolarHBondContact O-N 3.3Å; E233-L236 VanDerWaalsContact O-N 3.14Å; E233-Q237 WeakPolarHBondContact O-CB 3.33Å; E233-Q237 WeakPolarHBondContact O-CG 3.47Å; E233-Q237 PolarHBondContact O-N 3.27Å
234M94.4Very high92.9Very high107 Ų10798.6 Ų98.653%0.52750%0.495SS..Hα-helixtrans-60.8-39.8175.8-178177.261.800111.6L230 T238L230-M234 WeakPolarHBondContact O-CB 3.43Å; L230-M234 PolarHBondContact O-N 3.12Å; M234-T238 VanDerWaalsContact O-CB 3.31Å; M234-T238 WeakPolarHBondContact O-CB 3.39Å; M234-T238 PolarHBondContact O-N 2.67Å; M234-T238 PolarHBondContact O-OG1 2.87Å
235R93.8Very high92.6Very high185 Ų185104.8 Ų104.870%0.69851%0.511SS*.Hα-helixtrans-65.3-40.4174.6-75.6176.8-178.8-174.62.7111.7Q231 S232 E233 T238 S239Q231-R235 VanDerWaalsContact O-CG 3.29Å; Q231-R235 WeakPolarHBondContact O-CG 3.42Å; Q231-R235 PolarHBondContact O-N 2.89Å; Q231-R235 VanDerWaalsContact O-N 3.1Å; S232-R235 PolarHBondContact O-N 2.76Å; E233-R235 VanDerWaalsContact C-N 3.3Å; E233-R235 PolarHBondContact O-N 2.66Å; R235-T238 PolarHBondContact O-N 2.83Å; R235-S239 WeakPolarHBondContact O-CB 3.4Å; R235-S239 PolarHBondContact O-N 3.4Å
236L95.4Very high91.8Very high114 Ų114104.5 Ų104.560%0.59751%0.509SS*.Hα-helixtrans-64-48175.9-17467000111.2S232 E233 T238 S239 L240S232-L236 PolarHBondContact O-N 2.99Å; E233-L236 WeakPolarHBondContact O-CB 3.35Å; E233-L236 PolarHBondContact O-N 3.3Å; E233-L236 VanDerWaalsContact O-N 3.14Å; L236-T238 PolarHBondContact O-N 3.11Å; L236-S239 WeakPolarHBondContact O-CB 3.24Å; L236-S239 PolarHBondContact O-N 2.85Å; L236-L240 WeakPolarHBondContact O-CB 3.42Å; L236-L240 PolarHBondContact O-N 2.93Å
237Q93.9Very high90.5Very high126 Ų126105 Ų10559%0.58951%0.514SS*.Hα-helixtrans-60.2-44.9175.8-74.2-177.5-7.800111.8E233 S239 L240 V241E233-Q237 WeakPolarHBondContact O-CB 3.33Å; E233-Q237 WeakPolarHBondContact O-CG 3.47Å; E233-Q237 PolarHBondContact O-N 3.27Å; Q237-S239 VanDerWaalsContact C-N 3.29Å; Q237-S239 PolarHBondContact O-N 2.91Å; Q237-L240 PolarHBondContact O-N 3.43Å; Q237-V241 VanDerWaalsContact O-CG2 3.32Å; Q237-V241 WeakPolarHBondContact O-CG2 3.22Å; Q237-V241 PolarHBondContact O-N 3.19Å
238T92.9Very high89.1Confident67 Ų67107.1 Ų107.141%0.41152%0.522SS..Hα-helixtrans-62.8-38.5177.2-54.70000111.4M234 R235 L236 R242M234-T238 VanDerWaalsContact O-CB 3.31Å; M234-T238 WeakPolarHBondContact O-CB 3.39Å; M234-T238 PolarHBondContact O-N 2.67Å; M234-T238 PolarHBondContact O-OG1 2.87Å; R235-T238 PolarHBondContact O-N 2.83Å; L236-T238 PolarHBondContact O-N 3.11Å; T238-R242 WeakPolarHBondContact O-CB 3.17Å; T238-R242 PolarHBondContact O-N 3.39Å
239S91.8Very high87.5Confident38 Ų38105 Ų10527%0.26652%0.517SS..Hα-helixtrans-65.7-44.2175.2-171.10000111.6R235 L236 Q237 R242 K243R235-S239 WeakPolarHBondContact O-CB 3.4Å; R235-S239 PolarHBondContact O-N 3.4Å; L236-S239 WeakPolarHBondContact O-CB 3.24Å; L236-S239 PolarHBondContact O-N 2.85Å; Q237-S239 VanDerWaalsContact C-N 3.29Å; Q237-S239 PolarHBondContact O-N 2.91Å; S239-R242 PolarHBondContact O-N 3.38Å; S239-K243 WeakPolarHBondContact O-CG 3.22Å; S239-K243 PolarHBondContact O-N 2.83Å
240L93.8Very high85.6Confident100 Ų100105.1 Ų105.152%0.52452%0.524SS..Hα-helixtrans-62.4-46.3176.7-175.465.3000111.5L236 Q237 R242 K243 L244L236-L240 WeakPolarHBondContact O-CB 3.42Å; L236-L240 PolarHBondContact O-N 2.93Å; Q237-L240 PolarHBondContact O-N 3.43Å; L240-R242 VanDerWaalsContact C-N 3.32Å; L240-R242 PolarHBondContact O-N 3.24Å; L240-K243 PolarHBondContact O-N 3.32Å; L240-K243 VanDerWaalsContact O-N 3.1Å; L240-L244 HydrophobicContact CD1-CD1 4.14Å; L240-L244 HydrophobicContact CD1-CG 4.32Å; L240-L244 HydrophobicContact CG-CD1 3.92Å; L240-L244 HydrophobicContact CG-CG 4.43Å; L240-L244 WeakPolarHBondContact O-CG 3.04Å; L240-L244 PolarHBondContact O-N 3.27Å
241V90.4Very high83.4Confident80 Ų80104.4 Ų104.449%0.48552%0.524SS..Hα-helixtrans-60.5-41.5175.7170.40000111.2Q237 K243 L244 R245Q237-V241 VanDerWaalsContact O-CG2 3.32Å; Q237-V241 WeakPolarHBondContact O-CG2 3.22Å; Q237-V241 PolarHBondContact O-N 3.19Å; V241-K243 VanDerWaalsContact C-N 3.33Å; V241-K243 PolarHBondContact O-N 3.4Å; V241-L244 PolarHBondContact O-N 3.41Å; V241-R245 VanDerWaalsContact O-CB 3.31Å; V241-R245 WeakPolarHBondContact O-CB 3.27Å; V241-R245 PolarHBondContact O-N 2.94Å
242R90Very high81.4Confident153 Ų153110 Ų11058%0.57754%0.541SS*.Hα-helixtrans-62.5-37.5174-98.4-178-77.6114.8-3112.8T238 S239 L240 P246T238-R242 WeakPolarHBondContact O-CB 3.17Å; T238-R242 PolarHBondContact O-N 3.39Å; S239-R242 PolarHBondContact O-N 3.38Å; L240-R242 VanDerWaalsContact C-N 3.32Å; L240-R242 PolarHBondContact O-N 3.24Å; R242-P246 VanDerWaalsContact O-CD 3.31Å; R242-P246 WeakPolarHBondContact O-CD 3.47Å
243K90.9Very high79.1Confident154 Ų154115.7 Ų115.767%0.6756%0.561SS**Hα-helixtrans-72.3-34.3176.8-73-178.7178.9-172.30113.3S239 L240 V241 P246S239-K243 WeakPolarHBondContact O-CG 3.22Å; S239-K243 PolarHBondContact O-N 2.83Å; L240-K243 PolarHBondContact O-N 3.32Å; L240-K243 VanDerWaalsContact O-N 3.1Å; V241-K243 VanDerWaalsContact C-N 3.33Å; V241-K243 PolarHBondContact O-N 3.4Å; K243-P246 WeakPolarHBondContact O-CD 3.36Å
244L83.6Confident76.7Confident74 Ų74116.2 Ų116.239%0.38758%0.579SS.*Hα-helixtrans-83.7-22.7179.9-66.4175.5000113.2L240 V241 L247 I248L240-L244 HydrophobicContact CD1-CD1 4.14Å; L240-L244 HydrophobicContact CD1-CG 4.32Å; L240-L244 HydrophobicContact CG-CD1 3.92Å; L240-L244 HydrophobicContact CG-CG 4.43Å; L240-L244 WeakPolarHBondContact O-CG 3.04Å; L240-L244 PolarHBondContact O-N 3.27Å; V241-L244 PolarHBondContact O-N 3.41Å; L244-L247 HydrophobicContact CD2-CD2 4.4Å; L244-L247 WeakPolarHBondContact O-CB 3.36Å; L244-L247 PolarHBondContact O-N 2.83Å; L244-I248 HydrophobicContact CB-CD1 4.43Å; L244-I248 WeakPolarHBondContact O-CG1 3.4Å; L244-I248 PolarHBondContact O-N 2.9Å; L244-I248 VanDerWaalsContact O-N 3.13Å
245R84.3Confident74.4Confident179 Ų179115 Ų11568%0.67559%0.587SS**Hα-helixtrans-54.9-42.1-179-179.8178.8-63.6-139.5-1.9114.2V241 G249V241-R245 VanDerWaalsContact O-CB 3.31Å; V241-R245 WeakPolarHBondContact O-CB 3.27Å; V241-R245 PolarHBondContact O-N 2.94Å; R245-G249 PolarHBondContact O-N 3.11Å
246P76.9Confident71.6Confident79 Ų79111.4 Ų111.451%0.51359%0.59SS.*Hα-helixtrans-65.9-39.6173.8-21.634.2000112.9R242 K243 I248 G249 E250R242-P246 VanDerWaalsContact O-CD 3.31Å; R242-P246 WeakPolarHBondContact O-CD 3.47Å; K243-P246 WeakPolarHBondContact O-CD 3.36Å; P246-I248 VanDerWaalsContact C-N 3.29Å; P246-I248 PolarHBondContact O-N 2.99Å; P246-G249 PolarHBondContact O-N 2.9Å; P246-G249 VanDerWaalsContact O-N 3.09Å; P246-E250 PolarHBondContact O-N 3.45Å
247L68.6Low68.9Low106 Ų106112.4 Ų112.456%0.55560%0.601SS**Hα-helixtrans-65.9-30.8-177.1-160.468.8000112.7L244 T251L244-L247 HydrophobicContact CD2-CD2 4.4Å; L244-L247 WeakPolarHBondContact O-CB 3.36Å; L244-L247 PolarHBondContact O-N 2.83Å; L247-T251 PolarHBondContact O-N 2.86Å; L247-T251 PolarHBondContact O-OG1 3.4Å
248I62.8Low66.4Low111 Ų111111.9 Ų111.957%0.56961%0.606SS**Hα-helixtrans-78.2-28.9175.5-62.3165.3000111.7L244 P246L244-I248 HydrophobicContact CB-CD1 4.43Å; L244-I248 WeakPolarHBondContact O-CG1 3.4Å; L244-I248 PolarHBondContact O-N 2.9Å; L244-I248 VanDerWaalsContact O-N 3.13Å; P246-I248 VanDerWaalsContact C-N 3.29Å; P246-I248 PolarHBondContact O-N 2.99Å
249G59.1Low64.3Low44 Ų44114.5 Ų114.545%0.45462%0.624SS.*Hα-helixtrans-72.1-38.8174.200000112.7R245 P246 R252R245-G249 PolarHBondContact O-N 3.11Å; P246-G249 PolarHBondContact O-N 2.9Å; P246-G249 VanDerWaalsContact O-N 3.09Å; G249-R252 PolarHBondContact O-N 3.21Å
250E55.4Low62Low136 Ų136119 Ų11964%0.63665%0.649SS**Hα-helixtrans-72.6-32.9179.3-72.5174.3175.100112.8P246 R252 Q253P246-E250 PolarHBondContact O-N 3.45Å; E250-R252 VanDerWaalsContact C-N 3.26Å; E250-R252 PolarHBondContact O-N 3.39Å; E250-Q253 PolarHBondContact O-N 3.47Å
251T51.7Low59.6Low100 Ų100123.2 Ų123.261%0.61367%0.667SS**Hα-helixtrans-71.4-17.3176.516.80000113.9L247L247-T251 PolarHBondContact O-N 2.86Å; L247-T251 PolarHBondContact O-OG1 3.4Å
252R49.8Very low57.1Low210 Ų210124.3 Ų124.379%0.79268%0.677SS**THydrogen-bonded Turntrans-82.3-14.1174.5-95.5-165.3-177.7-1413.2114.5G249 E250G249-R252 PolarHBondContact O-N 3.21Å; E250-R252 VanDerWaalsContact C-N 3.26Å; E250-R252 PolarHBondContact O-N 3.39Å
253Q46.9Very low54.8Low184 Ų184124.2 Ų124.286%0.8669%0.687SS**SBendtrans-86.8-9.8176.2-75.1-172.5-400113.6E250E250-Q253 PolarHBondContact O-N 3.47Å
254A44.7Very low52.4Low93 Ų93124.8 Ų124.877%0.76970%0.697SS**SBendtrans-104-4.1-179.400000114.9
255A45Very low50.6Low83 Ų83128.5 Ų128.569%0.68672%0.717SS**  trans-148.694.6175.900000111.2
256S36.2Very low48.5Very low108 Ų108126.4 Ų126.476%0.75572%0.724SS**  trans-14983.7164.8-169.80000110.6
257T39Very low46.5Very low135 Ų135131 Ų13183%0.82874%0.739SS**SBendtrans-116.6120.6150.1-51.60000105.5
258V41.8Very low45.1Very low116 Ų116136 Ų13670%0.70376%0.756SS**SBendtrans83.8126.5176.4-164.10000116.6V260V258-V260 PolarHBondContact O-N 2.81Å
259P47.9Very low43.8Very low122 Ų122137 Ų13779%0.79276%0.763SS**  trans-80.5120.6-177.931.3-31.1000111.5
260V42.3Very low42.5Very low131 Ų131140.5 Ų140.579%0.79477%0.771SS**  trans-94.3112165.4176.40000108.3V258V258-V260 PolarHBondContact O-N 2.81Å
261Q44.2Very low41.4Very low189 Ų189140.7 Ų140.788%0.88378%0.776SS**  trans-86.5109173.8-178.8152.79.800109.5
262C37.7Very low40.7Very low103 Ų103142.5 Ų142.570%0.69678%0.782SS**  trans-165.4133.3164.4-78.50000105.8
263L41.7Very low39.9Very low151 Ų151140.2 Ų140.279%0.79179%0.785SS**  cis-163.1129-5.1-87.2165.5000102.2
264D40.9Very low39.9Very low167 Ų167137 Ų13789%0.89378%0.78SS**  trans-152.989.3159.9-122-46.2000107.5
265D45.8Very low39.3Very low151 Ų151138.7 Ų138.781%0.80778%0.781SS**  trans-111.9119.9163.7-84-36.8000106.4
266V39.3Very low38.7Very low135 Ų135141.2 Ų141.282%0.81878%0.781SS**  trans-162.2121.2133.8160.40000108.6
267E36.4Very low38.4Very low177 Ų177147.6 Ų147.683%0.82779%0.789SS**  trans89.894.2147.4-160.8168.5-137.600119.8
268K39.5Very low37.9Very low210 Ų210145.3 Ų145.391%0.91378%0.784SS**  -167.6150103.5-127.7167.1179171.40114.2
269N34.1Very low38.1Very low132 Ų132146 Ų14671%0.70679%0.79SS**  trans-80.8152.6-156.6-135.8-6.7000115.9
270N31.6Very low37.5Very low118 Ų118143.7 Ų143.763%0.63179%0.789SS**  trans61.7109.6140.4-73.8-15000121.1
271N33.1Very low37.5Very low139 Ų139143.8 Ų143.874%0.74379%0.792SS**  171.4138.597.6-84.8-36.6000113.1
272N35.9Very low37Very low139 Ų139146.1 Ų146.174%0.74379%0.793SS**  trans8891.8153.6-56.3-28.2000121
273L34.9Very low37.6Very low161 Ų161146.6 Ų146.684%0.84380%0.795SS**  54.9129.1128.4-79.6149.5000121.5
274P45.6Very low38Very low117 Ų117144.6 Ų144.676%0.7679%0.791SS**  trans-102.8138.3174.336.9-27.5000113.1
275V33.2Very low37.6Very low129 Ų129142.2 Ų142.278%0.78279%0.787SS**  trans-141.6104.4166.4177.20000112
276I31.8Very low37Very low136 Ų136139.8 Ų139.870%0.69779%0.788SS**  63.1125.8125.7-57.8-177.3000122.4
277R29.7Very low37.1Very low241 Ų241139.2 Ų139.291%0.90979%0.787SS**  trans85.8133.1142.8-88168.3-174.6163.4-0.1123.6
278A28.5Very low37.8Very low88 Ų88136.1 Ų136.173%0.72778%0.783SS**  trans-80.2-171.7155.600000112.1
279P46.9Very low37.9Very low129 Ų129133 Ų13384%0.83878%0.781SS**  cis-131.3169.4-45.931.4-12.3000115.3
280G34Very low38.6Very low74 Ų74132.2 Ų132.276%0.76378%0.783SS**  trans102.9162156.100000117.3
281P43.7Very low38.5Very low133 Ų133132.4 Ų132.486%0.86479%0.793SS**  cis-133.6175.91.438.8-18.4000116.6
282R33.4Very low38.3Very low239 Ų239131.4 Ų131.490%0.90280%0.796SS**  trans-78.5-178.4167.7-105-168.4-88.1-172.6-6.8111.6
283P48.6Very low38.2Very low113 Ų113131 Ų13173%0.73480%0.804SS**  cis-136.6-149.7-0.537.2-11.3000111.8
284P51.1Low38Very low109 Ų109127 Ų12771%0.70880%0.801SS**  cis-143.7171.6-0.643.5-22.5000120.2
285S32.4Very low37.7Very low116 Ų116131 Ų13181%0.81180%0.801SS**  trans97129143.6-57.90000122.5
286A32.4Very low38.1Very low101 Ų101130.6 Ų130.684%0.83580%0.802SS**  trans103.2143.8159.700000118.3
287P41.3Very low38.3Very low122 Ų122128.3 Ų128.379%0.79280%0.796SS**  -108.5168-122.640.1-36.9000116.4
288P51.1Low38.9Very low113 Ų113123.2 Ų123.273%0.73480%0.795SS**  trans-106.7149.3173.837.9-27.8000113
289V43.1Very low39.1Very low145 Ų145123.3 Ų123.388%0.87980%0.796SS**  trans178.7159.8153.1-87.60000110.5
290P47.6Very low38.5Very low115 Ų115124.6 Ų124.675%0.74780%0.8SS**  -137.1171.1-66.734-11.9000113.7
291S31Very low38.3Very low121 Ų121124.8 Ų124.885%0.84680%0.802SS**  trans-76.5139.5170.8-160.70000111.4
292C29.2Very low37.6Very low119 Ų119122.1 Ų122.180%0.80480%0.8SS**  trans-98.8114.7179.3-69.10000111.6
293S33.4Very low38.7Very low129 Ų129116.7 Ų116.790%0.90280%0.795SS**  trans-152.8121.2155.9-87.10000109
294G30Very low38.9Very low77 Ų77117.3 Ų117.379%0.79480%0.799SS**  trans157.494.3175.300000113.2
295R39.2Very low38.1Very low202 Ų202117.2 Ų117.276%0.76281%0.807SS**  trans-73.1161166.7-150.3-177.4-156.3-100.71.9109.9C297R295-C297 PolarHBondContact NH1-SG 3.39Å
296P41.8Very low38Very low121 Ų121115.2 Ų115.279%0.78681%0.805SS**  -137.8153.311617.73.3000114.4
297C36.1Very low38.5Very low87 Ų87116.5 Ų116.559%0.58881%0.805SS**  trans-70170.5172.8-48.20000112.5R295R295-C297 PolarHBondContact NH1-SG 3.39Å
298P43.3Very low38.6Very low135 Ų135116.5 Ų116.588%0.87781%0.805SS**  -133.4167.7108.136.8-26.8000113.8
299A32.3Very low38Very low90 Ų90118.7 Ų118.774%0.74481%0.81SS**  trans-115.6166.2-176.500000112.1
300V33.5Very low38.1Very low155 Ų155117 Ų11794%0.93980%0.802SS**  trans123.7118.4146.9-179.60000114.8
301G29.3Very low37.3Very low78 Ų78118.8 Ų118.880%0.80481%0.805SS**  trans14791.6159.900000114.1
302G30.6Very low37.2Very low78 Ų78117.9 Ų117.980%0.80480%0.799SS**  trans-94.4-176.5-178.500000116.6
303P56.5Low37.6Very low125 Ų125120.7 Ų120.781%0.81281%0.805SS**  trans-110.1-167.1-142.743.8-35.4000114.9
304P52.4Low37.6Very low125 Ų125123.5 Ų123.581%0.81280%0.796SS**  -161.1-178.789.540.5-18000119.5
305A33.8Very low37.7Very low107 Ų107126 Ų12688%0.88479%0.787SS**  trans94.4127.2164.400000116.7
306G30.4Very low37.6Very low74 Ų74124 Ų12476%0.76379%0.791SS**  cis174.1-179900000109.2
307P43Very low37.2Very low128 Ų128123.3 Ų123.383%0.83179%0.788SS**  trans-113.2-160.4-133.843.6-34.9000115.9
308P43.7Very low36.9Very low123 Ų123131.1 Ų131.180%0.79981%0.805SS**  cis-124.2179.6-42.327.7-4.9000114.4
309L37.3Very low36.2Very low159 Ų159134.8 Ų134.883%0.83280%0.803SS**  trans-44.8162.3170-96.6154.8000116.6
310P46.1Very low36.7Very low110 Ų110138.1 Ų138.171%0.71481%0.809SS**  -154.8168.565.140.7-18.1000120.4
311D30.1Very low36.6Very low151 Ų151132.8 Ų132.881%0.80779%0.785SS**  trans60.5130.3143.3-75.1-27000125.8
312S29.6Very low37.2Very low103 Ų103134.8 Ų134.872%0.7278%0.784SS**  trans85.5100.9143-148.30000119.8
313L38Very low37.6Very low177 Ų177142.5 Ų142.593%0.92779%0.789SS**  -159.5130.1103.8-99.7169.7000109.8
314R31.8Very low36.8Very low189 Ų189142.3 Ų142.371%0.71379%0.787SS**  trans-125.5142.2-166.7-169.2-157.2-88.2-88.6-1.5105.8
315E33Very low35.9Very low129 Ų129142.1 Ų142.160%0.60379%0.789SS**  trans65.4141.7170.1-76.6111-148.600115.9
316D36.4Very low35.7Very low161 Ų161145.9 Ų145.986%0.86179%0.788SS**  -144.8144.853.3-83.8-57.1000115.9
317C33.3Very low35.8Very low106 Ų106147.8 Ų147.872%0.71679%0.79SS**  trans-73150.9-178.4-56.50000112.8Y319C317-Y319 PolarHBondContact O-N 3.49Å
318W31.3Very low35.1Very low251 Ų251147.2 Ų147.295%0.95179%0.788SS**  trans-59.5107.9164.5-68.389.3000110.2N320W318-N320 PolarHBondContact O-N 2.83Å
319Y28Very low34.5Very low211 Ų211148.4 Ų148.483%0.82779%0.786SS**  trans-76.6107.5172.8-167.2-97.3000109.5C317C317-Y319 PolarHBondContact O-N 3.49Å
320N42.1Very low34.2Very low161 Ų161145.8 Ų145.886%0.86178%0.777SS**  trans-83.3102.7159.9-76.3-57.8000107.7W318W318-N320 PolarHBondContact O-N 2.83Å
321G32.5Very low33.5Very low43 Ų43149.3 Ų149.344%0.44378%0.784SS.*PPolyproline II helixtrans-86.5149.9172.800000112.4
322P42Very low33.6Very low119 Ų119146 Ų14677%0.77378%0.777SS**PPolyproline II helixtrans-80.7142.5-172.232.8-33.9000112.9
323W38.2Very low33.7Very low241 Ų241148.6 Ų148.691%0.91378%0.782SS**PPolyproline II helixtrans-67.4136.1169.4-65.385.4000110.5S325W323-S325 PolarHBondContact O-N 3.43Å
324P39.5Very low33.4Very low121 Ų121146.6 Ų146.679%0.78678%0.777SS**  trans-79.9108.5170.628.9-27.7000110.2
325S33.3Very low33.2Very low121 Ų121140.6 Ų140.685%0.84677%0.774SS**  trans-74.9121.2157.3-570000108.6W323W323-S325 PolarHBondContact O-N 3.43Å
326Q30.6Very low32.9Very low186 Ų186139.9 Ų139.987%0.86978%0.783SS**  trans-131.6115.5164.2-158.8156.329.500110.2
327S31.2Very low32.7Very low113 Ų113140.6 Ų140.679%0.7978%0.782SS**  trans-121154.8161.5-97.30000108.3
328C28.7Very low33.1Very low117 Ų117140.4 Ų140.479%0.79179%0.787SS**  trans92.5134.2176.7-60.50000115
329L31.1Very low33.1Very low147 Ų147134.5 Ų134.577%0.7778%0.783SS**  cis-174131.5-5.1-165.2121.2000107.4
330V31.9Very low33.5Very low104 Ų104129 Ų12963%0.6378%0.782SS**  trans43.9129.5140.6178.20000122.7
331E31.9Very low33.2Very low185 Ų185127.4 Ų127.486%0.86478%0.777SS**  trans66.7140.4152.7-75.8164.9179.700119.5
332A31.3Very low33.5Very low81 Ų81131.8 Ų131.867%0.66980%0.795SS**  cis-163.6161.617.900000112.1
333L32.4Very low33.8Very low157 Ų157132.9 Ų132.982%0.82279%0.794SS**  trans80.2115.3146.1-69.4148.4000123.1
334V31Very low34.1Very low135 Ų135126.7 Ų126.782%0.81879%0.785SS**  68.9119.4129-177.70000120.2
335G27.4Very low34.6Very low64 Ų64126.6 Ų126.666%0.6678%0.784SS**  112.7111.4128.900000118.4
336S27.8Very low35Very low113 Ų113126.4 Ų126.479%0.7978%0.78SS**  trans62.4130.3144.8-820000123.6
337E30.5Very low35.7Very low177 Ų177123.9 Ų123.983%0.82778%0.78SS**  trans72.1110.4139.3-71.4-177.4149.700121.1
338A41.5Very low36.2Very low101 Ų101125.8 Ų125.884%0.83578%0.78SS**  trans4191.9134.500000117.8
339C32.6Very low36.8Very low127 Ų127127.6 Ų127.686%0.85878%0.782SS**  trans-122.3107.6154.7-87.70000109.5V341C339-V341 PolarHBondContact O-N 3.49Å
340A35.5Very low37Very low97 Ų97129.7 Ų129.780%0.80279%0.788SS**  trans-62.8120.7174.100000110.2V342A340-V342 PolarHBondContact O-N 3.5Å
341V36.2Very low37.2Very low127 Ų127129.4 Ų129.477%0.7780%0.796SS**  trans-74.7105.6168.1175.10000107.6C339 L343C339-V341 PolarHBondContact O-N 3.49Å; V341-L343 PolarHBondContact O-N 2.78Å
342V39.8Very low37.3Very low134 Ų134124.9 Ų124.981%0.81279%0.785SS**  trans-74.6109.6169.5175.70000107.8A340A340-V342 PolarHBondContact O-N 3.5Å
343L47.1Very low38.1Very low142 Ų142129.3 Ų129.374%0.74380%0.796SS**PPolyproline II helixtrans-78.6143167.1-68.9170000109.5V341V341-L343 PolarHBondContact O-N 2.78Å
344P44.2Very low38.3Very low112 Ų112127.8 Ų127.873%0.72779%0.789SS**PPolyproline II helixtrans-70.3148.1173.529.6-31.7000110.4
345P50Low39Very low118 Ų118128.9 Ų128.977%0.76679%0.791SS**PPolyproline II helixtrans-72.2153.1-179.631.7-33.4000110.7
346P43.4Very low39.9Very low118 Ų118131 Ų13177%0.76680%0.796SS**PPolyproline II helixtrans-69.5141.1176.429.9-32.1000109.7L348P346-L348 PolarHBondContact O-N 2.89Å
347P43.9Very low40.9Very low133 Ų133130.8 Ų130.886%0.86479%0.794SS**PPolyproline II helixtrans-69123.6178.326.1-30.4000110.5
348L41.7Very low41.9Very low153 Ų153133.4 Ų133.480%0.80180%0.796SS**PPolyproline II helixtrans-71.3129.9172.5-170.574.3000109.9P346P346-L348 PolarHBondContact O-N 2.89Å
349N42.6Very low42.3Very low154 Ų154134.1 Ų134.182%0.82480%0.795SS**  trans8107.9160.2-76.6-45.1000116.9
350Q33.7Very low43.1Very low192 Ų192136.9 Ų136.990%0.89779%0.792SS**  trans-121123.5154.9-71.5-113.5-16.500108.1
351A36.9Very low43.9Very low98 Ų98137.9 Ų137.981%0.8179%0.791SS**  trans-63.4127.6-174.800000111.9
352S34.1Very low44.7Very low89 Ų89137 Ų13762%0.62279%0.791SS**  trans-76.5115.6159.9178.60000108.1D354S352-D354 VanDerWaalsContact C-N 3.34Å; S352-D354 PolarHBondContact O-N 2.96Å; S352-D354 PolarHBondContact OG-OD2 2.93Å
353L47.8Very low45.2Very low174 Ų174136.2 Ų136.291%0.91179%0.788SS**  trans-77.588.4162.6-83.5167.7000107.8D355L353-D355 PolarHBondContact O-N 3.17Å
354D37.3Very low45.7Very low125 Ų125135.1 Ų135.167%0.66879%0.79SS**  trans-78.596.6166.6-76.3-72.4000109.6S352 S356S352-D354 VanDerWaalsContact C-N 3.34Å; S352-D354 PolarHBondContact O-N 2.96Å; S352-D354 PolarHBondContact OG-OD2 2.93Å; D354-S356 PolarHBondContact O-N 3.34Å
355D45.3Very low46.3Very low159 Ų159137.8 Ų137.885%0.8579%0.789SS**  trans-73.473.7161.5-173.531.3000109.3L353L353-D355 PolarHBondContact O-N 3.17Å
356S45.7Very low46.6Very low109 Ų109138.2 Ų138.276%0.76279%0.793SS**  trans-152.753.9167.3-85.50000110.6D354 R358D354-S356 PolarHBondContact O-N 3.34Å; S356-R358 VanDerWaalsContact C-N 3.31Å; S356-R358 PolarHBondContact O-N 2.81Å; S356-R358 VanDerWaalsContact O-N 3.11Å
357S49.6Very low47.1Very low107 Ų107138.7 Ų138.775%0.74879%0.793SS**  trans-80.478.4166.2-64.40000110.1
358R50.7Low47.5Very low233 Ų233139 Ų13988%0.87979%0.788SS**  trans-126.669.3158-70.4-171.2-176.4-98.60.3109.2S356 F360S356-R358 VanDerWaalsContact C-N 3.31Å; S356-R358 PolarHBondContact O-N 2.81Å; S356-R358 VanDerWaalsContact O-N 3.11Å; R358-F360 PolarHBondContact O-N 3.18Å
359S49.8Very low47.9Very low115 Ų115135.4 Ų135.480%0.80478%0.78SS**PPolyproline II helixtrans-69.6119165.8-16.40000108.2
360F50.1Low48.4Very low185 Ų185135.7 Ų135.781%0.81178%0.778SS**PPolyproline II helixtrans-68.5137.3166.5-77.9-90.6000109.2R358R358-F360 PolarHBondContact O-N 3.18Å
361P51.7Low49.1Very low119 Ų119134.2 Ų134.277%0.77377%0.769SS**PPolyproline II helixtrans-63.4140.6176.126.6-32.5000110
362S52.7Low49.7Very low109 Ų109139.8 Ų139.876%0.76277%0.77SS**PPolyproline II helixtrans-58.8143.2173.2-51.70000110.3
363P51.5Low50.3Low116 Ų116143.4 Ų143.475%0.75378%0.776SS**PPolyproline II helixtrans-61.3143.5178.724.2-31000110.4
364P56.5Low49.9Very low120 Ų120138 Ų13878%0.77976%0.763SS**PPolyproline II helixtrans-61.3143.4-177.423.9-32000111
365K58.1Low50.1Low167 Ų167141.2 Ų141.273%0.72677%0.774SS**PPolyproline II helixtrans-64.3143.3176.5-72174.9180171.60109.7T367 D368K365-T367 PolarHBondContact O-N 2.94Å; K365-D368 PolarHBondContact O-N 3.41Å
366P56.3Low49.7Very low128 Ų128139.2 Ų139.283%0.83177%0.772SS**THydrogen-bonded Turntrans-64.8-5.3-173.223.6-32.9000115.2
367T53.4Low49.3Very low128 Ų128142.3 Ų142.379%0.78578%0.78SS**THydrogen-bonded Turntrans-90.1-3.5-178.549.50000114.8K365K365-T367 PolarHBondContact O-N 2.94Å
368D51.3Low48.6Very low140 Ų140140.4 Ų140.475%0.74978%0.778SS**  trans-117.28.6-173.4-122.6-2.7000114.2K365 M370K365-D368 PolarHBondContact O-N 3.41Å; D368-M370 VanDerWaalsContact C-N 3.31Å; D368-M370 PolarHBondContact O-N 3.48Å
369A51Low47.8Very low77 Ų77135 Ų13564%0.63678%0.775SS**  trans-8568.1178.700000111.6F371A369-F371 PolarHBondContact O-N 3.19Å
370M52.5Low47.2Very low159 Ų159137.1 Ų137.178%0.78378%0.778SS**THydrogen-bonded Turntrans-71.716.1173.2-67.3-73.1-115.500113.6D368D368-M370 VanDerWaalsContact C-N 3.31Å; D368-M370 PolarHBondContact O-N 3.48Å
371F49.5Very low46.5Very low161 Ų161134.4 Ų134.471%0.70678%0.781SS**THydrogen-bonded Turntrans-90-10.3-170.6-172-107000114.3A369A369-F371 PolarHBondContact O-N 3.19Å
372W48.3Very low45.9Very low216 Ų216134 Ų13482%0.81878%0.782SS**  trans-119.910.7-173.8-66.8115.5000116.1G374W372-G374 VanDerWaalsContact C-N 3.29Å; W372-G374 PolarHBondContact O-N 3.49Å
373E46.3Very low45Very low164 Ų164134.6 Ų134.677%0.76679%0.786SS**  trans-83.176.4-179.1-138.8150.8-13600111.8
374G40.3Very low44.2Very low62 Ų62134.3 Ų134.364%0.63979%0.786SS**  trans-62.5128.5165.900000110.5W372 S376W372-G374 VanDerWaalsContact C-N 3.29Å; W372-G374 PolarHBondContact O-N 3.49Å; G374-S376 PolarHBondContact O-N 2.79Å
375H42.5Very low43.4Very low192 Ų192137 Ų13789%0.88979%0.793SS**  trans-58.4122.6-176.3-6217.4000111.3
376S35.5Very low42.2Very low116 Ų116132 Ų13281%0.81179%0.789SS**  trans-13394.7161.145.20000109.1G374 G378G374-S376 PolarHBondContact O-N 2.79Å; S376-G378 PolarHBondContact O-N 2.79Å
377N37.7Very low41.2Very low175 Ų175133.6 Ų133.694%0.93679%0.791SS**  trans-66.3125.8162.5-94.415.6000108.9
378G35.4Very low40.3Very low67 Ų67137.5 Ų137.569%0.69180%0.797SS**  trans135.3103.1146.200000117.2S376S376-G378 PolarHBondContact O-N 2.79Å
379S33.5Very low39.8Very low119 Ų119136.9 Ų136.983%0.83280%0.798SS**  trans100.195.7141-47.50000118.8
380N37.7Very low39.5Very low160 Ų160139 Ų13986%0.85681%0.806SS**  trans31119.1132.4-66.9-3.2000119.4
381S34.7Very low38.8Very low127 Ų127140.4 Ų140.489%0.88881%0.813SS**  -166.9142.2108.8160000112.1
382S39.7Very low38.6Very low111 Ų111138 Ų13878%0.77682%0.816SS**  trans-77.3149.8-174.153.20000114.8
383S34.4Very low38.5Very low121 Ų121133.4 Ų133.485%0.84681%0.814SS**  trans145.9152.4140.654.80000108.8
384S34Very low38.8Very low110 Ų110131.5 Ų131.577%0.76982%0.816SS**  cis-170.8145.9-20.3163.20000103.2
385L39.8Very low38.8Very low177 Ų177134.1 Ų134.193%0.92782%0.824SS**  trans-50.9150178.4-78.978.2000113.4
386G32.9Very low38.8Very low61 Ų61130 Ų13063%0.62982%0.823SS**  trans-175.192162.600000113.4
387N35.6Very low39.2Very low163 Ų163132.3 Ų132.387%0.87282%0.821SS**  trans-59.7139.8168.9-77-15000111.4
388F33Very low39.4Very low209 Ų209135 Ų13592%0.91782%0.818SS**  trans-119.6122.2165.2-81.2-83.1000110.6
389T41.9Very low39.7Very low127 Ų127136.7 Ų136.778%0.77983%0.826SS**  trans-114.7140.8165.5-41.30000107.3
390P44.4Very low40.1Very low121 Ų121140.8 Ų140.879%0.78683%0.829SS**PPolyproline II helixtrans-85.9137.7-17033.3-32.7000112.2
391M37.7Very low41Very low190 Ų190138.2 Ų138.294%0.93682%0.821SS**PPolyproline II helixtrans-95.7132.9170.4-86.5-70.7-162.400110.7
392S44.9Very low41.3Very low110 Ų110146.5 Ų146.577%0.76984%0.835SS**PPolyproline II helixtrans-71.6155.6170.7-54.40000112.2
393P47.7Very low41.4Very low120 Ų120148.3 Ų148.378%0.77984%0.838SS**PPolyproline II helixtrans-83.6147.7179.332.5-31.6000112.2
394P51.8Low41.8Very low124 Ų124149.7 Ų149.781%0.80584%0.838SS**PPolyproline II helixtrans-88.4139.8176.934-29.8000111.9
395S41.1Very low42.2Very low117 Ų117151.9 Ų151.982%0.81884%0.841SS**PPolyproline II helixtrans-60134.5159.250.50000111.4
396A42.4Very low42.3Very low105 Ų105150.5 Ų150.587%0.86884%0.836SS**  trans-143.8118.7159.300000110.4
397E43.4Very low42.9Very low165 Ų165156.1 Ų156.177%0.77185%0.849SS**  trans-89.7138.7-177.7-93.5-162.4141.200111.4
398W42.3Very low43.4Very low230 Ų230155.6 Ų155.687%0.87185%0.848SS**  trans60.8117.6146-58.654.6000120.6
399A40.3Very low44.1Very low104 Ų104151.8 Ų151.886%0.8684%0.843SS**  -170.6112.6129.700000111.7
400K43Very low44.3Very low204 Ų204153.7 Ų153.789%0.88785%0.848SS**  trans-83.8164.1141.4-84-175.8178.9-177.60107
401P55.3Low44.3Very low106 Ų106156.4 Ų156.469%0.68885%0.853SS**  cis-141.3163.725.638.2-18.4000116.3
402Y41.9Very low44.9Very low302 Ų302153.4 Ų153.4100%1.18485%0.846SS**  -1650117.5-102.9-74.1000109.1

Retrieved 402 of 402 residues in 399.2 ms (Link to these results)