A0A087YCG2_POEFO Loading...

WAS/WASL interacting protein family member 1

AlphaFold DB , UniProt , Accession A0A087YCG2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 519 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
1M72.8Confident80.7Confident228 Ų228120.7 Ų120.7100%1.12379%0.788SS**  0130.80-68-59.2-79.600108.3
2P71.1Confident80.8Confident124 Ų124120.9 Ų120.981%0.80579%0.789SS**PPolyproline II helixtrans-61.1146.3168.9-18.532.1000110.4
3A74.8Confident80.7Confident91 Ų91120.3 Ų120.375%0.75279%0.785SS**PPolyproline II helixtrans-66144.4173.300000110.4
4P82.7Confident80.7Confident114 Ų114120.1 Ų120.174%0.7478%0.783SS**PPolyproline II helixtrans-63.3147.1174.527.9-34.3000110.4
5P83.1Confident80.3Confident114 Ų114119.2 Ų119.274%0.7478%0.777SS**PPolyproline II helixtrans-62148.2177.127.3-34.7000110.8
6P85.1Confident79.7Confident115 Ų115119.3 Ų119.375%0.74778%0.777SS**PPolyproline II helixtrans-61.3149176.727.1-34.7000110.8
7P85.3Confident78.7Confident116 Ų116117.7 Ų117.775%0.75377%0.765SS**PPolyproline II helixtrans-62.3148.8176.527.7-34.8000110.7
8P84.1Confident77.6Confident116 Ų116120.3 Ų120.375%0.75377%0.77SS**PPolyproline II helixtrans-61.4147.3175.727.1-34.6000110.6
9P85Confident76.5Confident116 Ų116117.7 Ų117.775%0.75376%0.761SS**PPolyproline II helixtrans-62.5152.717827-34.7000111.1G11P9-G11 PolarHBondContact O-N 3.2Å
10P83.8Confident75.5Confident130 Ų130119.1 Ų119.184%0.84476%0.761SS**PPolyproline II helixtrans-54.5138.3173.5-23.833.9000111.4
11G80.4Confident74.4Confident64 Ų64116.9 Ų116.966%0.6675%0.753SS**PPolyproline II helixtrans-60.7153174.100000111.7P9P9-G11 PolarHBondContact O-N 3.2Å
12P81.1Confident73.7Confident123 Ų123112.8 Ų112.880%0.79974%0.736SS**PPolyproline II helixtrans-58.8147.9177.226.3-34.6000110.7
13P80.2Confident73Confident113 Ų113112.4 Ų112.473%0.73473%0.732SS**PPolyproline II helixtrans-59.3149177.226.3-34.6000110.6
14P79.9Confident72.4Confident117 Ų117115.7 Ų115.776%0.7673%0.731SS**PPolyproline II helixtrans-58.9144.4177.926-34.5000110.3
15P74.8Confident71.7Confident107 Ų107119.1 Ų119.170%0.69573%0.734SS**PPolyproline II helixtrans-59.3143.6179.125.7-34.5000110.2T17P15-T17 PolarHBondContact O-N 3.41Å
16P70.8Confident71.1Confident120 Ų120117.3 Ų117.378%0.77972%0.723SS**PPolyproline II helixtrans-59116.5177.524.7-33.3000109.2
17T62.7Low70.8Confident93 Ų93118.5 Ų118.557%0.57173%0.728SS**PPolyproline II helixtrans-69.2135.7176.452.90000109P15 A19 L20P15-T17 PolarHBondContact O-N 3.41Å; T17-A19 PolarHBondContact O-N 3.07Å; T17-L20 PolarHBondContact O-N 3.39Å
18L58.5Low70.4Confident164 Ų164114.5 Ų114.586%0.85970%0.7SS**G310 helixtrans-60.4-7.5177.6-63.8175.5000113.4L20 A21L18-L20 PolarHBondContact O-N 3.19Å; L18-A21 PolarHBondContact O-N 3.48Å
19A58.2Low70.5Confident72 Ų72112.1 Ų112.160%0.59569%0.686SS**G310 helixtrans-65.9-11.9173.300000114.6T17 T23T17-A19 PolarHBondContact O-N 3.07Å; A19-T23 WeakPolarHBondContact O-CG2 3.4Å
20L56.6Low70.4Confident145 Ų145117 Ų11776%0.75969%0.69SS**G310 helixtrans-89.6-6.4176.8-77.4163.5000114.2T17 L18T17-L20 PolarHBondContact O-N 3.39Å; L18-L20 PolarHBondContact O-N 3.19Å
21A51.4Low70.6Confident72 Ų72116.6 Ų116.660%0.59569%0.685SS**SBendtrans-104.4118.4171.800000110L18L18-A21 PolarHBondContact O-N 3.48Å
22N58.1Low71Confident143 Ų143118.3 Ų118.377%0.76568%0.676SS**  trans67.260.1-172.7-69.8-70.9000116.3
23T56.7Low71.4Confident116 Ų116118 Ų11871%0.71266%0.664SS**  trans-79.7-23.4155.551.50000112.6A19 K25A19-T23 WeakPolarHBondContact O-CG2 3.4Å; T23-K25 PolarHBondContact O-N 3.1Å; T23-K25 VanDerWaalsContact O-N 3.16Å
24E62.5Low71.8Confident160 Ų160119.8 Ų119.875%0.74866%0.662SS**SBendtrans-69.1106.5170.3-67.4-111.9138.500109.7P26E24-P26 VanDerWaalsContact O-CD 3.32Å; E24-P26 WeakPolarHBondContact O-CD 3.44Å
25K67.2Low72.4Confident185 Ų185116.2 Ų116.280%0.80465%0.646SS**  trans-64.7120.2172.7-176.8-178.2-178.2-177.60108.4T23 T27T23-K25 PolarHBondContact O-N 3.1Å; T23-K25 VanDerWaalsContact O-N 3.16Å; K25-T27 PolarHBondContact O-N 3.12Å; K25-T27 VanDerWaalsContact O-N 3.14Å
26P70.6Confident73.3Confident77 Ų77117.6 Ų117.650%0.564%0.638SS.*  trans-52.5123.2-178.2-29.435.9000111.6E24 L28E24-P26 VanDerWaalsContact O-CD 3.32Å; E24-P26 WeakPolarHBondContact O-CD 3.44Å; P26-L28 HydrophobicContact CB-CD2 3.83Å; P26-L28 HydrophobicContact CB-CG 4.28Å; P26-L28 PolarHBondContact O-N 3.46Å
27T78.9Confident74.3Confident140 Ų140113.7 Ų113.786%0.85962%0.619SS**  trans-79.860.4-175.546.80000111.1K25 S29K25-T27 PolarHBondContact O-N 3.12Å; K25-T27 VanDerWaalsContact O-N 3.14Å; T27-S29 PolarHBondContact O-N 3.04Å
28L77Confident75.7Confident32 Ų32111.5 Ų111.517%0.16861%0.611CS.*  trans-60.3134.6-179.2-51.7-174.3000110.5P26 E32 Q33P26-L28 HydrophobicContact CB-CD2 3.83Å; P26-L28 HydrophobicContact CB-CG 4.28Å; P26-L28 PolarHBondContact O-N 3.46Å; L28-E32 WeakPolarHBondContact CA-OE2 3.44Å; L28-E32 HydrophobicContact CB-CB 4.25Å; L28-E32 HydrophobicContact CB-CG 4.01Å; L28-E32 HydrophobicContact CD1-CG 4.47Å; L28-E32 HydrophobicContact CD2-CG 4.23Å; L28-E32 WeakPolarHBondContact CD2-OE1 3.49Å; L28-E32 HydrophobicContact CG-CG 4.45Å; L28-Q33 HydrophobicContact CB-CG 3.69Å; L28-Q33 PolarHBondContact O-NE2 2.86Å
29S85.2Confident77.4Confident65 Ų65108.7 Ų108.746%0.45560%0.596SS.*  trans-62.9160.7175.867.80000111.7T27 T31 E32 Q33T27-S29 PolarHBondContact O-N 3.04Å; S29-T31 VanDerWaalsContact C-N 3.26Å; S29-T31 PolarHBondContact O-N 3.35Å; S29-E32 PolarHBondContact N-OE2 3.46Å; S29-E32 VanDerWaalsContact N-OE2 3.12Å; S29-E32 WeakPolarHBondContact O-CB 3.34Å; S29-E32 PolarHBondContact O-N 3.41Å; S29-E32 VanDerWaalsContact OG-CB 3.24Å; S29-E32 WeakPolarHBondContact OG-CB 3.38Å; S29-E32 PolarHBondContact OG-N 2.96Å; S29-Q33 WeakPolarHBondContact O-CG 3.24Å; S29-Q33 PolarHBondContact O-N 3.49Å
30R84.8Confident79.1Confident220 Ų220109.4 Ų109.483%0.8359%0.59SS**Hα-helixtrans-56.2-40-177.5-166.4173.4-171.5143.90.9112.7Q34R30-Q34 PolarHBondContact O-N 2.81Å
31T86.6Confident80.7Confident120 Ų120104.5 Ų104.574%0.73657%0.567SS**Hα-helixtrans-64.8-40.9175.3-490000112S29 Q34 G35S29-T31 VanDerWaalsContact C-N 3.26Å; S29-T31 PolarHBondContact O-N 3.35Å; T31-Q34 PolarHBondContact O-N 2.88Å; T31-G35 PolarHBondContact O-N 3.01Å
32E89.6Confident82.6Confident100 Ų100105.2 Ų105.247%0.46756%0.561SS.*Hα-helixtrans-74.1-36.2-178.7-175.6179.6-16500112.7L28 S29 Q34 G35 R36L28-E32 WeakPolarHBondContact CA-OE2 3.44Å; L28-E32 HydrophobicContact CB-CB 4.25Å; L28-E32 HydrophobicContact CB-CG 4.01Å; L28-E32 HydrophobicContact CD1-CG 4.47Å; L28-E32 HydrophobicContact CD2-CG 4.23Å; L28-E32 WeakPolarHBondContact CD2-OE1 3.49Å; L28-E32 HydrophobicContact CG-CG 4.45Å; S29-E32 PolarHBondContact N-OE2 3.46Å; S29-E32 VanDerWaalsContact N-OE2 3.12Å; S29-E32 WeakPolarHBondContact O-CB 3.34Å; S29-E32 PolarHBondContact O-N 3.41Å; S29-E32 VanDerWaalsContact OG-CB 3.24Å; S29-E32 WeakPolarHBondContact OG-CB 3.38Å; S29-E32 PolarHBondContact OG-N 2.96Å; E32-Q34 VanDerWaalsContact C-N 3.29Å; E32-Q34 PolarHBondContact O-N 3.12Å; E32-G35 PolarHBondContact O-N 3.44Å; E32-R36 VanDerWaalsContact O-CB 3.32Å; E32-R36 WeakPolarHBondContact O-CB 3.22Å; E32-R36 PolarHBondContact O-N 3.14Å
33Q89.4Confident84.1Confident117 Ų117103.8 Ų103.855%0.54755%0.552SS.*Hα-helixtrans-59.3-42.3169.6-69179.510.300111L28 S29 G37L28-Q33 HydrophobicContact CB-CG 3.69Å; L28-Q33 PolarHBondContact O-NE2 2.86Å; S29-Q33 WeakPolarHBondContact O-CG 3.24Å; S29-Q33 PolarHBondContact O-N 3.49Å; Q33-G37 PolarHBondContact O-N 2.77Å
34Q89.1Confident85.6Confident150 Ų150103.6 Ų103.670%0.70156%0.555SS**Hα-helixtrans-70.7-39.3177.3-170.7156.3-9.600112.3R30 T31 E32 G37 A38R30-Q34 PolarHBondContact O-N 2.81Å; T31-Q34 PolarHBondContact O-N 2.88Å; E32-Q34 VanDerWaalsContact C-N 3.29Å; E32-Q34 PolarHBondContact O-N 3.12Å; Q34-G37 PolarHBondContact O-N 3.15Å; Q34-A38 PolarHBondContact O-N 2.87Å
35G92.1Very high87.1Confident42 Ų42102.8 Ų102.843%0.43355%0.549SS..Hα-helixtrans-61.4-44.9172.300000112.8T31 E32 A38 L39T31-G35 PolarHBondContact O-N 3.01Å; E32-G35 PolarHBondContact O-N 3.44Å; G35-A38 PolarHBondContact O-N 3.2Å; G35-L39 WeakPolarHBondContact O-CB 3.1Å; G35-L39 PolarHBondContact O-N 3.14Å
36R93.5Very high88Confident136 Ų13696.2 Ų96.251%0.51353%0.533SS..Hα-helixtrans-62.7-42.2173.7-176.7177.1178.5-179.51.9111.5E32 L39 L40E32-R36 VanDerWaalsContact O-CB 3.32Å; E32-R36 WeakPolarHBondContact O-CB 3.22Å; E32-R36 PolarHBondContact O-N 3.14Å; R36-L39 PolarHBondContact O-N 2.84Å; R36-L40 HydrophobicContact CG-CD1 3.95Å; R36-L40 HydrophobicContact CG-CG 4.31Å; R36-L40 WeakPolarHBondContact O-CB 3.48Å; R36-L40 VanDerWaalsContact O-CG 3.23Å; R36-L40 WeakPolarHBondContact O-CG 3.16Å; R36-L40 PolarHBondContact O-N 3.04Å
37G92.7Very high88.6Confident38 Ų3898.3 Ų98.339%0.39255%0.545SS..Hα-helixtrans-60.9-4517600000112.8Q33 Q34 S41Q33-G37 PolarHBondContact O-N 2.77Å; Q34-G37 PolarHBondContact O-N 3.15Å; G37-S41 WeakPolarHBondContact O-CB 3.32Å; G37-S41 PolarHBondContact O-N 2.82Å
38A91.6Very high88.8Confident47 Ų47103.5 Ų103.539%0.38855%0.549SS..Hα-helixtrans-61.2-5117500000111.5Q34 G35 L40 S41 D42Q34-A38 PolarHBondContact O-N 2.87Å; G35-A38 PolarHBondContact O-N 3.2Å; A38-L40 PolarHBondContact O-N 3.4Å; A38-S41 WeakPolarHBondContact O-CA 3.32Å; A38-S41 WeakPolarHBondContact O-CB 3.46Å; A38-S41 PolarHBondContact O-N 3.05Å; A38-S41 PolarHBondContact O-OG 2.89Å; A38-D42 PolarHBondContact O-N 3Å
39L92.8Very high89.1Confident106 Ų106109.3 Ų109.356%0.55558%0.579SS**Hα-helixtrans-56.8-48.1177.9175.662000112.3G35 R36 S41 D42 I43G35-L39 WeakPolarHBondContact O-CB 3.1Å; G35-L39 PolarHBondContact O-N 3.14Å; R36-L39 PolarHBondContact O-N 2.84Å; L39-S41 VanDerWaalsContact C-N 3.29Å; L39-S41 PolarHBondContact O-N 3.34Å; L39-D42 PolarHBondContact O-N 3.24Å; L39-I43 HydrophobicContact CD1-CD1 4.03Å; L39-I43 HydrophobicContact CD1-CG1 4.31Å; L39-I43 HydrophobicContact CG-CD1 3.93Å; L39-I43 VanDerWaalsContact O-CG1 3.31Å; L39-I43 WeakPolarHBondContact O-CG1 3.43Å; L39-I43 PolarHBondContact O-N 2.99Å
40L94.2Very high89.2Confident87 Ų87115.7 Ų115.746%0.45560%0.599SS.*Hα-helixtrans-60.6-39.9175.8-71.5173.1000111.2R36 A38 D42 I43 C44R36-L40 HydrophobicContact CG-CD1 3.95Å; R36-L40 HydrophobicContact CG-CG 4.31Å; R36-L40 WeakPolarHBondContact O-CB 3.48Å; R36-L40 VanDerWaalsContact O-CG 3.23Å; R36-L40 WeakPolarHBondContact O-CG 3.16Å; R36-L40 PolarHBondContact O-N 3.04Å; A38-L40 PolarHBondContact O-N 3.4Å; L40-D42 VanDerWaalsContact C-N 3.33Å; L40-D42 PolarHBondContact O-N 2.84Å; L40-I43 PolarHBondContact O-N 2.87Å; L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.16Å; L40-C44 PolarHBondContact O-SG 3.25Å
41S91.1Very high89.2Confident42 Ų42114.7 Ų114.729%0.29460%0.6SS.*Hα-helixtrans-63.4-37.3175.886.60000112.6G37 A38 L39 C44 K45G37-S41 WeakPolarHBondContact O-CB 3.32Å; G37-S41 PolarHBondContact O-N 2.82Å; A38-S41 WeakPolarHBondContact O-CA 3.32Å; A38-S41 WeakPolarHBondContact O-CB 3.46Å; A38-S41 PolarHBondContact O-N 3.05Å; A38-S41 PolarHBondContact O-OG 2.89Å; L39-S41 VanDerWaalsContact C-N 3.29Å; L39-S41 PolarHBondContact O-N 3.34Å; S41-C44 PolarHBondContact O-N 3.45Å; S41-K45 WeakPolarHBondContact O-CD 3.33Å; S41-K45 VanDerWaalsContact O-CE 3.27Å; S41-K45 WeakPolarHBondContact O-CE 3.41Å; S41-K45 WeakPolarHBondContact O-CG 3.4Å; S41-K45 PolarHBondContact O-N 2.99Å; S41-K45 PolarHBondContact OG-NZ 3.37Å
42D90.5Very high89.1Confident86 Ų86112.5 Ų112.546%0.4659%0.594SS.*Hα-helixtrans-76.6-33.9-179.8-68.3-24.2000112.3A38 L39 L40 K45 G46A38-D42 PolarHBondContact O-N 3Å; L39-D42 PolarHBondContact O-N 3.24Å; L40-D42 VanDerWaalsContact C-N 3.33Å; L40-D42 PolarHBondContact O-N 2.84Å; D42-K45 PolarHBondContact O-N 3.21Å; D42-K45 IonicContact OD1-NZ 3.25Å; D42-K45 PolarHBondContact OD1-NZ 2.96Å; D42-G46 PolarHBondContact O-N 2.85Å; D42-G46 VanDerWaalsContact O-N 3.08Å
43I89.8Confident89Confident113 Ų113114.3 Ų114.358%0.57961%0.612SS**Hα-helixtrans-60.7-47.9168.1-68.1165.4000110.1L39 L40 G46L39-I43 HydrophobicContact CD1-CD1 4.03Å; L39-I43 HydrophobicContact CD1-CG1 4.31Å; L39-I43 HydrophobicContact CG-CD1 3.93Å; L39-I43 VanDerWaalsContact O-CG1 3.31Å; L39-I43 WeakPolarHBondContact O-CG1 3.43Å; L39-I43 PolarHBondContact O-N 2.99Å; L40-I43 PolarHBondContact O-N 2.87Å; I43-G46 PolarHBondContact O-N 3.04Å
44C89.4Confident88.6Confident113 Ų113114.6 Ų114.676%0.76462%0.622SS**Hα-helixtrans-68.4-31.6179.5-69.60000113.9L40 S41 G46L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.16Å; L40-C44 PolarHBondContact O-SG 3.25Å; S41-C44 PolarHBondContact O-N 3.45Å; C44-G46 VanDerWaalsContact C-N 3.32Å
45K93.3Very high88.2Confident143 Ų143112.7 Ų112.762%0.62262%0.617SS**Hα-helixtrans-66.4-36.8171.5-72.7161.9-145.5159.30111.6S41 D42S41-K45 WeakPolarHBondContact O-CD 3.33Å; S41-K45 VanDerWaalsContact O-CE 3.27Å; S41-K45 WeakPolarHBondContact O-CE 3.41Å; S41-K45 WeakPolarHBondContact O-CG 3.4Å; S41-K45 PolarHBondContact O-N 2.99Å; S41-K45 PolarHBondContact OG-NZ 3.37Å; D42-K45 PolarHBondContact O-N 3.21Å; D42-K45 IonicContact OD1-NZ 3.25Å; D42-K45 PolarHBondContact OD1-NZ 2.96Å
46G85.1Confident87.7Confident47 Ų47116.1 Ų116.149%0.48563%0.625SS.*  trans72.3136.6-17700000112.9D42 I43 C44D42-G46 PolarHBondContact O-N 2.85Å; D42-G46 VanDerWaalsContact O-N 3.08Å; I43-G46 PolarHBondContact O-N 3.04Å; C44-G46 VanDerWaalsContact C-N 3.32Å
47T84.3Confident87.2Confident121 Ų121119.4 Ų119.474%0.74264%0.637SS**  trans-99.5120.2172.253.30000110L49T47-L49 PolarHBondContact O-N 2.8Å
48R82.4Confident86.9Confident249 Ų249122.4 Ų122.494%0.9465%0.652SS**  trans-70.999.5174.1-69.5-177.766.8169.21.6109.2
49L83.1Confident86.3Confident154 Ų154122.5 Ų122.581%0.80666%0.658SS**  trans-60.6143.6173.7-59.3-179.3000110.3T47T47-L49 PolarHBondContact O-N 2.8Å
50K87.8Confident85Confident199 Ų199122.9 Ų122.987%0.86567%0.667SS**  trans-67.6143.6171.5-68.2-179.4177.5179.50108.9A52K50-A52 PolarHBondContact O-N 2.84Å; K50-A52 VanDerWaalsContact O-N 3.07Å
51K84.6Confident83.7Confident198 Ų198124.4 Ų124.486%0.86168%0.68SS**  trans-57.2115.6173.6-177.3177.4179.7-179.90109.1
52A84.8Confident82.3Confident74 Ų74131.2 Ų131.261%0.61270%0.704SS**  trans-68.7135.9170.200000109.2K50 T54K50-A52 PolarHBondContact O-N 2.84Å; K50-A52 VanDerWaalsContact O-N 3.07Å; A52-T54 PolarHBondContact O-N 3.29Å
53V87.8Confident80.9Confident139 Ų139133.9 Ų133.984%0.84272%0.719SS**  trans-93.589.4168.3-179.40000106.8N55V53-N55 PolarHBondContact O-N 3.32Å
54T81.1Confident79.7Confident122 Ų122137.6 Ų137.675%0.74873%0.731SS**  trans-73.5113.1173.1-51.40000108.5A52 D56A52-T54 PolarHBondContact O-N 3.29Å; T54-D56 PolarHBondContact O-N 3.11Å
55N80Confident78.1Confident111 Ų111138.1 Ų138.159%0.59473%0.732SS**  trans-86.284.7170.1-171.5-6.6000108.4V53 R57V53-N55 PolarHBondContact O-N 3.32Å; N55-R57 PolarHBondContact O-N 2.92Å
56D81.6Confident76.2Confident114 Ų114141.5 Ų141.561%0.6175%0.747SS**  trans-74.6120.8174.2-171.6-1.6000109.8T54 S58T54-D56 PolarHBondContact O-N 3.11Å; D56-S58 WeakPolarHBondContact OD1-CB 3.47Å; D56-S58 PolarHBondContact OD1-N 3.4Å; D56-S58 PolarHBondContact OD1-OG 2.89Å
57R84.6Confident74Confident205 Ų205142.6 Ų142.677%0.77476%0.758SS**  trans-117.615.1177.4-60.6-171.6-176.5-173.40.4112.5N55 G59N55-R57 PolarHBondContact O-N 2.92Å; R57-G59 VanDerWaalsContact C-N 3.26Å; R57-G59 PolarHBondContact O-N 2.96Å
58S85.3Confident72.4Confident100 Ų100140 Ų14070%0.69976%0.755SS**  trans-81.5-0.7179.4670000114.1D56D56-S58 WeakPolarHBondContact OD1-CB 3.47Å; D56-S58 PolarHBondContact OD1-N 3.4Å; D56-S58 PolarHBondContact OD1-OG 2.89Å
59G78.1Confident70.5Confident50 Ų50134.2 Ų134.252%0.51575%0.753SS.*SBendtrans-62137.9171.300000111.7R57 V61R57-G59 VanDerWaalsContact C-N 3.26Å; R57-G59 PolarHBondContact O-N 2.96Å; G59-V61 PolarHBondContact O-N 3.36Å
60P66.3Low68.7Low114 Ų114130.5 Ų130.574%0.7475%0.753SS**  trans-64.5119.3-176.425.5-33.8000111.2F62P60-F62 PolarHBondContact O-N 3.19Å
61V66.9Low66.5Low119 Ų119125 Ų12572%0.72175%0.752SS**  trans-77.3102.9172.7-179.50000108.1G59 D63G59-V61 PolarHBondContact O-N 3.36Å; V61-D63 PolarHBondContact O-N 3.27Å
62F61.8Low64.5Low185 Ų185119.7 Ų119.781%0.81175%0.753SS**  trans-7995166.3-86.5-84000109.5P60 K64P60-F62 PolarHBondContact O-N 3.19Å; F62-K64 PolarHBondContact O-N 2.89Å
63D61.2Low62.5Low142 Ų142120 Ų12076%0.75976%0.764SS**  trans-64.5101.5163.4-73.9-40.8000108.9V61V61-D63 PolarHBondContact O-N 3.27Å
64K65.1Low60.5Low191 Ų191119.6 Ų119.683%0.8377%0.767SS**  trans-62124.9169.3-77.3178.3174.7177.10108F62 K66F62-K64 PolarHBondContact O-N 2.89Å; K64-K66 PolarHBondContact O-N 3.33Å
65P55.3Low58.7Low124 Ų124116.8 Ų116.881%0.80576%0.763SS**  trans-59.2137.5175.824.6-33000109.6G67P65-G67 VanDerWaalsContact C-N 3.28Å; P65-G67 PolarHBondContact O-N 2.83Å
66K52.4Low56.9Low213 Ų213119.1 Ų119.193%0.92678%0.781SS**  trans-68.878.2-173.8-173.8-179.9177178.40111.4K64K64-K66 PolarHBondContact O-N 3.33Å
67G40.6Very low54.9Low70 Ų70117.1 Ų117.172%0.72279%0.787SS**  trans-70.7123.8166.900000110.2P65P65-G67 VanDerWaalsContact C-N 3.28Å; P65-G67 PolarHBondContact O-N 2.83Å
68G49Very low52.8Low66 Ų66111.5 Ų111.568%0.6879%0.793SS**  trans-79.4-176.2174.900000113.1
69S44Very low50.8Low128 Ų128110.1 Ų110.190%0.89579%0.794SS**  trans75.5140-165.878.90000114
70G45.1Very low49.2Very low77 Ų77113.3 Ų113.379%0.79481%0.809SS**  cis127.3122.41.100000110.7
71G41.3Very low48.1Very low82 Ų82112 Ų11285%0.84582%0.816SS**  trans99.5127.5176.600000114
72G43.5Very low46.8Very low87 Ų87110.1 Ų110.190%0.89782%0.821SS**  trans-90.9169.7166.600000111.3
73G42.2Very low46.1Very low81 Ų81107.9 Ų107.984%0.83583%0.828SS**  trans-172.5120.8176.700000111.1
74S45.4Very low45.2Very low130 Ų130104.9 Ų104.991%0.90983%0.83SS**  trans-85.3151.4-176.5-57.20000112.8
75G42.7Very low44.4Very low64 Ų6499.9 Ų99.966%0.6683%0.834SS**  trans102145.4132.100000118.5
76V41.8Very low43.8Very low159 Ų15997.8 Ų97.896%0.96483%0.834SS**  trans58.7148.2161.7-47.40000117.6
77G40.7Very low43.7Very low73 Ų7398.1 Ų98.175%0.75384%0.836SS**  cis158.8133.7-8.400000111.5
78G40.8Very low44.2Very low87 Ų8798.5 Ų98.590%0.89784%0.84SS**  trans73.5158.6160.500000119.3
79G42.4Very low44.1Very low70 Ų7099.5 Ų99.572%0.72285%0.85SS**  trans110.479.5144.100000119.2
80S43.9Very low44.4Very low118 Ų11896.9 Ų96.983%0.82584%0.844SS**  trans27.5118.1132.256.60000121.4
81G43.1Very low44.5Very low86 Ų8699 Ų9989%0.88785%0.846SS**  62.9129.4118.800000121
82G40.8Very low45Very low79 Ų79101 Ų10181%0.81484%0.844SS**  trans165.4119165.400000114
83S47.3Very low45.7Very low138 Ų138102.3 Ų102.397%0.96585%0.847SS**  trans-63.8146.7172.6-51.40000112.6
84G41Very low46.2Very low79 Ų79101.7 Ų101.781%0.81484%0.84SS**  trans179.8124.5167.800000111.9
85G48.8Very low46.9Very low87 Ų87104.5 Ų104.590%0.89784%0.844SS**  trans-78.4156.5179.800000113.1
86G43.9Very low47.5Very low79 Ų79104.1 Ų104.181%0.81484%0.84SS**  trans-158.993.317600000111.7
87F49.8Very low48.4Very low220 Ų22099.9 Ų99.997%0.96583%0.829SS**  trans-82.6128.6164-62.6-87.4000108.4
88G50.2Low49.5Very low79 Ų79103.3 Ų103.381%0.81483%0.829SS**  trans170.3127.3172.500000115.1
89G47Very low50.6Low86 Ų86106.1 Ų106.189%0.88782%0.817SS**  trans94.3111172.500000114.1
90G50.2Low51.4Low74 Ų74107.4 Ų107.476%0.76382%0.821SS**  cis129.496.9200000111.2
91S48.2Very low52.4Low121 Ų121105.7 Ų105.785%0.84682%0.822SS**  trans-170.6160.3172.3-89.10000109.7
92P50.5Low54Low124 Ų124104 Ų10481%0.80580%0.804SS**  -90.3171.2-116.632.2-37000115.4G94P92-G94 PolarHBondContact O-N 3.18Å
93A58.9Low55.7Low114 Ų114107.6 Ų107.694%0.94280%0.802SS**  trans-59114.9179.600000112.6
94G52.6Low56.7Low68 Ų68106.5 Ų106.570%0.70179%0.791SS**  trans-159.8100.3174.100000110.9P92P92-G94 PolarHBondContact O-N 3.18Å
95L59.5Low58.4Low190 Ų190112.6 Ų112.6100%0.99580%0.795SS**SBendtrans25.299.8163.6-77.5156.3000118.2
96G55.4Low59.2Low55 Ų55116.3 Ų116.357%0.56779%0.794SS**  trans12181.9152.600000116.2L98G96-L98 PolarHBondContact O-N 3.29Å
97G61.6Low60.3Low71 Ų71123.2 Ų123.273%0.73280%0.795SS**G310 helixtrans-68.523.6175.900000116.6F99G97-F99 PolarHBondContact O-N 3.5Å
98L64.4Low60.6Low145 Ų145117.8 Ų117.876%0.75978%0.784SS**G310 helixtrans-70-14.7-173.8-63.3107.8000114.1G96G96-L98 PolarHBondContact O-N 3.29Å
99F63.5Low60.7Low145 Ų145119.4 Ų119.464%0.63679%0.79SS**G310 helixtrans-125.720.9-178.7-57.9-72000113.6G97 G101 G102 M103G97-F99 PolarHBondContact O-N 3.5Å; F99-G101 PolarHBondContact O-N 3.42Å; F99-G102 PolarHBondContact O-N 2.7Å; F99-M103 HydrophobicContact CE1-CE 4.44Å
100A58.8Low61Low97 Ų97118.9 Ų118.980%0.80278%0.777SS**THydrogen-bonded Turntrans-61-17-177.900000114.7
101G64.6Low61.1Low83 Ų83122.1 Ų122.186%0.85678%0.777SS**THydrogen-bonded Turntrans-98.73.3172.200000115.3F99F99-G101 PolarHBondContact O-N 3.42Å
102G76.6Confident61.1Low49 Ų49127.1 Ų127.151%0.50578%0.778SS.*  trans73.4156.7-169.300000113.4F99F99-G102 PolarHBondContact O-N 2.7Å
103M76.4Confident60.9Low156 Ų156127.6 Ų127.677%0.76877%0.774SS**  trans-74.8126.7178.1-144.3178.2-164.500109.6F99 K105F99-M103 HydrophobicContact CE1-CE 4.44Å; M103-K105 PolarHBondContact O-N 2.87Å
104P68.8Low60.2Low115 Ų115129.6 Ų129.675%0.74777%0.768SS**  trans-57.3115.5-179-27.535.8000111.9L106P104-L106 PolarHBondContact O-N 3.06Å
105K76.4Confident59.6Low206 Ų206133.5 Ų133.590%0.89677%0.773SS**  trans-69.2107-177.7-167.2117.7178.9177.80109.6M103 R107M103-K105 PolarHBondContact O-N 2.87Å; K105-R107 PolarHBondContact O-N 2.95Å
106L65.1Low58.7Low165 Ų165129.8 Ų129.886%0.86476%0.763SS**PPolyproline II helixtrans-59.7122.3173.8-65.3179.2000109.7P104P104-L106 PolarHBondContact O-N 3.06Å
107R68.4Low58Low224 Ų224130.2 Ų130.285%0.84577%0.767SS**PPolyproline II helixtrans-64.3132.1169.659-166.9179.8-150-0.3109.1K105 A109K105-R107 PolarHBondContact O-N 2.95Å; R107-A109 PolarHBondContact O-N 3.41Å
108S55Low57.5Low106 Ų106133.4 Ų133.474%0.74178%0.775SS**PPolyproline II helixtrans-56.9131.2-172.4-164.50000111.5A110S108-A110 PolarHBondContact O-N 3.44Å
109A53.7Low56.5Low114 Ų114132.1 Ų132.194%0.94278%0.778SS**SBendtrans-81.146.7-178.400000112.3R107R107-A109 PolarHBondContact O-N 3.41Å
110A52.5Low56Low74 Ų74137.2 Ų137.261%0.61279%0.793SS**  trans-125.4131.3174.500000109.1S108S108-A110 PolarHBondContact O-N 3.44Å
111N52.2Low55.5Low143 Ų143135.6 Ų135.677%0.76579%0.786SS**  trans72.298.1-178.5-162.5-13.4000115.8
112R48.2Very low54.8Low225 Ų225137.8 Ų137.885%0.84979%0.785SS**  trans-152.988.1135.6-148.5-178.8-68.7-175.3-5.6109.9
113D46.4Very low53.4Low135 Ų135142.1 Ų142.172%0.72280%0.801SS**  trans-66.1158.3162-71.3-78.8000110.6
114N45Very low52.7Low155 Ų155142 Ų14283%0.82980%0.803SS**  trans-39.3131.9-171.1-68.3-92.7000116.4
115D39.7Very low51.6Low151 Ų151141.9 Ų141.981%0.80780%0.802SS**  -158.9129.8126.5-126.9-51.3000114.4
116S40.4Very low50.2Low111 Ų111138.7 Ų138.778%0.77680%0.802SS**  trans30.4120.8150.1-55.30000123.4
117G39.6Very low49.3Very low64 Ų64134.2 Ų134.266%0.6680%0.797SS**  trans124.1123.3143.600000118.2S119G117-S119 PolarHBondContact O-N 2.98Å
118P52.1Low48.1Very low139 Ų139129.4 Ų129.490%0.90380%0.797SS**  trans-85.991.2179.634.1-33.4000112.7
119S43.6Very low47.8Very low117 Ų117136.1 Ų136.182%0.81881%0.806SS**PPolyproline II helixtrans-96131.2172.644.80000112.1G117G117-S119 PolarHBondContact O-N 2.98Å
120R51.5Low47.3Very low253 Ų253136.5 Ų136.596%0.95580%0.802SS**PPolyproline II helixtrans-72.2131.9-171.1-63.4175.4175.7179.8-3.2111.9
121G48.7Very low46.6Very low62 Ų62137.1 Ų137.164%0.63982%0.816SS**PPolyproline II helixtrans-83.2157.916400000112.3
122P51.4Low45.8Very low130 Ų130133.4 Ų133.484%0.84481%0.811SS**PPolyproline II helixtrans-72.2141.2-176.129.6-34.7000112.6
123V46.7Very low45.7Very low139 Ų139129.5 Ų129.584%0.84282%0.815SS**PPolyproline II helixtrans-79.8133.5176.8175.70000110
124L61.9Low45.3Very low153 Ų153128.3 Ų128.380%0.80182%0.817SS**  trans-115.3149.2167.9-69.9177.7000110.1
125P45.7Very low45.2Very low113 Ų113126.2 Ų126.273%0.73481%0.812SS**  trans-72.7148.3-169.728.3-35.5000113.5G127P125-G127 PolarHBondContact O-N 2.89Å
126P45.4Very low45.3Very low139 Ų139129.4 Ų129.490%0.90382%0.819SS**SBendtrans-82.497.6-175.132.4-34.4000111.9
127G47.2Very low45.1Very low72 Ų72127.9 Ų127.974%0.74282%0.821SS**  trans179.349.9-178.800000120P125P125-G127 PolarHBondContact O-N 2.89Å
128S44.1Very low45.2Very low123 Ų123129 Ų12986%0.8683%0.832SS**  trans-158.2123.9157.940.50000111.8
129R47.6Very low44.3Very low246 Ų246126.3 Ų126.393%0.92883%0.83SS**  trans-133.8108.8-179.439.4174165-103.5-4.5108.8
130S42.6Very low43.9Very low122 Ų122124.2 Ų124.285%0.85383%0.827SS**  trans-136.3117.4170.737.70000108
131G38.7Very low43.4Very low87 Ų87117.8 Ų117.890%0.89782%0.821SS**  trans-90.1149.6-17500000112.8
132G35.1Very low43.2Very low65 Ų65120.1 Ų120.167%0.6783%0.825SS**  trans-140.9139.616200000108.2
133P46.8Very low42.7Very low144 Ų144119 Ų11994%0.93582%0.82SS**  trans-76.8132.2-169.430.2-34.3000112
134S37.9Very low42.5Very low110 Ų110115.9 Ų115.977%0.76982%0.816SS**  trans-132.9138.2167.1-173.30000108.4
135P41.5Very low42Very low110 Ų110114 Ų11471%0.71481%0.812SS**  trans-74.3139.4-166.728.8-35.4000113.2
136F43.4Very low41.8Very low219 Ų219115.1 Ų115.196%0.96182%0.82SS**  trans32.584.2158.2-74.1-85.2000117.2
137G36.5Very low41.7Very low78 Ų78117.9 Ų117.980%0.80482%0.818SS**  trans-154.287.617300000114.7
138G40.4Very low41.7Very low87 Ų87122.3 Ų122.390%0.89782%0.823SS**  trans93.7109.1149.200000118.5
139G32.6Very low41.5Very low83 Ų83122.9 Ų122.986%0.85682%0.824SS**  trans-119.1106.2146.800000107.7
140G37.2Very low41.5Very low73 Ų73114.6 Ų114.675%0.75382%0.815SS**  trans-84.8134.7-17400000113.5
141S39.9Very low41.6Very low119 Ų119115.5 Ų115.583%0.83282%0.815SS**  trans125.2152.8141.4-56.10000113.6
142P45.2Very low41.5Very low111 Ų111117.7 Ų117.772%0.72181%0.814SS**  cis-120.6-171.9-2932-12.9000111.3
143S39.4Very low41.7Very low107 Ų107119 Ų11975%0.74882%0.818SS**  trans4789.2149.161.70000120.8
144G42.5Very low41.4Very low73 Ų73118.7 Ų118.775%0.75381%0.814SS**  trans70.5167.6138.200000119.9
145P52.4Low41.7Very low112 Ų112119.2 Ų119.273%0.72781%0.814SS**SBendtrans-75.3152.9172.632.8-34.6000111K147P145-K147 PolarHBondContact O-N 2.93Å
146P42Very low41.7Very low137 Ų137126 Ų12689%0.8983%0.826SS**  trans-65.3127.3-175.827.2-34.6000111.2
147K42.4Very low41.1Very low198 Ų198119.3 Ų119.386%0.86182%0.818SS**  trans-112.5140.3167-81.4-173.1174-175.40110P145P145-K147 PolarHBondContact O-N 2.93Å
148L47.7Very low41Very low164 Ų164119.4 Ų119.486%0.85982%0.819SS**  trans-64.8154.4179.9-58.7167.4000111
149P39.9Very low41.1Very low135 Ų135119.8 Ų119.888%0.87781%0.814SS**SBendtrans-65.7135.1178.2-18.631.9000112.5
150G46.4Very low41.5Very low72 Ų72121.9 Ų121.974%0.74281%0.812SS**  trans117.269.1160.700000117.7
151V45.1Very low41.5Very low142 Ų142125.5 Ų125.586%0.86182%0.815SS**  trans-161.6147.6150.8-101.80000110.1
152P37.4Very low42.1Very low132 Ų132126.6 Ų126.686%0.85781%0.81SS**  trans-79.8170.4-176.633.2-35.5000114.1
153A40Very low42.2Very low93 Ų93127.4 Ų127.477%0.76982%0.815SS**  trans-101.3-174.6-168.900000114.9
154V39.2Very low42.7Very low138 Ų138132.3 Ų132.384%0.83682%0.823SS**  trans99.2138.3171.7-177.30000115
155P43.7Very low42.2Very low121 Ų121132 Ų13279%0.78682%0.819SS**  cis-124.3-171-40.335.3-15.2000112.4
156R41.5Very low41.6Very low253 Ų253136.8 Ų136.896%0.95582%0.823SS**  trans-85.8148.1178.8-66.8178.7171.398.5-3.2113.2
157G31.8Very low41.3Very low78 Ų78135.1 Ų135.180%0.80481%0.812SS**  trans-175.8137.8161.400000114
158G34.1Very low40.7Very low80 Ų80131.9 Ų131.983%0.82580%0.804SS**  trans85.5121.8163.400000117.5
159A43.4Very low40.3Very low95 Ų95133 Ų13379%0.78580%0.803SS**  trans-78.4148.6159.400000109.9D161A159-D161 PolarHBondContact O-N 3.44Å
160P40.8Very low40.1Very low126 Ų126131.9 Ų131.982%0.81880%0.798SS**  trans-75.1105.217329.8-31.9000110.2
161D37.3Very low39.6Very low150 Ų150133.8 Ų133.880%0.80280%0.8SS**  trans-69.1150172.7-163.65.1000111.3A159A159-D161 PolarHBondContact O-N 3.44Å
162L52.3Low39.1Very low142 Ų142138.4 Ų138.474%0.74380%0.802SS**  trans-79.6126.7-179.9-84.279.3000110.5K164L162-K164 VanDerWaalsContact C-N 3.34Å; L162-K164 PolarHBondContact O-N 2.77Å
163P47.2Very low38.9Very low127 Ų127139.6 Ų139.683%0.82580%0.796SS**  trans-70.590.8167.328.7-33000110.8G165P163-G165 VanDerWaalsContact C-N 3.3Å; P163-G165 PolarHBondContact O-N 3.07Å
164K48.9Very low38.8Very low211 Ų211143.3 Ų143.392%0.91780%0.803SS**  trans-65.890.3155.9-74.9174-179.4163.80108.3L162L162-K164 VanDerWaalsContact C-N 3.34Å; L162-K164 PolarHBondContact O-N 2.77Å
165G33Very low38.7Very low65 Ų65141.9 Ų141.967%0.6780%0.795SS**  trans-13980.7-176.400000113P163P163-G165 VanDerWaalsContact C-N 3.3Å; P163-G165 PolarHBondContact O-N 3.07Å
166R39.3Very low38.7Very low214 Ų214142.5 Ų142.581%0.80880%0.799SS**  trans-88.1118.1167.8-174.6-173.8-168.7-142.96108.4N168R166-N168 PolarHBondContact O-N 3.19Å; R166-N168 VanDerWaalsContact O-N 3.14Å
167P36.4Very low39.1Very low102 Ų102134 Ų13466%0.66279%0.791SS**  trans-69.3112166.828-31000108.4F169P167-F169 HydrophobicContact CB-CE2 4.33Å; P167-F169 PolarHBondContact O-N 2.74Å
168N30.1Very low40.1Very low129 Ų129133.6 Ų133.669%0.6979%0.786SS**  trans-89.397.1172.4-162.559.5000107.8R166R166-N168 PolarHBondContact O-N 3.19Å; R166-N168 VanDerWaalsContact O-N 3.14Å
169F38.8Very low41.1Very low188 Ų188135.4 Ų135.483%0.82578%0.783SS**  trans-77.4142.7166.8-79.4-76.3000110.1P167P167-F169 HydrophobicContact CB-CE2 4.33Å; P167-F169 PolarHBondContact O-N 2.74Å
170S34.8Very low41.9Very low112 Ų112136.4 Ų136.478%0.78378%0.781SS**  trans-64.6149.6-167.8-57.80000114.5
171S35.5Very low42.8Very low112 Ų112135.7 Ų135.778%0.78378%0.777SS**  trans-38.7139.1174.355.90000116.9
172R34.9Very low43.6Very low239 Ų239134.8 Ų134.890%0.90278%0.779SS**  trans-146.595.4131.4-139.4175.3-170-1391.2113.2
173Q33.8Very low44.2Very low156 Ų156134.2 Ų134.273%0.72978%0.781SS**  trans64.484.9144.6-160.7168.9-10.200118.7
174D37.8Very low44.3Very low172 Ų172133.9 Ų133.992%0.9278%0.779SS**  trans-71.5120.2157.1-76.2-76.3000111.1
175T37.1Very low44.2Very low107 Ų107131.9 Ų131.966%0.65678%0.779SS**  trans-150.7132.7162.1-44.40000107.7G177T175-G177 PolarHBondContact O-N 3.04Å
176P44.7Very low44.8Very low134 Ų134134.8 Ų134.887%0.8778%0.783SS**SBendtrans-79.9113.2-16530.1-34.7000112.3
177G49.2Very low44.7Very low76 Ų76131 Ų13178%0.78479%0.786SS**  trans166.7-1.7174.200000118.5T175T175-G177 PolarHBondContact O-N 3.04Å
178G52Low45.2Very low68 Ų68136.4 Ų136.470%0.70179%0.794SS**PPolyproline II helixtrans-69.7138.9-179.700000113.7
179P56.5Low45.7Very low119 Ų119135.1 Ų135.177%0.77379%0.792SS**PPolyproline II helixtrans-68.5153.6173.529.6-34.6000111.8
180P60.6Low45.9Very low115 Ų115132.1 Ų132.175%0.74779%0.792SS**PPolyproline II helixtrans-69.8157.7-179.230-35.7000112.6
181P59.5Low46Very low112 Ų112135.8 Ų135.873%0.72780%0.796SS**PPolyproline II helixtrans-64.3152.8177.128.2-35.7000112.1
182P53.4Low46.1Very low131 Ų131135.5 Ų135.585%0.85180%0.795SS**PPolyproline II helixtrans-67.5135.8-175.827.6-34.6000112
183V64.6Low46.4Very low129 Ų129132.3 Ų132.378%0.78280%0.795SS**PPolyproline II helixtrans-93.5147.4175.1-710000111.6
184P48.7Very low46.8Very low121 Ų121130.7 Ų130.779%0.78680%0.798SS**PPolyproline II helixtrans-62.5139.7174.6-22.234000112.6T186P184-T186 PolarHBondContact O-N 3.07Å
185N46.8Very low46.7Very low169 Ų169127.9 Ų127.990%0.90479%0.791SS**PPolyproline II helixtrans-56.9130.6-176-89.2-43.2000113.7
186T45.8Very low46.7Very low125 Ų125135 Ų13577%0.76781%0.806SS**  trans-135.4144.3156490000109.5P184P184-T186 PolarHBondContact O-N 3.07Å
187P38.6Very low46.2Very low134 Ų134132.4 Ų132.487%0.8780%0.804SS**PPolyproline II helixtrans-75.2132-168.7-14.930.7000112.6
188R46Very low45.6Very low217 Ų217132.4 Ų132.482%0.81980%0.804SS**PPolyproline II helixtrans-94.6131.7175.7-165.3178.6-162.7-99.93.9110
189P39.9Very low45.1Very low102 Ų102135.7 Ų135.766%0.66281%0.813SS**PPolyproline II helixtrans-70.6142.9173.529.3-33.8000110.8
190P43.7Very low44.2Very low125 Ų125135.6 Ų135.681%0.81282%0.815SS**PPolyproline II helixtrans-75.9132.1178.430.3-33.3000110.9
191Q38.1Very low43.6Very low188 Ų188135.7 Ų135.788%0.87982%0.816SS**PPolyproline II helixtrans-96.9122.7161.3-73.5-166.5-27.900108.7
192S36.8Very low42.8Very low107 Ų107136.4 Ų136.475%0.74882%0.82SS**  trans-121.1125.216649.10000109.5
193L40.6Very low41.9Very low172 Ų172136 Ų13690%0.90182%0.821SS**  trans-91.1138.4164-72159.9000107.9
194P42.8Very low40.7Very low122 Ų122138 Ų13879%0.79283%0.826SS**  trans-117.5134.4147.11.219.7000111
195S34.8Very low40.4Very low112 Ų112138.4 Ų138.478%0.78383%0.829SS**  trans-92137.8170.2-71.50000110.9
196R38.2Very low39.7Very low256 Ų256134 Ų13497%0.96682%0.824SS**  trans56.2115.4157.1-67.1-174.3169.4-150.2-3.6119.2
197G33.7Very low39.1Very low81 Ų81131.9 Ų131.984%0.83583%0.826SS**  trans160.8108.8156.600000112.5
198G37.4Very low39.3Very low76 Ų76131.9 Ų131.978%0.78483%0.826SS**  trans-80.6164.2169.500000111.7
199P40Very low38.8Very low137 Ų137131.7 Ų131.789%0.8983%0.826SS**  -144.1-17281.838.4-20.7000116
200S37.4Very low39Very low117 Ų117132.3 Ų132.382%0.81883%0.829SS**  trans-80.8176.4-167.5-40.80000115.3
201P48.9Very low38.3Very low116 Ų116129 Ų12975%0.75381%0.81SS**PPolyproline II helixtrans-100.3170.8-153.540.5-39.1000116.6
202P41.8Very low38Very low127 Ų127128.3 Ų128.383%0.82581%0.806SS**PPolyproline II helixtrans-93.4158.3163.936.5-32.2000114
203S35.8Very low37.7Very low124 Ų124127.4 Ų127.487%0.86781%0.805SS**PPolyproline II helixtrans-94169-169.3-48.80000115.7
204L39.3Very low37.3Very low170 Ų170124.9 Ų124.989%0.8980%0.802SS**PPolyproline II helixtrans-75155.4175.8-62.1169.8000113.5
205P42.6Very low37.2Very low130 Ų130124.3 Ų124.384%0.84480%0.8SS**  -142.7167.1112.838.4-25.7000113.1
206G30.9Very low37.7Very low77 Ų77124.2 Ų124.279%0.79480%0.797SS**  cis162.6100.9-7.400000113.9
207G33.4Very low37.5Very low80 Ų80118.5 Ų118.583%0.82579%0.79SS**  trans70.2175.3163.400000119.1
208P42.5Very low38.5Very low133 Ų133120 Ų12086%0.86479%0.785SS**  cis-128-177.6-440.8-24.3000116.5
209R35.6Very low39.5Very low214 Ų214121.5 Ų121.581%0.80878%0.782SS**  trans-63.4177.4171.4-114.6-176.9167.2-167.5-2.9113.6
210P43.9Very low39Very low114 Ų114120.7 Ų120.774%0.7478%0.779SS**  cis-122.6163.828.118.86.7000114.1
211S29.4Very low39.1Very low57 Ų57121.6 Ų121.640%0.39978%0.779SS.*  cis89.314736.778.90000117
212H31.7Very low39.2Very low172 Ų172121.5 Ų121.580%0.79678%0.779SS**  trans79.7115.9-179.2-44.9-72.5000115.1
213A31.5Very low39.3Very low89 Ų89121.1 Ų121.174%0.73678%0.776SS**  cis108.814828.800000112.1
214S31.7Very low39.1Very low119 Ų119118.3 Ų118.383%0.83277%0.767SS**  trans107.1108.2167-53.20000117.8
215S40Very low38.9Very low109 Ų109122.1 Ų122.176%0.76277%0.77SS**  trans-63175.8145.7510000110.5
216P45.2Very low38.6Very low111 Ų111125.2 Ų125.272%0.72177%0.772SS**  cis-153.7-170.130.535.2-7.5000118.9
217V33.6Very low38.7Very low135 Ų135124.6 Ų124.682%0.81877%0.766SS**  trans63.6152.3158.5-84.90000123.8
218P55.4Low39Very low112 Ų112126.4 Ų126.473%0.72777%0.766SS**  trans-105.8-157.6-178.546.5-37.5000111.5
219P58.8Low39.4Very low109 Ų109128 Ų12871%0.70877%0.766SS**  cis-125.3-179.7-1841.7-27.5000113.3
220S30.1Very low40.4Very low120 Ų120123.4 Ų123.484%0.83976%0.764SS**  trans162.7163.6143.1-79.90000116.2
221V38.2Very low41Very low135 Ų135123.6 Ų123.682%0.81877%0.766SS**  trans-152.4147.2179.1168.90000105.7
222P52.4Low42.4Very low115 Ų115126.3 Ų126.375%0.74778%0.782SS**  cis-120.6-140.421.534.3-10000110.5
223P42.3Very low43.6Very low118 Ų118124 Ų12477%0.76678%0.783SS**  cis-139.8154.8-10.439.4-19.9000119.5
224G32.4Very low44.8Very low65 Ų65125.6 Ų125.667%0.6779%0.785SS**  67.7117.9126.900000122.8
225R34.9Very low45.4Very low251 Ų251126.2 Ų126.295%0.94779%0.786SS**  trans-158145134.4-107.7163-166.7-100.1-0.4110.9
226H35.7Very low45.2Very low194 Ų194125 Ų12590%0.89879%0.792SS**  trans-101.6163.2-162.4-66.1-109.4000114.2
227G33.2Very low44.6Very low65 Ų65123.5 Ų123.567%0.6780%0.796SS**  trans162.954172.900000112.2
228S41.5Very low44.7Very low118 Ų118122.9 Ų122.983%0.82580%0.798SS**  77.5100.39668.40000114.6
229L50.5Low43.7Very low165 Ų165123.5 Ų123.586%0.86481%0.805SS**PPolyproline II helixtrans-63.9157.4169.8-64.9162000111.8
230P55.2Low42.6Very low118 Ų118122.2 Ų122.277%0.76681%0.811SS**PPolyproline II helixtrans-66.2143.2167.829.5-34.5000111.1
231P57.3Low42.8Very low118 Ų118120.1 Ų120.177%0.76681%0.809SS**PPolyproline II helixtrans-78.4152.4-176.631.9-35.6000112.9
232P58.1Low43.1Very low115 Ų115119.3 Ų119.375%0.74781%0.806SS**PPolyproline II helixtrans-75.3151.1168.932.7-34.5000111.6
233P56.8Low42.2Very low124 Ų124124.6 Ų124.681%0.80581%0.811SS**PPolyproline II helixtrans-72141174.929.1-33.7000112.1
234P56.7Low41.9Very low122 Ų122125.3 Ų125.379%0.79282%0.819SS**PPolyproline II helixtrans-82.1168.8-176.733.7-36.5000114.1
235P45.2Very low42.1Very low131 Ų131126.5 Ų126.585%0.85182%0.817SS**PPolyproline II helixtrans-98.8151.3-166.337.1-34.9000116
236G35.7Very low42.7Very low85 Ų85124.9 Ų124.988%0.87682%0.817SS**  trans111.7146.2156.200000116.6
237G31.9Very low42.8Very low79 Ų79121.4 Ų121.481%0.81482%0.815SS**  trans134.358.2163.200000119
238S35.8Very low43.5Very low122 Ų122122.5 Ų122.585%0.85382%0.817SS**  trans-9.6130.9162.7-52.40000121.2
239S35.5Very low43.9Very low125 Ų125122.4 Ų122.487%0.87481%0.814SS**  -172.3140.3119.243.80000113.3
240G34.6Very low44.2Very low81 Ų81120 Ų12084%0.83581%0.808SS**  trans83.887.4164.900000118.2
241G35.7Very low44.4Very low77 Ų77119.8 Ų119.879%0.79481%0.807SS**  trans-79.8-168161.400000113.1
242P43.1Very low44.4Very low118 Ų118119.7 Ų119.777%0.76681%0.806SS**  cis-133.615113.937.6-19.4000117.3
243R34.8Very low44.2Very low226 Ų226120 Ų12085%0.85381%0.808SS**  trans53.197.3142.9-57.5175.784.9173.27.3118.3S245R243-S245 PolarHBondContact O-N 3.45Å
244S34.9Very low43.9Very low133 Ų133119.4 Ų119.493%0.9381%0.807SS**  trans-68.995.4155.6-1790000110.2
245S36Very low43.7Very low89 Ų89120.9 Ų120.962%0.62281%0.808SS**  trans-81150.7160.8-64.20000109.7R243 S247R243-S245 PolarHBondContact O-N 3.45Å; S245-S247 PolarHBondContact O-N 3.49Å
246F47.7Very low44Very low217 Ų217119.7 Ų119.795%0.95280%0.803SS**  trans-50.5129.2170.6-80.3-105000111.3
247S38.6Very low44.7Very low122 Ų122121.3 Ų121.385%0.85380%0.801SS**  trans-143.6144.3166.5-108.30000110.6S245S245-S247 PolarHBondContact O-N 3.49Å
248A48.6Very low45.5Very low87 Ų87127.7 Ų127.772%0.71980%0.8SS**PPolyproline II helixtrans-63.1159-173.600000113.2
249P49.9Very low46.5Very low116 Ų116127.1 Ų127.175%0.75379%0.793SS**PPolyproline II helixtrans-59.4146.1171.526.5-35.5000111.1
250P57.1Low47.5Very low114 Ų114127.1 Ų127.174%0.7479%0.79SS**PPolyproline II helixtrans-65.4149.917928.1-35000111.4
251P59.3Low48.5Very low115 Ų115130.6 Ų130.675%0.74779%0.789SS**PPolyproline II helixtrans-63.7150.2172.928.6-34.7000110.8
252P56.9Low49.2Very low116 Ų116132.2 Ų132.275%0.75379%0.786SS**PPolyproline II helixtrans-64.5145.7178.128-34.8000111.2
253P53.4Low49.5Very low122 Ų122132.8 Ų132.879%0.79279%0.789SS**PPolyproline II helixtrans-66.9144.7-178.227.4-34.7000112.3
254S49.7Very low50.1Low110 Ų110126 Ų12677%0.76978%0.782SS**PPolyproline II helixtrans-57.4139.5178-590000112.4S256S254-S256 PolarHBondContact O-N 3.08Å
255N53.2Low50.6Low154 Ų154126.5 Ų126.582%0.82478%0.782SS**SBendtrans-81.246.8-162.6-158.118.7000114.1
256S52.7Low51.2Low106 Ų106125.8 Ų125.874%0.74179%0.788SS**  trans-1062.6-165.4-49.70000115.4S254S254-S256 PolarHBondContact O-N 3.08Å
257S48.5Very low50.8Low118 Ų118119.1 Ų119.183%0.82578%0.781SS**  trans-136.352.1-168.8-53.30000113.5
258R48.5Very low51Low213 Ų213124.9 Ų124.980%0.80478%0.784SS**  trans-109.2136.3162.8-87.3-175.2170.7-119.2-1110.1
259P58.2Low50.9Low110 Ų110126 Ų12671%0.71478%0.784SS**PPolyproline II helixtrans-65.5154.1169.829.9-34.7000110.3
260P55.3Low51.1Low125 Ų125126.5 Ų126.581%0.81279%0.787SS**PPolyproline II helixtrans-63.7142.1176.527.5-34.3000110.9
261L56.6Low50.4Low154 Ų154129 Ų12981%0.80679%0.793SS**PPolyproline II helixtrans-74149.2172.6-67.2170.1000110.2
262P51Low49.9Very low111 Ų111128.9 Ų128.972%0.72179%0.793SS**PPolyproline II helixtrans-64.7149.1177.727.5-35000111.6A264P262-A264 PolarHBondContact O-N 3.49Å
263P48.8Very low49.6Very low130 Ų130131.4 Ų131.484%0.84480%0.8SS**PPolyproline II helixtrans-60.1136.9177.3-22.533.5000112.2
264A46.3Very low49.6Very low84 Ų84132.8 Ų132.869%0.69480%0.801SS**PPolyproline II helixtrans-69.3142.4173.500000111P262 G266P262-A264 PolarHBondContact O-N 3.49Å; A264-G266 PolarHBondContact O-N 2.67Å
265P46.7Very low49.8Very low143 Ų143138.9 Ų138.993%0.92981%0.807SS**THydrogen-bonded Turntrans-70.797.717727.7-32.3000110.2
266G49.1Very low49.9Very low74 Ų74137 Ų13776%0.76380%0.803SS**THydrogen-bonded Turntrans-172.8-15-178.700000116.5A264 R268A264-G266 PolarHBondContact O-N 2.67Å; G266-R268 PolarHBondContact O-N 3.44Å
267G38.5Very low50.2Low77 Ų77137.6 Ų137.679%0.79480%0.804SS**  trans-77.9110173.300000112
268R43.7Very low50.4Low244 Ų244137.6 Ų137.692%0.92180%0.802SS**PPolyproline II helixtrans-69.5137.1166.5-86.9-176.7165-140.3-1.1110.3G266G266-R268 PolarHBondContact O-N 3.44Å
269P44.7Very low50.3Low109 Ų109133.1 Ų133.171%0.70880%0.8SS**PPolyproline II helixtrans-74.7156.9163.233.2-33.7000110.7
270P53.9Low49.8Very low128 Ų128134 Ų13483%0.83181%0.805SS**PPolyproline II helixtrans-74.1142.7174.132.2-34000110.9
271L43.3Very low49.3Very low166 Ų166132.3 Ų132.387%0.86980%0.802SS**  trans-145.7139.7175.6-162.161.6000106.9
272P48.6Very low48.9Very low113 Ų113131.3 Ų131.373%0.73481%0.805SS**  trans-79.5162.1-145.629.5-37.3000115.6D274P272-D274 PolarHBondContact O-N 3.17Å
273D50.5Low48.7Very low169 Ų169133.1 Ų133.190%0.90481%0.814SS**  trans-60.2103.5172.2-62.3-87.3000112.3
274D54.1Low48.5Very low151 Ų151130.4 Ų130.481%0.80781%0.809SS**  trans-154.282.1162.3-146.2-18.3000112.5P272P272-D274 PolarHBondContact O-N 3.17Å
275R53Low48Very low238 Ų238130 Ų13090%0.89881%0.814SS**  trans-143.8135.7161.5-75.7-162.1176.5-143.8-3.7111.1
276P56.3Low47.9Very low114 Ų114132.3 Ų132.374%0.7481%0.812SS**PPolyproline II helixtrans-72.8156.9178.831.4-36000112
277P58.6Low47.5Very low118 Ų118140.4 Ų140.477%0.76682%0.819SS**PPolyproline II helixtrans-71.5150.5179.830.1-35.3000112.5
278P52.3Low47.8Very low119 Ų119142.7 Ų142.777%0.77382%0.82SS**PPolyproline II helixtrans-77158.1176.132.5-35.3000112.7
279P47.6Very low47.7Very low118 Ų118136.7 Ų136.777%0.76682%0.815SS**PPolyproline II helixtrans-75.4158.6-178.231.9-36.5000113.3
280P46.9Very low48.1Very low128 Ų128140 Ų14083%0.83182%0.824SS**PPolyproline II helixtrans-74.7152.6179.631.7-35.4000112.8
281A45.3Very low47.9Very low90 Ų90139.9 Ų139.974%0.74482%0.823SS**PPolyproline II helixtrans-87.8153-176.900000113.5
282P46.9Very low48.4Very low133 Ų133143.4 Ų143.486%0.86482%0.824SS**PPolyproline II helixtrans-73.2145.9178.9-13.929.8000113.5
283V47.9Very low48.8Very low150 Ų150144.8 Ų144.891%0.90983%0.826SS**PPolyproline II helixtrans-86.8138.4176.1170.80000111.3
284G44.7Very low49.1Very low72 Ų72144.8 Ų144.874%0.74282%0.822SS**  trans105.5126.7155.900000116.4
285G35.7Very low49.6Very low77 Ų77142.7 Ų142.779%0.79482%0.817SS**  trans165.181.7174.900000114.1
286H43.8Very low50.1Low191 Ų191137 Ų13788%0.88481%0.811SS**  trans-79.5150.1178.7-53.7-81.5000112.1
287R41.4Very low50.1Low244 Ų244137.2 Ų137.292%0.92181%0.812SS**  trans-122.5135171.6-113.5-167.9179.7-149.60.7110.5
288P45.3Very low50.2Low124 Ų124137 Ų13781%0.80581%0.811SS**  trans-79.8150.5174.232.7-33.9000112
289S41.1Very low49.9Very low119 Ų119137.2 Ų137.283%0.83281%0.812SS**  trans-83.1145.2173.337.80000111.8
290M52.4Low50.3Low179 Ų179137.4 Ų137.488%0.88282%0.816SS**  trans-108.6141.9173.4-67.3-82.1-113.300109.9
291P50.8Low50.6Low125 Ų125137.9 Ų137.981%0.81282%0.816SS**  trans-70.6160.1-176.4-17.832.5000114
292R54Low50.4Low239 Ų239140.7 Ų140.790%0.90282%0.819SS**  trans-115.236.3-162.8-155.4-167.6-163.5164.35.9114.1
293D55.6Low50Low142 Ų142139.4 Ų139.476%0.75981%0.813SS**  trans-13069-173-71.8-68.2000112.8
294M57.2Low49.6Very low170 Ų170141.4 Ų141.484%0.83781%0.809SS**  trans-151.6130.9163.1-151.363.165.900110.9
295P65.8Low49.2Very low106 Ų106143.9 Ų143.969%0.68881%0.813SS**PPolyproline II helixtrans-72151.8175.829.8-34.4000111.7
296P62.3Low49Very low119 Ų119145.9 Ų145.977%0.77382%0.815SS**PPolyproline II helixtrans-71.5147.7-178.629.8-35.2000112.4
297P56.4Low48.6Very low118 Ų118141.2 Ų141.277%0.76681%0.809SS**PPolyproline II helixtrans-70.4152.2177.629.8-35.2000112.3
298P60.2Low48.2Very low114 Ų114135.1 Ų135.174%0.7480%0.804SS**PPolyproline II helixtrans-71.1153.7177.830.7-35.6000112.2S300P298-S300 PolarHBondContact O-N 2.93Å
299P47.6Very low48.1Very low123 Ų123135.4 Ų135.480%0.79981%0.806SS**PPolyproline II helixtrans-73.5125.3-178.429.2-34.2000112.4
300S55.3Low47.7Very low123 Ų123134.8 Ų134.886%0.8680%0.801SS**PPolyproline II helixtrans-63.2135.9174.7-52.70000112.4P298P298-S300 PolarHBondContact O-N 2.93Å
301V52.4Low46.9Very low137 Ų137131.3 Ų131.383%0.8379%0.794SS**  trans-106.5146.4172.2-69.10000110.9
302N41.3Very low46Very low150 Ų150132.1 Ų132.180%0.80280%0.797SS**  trans68144.9-175.5-1083.3000114.5
303S38.5Very low44.9Very low105 Ų105124.5 Ų124.573%0.73479%0.793SS**  cis-143.1157.928.5-63.70000113.9
304K39.1Very low43.7Very low192 Ų192129 Ų12984%0.83580%0.799SS**PPolyproline II helixtrans-71.8149168.7-65172.6179.91730111.1
305P37.7Very low42.8Very low125 Ų125126 Ų12681%0.81280%0.795SS**PPolyproline II helixtrans-71.7151169.530.5-33.9000112
306S31.9Very low41.8Very low119 Ų119126.7 Ų126.783%0.83280%0.799SS**PPolyproline II helixtrans-68.7152.1-178.2-1700000113.1
307A35.3Very low40.5Very low92 Ų92125.2 Ų125.276%0.7680%0.798SS**  trans-123.1124.5164.600000109.1
308S32.6Very low39.6Very low117 Ų117124.9 Ų124.982%0.81880%0.798SS**  trans-70.2141.4-176.6-480000112.5
309P42.4Very low38.8Very low130 Ų130125.3 Ų125.384%0.84480%0.804SS**  trans-94.6138.3167.134.8-29.9000111.5
310S33.1Very low38.4Very low106 Ų106123.1 Ų123.174%0.74180%0.803SS**  trans-113.8124.8166.553.60000110.5
311S35.3Very low37.9Very low105 Ų105123.8 Ų123.873%0.73480%0.802SS**  trans44.8133.7149600000119.6
312T32.6Very low37.7Very low143 Ų143122.5 Ų122.588%0.87780%0.796SS**  cis-176.8155.29.510.90000106.7
313G30.1Very low38.1Very low78 Ų78121.3 Ų121.380%0.80480%0.797SS**  trans152.137.3165.900000122.9
314R31.8Very low38.7Very low236 Ų236124.2 Ų124.289%0.89180%0.803SS**  trans30.996.6143.5-164.2174.9175.8-132.41.1121.5
315S36.5Very low39.5Very low108 Ų108120.6 Ų120.676%0.75580%0.8SS**  trans73.1173.2132.6-43.20000119.7
316P45.7Very low39.9Very low120 Ų120120.9 Ų120.978%0.77980%0.801SS**  -136.1172.4-86.640.6-22.5000117.3
317A35.3Very low40.3Very low89 Ų89118.8 Ų118.874%0.73680%0.798SS**  trans75.9134.8150.900000122.6
318S36.5Very low40.8Very low110 Ų110126 Ų12677%0.76981%0.806SS**  trans75.7136.4150.866.70000121.8
319S44Very low41.3Very low123 Ų123126.6 Ų126.686%0.8681%0.807SS**  trans49104.8160.454.80000119.4
320G39.5Very low41.6Very low77 Ų77123.3 Ų123.379%0.79480%0.797SS**  trans177.8124.1164.700000112.7
321V43.4Very low42.8Very low138 Ų138124.1 Ų124.184%0.83680%0.8SS**PPolyproline II helixtrans-70.7136.3177.9-172.70000109.7
322P49.1Very low43.9Very low109 Ų109124.4 Ų124.471%0.70880%0.799SS**PPolyproline II helixtrans-69.6138.7171.929-33.9000110.7
323P49.5Very low44.7Very low125 Ų125123.7 Ų123.781%0.81280%0.796SS**PPolyproline II helixtrans-69.1147.8-175.828.1-35.2000112.6
324L50.7Low45.6Very low166 Ų166127.4 Ų127.487%0.86980%0.796SS**PPolyproline II helixtrans-66.8139.8173.6-68.2170.9000111
325P56.3Low46.6Very low117 Ų117121.2 Ų121.276%0.7679%0.787SS**PPolyproline II helixtrans-70.7139.1174.829.2-34000111.2
326P45.9Very low46.9Very low131 Ų131122.3 Ų122.385%0.85179%0.791SS**SBendtrans-74.9146.2-178.930.4-35000112.3
327G41.3Very low46.4Very low74 Ų74120.2 Ų120.276%0.76379%0.792SS**  trans94.779161.800000116.6
328R44.8Very low46.4Very low244 Ų244125.5 Ų125.592%0.92180%0.801SS**  trans-114.8117.5149.5-77.4-174.7175.8-1212.9108.9G330R328-G330 PolarHBondContact O-N 3.46Å
329P43.8Very low46.3Very low130 Ų130124.2 Ų124.284%0.84481%0.805SS**PPolyproline II helixtrans-61.6127.8161.5-17.531.4000108.6
330G47.5Very low45.7Very low61 Ų61122.5 Ų122.563%0.62981%0.807SS**PPolyproline II helixtrans-69.4168.517200000112.1R328R328-G330 PolarHBondContact O-N 3.46Å
331P59.9Low45.5Very low123 Ų123122.1 Ų122.180%0.79980%0.803SS**PPolyproline II helixtrans-60.1151.6169.128.4-34.7000110.7
332P58.2Low45.2Very low111 Ų111123.8 Ų123.872%0.72180%0.801SS**PPolyproline II helixtrans-65.2147.1-179.528.3-35.1000111.4
333P47.8Very low44.9Very low127 Ų127125.9 Ų125.983%0.82581%0.807SS**PPolyproline II helixtrans-68.4137.7177.828.7-34.1000111.3
334I50.7Low44.6Very low156 Ų156128.6 Ų128.680%0.881%0.809SS**PPolyproline II helixtrans-77.3133.8170.8-57.8172.4000107.7
335P51.6Low44.3Very low107 Ų107128 Ų12870%0.69581%0.807SS**PPolyproline II helixtrans-68.7143.8176.628.6-34.6000111.4G337P335-G337 PolarHBondContact O-N 3.44Å
336P43.3Very low44.2Very low131 Ų131128.1 Ų128.185%0.85181%0.805SS**  trans-74.3109.5-17929.5-33.6000111.3
337G35.5Very low44.3Very low76 Ų76127.8 Ų127.878%0.78480%0.803SS**  trans-81.9125.1164.800000110.5P335P335-G337 PolarHBondContact O-N 3.44Å
338Q35Very low44.4Very low199 Ų199135.5 Ų135.593%0.9381%0.809SS**  trans-75.6132.5175.8-73.4-179.3-26.700111.6
339G34Very low44.5Very low83 Ų83131.2 Ų131.286%0.85680%0.804SS**  trans26.6119.2149.500000122.2
340G32.8Very low44.8Very low87 Ų87131.1 Ų131.190%0.89780%0.803SS**  trans98.8149.3134.700000117.1
341G35.4Very low44.4Very low69 Ų69135.3 Ų135.371%0.71181%0.806SS**  trans109.1103.2165.400000115.1
342E36.4Very low43.6Very low173 Ų173138.6 Ų138.681%0.80880%0.803SS**  trans-24.8148.1156.557.8-123.4145.900120.1
343D42Very low42.8Very low153 Ų153140.9 Ų140.982%0.81881%0.809SS**  trans32.3118.9143.6-56.9-34.7000121.1
344Q43.9Very low42.6Very low182 Ų182140.4 Ų140.485%0.8581%0.809SS**  trans-179.7113.7133.1-94-82.315.500109.9T346Q344-T346 PolarHBondContact O-N 3.29Å
345N44.9Very low42.2Very low155 Ų155139 Ų13983%0.82981%0.812SS**  trans-101.471.7-167.8-161.7-13.2000113
346T52.8Low41.9Very low118 Ų118141.7 Ų141.772%0.72482%0.82SS**  trans-152.8105.8165.741.50000114.1Q344Q344-T346 PolarHBondContact O-N 3.29Å
347P47.8Very low41.5Very low124 Ų124143 Ų14381%0.80582%0.82SS**  trans-82.8115.9165.530.2-30.2000111.6
348R45.3Very low41.5Very low236 Ų236143.7 Ų143.789%0.89181%0.813SS**PPolyproline II helixtrans-71.5133.7-178.5-179.4174176.2-105.17.9112.7
349L46.3Very low41.7Very low155 Ų155142.8 Ų142.881%0.81281%0.808SS**PPolyproline II helixtrans-65.3133179.2-69.3169.4000113.4
350P49.5Very low42Very low128 Ų128145 Ų14583%0.83181%0.805SS**PPolyproline II helixtrans-69.4133.7163.4-20.334.2000112.1
351Q40.1Very low42.2Very low148 Ų148147 Ų14769%0.69280%0.803SS**PPolyproline II helixtrans-86.7140.9-179.1-83.7-173.6000113.2
352R42.1Very low42.4Very low193 Ų193148.2 Ų148.273%0.72881%0.805SS**  trans54.4125.8148-58.2174.7-168.8138.1-1118.8
353N41.4Very low42.8Very low158 Ų158145.6 Ų145.685%0.84580%0.803SS**  -165.7123.891.3-95.6-24.8000111.8
354S42.9Very low43Very low118 Ų118144.4 Ų144.483%0.82580%0.804SS**  trans-92.7126.8171.9-51.60000109.8
355S43.3Very low42.6Very low125 Ų125141.9 Ų141.987%0.87481%0.807SS**  trans-157.7122.2157.5-80.20000110.1
356L44.4Very low42.1Very low165 Ų165138.3 Ų138.386%0.86481%0.806SS**  trans-74.4147.4166.1-66.8152000108.6
357N35.7Very low41.4Very low158 Ų158144.8 Ų144.885%0.84582%0.818SS**  trans-161.8141130.7-104.5-2.4000112.2
358S36.5Very low41.4Very low91 Ų91144.9 Ų144.964%0.63682%0.821SS**  trans-70.7153170.144.50000111.2
359H37.3Very low41.7Very low180 Ų180136.3 Ų136.383%0.83381%0.806SS**  trans-170.3148.3130.1-89.2-49.4000112.1
360T41Very low42.2Very low128 Ų128135.3 Ų135.379%0.78581%0.809SS**PPolyproline II helixtrans-82.7139.3177.1460000112.1
361P37.8Very low42.5Very low131 Ų131137 Ų13785%0.85181%0.81SS**PPolyproline II helixtrans-82129.1166.9-825.8000111.7
362A39Very low43.4Very low93 Ų93135.3 Ų135.377%0.76981%0.812SS**PPolyproline II helixtrans-89.3149.7164.800000110.8
363P45.3Very low44.5Very low118 Ų118131.7 Ų131.777%0.76681%0.813SS**PPolyproline II helixtrans-83.4153.9172.433.8-33.6000112.3
364P45Very low45.6Very low129 Ų129129.2 Ų129.284%0.83881%0.806SS**PPolyproline II helixtrans-82.8154.1-173.133.1-36.6000114.6
365S35.5Very low46.1Very low128 Ų128129.7 Ų129.790%0.89581%0.806SS**PPolyproline II helixtrans-82.4142.8174-56.10000112.7
366G35.8Very low46.4Very low80 Ų80131.1 Ų131.183%0.82580%0.804SS**  trans12383.2151.600000117.6
367R37.9Very low46.3Very low255 Ų255132.2 Ų132.296%0.96281%0.805SS**  trans-145.2126.9144.4-142176.9-172-141.41110.3
368S46.7Very low47Very low126 Ų126135.3 Ų135.388%0.88181%0.805SS**  trans-82.3132.6-168.450.20000113.7
369G53.3Low47.8Very low55 Ų55136.1 Ų136.157%0.56781%0.808SS**  trans-169.4147.4165.400000109.7
370P56.8Low48.2Very low135 Ų135132.9 Ų132.988%0.87780%0.802SS**PPolyproline II helixtrans-67.2135.1-178.727.7-33.6000111.1
371L55.1Low48.2Very low162 Ų162132.2 Ų132.285%0.84880%0.803SS**PPolyproline II helixtrans-73.7146.1178.6-65.9169.4000111.1
372P58.8Low48.4Very low113 Ų113132.5 Ų132.573%0.73480%0.802SS**PPolyproline II helixtrans-66.5145.1167.329.7-33.8000110.3
373P64.9Low48.3Very low117 Ų117131.2 Ų131.276%0.7680%0.798SS**PPolyproline II helixtrans-67.6151.9177.928.7-34.9000111.7
374P65Low47.9Very low106 Ų106136.7 Ų136.769%0.68880%0.804SS**PPolyproline II helixtrans-67.1150.5176.129.5-35.4000111.5N376P374-N376 PolarHBondContact O-N 2.95Å; P374-N376 VanDerWaalsContact O-N 3.07Å
375P53.4Low47.5Very low128 Ų128137.3 Ų137.383%0.83180%0.8SS**  trans-66.4109.4175.326.9-33.2000110.8E377P375-E377 PolarHBondContact O-N 2.85Å
376N49.3Very low47.4Very low155 Ų155140.7 Ų140.783%0.82980%0.802SS**  trans-75.895.4172.6-102.2-22.9000110.3P374P374-N376 PolarHBondContact O-N 2.95Å; P374-N376 VanDerWaalsContact O-N 3.07Å
377E41.8Very low47.4Very low189 Ų189142 Ų14288%0.88380%0.799SS**  trans-121.669.4163.8-70.8-161.617600111.2P375P375-E377 PolarHBondContact O-N 2.85Å
378R49.8Very low47.4Very low223 Ų223134.9 Ų134.984%0.84279%0.788SS**PPolyproline II helixtrans-103.3116159.6-166.9-178.6-165.7-142.74.1107.7
379P55.3Low47.4Very low107 Ų107134.9 Ų134.970%0.69578%0.784SS**PPolyproline II helixtrans-65.3145.1175.427.3-33.5000110.2S381P379-S381 PolarHBondContact O-N 3.34Å
380P44.3Very low46.6Very low112 Ų112144 Ų14473%0.72780%0.802SS**PPolyproline II helixtrans-69.2132.5-177.527.6-34.1000111.4V382P380-V382 PolarHBondContact O-N 2.86Å; P380-V382 VanDerWaalsContact O-N 3.1Å
381S42.2Very low45.9Very low115 Ų115144.3 Ų144.380%0.80480%0.801SS**  trans-73.894.716853.10000109.7P379 G383P379-S381 PolarHBondContact O-N 3.34Å; S381-G383 PolarHBondContact O-N 3.12Å; S381-G383 VanDerWaalsContact O-N 3.12Å
382V41.8Very low45.7Very low136 Ų136139.7 Ų139.782%0.82479%0.793SS**  trans-70.9107.2178.1177.80000110.8P380P380-V382 PolarHBondContact O-N 2.86Å; P380-V382 VanDerWaalsContact O-N 3.1Å
383G37.1Very low45.1Very low67 Ų67140.7 Ų140.769%0.69180%0.799SS**  57.895.5126.500000118S381S381-G383 PolarHBondContact O-N 3.12Å; S381-G383 VanDerWaalsContact O-N 3.12Å
384R36.7Very low44.7Very low233 Ų233142.8 Ų142.888%0.87980%0.803SS**  trans-80.8124.5163-179.2179.1-176.1172.10.7110.2
385N35.3Very low44.4Very low142 Ų142143.1 Ų143.176%0.75981%0.805SS**  trans60.7120.5166-70.1-18000119.5
386Q34.3Very low44.7Very low198 Ų198142.7 Ų142.793%0.92580%0.802SS**  -147.5153114.3-70.1-154.9-3.200110.3
387S34.7Very low45.5Very low109 Ų109140.7 Ų140.776%0.76280%0.798SS**  trans-79.1163.2176.952.70000111.4
388S39.6Very low46.2Very low105 Ų105137.2 Ų137.273%0.73479%0.792SS**  cis-165.2-159.546.6-48.80000110.9
389P46.9Very low46.1Very low125 Ų125132.7 Ų132.781%0.81279%0.791SS**  -93.3157.4-127.440.9-29.5000116.1
390R35.1Very low45.9Very low248 Ų248133.4 Ų133.494%0.93680%0.799SS**  trans-142.5141.1152.6-157.7170.5-176.1-154.2-0.4111.7
391T42.4Very low45.6Very low140 Ų140131.4 Ų131.486%0.85980%0.799SS**  trans-88.6147.5-164.339.50000114
392G50.7Low45.5Very low65 Ų65138 Ų13867%0.6781%0.806SS**  trans-169.2137.9168.100000109.4
393P47.4Very low45.6Very low134 Ų134136.9 Ų136.987%0.8780%0.804SS**PPolyproline II helixtrans-76.1145.5-172.230.5-34.8000112.5
394L55.8Low46Very low162 Ų162142.6 Ų142.685%0.84882%0.815SS**PPolyproline II helixtrans-80.4147.9172-66.9170.4000110.9
395P58.6Low45.8Very low113 Ų113135 Ų13573%0.73481%0.81SS**PPolyproline II helixtrans-69.7151171.630.3-34.7000111.6
396P60.3Low45.6Very low118 Ų118132.5 Ų132.577%0.76682%0.817SS**PPolyproline II helixtrans-73.6150.8-177.630.6-35.8000112.8
397P64.8Low45.5Very low113 Ų113126.9 Ų126.973%0.73481%0.812SS**PPolyproline II helixtrans-73.5152171.731.7-34.9000111.9
398P56.6Low45.4Very low117 Ų117126.8 Ų126.876%0.7681%0.812SS**PPolyproline II helixtrans-67149.9172.529-34.5000111.5
399P48.6Very low45.7Very low128 Ų128129.4 Ų129.483%0.83182%0.817SS**PPolyproline II helixtrans-77.3133.5-168.129.7-35.5000113.8G401P399-G401 PolarHBondContact O-N 2.79Å
400S50.6Low45.1Very low122 Ų122135.5 Ų135.585%0.85382%0.823SS**  trans-85.498.2166.2-64.70000111.2
401G37.3Very low45Very low70 Ų70128.1 Ų128.172%0.72282%0.815SS**  trans-107.9113.6160.100000108.7P399P399-G401 PolarHBondContact O-N 2.79Å
402R40.6Very low44.6Very low252 Ų252128 Ų12895%0.95182%0.815SS**  67.4119.967.6-71.1-164.3168.2-150.7-2.3114
403S44.7Very low43.8Very low113 Ų113134 Ų13479%0.7983%0.826SS**  trans-77136.7-176.4177.10000113.3
404M44.3Very low43Very low187 Ų187132.6 Ų132.692%0.92183%0.825SS**  trans-154.7144.8152.8-62.4-64.6-90.700106.3
405G32.7Very low41.8Very low75 Ų75129.1 Ų129.177%0.77382%0.82SS**  cis147.969.3-3.200000114.1
406G32.3Very low41Very low88 Ų88129.3 Ų129.391%0.90782%0.821SS**  trans76152.9170.300000116.4
407G32Very low40.9Very low80 Ų80129.4 Ų129.483%0.82582%0.822SS**  cis-145.8-178.1-9.500000108.4
408S32.5Very low39.4Very low107 Ų107131.7 Ų131.775%0.74883%0.826SS**  cis-176.8137.848.2-172.30000111.7
409L45.7Very low38.3Very low161 Ų161131.3 Ų131.384%0.84383%0.826SS**  trans51.9103.6152.5-58.9171.4000122.8
410R34.2Very low37.9Very low252 Ų252136.5 Ų136.595%0.95183%0.829SS**  -169.8148.1106.3-104.7-176.1179.9-143.50.1113.6
411A33.8Very low37.3Very low93 Ų93137 Ų13777%0.76983%0.83SS**  trans-49.5164.5-176.500000117
412T33.8Very low37.2Very low139 Ų139137 Ų13785%0.85383%0.83SS**  cis-143.7173.622.545.80000113
413Q33.5Very low38.1Very low191 Ų191131 Ų13189%0.89382%0.824SS**  trans-99.4144.2-177.2-63.9177.60.200114.8
414A29.3Very low37.5Very low103 Ų103134.1 Ų134.185%0.85183%0.826SS**  trans10154.7134.800000121
415A31Very low37.6Very low90 Ų90129.6 Ų129.674%0.74481%0.81SS**  cis-161.9-150.5-2.500000106.8
416P42.4Very low38.4Very low117 Ų117132.3 Ų132.376%0.7681%0.814SS**  cis-117.1-171.2-40.341.9-26.3000111.9
417P57.6Low38.8Very low120 Ų120139.9 Ų139.978%0.77982%0.815SS**  trans-100.3143-177.236.4-31000115
418I34.6Very low39.4Very low160 Ų160139.8 Ų139.882%0.82182%0.815SS**  trans-156136.3172.1-107.2151.3000113.9
419S32.9Very low39.6Very low110 Ų110138 Ų13877%0.76981%0.812SS**  trans56.4138.9153-60.80000125.1
420R41Very low39.7Very low237 Ų237137.2 Ų137.289%0.89482%0.817SS**  trans-57157.7157.9-74.5174.6162.2-170.4-5.5112.5
421P38Very low40.2Very low132 Ų132128.8 Ų128.886%0.85781%0.809SS**  -118.7172.9119.5-7.127.2000114.6
422G33.5Very low40.7Very low71 Ų71128.1 Ų128.173%0.73281%0.811SS**  trans-105.6-146.8-170.600000116.2
423P61.1Low41.9Very low126 Ų126132.9 Ų132.982%0.81881%0.813SS**  trans-105.4158.6-148.640.1-36.3000115.8
424E31.3Very low42.8Very low178 Ų178129.1 Ų129.183%0.83281%0.805SS**  trans-154.4167.9169.5-102.9-65.586.900108.7
425P47.2Very low44.3Very low91 Ų91130.1 Ų130.159%0.59180%0.803SS**  -118.1169.1-123.735.3-18.6000115.1R427P425-R427 PolarHBondContact O-N 2.74Å; P425-R427 VanDerWaalsContact O-N 3.17Å
426P49.2Very low45.5Very low132 Ų132133.5 Ų133.586%0.85781%0.808SS**  trans-74.9107.4179.830.1-34.3000112G428P426-G428 PolarHBondContact O-N 3.5Å
427R41.1Very low46Very low247 Ų247133.1 Ų133.193%0.93281%0.805SS**  trans-69.1117.8168-162.6176.9-172.399.8-2.9109.2P425P425-R427 PolarHBondContact O-N 2.74Å; P425-R427 VanDerWaalsContact O-N 3.17Å
428G42.8Very low46.2Very low79 Ų79133.2 Ų133.281%0.81481%0.806SS**  trans-69.6151.7-171.900000115.2P426P426-G428 PolarHBondContact O-N 3.5Å
429G37Very low47.1Very low68 Ų68133.4 Ų133.470%0.70181%0.809SS**  trans-153.8150.6170.600000109.6G431G429-G431 PolarHBondContact O-N 2.81Å
430P48.2Very low47.9Very low145 Ų145139.5 Ų139.594%0.94282%0.815SS**SBendtrans-81.8120.7-154.530.8-35.3000113.7
431G44.2Very low48.3Very low76 Ų76134 Ų13478%0.78481%0.81SS**  trans176.368.8179.100000110.8G429G429-G431 PolarHBondContact O-N 2.81Å
432G44.1Very low49Very low78 Ų78135.3 Ų135.380%0.80482%0.815SS**PPolyproline II helixtrans-61.3144-170.600000113.9
433R59.2Low49.5Very low239 Ų239135 Ų13590%0.90281%0.811SS**PPolyproline II helixtrans-60.1147.5159.2-73.8-177.7170.5-158.1-2.2109.2
434P53.7Low49Very low112 Ų112132.8 Ų132.873%0.72781%0.812SS**PPolyproline II helixtrans-60.9147.516928.1-34.6000110
435P59.3Low49.9Very low124 Ų124132.1 Ų132.181%0.80581%0.813SS**PPolyproline II helixtrans-64.9150175.328.6-34.4000110.8
436L56.7Low50.4Low161 Ų161133 Ų13384%0.84382%0.819SS**PPolyproline II helixtrans-68147.8170.8-65.3171.4000109.8
437P54.3Low51Low109 Ų109132.3 Ų132.371%0.70881%0.814SS**PPolyproline II helixtrans-66.1150.7177.329.3-35.2000111
438P60.1Low51.8Low122 Ų122126.1 Ų126.179%0.79281%0.806SS**PPolyproline II helixtrans-69138-178.528.2-34.7000112R440P438-R440 PolarHBondContact O-N 3.08Å
439D55.1Low52.9Low164 Ų164127.5 Ų127.588%0.87780%0.801SS**PPolyproline II helixtrans-60.5127.5174.8-64.3-60.6000111
440R49.1Very low54.1Low239 Ų239130.3 Ų130.390%0.90281%0.807SS**PPolyproline II helixtrans-77.6143171.7-86.6-176.9172.8167.1-2.3110.3P438P438-R440 PolarHBondContact O-N 3.08Å
441P49.2Very low54.2Low121 Ų121132 Ų13279%0.78680%0.804SS**PPolyproline II helixtrans-66.4152.4-178.128.8-35.5000111.9G443P441-G443 PolarHBondContact O-N 2.99Å; P441-G443 VanDerWaalsContact O-N 3.13Å
442V52.4Low54.5Low159 Ų159131.7 Ų131.796%0.96480%0.8SS**  trans-50.5112.8177.9177.30000111.3
443G44.1Very low54.7Low64 Ų64135.9 Ų135.966%0.6681%0.805SS**  trans-141.3127.4170.100000108.5P441 L445P441-G443 PolarHBondContact O-N 2.99Å; P441-G443 VanDerWaalsContact O-N 3.13Å; G443-L445 PolarHBondContact O-N 2.92Å
444G49.9Very low54.2Low80 Ų80127.3 Ų127.383%0.82579%0.79SS**PPolyproline II helixtrans-59132.2-162.500000114.7
445L50.7Low53.7Low165 Ų165130.7 Ų130.786%0.86479%0.794SS**PPolyproline II helixtrans-69142.3163.2-61.4174.3000109G443G443-L445 PolarHBondContact O-N 2.92Å
446P58.6Low53.1Low109 Ų109133.2 Ų133.271%0.70880%0.795SS**PPolyproline II helixtrans-61151.2169.328-34.4000110.1
447P61.7Low52.6Low117 Ų117129.6 Ų129.676%0.7678%0.776SS**PPolyproline II helixtrans-58.7139.7179.325.3-34.1000110.3
448P58.2Low52.6Low117 Ų117127.7 Ų127.776%0.7677%0.766SS**PPolyproline II helixtrans-62141.6178.226.6-34000110
449P65.2Low52.3Low108 Ų108130 Ų13070%0.70177%0.766SS**PPolyproline II helixtrans-61.7151.1176.427.2-34.6000110.4M451P449-M451 PolarHBondContact O-N 3.32Å
450P63.4Low52.3Low128 Ų128128.2 Ų128.283%0.83175%0.752SS**PPolyproline II helixtrans-58.1124.817725-33.7000109.5G452P450-G452 VanDerWaalsContact C-N 3.29Å; P450-G452 PolarHBondContact O-N 3.13Å
451M49.6Very low52.5Low181 Ų181120.3 Ų120.389%0.89273%0.727SS**  trans-71.484.2179.4-72-179.561.400110.4P449P449-M451 PolarHBondContact O-N 3.32Å
452G51Low53Low68 Ų68120.8 Ų120.870%0.70172%0.719SS**  trans-63.6134.8163.800000110.4P450 G454P450-G452 VanDerWaalsContact C-N 3.29Å; P450-G452 PolarHBondContact O-N 3.13Å; G452-G454 PolarHBondContact O-N 2.87Å; G452-G454 VanDerWaalsContact O-N 3.07Å
453N47.4Very low53.3Low167 Ų167120 Ų12089%0.89371%0.707SS**SBendtrans-66.6106.8-175.1-72.842.8000112.7
454G49.5Very low54Low58 Ų58120.6 Ų120.660%0.59869%0.692SS**SBendtrans104.6149.6153.300000117.1G452G452-G454 PolarHBondContact O-N 2.87Å; G452-G454 VanDerWaalsContact O-N 3.07Å
455F42.4Very low54.7Low184 Ų184120 Ų12081%0.80767%0.67SS**  trans71.473.1168.6-44.6-70.1000117.4N457F455-N457 VanDerWaalsContact C-N 3.27Å; F455-N457 PolarHBondContact O-N 3.47Å
456Q47.6Very low55.7Low176 Ų176116.9 Ų116.982%0.82265%0.654SS**  trans-65.782160.7-74.7-78.4-21.300111.1S458Q456-S458 PolarHBondContact OE1-OG 3Å
457N45.8Very low56.5Low85 Ų85116.1 Ų116.146%0.45564%0.64SS.*  trans-110.737.7174.9-85.6-37.6000111.2F455 H459 H460 N461F455-N457 VanDerWaalsContact C-N 3.27Å; F455-N457 PolarHBondContact O-N 3.47Å; N457-H459 VanDerWaalsContact C-N 3.27Å; N457-H459 PolarHBondContact O-N 2.95Å; N457-H459 VanDerWaalsContact O-N 3.13Å; N457-H460 HydrophobicContact CB-CB 4.49Å; N457-H460 PolarHBondContact O-N 3.21Å; N457-N461 VanDerWaalsContact CB-ND2 3.27Å; N457-N461 WeakPolarHBondContact CB-ND2 3.37Å; N457-N461 PolarHBondContact O-N 3.44Å; N457-N461 PolarHBondContact O-ND2 3.5Å
458S54.5Low57Low69 Ų69114.8 Ų114.848%0.48362%0.624SS.*Hα-helixtrans-60.6-27.9-166.4-49.30000115Q456Q456-S458 PolarHBondContact OE1-OG 3Å
459H53.6Low57.7Low172 Ų172118.8 Ų118.880%0.79663%0.625SS**Hα-helixtrans-85.2-18.1175.2-69.4-74.8000114.3N457N457-H459 VanDerWaalsContact C-N 3.27Å; N457-H459 PolarHBondContact O-N 2.95Å; N457-H459 VanDerWaalsContact O-N 3.13Å
460H54.1Low58.2Low125 Ų125121.9 Ų121.958%0.57962%0.623SS**Hα-helixtrans-91.1-39.1177.2-171.148.2000111.5N457 M463 Q464N457-H460 HydrophobicContact CB-CB 4.49Å; N457-H460 PolarHBondContact O-N 3.21Å; H460-M463 PolarHBondContact O-N 3.1Å; H460-Q464 PolarHBondContact O-N 3.03Å
461N54.4Low58.8Low73 Ų73121.2 Ų121.239%0.3961%0.607SS.*Hα-helixtrans-63.2-43177.1-73-86.6000111.8N457 M463 Q464 D465N457-N461 VanDerWaalsContact CB-ND2 3.27Å; N457-N461 WeakPolarHBondContact CB-ND2 3.37Å; N457-N461 PolarHBondContact O-N 3.44Å; N457-N461 PolarHBondContact O-ND2 3.5Å; N461-M463 PolarHBondContact O-N 3.42Å; N461-M463 VanDerWaalsContact O-N 3.08Å; N461-Q464 CarbonylContact O-C 3.49Å; N461-Q464 WeakPolarHBondContact O-CA 3.31Å; N461-Q464 VanDerWaalsContact O-CB 3.31Å; N461-Q464 WeakPolarHBondContact O-CB 3.23Å; N461-Q464 PolarHBondContact O-N 2.83Å; N461-D465 VanDerWaalsContact C-OD2 3.25Å; N461-D465 WeakPolarHBondContact O-CB 3.06Å; N461-D465 PolarHBondContact O-N 3.3Å
462Q59.5Low60.3Low132 Ų132118.9 Ų118.962%0.61760%0.603SS**Hα-helixtrans-54.8-37.6-177.7-149.3166.379.200113.5D466Q462-D466 PolarHBondContact O-N 3.49Å
463M57.3Low61.8Low143 Ų143122 Ų12270%0.70460%0.598SS**Hα-helixtrans-77-27.1175.1-62.6-77.9-174.500113.6H460 N461 F467H460-M463 PolarHBondContact O-N 3.1Å; N461-M463 PolarHBondContact O-N 3.42Å; N461-M463 VanDerWaalsContact O-N 3.08Å; M463-F467 PolarHBondContact O-N 2.96Å
464Q59.3Low63.6Low75 Ų75120.1 Ų120.135%0.3558%0.583SS.*Hα-helixtrans-76.5-44.7176.5-172.370.227.500110.2H460 N461 D466 F467 E468H460-Q464 PolarHBondContact O-N 3.03Å; N461-Q464 CarbonylContact O-C 3.49Å; N461-Q464 WeakPolarHBondContact O-CA 3.31Å; N461-Q464 VanDerWaalsContact O-CB 3.31Å; N461-Q464 WeakPolarHBondContact O-CB 3.23Å; N461-Q464 PolarHBondContact O-N 2.83Å; Q464-D466 PolarHBondContact O-N 3.2Å; Q464-F467 WeakPolarHBondContact O-CA 3.38Å; Q464-F467 WeakPolarHBondContact O-CB 3.49Å; Q464-F467 PolarHBondContact O-N 3.13Å; Q464-E468 WeakPolarHBondContact CG-OE1 3.43Å; Q464-E468 PolarHBondContact NE2-OE1 3.07Å; Q464-E468 WeakPolarHBondContact O-CG 3.27Å; Q464-E468 PolarHBondContact O-N 3.37Å
465D65.8Low65.4Low69 Ų69121.3 Ų121.337%0.36958%0.58SS.*Hα-helixtrans-55.8-50.1172.6-63.1-44.8000109.9N461 F467 E468 Y469N461-D465 VanDerWaalsContact C-OD2 3.25Å; N461-D465 WeakPolarHBondContact O-CB 3.06Å; N461-D465 PolarHBondContact O-N 3.3Å; D465-F467 PolarHBondContact O-N 3.46Å; D465-F467 VanDerWaalsContact O-N 3.1Å; D465-E468 PolarHBondContact O-N 3.33Å; D465-E468 VanDerWaalsContact O-N 3.12Å; D465-Y469 HydrophobicContact CB-CD2 4.29Å; D465-Y469 HydrophobicContact CB-CE2 4.46Å; D465-Y469 WeakPolarHBondContact O-CB 3.17Å; D465-Y469 VanDerWaalsContact O-CD2 3.31Å; D465-Y469 WeakPolarHBondContact O-CD2 3.45Å; D465-Y469 PolarHBondContact O-N 3.46Å
466D71Confident67Low98 Ų98119.6 Ų119.652%0.52458%0.578SS.*Hα-helixtrans-60.1-21175.8-76.6-19.9000114.2Q462 Q464 R470Q462-D466 PolarHBondContact O-N 3.49Å; Q464-D466 PolarHBondContact O-N 3.2Å; D466-R470 PolarHBondContact O-NE 3.47Å; D466-R470 PolarHBondContact O-NH2 2.89Å
467F74.8Confident68.7Low94 Ų94116.6 Ų116.641%0.41258%0.576SS.*Hα-helixtrans-87.2-43.1173.2-177.3-93000111.6M463 Q464 D465 R470 F471M463-F467 PolarHBondContact O-N 2.96Å; Q464-F467 WeakPolarHBondContact O-CA 3.38Å; Q464-F467 WeakPolarHBondContact O-CB 3.49Å; Q464-F467 PolarHBondContact O-N 3.13Å; D465-F467 PolarHBondContact O-N 3.46Å; D465-F467 VanDerWaalsContact O-N 3.1Å; F467-R470 PolarHBondContact O-N 3.14Å; F467-F471 HydrophobicContact CE2-CE2 4.48Å; F467-F471 HydrophobicContact CZ-CE2 4.47Å
468E71.8Confident70.8Confident89 Ų89117.4 Ų117.442%0.41658%0.581SS.*Hα-helixtrans-71.6-35-179.8-70.3178.5-163.500112.4Q464 D465 R470 F471 F473Q464-E468 WeakPolarHBondContact CG-OE1 3.43Å; Q464-E468 PolarHBondContact NE2-OE1 3.07Å; Q464-E468 WeakPolarHBondContact O-CG 3.27Å; Q464-E468 PolarHBondContact O-N 3.37Å; D465-E468 PolarHBondContact O-N 3.33Å; D465-E468 VanDerWaalsContact O-N 3.12Å; E468-R470 PolarHBondContact O-N 3.26Å; E468-F471 CarbonylContact O-C 3.34Å; E468-F471 PolarHBondContact O-N 3.46Å; E468-F473 HydrophobicContact CG-CE2 4.34Å
469Y73Confident72.4Confident200 Ų200119.2 Ų119.278%0.78458%0.584SS**THydrogen-bonded Turntrans-64.5-19.7173.1-89.6-75.5000114.1D465D465-Y469 HydrophobicContact CB-CD2 4.29Å; D465-Y469 HydrophobicContact CB-CE2 4.46Å; D465-Y469 WeakPolarHBondContact O-CB 3.17Å; D465-Y469 VanDerWaalsContact O-CD2 3.31Å; D465-Y469 WeakPolarHBondContact O-CD2 3.45Å; D465-Y469 PolarHBondContact O-N 3.46Å
470R77.1Confident74.2Confident174 Ų174116.2 Ų116.266%0.65758%0.58SS**THydrogen-bonded Turntrans-84.7-11.8175-74.1-177.8-72.2156.4-2.8113.6D466 F467 E468D466-R470 PolarHBondContact O-NE 3.47Å; D466-R470 PolarHBondContact O-NH2 2.89Å; F467-R470 PolarHBondContact O-N 3.14Å; E468-R470 PolarHBondContact O-N 3.26Å
471F76Confident75.8Confident113 Ų113115.8 Ų115.850%0.49659%0.588SS.*SBendtrans-135.5103.4-179.6-72.3-81.2000109.9F467 E468 F473F467-F471 HydrophobicContact CE2-CE2 4.48Å; F467-F471 HydrophobicContact CZ-CE2 4.47Å; E468-F471 CarbonylContact O-C 3.34Å; E468-F471 PolarHBondContact O-N 3.46Å; F471-F473 VanDerWaalsContact C-N 3.31Å; F471-F473 HydrophobicContact CB-CD2 4.2Å; F471-F473 HydrophobicContact CB-CE2 3.64Å; F471-F473 HydrophobicContact CB-CZ 3.89Å; F471-F473 WeakPolarHBondContact O-CD2 3.44Å; F471-F473 PolarHBondContact O-N 2.67Å
472T81.4Confident77.5Confident132 Ų132118.1 Ų118.181%0.8161%0.608SS**  trans-63.992172.9-48.20000110.2
473F82.3Confident79Confident135 Ų135119.2 Ų119.259%0.59262%0.618SS**PPolyproline II helixtrans-72129.8172.1-69.3-77.3000109.2E468 F471E468-F473 HydrophobicContact CG-CE2 4.34Å; F471-F473 VanDerWaalsContact C-N 3.31Å; F471-F473 HydrophobicContact CB-CD2 4.2Å; F471-F473 HydrophobicContact CB-CE2 3.64Å; F471-F473 HydrophobicContact CB-CZ 3.89Å; F471-F473 WeakPolarHBondContact O-CD2 3.44Å; F471-F473 PolarHBondContact O-N 2.67Å
474H85.1Confident80.7Confident127 Ų127117.7 Ų117.759%0.58862%0.619SS**PPolyproline II helixtrans-71.3138.1172.2-61.261.6000107.3D478H474-D478 HydrophobicContact CB-CB 4.37Å; H474-D478 IonicContact CD2-OD2 3.84Å; H474-D478 PolarHBondContact CD2-OD2 3.46Å; H474-D478 VanDerWaalsContact CD2-OD2 3.25Å; H474-D478 IonicContact CG-OD2 2.67Å
475P85.9Confident82.2Confident83 Ų83122.9 Ų122.954%0.53964%0.636SS.*PPolyproline II helixtrans-61.4151.4179.827.2-34.2000109.7S477 D478P475-S477 PolarHBondContact O-N 2.99Å; P475-D478 HydrophobicContact CG-CB 4.05Å; P475-D478 WeakPolarHBondContact O-CB 3.4Å; P475-D478 PolarHBondContact O-N 3.39Å
476I77.3Confident83.4Confident148 Ų148125 Ų12576%0.75965%0.652SS**G310 helixtrans-58.4-21.1-178.6-156.1169.9000113D478 L479I476-D478 VanDerWaalsContact C-N 3.3Å; I476-D478 PolarHBondContact O-N 3.22Å; I476-L479 HydrophobicContact CG1-CD1 4.08Å; I476-L479 PolarHBondContact O-N 3.2Å
477S83.3Confident84.3Confident112 Ų112125.4 Ų125.478%0.78366%0.659SS**G310 helixtrans-68.3-20.5173.6-40.40000115P475P475-S477 PolarHBondContact O-N 2.99Å
478D89.5Confident84.7Confident103 Ų103124.7 Ų124.755%0.55167%0.666SS**G310 helixtrans-95.3-7-179.7-168.653.2000112.1H474 P475 I476H474-D478 HydrophobicContact CB-CB 4.37Å; H474-D478 IonicContact CD2-OD2 3.84Å; H474-D478 PolarHBondContact CD2-OD2 3.46Å; H474-D478 VanDerWaalsContact CD2-OD2 3.25Å; H474-D478 IonicContact CG-OD2 2.67Å; P475-D478 HydrophobicContact CG-CB 4.05Å; P475-D478 WeakPolarHBondContact O-CB 3.4Å; P475-D478 PolarHBondContact O-N 3.39Å; I476-D478 VanDerWaalsContact C-N 3.3Å; I476-D478 PolarHBondContact O-N 3.22Å
479L88.3Confident85.4Confident106 Ų106129.4 Ų129.456%0.55569%0.688SS**SBendtrans-73.1136.4169.1-58.7-178.1000109.5I476I476-L479 HydrophobicContact CG1-CD1 4.08Å; I476-L479 PolarHBondContact O-N 3.2Å
480P90.7Very high85.9Confident109 Ų109126.4 Ų126.471%0.70868%0.679SS**PPolyproline II helixtrans-60.2146.3174.326.3-34.2000110.2
481P89.1Confident86.1Confident116 Ų116123.2 Ų123.275%0.75368%0.679SS**PPolyproline II helixtrans-52.3137.9172.6-25.834.5000110.7
482P89.9Confident86.3Confident123 Ų123123.1 Ų123.180%0.79968%0.676SS**PPolyproline II helixtrans-62.8143-178.226.7-34.9000110.7
483D91.4Very high85.9Confident154 Ų154122.4 Ų122.482%0.82467%0.674SS**PPolyproline II helixtrans-52.6138.3176.2-73.4-45.8000111.1Y485D483-Y485 PolarHBondContact O-N 3.17Å
484P92.1Very high85.4Confident111 Ų111121 Ų12172%0.72168%0.681SS**PPolyproline II helixtrans-54.4134.2175.6-25.834.3000111.3V486P484-V486 PolarHBondContact O-N 2.84Å
485Y91.3Very high84.2Confident184 Ų184122.8 Ų122.872%0.72269%0.687SS**  trans-61.6109.3179.6176.2-102.3000111.2D483 P487D483-Y485 PolarHBondContact O-N 3.17Å; Y485-P487 HydrophobicContact CD1-CG 4.19Å; Y485-P487 HydrophobicContact CE1-CB 4.07Å; Y485-P487 HydrophobicContact CE1-CG 3.87Å; Y485-P487 WeakPolarHBondContact O-CD 3.47Å
486V91.3Very high83.2Confident114 Ų114123.3 Ų123.369%0.69168%0.684SS**  trans-88.3115.6170.4-1780000108.9P484 S488P484-V486 PolarHBondContact O-N 2.84Å; V486-S488 PolarHBondContact O-N 3.38Å
487P89.8Confident82.2Confident106 Ų106119.3 Ų119.369%0.68867%0.669SS**  trans-62.1111.6176.1-2133.2000110.8Y485Y485-P487 HydrophobicContact CD1-CG 4.19Å; Y485-P487 HydrophobicContact CE1-CB 4.07Å; Y485-P487 HydrophobicContact CE1-CG 3.87Å; Y485-P487 WeakPolarHBondContact O-CD 3.47Å
488S83Confident80.9Confident79 Ų79123.8 Ų123.855%0.55267%0.674SS**  trans-110.7136.5178.246.90000110.8V486 K490V486-S488 PolarHBondContact O-N 3.38Å; S488-K490 PolarHBondContact O-N 3.02Å
489Q85.1Confident79.2Confident188 Ų188124 Ų12488%0.87968%0.68SS**  trans-70101.5172.6-70.5-170.9-3.900109.3T491Q489-T491 VanDerWaalsContact C-N 3.31Å; Q489-T491 PolarHBondContact O-N 3.17Å
490K83.4Confident77.5Confident137 Ų137126 Ų12660%0.59669%0.686SS**  trans-73.183.1179.1-58.1-173.177.8-1770110.4S488 Y492S488-K490 PolarHBondContact O-N 3.02Å; K490-Y492 HydrophobicContact CB-CD2 4.26Å; K490-Y492 HydrophobicContact CB-CE2 3.63Å; K490-Y492 WeakPolarHBondContact CD-OH 3.31Å; K490-Y492 WeakPolarHBondContact CE-OH 3.42Å; K490-Y492 PolarHBondContact NZ-OH 3.22Å; K490-Y492 WeakPolarHBondContact O-CD2 3.31Å; K490-Y492 WeakPolarHBondContact O-CE2 3.34Å; K490-Y492 PolarHBondContact O-N 2.8Å
491T82.6Confident75.7Confident107 Ų107125.5 Ų125.566%0.65669%0.685SS**  trans-72.290.5171.2-59.70000109.7Q489Q489-T491 VanDerWaalsContact C-N 3.31Å; Q489-T491 PolarHBondContact O-N 3.17Å
492Y79.1Confident73.8Confident112 Ų112129.4 Ų129.444%0.43969%0.691SS.*  trans-71.8136.9173.4-60.9-82.9000110.3K490 S494 K495K490-Y492 HydrophobicContact CB-CD2 4.26Å; K490-Y492 HydrophobicContact CB-CE2 3.63Å; K490-Y492 WeakPolarHBondContact CD-OH 3.31Å; K490-Y492 WeakPolarHBondContact CE-OH 3.42Å; K490-Y492 PolarHBondContact NZ-OH 3.22Å; K490-Y492 WeakPolarHBondContact O-CD2 3.31Å; K490-Y492 WeakPolarHBondContact O-CE2 3.34Å; K490-Y492 PolarHBondContact O-N 2.8Å; Y492-S494 PolarHBondContact O-N 3.33Å; Y492-K495 HydrophobicContact CD2-CG 4.42Å; Y492-K495 WeakPolarHBondContact O-CB 3.47Å; Y492-K495 PolarHBondContact O-N 3.17Å
493P73.3Confident71.6Confident117 Ų117126.3 Ų126.376%0.7668%0.681SS**THydrogen-bonded Turntrans-58.8-16.4175.2-26.535.2000114.8I496P493-I496 VanDerWaalsContact O-CG1 3.22Å; P493-I496 WeakPolarHBondContact O-CG1 3.27Å
494S72.2Confident69.7Low105 Ų105125 Ų12573%0.73468%0.684SS**THydrogen-bonded Turntrans-84.6-9.1173.453.20000114.3Y492Y492-S494 PolarHBondContact O-N 3.33Å
495K60.8Low67.8Low165 Ų165122.7 Ų122.772%0.71768%0.68SS**THydrogen-bonded Turntrans-105.2-11.3-178.6-70.3-67.2-168.3175.30113.9Y492 S497Y492-K495 HydrophobicContact CD2-CG 4.42Å; Y492-K495 WeakPolarHBondContact O-CB 3.47Å; Y492-K495 PolarHBondContact O-N 3.17Å; K495-S497 PolarHBondContact O-N 3.35Å
496I64.3Low65.8Low94 Ų94123.1 Ų123.148%0.48269%0.685SS.*SBendtrans-60.2113.7163.949.8157.2000108.3P493 K498P493-I496 VanDerWaalsContact O-CG1 3.22Å; P493-I496 WeakPolarHBondContact O-CG1 3.27Å; I496-K498 PolarHBondContact O-N 3.38Å
497S55Low64.2Low63 Ų63127.3 Ų127.344%0.44169%0.694SS.*  trans-60.3135.4175.744.40000108.3K495 T499 E500K495-S497 PolarHBondContact O-N 3.35Å; S497-T499 WeakPolarHBondContact CB-OG1 3.35Å; S497-T499 PolarHBondContact O-N 3.18Å; S497-T499 PolarHBondContact OG-OG1 2.85Å; S497-T499 VanDerWaalsContact OG-OG1 3.14Å; S497-E500 PolarHBondContact O-N 3.44Å
498K57.1Low62.5Low206 Ų206130.8 Ų130.890%0.89670%0.702SS**THydrogen-bonded Turntrans-63.64.3-176.7-139.5170.8-175.61770113.7I496I496-K498 PolarHBondContact O-N 3.38Å
499T53.3Low61.3Low108 Ų108138.2 Ų138.266%0.66372%0.717SS**THydrogen-bonded Turntrans-88.9-29.1-179.949.70000113.3S497S497-T499 WeakPolarHBondContact CB-OG1 3.35Å; S497-T499 PolarHBondContact O-N 3.18Å; S497-T499 PolarHBondContact OG-OG1 2.85Å; S497-T499 VanDerWaalsContact OG-OG1 3.14Å
500E52.4Low60.6Low148 Ų148131.9 Ų131.969%0.69270%0.703SS**G310 helixtrans-84.1-21.7-178.1-69.4-165.5145.800113.9S497 K502 G503S497-E500 PolarHBondContact O-N 3.44Å; E500-K502 PolarHBondContact O-N 2.94Å; E500-G503 PolarHBondContact O-N 3.2Å; E500-G503 VanDerWaalsContact O-N 3.15Å
501S52.5Low60.1Low99 Ų99129.8 Ų129.869%0.69271%0.711SS**G310 helixtrans-7017.7171.7-59.90000114.5
502K50.5Low59.6Low198 Ų198129.9 Ų129.986%0.86171%0.714SS**G310 helixtrans-107.711.2168.6-130.8-179.8-177.1-174.80113.3E500E500-K502 PolarHBondContact O-N 2.94Å
503G43.9Very low59.5Low57 Ų57130.6 Ų130.659%0.58873%0.732SS**SBendtrans-69.7139.3156.600000111.1E500 G505E500-G503 PolarHBondContact O-N 3.2Å; E500-G503 VanDerWaalsContact O-N 3.15Å; G503-G505 PolarHBondContact O-N 3.06Å
504S51.8Low59.7Low128 Ų128132.8 Ų132.890%0.89574%0.736SS**  trans-72.366.7178.9-173.40000112.2
505G51.3Low60.1Low62 Ų62132.7 Ų132.764%0.63973%0.733SS**  trans-94.2100.6168.200000109.7G503 K507G503-G505 PolarHBondContact O-N 3.06Å; G505-K507 PolarHBondContact O-N 3.06Å
506K49.9Very low60.9Low192 Ų192130.7 Ų130.784%0.83574%0.737SS**  trans-54.4130.9165-70.1177.9-179.9176.30107.5E508K506-E508 PolarHBondContact O-N 3.06Å
507K56.3Low61.4Low202 Ų202133.5 Ų133.588%0.87875%0.752SS**  trans-75.567.8177.2-61.7175.6-172.61720109.4G505 R509G505-K507 PolarHBondContact O-N 3.06Å; K507-R509 PolarHBondContact O-N 2.9Å
508E55.4Low62.3Low180 Ų180136.3 Ų136.384%0.84177%0.768SS**  trans-70.979.8169.2-169.7168.5-17100108.2K506 G510K506-E508 PolarHBondContact O-N 3.06Å; E508-G510 VanDerWaalsContact C-N 3.29Å; E508-G510 PolarHBondContact O-N 3.24Å; E508-G510 VanDerWaalsContact O-N 3.11Å
509R58Low62.8Low234 Ų234141.7 Ų141.788%0.88378%0.783SS**  trans-67.6100.8153.5-67.9-173.3-178.1-163.60.3105K507K507-R509 PolarHBondContact O-N 2.9Å
510G69.5Low63.2Low56 Ų56143.4 Ų143.458%0.57779%0.789SS**PPolyproline II helixtrans-50.2147.8168.600000110E508E508-G510 VanDerWaalsContact C-N 3.29Å; E508-G510 PolarHBondContact O-N 3.24Å; E508-G510 VanDerWaalsContact O-N 3.11Å
511A72.3Confident63.8Low92 Ų92143.2 Ų143.276%0.7679%0.794SS**PPolyproline II helixtrans-55.2144.4179.200000110.5
512P72.6Confident64.4Low110 Ų110145.6 Ų145.671%0.71480%0.8SS**PPolyproline II helixtrans-58.7147.9174.927-34.6000110.2L514P512-L514 PolarHBondContact O-N 3.22Å
513P76.8Confident65.3Low127 Ų127142.5 Ų142.583%0.82580%0.796SS**PPolyproline II helixtrans-58.9140.9178.625.8-34.4000110.5
514L77.2Confident66.6Low163 Ų163147.9 Ų147.985%0.85381%0.809SS**PPolyproline II helixtrans-63.4146.3177.3-70.1172.7000110.6P512P512-L514 PolarHBondContact O-N 3.22Å
515P80.8Confident67.6Low103 Ų103149.2 Ų149.267%0.66980%0.804SS**PPolyproline II helixtrans-62.7151.2174.628.2-35000110.8I517P515-I517 PolarHBondContact O-N 3.24Å
516P77.5Confident68.8Low123 Ų123155.4 Ų155.480%0.79982%0.815SS**PPolyproline II helixtrans-61.7134.2177.126.3-34000110.7
517I75Confident70.2Confident153 Ų153152.6 Ų152.679%0.78581%0.814SS**PPolyproline II helixtrans-71.8128.6176.4-54175.2000108P515P515-I517 PolarHBondContact O-N 3.24Å
518P73.5Confident71.4Confident122 Ų122148.5 Ų148.579%0.79281%0.809SS**PPolyproline II helixtrans-57.4139.3171.6-23.734.5000111.3
519R67.8Low72.8Confident319 Ų319145.6 Ų145.6100%1.20481%0.806SS**  trans-96.30169.4-73-176.2175.9155.5-2110.1

Retrieved 519 of 519 residues in 47 ms (Link to these results)