A0A096NAT9_PAPAN Loading...

Protein phosphatase 1 regulatory subunit 1A

Inhibitor of protein-phosphatase 1. This protein may be important in hormonal control of glycogen metabolism. Hormones that elevate intracellular cAMP increase I-1 activity in many tissues. I-1 activation may impose cAMP control over proteins that are not directly phosphorylated by PKA. Following a rise in intracellular calcium, I-1 is inactivated by calcineurin (or PP2B). Does not inhibit type-2 phosphatases.

AlphaFold DB , UniProt , Accession A0A096NAT9, Species PAPAN (Papio anubis, Olive baboon), Gene PPP1R1A, Length 171 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
1M59Low73.1Confident242 Ų242164.8 Ų164.8100%1.19281%0.809SS**  0100.40-66172.7-176.200105.6Q3M1-Q3 PolarHBondContact O-N 3.46Å
2E64.9Low73.9Confident201 Ų201166.2 Ų166.294%0.93981%0.808SS**  trans-68.8122.4-179.2-75.6155.6116.100109.2D4E2-D4 PolarHBondContact O-N 3.41Å
3Q67.3Low74.6Confident158 Ų158162.6 Ų162.674%0.73880%0.802SS**  trans-79.3111.1-180-169.3170.9-4.800107.5M1 N5M1-Q3 PolarHBondContact O-N 3.46Å; Q3-N5 PolarHBondContact O-N 3.46Å; Q3-N5 PolarHBondContact O-ND2 3.28Å
4D65.9Low75.2Confident148 Ų148160.9 Ų160.979%0.79181%0.805SS**  trans-65.5104.3175.7-168.2-11.6000108.8E2 S6E2-D4 PolarHBondContact O-N 3.41Å; D4-S6 PolarHBondContact O-N 3.43Å; D4-S6 WeakPolarHBondContact OD1-CB 3.37Å; D4-S6 PolarHBondContact OD1-N 3.31Å
5N66.6Low75.3Confident135 Ų135156.7 Ų156.772%0.72279%0.794SS**  trans-88.632.8-177.3-66-66.4000111.9Q3 P7Q3-N5 PolarHBondContact O-N 3.46Å; Q3-N5 PolarHBondContact O-ND2 3.28Å; N5-P7 WeakPolarHBondContact O-CD 3.42Å
6S73.8Confident75.1Confident84 Ų84156.8 Ų156.859%0.58780%0.796SS**  trans-71.1119.3177.3-169.40000110.8D4 R8D4-S6 PolarHBondContact O-N 3.43Å; D4-S6 WeakPolarHBondContact OD1-CB 3.37Å; D4-S6 PolarHBondContact OD1-N 3.31Å; S6-R8 PolarHBondContact O-N 3.39Å; S6-R8 VanDerWaalsContact O-N 3.13Å
7P79.3Confident74.8Confident110 Ų110156.4 Ų156.471%0.71480%0.795SS**  trans-59121.3177.3-18.830.1000109.2N5 K9N5-P7 WeakPolarHBondContact O-CD 3.42Å; P7-K9 PolarHBondContact O-N 3.47Å
8R80.9Confident74.5Confident240 Ų240156.4 Ų156.491%0.90679%0.792SS**  trans-54.5111.2178.1-75.7179.2-81.1-133.2-3.2109.3S6 I10S6-R8 PolarHBondContact O-N 3.39Å; S6-R8 VanDerWaalsContact O-N 3.13Å; R8-I10 PolarHBondContact O-N 3.18Å; R8-I10 VanDerWaalsContact O-N 3.16Å
9K81.8Confident74.4Confident191 Ų191154.7 Ų154.783%0.8379%0.792SS**  trans-67.2113.3173.8-71.1-177.166.5-1790108.4P7 Q11P7-K9 PolarHBondContact O-N 3.47Å; K9-Q11 PolarHBondContact O-N 3.35Å
10I81.7Confident74.2Confident131 Ų131155.7 Ų155.767%0.67279%0.793SS**  trans-72122171.5-56172.8000107R8 F12R8-I10 PolarHBondContact O-N 3.18Å; R8-I10 VanDerWaalsContact O-N 3.16Å; I10-F12 HydrophobicContact CB-CE2 4.16Å; I10-F12 HydrophobicContact CB-CZ 4.46Å; I10-F12 HydrophobicContact CG2-CD1 4.46Å; I10-F12 HydrophobicContact CG2-CD2 4.11Å; I10-F12 HydrophobicContact CG2-CE1 4.07Å; I10-F12 HydrophobicContact CG2-CE2 3.68Å; I10-F12 HydrophobicContact CG2-CG 4.49Å; I10-F12 HydrophobicContact CG2-CZ 3.66Å
11Q83.3Confident74.1Confident173 Ų173153 Ų15381%0.80878%0.78SS**  trans-97.7112.7172.6-63.6-172.956.900107.8K9K9-Q11 PolarHBondContact O-N 3.35Å
12F81.9Confident75.4Confident181 Ų181147.3 Ų147.379%0.79476%0.755SS**  trans-87.6108.8172.4-66.7-81.9000108.4I10I10-F12 HydrophobicContact CB-CE2 4.16Å; I10-F12 HydrophobicContact CB-CZ 4.46Å; I10-F12 HydrophobicContact CG2-CD1 4.46Å; I10-F12 HydrophobicContact CG2-CD2 4.11Å; I10-F12 HydrophobicContact CG2-CE1 4.07Å; I10-F12 HydrophobicContact CG2-CE2 3.68Å; I10-F12 HydrophobicContact CG2-CG 4.49Å; I10-F12 HydrophobicContact CG2-CZ 3.66Å
13T83.2Confident76.2Confident120 Ų120143 Ų14374%0.73674%0.744SS**PPolyproline II helixtrans-97.7128169.454.80000108.7P15T13-P15 WeakPolarHBondContact O-CD 3.38Å
14V82.8Confident77Confident138 Ų138142.4 Ų142.484%0.83674%0.742SS**PPolyproline II helixtrans-73.2120.3173.8177.30000108.2L16V14-L16 PolarHBondContact O-N 2.89Å
15P77.9Confident77.8Confident99 Ų99136.9 Ų136.964%0.64372%0.716SS**PPolyproline II helixtrans-64.7123.9172.7-17.231.3000109.1T13 L17T13-P15 WeakPolarHBondContact O-CD 3.38Å; P15-L17 PolarHBondContact O-N 3.17Å
16L71.6Confident78.6Confident157 Ų157132.2 Ų132.282%0.82270%0.697SS**  trans-70.8102.2172.1-173.867000107.8V14 E18V14-L16 PolarHBondContact O-N 2.89Å; L16-E18 PolarHBondContact O-N 3.41Å
17L69.6Low79.1Confident151 Ų151132.7 Ų132.779%0.79169%0.69SS**  trans-80.2108.2172-64.6176.6000107.9P15P15-L17 PolarHBondContact O-N 3.17Å
18E70.1Confident79.6Confident156 Ų156132.5 Ų132.573%0.72968%0.679SS**  trans-66.5128.8167.3-73.8-177.9-152.400109L16 H20L16-E18 PolarHBondContact O-N 3.41Å; E18-H20 PolarHBondContact O-N 3.09Å
19P71.4Confident79.8Confident124 Ų124123.9 Ų123.981%0.80565%0.65SS**  trans-72.379.7174.329.3-31.5000108.8L21P19-L21 PolarHBondContact O-N 3.48Å
20H71.8Confident79.9Confident174 Ų174118.7 Ų118.781%0.80663%0.625SS**  trans-72.622.7179.3-17165000113.2E18E18-H20 PolarHBondContact O-N 3.09Å
21L71.9Confident80.2Confident100 Ų100121.7 Ų121.752%0.52463%0.628SS.*SBendtrans-118135.7-177.5-60.4178.7000109.2P19 I29P19-L21 PolarHBondContact O-N 3.48Å; L21-I29 HydrophobicContact CD1-CD1 3.71Å
22D85.7Confident80.4Confident122 Ų122123.5 Ų123.565%0.65263%0.628SS**  trans-53140.5175.7-61.6-41.3000110.5E24 A25 A26D22-E24 PolarHBondContact O-N 3.26Å; D22-E24 VanDerWaalsContact O-N 3.13Å; D22-A25 HydrophobicContact CB-CB 4.16Å; D22-A25 WeakPolarHBondContact O-CA 3.14Å; D22-A25 WeakPolarHBondContact O-CB 3.44Å; D22-A25 PolarHBondContact O-N 3.46Å; D22-A26 PolarHBondContact O-N 3.38Å
23P81.3Confident80.5Confident111 Ų111121.7 Ų121.772%0.72162%0.616SS**Hα-helixtrans-53.2-38.7-177.2-28.134.4000113.7A26 E27P23-A26 PolarHBondContact O-N 2.94Å; P23-E27 PolarHBondContact O-N 3.28Å; P23-E27 VanDerWaalsContact O-N 3.16Å
24E83.9Confident80.4Confident146 Ų146122.5 Ų122.568%0.68262%0.623SS**Hα-helixtrans-67.5-40.2176.8-170.4177.1173.700112.1D22 E27 Q28D22-E24 PolarHBondContact O-N 3.26Å; D22-E24 VanDerWaalsContact O-N 3.13Å; E24-E27 PolarHBondContact O-N 2.72Å; E24-Q28 WeakPolarHBondContact O-CG 3.48Å; E24-Q28 PolarHBondContact O-N 3.02Å
25A83.1Confident79.9Confident32 Ų32121.2 Ų121.226%0.26462%0.615SS.*Hα-helixtrans-68.1-37.7176.600000111.8D22 E27 Q28 I29D22-A25 HydrophobicContact CB-CB 4.16Å; D22-A25 WeakPolarHBondContact O-CA 3.14Å; D22-A25 WeakPolarHBondContact O-CB 3.44Å; D22-A25 PolarHBondContact O-N 3.46Å; A25-E27 VanDerWaalsContact C-N 3.3Å; A25-E27 PolarHBondContact O-N 3.11Å; A25-Q28 PolarHBondContact O-N 2.99Å; A25-I29 WeakPolarHBondContact O-CG1 3.38Å; A25-I29 PolarHBondContact O-N 3.48Å
26A83.5Confident79Confident37 Ų37120.4 Ų120.431%0.30661%0.61SS.*Hα-helixtrans-60.4-41.1174.200000111.3D22 P23 I29 R30D22-A26 PolarHBondContact O-N 3.38Å; P23-A26 PolarHBondContact O-N 2.94Å; A26-I29 PolarHBondContact O-N 3.17Å; A26-R30 VanDerWaalsContact O-CG 3.25Å; A26-R30 WeakPolarHBondContact O-CG 3.42Å; A26-R30 PolarHBondContact O-N 3.41Å
27E85.4Confident78.8Confident94 Ų94115.8 Ų115.844%0.43960%0.595SS.*Hα-helixtrans-65.1-43.2172.9-78.1-157.3-165.100113.1P23 E24 A25 I29 R30 R31P23-E27 PolarHBondContact O-N 3.28Å; P23-E27 VanDerWaalsContact O-N 3.16Å; E24-E27 PolarHBondContact O-N 2.72Å; A25-E27 VanDerWaalsContact C-N 3.3Å; A25-E27 PolarHBondContact O-N 3.11Å; E27-I29 VanDerWaalsContact C-N 3.3Å; E27-I29 PolarHBondContact O-N 3.05Å; E27-R30 WeakPolarHBondContact O-CB 3.37Å; E27-R30 PolarHBondContact O-N 3.17Å; E27-R30 VanDerWaalsContact O-N 3.12Å; E27-R31 WeakPolarHBondContact O-CG 3.35Å; E27-R31 PolarHBondContact O-N 2.91Å; E27-R31 IonicContact OE2-CZ 3.8Å; E27-R31 IonicContact OE2-NE 3.72Å; E27-R31 IonicContact OE2-NH2 2.98Å; E27-R31 PolarHBondContact OE2-NH2 3.17Å
28Q89.5Confident78.3Confident106 Ų106113 Ų11350%0.49558%0.584SS.*Hα-helixtrans-58.9-43.4176.6-72.6-176.26.500111.5E24 A25 R30 R31 R32E24-Q28 WeakPolarHBondContact O-CG 3.48Å; E24-Q28 PolarHBondContact O-N 3.02Å; A25-Q28 PolarHBondContact O-N 2.99Å; Q28-R30 PolarHBondContact O-N 2.91Å; Q28-R31 PolarHBondContact O-N 3.41Å; Q28-R32 WeakPolarHBondContact O-CB 3.32Å; Q28-R32 WeakPolarHBondContact O-CG 3.47Å; Q28-R32 PolarHBondContact O-N 3.48Å
29I83.6Confident78Confident58 Ų58112.3 Ų112.330%0.29759%0.585SS.*Hα-helixtrans-62.1-43.5174.9-67.7167.2000110.6L21 A25 A26 E27 R31 R32 R33L21-I29 HydrophobicContact CD1-CD1 3.71Å; A25-I29 WeakPolarHBondContact O-CG1 3.38Å; A25-I29 PolarHBondContact O-N 3.48Å; A26-I29 PolarHBondContact O-N 3.17Å; E27-I29 VanDerWaalsContact C-N 3.3Å; E27-I29 PolarHBondContact O-N 3.05Å; I29-R31 PolarHBondContact O-N 3.35Å; I29-R32 PolarHBondContact O-N 3.13Å; I29-R33 VanDerWaalsContact CG2-NE 3.29Å; I29-R33 VanDerWaalsContact O-CG 3.28Å; I29-R33 WeakPolarHBondContact O-CG 3.23Å; I29-R33 PolarHBondContact O-N 3.29Å; I29-R33 VanDerWaalsContact O-N 3.09Å
30R84.4Confident77.3Confident82 Ų82110 Ų11031%0.30957%0.568SS.*Hα-helixtrans-61.7-41177.9-73.8167.371172.6-1.3112.5A26 E27 Q28 T38A26-R30 VanDerWaalsContact O-CG 3.25Å; A26-R30 WeakPolarHBondContact O-CG 3.42Å; A26-R30 PolarHBondContact O-N 3.41Å; E27-R30 WeakPolarHBondContact O-CB 3.37Å; E27-R30 PolarHBondContact O-N 3.17Å; E27-R30 VanDerWaalsContact O-N 3.12Å; Q28-R30 PolarHBondContact O-N 2.91Å; R30-T38 VanDerWaalsContact NH2-CB 3.33Å
31R87.7Confident76.7Confident195 Ų195108.5 Ų108.574%0.73657%0.566SS**Hα-helixtrans-74.6-29.1-180-68.1-177.7-163.9-95.3-0.5113.1E27 Q28 I29E27-R31 WeakPolarHBondContact O-CG 3.35Å; E27-R31 PolarHBondContact O-N 2.91Å; E27-R31 IonicContact OE2-CZ 3.8Å; E27-R31 IonicContact OE2-NE 3.72Å; E27-R31 IonicContact OE2-NH2 2.98Å; E27-R31 PolarHBondContact OE2-NH2 3.17Å; Q28-R31 PolarHBondContact O-N 3.41Å; I29-R31 PolarHBondContact O-N 3.35Å
32R88.9Confident75.5Confident211 Ų211108.7 Ų108.780%0.79657%0.571SS**Hα-helixtrans-81.4-17.7176.9-68.417373.6-173.53.6113.1Q28 I29Q28-R32 WeakPolarHBondContact O-CB 3.32Å; Q28-R32 WeakPolarHBondContact O-CG 3.47Å; Q28-R32 PolarHBondContact O-N 3.48Å; I29-R32 PolarHBondContact O-N 3.13Å
33R83.9Confident73.8Confident142 Ų142108.6 Ų108.654%0.53658%0.58SS.*SBendtrans-77.1132.2173.7-75.1174.5-173.7-169.65.2110.1I29 T35I29-R33 VanDerWaalsContact CG2-NE 3.29Å; I29-R33 VanDerWaalsContact O-CG 3.28Å; I29-R33 WeakPolarHBondContact O-CG 3.23Å; I29-R33 PolarHBondContact O-N 3.29Å; I29-R33 VanDerWaalsContact O-N 3.09Å; R33-T35 PolarHBondContact O-N 3.34Å; R33-T35 VanDerWaalsContact O-N 3.11Å
34P81.4Confident72.2Confident137 Ų137109.3 Ų109.389%0.8958%0.577SS**SBendtrans-58.5-25.1179.4-24.132.4000114.1
35T72.3Confident70.7Confident111 Ų111111.4 Ų111.468%0.68159%0.587SS**SBendtrans-120.3111.7170.5-43.40000106.7R33 A37R33-T35 PolarHBondContact O-N 3.34Å; R33-T35 VanDerWaalsContact O-N 3.11Å; T35-A37 VanDerWaalsContact C-N 3.27Å; T35-A37 PolarHBondContact O-N 2.94Å
36P58.9Low68.9Low82 Ų82114.4 Ų114.453%0.53261%0.606SS.*  trans-68.392.3175.526.6-31.5000108T38P36-T38 VanDerWaalsContact C-N 3.34Å; P36-T38 PolarHBondContact O-N 3.46Å
37A65.6Low67.2Low61 Ų61117.4 Ų117.450%0.50463%0.625SS.*  trans-71.396169.300000107.1T35 L39T35-A37 VanDerWaalsContact C-N 3.27Å; T35-A37 PolarHBondContact O-N 2.94Å; A37-L39 VanDerWaalsContact C-N 3.28Å; A37-L39 PolarHBondContact O-N 3.06Å; A37-L39 VanDerWaalsContact O-N 3.07Å
38T60.7Low65.5Low91 Ų91118.5 Ų118.556%0.55864%0.64SS**  trans-78.282.2172.357.90000107.9R30 P36 V40R30-T38 VanDerWaalsContact NH2-CB 3.33Å; P36-T38 VanDerWaalsContact C-N 3.34Å; P36-T38 PolarHBondContact O-N 3.46Å; T38-V40 PolarHBondContact O-N 3.3Å; T38-V40 VanDerWaalsContact O-N 3.08Å
39L63Low63.6Low142 Ų142121.9 Ų121.974%0.74366%0.656SS**  trans-83.873.4164-156138.2000107.3A37 L41A37-L39 VanDerWaalsContact C-N 3.28Å; A37-L39 PolarHBondContact O-N 3.06Å; A37-L39 VanDerWaalsContact O-N 3.07Å; L39-L41 HydrophobicContact CD2-CD1 3.43Å; L39-L41 VanDerWaalsContact CD2-CD1 3.43Å; L39-L41 HydrophobicContact CD2-CG 3.72Å; L39-L41 PolarHBondContact O-N 3.06Å
40V57.6Low62.4Low75 Ų75124.8 Ų124.846%0.45567%0.671SS.*  trans-88.297.4166.9176.50000105T38 T42T38-V40 PolarHBondContact O-N 3.3Å; T38-V40 VanDerWaalsContact O-N 3.08Å; V40-T42 HydrophobicContact CG1-CG2 3.35Å; V40-T42 PolarHBondContact O-N 2.98Å
41L57.6Low61.3Low144 Ų144125.7 Ų125.775%0.75468%0.682SS**  trans-69.662.4163-78.4145.5000108.2L39 S43L39-L41 HydrophobicContact CD2-CD1 3.43Å; L39-L41 VanDerWaalsContact CD2-CD1 3.43Å; L39-L41 HydrophobicContact CD2-CG 3.72Å; L39-L41 PolarHBondContact O-N 3.06Å; L41-S43 PolarHBondContact O-N 2.97Å
42T47.5Very low60Low104 Ų104123.9 Ų123.964%0.63868%0.682SS**  trans-76.186.4159.7430000106V40 D44V40-T42 HydrophobicContact CG1-CG2 3.35Å; V40-T42 PolarHBondContact O-N 2.98Å; T42-D44 PolarHBondContact O-N 2.96Å
43S50Low58.6Low120 Ų120120.7 Ų120.784%0.83968%0.681SS**  trans-64.470.5145.8-54.80000107.4L41L41-S43 PolarHBondContact O-N 2.97Å
44D48.1Very low57.5Low125 Ų125122.9 Ų122.967%0.66869%0.689SS**  trans-128.7124.8160.8-167.817.6000107.3T42 S46T42-D44 PolarHBondContact O-N 2.96Å; D44-S46 PolarHBondContact O-N 3.48Å
45Q52.4Low56.6Low191 Ų191123 Ų12389%0.89368%0.681SS**  trans-72.972.7-173.9-71.9-85.96900109.7
46S43.9Very low56.2Low94 Ų94121.8 Ų121.866%0.65768%0.675SS**  trans-126.489154.550.50000108.3D44D44-S46 PolarHBondContact O-N 3.48Å
47S48.1Very low55.8Low101 Ų101121.3 Ų121.371%0.70667%0.667SS**  trans-43.4135.2153.9-168.70000107.5E49S47-E49 PolarHBondContact O-N 3.16Å
48P49.8Very low55.7Low116 Ų116122.2 Ų122.275%0.75367%0.668SS**  trans-69.482167.431.4-30.1000105.8I50P48-I50 PolarHBondContact O-N 2.94Å
49E51Low55.6Low178 Ų178124.6 Ų124.683%0.83267%0.673SS**  trans-61.595.9147.8-166.3171.1-168.300103.7S47 D51S47-E49 PolarHBondContact O-N 3.16Å; E49-D51 VanDerWaalsContact C-N 3.29Å; E49-D51 PolarHBondContact O-N 3.5Å
50I57.5Low55.4Low118 Ų118122.5 Ų122.561%0.60566%0.662SS**  trans-28.995.2156.141.5147.8000109.9P48 E52P48-I50 PolarHBondContact O-N 2.94Å; I50-E52 HydrophobicContact CB-CG 4.22Å; I50-E52 HydrophobicContact CD1-CG 3.73Å; I50-E52 WeakPolarHBondContact CD1-OE1 3.33Å; I50-E52 HydrophobicContact CG1-CG 4.41Å; I50-E52 PolarHBondContact O-N 3.3Å
51D61.2Low55.4Low102 Ų102124.5 Ų124.555%0.54567%0.665SS.*  trans-6882.8158.9-179.720.1000106.3E49 D53 R54E49-D51 VanDerWaalsContact C-N 3.29Å; E49-D51 PolarHBondContact O-N 3.5Å; D51-D53 PolarHBondContact O-N 3.38Å; D51-D53 VanDerWaalsContact O-N 3.11Å; D51-D53 PolarHBondContact OD1-N 3.47Å; D51-R54 HydrophobicContact CB-CB 4.22Å; D51-R54 WeakPolarHBondContact O-CB 3.32Å; D51-R54 PolarHBondContact O-N 2.75Å; D51-R54 WeakPolarHBondContact OD2-CB 3.41Å
52E60.1Low55.4Low157 Ų157121.3 Ų121.373%0.73465%0.654SS**THydrogen-bonded Turntrans-58.8-13.3175.3-68.5-87.3139.200111.4I50I50-E52 HydrophobicContact CB-CG 4.22Å; I50-E52 HydrophobicContact CD1-CG 3.73Å; I50-E52 WeakPolarHBondContact CD1-OE1 3.33Å; I50-E52 HydrophobicContact CG1-CG 4.41Å; I50-E52 PolarHBondContact O-N 3.3Å
53D59.4Low55.9Low144 Ų144121.4 Ų121.477%0.7766%0.655SS**THydrogen-bonded Turntrans-97.93.3175.7-70.3-45.7000113.8D51 I55D51-D53 PolarHBondContact O-N 3.38Å; D51-D53 VanDerWaalsContact O-N 3.11Å; D51-D53 PolarHBondContact OD1-N 3.47Å; D53-I55 VanDerWaalsContact C-N 3.32Å; D53-I55 PolarHBondContact O-N 3.06Å
54R61.8Low56.2Low188 Ų188122 Ų12271%0.70965%0.648SS**SBendtrans-71.890.3173.3-160.6176.8-177.6-145.13.9109.8D51 P56D51-R54 HydrophobicContact CB-CB 4.22Å; D51-R54 WeakPolarHBondContact O-CB 3.32Å; D51-R54 PolarHBondContact O-N 2.75Å; D51-R54 WeakPolarHBondContact OD2-CB 3.41Å; R54-P56 VanDerWaalsContact O-N 3.08Å
55I62.5Low56.6Low139 Ų139120.2 Ų120.271%0.71364%0.642SS**  trans-32.8118.2170.2-59.8-177.3000109.3D53 N57D53-I55 VanDerWaalsContact C-N 3.32Å; D53-I55 PolarHBondContact O-N 3.06Å; I55-N57 PolarHBondContact O-N 3.28Å
56P62.4Low56.7Low86 Ų86118.4 Ų118.456%0.55864%0.635SS**  trans-60.1106.9-178-24.332.4000109.2R54 P58R54-P56 VanDerWaalsContact O-N 3.08Å; P56-P58 VanDerWaalsContact O-CD 3.25Å; P56-P58 WeakPolarHBondContact O-CD 3.4Å
57N52.5Low57.2Low71 Ų71115.5 Ų115.538%0.3862%0.615SS.*  trans-51.2111.4-177.9177-3.9000109I55 H59 L60I55-N57 PolarHBondContact O-N 3.28Å; N57-H59 PolarHBondContact O-N 3.34Å; N57-H59 VanDerWaalsContact O-N 3.12Å; N57-H59 WeakPolarHBondContact OD1-CB 3.28Å; N57-H59 PolarHBondContact OD1-CD2 3.05Å; N57-H59 PolarHBondContact OD1-N 3.15Å; N57-H59 VanDerWaalsContact OD1-N 3.11Å; N57-L60 HydrophobicContact CB-CD1 3.83Å; N57-L60 HydrophobicContact CB-CG 3.88Å; N57-L60 WeakPolarHBondContact O-CB 3.39Å; N57-L60 PolarHBondContact O-N 2.91Å
58P61.6Low57.7Low81 Ų81115.9 Ų115.953%0.52662%0.615SS.*Hα-helixtrans-64.3-22.2-172.122.6-30.4000112.1P56 L60 K61 S62P56-P58 VanDerWaalsContact O-CD 3.25Å; P56-P58 WeakPolarHBondContact O-CD 3.4Å; P58-L60 VanDerWaalsContact C-N 3.33Å; P58-L60 PolarHBondContact O-N 2.8Å; P58-K61 PolarHBondContact O-N 2.74Å; P58-S62 PolarHBondContact O-N 3.46Å
59H59Low58.2Low141 Ų141120.5 Ų120.565%0.65362%0.617SS**Hα-helixtrans-69.1-31.7178-63.1-111.2000112N57 K61 S62 T63N57-H59 PolarHBondContact O-N 3.34Å; N57-H59 VanDerWaalsContact O-N 3.12Å; N57-H59 WeakPolarHBondContact OD1-CB 3.28Å; N57-H59 PolarHBondContact OD1-CD2 3.05Å; N57-H59 PolarHBondContact OD1-N 3.15Å; N57-H59 VanDerWaalsContact OD1-N 3.11Å; H59-K61 VanDerWaalsContact C-N 3.33Å; H59-K61 PolarHBondContact O-N 3.47Å; H59-S62 PolarHBondContact O-N 2.8Å; H59-T63 PolarHBondContact O-N 3.09Å; H59-T63 PolarHBondContact O-OG1 3.4Å
60L59Low58.7Low97 Ų97120.5 Ų120.551%0.50862%0.617SS.*Hα-helixtrans-67-36178.5-62177.9000111.7N57 P58 T63 L64N57-L60 HydrophobicContact CB-CD1 3.83Å; N57-L60 HydrophobicContact CB-CG 3.88Å; N57-L60 WeakPolarHBondContact O-CB 3.39Å; N57-L60 PolarHBondContact O-N 2.91Å; P58-L60 VanDerWaalsContact C-N 3.33Å; P58-L60 PolarHBondContact O-N 2.8Å; L60-T63 PolarHBondContact O-N 3.11Å; L60-L64 WeakPolarHBondContact O-CD1 3.25Å; L60-L64 PolarHBondContact O-N 3.39Å
61K58.6Low59Low118 Ų118124.5 Ų124.551%0.51363%0.625SS.*Hα-helixtrans-65.8-41178.1-48.6-177.6-156.7-176.20110.6P58 H59 T63 L64 T65P58-K61 PolarHBondContact O-N 2.74Å; H59-K61 VanDerWaalsContact C-N 3.33Å; H59-K61 PolarHBondContact O-N 3.47Å; K61-T63 VanDerWaalsContact C-N 3.34Å; K61-T63 PolarHBondContact O-N 3.38Å; K61-L64 PolarHBondContact O-N 2.97Å; K61-T65 WeakPolarHBondContact O-CG2 3.38Å; K61-T65 PolarHBondContact O-N 3Å; K61-T65 PolarHBondContact O-OG1 3.35Å
62S57.7Low59.3Low76 Ų76128.4 Ų128.453%0.53164%0.637SS.*Hα-helixtrans-63.1-36.5178.2-172.80000112.8P58 H59 L64 T65P58-S62 PolarHBondContact O-N 3.46Å; H59-S62 PolarHBondContact O-N 2.8Å; S62-L64 VanDerWaalsContact C-N 3.35Å; S62-T65 PolarHBondContact O-OG1 3.44Å
63T56.4Low59.8Low107 Ų107130.9 Ų130.966%0.65665%0.645SS**Hα-helixtrans-73.4-28.6177-20.30000112.6H59 L60 K61H59-T63 PolarHBondContact O-N 3.09Å; H59-T63 PolarHBondContact O-OG1 3.4Å; L60-T63 PolarHBondContact O-N 3.11Å; K61-T63 VanDerWaalsContact C-N 3.34Å; K61-T63 PolarHBondContact O-N 3.38Å
64L58Low60.5Low131 Ų131130.6 Ų130.669%0.68664%0.641SS**Hα-helixtrans-77.1-32.8176.6-79.5154.8000112.7L60 K61 S62 M66 S67L60-L64 WeakPolarHBondContact O-CD1 3.25Å; L60-L64 PolarHBondContact O-N 3.39Å; K61-L64 PolarHBondContact O-N 2.97Å; S62-L64 VanDerWaalsContact C-N 3.35Å; L64-M66 VanDerWaalsContact C-N 3.34Å; L64-S67 VanDerWaalsContact O-CB 3.27Å; L64-S67 WeakPolarHBondContact O-CB 3.46Å; L64-S67 PolarHBondContact O-N 3.08Å
65T56.7Low61.6Low89 Ų89127.1 Ų127.155%0.54664%0.641SS.*Hα-helixtrans-73.3-24-18054.80000113.4K61 S62 S67K61-T65 WeakPolarHBondContact O-CG2 3.38Å; K61-T65 PolarHBondContact O-N 3Å; K61-T65 PolarHBondContact O-OG1 3.35Å; S62-T65 PolarHBondContact O-OG1 3.44Å; T65-S67 VanDerWaalsContact C-N 3.3Å
66M52.7Low62.6Low152 Ų152131.7 Ų131.775%0.74965%0.649SS**THydrogen-bonded Turntrans-92.715.2173.4-63.7-61.5129.600113L64 P68L64-M66 VanDerWaalsContact C-N 3.34Å; M66-P68 WeakPolarHBondContact O-CD 3.42Å
67S54.5Low63.9Low33 Ų33134 Ų13423%0.23166%0.655CS.*  trans-79.2126177-163.40000110.5L64 T65 R69L64-S67 VanDerWaalsContact O-CB 3.27Å; L64-S67 WeakPolarHBondContact O-CB 3.46Å; L64-S67 PolarHBondContact O-N 3.08Å; T65-S67 VanDerWaalsContact C-N 3.3Å; S67-R69 PolarHBondContact O-N 3.02Å; S67-R69 WeakPolarHBondContact OG-CB 3.46Å; S67-R69 VanDerWaalsContact OG-CD 3.29Å; S67-R69 WeakPolarHBondContact OG-CD 3.18Å; S67-R69 WeakPolarHBondContact OG-CG 3.46Å
68P59.4Low65.8Low110 Ų110136 Ų13671%0.71467%0.67SS**G310 helixtrans-590.1169.3-2333.8000114.3M66 Q70 R71M66-P68 WeakPolarHBondContact O-CD 3.42Å; P68-Q70 PolarHBondContact O-N 3.07Å; P68-R71 PolarHBondContact O-N 3Å
69R60.1Low67.3Low213 Ų213135.8 Ų135.880%0.80467%0.669SS**G310 helixtrans-69.4-2.7-177.4-76.2178.3171.4-120.1-0.7114.9S67 R71S67-R69 PolarHBondContact O-N 3.02Å; S67-R69 WeakPolarHBondContact OG-CB 3.46Å; S67-R69 VanDerWaalsContact OG-CD 3.29Å; S67-R69 WeakPolarHBondContact OG-CD 3.18Å; S67-R69 WeakPolarHBondContact OG-CG 3.46Å; R69-R71 PolarHBondContact O-N 3.49Å
70Q61.5Low69.1Low178 Ų178132.5 Ų132.583%0.83266%0.659SS**G310 helixtrans-7715.9168.8-68.5-170.2-32.600113.6P68 K72P68-Q70 PolarHBondContact O-N 3.07Å; Q70-K72 PolarHBondContact O-N 3.11Å
71R63.5Low70.9Confident201 Ų201135 Ų13576%0.75867%0.669SS**  trans-46.9114.4166.6-80.1-174.8-89.9136.1-11.7108.8P68 R69 K73P68-R71 PolarHBondContact O-N 3Å; R69-R71 PolarHBondContact O-N 3.49Å; R71-K73 PolarHBondContact O-N 3.13Å; R71-K73 VanDerWaalsContact O-N 3.11Å
72K68.8Low72.7Confident185 Ų185136.6 Ų136.680%0.80468%0.677SS**  trans-35.8118.2176172.2176.8155.3178.20108.8Q70 M74Q70-K72 PolarHBondContact O-N 3.11Å; K72-M74 PolarHBondContact O-N 2.89Å
73K70.6Confident74.5Confident208 Ų208137.7 Ų137.790%0.90467%0.673SS**  trans-68.176174.1-59.9-178.9-172.6178.50107.9R71 T75R71-K73 PolarHBondContact O-N 3.13Å; R71-K73 VanDerWaalsContact O-N 3.11Å; K73-T75 PolarHBondContact O-N 2.93Å
74M73.2Confident76.4Confident139 Ų139135.7 Ų135.769%0.68566%0.658SS**  trans-78.3111.3168178.5174.4171.100106.1K72 R76K72-M74 PolarHBondContact O-N 2.89Å; M74-R76 PolarHBondContact O-N 3.43Å; M74-R76 VanDerWaalsContact O-N 3.15Å
75T85.3Confident78.3Confident115 Ų115136 Ų13671%0.70666%0.656SS**  trans-54.8121.1167.8-58.60000107.2K73 I77K73-T75 PolarHBondContact O-N 2.93Å; T75-I77 WeakPolarHBondContact O-CG1 3.41Å; T75-I77 PolarHBondContact O-N 3.32Å
76R82.9Confident80.1Confident235 Ų235137.2 Ų137.289%0.88766%0.657SS**  trans-63.8111.9173.5-175.1178.9-175.8-145.11107.2M74M74-R76 PolarHBondContact O-N 3.43Å; M74-R76 VanDerWaalsContact O-N 3.15Å
77I89.9Confident82.1Confident135 Ų135134.7 Ų134.769%0.69265%0.645SS**PPolyproline II helixtrans-85.5130178.7-52.2-179.5000107.5T75T75-I77 WeakPolarHBondContact O-CG1 3.41Å; T75-I77 PolarHBondContact O-N 3.32Å
78T91.7Very high84.1Confident113 Ų113137.9 Ų137.969%0.69366%0.662SS**PPolyproline II helixtrans-74.7139.8169.948.70000109.2T80T78-T80 PolarHBondContact O-N 3.16Å
79P93.4Very high85.7Confident75 Ų75139.2 Ų139.249%0.48766%0.659SS.*PPolyproline II helixtrans-59.4142.9179.926.8-34.6000110.6E83 L84P79-E83 VanDerWaalsContact CA-OE2 3.23Å; P79-E83 WeakPolarHBondContact CA-OE2 3.29Å; P79-E83 HydrophobicContact CB-CB 4.47Å; P79-L84 HydrophobicContact CB-CD2 4.18Å; P79-L84 HydrophobicContact CB-CG 4.31Å; P79-L84 HydrophobicContact CG-CD2 4.01Å; P79-L84 HydrophobicContact CG-CG 4.39Å
80T96.1Very high87.3Confident72 Ų72134.6 Ų134.644%0.44265%0.646SS.*PPolyproline II helixtrans-76.6157.5175.468.50000110.4T78 K82 E83 L84T78-T80 PolarHBondContact O-N 3.16Å; T80-K82 PolarHBondContact O-N 3.22Å; T80-E83 PolarHBondContact N-OE2 3.45Å; T80-E83 PolarHBondContact O-N 3.49Å; T80-E83 WeakPolarHBondContact OG1-CG 3.36Å; T80-E83 PolarHBondContact OG1-N 3.12Å; T80-E83 PolarHBondContact OG1-OE2 3.37Å; T80-L84 PolarHBondContact O-N 2.88Å
81M97.4Very high88.8Confident149 Ų149131.9 Ų131.973%0.73463%0.633SS**Hα-helixtrans-56.3-32.9175.3-72.7-56-58.200112.8L84 Q85M81-L84 PolarHBondContact O-N 2.93Å; M81-L84 HydrophobicContact SD-CD1 4.17Å; M81-Q85 WeakPolarHBondContact O-CB 3.47Å; M81-Q85 PolarHBondContact O-N 2.9Å
82K96.5Very high89.9Confident153 Ų153126.8 Ų126.867%0.66562%0.621SS**Hα-helixtrans-66.6-42.1176.3-175.3179.7177-177.80112T80 L84 Q85 M86T80-K82 PolarHBondContact O-N 3.22Å; K82-L84 VanDerWaalsContact C-N 3.34Å; K82-Q85 PolarHBondContact O-N 3.48Å; K82-M86 WeakPolarHBondContact O-CG 3.21Å; K82-M86 PolarHBondContact O-N 3.01Å
83E96.1Very high90.1Very high99 Ų99119.8 Ų119.846%0.46360%0.601SS.*Hα-helixtrans-66.2-38.9177.2-71165.7158.400111.5P79 T80 M86 M87P79-E83 VanDerWaalsContact CA-OE2 3.23Å; P79-E83 WeakPolarHBondContact CA-OE2 3.29Å; P79-E83 HydrophobicContact CB-CB 4.47Å; T80-E83 PolarHBondContact N-OE2 3.45Å; T80-E83 PolarHBondContact O-N 3.49Å; T80-E83 WeakPolarHBondContact OG1-CG 3.36Å; T80-E83 PolarHBondContact OG1-N 3.12Å; T80-E83 PolarHBondContact OG1-OE2 3.37Å; E83-M86 PolarHBondContact O-N 3.17Å; E83-M87 WeakPolarHBondContact O-CB 3.48Å; E83-M87 PolarHBondContact O-N 3.48Å
84L96.7Very high90.2Very high65 Ų65115.3 Ų115.334%0.3458%0.583SS.*Hα-helixtrans-64.3-43.7173.8-66.1176.2000111.5P79 T80 M81 K82 M86 M87 V88P79-L84 HydrophobicContact CB-CD2 4.18Å; P79-L84 HydrophobicContact CB-CG 4.31Å; P79-L84 HydrophobicContact CG-CD2 4.01Å; P79-L84 HydrophobicContact CG-CG 4.39Å; T80-L84 PolarHBondContact O-N 2.88Å; M81-L84 PolarHBondContact O-N 2.93Å; M81-L84 HydrophobicContact SD-CD1 4.17Å; K82-L84 VanDerWaalsContact C-N 3.34Å; L84-M86 PolarHBondContact O-N 3.38Å; L84-M87 HydrophobicContact CD2-CE 4.47Å; L84-M87 WeakPolarHBondContact O-CB 3.39Å; L84-M87 PolarHBondContact O-N 3.18Å; L84-V88 WeakPolarHBondContact O-CG2 3.27Å; L84-V88 PolarHBondContact O-N 3.02Å
85Q96.5Very high89.7Confident136 Ų136115.1 Ų115.164%0.63658%0.581SS**Hα-helixtrans-60-45.9176.9-171.9168.721.500111.6M81 K82 M87 V88 E89M81-Q85 WeakPolarHBondContact O-CB 3.47Å; M81-Q85 PolarHBondContact O-N 2.9Å; K82-Q85 PolarHBondContact O-N 3.48Å; Q85-M87 VanDerWaalsContact C-N 3.3Å; Q85-M87 PolarHBondContact O-N 2.98Å; Q85-V88 PolarHBondContact O-N 2.82Å; Q85-E89 WeakPolarHBondContact O-CB 3.36Å; Q85-E89 PolarHBondContact O-N 2.88Å
86M95.5Very high88.5Confident115 Ų115116.8 Ų116.857%0.56758%0.581SS**Hα-helixtrans-60.4-39.6174.5-72.618061.200112.4K82 E83 L84 H90K82-M86 WeakPolarHBondContact O-CG 3.21Å; K82-M86 PolarHBondContact O-N 3.01Å; E83-M86 PolarHBondContact O-N 3.17Å; L84-M86 PolarHBondContact O-N 3.38Å; M86-H90 WeakPolarHBondContact O-CB 3.41Å; M86-H90 PolarHBondContact O-N 2.79Å
87M95.3Very high87.1Confident100 Ų100113 Ų11349%0.49357%0.573SS.*Hα-helixtrans-65.8-43.1177.9-167.8-177.1-45.500111.3E83 L84 Q85 H91E83-M87 WeakPolarHBondContact O-CB 3.48Å; E83-M87 PolarHBondContact O-N 3.48Å; L84-M87 HydrophobicContact CD2-CE 4.47Å; L84-M87 WeakPolarHBondContact O-CB 3.39Å; L84-M87 PolarHBondContact O-N 3.18Å; Q85-M87 VanDerWaalsContact C-N 3.3Å; Q85-M87 PolarHBondContact O-N 2.98Å; M87-H91 PolarHBondContact O-N 3.22Å; M87-H91 VanDerWaalsContact O-N 3.11Å; M87-H91 PolarHBondContact O-ND1 3.29Å
88V94.9Very high85.3Confident100 Ų100109.6 Ų109.661%0.60657%0.571SS**Hα-helixtrans-64.1-47.4176.8171.30000110.9L84 Q85 H90 H91 L92L84-V88 WeakPolarHBondContact O-CG2 3.27Å; L84-V88 PolarHBondContact O-N 3.02Å; Q85-V88 PolarHBondContact O-N 2.82Å; V88-H90 VanDerWaalsContact C-N 3.32Å; V88-H90 PolarHBondContact O-N 2.94Å; V88-H91 PolarHBondContact O-N 3.29Å; V88-H91 VanDerWaalsContact O-N 3.17Å; V88-L92 PolarHBondContact O-N 2.72Å
89E92.9Very high83.2Confident137 Ų137112.3 Ų112.364%0.6458%0.576SS**Hα-helixtrans-59.4-43.2178.7-175.2175.6-17600111.6Q85 H91 L92 G93Q85-E89 WeakPolarHBondContact O-CB 3.36Å; Q85-E89 PolarHBondContact O-N 2.88Å; E89-H91 PolarHBondContact O-N 3.41Å; E89-L92 PolarHBondContact O-N 2.92Å; E89-G93 PolarHBondContact O-N 3.05Å
90H94.4Very high80.9Confident116 Ų116117.1 Ų117.154%0.53759%0.592SS.*Hα-helixtrans-59.8-46.2174.5178.9-84.8000112M86 V88 L92 Q94M86-H90 WeakPolarHBondContact O-CB 3.41Å; M86-H90 PolarHBondContact O-N 2.79Å; V88-H90 VanDerWaalsContact C-N 3.32Å; V88-H90 PolarHBondContact O-N 2.94Å; H90-L92 VanDerWaalsContact C-N 3.33Å; H90-L92 PolarHBondContact O-N 3.29Å; H90-Q94 WeakPolarHBondContact O-CB 3.41Å; H90-Q94 WeakPolarHBondContact O-CG 3.38Å; H90-Q94 PolarHBondContact O-N 3.25Å
91H92.8Very high78.9Confident122 Ų122119 Ų11957%0.56561%0.605SS**Hα-helixtrans-67.4-35.3-179.9-73.986.8000112.6M87 V88 E89 Q95M87-H91 PolarHBondContact O-N 3.22Å; M87-H91 VanDerWaalsContact O-N 3.11Å; M87-H91 PolarHBondContact O-ND1 3.29Å; V88-H91 PolarHBondContact O-N 3.29Å; V88-H91 VanDerWaalsContact O-N 3.17Å; E89-H91 PolarHBondContact O-N 3.41Å; H91-Q95 PolarHBondContact O-N 3.22Å
92L87.3Confident76.9Confident93 Ų93121.4 Ų121.449%0.48762%0.615SS.*Hα-helixtrans-70.7-44.3177.5-173.660.5000111.5V88 E89 H90 Q94 Q95 E96V88-L92 PolarHBondContact O-N 2.72Å; E89-L92 PolarHBondContact O-N 2.92Å; H90-L92 VanDerWaalsContact C-N 3.33Å; H90-L92 PolarHBondContact O-N 3.29Å; L92-Q94 VanDerWaalsContact C-N 3.33Å; L92-Q94 PolarHBondContact O-N 3.44Å; L92-Q95 WeakPolarHBondContact O-CB 3.34Å; L92-Q95 PolarHBondContact O-N 2.98Å; L92-Q95 VanDerWaalsContact O-N 3.09Å; L92-E96 PolarHBondContact O-N 3.44Å
93G73.6Confident74.2Confident38 Ų38117.6 Ų117.639%0.39262%0.618SS.*Hα-helixtrans-63.4-36.3176.200000113.4E89 Q95 E96 Q97E89-G93 PolarHBondContact O-N 3.05Å; G93-Q95 VanDerWaalsContact C-N 3.3Å; G93-Q95 PolarHBondContact O-N 2.83Å; G93-E96 PolarHBondContact O-N 2.85Å; G93-Q97 PolarHBondContact O-N 3.11Å
94Q71Confident71.6Confident114 Ų114117.9 Ų117.953%0.53364%0.638SS.*Hα-helixtrans-69.2-27.6173.8-67.5-69.5111.500112.7H90 L92H90-Q94 WeakPolarHBondContact O-CB 3.41Å; H90-Q94 WeakPolarHBondContact O-CG 3.38Å; H90-Q94 PolarHBondContact O-N 3.25Å; L92-Q94 VanDerWaalsContact C-N 3.33Å; L92-Q94 PolarHBondContact O-N 3.44Å
95Q63.9Low69.1Low136 Ų136119.9 Ų119.964%0.63666%0.664SS**Hα-helixtrans-70.4-42.8175.3-175.3179.340.600111.1H91 L92 G93 Q97 G98H91-Q95 PolarHBondContact O-N 3.22Å; L92-Q95 WeakPolarHBondContact O-CB 3.34Å; L92-Q95 PolarHBondContact O-N 2.98Å; L92-Q95 VanDerWaalsContact O-N 3.09Å; G93-Q95 VanDerWaalsContact C-N 3.3Å; G93-Q95 PolarHBondContact O-N 2.83Å; Q95-Q97 VanDerWaalsContact C-N 3.32Å; Q95-Q97 PolarHBondContact O-N 2.85Å; Q95-G98 PolarHBondContact O-N 3.01Å
96E58.8Low66.5Low150 Ų150122.6 Ų122.670%0.70168%0.677SS**Hα-helixtrans-72.8-23.5-178.9-61.6-158.5119.800113.3L92 G93 G98L92-E96 PolarHBondContact O-N 3.44Å; G93-E96 PolarHBondContact O-N 2.85Å; E96-G98 PolarHBondContact O-N 3.38Å
97Q54.3Low64Low155 Ų155122 Ų12272%0.72468%0.683SS**THydrogen-bonded Turntrans-79.22175.2-150.6169.130.200113.6G93 Q95G93-Q97 PolarHBondContact O-N 3.11Å; Q95-Q97 VanDerWaalsContact C-N 3.32Å; Q95-Q97 PolarHBondContact O-N 2.85Å
98G51.5Low61.5Low63 Ų63123.7 Ų123.765%0.64970%0.7SS**THydrogen-bonded Turntrans-94.6-6177.800000115.6Q95 E96Q95-G98 PolarHBondContact O-N 3.01Å; E96-G98 PolarHBondContact O-N 3.38Å
99E48.8Very low58.8Low171 Ų171122.2 Ų122.280%0.79971%0.705SS**  trans-11273.3177.5-75.1-178.7109.100110.7
100E44.8Very low56.4Low175 Ų175121.6 Ų121.682%0.81871%0.71SS**  trans-82.5126.1164.8-87.5-77.4125.900110.3
101P54.2Low53.7Low111 Ų111124.8 Ų124.872%0.72173%0.726SS**  trans-82.5115.9170.731-30.4000112.3
102E55.1Low51.4Low201 Ų201127.3 Ų127.394%0.93974%0.738SS**  trans22.5117.8142.5-163.8-176.8148.800119.6
103G39.8Very low49.2Very low72 Ų72128.6 Ų128.674%0.74275%0.754SS**  trans154.993.214900000119
104A42.6Very low48.2Very low106 Ų106136.3 Ų136.388%0.87677%0.771SS**  trans65.499.9149.500000120.8
105A42.5Very low47.1Very low106 Ų106136.1 Ų136.188%0.87678%0.78SS**  -179132.1120.400000111
106E43.6Very low46.6Very low194 Ų194135.3 Ų135.391%0.90779%0.787SS**  trans-59.3134.5178.4-169.5-179.1165.500113.2
107S41.7Very low45.8Very low101 Ų101131.5 Ų131.571%0.70679%0.787SS**  trans172.9102.7136.8-173.40000113.8
108T43.4Very low45.9Very low137 Ų137131.8 Ų131.884%0.8479%0.792SS**  trans50.6121.9140.5720000122.2
109G39Very low45.7Very low69 Ų69134.3 Ų134.371%0.71180%0.797SS**  trans142.268.8144.200000119.6
110T41.9Very low45.2Very low124 Ų124133.9 Ų133.976%0.76180%0.8SS**  trans64.192.7134.6-470000119
111Q38.3Very low45.2Very low183 Ų183131.9 Ų131.986%0.85580%0.8SS**  159.3102.4110-68.3-124.8-14.900112.2
112E44Very low44.8Very low175 Ų175135 Ų13582%0.81881%0.806SS**  trans-108.2130.4163.2-174.3-162130.900107.9
113S41.6Very low44.4Very low119 Ų119131.7 Ų131.783%0.83280%0.799SS**  trans-141.799149.859.30000110.4
114R50.6Low44.4Very low200 Ų200135.5 Ų135.576%0.75580%0.797SS**  trans-39.2143.5164.2172.7179.3179.1175.72.3113.9
115P48.1Very low44.4Very low111 Ų111134.9 Ų134.972%0.72179%0.786SS**PPolyproline II helixtrans-71.5133.6166.729-31.6000110.7G117P115-G117 PolarHBondContact O-N 3.41Å
116P53.8Low44.7Very low119 Ų119140.4 Ų140.477%0.77378%0.784SS**PPolyproline II helixtrans-69.6127.4178.3-14.828.4000111.7
117G42.2Very low44.7Very low69 Ų69139.9 Ų139.971%0.71179%0.787SS**PPolyproline II helixtrans-72.9134.3155.700000109.3P115P115-G117 PolarHBondContact O-N 3.41Å
118I55.8Low44.4Very low162 Ų162138.7 Ų138.783%0.83179%0.79SS**PPolyproline II helixtrans-88.7135.5168.153.1173.6000108.8
119P47.4Very low44.6Very low115 Ų115138.5 Ų138.575%0.74779%0.79SS**PPolyproline II helixtrans-74.2141.6178.829.5-33.2000111.7T121P119-T121 PolarHBondContact O-N 3.47Å
120D38.7Very low44.7Very low162 Ų162140.8 Ų140.887%0.86679%0.794SS**PPolyproline II helixtrans-52.9127.9164.2-71-62000110.6
121T44.6Very low44.7Very low134 Ų134137.7 Ų137.782%0.82279%0.788SS**  trans-114.4100.6152.6-40.50000106.6P119 V123P119-T121 PolarHBondContact O-N 3.47Å; T121-V123 PolarHBondContact O-N 3.48Å
122E46.6Very low44.9Very low177 Ų177135.5 Ų135.583%0.82779%0.787SS**  trans-56.1121.8168.2-177.3-166.1134.900110.3
123V46.8Very low45Very low131 Ų131131.5 Ų131.579%0.79478%0.784SS**  trans-149.9102.4137.8-83.60000109T121T121-V123 PolarHBondContact O-N 3.48Å
124E39.7Very low45.3Very low152 Ų152135 Ų13571%0.7178%0.784SS**  55.9101.4129.1-130.5177.9123.800119.9
125S42.1Very low45.4Very low93 Ų93134.7 Ų134.765%0.6579%0.788SS**  58.2136.9118.1-44.20000122.1
126R49.1Very low45.1Very low221 Ų221135.3 Ų135.383%0.83479%0.792SS**  trans98.7106.1144.6-44.8-163.6-165.5-137-0.6117
127L43.8Very low44.4Very low183 Ų183133.8 Ų133.896%0.95879%0.789SS**  37.5111.1117.5-153.877000116.2
128G35.7Very low44.5Very low76 Ų76139.6 Ų139.678%0.78480%0.798SS**  trans-171.2111.7171.100000114.2
129T46.6Very low43.8Very low134 Ų134137.2 Ų137.282%0.82280%0.796SS**  trans-66.6174169.253.10000113.1
130S41Very low44.2Very low116 Ų116138.9 Ų138.981%0.81180%0.797SS**  trans86.1128.5171.5880000113.5
131G42.4Very low44.6Very low60 Ų60136.6 Ų136.662%0.61979%0.791SS**  cis97.5103.538.900000107.5
132T41.4Very low44.4Very low137 Ų137140 Ų14084%0.8480%0.795SS**  trans154.3130.913950.40000111.2
133A46.2Very low44.2Very low91 Ų91138.2 Ų138.275%0.75280%0.796SS**  trans-62.9143.8176.200000112.6
134K48Very low44.1Very low192 Ų192140.9 Ų140.984%0.83580%0.799SS**  trans-142.5110.7157-60.6-67.1164.8-179.30110.5
135K53.9Low44.6Very low193 Ų193142.7 Ų142.784%0.83981%0.808SS**  trans-17.9132.2157.7-176.6-177.3-177.5-179.70115.4
136P42.4Very low44.6Very low124 Ų124149.2 Ų149.281%0.80582%0.818SS**PPolyproline II helixtrans-80.7123.2162.126.9-20.8000109.9
137A37.8Very low44.4Very low87 Ų87142.2 Ų142.272%0.71982%0.815SS**PPolyproline II helixtrans-71.5143167.100000110S139A137-S139 PolarHBondContact O-N 3.07Å
138E44Very low44.5Very low191 Ų191138.6 Ų138.689%0.89381%0.805SS**PPolyproline II helixtrans-54.7128.8175-66.5162.312600111.1
139S41.8Very low45.2Very low112 Ų112145.1 Ų145.178%0.78381%0.812SS**  trans-129.4100.8166.8-179.10000107.7A137 P141A137-S139 PolarHBondContact O-N 3.07Å; S139-P141 WeakPolarHBondContact O-CD 3.25Å
140I55.5Low45.5Very low150 Ų150147.3 Ų147.377%0.76981%0.813SS**PPolyproline II helixtrans-82.1118.9173.9-59.4163.7000107.2K142I140-K142 PolarHBondContact O-N 3.12Å
141P46.3Very low45.7Very low115 Ų115147.2 Ų147.275%0.74781%0.809SS**PPolyproline II helixtrans-77.7121.8165.828.1-29000110.1S139 T143S139-P141 WeakPolarHBondContact O-CD 3.25Å; P141-T143 PolarHBondContact O-N 3.48Å
142K40.7Very low45.9Very low206 Ų206149.9 Ų149.990%0.89682%0.818SS**PPolyproline II helixtrans-57.3120.1170.7-85.8171.2169.7171.60110.8I140 Q144I140-K142 PolarHBondContact O-N 3.12Å; K142-Q144 PolarHBondContact O-N 3.35Å
143T42.5Very low46.1Very low138 Ų138149.5 Ų149.585%0.84782%0.816SS**PPolyproline II helixtrans-66.2123.4167.4-580000110.3P141 Q145P141-T143 PolarHBondContact O-N 3.48Å; T143-Q145 PolarHBondContact O-N 3.37Å
144Q45.6Very low46.5Very low187 Ų187154.1 Ų154.187%0.87482%0.819SS**PPolyproline II helixtrans-71.3118.8172.4-155.2-179.236.100109.1K142 R146K142-Q144 PolarHBondContact O-N 3.35Å; Q144-R146 PolarHBondContact O-N 3.22Å
145Q48.9Very low46.7Very low190 Ų190153.3 Ų153.389%0.88882%0.818SS**  trans-66.9104.1176-176.8-176.56800109.5T143T143-Q145 PolarHBondContact O-N 3.37Å
146R42.6Very low46.7Very low231 Ų231149.3 Ų149.387%0.87281%0.812SS**  trans-108.2102.5160.7-169.7179.4-93.4-153.2-2.7107.6Q144 S148Q144-R146 PolarHBondContact O-N 3.22Å; R146-S148 PolarHBondContact O-N 3.11Å
147G45.8Very low47.2Very low74 Ų74148.8 Ų148.876%0.76381%0.811SS**  trans-60.4120.5176.100000110.8
148S44.6Very low48Very low106 Ų106150.3 Ų150.374%0.74181%0.812SS**  trans-118.5110.7164-43.80000105.3R146R146-S148 PolarHBondContact O-N 3.11Å
149K51.3Low48.8Very low214 Ų214148.5 Ų148.593%0.9380%0.803SS**  trans-79113.8170.6-60.4-175.1179.7-169.20106.4
150E53.4Low49.9Very low180 Ų180149.8 Ų149.884%0.84180%0.8SS**  trans-116.3138.9161.5-86.8-16912600109.8
151P45.4Very low50.4Low114 Ų114146.7 Ų146.774%0.7479%0.789SS**  trans-73.6133.6-171.928.8-33.3000112.1T153P151-T153 PolarHBondContact O-N 2.81Å
152S46.6Very low51.2Low116 Ų116146.5 Ų146.581%0.81179%0.788SS**  trans-52.9112.2164.9174.90000111.3
153T45.9Very low52.1Low129 Ų129144.9 Ų144.979%0.79179%0.788SS**  trans-103.3102159.8410000108.9P151 E155P151-T153 PolarHBondContact O-N 2.81Å; T153-E155 PolarHBondContact O-N 3.2Å
154K54.3Low52.7Low187 Ų187144.5 Ų144.581%0.81378%0.781SS**  trans-54.4109.4166.4178.8-169.4-179.2-159.10109.5
155E52.4Low53.4Low175 Ų175141.5 Ų141.582%0.81878%0.781SS**  trans-70.7132.5164.1-65-158142.900109.3T153 S157T153-E155 PolarHBondContact O-N 3.2Å; E155-S157 PolarHBondContact O-N 3.13Å
156P53.8Low53.8Low110 Ų110141.3 Ų141.371%0.71478%0.777SS**  trans-72.5111.7171.428.2-30.3000109.2T158P156-T158 PolarHBondContact O-N 3.05Å
157S52.4Low54.2Low112 Ų112133 Ų13378%0.78376%0.763SS**  trans-54.1101.1164.3168.10000110.2E155 H159E155-S157 PolarHBondContact O-N 3.13Å; S157-H159 VanDerWaalsContact C-N 3.34Å; S157-H159 PolarHBondContact O-N 2.98Å
158T53.9Low54.5Low120 Ų120134.6 Ų134.674%0.73677%0.77SS**  trans-75.691.2165.5-54.20000108.2P156 I160P156-T158 PolarHBondContact O-N 3.05Å; T158-I160 HydrophobicContact CG2-CG1 4.21Å; T158-I160 PolarHBondContact O-N 3.21Å; T158-I160 VanDerWaalsContact O-N 3.13Å
159H61.3Low54.9Low152 Ų152137.1 Ų137.170%0.70478%0.775SS**  trans-68.1101.5167.9173.4-78.4000108.5S157 P161S157-H159 VanDerWaalsContact C-N 3.34Å; S157-H159 PolarHBondContact O-N 2.98Å; H159-P161 WeakPolarHBondContact O-CD 3.4Å
160I64Low55.2Low140 Ų140132.6 Ų132.672%0.71877%0.77SS**  trans-81.4115.5173.5-55.4172.9000107.2T158T158-I160 HydrophobicContact CG2-CG1 4.21Å; T158-I160 PolarHBondContact O-N 3.21Å; T158-I160 VanDerWaalsContact O-N 3.13Å
161P66.6Low55.2Low84 Ų84134.4 Ų134.455%0.54579%0.793SS.*  trans-68.3150.5172.829.3-32.6000110H159 L163H159-P161 WeakPolarHBondContact O-CD 3.4Å; P161-L163 PolarHBondContact O-N 3.4Å
162P62.4Low55.7Low112 Ų112135.5 Ų135.573%0.72780%0.796SS**  trans-60.2134.8174.3-11.124000109.5D164P162-D164 PolarHBondContact O-N 3.17Å
163L61.2Low56.2Low171 Ų171136.5 Ų136.590%0.89580%0.795SS**  trans-68.4110170.7-83.1153.4000108.9P161 S165P161-L163 PolarHBondContact O-N 3.4Å; L163-S165 PolarHBondContact O-N 3.02Å; L163-S165 VanDerWaalsContact O-N 3.14Å
164D54.6Low56.7Low131 Ų131136.9 Ų136.970%0.70180%0.795SS**  trans-56.6116.2173.2-32.4-35.7000109.4P162 K166P162-D164 PolarHBondContact O-N 3.17Å; D164-K166 PolarHBondContact O-N 3.14Å
165S60.1Low56.9Low124 Ų124133.9 Ų133.987%0.86779%0.794SS**  trans-67.4102171.4-73.90000109.2L163 G167L163-S165 PolarHBondContact O-N 3.02Å; L163-S165 VanDerWaalsContact O-N 3.14Å; S165-G167 PolarHBondContact O-N 3.21Å
166K57.9Low57.1Low185 Ų185131.4 Ų131.480%0.80479%0.792SS**  trans-89.2102.9168.8-68.8-68179.8-176.70109.7D164D164-K166 PolarHBondContact O-N 3.14Å
167G49.4Very low57.4Low56 Ų56132.8 Ų132.858%0.57780%0.798SS**  trans31.9108143.500000118.6S165 N169S165-G167 PolarHBondContact O-N 3.21Å; G167-N169 PolarHBondContact O-N 3.49Å
168A52.3Low57.7Low109 Ų109134.3 Ų134.390%0.90180%0.799SS**  trans-64.4107.6149.700000108.6
169N52.7Low58Low159 Ų159135.4 Ų135.485%0.8580%0.803SS**  trans-88.7104.7165.1-55.2-43.3000106.9G167G167-N169 PolarHBondContact O-N 3.49Å
170S57.6Low57.7Low119 Ų119134 Ų13483%0.83281%0.812SS**  trans-81.1117.6162.7-132.70000107.7
171V54.1Low57.2Low218 Ų218133.5 Ų133.5100%1.32182%0.82SS**  trans-155.70139.9-177.70000107.7

Retrieved 171 of 171 residues in 68.7 ms (Link to these results)