A0A060YYH2_ONCMY Loading...

cAMP-responsive element-binding protein-like 2

AlphaFold DB , UniProt , Accession A0A060YYH2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC118942856, Length 114 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M52.6Low46.8Very low231 Ų231150.5 Ų150.5100%1.13885%0.852SS**  097.10-75.4154.4168.400106.8
2D45.1Very low47.6Very low159 Ų159154.3 Ų154.385%0.8585%0.851SS**  -176.1104.1108-110.3-89.8000108.2
3D45.3Very low48.3Very low152 Ų152157.4 Ų157.481%0.81385%0.851SS**  trans-67.2128.6171.3-85.2-98.4000110.3
4S47.8Very low49.1Very low120 Ų120156.6 Ų156.684%0.83986%0.858SS**  trans-144.781.7158.7-87.20000111.5
5K42.1Very low49.7Very low183 Ų183150.1 Ų150.180%0.79684%0.842SS**  58.488.6124.9-159.3162.5-175.9168.10116.6V7K5-V7 HydrophobicContact CG-CG2 4.19Å; K5-V7 PolarHBondContact O-N 2.87Å
6M44.4Very low50.1Low195 Ų195152.6 Ų152.696%0.96184%0.84SS**  trans-57121.4150.9-76.9-176.3173.800110.1
7V43Very low50.6Low118 Ų118158.8 Ų158.872%0.71585%0.848SS**  trans-129.9117.1158.9159.40000108.2K5 G9K5-V7 HydrophobicContact CG-CG2 4.19Å; K5-V7 PolarHBondContact O-N 2.87Å; V7-G9 PolarHBondContact O-N 3.1Å
8G49.3Very low51.2Low85 Ų85153.9 Ų153.988%0.87684%0.841SS**  trans-62117.917300000111.2
9G41.3Very low51.6Low57 Ų57156.9 Ų156.959%0.58884%0.839SS**  trans-125.1110165.600000108.4V7 V11V7-G9 PolarHBondContact O-N 3.1Å; G9-V11 VanDerWaalsContact O-CG2 3.32Å; G9-V11 WeakPolarHBondContact O-CG2 3.29Å; G9-V11 PolarHBondContact O-N 3.3Å
10K51.2Low52Low214 Ų214158.3 Ų158.393%0.9384%0.837SS**  trans-4385.2177.5-156.5167.9-174.7170.90113.1K12K10-K12 PolarHBondContact O-N 3.24Å
11V52.5Low52.6Low142 Ų142155.6 Ų155.686%0.86183%0.829SS**  trans-79.5122.7174.7-168.60000109.4G9 K13G9-V11 VanDerWaalsContact O-CG2 3.32Å; G9-V11 WeakPolarHBondContact O-CG2 3.29Å; G9-V11 PolarHBondContact O-N 3.3Å; V11-K13 PolarHBondContact O-N 2.96Å
12K56.5Low53.4Low195 Ų195148.2 Ų148.285%0.84881%0.805SS**  trans-61.6122.7-172-64.6-178.3175.3174.30112.6K10K10-K12 PolarHBondContact O-N 3.24Å
13K57.4Low54.3Low195 Ų195150.9 Ų150.985%0.84881%0.809SS**  trans39.9109.9152.8-64.9-174.6174.7-179.80118.5V11 G15V11-K13 PolarHBondContact O-N 2.96Å; K13-G15 PolarHBondContact O-N 3.36Å; K13-G15 VanDerWaalsContact O-N 3.1Å
14P58.9Low55.4Low147 Ų147147.4 Ų147.496%0.95579%0.789SS**  trans-8186.1160.833.5-29.1000108.9
15G58.8Low57.1Low59 Ų59146.4 Ų146.461%0.60878%0.775SS**  trans-152.339.4-16700000116.1K13K13-G15 PolarHBondContact O-N 3.36Å; K13-G15 VanDerWaalsContact O-N 3.1Å
16K55.3Low59.2Low189 Ų189144.1 Ų144.182%0.82277%0.77SS**  trans-144.440.7160.8-69.3-163.6-178.5179.90112.5G18K16-G18 PolarHBondContact O-N 2.88Å
17R59.4Low61.4Low259 Ų259142.6 Ų142.698%0.97776%0.758SS**THydrogen-bonded Turntrans-79.3109.1155.7-84.7177148.2158-6.6106.7
18G60.8Low63.6Low70 Ų70138.6 Ų138.672%0.72274%0.738SS**THydrogen-bonded Turntrans11917.8174.800000116.9K16 K20K16-G18 PolarHBondContact O-N 2.88Å; G18-K20 VanDerWaalsContact C-N 3.33Å; G18-K20 PolarHBondContact O-N 3.43Å
19R59.7Low65.7Low211 Ų211140.9 Ų140.980%0.79672%0.723SS**  trans-64.7103.7160.1-168.7177.4-175.2-138.62.1106.7
20K58.8Low68.3Low184 Ų184141.9 Ų141.980%0.872%0.715SS**  trans-44126.2170.4-69.8179.4178.7179.10106.7G18 A22G18-K20 VanDerWaalsContact C-N 3.33Å; G18-K20 PolarHBondContact O-N 3.43Å; K20-A22 PolarHBondContact O-N 3.05Å
21P64.5Low70.4Confident103 Ų103135.5 Ų135.567%0.66969%0.688SS**  trans-52.7120.9174.718.9-28.1000106.7K23P21-K23 PolarHBondContact O-N 3.42Å
22A68.8Low72.5Confident76 Ų76134.7 Ų134.763%0.62867%0.67SS**SBendtrans-47.5131.3172.500000106.8K20 I24K20-A22 PolarHBondContact O-N 3.05Å; A22-I24 VanDerWaalsContact C-N 3.27Å; A22-I24 WeakPolarHBondContact O-CA 3.43Å; A22-I24 PolarHBondContact O-N 3.21Å
23K65.1Low74.3Confident215 Ų215129 Ų12994%0.93566%0.655SS**  trans-23.390.5-172.2-79.1177.2178.4176.50110.2P21 D25P21-K23 PolarHBondContact O-N 3.42Å; K23-D25 PolarHBondContact O-N 2.89Å
24I67.2Low76.3Confident79 Ų79126 Ų12641%0.40564%0.638SS.*  trans-70.7126.9-176.5-157.1155.2000104.4A22 L26 K29A22-I24 VanDerWaalsContact C-N 3.27Å; A22-I24 WeakPolarHBondContact O-CA 3.43Å; A22-I24 PolarHBondContact O-N 3.21Å; I24-L26 PolarHBondContact O-N 2.74Å; I24-K29 HydrophobicContact CG2-CB 4.06Å; I24-K29 HydrophobicContact CG2-CD 4.25Å
25D83.4Confident78.1Confident99 Ų99122.9 Ų122.953%0.52961%0.611SS.*  trans-50.8123.9-179.6176.518000108.1K23 K27 A28 K29K23-D25 PolarHBondContact O-N 2.89Å; D25-K27 PolarHBondContact O-N 3.5Å; D25-K27 VanDerWaalsContact O-N 3.17Å; D25-K27 PolarHBondContact OD1-N 2.99Å; D25-K27 WeakPolarHBondContact OD2-CB 3.45Å; D25-A28 HydrophobicContact CB-CB 4.05Å; D25-A28 WeakPolarHBondContact O-CA 3.47Å; D25-A28 WeakPolarHBondContact O-CB 3.35Å; D25-A28 PolarHBondContact O-N 3.3Å; D25-K29 PolarHBondContact O-N 2.91Å
26L86.8Confident80Confident135 Ų135122.9 Ų122.971%0.70760%0.601SS**Hα-helixtrans-55.1-37.1-175.4179.266.1000109.6I24 K29 L30I24-L26 PolarHBondContact O-N 2.74Å; L26-K29 PolarHBondContact O-N 3.24Å; L26-L30 WeakPolarHBondContact O-CB 3.33Å; L26-L30 PolarHBondContact O-N 3.32Å
27K89.9Confident82Confident163 Ų163116 Ų11671%0.70958%0.58SS**Hα-helixtrans-60.5-46.2174-173.9179.3-179.3178.70111.8D25 K29 L30 E31D25-K27 PolarHBondContact O-N 3.5Å; D25-K27 VanDerWaalsContact O-N 3.17Å; D25-K27 PolarHBondContact OD1-N 2.99Å; D25-K27 WeakPolarHBondContact OD2-CB 3.45Å; K27-K29 PolarHBondContact O-N 3.34Å; K27-L30 PolarHBondContact O-N 3.22Å; K27-E31 WeakPolarHBondContact O-CB 3.46Å; K27-E31 PolarHBondContact O-N 3.03Å
28A90.4Very high83.9Confident34 Ų34109.3 Ų109.328%0.28156%0.555SS.*Hα-helixtrans-65.6-35.7176.900000113.1D25 R32D25-A28 HydrophobicContact CB-CB 4.05Å; D25-A28 WeakPolarHBondContact O-CA 3.47Å; D25-A28 WeakPolarHBondContact O-CB 3.35Å; D25-A28 PolarHBondContact O-N 3.3Å; A28-R32 VanDerWaalsContact O-CZ 3.3Å; A28-R32 PolarHBondContact O-N 3.4Å; A28-R32 VanDerWaalsContact O-N 3.15Å; A28-R32 PolarHBondContact O-NH2 3.33Å
29K93.8Very high85.7Confident132 Ų132110 Ų11057%0.57454%0.54SS*.Hα-helixtrans-67.4-44.2175-173.3178.2178-177.30111.5I24 D25 L26 K27 E31 R32 S33I24-K29 HydrophobicContact CG2-CB 4.06Å; I24-K29 HydrophobicContact CG2-CD 4.25Å; D25-K29 PolarHBondContact O-N 2.91Å; L26-K29 PolarHBondContact O-N 3.24Å; K27-K29 PolarHBondContact O-N 3.34Å; K29-E31 VanDerWaalsContact C-N 3.34Å; K29-R32 VanDerWaalsContact CA-NH2 3.27Å; K29-R32 PolarHBondContact O-N 3.34Å; K29-S33 PolarHBondContact O-N 3.41Å; K29-S33 VanDerWaalsContact O-N 3.1Å
30L95.3Very high87.5Confident79 Ų79103.5 Ų103.541%0.41453%0.525SS..Hα-helixtrans-64.8-40.7180-162.3150.1000110.8L26 K27 S33 R34L26-L30 WeakPolarHBondContact O-CB 3.33Å; L26-L30 PolarHBondContact O-N 3.32Å; K27-L30 PolarHBondContact O-N 3.22Å; L30-S33 PolarHBondContact O-N 3.49Å; L30-R34 HydrophobicContact CD2-CG 4.21Å; L30-R34 VanDerWaalsContact CD2-NH2 3.31Å; L30-R34 WeakPolarHBondContact O-CG 3.45Å; L30-R34 PolarHBondContact O-N 3.37Å
31E96.2Very high89.4Confident79 Ų79104.1 Ų104.137%0.36952%0.523SS..Hα-helixtrans-68.2-39.2178.1-160.254-139.500112.9K27 K29 S33 R34 Q35 R38K27-E31 WeakPolarHBondContact O-CB 3.46Å; K27-E31 PolarHBondContact O-N 3.03Å; K29-E31 VanDerWaalsContact C-N 3.34Å; E31-S33 VanDerWaalsContact C-N 3.31Å; E31-S33 PolarHBondContact O-N 2.97Å; E31-R34 PolarHBondContact O-N 2.9Å; E31-R34 WeakPolarHBondContact OE2-CD 3.4Å; E31-R34 IonicContact OE2-NH1 2.74Å; E31-R34 PolarHBondContact OE2-NH1 3.16Å; E31-R34 VanDerWaalsContact OE2-NH1 3.11Å; E31-Q35 WeakPolarHBondContact O-CB 3.46Å; E31-Q35 PolarHBondContact O-N 3.05Å; E31-R38 IonicContact OE1-CZ 3.95Å; E31-R38 IonicContact OE1-NH1 3.76Å; E31-R38 IonicContact OE1-NH2 3.11Å; E31-R38 PolarHBondContact OE1-NH2 2.92Å
32R94.6Very high91.1Very high125 Ų125102 Ų10247%0.47251%0.514SS..Hα-helixtrans-60.5-39.6171.7-79.2-171.4-63.9-83.6-14.5112.7A28 K29 Q35 S36A28-R32 VanDerWaalsContact O-CZ 3.3Å; A28-R32 PolarHBondContact O-N 3.4Å; A28-R32 VanDerWaalsContact O-N 3.15Å; A28-R32 PolarHBondContact O-NH2 3.33Å; K29-R32 VanDerWaalsContact CA-NH2 3.27Å; K29-R32 PolarHBondContact O-N 3.34Å; R32-Q35 PolarHBondContact O-N 3.01Å; R32-S36 PolarHBondContact O-N 3.41Å; R32-S36 PolarHBondContact O-OG 3.3Å
33S96.2Very high92.5Very high77 Ų77106 Ų10654%0.53851%0.513SS..Hα-helixtrans-67.3-38176.8-168.80000112.3K29 L30 E31 Q35 S36 A37K29-S33 PolarHBondContact O-N 3.41Å; K29-S33 VanDerWaalsContact O-N 3.1Å; L30-S33 PolarHBondContact O-N 3.49Å; E31-S33 VanDerWaalsContact C-N 3.31Å; E31-S33 PolarHBondContact O-N 2.97Å; S33-Q35 VanDerWaalsContact C-N 3.35Å; S33-S36 PolarHBondContact O-OG 3.26Å; S33-A37 WeakPolarHBondContact O-CB 3.27Å; S33-A37 PolarHBondContact O-N 2.96Å
34R98.1Very high94.1Very high132 Ų132101.3 Ų101.350%0.49849%0.493SS..Hα-helixtrans-64.5-43.2173.7-73.3173.2172160.5-1111L30 E31 A37 R38L30-R34 HydrophobicContact CD2-CG 4.21Å; L30-R34 VanDerWaalsContact CD2-NH2 3.31Å; L30-R34 WeakPolarHBondContact O-CG 3.45Å; L30-R34 PolarHBondContact O-N 3.37Å; E31-R34 PolarHBondContact O-N 2.9Å; E31-R34 WeakPolarHBondContact OE2-CD 3.4Å; E31-R34 IonicContact OE2-NH1 2.74Å; E31-R34 PolarHBondContact OE2-NH1 3.16Å; E31-R34 VanDerWaalsContact OE2-NH1 3.11Å; R34-A37 PolarHBondContact O-N 3.21Å; R34-R38 WeakPolarHBondContact O-CG 3.27Å; R34-R38 PolarHBondContact O-N 3.48Å
35Q98.1Very high95.6Very high80 Ų80105 Ų10537%0.37451%0.506SS..Hα-helixtrans-64.7-46-179.2-173.157.820.300112.1E31 R32 S33 A37 R38 E39E31-Q35 WeakPolarHBondContact O-CB 3.46Å; E31-Q35 PolarHBondContact O-N 3.05Å; R32-Q35 PolarHBondContact O-N 3.01Å; S33-Q35 VanDerWaalsContact C-N 3.35Å; Q35-A37 VanDerWaalsContact C-N 3.27Å; Q35-A37 PolarHBondContact O-N 2.98Å; Q35-R38 WeakPolarHBondContact O-CB 3.31Å; Q35-R38 PolarHBondContact O-N 2.99Å; Q35-R38 VanDerWaalsContact O-N 3.13Å; Q35-E39 WeakPolarHBondContact CG-OE1 3.27Å; Q35-E39 PolarHBondContact NE2-OE1 2.94Å; Q35-E39 WeakPolarHBondContact O-CG 3.33Å; Q35-E39 PolarHBondContact O-N 3.13Å
36S97.8Very high96.3Very high59 Ų59105.7 Ų105.741%0.41351%0.509SS..Hα-helixtrans-61.6-36.5176.465.10000112.4R32 S33 C40R32-S36 PolarHBondContact O-N 3.41Å; R32-S36 PolarHBondContact O-OG 3.3Å; S33-S36 PolarHBondContact O-OG 3.26Å; S36-C40 WeakPolarHBondContact O-CB 3.48Å; S36-C40 PolarHBondContact O-N 3.47Å
37A98.1Very high96.9Very high46 Ų46107.6 Ų107.638%0.3851%0.507SS..Hα-helixtrans-66.3-41.9174.200000112.2S33 R34 Q35 C40 R41S33-A37 WeakPolarHBondContact O-CB 3.27Å; S33-A37 PolarHBondContact O-N 2.96Å; R34-A37 PolarHBondContact O-N 3.21Å; Q35-A37 VanDerWaalsContact C-N 3.27Å; Q35-A37 PolarHBondContact O-N 2.98Å; A37-C40 WeakPolarHBondContact O-CB 3.46Å; A37-C40 PolarHBondContact O-N 3.44Å; A37-R41 WeakPolarHBondContact O-CG 3.39Å; A37-R41 PolarHBondContact O-N 3.34Å; A37-R41 VanDerWaalsContact O-N 3.17Å
38R98.5Very high97.3Very high117 Ų117105.9 Ų105.944%0.44250%0.497SS..Hα-helixtrans-61.6-48.2174.2-75.4-172.8-75.8-107.41.3111.4E31 R34 Q35 C40 R41 A42E31-R38 IonicContact OE1-CZ 3.95Å; E31-R38 IonicContact OE1-NH1 3.76Å; E31-R38 IonicContact OE1-NH2 3.11Å; E31-R38 PolarHBondContact OE1-NH2 2.92Å; R34-R38 WeakPolarHBondContact O-CG 3.27Å; R34-R38 PolarHBondContact O-N 3.48Å; Q35-R38 WeakPolarHBondContact O-CB 3.31Å; Q35-R38 PolarHBondContact O-N 2.99Å; Q35-R38 VanDerWaalsContact O-N 3.13Å; R38-C40 VanDerWaalsContact C-N 3.31Å; R38-C40 PolarHBondContact O-N 2.96Å; R38-R41 PolarHBondContact O-N 3.33Å; R38-A42 WeakPolarHBondContact O-CB 3.48Å; R38-A42 PolarHBondContact O-N 3.25Å
39E98.4Very high97.7Very high86 Ų86108.5 Ų108.540%0.40250%0.503SS..Hα-helixtrans-63.1-35.7177.7-73.2170.1-167.400112.6Q35 A42 R43Q35-E39 WeakPolarHBondContact CG-OE1 3.27Å; Q35-E39 PolarHBondContact NE2-OE1 2.94Å; Q35-E39 WeakPolarHBondContact O-CG 3.33Å; Q35-E39 PolarHBondContact O-N 3.13Å; E39-A42 PolarHBondContact O-N 3.08Å; E39-R43 VanDerWaalsContact O-CB 3.28Å; E39-R43 WeakPolarHBondContact O-CB 3.43Å; E39-R43 VanDerWaalsContact O-CG 3.26Å; E39-R43 WeakPolarHBondContact O-CG 3.23Å; E39-R43 PolarHBondContact O-N 3.32Å; E39-R43 PolarHBondContact O-NE 3.49Å
40C98.5Very high97.9Very high73 Ų73108.7 Ų108.749%0.49350%0.501SS..Hα-helixtrans-60-47.6173.3-177.90000111.2S36 A37 R38 R43 K44S36-C40 WeakPolarHBondContact O-CB 3.48Å; S36-C40 PolarHBondContact O-N 3.47Å; A37-C40 WeakPolarHBondContact O-CB 3.46Å; A37-C40 PolarHBondContact O-N 3.44Å; R38-C40 VanDerWaalsContact C-N 3.31Å; R38-C40 PolarHBondContact O-N 2.96Å; C40-R43 PolarHBondContact O-N 3.05Å; C40-K44 WeakPolarHBondContact O-CB 3.3Å; C40-K44 PolarHBondContact O-N 2.91Å
41R98.6Very high98.1Very high197 Ų197108.7 Ų108.774%0.74350%0.501SS*.Hα-helixtrans-64.5-45.8177.6-65.8175-173.8-160.60.9111.7A37 R38 R43 K44 K45A37-R41 WeakPolarHBondContact O-CG 3.39Å; A37-R41 PolarHBondContact O-N 3.34Å; A37-R41 VanDerWaalsContact O-N 3.17Å; R38-R41 PolarHBondContact O-N 3.33Å; R41-R43 PolarHBondContact O-N 2.84Å; R41-K44 PolarHBondContact O-N 3.29Å; R41-K45 PolarHBondContact O-N 3.03Å
42A98.6Very high98.2Very high60 Ų60111.2 Ų111.250%0.49651%0.513SS..Hα-helixtrans-60-45.5178.400000111.7R38 E39 K44 K45 L46R38-A42 WeakPolarHBondContact O-CB 3.48Å; R38-A42 PolarHBondContact O-N 3.25Å; E39-A42 PolarHBondContact O-N 3.08Å; A42-K44 PolarHBondContact O-N 2.89Å; A42-K45 PolarHBondContact O-N 3.47Å; A42-L46 PolarHBondContact O-N 3.08Å
43R98.6Very high98.4Very high159 Ų159110.3 Ų110.360%0.651%0.514SS*.Hα-helixtrans-62.8-41.8176-76.3-177-70.3-168.1-3.1112.6E39 C40 R41 L46 R47E39-R43 VanDerWaalsContact O-CB 3.28Å; E39-R43 WeakPolarHBondContact O-CB 3.43Å; E39-R43 VanDerWaalsContact O-CG 3.26Å; E39-R43 WeakPolarHBondContact O-CG 3.23Å; E39-R43 PolarHBondContact O-N 3.32Å; E39-R43 PolarHBondContact O-NE 3.49Å; C40-R43 PolarHBondContact O-N 3.05Å; R41-R43 PolarHBondContact O-N 2.84Å; R43-L46 PolarHBondContact O-N 3.39Å; R43-R47 WeakPolarHBondContact O-CB 3.38Å; R43-R47 PolarHBondContact O-N 3.46Å
44K98.8Very high98.5Very high116 Ų116109.7 Ų109.750%0.50450%0.504SS..Hα-helixtrans-62.1-44.8176.2-176.3174177.2175.60111.2C40 R41 A42 R47 Y48C40-K44 WeakPolarHBondContact O-CB 3.3Å; C40-K44 PolarHBondContact O-N 2.91Å; R41-K44 PolarHBondContact O-N 3.29Å; A42-K44 PolarHBondContact O-N 2.89Å; K44-R47 PolarHBondContact O-N 3.22Å; K44-Y48 HydrophobicContact CD-CE2 4.1Å; K44-Y48 VanDerWaalsContact CE-CZ 3.47Å; K44-Y48 WeakPolarHBondContact CE-OH 3.39Å; K44-Y48 HydrophobicContact CG-CD2 4.11Å; K44-Y48 HydrophobicContact CG-CE2 3.69Å; K44-Y48 PolarHBondContact O-N 3.43Å; K44-Y48 VanDerWaalsContact O-N 3.07Å
45K98.6Very high98.5Very high156 Ų156107 Ų10768%0.67850%0.502SS*.Hα-helixtrans-59.2-50.3176.3-173.9178.3179.8-178.30111.2R41 A42 R47 Y48 Q49R41-K45 PolarHBondContact O-N 3.03Å; A42-K45 PolarHBondContact O-N 3.47Å; K45-R47 VanDerWaalsContact C-N 3.33Å; K45-R47 PolarHBondContact O-N 3.39Å; K45-Y48 PolarHBondContact O-N 3.24Å; K45-Q49 WeakPolarHBondContact O-CB 3.39Å; K45-Q49 PolarHBondContact O-N 3.31Å
46L98.7Very high98.6Very high115 Ų115105.3 Ų105.360%0.60250%0.499SS*.Hα-helixtrans-61.7-41.1179.7-174.964.5000112.2A42 R43 Y48 Q49 Y50A42-L46 PolarHBondContact O-N 3.08Å; R43-L46 PolarHBondContact O-N 3.39Å; L46-Y48 PolarHBondContact O-N 3.06Å; L46-Q49 PolarHBondContact O-N 3.49Å; L46-Y50 PolarHBondContact O-N 2.9Å
47R98.6Very high98.6Very high175 Ų175105.3 Ų105.366%0.6650%0.499SS*.Hα-helixtrans-61-44.5177.3-177.7178.8179.2-170.6-0.2111.7R43 K44 K45 L51R43-R47 WeakPolarHBondContact O-CB 3.38Å; R43-R47 PolarHBondContact O-N 3.46Å; K44-R47 PolarHBondContact O-N 3.22Å; K45-R47 VanDerWaalsContact C-N 3.33Å; K45-R47 PolarHBondContact O-N 3.39Å; R47-L51 HydrophobicContact CG-CD1 4.3Å; R47-L51 VanDerWaalsContact O-CG 3.31Å; R47-L51 WeakPolarHBondContact O-CG 3.42Å; R47-L51 PolarHBondContact O-N 3.07Å; R47-L51 VanDerWaalsContact O-N 3.12Å
48Y98.8Very high98.6Very high127 Ų127109.7 Ų109.750%0.49851%0.51SS..Hα-helixtrans-70-40.3179.2-67.4-20.7000112.2K44 K45 L46 Y50 L51 E52K44-Y48 HydrophobicContact CD-CE2 4.1Å; K44-Y48 VanDerWaalsContact CE-CZ 3.47Å; K44-Y48 WeakPolarHBondContact CE-OH 3.39Å; K44-Y48 HydrophobicContact CG-CD2 4.11Å; K44-Y48 HydrophobicContact CG-CE2 3.69Å; K44-Y48 PolarHBondContact O-N 3.43Å; K44-Y48 VanDerWaalsContact O-N 3.07Å; K45-Y48 PolarHBondContact O-N 3.24Å; L46-Y48 PolarHBondContact O-N 3.06Å; Y48-Y50 VanDerWaalsContact C-N 3.34Å; Y48-Y50 PolarHBondContact O-N 2.95Å; Y48-L51 HydrophobicContact CD1-CD1 4.45Å; Y48-L51 PolarHBondContact O-N 3.36Å; Y48-E52 WeakPolarHBondContact O-CB 3.5Å; Y48-E52 PolarHBondContact O-N 2.92Å
49Q98.8Very high98.6Very high88 Ų88109.3 Ų109.341%0.41151%0.513SS..Hα-helixtrans-56.8-47.4173.5-178178.4-1.300111.7K45 L46 L51 E52 E53K45-Q49 WeakPolarHBondContact O-CB 3.39Å; K45-Q49 PolarHBondContact O-N 3.31Å; L46-Q49 PolarHBondContact O-N 3.49Å; Q49-L51 PolarHBondContact O-N 2.57Å; Q49-E52 PolarHBondContact O-N 3.49Å; Q49-E53 WeakPolarHBondContact CG-OE1 3.37Å; Q49-E53 PolarHBondContact NE2-OE1 2.83Å; Q49-E53 WeakPolarHBondContact O-CB 3.42Å; Q49-E53 WeakPolarHBondContact O-CG 3.34Å; Q49-E53 PolarHBondContact O-N 2.94Å
50Y98.7Very high98.6Very high137 Ų137112.9 Ų112.954%0.53752%0.523SS..Hα-helixtrans-61.5-42.3177.1173.7-111.1000112.7L46 Y48 E53 L54L46-Y50 PolarHBondContact O-N 2.9Å; Y48-Y50 VanDerWaalsContact C-N 3.34Å; Y48-Y50 PolarHBondContact O-N 2.95Å; Y50-E53 PolarHBondContact O-N 3.15Å; Y50-L54 HydrophobicContact CD1-CD1 4Å; Y50-L54 HydrophobicContact CD2-CG 4.38Å; Y50-L54 HydrophobicContact CE1-CD1 3.37Å; Y50-L54 HydrophobicContact CE1-CG 4.12Å; Y50-L54 HydrophobicContact CE2-CD1 4.09Å; Y50-L54 HydrophobicContact CE2-CD2 4.18Å; Y50-L54 HydrophobicContact CE2-CG 3.94Å; Y50-L54 VanDerWaalsContact CZ-CD1 3.43Å; Y50-L54 WeakPolarHBondContact O-CB 3.31Å; Y50-L54 WeakPolarHBondContact O-CG 3.16Å; Y50-L54 PolarHBondContact O-N 3.17Å
51L98.7Very high98.6Very high78 Ų78111.9 Ų111.941%0.40852%0.52SS..Hα-helixtrans-65.4-40.4177.5-71.4173.4000111.8R47 Y48 Q49 L54 V55R47-L51 HydrophobicContact CG-CD1 4.3Å; R47-L51 VanDerWaalsContact O-CG 3.31Å; R47-L51 WeakPolarHBondContact O-CG 3.42Å; R47-L51 PolarHBondContact O-N 3.07Å; R47-L51 VanDerWaalsContact O-N 3.12Å; Y48-L51 HydrophobicContact CD1-CD1 4.45Å; Y48-L51 PolarHBondContact O-N 3.36Å; Q49-L51 PolarHBondContact O-N 2.57Å; L51-L54 PolarHBondContact O-N 2.97Å; L51-V55 VanDerWaalsContact O-CG2 3.3Å; L51-V55 WeakPolarHBondContact O-CG2 3.35Å; L51-V55 PolarHBondContact O-N 3.33Å
52E98.6Very high98.6Very high133 Ų133106.6 Ų106.662%0.62151%0.505SS*.Hα-helixtrans-61.7-49.5175-175.6173.9-16700110.8Y48 Q49 L54 V55 S56Y48-E52 WeakPolarHBondContact O-CB 3.5Å; Y48-E52 PolarHBondContact O-N 2.92Å; Q49-E52 PolarHBondContact O-N 3.49Å; E52-L54 VanDerWaalsContact C-N 3.32Å; E52-L54 PolarHBondContact O-N 3.29Å; E52-V55 PolarHBondContact O-N 2.85Å; E52-V55 VanDerWaalsContact O-N 3.17Å; E52-S56 WeakPolarHBondContact O-CB 3.43Å; E52-S56 PolarHBondContact O-N 3.47Å; E52-S56 PolarHBondContact O-OG 3.03Å
53E98.4Very high98.6Very high105 Ų105107 Ų10749%0.49150%0.503SS..Hα-helixtrans-58.6-41.3176.6-73.5171.2-168.300112.3Q49 Y50 S57Q49-E53 WeakPolarHBondContact CG-OE1 3.37Å; Q49-E53 PolarHBondContact NE2-OE1 2.83Å; Q49-E53 WeakPolarHBondContact O-CB 3.42Å; Q49-E53 WeakPolarHBondContact O-CG 3.34Å; Q49-E53 PolarHBondContact O-N 2.94Å; Y50-E53 PolarHBondContact O-N 3.15Å; E53-S57 WeakPolarHBondContact O-CB 3.38Å; E53-S57 PolarHBondContact O-N 3.22Å
54L98.6Very high98.6Very high64 Ų64101.8 Ų101.834%0.33550%0.495SS..Hα-helixtrans-62.8-46.1175-78.9-179.6000112.5Y50 L51 E52 K58Y50-L54 HydrophobicContact CD1-CD1 4Å; Y50-L54 HydrophobicContact CD2-CG 4.38Å; Y50-L54 HydrophobicContact CE1-CD1 3.37Å; Y50-L54 HydrophobicContact CE1-CG 4.12Å; Y50-L54 HydrophobicContact CE2-CD1 4.09Å; Y50-L54 HydrophobicContact CE2-CD2 4.18Å; Y50-L54 HydrophobicContact CE2-CG 3.94Å; Y50-L54 VanDerWaalsContact CZ-CD1 3.43Å; Y50-L54 WeakPolarHBondContact O-CB 3.31Å; Y50-L54 WeakPolarHBondContact O-CG 3.16Å; Y50-L54 PolarHBondContact O-N 3.17Å; L51-L54 PolarHBondContact O-N 2.97Å; E52-L54 VanDerWaalsContact C-N 3.32Å; E52-L54 PolarHBondContact O-N 3.29Å; L54-K58 WeakPolarHBondContact O-CG 3.2Å; L54-K58 PolarHBondContact O-N 3.34Å; L54-K58 VanDerWaalsContact O-N 3.14Å
55V98.8Very high98.5Very high76 Ų76101.5 Ų101.546%0.46150%0.498SS..Hα-helixtrans-65.1-51.7179.9170.20000109.8L51 E52 S57 K58 E59L51-V55 VanDerWaalsContact O-CG2 3.3Å; L51-V55 WeakPolarHBondContact O-CG2 3.35Å; L51-V55 PolarHBondContact O-N 3.33Å; E52-V55 PolarHBondContact O-N 2.85Å; E52-V55 VanDerWaalsContact O-N 3.17Å; V55-S57 VanDerWaalsContact C-N 3.26Å; V55-S57 PolarHBondContact O-N 3.45Å; V55-K58 PolarHBondContact O-N 2.86Å; V55-K58 VanDerWaalsContact O-N 3.08Å; V55-E59 HydrophobicContact CG1-CG 4.26Å; V55-E59 WeakPolarHBondContact CG1-OE1 3.49Å; V55-E59 WeakPolarHBondContact O-CG 3.47Å; V55-E59 PolarHBondContact O-N 3.3Å
56S98.7Very high98.5Very high44 Ų44102.7 Ų102.731%0.30850%0.499SS..Hα-helixtrans-60.4-34.3178.9-61.50000113E52 R60E52-S56 WeakPolarHBondContact O-CB 3.43Å; E52-S56 PolarHBondContact O-N 3.47Å; E52-S56 PolarHBondContact O-OG 3.03Å; S56-R60 WeakPolarHBondContact O-CB 3.31Å; S56-R60 WeakPolarHBondContact O-CG 3.36Å; S56-R60 PolarHBondContact O-N 3.14Å; S56-R60 VanDerWaalsContact O-N 3.08Å; S56-R60 PolarHBondContact O-NE 2.95Å
57S98.4Very high98.4Very high59 Ų59103.8 Ų103.841%0.41350%0.501SS..Hα-helixtrans-65.4-45.2174.9-171.20000111.9E53 V55 R60 A61E53-S57 WeakPolarHBondContact O-CB 3.38Å; E53-S57 PolarHBondContact O-N 3.22Å; V55-S57 VanDerWaalsContact C-N 3.26Å; V55-S57 PolarHBondContact O-N 3.45Å; S57-R60 PolarHBondContact O-N 2.97Å; S57-A61 PolarHBondContact O-N 2.89Å; S57-A61 VanDerWaalsContact O-N 3.07Å
58K98.6Very high98.3Very high138 Ų13899.6 Ų99.660%0.649%0.489SS*.Hα-helixtrans-65.2-43177.2-72.2177.9178.8-174.90112.1L54 V55 R60 A61 I62L54-K58 WeakPolarHBondContact O-CG 3.2Å; L54-K58 PolarHBondContact O-N 3.34Å; L54-K58 VanDerWaalsContact O-N 3.14Å; V55-K58 PolarHBondContact O-N 2.86Å; V55-K58 VanDerWaalsContact O-N 3.08Å; K58-R60 PolarHBondContact O-N 3.12Å; K58-A61 PolarHBondContact O-N 3.31Å; K58-I62 VanDerWaalsContact O-CG1 3.27Å; K58-I62 WeakPolarHBondContact O-CG1 3.48Å; K58-I62 PolarHBondContact O-N 2.93Å
59E98.7Very high98.2Very high109 Ų10998.7 Ų98.751%0.50949%0.492SS..Hα-helixtrans-59.8-46177.3-72.1172164.300111.2V55 A61 I62 C63V55-E59 HydrophobicContact CG1-CG 4.26Å; V55-E59 WeakPolarHBondContact CG1-OE1 3.49Å; V55-E59 WeakPolarHBondContact O-CG 3.47Å; V55-E59 PolarHBondContact O-N 3.3Å; E59-A61 PolarHBondContact O-N 3.44Å; E59-I62 PolarHBondContact O-N 2.98Å; E59-C63 PolarHBondContact O-N 3.42Å; E59-C63 PolarHBondContact O-SG 3.41Å; E59-C63 VanDerWaalsContact O-SG 3.33Å
60R98.4Very high98.1Very high162 Ų16298.3 Ų98.361%0.61149%0.49SS*.Hα-helixtrans-59-44174.6-80.9-174.3-81.3100.4-3.8112.7S56 S57 K58 I62 C63 A64S56-R60 WeakPolarHBondContact O-CB 3.31Å; S56-R60 WeakPolarHBondContact O-CG 3.36Å; S56-R60 PolarHBondContact O-N 3.14Å; S56-R60 VanDerWaalsContact O-N 3.08Å; S56-R60 PolarHBondContact O-NE 2.95Å; S57-R60 PolarHBondContact O-N 2.97Å; K58-R60 PolarHBondContact O-N 3.12Å; R60-I62 VanDerWaalsContact C-N 3.35Å; R60-C63 PolarHBondContact O-N 3.07Å; R60-A64 PolarHBondContact O-N 3.21Å
61A98.3Very high97.8Very high52 Ų5294.7 Ų94.743%0.4348%0.479SS..Hα-helixtrans-63.7-40.8177.200000112S57 K58 E59 A64 L65S57-A61 PolarHBondContact O-N 2.89Å; S57-A61 VanDerWaalsContact O-N 3.07Å; K58-A61 PolarHBondContact O-N 3.31Å; E59-A61 PolarHBondContact O-N 3.44Å; A61-A64 PolarHBondContact O-N 3.43Å; A61-L65 VanDerWaalsContact O-CG 3.31Å; A61-L65 WeakPolarHBondContact O-CG 3.47Å; A61-L65 PolarHBondContact O-N 3.27Å
62I98.4Very high97.5Very high86 Ų8696.1 Ų96.144%0.44148%0.479SS..Hα-helixtrans-64.1-43.9176.7-69.9165000111K58 E59 R60 L65 R66K58-I62 VanDerWaalsContact O-CG1 3.27Å; K58-I62 WeakPolarHBondContact O-CG1 3.48Å; K58-I62 PolarHBondContact O-N 2.93Å; E59-I62 PolarHBondContact O-N 2.98Å; R60-I62 VanDerWaalsContact C-N 3.35Å; I62-L65 PolarHBondContact O-N 3.38Å; I62-R66 HydrophobicContact CG2-CG 4.42Å; I62-R66 WeakPolarHBondContact O-CB 3.46Å; I62-R66 VanDerWaalsContact O-CG 3.27Å; I62-R66 WeakPolarHBondContact O-CG 3.35Å; I62-R66 PolarHBondContact O-N 3.47Å
63C98.4Very high97.3Very high67 Ų6795 Ų9545%0.45347%0.472SS..Hα-helixtrans-60.8-48.3177.3-68.70000111.4E59 R60 L65 R66 E67E59-C63 PolarHBondContact O-N 3.42Å; E59-C63 PolarHBondContact O-SG 3.41Å; E59-C63 VanDerWaalsContact O-SG 3.33Å; R60-C63 PolarHBondContact O-N 3.07Å; C63-L65 PolarHBondContact O-N 2.94Å; C63-R66 PolarHBondContact O-N 3.41Å; C63-R66 VanDerWaalsContact O-N 3.13Å; C63-E67 WeakPolarHBondContact O-CG 3.35Å; C63-E67 PolarHBondContact O-N 3.46Å
64A98Very high97Very high51 Ų5195.3 Ų95.342%0.42147%0.474SS..Hα-helixtrans-58.3-45.8178.600000112.4R60 A61 R66 E67 E68R60-A64 PolarHBondContact O-N 3.21Å; A61-A64 PolarHBondContact O-N 3.43Å; A64-R66 VanDerWaalsContact C-N 3.31Å; A64-R66 PolarHBondContact O-N 2.89Å; A64-E67 PolarHBondContact O-N 3.43Å; A64-E68 WeakPolarHBondContact O-CB 3.48Å; A64-E68 PolarHBondContact O-N 3.1Å
65L98.1Very high96.6Very high110 Ų11093.9 Ų93.958%0.57646%0.464SS*.Hα-helixtrans-65.3-34.2177.9-70.2172.6000112.7A61 I62 C63 L69A61-L65 VanDerWaalsContact O-CG 3.31Å; A61-L65 WeakPolarHBondContact O-CG 3.47Å; A61-L65 PolarHBondContact O-N 3.27Å; I62-L65 PolarHBondContact O-N 3.38Å; C63-L65 PolarHBondContact O-N 2.94Å; L65-L69 VanDerWaalsContact O-CB 3.31Å; L65-L69 WeakPolarHBondContact O-CB 3.48Å; L65-L69 PolarHBondContact O-N 2.99Å
66R98.1Very high96.3Very high181 Ų18193.4 Ų93.468%0.68346%0.463SS*.Hα-helixtrans-69.3-41.8176.1-76.4173.5175.6-116.60.1111.7I62 C63 A64 L69 E70I62-R66 HydrophobicContact CG2-CG 4.42Å; I62-R66 WeakPolarHBondContact O-CB 3.46Å; I62-R66 VanDerWaalsContact O-CG 3.27Å; I62-R66 WeakPolarHBondContact O-CG 3.35Å; I62-R66 PolarHBondContact O-N 3.47Å; C63-R66 PolarHBondContact O-N 3.41Å; C63-R66 VanDerWaalsContact O-N 3.13Å; A64-R66 VanDerWaalsContact C-N 3.31Å; A64-R66 PolarHBondContact O-N 2.89Å; R66-L69 PolarHBondContact O-N 2.91Å; R66-E70 WeakPolarHBondContact O-CB 3.34Å; R66-E70 PolarHBondContact O-N 2.97Å
67E97.1Very high95.9Very high138 Ų13894.9 Ų94.965%0.64547%0.47SS*.Hα-helixtrans-62.7-45.8176-71.9167.9-169.100111C63 A64 E70 M71C63-E67 WeakPolarHBondContact O-CG 3.35Å; C63-E67 PolarHBondContact O-N 3.46Å; A64-E67 PolarHBondContact O-N 3.43Å; E67-E70 PolarHBondContact O-N 3.17Å; E67-M71 WeakPolarHBondContact O-CB 3.48Å; E67-M71 PolarHBondContact O-N 3.27Å
68E95.4Very high95.4Very high87 Ų8793.1 Ų93.141%0.40746%0.459SS..Hα-helixtrans-61.4-45.3176.4-177179.4-166.900112A64 E70 M71 Y72A64-E68 WeakPolarHBondContact O-CB 3.48Å; A64-E68 PolarHBondContact O-N 3.1Å; E68-E70 VanDerWaalsContact C-N 3.33Å; E68-E70 PolarHBondContact O-N 3.17Å; E68-M71 HydrophobicContact CG-CE 4.47Å; E68-M71 WeakPolarHBondContact O-CB 3.33Å; E68-M71 PolarHBondContact O-N 3.5Å; E68-Y72 HydrophobicContact CG-CD2 4.06Å; E68-Y72 HydrophobicContact CG-CE2 3.49Å; E68-Y72 VanDerWaalsContact CG-CE2 3.49Å; E68-Y72 VanDerWaalsContact O-CD2 3.23Å; E68-Y72 WeakPolarHBondContact O-CD2 3.43Å; E68-Y72 PolarHBondContact O-N 3.47Å; E68-Y72 PolarHBondContact OE1-OH 3.44Å
69L97.1Very high95Very high108 Ų10890.7 Ų90.757%0.56545%0.451SS*.Hα-helixtrans-62-42.2176.5-178.665.5000111.9L65 R66 Y72 K73L65-L69 VanDerWaalsContact O-CB 3.31Å; L65-L69 WeakPolarHBondContact O-CB 3.48Å; L65-L69 PolarHBondContact O-N 2.99Å; R66-L69 PolarHBondContact O-N 2.91Å; L69-Y72 PolarHBondContact O-N 3.12Å; L69-K73 HydrophobicContact CG-CD 4.4Å; L69-K73 WeakPolarHBondContact O-CG 3.26Å; L69-K73 PolarHBondContact O-N 3.02Å
70E96.4Very high94.6Very high80 Ų8092.2 Ų92.237%0.37446%0.463SS..Hα-helixtrans-67.7-38.2179.8-171.555.3-147.600111.5R66 E67 E68 Y72 K73 Q74R66-E70 WeakPolarHBondContact O-CB 3.34Å; R66-E70 PolarHBondContact O-N 2.97Å; E67-E70 PolarHBondContact O-N 3.17Å; E68-E70 VanDerWaalsContact C-N 3.33Å; E68-E70 PolarHBondContact O-N 3.17Å; E70-Y72 PolarHBondContact O-N 3.4Å; E70-K73 PolarHBondContact O-N 3.49Å; E70-K73 IonicContact OE1-NZ 3.96Å; E70-K73 IonicContact OE2-NZ 2.71Å; E70-K73 PolarHBondContact OE2-NZ 2.89Å; E70-Q74 WeakPolarHBondContact O-CG 3.43Å; E70-Q74 PolarHBondContact O-N 2.94Å
71M93.6Very high94.3Very high61 Ų6190.5 Ų90.530%0.346%0.462SS..Hα-helixtrans-56.4-49.7170.5178.3-163.472.800111.2E67 E68 K73 Q74 W75E67-M71 WeakPolarHBondContact O-CB 3.48Å; E67-M71 PolarHBondContact O-N 3.27Å; E68-M71 HydrophobicContact CG-CE 4.47Å; E68-M71 WeakPolarHBondContact O-CB 3.33Å; E68-M71 PolarHBondContact O-N 3.5Å; M71-K73 VanDerWaalsContact C-N 3.34Å; M71-K73 PolarHBondContact O-N 2.9Å; M71-Q74 PolarHBondContact O-N 3.26Å; M71-W75 HydrophobicContact CE-CH2 3.74Å; M71-W75 HydrophobicContact CE-CZ2 3.9Å; M71-W75 HydrophobicContact CE-CZ3 4.09Å; M71-W75 HydrophobicContact CG-CD2 4.33Å; M71-W75 HydrophobicContact CG-CZ2 3.79Å; M71-W75 PolarHBondContact O-N 3.37Å; M71-W75 HydrophobicContact SD-CH2 3.94Å; M71-W75 HydrophobicContact SD-CZ2 3.52Å; M71-W75 VanDerWaalsContact SD-CZ2 3.52Å
72Y92.3Very high93.6Very high108 Ų10891.2 Ų91.242%0.42448%0.475SS..Hα-helixtrans-62.4-38.8178.5-70.1-48000113E68 L69 E70 Q74 W75 C76E68-Y72 HydrophobicContact CG-CD2 4.06Å; E68-Y72 HydrophobicContact CG-CE2 3.49Å; E68-Y72 VanDerWaalsContact CG-CE2 3.49Å; E68-Y72 VanDerWaalsContact O-CD2 3.23Å; E68-Y72 WeakPolarHBondContact O-CD2 3.43Å; E68-Y72 PolarHBondContact O-N 3.47Å; E68-Y72 PolarHBondContact OE1-OH 3.44Å; L69-Y72 PolarHBondContact O-N 3.12Å; E70-Y72 PolarHBondContact O-N 3.4Å; Y72-Q74 PolarHBondContact O-N 3.48Å; Y72-W75 AromaticContact CD1-CE3 3.75Å; Y72-W75 HydrophobicContact CD1-CE3 3.75Å; Y72-W75 AromaticContact CD1-CZ3 3.95Å; Y72-W75 HydrophobicContact CD1-CZ3 3.95Å; Y72-W75 HydrophobicContact CE1-CE3 4.04Å; Y72-W75 AromaticContact CE1-CZ3 3.74Å; Y72-W75 HydrophobicContact CE1-CZ3 3.74Å; Y72-W75 WeakPolarHBondContact O-CB 3.47Å; Y72-W75 PolarHBondContact O-N 2.98Å; Y72-C76 PolarHBondContact O-N 3.25Å; Y72-C76 PolarHBondContact O-SG 3.27Å; Y72-C76 VanDerWaalsContact O-SG 3.37Å
73K94.3Very high93Very high108 Ų10893.5 Ų93.547%0.4748%0.481SS..Hα-helixtrans-62.5-42.3175.1-74.1170.163.3-148.20112.3L69 E70 M71 W75 C76 T77L69-K73 HydrophobicContact CG-CD 4.4Å; L69-K73 WeakPolarHBondContact O-CG 3.26Å; L69-K73 PolarHBondContact O-N 3.02Å; E70-K73 PolarHBondContact O-N 3.49Å; E70-K73 IonicContact OE1-NZ 3.96Å; E70-K73 IonicContact OE2-NZ 2.71Å; E70-K73 PolarHBondContact OE2-NZ 2.89Å; M71-K73 VanDerWaalsContact C-N 3.34Å; M71-K73 PolarHBondContact O-N 2.9Å; K73-W75 VanDerWaalsContact C-N 3.3Å; K73-C76 PolarHBondContact O-N 2.96Å; K73-T77 PolarHBondContact O-N 2.88Å; K73-T77 PolarHBondContact O-OG1 3.33Å
74Q92Very high92.2Very high113 Ų11396.2 Ų96.253%0.52849%0.49SS..Hα-helixtrans-63.8-39176.1-70.9172.121.600111.2E70 M71 Y72 T77 A78E70-Q74 WeakPolarHBondContact O-CG 3.43Å; E70-Q74 PolarHBondContact O-N 2.94Å; M71-Q74 PolarHBondContact O-N 3.26Å; Y72-Q74 PolarHBondContact O-N 3.48Å; Q74-T77 PolarHBondContact O-N 2.9Å; Q74-A78 WeakPolarHBondContact O-CB 3.28Å; Q74-A78 PolarHBondContact O-N 3.29Å
75W90.3Very high91.4Very high34 Ų3494.7 Ų94.713%0.12948%0.476CS..Hα-helixtrans-63.5-45.5175.2-72.64.3000113M71 Y72 K73 T77 A78 M79 P85 E87 I88 L91M71-W75 HydrophobicContact CE-CH2 3.74Å; M71-W75 HydrophobicContact CE-CZ2 3.9Å; M71-W75 HydrophobicContact CE-CZ3 4.09Å; M71-W75 HydrophobicContact CG-CD2 4.33Å; M71-W75 HydrophobicContact CG-CZ2 3.79Å; M71-W75 PolarHBondContact O-N 3.37Å; M71-W75 HydrophobicContact SD-CH2 3.94Å; M71-W75 HydrophobicContact SD-CZ2 3.52Å; M71-W75 VanDerWaalsContact SD-CZ2 3.52Å; Y72-W75 AromaticContact CD1-CE3 3.75Å; Y72-W75 HydrophobicContact CD1-CE3 3.75Å; Y72-W75 AromaticContact CD1-CZ3 3.95Å; Y72-W75 HydrophobicContact CD1-CZ3 3.95Å; Y72-W75 HydrophobicContact CE1-CE3 4.04Å; Y72-W75 AromaticContact CE1-CZ3 3.74Å; Y72-W75 HydrophobicContact CE1-CZ3 3.74Å; Y72-W75 WeakPolarHBondContact O-CB 3.47Å; Y72-W75 PolarHBondContact O-N 2.98Å; K73-W75 VanDerWaalsContact C-N 3.3Å; W75-T77 VanDerWaalsContact C-N 3.3Å; W75-T77 PolarHBondContact O-N 3.38Å; W75-A78 PolarHBondContact O-N 3.4Å; W75-M79 WeakPolarHBondContact O-CB 3.5Å; W75-M79 WeakPolarHBondContact O-CG 3.5Å; W75-M79 PolarHBondContact O-N 3.4Å; W75-P85 HydrophobicContact CB-CG 4.28Å; W75-P85 HydrophobicContact CG-CB 4.36Å; W75-P85 HydrophobicContact CG-CG 4.07Å; W75-E87 HydrophobicContact CH2-CB 3.85Å; W75-E87 HydrophobicContact CZ2-CB 3.25Å; W75-E87 HydrophobicContact CZ2-CG 3.99Å; W75-I88 HydrophobicContact CB-CD1 3.66Å; W75-I88 HydrophobicContact CD2-CD1 3.62Å; W75-I88 HydrophobicContact CD2-CG1 3.62Å; W75-I88 HydrophobicContact CE3-CD1 3.47Å; W75-I88 VanDerWaalsContact CE3-CD1 3.47Å; W75-I88 HydrophobicContact CE3-CG1 3.24Å; W75-I88 HydrophobicContact CG-CD1 3.73Å; W75-I88 HydrophobicContact CG-CG1 4.23Å; W75-I88 HydrophobicContact CH2-CG1 4.22Å; W75-I88 HydrophobicContact CZ3-CD1 4.3Å; W75-I88 HydrophobicContact CZ3-CG1 3.56Å; W75-L91 HydrophobicContact CH2-CD1 3.85Å; W75-L91 HydrophobicContact CZ3-CD1 3.95Å
76C90.9Very high90.4Very high65 Ų6593.4 Ų93.444%0.43948%0.476SS..Hα-helixtrans-56.7-47.6173.7-66.60000110.8Y72 K73 A78 M79 D80Y72-C76 PolarHBondContact O-N 3.25Å; Y72-C76 PolarHBondContact O-SG 3.27Å; Y72-C76 VanDerWaalsContact O-SG 3.37Å; K73-C76 PolarHBondContact O-N 2.96Å; C76-A78 VanDerWaalsContact C-N 3.32Å; C76-A78 PolarHBondContact O-N 3.22Å; C76-M79 PolarHBondContact O-N 3.13Å; C76-D80 PolarHBondContact O-N 3.33Å
77T90.9Very high89.3Confident75 Ų7589.5 Ų89.546%0.4647%0.466SS..Hα-helixtrans-60.5-40.1179.1-52.10000112.3K73 Q74 W75 Q81K73-T77 PolarHBondContact O-N 2.88Å; K73-T77 PolarHBondContact O-OG1 3.33Å; Q74-T77 PolarHBondContact O-N 2.9Å; W75-T77 VanDerWaalsContact C-N 3.3Å; W75-T77 PolarHBondContact O-N 3.38Å; T77-Q81 VanDerWaalsContact O-CG 3.29Å; T77-Q81 WeakPolarHBondContact O-CG 3.32Å; T77-Q81 PolarHBondContact O-N 3.36Å
78A88.8Confident88.3Confident22 Ų2284 Ų8418%0.18244%0.44CS..Hα-helixtrans-68.8-42.3177.200000112.1Q74 W75 C76 Q81 G82 K83 P85Q74-A78 WeakPolarHBondContact O-CB 3.28Å; Q74-A78 PolarHBondContact O-N 3.29Å; W75-A78 PolarHBondContact O-N 3.4Å; C76-A78 VanDerWaalsContact C-N 3.32Å; C76-A78 PolarHBondContact O-N 3.22Å; A78-Q81 CarbonylContact O-C 3.51Å; A78-Q81 WeakPolarHBondContact O-CA 3.41Å; A78-Q81 WeakPolarHBondContact O-CB 3.34Å; A78-Q81 PolarHBondContact O-N 2.96Å; A78-Q81 VanDerWaalsContact O-N 3.1Å; A78-G82 PolarHBondContact O-N 3.01Å; A78-K83 CarbonylContact C-O 3.13Å; A78-K83 PolarHBondContact O-N 3.1Å; A78-P85 HydrophobicContact CB-CG 3.82Å
79M89.5Confident87.3Confident87 Ų8786.4 Ų86.443%0.42945%0.449SS..Hα-helixtrans-63.5-40.7176.8-72.8-170.8-62.100111.8W75 C76 Q81 G82 K83 I88W75-M79 WeakPolarHBondContact O-CB 3.5Å; W75-M79 WeakPolarHBondContact O-CG 3.5Å; W75-M79 PolarHBondContact O-N 3.4Å; C76-M79 PolarHBondContact O-N 3.13Å; M79-Q81 PolarHBondContact O-N 2.88Å; M79-G82 WeakPolarHBondContact O-CA 3.33Å; M79-G82 PolarHBondContact O-N 2.88Å; M79-K83 WeakPolarHBondContact CA-O 3.43Å; M79-K83 PolarHBondContact N-O 3.47Å; M79-I88 HydrophobicContact CE-CD1 4.19Å; M79-I88 HydrophobicContact CG-CD1 4.31Å; M79-I88 HydrophobicContact SD-CD1 3.8Å
80D90.3Very high86.4Confident142 Ų14282.5 Ų82.576%0.75943%0.433SS*.Hα-helixtrans-61.7-27.3174.6-67.4-24.1000112C76 G82C76-D80 PolarHBondContact O-N 3.33Å; D80-G82 VanDerWaalsContact C-N 3.27Å
81Q91.6Very high85.2Confident125 Ų12584.1 Ų84.158%0.58444%0.444SS*.THydrogen-bonded Turntrans-85.76.6173.3-66171.817.200113.4T77 A78 M79 K83T77-Q81 VanDerWaalsContact O-CG 3.29Å; T77-Q81 WeakPolarHBondContact O-CG 3.32Å; T77-Q81 PolarHBondContact O-N 3.36Å; A78-Q81 CarbonylContact O-C 3.51Å; A78-Q81 WeakPolarHBondContact O-CA 3.41Å; A78-Q81 WeakPolarHBondContact O-CB 3.34Å; A78-Q81 PolarHBondContact O-N 2.96Å; A78-Q81 VanDerWaalsContact O-N 3.1Å; M79-Q81 PolarHBondContact O-N 2.88Å; Q81-K83 VanDerWaalsContact C-N 3.29Å; Q81-K83 PolarHBondContact O-N 2.99Å
82G84.9Confident84.3Confident68 Ų6888.2 Ų88.270%0.70147%0.466SS*.THydrogen-bonded Turntrans75.312.6-179.300000114.5A78 M79 D80A78-G82 PolarHBondContact O-N 3.01Å; M79-G82 WeakPolarHBondContact O-CA 3.33Å; M79-G82 PolarHBondContact O-N 2.88Å; D80-G82 VanDerWaalsContact C-N 3.27Å
83K84.7Confident83.5Confident133 Ų13387.7 Ų87.758%0.57847%0.474SS*.  trans-102.4120.6176.5-63175.2-174.81680108.9A78 M79 Q81 P85A78-K83 CarbonylContact C-O 3.13Å; A78-K83 PolarHBondContact O-N 3.1Å; M79-K83 WeakPolarHBondContact CA-O 3.43Å; M79-K83 PolarHBondContact N-O 3.47Å; Q81-K83 VanDerWaalsContact C-N 3.29Å; Q81-K83 PolarHBondContact O-N 2.99Å; K83-P85 VanDerWaalsContact O-CD 3.27Å; K83-P85 WeakPolarHBondContact O-CD 3.48Å
84I81.3Confident82Confident125 Ų12585.2 Ų85.264%0.64148%0.479SS*.  trans-84.9114.9172.5-59.6172.8000107.9I88 K89I84-I88 HydrophobicContact CG2-CG2 4.33Å; I84-K89 HydrophobicContact CG2-CB 4.42Å
85P82.4Confident80.4Confident19 Ų1985.4 Ų85.412%0.12348%0.484CS..  trans-58.8142.3175.1-25.237.4000111.9W75 A78 K83 E87 I88 K89W75-P85 HydrophobicContact CB-CG 4.28Å; W75-P85 HydrophobicContact CG-CB 4.36Å; W75-P85 HydrophobicContact CG-CG 4.07Å; A78-P85 HydrophobicContact CB-CG 3.82Å; K83-P85 VanDerWaalsContact O-CD 3.27Å; K83-P85 WeakPolarHBondContact O-CD 3.48Å; P85-E87 PolarHBondContact O-N 3.1Å; P85-I88 HydrophobicContact CB-CD1 4.31Å; P85-I88 HydrophobicContact CB-CG1 4.48Å; P85-I88 HydrophobicContact CG-CD1 3.94Å; P85-I88 PolarHBondContact O-N 3.4Å; P85-I88 VanDerWaalsContact O-N 3.16Å; P85-K89 PolarHBondContact O-N 2.81Å
86S75.9Confident78.3Confident83 Ų8392.3 Ų92.358%0.5852%0.518SS*.Hα-helixtrans-55.9-34.5-178.628.40000113.3K89 A90S86-K89 WeakPolarHBondContact O-CB 3.37Å; S86-K89 PolarHBondContact O-N 3.11Å; S86-A90 PolarHBondContact O-N 2.94Å
87E76.4Confident76.5Confident99 Ų9997.6 Ų97.646%0.46354%0.536SS..Hα-helixtrans-70.3-41.5-179.2-65.975.1-171.700111.1W75 P85 K89 A90 L91W75-E87 HydrophobicContact CH2-CB 3.85Å; W75-E87 HydrophobicContact CZ2-CB 3.25Å; W75-E87 HydrophobicContact CZ2-CG 3.99Å; P85-E87 PolarHBondContact O-N 3.1Å; E87-K89 VanDerWaalsContact C-N 3.29Å; E87-K89 PolarHBondContact O-N 3.26Å; E87-A90 PolarHBondContact O-N 2.71Å; E87-L91 WeakPolarHBondContact O-CG 3.48Å; E87-L91 PolarHBondContact O-N 3.15Å
88I76.3Confident74.1Confident22 Ų22101.1 Ų101.111%0.11355%0.545CS..Hα-helixtrans-63.8-40.5171.7-69.7170.4000109.8W75 M79 I84 P85 L91 L92W75-I88 HydrophobicContact CB-CD1 3.66Å; W75-I88 HydrophobicContact CD2-CD1 3.62Å; W75-I88 HydrophobicContact CD2-CG1 3.62Å; W75-I88 HydrophobicContact CE3-CD1 3.47Å; W75-I88 VanDerWaalsContact CE3-CD1 3.47Å; W75-I88 HydrophobicContact CE3-CG1 3.24Å; W75-I88 HydrophobicContact CG-CD1 3.73Å; W75-I88 HydrophobicContact CG-CG1 4.23Å; W75-I88 HydrophobicContact CH2-CG1 4.22Å; W75-I88 HydrophobicContact CZ3-CD1 4.3Å; W75-I88 HydrophobicContact CZ3-CG1 3.56Å; M79-I88 HydrophobicContact CE-CD1 4.19Å; M79-I88 HydrophobicContact CG-CD1 4.31Å; M79-I88 HydrophobicContact SD-CD1 3.8Å; I84-I88 HydrophobicContact CG2-CG2 4.33Å; P85-I88 HydrophobicContact CB-CD1 4.31Å; P85-I88 HydrophobicContact CB-CG1 4.48Å; P85-I88 HydrophobicContact CG-CD1 3.94Å; P85-I88 PolarHBondContact O-N 3.4Å; P85-I88 VanDerWaalsContact O-N 3.16Å; I88-L91 PolarHBondContact O-N 3.34Å; I88-L92 HydrophobicContact CG2-CD1 3.84Å; I88-L92 WeakPolarHBondContact O-CB 3.39Å; I88-L92 WeakPolarHBondContact O-CD1 3.43Å; I88-L92 PolarHBondContact O-N 2.95Å
89K74.3Confident72Confident137 Ų137105 Ų10560%0.59657%0.568SS**Hα-helixtrans-62-44.3176.3-163.5177.9-178.7-177.70110.9I84 P85 S86 E87 L92 T93I84-K89 HydrophobicContact CG2-CB 4.42Å; P85-K89 PolarHBondContact O-N 2.81Å; S86-K89 WeakPolarHBondContact O-CB 3.37Å; S86-K89 PolarHBondContact O-N 3.11Å; E87-K89 VanDerWaalsContact C-N 3.29Å; E87-K89 PolarHBondContact O-N 3.26Å; K89-L92 PolarHBondContact O-N 3.37Å; K89-T93 WeakPolarHBondContact O-CB 3.37Å; K89-T93 PolarHBondContact O-N 3.31Å; K89-T93 PolarHBondContact O-OG1 3.25Å
90A77.1Confident69.8Low26 Ų26107.1 Ų107.122%0.21559%0.588CS.*Hα-helixtrans-61.4-45.1175.800000112.1S86 E87 L92 T93 G94 D95S86-A90 PolarHBondContact O-N 2.94Å; E87-A90 PolarHBondContact O-N 2.71Å; A90-L92 PolarHBondContact O-N 2.96Å; A90-T93 PolarHBondContact O-N 3.47Å; A90-G94 PolarHBondContact O-N 3.43Å; A90-D95 PolarHBondContact O-N 2.97Å
91L72.5Confident67.6Low115 Ų115107 Ų10760%0.60258%0.583SS**Hα-helixtrans-61.1-39.7175.5-72.4171.4000112.9W75 E87 I88W75-L91 HydrophobicContact CH2-CD1 3.85Å; W75-L91 HydrophobicContact CZ3-CD1 3.95Å; E87-L91 WeakPolarHBondContact O-CG 3.48Å; E87-L91 PolarHBondContact O-N 3.15Å; I88-L91 PolarHBondContact O-N 3.34Å
92L72.7Confident65.2Low147 Ų147106.9 Ų106.977%0.7760%0.596SS**Hα-helixtrans-72.4-29.5176.8-100.876000113.2I88 K89 A90I88-L92 HydrophobicContact CG2-CD1 3.84Å; I88-L92 WeakPolarHBondContact O-CB 3.39Å; I88-L92 WeakPolarHBondContact O-CD1 3.43Å; I88-L92 PolarHBondContact O-N 2.95Å; K89-L92 PolarHBondContact O-N 3.37Å; A90-L92 PolarHBondContact O-N 2.96Å
93T77.3Confident63.1Low96 Ų96109.1 Ų109.159%0.58960%0.601SS**Hα-helixtrans-92.8-6.5-175.5-31.50000112.4K89 A90 D95K89-T93 WeakPolarHBondContact O-CB 3.37Å; K89-T93 PolarHBondContact O-N 3.31Å; K89-T93 PolarHBondContact O-OG1 3.25Å; A90-T93 PolarHBondContact O-N 3.47Å; T93-D95 VanDerWaalsContact C-N 3.29Å; T93-D95 PolarHBondContact O-N 3.48Å
94G62.8Low60.9Low57 Ų57107.7 Ų107.759%0.58861%0.608SS**THydrogen-bonded Turntrans75.613.1177.900000114.5A90 E96A90-G94 PolarHBondContact O-N 3.43Å; G94-E96 PolarHBondContact O-N 2.9Å; G94-E96 VanDerWaalsContact O-N 3.1Å
95D56.8Low58.8Low117 Ų117108.1 Ų108.163%0.62662%0.617SS**  trans-79.390.8172.2-88.9-40000109A90 T93 Q97A90-D95 PolarHBondContact O-N 2.97Å; T93-D95 VanDerWaalsContact C-N 3.29Å; T93-D95 PolarHBondContact O-N 3.48Å; D95-Q97 VanDerWaalsContact C-N 3.33Å; D95-Q97 PolarHBondContact O-N 3.06Å
96E47.2Very low56.9Low179 Ų179116.8 Ų116.884%0.83665%0.652SS**  trans-62.783.7174.3-71.7-84.4109.400111.1G94 K98G94-E96 PolarHBondContact O-N 2.9Å; G94-E96 VanDerWaalsContact O-N 3.1Å; E96-K98 PolarHBondContact O-N 3.32Å
97Q51.9Low55.1Low176 Ų176118.2 Ų118.282%0.82266%0.662SS**  trans-83.597.4164.4-82.9-171.3-53.400110.2D95D95-Q97 VanDerWaalsContact C-N 3.33Å; D95-Q97 PolarHBondContact O-N 3.06Å
98K42Very low53.3Low149 Ų149119.5 Ų119.565%0.64868%0.682SS**  trans-41.4130.1166.9-175.5177.7178.4-177.30110.9E96E96-K98 PolarHBondContact O-N 3.32Å
99P44.7Very low51.8Low102 Ų102128.1 Ų128.166%0.66272%0.719SS**  trans-59.7148.2178.524.8-33.8000110.6Q101P99-Q101 PolarHBondContact O-N 3.17Å
100P42.4Very low50Low132 Ų132129.2 Ų129.286%0.85773%0.731SS**  trans-62.6104.5-178.824.5-32.2000110S102P100-S102 PolarHBondContact O-N 3.23Å; P100-S102 VanDerWaalsContact O-N 3.12Å
101Q43.8Very low48.5Very low140 Ų140132.4 Ų132.465%0.65475%0.752SS**  trans-61.8112.2166.3-69.4-169.2-88.700108P99 S103P99-Q101 PolarHBondContact O-N 3.17Å; Q101-S103 PolarHBondContact O-N 2.69Å
102S41.2Very low47.1Very low122 Ų122134.5 Ų134.585%0.85376%0.764SS**  trans-59.3103.7166.757.80000108.7P100P100-S102 PolarHBondContact O-N 3.23Å; P100-S102 VanDerWaalsContact O-N 3.12Å
103S40.5Very low46Very low115 Ų115136.4 Ų136.480%0.80477%0.769SS**  trans-104.1110.3175.349.10000109.4Q101Q101-S103 PolarHBondContact O-N 2.69Å
104S39.7Very low44.4Very low104 Ų104141.1 Ų141.173%0.72781%0.805SS**  trans-163.1118.816354.80000106.8
105T37Very low43.5Very low134 Ų134145.3 Ų145.382%0.82282%0.816SS**  cis-166.6134.811.624.50000107.6
106K43.3Very low42.8Very low201 Ų201146.8 Ų146.887%0.87483%0.826SS**  trans38.9120.1136.7-138.4169.1-1761760120.4
107S37.2Very low42.5Very low113 Ų113145 Ų14579%0.7983%0.826SS**  trans-52.2139.8162.135.50000115.3
108S38.8Very low42Very low125 Ų125143.2 Ų143.287%0.87483%0.826SS**  trans-120.1112.7153.6-80.20000109
109K45Very low42Very low204 Ų204142.8 Ų142.889%0.88784%0.837SS**  trans-53137.6161.2-91.4165.7166.5168.60108.8
110N37.2Very low41.8Very low160 Ų160145.5 Ų145.586%0.85685%0.849SS**  trans-142.7129.5131.5-145.829.1000111.7
111S45.2Very low41.7Very low93 Ų93146.5 Ų146.565%0.6585%0.848SS**  trans-71.9150.2-178.642.40000112.8
112N43.5Very low41.6Very low158 Ų158147 Ų14785%0.84586%0.863SS**  trans-16.8137.4152.7-110.210.7000116
113Q48.5Very low41.6Very low187 Ų187149.1 Ų149.187%0.87486%0.864SS**  trans-154.3125.7142.2-106.11774100111
114S43.6Very low41.7Very low195 Ų195152.2 Ų152.2100%1.36487%0.869SS**  trans61.50155.5-64.50000121.5

Retrieved 114 of 114 residues in 47.3 ms (Link to these results)