A0A093H131_STRCA Loading...

Zinc finger protein 750

AlphaFold DB , UniProt , Accession A0A093H131, Species STRCA (Struthio camelus australis), Gene n/a, Length 715 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
1M39.8Very low56.8Low240 Ų240176.4 Ų176.4100%1.18285%0.846SS**  01350-58.617782.900108.5
2S42.4Very low58Low103 Ų103172.1 Ų172.172%0.7284%0.844SS**  trans-100.7116.5-176.9-173.50000111.6L4S2-L4 PolarHBondContact O-N 3.42Å; S2-L4 VanDerWaalsContact O-N 3.09Å
3L50.3Low58.7Low170 Ų170171.7 Ų171.789%0.8984%0.838SS**  trans-85.859.8177-67.1178.1000111.5K5L3-K5 PolarHBondContact O-N 3.03Å
4L54.6Low59.5Low154 Ų154173 Ų17381%0.80683%0.831SS**  trans-64.8102.7168-82.2170.5000109.2S2 E6S2-L4 PolarHBondContact O-N 3.42Å; S2-L4 VanDerWaalsContact O-N 3.09Å; L4-E6 VanDerWaalsContact C-N 3.32Å; L4-E6 PolarHBondContact O-N 3.17Å
5K57.4Low60Low184 Ų184170.2 Ų170.280%0.882%0.821SS**  trans-73.483-172.9-169.9169.4-174.5168.50111.3L3 R7L3-K5 PolarHBondContact O-N 3.03Å; K5-R7 PolarHBondContact O-N 2.98Å
6E55Low60.2Low163 Ų163165.6 Ų165.676%0.76281%0.808SS**  trans-49.6106.3178.3-169.1-169-169.100111.2L4 K8L4-E6 VanDerWaalsContact C-N 3.32Å; L4-E6 PolarHBondContact O-N 3.17Å; E6-K8 PolarHBondContact O-N 3.28Å
7R63.8Low61.2Low225 Ų225166.6 Ų166.685%0.84980%0.802SS**  trans-84.1101.7173.2-76.7-173.716994.9-9.2108K5K5-R7 PolarHBondContact O-N 2.98Å
8K62.6Low61.3Low180 Ų180164 Ų16478%0.78380%0.8SS**PPolyproline II helixtrans-47.4135.7-179.1-63.5-157.8174-1590111.7E6 K10E6-K8 PolarHBondContact O-N 3.28Å; K8-K10 PolarHBondContact O-N 3Å
9P66.2Low61.3Low118 Ų118162.4 Ų162.477%0.76680%0.804SS**PPolyproline II helixtrans-59137.2178.324.3-33.5000110.4K11P9-K11 PolarHBondContact O-N 2.86Å
10K66.8Low61.1Low209 Ų209158.3 Ų158.391%0.90981%0.805SS**PPolyproline II helixtrans-61.4129.9173.6-113.8178.4177.2179.50108.3K8K8-K10 PolarHBondContact O-N 3Å
11K65.7Low61Low194 Ų194159.2 Ų159.284%0.84380%0.803SS**PPolyproline II helixtrans-54.1137.6172.7-70.1-173.1175.7-173.10109.4P9 H13P9-K11 PolarHBondContact O-N 2.86Å; K11-H13 PolarHBondContact O-N 3.09Å
12P70.8Confident61.9Low125 Ų125153.7 Ų153.781%0.81279%0.785SS**PPolyproline II helixtrans-60133.5175.825.5-33.6000109.5Y14P12-Y14 PolarHBondContact O-N 2.85Å; P12-Y14 VanDerWaalsContact O-N 3.15Å
13H68Low62.3Low167 Ų167154.5 Ų154.577%0.77378%0.776SS**  trans-73.5107.2178.6-171.1-65.5000108.9K11 I15K11-H13 PolarHBondContact O-N 3.09Å; H13-I15 PolarHBondContact O-N 3.31Å
14Y69Low62.1Low190 Ų190156.7 Ų156.775%0.74578%0.779SS**  trans-64.2119.8175-175.3-96000109.5P12 P16P12-Y14 PolarHBondContact O-N 2.85Å; P12-Y14 VanDerWaalsContact O-N 3.15Å; Y14-P16 HydrophobicContact CD1-CG 4.22Å; Y14-P16 HydrophobicContact CE1-CB 4.29Å; Y14-P16 HydrophobicContact CE1-CG 4.2Å
15I67.3Low61.6Low131 Ų131155.6 Ų155.667%0.67276%0.764SS**  trans-97.9113.3171.5-59.9175.4000106.4H13 R17H13-I15 PolarHBondContact O-N 3.31Å; I15-R17 PolarHBondContact O-N 3.27Å
16P63.3Low61Low96 Ų96154 Ų15462%0.62376%0.758SS**PPolyproline II helixtrans-58.7128.8173.8-22.133.7000110.1Y14Y14-P16 HydrophobicContact CD1-CG 4.22Å; Y14-P16 HydrophobicContact CE1-CB 4.29Å; Y14-P16 HydrophobicContact CE1-CG 4.2Å
17R76.6Confident60.2Low183 Ų183151.6 Ų151.669%0.69176%0.758SS**PPolyproline II helixtrans-80.2138.6177.2-67.8-171.9176.8-155.4-0.5110I15I15-R17 PolarHBondContact O-N 3.27Å
18P63.5Low59.3Low120 Ų120147.8 Ų147.878%0.77975%0.747SS**PPolyproline II helixtrans-59.7135.7172.6-23.333.8000111.4
19P61.8Low58.4Low133 Ų133148 Ų14886%0.86475%0.751SS**SBendtrans-70.2158.9173.230.3-34.7000111.4
20G57.3Low57.6Low80 Ų80146.9 Ų146.983%0.82575%0.745SS**  trans101.67.3164.100000118
21K57.7Low56.7Low178 Ų178141.8 Ų141.877%0.77473%0.733SS**  trans-115.6108.5173.6-139.1168.2-168.8172.60112F23K21-F23 WeakPolarHBondContact O-CD2 3.29Å; K21-F23 PolarHBondContact O-N 3.21Å
22P59Low55.6Low124 Ų124139.9 Ų139.981%0.80573%0.725SS**  trans-70.4114.8174.828.1-32.4000109.6
23F51.2Low54.4Low121 Ų121139.5 Ų139.553%0.53172%0.721SS.*  trans-74.2130.1176.2-74.7-96.9000110.1K21 Y25K21-F23 WeakPolarHBondContact O-CD2 3.29Å; K21-F23 PolarHBondContact O-N 3.21Å; F23-Y25 HydrophobicContact CB-CD1 3.7Å; F23-Y25 HydrophobicContact CB-CD2 4.17Å; F23-Y25 HydrophobicContact CB-CE1 3.35Å; F23-Y25 HydrophobicContact CB-CE2 3.87Å; F23-Y25 HydrophobicContact CB-CG 4.11Å; F23-Y25 VanDerWaalsContact CB-CZ 3.46Å; F23-Y25 HydrophobicContact CD1-CE1 4.24Å; F23-Y25 AromaticContact CG-CE1 3.82Å; F23-Y25 HydrophobicContact CG-CE1 3.82Å; F23-Y25 AromaticContact CG-CZ 3.9Å; F23-Y25 PolarHBondContact O-N 3.47Å
24K45.5Very low53.5Low216 Ų216134.1 Ų134.194%0.93970%0.702SS**  trans-72.481167-78.3-171.1174.2-1760109.7K26K24-K26 PolarHBondContact O-N 2.9Å
25Y45.6Very low52.4Low130 Ų130132.5 Ų132.551%0.5171%0.706SS.*  trans-7587.4177.5-64.6-47.9000111.8F23 F28F23-Y25 HydrophobicContact CB-CD1 3.7Å; F23-Y25 HydrophobicContact CB-CD2 4.17Å; F23-Y25 HydrophobicContact CB-CE1 3.35Å; F23-Y25 HydrophobicContact CB-CE2 3.87Å; F23-Y25 HydrophobicContact CB-CG 4.11Å; F23-Y25 VanDerWaalsContact CB-CZ 3.46Å; F23-Y25 HydrophobicContact CD1-CE1 4.24Å; F23-Y25 AromaticContact CG-CE1 3.82Å; F23-Y25 HydrophobicContact CG-CE1 3.82Å; F23-Y25 AromaticContact CG-CZ 3.9Å; F23-Y25 PolarHBondContact O-N 3.47Å; Y25-F28 AromaticContact CD1-CD2 3.71Å; Y25-F28 HydrophobicContact CD1-CD2 3.71Å; Y25-F28 AromaticContact CD1-CE2 3.19Å; Y25-F28 HydrophobicContact CD1-CE2 3.19Å; Y25-F28 AromaticContact CD1-CZ 3.79Å; Y25-F28 HydrophobicContact CD1-CZ 3.79Å; Y25-F28 HydrophobicContact CD2-CD2 4.42Å; Y25-F28 HydrophobicContact CD2-CE2 4.3Å; Y25-F28 HydrophobicContact CD2-CZ 4.43Å; Y25-F28 HydrophobicContact CE1-CD2 4.36Å; Y25-F28 AromaticContact CE1-CE2 3.45Å; Y25-F28 HydrophobicContact CE1-CE2 3.45Å; Y25-F28 VanDerWaalsContact CE1-CE2 3.45Å; Y25-F28 AromaticContact CE1-CZ 3.57Å; Y25-F28 HydrophobicContact CE1-CZ 3.57Å; Y25-F28 HydrophobicContact CE2-CZ 4.25Å; Y25-F28 AromaticContact CG-CD2 3.73Å; Y25-F28 HydrophobicContact CG-CD2 3.73Å; Y25-F28 AromaticContact CG-CE2 3.66Å; Y25-F28 HydrophobicContact CG-CE2 3.66Å; Y25-F28 HydrophobicContact CG-CG 4.35Å; Y25-F28 HydrophobicContact CG-CZ 4.21Å; Y25-F28 AromaticContact CZ-CZ 3.81Å
26K44.4Very low51.7Low152 Ų152133 Ų13366%0.66171%0.705SS**SBendtrans-73.3135.8152.4-81.6-171.8173.2-176.10107.8K24K24-K26 PolarHBondContact O-N 2.9Å
27C39.1Very low51.4Low112 Ų112137.8 Ų137.876%0.75772%0.716SS**  trans55.588.6-176.9-70.90000116.3
28F44.6Very low50.5Low144 Ų144132.2 Ų132.263%0.63271%0.705SS**  trans-114.624.8166.1-112-114.9000113.4Y25Y25-F28 AromaticContact CD1-CD2 3.71Å; Y25-F28 HydrophobicContact CD1-CD2 3.71Å; Y25-F28 AromaticContact CD1-CE2 3.19Å; Y25-F28 HydrophobicContact CD1-CE2 3.19Å; Y25-F28 AromaticContact CD1-CZ 3.79Å; Y25-F28 HydrophobicContact CD1-CZ 3.79Å; Y25-F28 HydrophobicContact CD2-CD2 4.42Å; Y25-F28 HydrophobicContact CD2-CE2 4.3Å; Y25-F28 HydrophobicContact CD2-CZ 4.43Å; Y25-F28 HydrophobicContact CE1-CD2 4.36Å; Y25-F28 AromaticContact CE1-CE2 3.45Å; Y25-F28 HydrophobicContact CE1-CE2 3.45Å; Y25-F28 VanDerWaalsContact CE1-CE2 3.45Å; Y25-F28 AromaticContact CE1-CZ 3.57Å; Y25-F28 HydrophobicContact CE1-CZ 3.57Å; Y25-F28 HydrophobicContact CE2-CZ 4.25Å; Y25-F28 AromaticContact CG-CD2 3.73Å; Y25-F28 HydrophobicContact CG-CD2 3.73Å; Y25-F28 AromaticContact CG-CE2 3.66Å; Y25-F28 HydrophobicContact CG-CE2 3.66Å; Y25-F28 HydrophobicContact CG-CG 4.35Å; Y25-F28 HydrophobicContact CG-CZ 4.21Å; Y25-F28 AromaticContact CZ-CZ 3.81Å
29Q43.9Very low50.4Low186 Ų186130.6 Ų130.687%0.86969%0.687SS**  trans-110.130.5-178.6-148.480.632.800113.6
30C48.2Very low50.8Low93 Ų93129 Ų12963%0.62867%0.671SS**  trans-128.277.6162.4-167.40000108.6F32C30-F32 PolarHBondContact O-N 3.41Å
31P47.4Very low50.9Low103 Ų103131.4 Ų131.467%0.66966%0.659SS**  trans-76.3-4.3-16829.7-35.2000114.6
32F42.4Very low51.1Low153 Ų153126.5 Ų126.567%0.67164%0.641SS**SBendtrans-123.1103.6179.7-69-74.1000112.2C30 C34C30-F32 PolarHBondContact O-N 3.41Å; F32-C34 PolarHBondContact O-N 2.92Å
33T46.6Very low51.6Low117 Ų117123.7 Ų123.772%0.71862%0.617SS**  trans14.581143.152.30000116.7N35T33-N35 PolarHBondContact O-N 3.3Å
34C48.7Very low52.4Low55 Ų55123.9 Ų123.937%0.37262%0.621SS.*THydrogen-bonded Turntrans-74.950.3170.4-156.40000111.8F32 L40F32-C34 PolarHBondContact O-N 2.92Å; C34-L40 VanDerWaalsContact SG-CA 3.58Å; C34-L40 PolarHBondContact SG-N 3.37Å; C34-L40 VanDerWaalsContact SG-N 3.43Å
35N45.9Very low53.5Low155 Ų155119.7 Ų119.783%0.82960%0.603SS**THydrogen-bonded Turntrans-107.5-5.3-179.5-167.154.1000112.1T33T33-N35 PolarHBondContact O-N 3.3Å
36E52.1Low54.4Low142 Ų142120.4 Ų120.466%0.66461%0.606SS**SBendtrans-87.8123.9163.3-65.4-167.7161.500109.4S38 H39E36-S38 PolarHBondContact O-N 3.3Å; E36-H39 PolarHBondContact O-N 2.93Å
37K58.9Low55Low197 Ų197114.6 Ų114.686%0.85759%0.589SS**Hα-helixtrans-58-24.8-171.9-166.6177.8179.7-175.40113.5F41K37-F41 WeakPolarHBondContact O-CB 3.32Å; K37-F41 PolarHBondContact O-N 3.22Å
38S57.3Low56.1Low65 Ų65115 Ų11546%0.45558%0.583SS.*Hα-helixtrans-65.3-43.7173.946.70000113.4E36 F41 N42E36-S38 PolarHBondContact O-N 3.3Å; S38-F41 PolarHBondContact O-N 2.89Å; S38-N42 WeakPolarHBondContact O-CB 3.4Å; S38-N42 PolarHBondContact O-N 2.85Å
39H60.2Low56.7Low87 Ų87109.9 Ų109.940%0.40356%0.564SS.*Hα-helixtrans-71.7-39.4-173.8-165.4-45.6000111.6E36 H43E36-H39 PolarHBondContact O-N 2.93Å; H39-H43 WeakPolarHBondContact O-CB 3.3Å; H39-H43 PolarHBondContact O-N 3.33Å
40L71.8Confident57.2Low99 Ų99108.9 Ų108.952%0.51856%0.557SS.*Hα-helixtrans-65.6-43.6175.2-174.260.7000110.8C34 H43 M44C34-L40 VanDerWaalsContact SG-CA 3.58Å; C34-L40 PolarHBondContact SG-N 3.37Å; C34-L40 VanDerWaalsContact SG-N 3.43Å; L40-H43 PolarHBondContact O-N 3.23Å; L40-M44 WeakPolarHBondContact O-CB 3.39Å; L40-M44 PolarHBondContact O-N 3.35Å
41F58.1Low57.2Low130 Ų130111 Ų11157%0.5756%0.562SS**Hα-helixtrans-61.2-47.8177.7-173.3-107000111.9K37 S38 M44 K45K37-F41 WeakPolarHBondContact O-CB 3.32Å; K37-F41 PolarHBondContact O-N 3.22Å; S38-F41 PolarHBondContact O-N 2.89Å; F41-M44 PolarHBondContact O-N 2.91Å; F41-K45 HydrophobicContact CE1-CD 4.05Å; F41-K45 WeakPolarHBondContact O-CB 3.36Å; F41-K45 PolarHBondContact O-N 3.46Å
42N61.6Low57.5Low76 Ų76109 Ų10941%0.40655%0.55SS.*Hα-helixtrans-65.2-45.3177.4-77.9-20.3000112.4S38 M44 K45 Y46S38-N42 WeakPolarHBondContact O-CB 3.4Å; S38-N42 PolarHBondContact O-N 2.85Å; N42-M44 VanDerWaalsContact C-N 3.26Å; N42-M44 PolarHBondContact O-N 2.82Å; N42-K45 PolarHBondContact O-N 2.83Å; N42-Y46 HydrophobicContact CB-CD2 4.27Å; N42-Y46 HydrophobicContact CB-CE2 4.32Å; N42-Y46 WeakPolarHBondContact O-CD2 3.44Å; N42-Y46 PolarHBondContact O-N 2.78Å
43H71.1Confident58Low64 Ų64107.4 Ų107.430%0.29655%0.548SS..Hα-helixtrans-61.9-34.8-179.5-173.374.5000112.4H39 L40 L48H39-H43 WeakPolarHBondContact O-CB 3.3Å; H39-H43 PolarHBondContact O-N 3.33Å; L40-H43 PolarHBondContact O-N 3.23Å; H43-L48 WeakPolarHBondContact ND1-CB 3.37Å; H43-L48 PolarHBondContact O-N 3.38Å; H43-L48 VanDerWaalsContact O-N 3.09Å
44M67.8Low58.3Low126 Ų126105.6 Ų105.662%0.62154%0.537SS*.Hα-helixtrans-79.1-42175-15716876.500112.4L40 F41 N42 Y46 G47L40-M44 WeakPolarHBondContact O-CB 3.39Å; L40-M44 PolarHBondContact O-N 3.35Å; F41-M44 PolarHBondContact O-N 2.91Å; N42-M44 VanDerWaalsContact C-N 3.26Å; N42-M44 PolarHBondContact O-N 2.82Å; M44-Y46 VanDerWaalsContact C-N 3.34Å; M44-Y46 PolarHBondContact O-N 2.71Å; M44-G47 PolarHBondContact O-N 2.85Å
45K67.1Low58.3Low128 Ų128107.7 Ų107.756%0.55754%0.544SS*.Hα-helixtrans-60-38.8177.5-179.9-174.3178.5-167.10113F41 N42 G47F41-K45 HydrophobicContact CE1-CD 4.05Å; F41-K45 WeakPolarHBondContact O-CB 3.36Å; F41-K45 PolarHBondContact O-N 3.46Å; N42-K45 PolarHBondContact O-N 2.83Å; K45-G47 VanDerWaalsContact C-N 3.32Å
46Y66.1Low58.3Low145 Ų145105 Ų10557%0.56953%0.533SS*.THydrogen-bonded Turntrans-91.811.1177.1-62.2-67.8000113.2N42 M44 L48N42-Y46 HydrophobicContact CB-CD2 4.27Å; N42-Y46 HydrophobicContact CB-CE2 4.32Å; N42-Y46 WeakPolarHBondContact O-CD2 3.44Å; N42-Y46 PolarHBondContact O-N 2.78Å; M44-Y46 VanDerWaalsContact C-N 3.34Å; M44-Y46 PolarHBondContact O-N 2.71Å; Y46-L48 PolarHBondContact O-N 2.66Å; Y46-L48 VanDerWaalsContact O-N 3.1Å
47G56.3Low58.3Low30 Ų30102.2 Ų102.231%0.30953%0.529SS..THydrogen-bonded Turntrans66.611.6171.400000115.9M44 K45 C49 K50M44-G47 PolarHBondContact O-N 2.85Å; K45-G47 VanDerWaalsContact C-N 3.32Å; G47-C49 PolarHBondContact O-N 2.86Å; G47-C49 VanDerWaalsContact O-N 3.14Å; G47-K50 WeakPolarHBondContact O-CG 3.42Å; G47-K50 PolarHBondContact O-N 3.22Å; G47-K50 VanDerWaalsContact O-N 3.17Å
48L61.6Low58Low121 Ų12199.6 Ų99.663%0.63452%0.519SS*.THydrogen-bonded Turntrans-69.5-12.8-171.1-61.8177.3000113.4H43 Y46H43-L48 WeakPolarHBondContact ND1-CB 3.37Å; H43-L48 PolarHBondContact O-N 3.38Å; H43-L48 VanDerWaalsContact O-N 3.09Å; Y46-L48 PolarHBondContact O-N 2.66Å; Y46-L48 VanDerWaalsContact O-N 3.1Å
49C58.6Low57.6Low35 Ų35100.9 Ų100.924%0.23652%0.518CS..THydrogen-bonded Turntrans-84.93.3174.565.60000114.8G47 N51 S52G47-C49 PolarHBondContact O-N 2.86Å; G47-C49 VanDerWaalsContact O-N 3.14Å; C49-N51 PolarHBondContact O-N 2.85Å; C49-S52 PolarHBondContact O-N 2.96Å; C49-S52 PolarHBondContact O-OG 3.44Å; C49-S52 VanDerWaalsContact O-OG 3.07Å
50K53.3Low56.9Low166 Ų166103.8 Ų103.872%0.72254%0.537SS*.THydrogen-bonded Turntrans-50.3-31.7-173-100.2-176.6174.3-177.50114.8G47G47-K50 WeakPolarHBondContact O-CG 3.42Å; G47-K50 PolarHBondContact O-N 3.22Å; G47-K50 VanDerWaalsContact O-N 3.17Å
51N48.9Very low55.8Low137 Ų137110.1 Ų110.173%0.73355%0.554SS**THydrogen-bonded Turntrans-97.1-4.3-174.8-61.3-6.6000114.3C49C49-N51 PolarHBondContact O-N 2.85Å
52S52.9Low55.4Low60 Ų60110 Ų11042%0.4256%0.558SS.*THydrogen-bonded Turntrans-104.5-17.5-174.560.40000114.8C49C49-S52 PolarHBondContact O-N 2.96Å; C49-S52 PolarHBondContact O-OG 3.44Å; C49-S52 VanDerWaalsContact O-OG 3.07Å
53I53.6Low54.5Low120 Ų120113.1 Ų113.162%0.61557%0.573SS**SBendtrans-84.2-40.1-179.1-170.7166.7000112.8L55 V56 S57I53-L55 VanDerWaalsContact C-N 3.34Å; I53-L55 PolarHBondContact O-N 3.38Å; I53-V56 PolarHBondContact O-N 3.33Å; I53-V56 VanDerWaalsContact O-N 3.13Å; I53-S57 PolarHBondContact O-N 3.32Å; I53-S57 PolarHBondContact O-OG 3.32Å
54T51.5Low52.9Low79 Ų79120 Ų12049%0.48560%0.602SS.*Hα-helixtrans-61.1-39.6-179.446.40000112.8V56 S57 E58T54-V56 PolarHBondContact O-N 3.13Å; T54-S57 WeakPolarHBondContact CA-OG 3.37Å; T54-S57 PolarHBondContact O-N 3.05Å; T54-S57 PolarHBondContact O-OG 3.3Å; T54-E58 PolarHBondContact O-N 2.6Å
55L49.2Very low51.3Low100 Ų100119.6 Ų119.652%0.52461%0.61SS.*Hα-helixtrans-70.9-7.6178.3-72.3172.9000114.6I53I53-L55 VanDerWaalsContact C-N 3.34Å; I53-L55 PolarHBondContact O-N 3.38Å
56V46.3Very low50.1Low99 Ų99119.4 Ų119.460%0.662%0.622SS**Hα-helixtrans-95.7-44.4170.2-178.50000110.3I53 T54 E58 Q59 D60I53-V56 PolarHBondContact O-N 3.33Å; I53-V56 VanDerWaalsContact O-N 3.13Å; T54-V56 PolarHBondContact O-N 3.13Å; V56-E58 VanDerWaalsContact C-N 3.29Å; V56-E58 PolarHBondContact O-N 3.18Å; V56-Q59 PolarHBondContact O-N 3.02Å; V56-D60 PolarHBondContact O-N 3.16Å
57S52.5Low48.4Very low82 Ų82122 Ų12257%0.57364%0.637SS**Hα-helixtrans-62.1-30.4-179.547.20000114.5I53 T54I53-S57 PolarHBondContact O-N 3.32Å; I53-S57 PolarHBondContact O-OG 3.32Å; T54-S57 WeakPolarHBondContact CA-OG 3.37Å; T54-S57 PolarHBondContact O-N 3.05Å; T54-S57 PolarHBondContact O-OG 3.3Å
58E51.8Low47.2Very low142 Ų142126.9 Ų126.966%0.66466%0.66SS**THydrogen-bonded Turntrans-81-37.3177.8-171.2178-162.800112.4T54 V56 D60T54-E58 PolarHBondContact O-N 2.6Å; V56-E58 VanDerWaalsContact C-N 3.29Å; V56-E58 PolarHBondContact O-N 3.18Å; E58-D60 VanDerWaalsContact C-N 3.35Å; E58-D60 PolarHBondContact O-N 3.08Å
59Q48.9Very low45.7Very low93 Ų93128.8 Ų128.844%0.43567%0.671SS.*G310 helixtrans-74.7-25.2-173.2-152.581.898.600112.9V56 R61 I62V56-Q59 PolarHBondContact O-N 3.02Å; Q59-R61 PolarHBondContact O-N 3.13Å; Q59-I62 PolarHBondContact O-N 3.02Å
60D45.9Very low44.3Very low148 Ų148132 Ų13279%0.79169%0.694SS**G310 helixtrans-75.92.2-177.6-147.430.2000114.2V56 E58V56-D60 PolarHBondContact O-N 3.16Å; E58-D60 VanDerWaalsContact C-N 3.35Å; E58-D60 PolarHBondContact O-N 3.08Å
61R49.5Very low43.4Very low231 Ų231131.6 Ų131.687%0.87270%0.699SS**G310 helixtrans-100.6-9.4170-70.8-167.3175.9-158.1-0.3114.7Q59Q59-R61 PolarHBondContact O-N 3.13Å
62I48.5Very low42.5Very low129 Ų129131.8 Ų131.866%0.66270%0.696SS**  trans-134.863.1-170.5-40.2-177.8000113.1Q59Q59-I62 PolarHBondContact O-N 3.02Å
63I42.1Very low41.8Very low140 Ų140134.8 Ų134.872%0.71871%0.714SS**  trans-13583.2158.5-50.3-178.5000111.5
64K38.7Very low40.6Very low210 Ų210137 Ų13791%0.91372%0.719SS**  trans-128.8145.9141.1-76-173.1178.7175.70107.9
65C33.3Very low39.8Very low116 Ų116141.2 Ų141.278%0.78473%0.733SS**  trans-93.2167.5-161.5-70.20000114.1
66P41.6Very low38.9Very low124 Ų124143.8 Ų143.881%0.80575%0.746SS**  trans-104.7-167-152.842.1-38.9000116
67K31.9Very low38.3Very low201 Ų201144.9 Ų144.987%0.87475%0.748SS**  trans84.4138.6-173.4-91.4175.7172.9176.50113.9
68T30.3Very low37.2Very low132 Ų132148.6 Ų148.681%0.8176%0.756SS**  cis-130.4178.919.647.60000115.5
69N31.2Very low36.4Very low160 Ų160148 Ų14886%0.85676%0.757SS**  trans-70.5163-178.1-48.1-32.1000115.1
70S27.5Very low35.4Very low104 Ų104151.8 Ų151.873%0.72778%0.775SS**  -177.9133.2112.6-147.90000116.5
71L34.5Very low34.7Very low156 Ų156149.1 Ų149.182%0.81777%0.768SS**  trans62.8124.9149.2-70.7165.7000125.9
72E30.4Very low33.7Very low142 Ų142144.1 Ų144.166%0.66476%0.763SS**  trans62153.5143.4-84-70.887.300121K74E72-K74 PolarHBondContact OE1-N 3.04Å; E72-K74 VanDerWaalsContact OE1-N 3.13Å; E72-K74 PolarHBondContact OE2-N 3.23Å
73P37.8Very low32.8Very low123 Ų123144.7 Ų144.780%0.79977%0.772SS**  cis-137.8137.935.737.8-16.6000121.3
74K29.5Very low32.2Very low166 Ų166147 Ų14772%0.72278%0.777SS**  58.394.3124.8-141.7171.4-171.2178.30124.8E72E72-K74 PolarHBondContact OE1-N 3.04Å; E72-K74 VanDerWaalsContact OE1-N 3.13Å; E72-K74 PolarHBondContact OE2-N 3.23Å
75Q34.2Very low32.8Very low168 Ų168142 Ų14279%0.78577%0.766SS**  trans34.2133.4133.1-63-175.4-15.100125.8
76I31.5Very low32.5Very low154 Ų154142 Ų14279%0.7976%0.763SS**  -171.7116.6124.9-104163.6000108.9
77N32.3Very low32Very low122 Ų122141.4 Ų141.465%0.65276%0.761SS**  62.1140.891.5-70.6-17.3000115.8
78Q30.5Very low32Very low160 Ų160135.9 Ų135.975%0.74875%0.748SS**  cis-171.9174.1-6.2-98.7-170.8133.600107.8
79L33.5Very low32.3Very low130 Ų130139 Ų13968%0.68175%0.751SS**  cis-177.1150.7-25.3178.862000110.3
80E28Very low32.1Very low172 Ų172136 Ų13680%0.80474%0.742SS**  trans64.8166.1161.8-95.1-174.112800120.7
81S31.3Very low32.2Very low92 Ų92138.1 Ų138.164%0.64374%0.744SS**  cis-158.8147.4-12.970.60000110.3
82T28.5Very low32Very low126 Ų126135.8 Ų135.877%0.77374%0.736SS**  97.1156.993.9-72.40000118.1
83V29.4Very low32.1Very low141 Ų141136.9 Ų136.986%0.85575%0.746SS**  trans90.3162.9175.9-155.80000118.1
84K30Very low31.6Very low188 Ų188134.5 Ų134.582%0.81774%0.744SS**  trans-156.7-168.7-150.5-150.1-174.7-177177.40111.1
85P51.3Low31.7Very low106 Ų106135 Ų13569%0.68875%0.754SS**  -107.2-166.1-104.241.3-24.5000115.8
86T27.6Very low31.5Very low115 Ų115132 Ų13271%0.70675%0.751SS**  153.4119.1122.4-62.60000117.3
87S30.2Very low31.3Very low111 Ų111131 Ų13178%0.77675%0.748SS**  trans63.4167.7152.580.70000121
88S32.9Very low31.4Very low86 Ų86132.2 Ų132.260%0.60175%0.753SS**  cis-173.3152.4-40.965.20000112.3
89K36.5Very low31.2Very low198 Ų198130.9 Ų130.986%0.86175%0.751SS**  trans69.1157.1160.3-66.8168.2-176.6176.20116.4
90S26.6Very low31.1Very low96 Ų96129.7 Ų129.767%0.67175%0.754SS**  cis-174.5154.1-12.749.40000114.7
91I30.3Very low31.3Very low149 Ų149130.5 Ų130.576%0.76475%0.754SS**  trans85.1116.8135.6-81.1166.8000123.7
92T30.3Very low31.7Very low106 Ų106130.7 Ų130.765%0.6575%0.753SS**  trans73.3126.5141.657.70000128.2
93N31.2Very low31.5Very low165 Ų165132.8 Ų132.888%0.88276%0.755SS**  71139.2127-56.6-3.4000124.4
94G28.5Very low31.3Very low73 Ų73135 Ų13575%0.75375%0.749SS**  trans175.5161167.500000115.3
95L31.7Very low32Very low177 Ų177130.4 Ų130.493%0.92774%0.738SS**  trans-155.7167.5-170.2-71.8178.1000110.1
96S29.2Very low30.9Very low105 Ų105134.2 Ų134.273%0.73474%0.744SS**  cis-168.9-163.9-14.251.70000106.8
97N28Very low31Very low134 Ų134132.4 Ų132.472%0.71774%0.741SS**  cis-166.3-172.64.7-163.76.4000109.5
98L33.5Very low31.3Very low147 Ų147135.2 Ų135.277%0.7774%0.739SS**  trans69.5164.7157.7-66.9176.9000118
99D27Very low31.5Very low132 Ų132138.3 Ų138.371%0.70674%0.744SS**  cis-168.9169.9-21.8175.949.7000113.2
100S30.9Very low31.5Very low104 Ų104136 Ų13673%0.72774%0.741SS**  trans80.1135.9153.6-88.90000123.2
101K32.6Very low32.1Very low189 Ų189135.3 Ų135.382%0.82274%0.741SS**  trans-165.2126-174.4175.3-103.5174-171.90116.3
102P38.5Very low32.8Very low96 Ų96136.3 Ų136.362%0.62374%0.74SS**  trans-103.4-159.3165.742-35.2000111
103Q25Very low33Very low170 Ų170138.1 Ų138.179%0.79474%0.741SS**  cis-156.2165.2-27.6-119.8166.8-78.900105.9
104Y25.7Very low33.2Very low189 Ų189137 Ų13774%0.74174%0.735SS**  cis82.7134.714-110.4-125.4000118.1
105P44.3Very low33.8Very low91 Ų91140.1 Ų140.159%0.59174%0.739SS**  cis-139.2170.310.141.3-22.3000119.6
106F28.1Very low34Very low186 Ų186139.4 Ų139.482%0.81673%0.731SS**  trans61.1154.4147.2-74.3-44.9000123.1
107A29.8Very low34.3Very low76 Ų76142 Ų14263%0.62874%0.736SS**  cis-165.2152.1-14.100000113.4
108K37.4Very low34.3Very low170 Ų170143.2 Ų143.274%0.73974%0.738SS**  trans41.9160.8137.4-74.1-172.7171.9-78.90122.9
109E35.4Very low34.1Very low151 Ų151143.2 Ų143.271%0.70674%0.738SS**  cis163158.9-15.7-178.4171.3-83.600107.9
110D37.8Very low34.3Very low149 Ų149145.2 Ų145.280%0.79774%0.743SS**  cis-159.1161-48177.251.9000108.5
111A37.9Very low34.1Very low82 Ų82144.1 Ų144.168%0.67874%0.74SS**  trans-160.3111175.300000117.8
112K45.8Very low34Very low170 Ų170140.7 Ų140.774%0.73974%0.736SS**  trans55.3118133.5-81178.5170-81.50120.5
113E35.7Very low33.5Very low144 Ų144142.4 Ų142.467%0.67374%0.74SS**  8698.881.4-170.1-178.817400112.4
114N35.5Very low33.7Very low141 Ų141140.3 Ų140.375%0.75474%0.738SS**  85.6137.580.4-166.617.2000113.6
115V40.4Very low33.9Very low139 Ų139135.5 Ų135.584%0.84273%0.733SS**  trans175.1127.7147.7145.80000108.4
116E36.4Very low33.4Very low162 Ų162138.3 Ų138.376%0.75774%0.741SS**  trans-104.4151.9170.7166.4169.4-163.800109
117L34.2Very low33.5Very low161 Ų161138 Ų13884%0.84374%0.742SS**  -179.7151.3128.1-96.4167.5000115.8
118Q28.7Very low33.3Very low159 Ų159137.5 Ų137.574%0.74374%0.744SS**  trans-75.9147.3172.5169.9-174.143.300111.9
119N28.6Very low33.1Very low147 Ų147138.8 Ų138.879%0.78675%0.753SS**  trans-171.1-178136.8-108.4-58.9000115.5
120Q31.5Very low32.9Very low173 Ų173140.3 Ų140.381%0.80876%0.757SS**  trans-106.5146.8-159.2-49.217734.400115.8
121A27.9Very low32.8Very low81 Ų81138.5 Ų138.567%0.66975%0.753SS**  trans65.7158.6135.300000123.2
122T29.4Very low32.4Very low118 Ų118138.1 Ų138.172%0.72475%0.75SS**  trans82.2151.4164.873.70000119.3
123N28.8Very low31.6Very low132 Ų132136.6 Ų136.671%0.70675%0.749SS**  trans71.7114.9161.5-56.6-27.1000116.6
124T29.1Very low31.2Very low125 Ų125136.7 Ų136.777%0.76775%0.749SS**  58130.773.466.60000113.4
125S29Very low31Very low89 Ų89137.7 Ų137.762%0.62275%0.747SS**  cis-175.9165.8-1.953.40000109.5
126I33.9Very low30.4Very low150 Ų150137.2 Ų137.277%0.76974%0.736SS**  trans68.3150.1164.8-60.1159.8000112.1
127Q31Very low30.2Very low180 Ų180136.7 Ų136.784%0.84174%0.737SS**  cis-130.3161.6-5.5-134.2143.8-23.300105.9
128G25.6Very low30Very low65 Ų65135 Ų13567%0.6773%0.734SS**  cis109.58116.900000111.6
129Q32.3Very low30.5Very low196 Ų196133.2 Ų133.292%0.91674%0.736SS**  trans-138.8144.9159.2-81.1-146.61.400111.8
130K32.4Very low30.4Very low184 Ų184129.9 Ų129.980%0.873%0.729SS**  trans-158.8124179.1176.7-173.9178.7-176.10108.3
131P34.7Very low30.2Very low110 Ų110126.9 Ų126.971%0.71473%0.727SS**  -109.4156.5124.5-15.234000110.1
132A28.7Very low30.2Very low74 Ų74127.4 Ų127.461%0.61273%0.726SS**  cis70.5133.632.700000112.7
133I30.9Very low30.1Very low139 Ų139127.8 Ų127.871%0.71373%0.728SS**  cis-160.8150-1.3-128.2170.1000109.9
134Q27Very low30.2Very low145 Ų145127.8 Ų127.868%0.67873%0.733SS**  trans48.8144.3155.2-63.9178.729.100123.8
135K31.6Very low30.3Very low163 Ų163130.3 Ų130.371%0.70974%0.736SS**  trans64.9157.9139.6-74.1174.6171.6-102.30118.8
136E26.3Very low30.5Very low129 Ų129131.5 Ų131.560%0.60375%0.745SS**  cis-155.6160.3-21.6-128.7171.998.700110.4
137L32.8Very low30.3Very low150 Ų150128 Ų12879%0.78574%0.737SS**  trans60.1140.2153.6-72.8162.2000122.9
138T29.6Very low30.6Very low126 Ų126125.2 Ų125.277%0.77373%0.727SS**  trans-85164.7174-12.10000112.4
139P39.6Very low30.6Very low121 Ų121125.2 Ų125.279%0.78672%0.717SS**  -141.2-171.6100.444.6-31.9000111.5
140A26.6Very low30.4Very low78 Ų78119.6 Ų119.665%0.64569%0.692SS**  cis-156.7176.110.300000111.8
141S26.3Very low30.2Very low110 Ų110117.9 Ų117.977%0.76969%0.687SS**  trans62.2142.3147.3540000121.4
142S29.1Very low30.5Very low92 Ų92115.5 Ų115.564%0.64367%0.671SS**  cis-177.1147.3-10.447.10000111.8
143T27.6Very low30.5Very low125 Ų125117.9 Ų117.977%0.76767%0.673SS**  trans56.3147.5148.353.50000119.9
144T30.4Very low30.8Very low132 Ų132117.9 Ų117.981%0.8167%0.674SS**  cis-155.2-167.75.5-1.90000110.8
145E30.7Very low31.1Very low179 Ų179117.4 Ų117.484%0.83668%0.676SS**  trans-99179-162.9-51.9170.210300117.5
146S33.1Very low31.1Very low114 Ų114113.8 Ų113.880%0.79767%0.671SS**  trans84143.9160.9-66.60000119.2
147A30.1Very low31.5Very low75 Ų75115.8 Ų115.862%0.6268%0.684SS**  cis-168.2176.9-12.600000112.6
148I36.8Very low31.8Very low123 Ų123114.1 Ų114.163%0.63168%0.68SS**  trans77.4124.2169.6-42171.7000114.1M544I148-M544 HydrophobicContact CB-CE 4.08Å; I148-M544 HydrophobicContact CB-SD 4.33Å; I148-M544 HydrophobicContact CG2-CE 4Å; I148-M544 HydrophobicContact CG2-SD 3.67Å; I148-M544 WeakPolarHBondContact O-CE 3.19Å
149S26.3Very low32.7Very low65 Ų65119.1 Ų119.146%0.45569%0.685SS.*  cis105.3122.79.6-1560000114.4
150M29.1Very low33.1Very low78 Ų78119.7 Ų119.738%0.38469%0.688SS.*  -161.1151.562.5-64.9-119.348.700115.9P545 L546 N547M150-P545 PolarHBondContact N-O 2.95Å; M150-P545 VanDerWaalsContact N-O 3.11Å; M150-P545 CarbonylContact O-C 2.89Å; M150-P545 WeakPolarHBondContact O-CA 3.39Å; M150-P545 WeakPolarHBondContact O-CB 3.47Å; M150-P545 VanDerWaalsContact O-CG 3.27Å; M150-P545 WeakPolarHBondContact O-CG 3.43Å; M150-L546 CarbonylContact O-C 3.48Å; M150-L546 PolarHBondContact O-N 3.25Å; M150-N547 HydrophobicContact CB-CB 4.43Å; M150-N547 WeakPolarHBondContact CB-OD1 3.21Å; M150-N547 WeakPolarHBondContact CG-ND2 3.34Å; M150-N547 PolarHBondContact SD-ND2 3.38Å
151Q26.8Very low34.2Very low148 Ų148121.5 Ų121.569%0.69270%0.696SS**  trans-58.4171.8162.1-82.5-97.6-21.700112.9L546 N547Q151-L546 CarbonylContact C-O 3.12Å; Q151-N547 PolarHBondContact O-OD1 3.09Å
152P40.5Very low35.4Very low59 Ų59119.5 Ų119.538%0.38369%0.686SS.*  cis-149.8-175.227.437.7-13.4000119.3
153L30.3Very low36.3Very low125 Ų125124.6 Ų124.665%0.65470%0.697SS**  124.2121.6124.2-155.666.6000119.9
154L35.9Very low37.1Very low139 Ų139126.6 Ų126.673%0.72870%0.701SS**  trans-23.3164.8152.6-53.8173.6000118.3
155D33.3Very low37.8Very low135 Ų135126 Ų12672%0.72270%0.699SS**  cis-153.4175.114.9-141.7-27.6000115.4
156S31.3Very low38.2Very low86 Ų86124.4 Ų124.460%0.60170%0.702SS**  trans-58.9128.8174.9-177.60000115.2
157I35.4Very low38.8Very low171 Ų171122.3 Ų122.388%0.87770%0.698SS**  trans-93.898.5161.6-63.3179.9000108.9
158V38.8Very low39.2Very low116 Ų116127.3 Ų127.370%0.70371%0.709SS**  trans-69.2146.6177.2179.40000111.1
159R49.8Very low39.2Very low231 Ų231128.6 Ų128.687%0.87271%0.712SS**  trans-55.8137.2176.6-72.7175.3168.8170.4-4112S161R159-S161 PolarHBondContact O-N 2.98Å
160P46.2Very low39.8Very low132 Ų132135.5 Ų135.586%0.85773%0.728SS**  trans-70.4110.8165.629.2-32.4000110
161S50.8Low40.2Very low117 Ų117139.1 Ų139.182%0.81875%0.749SS**  trans-73.3137.1165.7-170.70000109.8R159R159-S161 PolarHBondContact O-N 2.98Å
162A51.5Low40.8Very low68 Ų68137 Ų13756%0.56275%0.751SS**  trans-75.9156.3167.100000110.7
163F48.2Very low40.5Very low199 Ų199144.1 Ų144.187%0.87378%0.775SS**  trans64.7100.5173.6-49.7-80.9000117.5
164I44Very low40.6Very low167 Ų167141.1 Ų141.186%0.85678%0.775SS**  -177.4148.8119.6-97.4165.3000108.6
165P45Very low40.9Very low118 Ų118140 Ų14077%0.76678%0.776SS**PPolyproline II helixtrans-88.2158.2-153.633.5-37.1000115.6
166V39.8Very low40.9Very low147 Ų147141.9 Ų141.989%0.89178%0.78SS**PPolyproline II helixtrans-82.1131.3172.3178.70000110
167G45.4Very low41Very low70 Ų70141.9 Ų141.972%0.72279%0.785SS**PPolyproline II helixtrans-78.5173.4176.200000114.3
168E37.1Very low40.9Very low179 Ų179140.5 Ų140.584%0.83678%0.78SS**PPolyproline II helixtrans-89137.9-167.1-170.3170.4-166.300113.3
169H37Very low40.6Very low150 Ų150142.6 Ų142.669%0.69478%0.782SS**  trans55.5123.7164.4-81.9-123.5000118.4
170R40.4Very low39.9Very low211 Ų211137.4 Ų137.480%0.79678%0.776SS**  48.5111.182.6-78.1-169.1171.8-117.6-1.7113.9
171D35.9Very low39.2Very low154 Ų154135.9 Ų135.982%0.82477%0.768SS**  -165.9171.898.1-96.1-22.8000113.1
172S40.2Very low38.3Very low104 Ų104138 Ų13873%0.72777%0.765SS**  trans-99.2136.2-168.2560000114.4
173K33.3Very low37.6Very low208 Ų208141.6 Ų141.690%0.90477%0.773SS**  trans-138122.9156-80.2-63.3-173.2173.10112.1
174G34.1Very low36.8Very low62 Ų62139.3 Ų139.364%0.63977%0.768SS**  trans-89.6-179.1153.600000110.9
175P41.9Very low36.1Very low115 Ų115136 Ų13675%0.74776%0.761SS**  trans-86-173-172.236.1-37.1000114.4
176E33.2Very low35.5Very low174 Ų174138.4 Ų138.481%0.81377%0.766SS**  trans100.3138.8165.8-58.7-52.8141.100120.4
177A33.8Very low34.9Very low86 Ų86135.2 Ų135.271%0.71175%0.75SS**  trans62.5112154.500000122.6
178N32.2Very low34.1Very low143 Ų143138.1 Ų138.177%0.76575%0.749SS**  59145.8129.8-91.520.6000125.2
179E32.8Very low33.9Very low160 Ų160137.8 Ų137.875%0.74875%0.745SS**  trans63.5111.3145-71.2179.4111.100122.8
180V35.9Very low33.7Very low122 Ų122135.6 Ų135.674%0.73975%0.746SS**  63108.9121-179.30000119.7
181S31.6Very low33.5Very low100 Ų100130.5 Ų130.570%0.69974%0.743SS**  trans84.1133.3139.8-77.90000124.4
182E31.9Very low33.9Very low162 Ų162128.8 Ų128.876%0.75774%0.741SS**  trans90.399.7132.4-72.8-179.3178.900124.8
183I36.8Very low33.7Very low143 Ų143133 Ų13373%0.73375%0.746SS**  58.7157126.7-42.1155.6000120.5
184I31.4Very low33.8Very low150 Ų150132.1 Ų132.177%0.76975%0.745SS**  trans81.5103.9169.8-45.2-178.9000114
185S28.8Very low34.2Very low99 Ų99133.7 Ų133.769%0.69275%0.752SS**  cis85.9103.435.2-55.70000116.9
186L32.3Very low34.3Very low167 Ų167137.6 Ų137.687%0.87476%0.757SS**  trans159.2124.5138.2-102.854.3000107.3
187S27Very low34.6Very low81 Ų81133.8 Ų133.857%0.56675%0.75SS**  cis93.1107.943.5-176.10000113.6
188N28Very low35.2Very low130 Ų130134.4 Ų134.470%0.69575%0.754SS**  169.1112.4125-80.9-29.9000109.8
189K32.7Very low36.2Very low173 Ų173136.9 Ų136.975%0.75276%0.759SS**  65.594.891.2-67.6174.2-172.1169.20112.3
190S33.3Very low36.4Very low103 Ų103137.5 Ų137.572%0.7276%0.761SS**  100.5118.587.263.20000111.2
191S36.4Very low36.9Very low104 Ų104135.8 Ų135.873%0.72776%0.76SS**  67.4138.782.3-163.50000112.9
192P43.9Very low37.7Very low119 Ų119136.5 Ų136.577%0.77376%0.762SS**  cis-134.7-175.224.741.9-23.7000117.3
193F36.3Very low38Very low191 Ų191136.5 Ų136.584%0.83877%0.767SS**  trans-73153.1-178.9-68.6-102000115.3
194H35.7Very low38.4Very low190 Ų190137.7 Ų137.788%0.8877%0.769SS**  trans-143123.7144.4-93.5-58.1000111.1
195A43.2Very low39.4Very low95 Ų95135.5 Ų135.579%0.78577%0.765SS**  trans-98.4124.1179.800000112
196K44.2Very low39.6Very low198 Ų198142.9 Ų142.986%0.86178%0.778SS**  trans-148.4133.3170.5-70.9-169.5179.6176.30113.7
197S38Very low40.1Very low94 Ų94144.4 Ų144.466%0.65778%0.778SS**  trans50.5111.7148.9-1560000120.4F199S197-F199 VanDerWaalsContact C-N 3.28Å; S197-F199 PolarHBondContact O-N 2.87Å
198A47.4Very low40.5Very low98 Ų98145.5 Ų145.581%0.8179%0.791SS**SBendtrans-81.358172.100000113.7
199F53.3Low40.8Very low196 Ų196143.3 Ų143.386%0.8680%0.799SS**  trans-15370.5162.1-82.2-59.8000110.9S197S197-F199 VanDerWaalsContact C-N 3.28Å; S197-F199 PolarHBondContact O-N 2.87Å
200H36.6Very low40.8Very low173 Ų173140.5 Ų140.580%0.80180%0.801SS**  trans-135122.5166.9-96.7-81.8000109.9
201A46.6Very low41.6Very low86 Ų86140 Ų14071%0.71180%0.796SS**  trans-75139.6167.600000109.6N203A201-N203 PolarHBondContact O-N 3.49Å
202P47.6Very low41.6Very low114 Ų114144.3 Ų144.374%0.7480%0.802SS**  trans-66.9117.3177.1-21.333.5000112.1H204P202-H204 PolarHBondContact O-N 3.44Å
203N38.6Very low41.6Very low162 Ų162145.7 Ų145.787%0.86680%0.802SS**  trans-72.9110.9159.4-79-34.2000108.4A201A201-N203 PolarHBondContact O-N 3.49Å
204H44.2Very low42Very low168 Ų168142.3 Ų142.378%0.77880%0.799SS**  trans-131.1149.6164.8-89.5-60.8000111.6P202P202-H204 PolarHBondContact O-N 3.44Å
205P53.3Low41.7Very low105 Ų105141 Ų14168%0.68279%0.793SS**  trans-131.7122.1-138.133.6-13.7000113.8
206W33Very low41.8Very low253 Ų253145.9 Ų145.996%0.95880%0.797SS**  trans-121.7104166.4-77.577.5000110.6
207K42.4Very low41.8Very low200 Ų200142 Ų14287%0.8779%0.792SS**  trans-88.6160150.9-65.7-166.1176.1-170.70107.4
208A35.6Very low41.9Very low103 Ų103145.8 Ų145.885%0.85180%0.799SS**  cis-139.41549.800000112
209G33.6Very low41.5Very low84 Ų84150.7 Ų150.787%0.86680%0.802SS**  trans-173.1100.2173.500000108.4
210S33.7Very low40.7Very low114 Ų114148.4 Ų148.480%0.79780%0.804SS**  trans-129.8160.2-167.1-171.10000109.7
211P49.2Very low40.7Very low92 Ų92144.2 Ų144.260%0.59780%0.799SS**  cis-115.5-175.7-42.437.1-24.7000110.1
212F36.1Very low40.9Very low196 Ų196145.7 Ų145.786%0.8680%0.802SS**  163.7115.9129.4-89.4-63.5000110.8
213L44.5Very low40.4Very low148 Ų148147.6 Ų147.678%0.77581%0.811SS**  trans-87.5155.1154.3-80.4166.9000108.3
214P45.7Very low40.7Very low119 Ų119150 Ų15077%0.77381%0.814SS**  -124.314088.537.7-31.5000110.8
215E29.2Very low40.5Very low163 Ų163145.6 Ų145.676%0.76281%0.814SS**  60.5104.755.8-166.8155.9-156.300113.4
216F44.8Very low39.9Very low197 Ų197151 Ų15186%0.86483%0.827SS**  trans-83.5137.8179-74.8-92.3000112
217P45.1Very low40Very low116 Ų116142.4 Ų142.475%0.75382%0.817SS**  trans-106.7164.5144.834.4-28.6000111.9
218H39.1Very low39.8Very low174 Ų174137.8 Ų137.881%0.80681%0.81SS**  trans-94.5157.1-167.7-55.2-87.4000114.8
219K38.5Very low40.1Very low201 Ų201140.8 Ų140.887%0.87481%0.81SS**  trans74.5144.5172.5-46.4-178.7-175.3-177.50111.6
220V37Very low40.1Very low149 Ų149141.5 Ų141.590%0.90380%0.802SS**  cis-140.3-178.136.5-147.30000111.7
221A36.2Very low40.5Very low85 Ų85141.9 Ų141.970%0.70280%0.802SS**  trans-148.5173171.900000109.2
222P51.8Low39.9Very low117 Ų117148.2 Ų148.276%0.7682%0.816SS**  cis-132.2144.2-44.934.8-20.1000112.8
223T37.5Very low40Very low153 Ų153147 Ų14794%0.93981%0.814SS**  trans-143148.6174.640.50000115.4
224K44.2Very low39.8Very low212 Ų212148.5 Ų148.592%0.92282%0.818SS**  trans-63.4147.8-171.1-57.3166.6179.7174.70115
225G40.8Very low39.6Very low76 Ų76148.5 Ų148.578%0.78482%0.818SS**  trans-169.4143.4162.500000110.1
226F40.2Very low40.2Very low218 Ų218149.9 Ų149.996%0.95683%0.826SS**  trans-110.2147.8-174.3-90.1-90.3000113
227G34.4Very low40.1Very low73 Ų73147.7 Ų147.775%0.75382%0.822SS**  trans112.9140.5170.400000113.8
228S39Very low40.1Very low103 Ų103147.8 Ų147.872%0.7282%0.823SS**  cis-164.2142.7-9.153.40000111.9
229I40.8Very low40.1Very low166 Ų166148.7 Ų148.785%0.85183%0.828SS**  trans73150.5161.4-57.3154000116.1
230S33.8Very low40.2Very low99 Ų99149.6 Ų149.669%0.69283%0.827SS**  trans-134.3147.7178.2-168.20000107.2
231P43.5Very low40.2Very low123 Ų123147.7 Ų147.780%0.79982%0.82SS**  -148.8131.186.235.5-16.1000115.8
232Y35.2Very low40.7Very low225 Ų225148 Ų14888%0.88282%0.815SS**  trans-140.7137.7147.8-161.4-102.3000110.1
233M39.2Very low40Very low169 Ų169150.2 Ų150.283%0.83382%0.815SS**PPolyproline II helixtrans-82.3135.2-167.2-59.6-115.374.100111.9
234Q39.6Very low40.1Very low181 Ų181153.2 Ų153.285%0.84682%0.815SS**PPolyproline II helixtrans-91.7152.7159.6-85-171.7-40.200110.5
235P42.5Very low39.8Very low119 Ų119153.6 Ų153.677%0.77381%0.813SS**PPolyproline II helixtrans-71.5139.1-175.529.1-35.3000112.2
236M41.9Very low39.5Very low191 Ų191158.4 Ų158.494%0.94182%0.815SS**PPolyproline II helixtrans-65.9131.7173.8-78.5-177.2165.500111.9
237I42.9Very low39.3Very low151 Ų151154.8 Ų154.877%0.77480%0.8SS**PPolyproline II helixtrans-97.7134.5158.2-60.1175000106.6E239I237-E239 PolarHBondContact O-N 3.48Å
238P44.3Very low39.4Very low119 Ų119161 Ų16177%0.77380%0.801SS**  trans-68.8111.7177.4-19.632.9000111.7
239E39.4Very low39.4Very low193 Ų193164.8 Ų164.890%0.90281%0.812SS**PPolyproline II helixtrans-98.8130.8174.3-163.1158.4-138.800109.5I237I237-E239 PolarHBondContact O-N 3.48Å
240Y40.4Very low39.3Very low220 Ų220160.8 Ų160.886%0.86380%0.804SS**PPolyproline II helixtrans-81131.6-171.8-82.9-99.7000111.8
241S36.5Very low39.5Very low109 Ų109163.6 Ų163.676%0.76281%0.81SS**PPolyproline II helixtrans-73.1133.5170.3-173.70000111.3
242P46.8Very low39Very low92 Ų92168.3 Ų168.360%0.59781%0.813SS**  trans-78.6-170.4165.234.1-33.8000111.5
243H36.6Very low39Very low162 Ų162161.4 Ų161.475%0.7580%0.802SS**  trans79.498.9178-45.4-68.1000116.4
244F39.3Very low38.9Very low216 Ų216159 Ų15995%0.94780%0.799SS**  -17499.5118.4-90.3-60.4000108.4
245Y37.9Very low38.7Very low221 Ų221161.6 Ų161.687%0.86780%0.803SS**  trans-148.781.3177.8-163.9-84.6000110.8
246E36Very low38.6Very low177 Ų177163.7 Ų163.783%0.82781%0.807SS**  trans-161.3162.7158.7-122.5-176124.300111.4
247H36.2Very low38.6Very low142 Ų142162.7 Ų162.766%0.65781%0.805SS**SBendtrans64.1117.1-177.3-8538.4000116.9
248R35.3Very low38.7Very low204 Ų204161.4 Ų161.477%0.7781%0.806SS**  cis-146141.5-12.9-75-167.5177.1-166.61.5110
249L38.8Very low38.1Very low181 Ų181159.8 Ų159.895%0.94881%0.811SS**  trans-103.7106.2156-80.9172.8000109.7
250A39.6Very low37.7Very low83 Ų83157.7 Ų157.769%0.68681%0.806SS**  trans-152.8135.515800000105.1
251I38.5Very low37.8Very low157 Ų157151.9 Ų151.981%0.80580%0.798SS**SBendcis-139.6115.523.5-59.6153.4000110
252Y32.5Very low37.7Very low223 Ų223156 Ų15688%0.87581%0.805SS**  trans-172141.9131.5-132-96.3000110.2
253A34.2Very low36.9Very low79 Ų79157.2 Ų157.265%0.65381%0.814SS**  trans-119.1126.7179.600000110.9
254P37Very low36.7Very low119 Ų119157.3 Ų157.377%0.77382%0.815SS**PPolyproline II helixtrans-80.2144.3161.733.2-31.1000109.9
255Y36.4Very low36.3Very low235 Ų235151.2 Ų151.292%0.92280%0.799SS**PPolyproline II helixtrans-66.7135.5-177.4-69.3-94000112.1
256L40.9Very low36Very low164 Ų164146.4 Ų146.486%0.85980%0.798SS**PPolyproline II helixtrans-79.4130.5175-69.3168.3000110.9
257L40.5Very low36Very low170 Ų170142 Ų14289%0.8979%0.792SS**  trans-125117.1153.5-79.9172.2000107.5G259L257-G259 PolarHBondContact O-N 2.91Å
258P45.2Very low36Very low123 Ų123143.4 Ų143.480%0.79980%0.803SS**PPolyproline II helixtrans-64.1130.6177.1-21.433.4000111N260P258-N260 PolarHBondContact O-N 2.85Å
259G32.3Very low35.9Very low85 Ų85139 Ų13988%0.87680%0.803SS**PPolyproline II helixtrans-71.1117.816900000110L257L257-G259 PolarHBondContact O-N 2.91Å
260N30.3Very low35.8Very low149 Ų149136 Ų13680%0.79779%0.793SS**PPolyproline II helixtrans-91.1144.1168.5-162.428.8000110P258P258-N260 PolarHBondContact O-N 2.85Å
261S42.4Very low35.6Very low99 Ų99142.8 Ų142.869%0.69280%0.802SS**PPolyproline II helixtrans-92.8124.7-176.8550000111.7
262E34.4Very low35.4Very low194 Ų194139.1 Ų139.191%0.90780%0.803SS**  trans-158.1179.8158.9-118151.4-128.100111.8
263C31.2Very low35.6Very low119 Ų119134.4 Ų134.480%0.80480%0.797SS**  trans-113-178-160-1500000114.1
264E31.6Very low35.6Very low164 Ų164139.2 Ų139.277%0.76681%0.807SS**  trans76118.2159.2-69.1-130.567.600121.4
265S30.2Very low35.6Very low88 Ų88141 Ų14162%0.61580%0.804SS**  70.5116.1120.4-61.10000122.9
266S31.6Very low35.7Very low120 Ų120138.6 Ų138.684%0.83980%0.802SS**  trans55.7127.8136.1-52.80000119.6
267A36.5Very low35.5Very low84 Ų84139.5 Ų139.569%0.69479%0.794SS**  -178.6143.157.500000114.7
268L37.3Very low35.6Very low171 Ų171138.5 Ų138.590%0.89578%0.784SS**  trans56.4161.9135.5-61.7177000124.3
269S33Very low35.3Very low111 Ų111142.3 Ų142.378%0.77679%0.789SS**  trans85.7114168.2-141.60000116.5
270V36.1Very low35.9Very low119 Ų119145.8 Ų145.872%0.72179%0.785SS**  cis112.5109.518.5171.30000111.9
271Y35.2Very low36.6Very low225 Ų225144.1 Ų144.188%0.88278%0.783SS**  trans50.7122.6158.2-86-106.6000120.7
272G35Very low36.3Very low80 Ų80148.1 Ų148.183%0.82579%0.79SS**  trans-159100.1162.200000110.7
273T36Very low36.6Very low124 Ų124143.9 Ų143.976%0.76179%0.788SS**  trans-92.2145.5168.848.30000109.7
274Q33.6Very low37.1Very low181 Ų181141.1 Ų141.185%0.84678%0.78SS**  -177.5148.4117.5-172150.5-20.400112
275E37.7Very low37.7Very low155 Ų155139.7 Ų139.772%0.72479%0.785SS**  trans-83.9132173.3169.2-171.2179.800111.5
276Q38.8Very low38.4Very low185 Ų185143.5 Ų143.586%0.86480%0.797SS**  trans-166.6174.4140.5-109.5166.713.200112.2
277R37.2Very low39.2Very low184 Ų184143.4 Ų143.469%0.69479%0.794SS**  trans-117168.6-153.5-41.9179.6-160.9150.35.8114.7
278H41.7Very low39.7Very low148 Ų148148.5 Ų148.569%0.68580%0.801SS**  trans66.3125.3158.9-40.9139.4000117.3
279F38.9Very low40.3Very low204 Ų204146.6 Ų146.690%0.89580%0.799SS**  -160.2141.7106.2-94.8-68.3000109.1
280I45.8Very low40.9Very low157 Ų157149 Ų14981%0.80580%0.801SS**  trans-110.2127.1169.4-63173.5000107.4
281P43.7Very low41Very low115 Ų115149.3 Ų149.375%0.74780%0.798SS**  trans-113.3103.1161.424.8-7.7000111.1
282H36.4Very low41.5Very low183 Ų183144.7 Ų144.785%0.84780%0.796SS**  trans31.9150.9151.2-60.9-80.6000123.5
283A40.6Very low42Very low104 Ų104145.6 Ų145.686%0.8679%0.79SS**PPolyproline II helixtrans-72138.5-175.900000114.1
284G42.2Very low42.4Very low62 Ų62144.2 Ų144.264%0.63979%0.791SS**PPolyproline II helixtrans-90.7169.6168.100000113.4
285P44.4Very low42.8Very low134 Ų134146.3 Ų146.387%0.8779%0.793SS**PPolyproline II helixtrans-68.7140.2-173.3-20.233.5000114.3
286L44.2Very low42.9Very low167 Ų167145.3 Ų145.387%0.87479%0.788SS**PPolyproline II helixtrans-74129.7173.9-70.9167.9000111.6
287P48.2Very low43.2Very low119 Ų119144.6 Ų144.677%0.77378%0.784SS**PPolyproline II helixtrans-73.1144.1170.430.4-33.5000111.3
288K47.2Very low43.2Very low191 Ų191146.6 Ų146.683%0.8379%0.793SS**PPolyproline II helixtrans-71144.1179.3-61.3174.1-176.91760110.8
289P49.5Very low43.3Very low131 Ų131149 Ų14985%0.85180%0.796SS**PPolyproline II helixtrans-67.4139.7178.328-34.6000111.9
290I46.5Very low43.8Very low161 Ų161146.7 Ų146.783%0.82679%0.793SS**PPolyproline II helixtrans-90.8143.6179.1-64.4174.9000110.2
291N38Very low43.3Very low125 Ų125149.3 Ų149.367%0.66880%0.799SS**PPolyproline II helixtrans-69.2125.6-172.6-173.86.1000113.2S293N291-S293 PolarHBondContact O-N 2.87Å; N291-S293 VanDerWaalsContact O-N 3.16Å
292P45.3Very low42.9Very low128 Ų128152 Ų15283%0.83180%0.802SS**  trans-88.171.1-175.936.2-37.3000113.5
293S46Very low43.1Very low99 Ų99149.3 Ų149.369%0.69279%0.789SS**  trans-125.721.518078.40000115.5N291N291-S293 PolarHBondContact O-N 2.87Å; N291-S293 VanDerWaalsContact O-N 3.16Å
294A44.5Very low42.9Very low95 Ų95155.8 Ų155.879%0.78579%0.793SS**SBendtrans-118.525.9-168.800000115.1
295Y43Very low42.9Very low225 Ų225159.4 Ų159.488%0.88279%0.793SS**  trans-14438.3-177.5-137-89000115.2
296E39.7Very low42.4Very low134 Ų134158.8 Ų158.863%0.62679%0.792SS**  trans-120.664.4167.7-88.9-74.3-174.100109.7R299E296-R299 IonicContact OE1-NH2 2.71Å; E296-R299 PolarHBondContact OE1-NH2 2.93Å
297H44.3Very low42Very low171 Ų171157.4 Ų157.479%0.79279%0.791SS**  trans-132.2152165.6-83.343.7000108
298Y37.3Very low41.9Very low225 Ų225156.7 Ų156.788%0.88279%0.786SS**  trans7052-170-57.1-76.7000116.7
299R44.1Very low42.2Very low198 Ų198153.9 Ų153.975%0.74779%0.787SS**  trans-122.930.6156-84.8-144-71.7178.3-7.1115.2E296E296-R299 IonicContact OE1-NH2 2.71Å; E296-R299 PolarHBondContact OE1-NH2 2.93Å
300L49.1Very low42.1Very low157 Ų157154.5 Ų154.582%0.82278%0.782SS**  trans-128.2104.5161.9-8691.1000110.9
301F36Very low41.7Very low211 Ų211152.7 Ų152.793%0.92578%0.781SS**  trans-162120.3139-92.6-62000108.1
302Q34.4Very low42Very low173 Ų173158.3 Ų158.381%0.80879%0.794SS**  trans-143.9150.8170.5-118.3-148.490.700109.6
303Q40.9Very low41.8Very low126 Ų126155.4 Ų155.459%0.58979%0.787SS**  trans62.8111.1169.9-58.3174.4-99.900117.7
304Y35.3Very low41.7Very low239 Ų239160.7 Ų160.794%0.93780%0.798SS**  -145.1164118.7-95.9-70.9000108.7
305H43.2Very low41.2Very low139 Ų139162 Ų16264%0.64480%0.8SS**  trans-121.7157.2-151.9-60.3-105.7000114.4
306S34.3Very low41.3Very low120 Ų120161.2 Ų161.284%0.83980%0.796SS**  trans-174.1104.4144.9-84.70000113.7
307T36.4Very low41.4Very low139 Ų139160.5 Ų160.585%0.85380%0.803SS**  trans-155.5147.6159.129.60000110.1
308P45.9Very low41Very low103 Ų103157.1 Ų157.167%0.66979%0.794SS**  trans-78.1160.4-173.332.2-36.7000114
309P52.7Low41.3Very low132 Ų132153.5 Ų153.586%0.85779%0.79SS**  trans-75.6132.218030.9-34.6000112.5
310I46.3Very low41.4Very low145 Ų145149.6 Ų149.674%0.74479%0.791SS**  trans-122.4137.7171.4-64.3179.3000106.5
311P38.8Very low41.5Very low123 Ų123146.6 Ų146.680%0.79978%0.78SS**  trans-62.7153.3-164.121.1-33.5000115.2
312Y43.5Very low41.3Very low243 Ų243144.6 Ų144.695%0.95377%0.771SS**  trans-64.2132-168.4-85.7-108.3000113.9
313G42.7Very low41.4Very low67 Ų67145.3 Ų145.369%0.69177%0.768SS**SBendtrans-170.252.8-179.200000113.8
314F43.5Very low41.1Very low209 Ų209150.2 Ų150.292%0.91778%0.781SS**  trans62.870.3173.1-60.8-80.3000118
315C32.9Very low40.9Very low122 Ų122147.6 Ų147.682%0.82478%0.775SS**  trans-99.9123.9141.2-80.40000107.6
316R46.1Very low40.2Very low209 Ų209146.2 Ų146.279%0.78978%0.781SS**  62126.593.6-75.3-86.2-167.8150.41.2112.4
317P42.3Very low40.5Very low119 Ų119149.7 Ų149.777%0.77378%0.784SS**  -139135.276.532.8-14.8000114.2
318T35.3Very low40.4Very low100 Ų100149.6 Ų149.661%0.61378%0.783SS**  79.7100.786.7-53.10000114
319D44.4Very low39.7Very low149 Ų149149.4 Ų149.480%0.79779%0.79SS**  trans-58148.4158.9-39.3-92.1000110
320P46.3Very low38.7Very low117 Ų117146.4 Ų146.476%0.7678%0.783SS**  -148.9-146.893.341.1-19.6000112.5
321P49.3Very low38.3Very low94 Ų94147.4 Ų147.461%0.6179%0.788SS**  -129.6-159.8-111.339.1-16.6000114.6
322F32.7Very low38Very low168 Ų168148.7 Ų148.774%0.73779%0.788SS**  trans78.8148.3-179-53.6-73.6000113.9
323Y35.9Very low37.4Very low188 Ų188147.2 Ų147.274%0.73778%0.781SS**  cis-120.3141.319.3-85.5-102.3000115.6F325Y323-F325 AromaticContact CD1-CD2 3.87Å; Y323-F325 HydrophobicContact CD1-CD2 3.87Å; Y323-F325 AromaticContact CD1-CE2 3.31Å; Y323-F325 HydrophobicContact CD1-CE2 3.31Å; Y323-F325 AromaticContact CD1-CZ 3.75Å; Y323-F325 HydrophobicContact CD1-CZ 3.75Å; Y323-F325 AromaticContact CE1-CE2 3.79Å; Y323-F325 HydrophobicContact CE1-CE2 3.79Å; Y323-F325 AromaticContact CE1-CZ 3.8Å; Y323-F325 HydrophobicContact CE1-CZ 3.8Å; Y323-F325 HydrophobicContact CG-CD2 4.36Å; Y323-F325 AromaticContact CG-CE2 3.96Å; Y323-F325 HydrophobicContact CG-CE2 3.96Å
324R35.1Very low37Very low229 Ų229150.7 Ų150.786%0.86478%0.784SS**  trans-84.1151.3137.3-64.7179.2-177.4163.8-0.7107.6
325F31.5Very low36.5Very low184 Ų184149.5 Ų149.581%0.80778%0.781SS**  trans-118.5158.3150.5-94.1-77.3000110.1Y323Y323-F325 AromaticContact CD1-CD2 3.87Å; Y323-F325 HydrophobicContact CD1-CD2 3.87Å; Y323-F325 AromaticContact CD1-CE2 3.31Å; Y323-F325 HydrophobicContact CD1-CE2 3.31Å; Y323-F325 AromaticContact CD1-CZ 3.75Å; Y323-F325 HydrophobicContact CD1-CZ 3.75Å; Y323-F325 AromaticContact CE1-CE2 3.79Å; Y323-F325 HydrophobicContact CE1-CE2 3.79Å; Y323-F325 AromaticContact CE1-CZ 3.8Å; Y323-F325 HydrophobicContact CE1-CZ 3.8Å; Y323-F325 HydrophobicContact CG-CD2 4.36Å; Y323-F325 AromaticContact CG-CE2 3.96Å; Y323-F325 HydrophobicContact CG-CE2 3.96Å
326S27.7Very low36.3Very low111 Ų111150.8 Ų150.878%0.77678%0.78SS**  trans-98166.1-162.9-59.30000113.6
327H41.8Very low35.6Very low193 Ų193146.2 Ų146.289%0.89478%0.78SS**  trans-67.1133.5176.2-58.2-89000113.4
328V33Very low35.2Very low137 Ų137147.8 Ų147.883%0.8378%0.777SS**  trans-143.2100.1150.9-177.10000104
329A31.6Very low34.9Very low98 Ų98150.5 Ų150.581%0.8179%0.787SS**  66.610276.500000113.6
330G31.2Very low34.3Very low70 Ų70148.4 Ų148.472%0.72277%0.773SS**  trans137.1134.7159.100000117.7
331I38.9Very low33.8Very low166 Ų166150.6 Ų150.685%0.85177%0.773SS**  trans57.1104.2144.162.3165.8000122.4
332N31.8Very low33.2Very low150 Ų150153.2 Ų153.280%0.80278%0.777SS**  72.1131.4113.3-153.4-6.6000121.4
333R32.6Very low33.5Very low212 Ų212150.5 Ų150.580%0.878%0.775SS**  trans91.8135.7148-141169.4-173.61660.6119.6
334D34Very low33.5Very low139 Ų139146.9 Ų146.974%0.74377%0.772SS**  trans-72.1148.2173.9-31.6-107.6000111.9
335Q32.8Very low33.6Very low184 Ų184142.3 Ų142.386%0.8677%0.765SS**  -162.3162.9118.8-113.6153.792.900114.2
336N28.4Very low33.9Very low149 Ų149141.8 Ų141.880%0.79777%0.769SS**  trans-111.8119.7-174.3166.828.4000109.8
337S30.9Very low34Very low114 Ų114146.4 Ų146.480%0.79777%0.771SS**  trans-163101.9156.645.20000114.1
338H33.3Very low33.8Very low152 Ų152142.5 Ų142.570%0.70476%0.763SS**  trans-31.1130146.1174.7-78.1000115.3
339L30.4Very low33.6Very low157 Ų157140.2 Ų140.282%0.82276%0.758SS**  trans-151.8114.3155.9-155.672.8000113.2
340M31.3Very low33.4Very low104 Ų104139.7 Ų139.751%0.51275%0.748SS.*  trans40.4116.6140.9-48.1-70.659.500120
341E34.6Very low33.7Very low163 Ų163141 Ų14176%0.76274%0.738SS**  98156.8100.5-78.4176.1147.900111
342E37.5Very low33.4Very low149 Ų149136.4 Ų136.470%0.69672%0.721SS**  cis-151.1164.111.5-144.7-166.613700110.4
343T39.1Very low33.8Very low112 Ų112131.9 Ų131.969%0.68770%0.7SS**  trans63.8145.7154.958.70000120.6
344T35.7Very low33.7Very low111 Ų111124 Ų12468%0.68168%0.677SS**  cis-163.2134.5-9.5-113.60000112.9
345L38Very low33.7Very low134 Ų134126.3 Ų126.370%0.70268%0.683SS**  trans51.5138.6151.2-51.3175.7000119.8
346L36.3Very low33.4Very low173 Ų173127.1 Ų127.191%0.90669%0.687SS**  -140.3166.264.9-110.271.7000115.6
347Y31.1Very low33.5Very low208 Ų208130.4 Ų130.482%0.81669%0.69SS**  trans-68.8173.4-178.4-99.7-142000115.9
348P36.9Very low33.8Very low111 Ų111130.3 Ų130.372%0.72169%0.687SS**  cis-138.8173.4-20.635-15.1000117.4
349A29.1Very low33.7Very low89 Ų89130.9 Ų130.974%0.73669%0.694SS**  trans-50.8176.7154.600000115.7
350S28.3Very low33.7Very low86 Ų86128.5 Ų128.560%0.60169%0.69SS**  cis-172.6-173.5-17.353.50000109.2
351L36.3Very low33.6Very low98 Ų98129.3 Ų129.351%0.51371%0.706SS.*  trans-75.4179.6168.4-49.589.6000110.9A533 E534L351-A533 CarbonylContact C-O 3.04Å; L351-A533 CarbonylContact O-C 2.95Å; L351-A533 PolarHBondContact O-N 3.24Å; L351-A533 VanDerWaalsContact O-N 3.17Å; L351-E534 WeakPolarHBondContact CB-O 3.38Å; L351-E534 PolarHBondContact O-N 3.15Å
352S32.4Very low33.7Very low69 Ų69130.5 Ų130.548%0.48371%0.712SS.*  cis95.765.6-2.3-1590000124.2A533 S535 Q536S352-A533 PolarHBondContact N-O 3.41Å; S352-S535 CarbonylContact O-C 3.56Å; S352-S535 WeakPolarHBondContact O-CA 3.42Å; S352-S535 PolarHBondContact O-N 2.94Å; S352-Q536 PolarHBondContact O-N 3.19Å
353P40Very low33.5Very low56 Ų56133.7 Ų133.736%0.36472%0.723SS.*  trans-47.1171.11652.1-0.8000125A533 E534 S535 Q536P353-A533 WeakPolarHBondContact CD-O 3.29Å; P353-E534 VanDerWaalsContact C-OE1 3.32Å; P353-E534 VanDerWaalsContact C-OE2 3.28Å; P353-E534 WeakPolarHBondContact CA-OE1 3.22Å; P353-E534 WeakPolarHBondContact CA-OE2 3.33Å; P353-E534 HydrophobicContact CB-CB 3.84Å; P353-E534 HydrophobicContact CB-CG 2.28Å; P353-E534 WeakPolarHBondContact CB-OE1 3.43Å; P353-E534 VanDerWaalsContact CD-OE1 3.27Å; P353-E534 WeakPolarHBondContact CD-OE1 3.29Å; P353-E534 WeakPolarHBondContact CD-OE2 3.3Å; P353-E534 HydrophobicContact CG-CB 3.33Å; P353-E534 HydrophobicContact CG-CG 2.3Å; P353-E534 WeakPolarHBondContact CG-OE1 3.29Å; P353-E534 WeakPolarHBondContact CG-OE2 3.4Å; P353-S535 CarbonylContact C-O 2.91Å; P353-S535 VanDerWaalsContact CA-O 3.27Å; P353-S535 WeakPolarHBondContact CA-O 3.33Å; P353-S535 VanDerWaalsContact N-N 3.18Å; P353-Q536 VanDerWaalsContact O-CD 3.27Å; P353-Q536 WeakPolarHBondContact O-CG 3.31Å; P353-Q536 PolarHBondContact O-NE2 2.87Å
354S32Very low33.2Very low46 Ų46137 Ų13732%0.32273%0.728SS.*  trans-147.1-174.917947.80000110.9S535S354-S535 WeakPolarHBondContact CB-O 3.47Å; S354-S535 PolarHBondContact N-O 2.94Å; S354-S535 VanDerWaalsContact N-O 3.16Å; S354-S535 PolarHBondContact OG-O 3.46Å
355Q32.6Very low32.9Very low187 Ų187138.8 Ų138.887%0.87473%0.729SS**  trans72.8104.4-174.8-66-16211.900117.2
356Q28.1Very low32.5Very low202 Ų202137.8 Ų137.894%0.94473%0.728SS**  -134.5146.6124.5-69.4-163.9-27.700109.7
357Y29.6Very low32.3Very low218 Ų218135 Ų13586%0.85572%0.715SS**  trans-108.8154.7165.6-122.1-80.6000106.7
358P37.9Very low32.4Very low111 Ų111134.9 Ų134.972%0.72171%0.714SS**  -156.2154.3104.139-20.8000118.1
359L30.9Very low32Very low164 Ų164135.7 Ų135.786%0.85971%0.708SS**  trans65.8171.6144.4-99.367.1000122.4
360S29.5Very low32.4Very low107 Ų107139.5 Ų139.575%0.74871%0.708SS**  trans-136.4160.9-160.956.70000112.2
361S30.4Very low32.3Very low121 Ų121143 Ų14385%0.84672%0.715SS**  trans-161.8159.3146.351.10000113
362H35.9Very low32Very low189 Ų189145.7 Ų145.788%0.87573%0.727SS**  trans-99.8160.4178.3-73.9-99.2000112.4
363K32.6Very low31.9Very low216 Ų216148.1 Ų148.194%0.93974%0.739SS**  trans-140.9168.3148.1-120.3178-178.5-178.70111.2
364K34.2Very low31.4Very low180 Ų180152.5 Ų152.578%0.78376%0.759SS**  trans-132.7151-159.5-94.1-167.5175.4-169.70113.3
365Q27.8Very low31.4Very low149 Ų149157.6 Ų157.670%0.69678%0.781SS**  trans67.5154.7145.4-144.8153.5-17.600115.2
366T31.4Very low31.2Very low113 Ų113156.5 Ų156.569%0.69378%0.776SS**  cis-167.5129.149.2-61.90000114.1
367D31.7Very low31.2Very low116 Ų116150.7 Ų150.762%0.6276%0.762SS**  trans36.5168.3141.3-54.4-58.9000126.5
368Y32.4Very low31.3Very low204 Ų204150 Ų15080%0.876%0.764SS**  trans84.9146.7168.3-73.9-103.1000120.7
369E28.6Very low30.8Very low128 Ų128150.3 Ų150.360%0.59877%0.768SS**  cis-161.1163.4-32.8-174.3159.7-134.900112.4
370K38.3Very low30.9Very low169 Ų169151.9 Ų151.974%0.73577%0.771SS**  trans-39.7158.4178.6-45.8139.4-173.6159.50119
371E26.6Very low30.9Very low161 Ų161152.7 Ų152.775%0.75278%0.777SS**  -155.1137.2119-126.8-165.999.200114.5
372M29.9Very low31.4Very low153 Ų153156.1 Ų156.175%0.75478%0.776SS**  trans38146.9142-95.9157.649.300123.9
373T29.1Very low31.2Very low120 Ų120154.6 Ų154.674%0.73678%0.775SS**  cis-147.3154.611.1-60.40000114.2
374L29.3Very low31.2Very low149 Ų149150.9 Ų150.978%0.7877%0.765SS**  trans-55.5150.7171.2-178.279.4000117.6
375L31.7Very low31.4Very low153 Ų153150.1 Ų150.180%0.80176%0.764SS**  trans-167.3126.3135.8-104.9179.6000114.2
376H29.3Very low31.7Very low164 Ų164149.6 Ų149.676%0.75977%0.766SS**  trans27.2150.7149.9-78.3-132.3000123.7
377A28.7Very low32.1Very low80 Ų80151.3 Ų151.366%0.66177%0.767SS**  cis-172.5140.6-17.800000113.7
378K30.1Very low32.3Very low203 Ų203155.5 Ų155.588%0.88377%0.774SS**  trans56.9108.5134.4-166.6175.4-173.2173.90121.6
379S27.4Very low32.7Very low117 Ų117153 Ų15382%0.81877%0.769SS**  -168.1151114.547.50000112.5
380H33.4Very low33.1Very low198 Ų198153.7 Ų153.792%0.91778%0.777SS**  trans-125.2146.1171.9-67-93000109.4
381S31Very low33.3Very low123 Ų123150.6 Ų150.686%0.8678%0.783SS**  trans-161.5147.213953.10000110.6
382K40.1Very low34.4Very low193 Ų193152.3 Ų152.384%0.83979%0.788SS**  trans-86.7159.8162.8-50.2174.4-177.8-179.50108.5
383D31.5Very low35.5Very low157 Ų157153.6 Ų153.684%0.8479%0.794SS**  -158170.2118.8-136.9-28000111.3
384D33.5Very low36.2Very low138 Ų138152.5 Ų152.574%0.73879%0.792SS**  trans-96.3-176.3-170.9-82.1-61.2000114.5
385Q36.8Very low37.4Very low165 Ų165151.6 Ų151.677%0.77180%0.795SS**  trans88.181.6140.1-138.771-21.400121.8
386N34.9Very low38.6Very low138 Ų138152.8 Ų152.874%0.73880%0.801SS**  77.8163.1123.1-151.210.1000120.9
387E39Very low39.5Very low149 Ų149149.9 Ų149.970%0.69681%0.805SS**  trans-62.7159.3-178.2-51.6175.4146.400115
388R37.2Very low40.2Very low204 Ų204149.5 Ų149.577%0.7781%0.809SS**  177.4162.3105.4-175.6148.1-67.6-157.1-0.9113.8
389E41.1Very low41.1Very low152 Ų152146.3 Ų146.371%0.7181%0.812SS**  trans74.283.1158.7-91.1174.499.800121.4
390N37.1Very low42.1Very low141 Ų141145.6 Ų145.675%0.75481%0.814SS**  trans24.4120.6131.746-118.4000121.5
391A42.2Very low43Very low105 Ų105140.4 Ų140.487%0.86881%0.805SS**  trans-126137.5150.100000111.1
392K49.5Very low43.9Very low197 Ų197141 Ų14186%0.85780%0.804SS**  trans-77.7145.4-174.9-53.7144.2-174.9171.70110.7
393M53.2Low44Very low180 Ų180135.1 Ų135.189%0.88780%0.798SS**  trans-170.4155.3131.9-88-33-85.500111.6
394S43.8Very low44.5Very low97 Ų97133.3 Ų133.368%0.67880%0.797SS**PPolyproline II helixtrans-87.2156.1-167.1-48.70000115
395P52.9Low45.8Very low130 Ų130133 Ų13384%0.84480%0.803SS**PPolyproline II helixtrans-73.4131.7164.731.4-33.4000110.9
396L57Low46.5Very low178 Ų178128.6 Ų128.693%0.93280%0.801SS**PPolyproline II helixtrans-100.9125.7170.4-93.6166.4000110.3
397A50.1Low47.7Very low102 Ų102133.2 Ų133.284%0.84381%0.809SS**PPolyproline II helixtrans-101.4151.9171.900000110.5
398G41.7Very low48.7Very low73 Ų73132.2 Ų132.275%0.75382%0.815SS**  trans139.5103.9163.300000115.3
399S50.8Low48.9Very low135 Ų135127.3 Ų127.394%0.94481%0.812SS**  trans-162.6107.4147.6-85.70000109.3
400A47Very low49.3Very low103 Ų103125.9 Ų125.985%0.85182%0.816SS**  trans-134.6116173.800000109.4
401A53.1Low49.8Very low89 Ų89125.6 Ų125.674%0.73682%0.819SS**  trans-150.7114.2163.200000106.1
402T48.8Very low49.8Very low136 Ų136128 Ų12883%0.83482%0.817SS**  53.399.559.277.40000112.6
403G42.6Very low49.5Very low69 Ų69127.4 Ų127.471%0.71182%0.815SS**  trans164.851178.500000116P405G403-P405 VanDerWaalsContact O-CD 3.29Å; G403-P405 WeakPolarHBondContact O-CD 3.29Å
404S42.9Very low49.3Very low118 Ų118125 Ų12583%0.82581%0.811SS**PPolyproline II helixtrans-68.8120.9171-50.30000110.5G406S404-G406 PolarHBondContact O-N 2.94Å
405P60.1Low49.3Very low132 Ų132128 Ų12886%0.85781%0.814SS**PPolyproline II helixtrans-64.8118.2176.6-22.735.5000110.9G403G403-P405 VanDerWaalsContact O-CD 3.29Å; G403-P405 WeakPolarHBondContact O-CD 3.29Å
406G51.9Low48.7Very low72 Ų72127.7 Ų127.774%0.74281%0.81SS**PPolyproline II helixtrans-66.7146.8-179.400000112.5S404S404-G406 PolarHBondContact O-N 2.94Å
407R59.9Low47.7Very low236 Ų236123.7 Ų123.789%0.89180%0.797SS**PPolyproline II helixtrans-60.9137.7172.7-66.4172.8176-107.2-0.8110.1S409R407-S409 PolarHBondContact O-N 2.91Å
408P59.6Low47.4Very low127 Ų127128.1 Ų128.183%0.82580%0.8SS**PPolyproline II helixtrans-63.3133.717227.1-33.7000110.2
409S40.8Very low47Very low101 Ų101130.6 Ų130.671%0.70680%0.801SS**PPolyproline II helixtrans-83144.4168.5-67.80000109.8R407 T411R407-S409 PolarHBondContact O-N 2.91Å; S409-T411 PolarHBondContact O-N 3.46Å
410P49.8Very low46.2Very low123 Ų123128.8 Ų128.880%0.79979%0.787SS**  trans-73.299.8-17729.2-34.4000111.3
411T49.2Very low45.7Very low134 Ų134132.8 Ų132.882%0.82279%0.788SS**  trans-71.9133.4168.438.40000110.2S409S409-T411 PolarHBondContact O-N 3.46Å
412N41.7Very low44.7Very low155 Ų155132 Ų13283%0.82979%0.788SS**  trans-77.7130.7175.3-78.3-103.7000108.9
413F41.8Very low44Very low185 Ų185133 Ų13381%0.81179%0.788SS**  trans-95.3108.7-176.6-172.9-89.8000111.3Q415F413-Q415 HydrophobicContact CE1-CB 4.11Å
414T49.3Very low43.5Very low129 Ų129138.6 Ų138.679%0.79179%0.792SS**  trans-131.268.9168.852.90000111.3
415Q45.1Very low42.9Very low160 Ų160139.7 Ų139.775%0.74879%0.789SS**  trans27.597.2136.2-169.5179.920.900118.6F413F413-Q415 HydrophobicContact CE1-CB 4.11Å
416T39.9Very low41.7Very low125 Ų125140.8 Ų140.877%0.76779%0.787SS**  trans-146.695.4146.751.70000107.9
417S36.5Very low40.7Very low93 Ų93143 Ų14365%0.6579%0.791SS**  61.884.382.6730000115
418H42.6Very low39.3Very low196 Ų196137 Ų13791%0.90778%0.777SS**  trans-153.8167.6150.4-89.7-62.2000109.5
419T34.3Very low38.1Very low125 Ų125139.3 Ų139.377%0.76777%0.774SS**  trans-129.3176.6-155.648.90000114.1
420C33.7Very low37.6Very low97 Ų97140.5 Ų140.566%0.65578%0.782SS**  trans75.8123.2175.8-65.20000114.1
421E35.2Very low36.7Very low187 Ų187140.2 Ų140.287%0.87478%0.783SS**  67.3130.482.7-64.6172.3124.700113.1
422G32.7Very low35.8Very low71 Ų71138 Ų13873%0.73278%0.779SS**  cis174.5174.4-5.500000113.1
423L35.3Very low35.1Very low158 Ų158136.5 Ų136.583%0.82778%0.775SS**  trans51118.8152.8-59.9169.6000121.3
424F32.2Very low34.6Very low186 Ų186132.8 Ų132.882%0.81677%0.772SS**  trans68.9114.8136.6-76.5-59.2000123.9
425D29.3Very low33.7Very low141 Ų141135 Ų13575%0.75478%0.778SS**  94.1161118.2-148.618.2000120.8
426L35.7Very low32.9Very low155 Ų155130.4 Ų130.481%0.81277%0.774SS**  trans-88.9139.8-167.2-56.8157.5000111.4
427S30.5Very low32.4Very low118 Ų118133 Ų13383%0.82577%0.774SS**  trans-163.2163.4130.7-1530000114.7
428N30.8Very low32Very low112 Ų112137.8 Ų137.860%0.59978%0.78SS**  trans-61.8147.3-178.9-74-95.5000115.1
429K34.9Very low31.5Very low175 Ų175135.1 Ų135.176%0.76177%0.772SS**  41.2116.7128.7-49.6162-174.1143.40117.9
430S29.4Very low31.5Very low125 Ų125137 Ų13787%0.87477%0.772SS**  178.7162.3109.8-80.30000113.9
431S30.1Very low32.2Very low118 Ų118137.2 Ų137.283%0.82577%0.773SS**  trans-88132.9-166.7-50.90000115.5
432A31.3Very low32Very low88 Ų88136.3 Ų136.373%0.72777%0.768SS**  73.6147.5124.500000124.1
433T27.2Very low32Very low122 Ų122140.3 Ų140.375%0.74877%0.768SS**  trans98.1133.6144.6-21.40000120
434S29.8Very low31.8Very low108 Ų108138 Ų13876%0.75576%0.756SS**  trans67.4151150.240.90000120.6
435L31.2Very low32.1Very low175 Ų175136.9 Ų136.992%0.91675%0.751SS**  cis-171.6144.3-17.5170.865.9000110.8
436G28.2Very low32.2Very low64 Ų64136.2 Ų136.266%0.6675%0.753SS**  trans10115516200000115.7
437K28.7Very low32Very low179 Ų179132.5 Ų132.578%0.77874%0.744SS**  cis-155.9144.44-105.9-162.7175.4-170.10111.5
438Y29.6Very low32.3Very low193 Ų193136.5 Ų136.576%0.75775%0.747SS**  trans63.2155.4152.4-74.8-125.8000116.5
439D32.1Very low32.4Very low140 Ų140142.5 Ų142.575%0.74976%0.762SS**  cis-140.8-179.85.4-142.2-32.3000112.1
440Q34.1Very low33.4Very low164 Ų164139.6 Ų139.677%0.76676%0.761SS**  trans-120.7-167.6175.2-123.1-154-6.100110.7
441P47.5Very low33.3Very low103 Ų103139.8 Ų139.867%0.66976%0.756SS**  cis-132.1172.211.637.4-16.3000116.9
442E30.8Very low33.2Very low167 Ų167144.3 Ų144.378%0.7876%0.755SS**  174146.7112.7-91.2-170.3146.700113.1
443E33.8Very low33.1Very low156 Ų156148.6 Ų148.673%0.72976%0.757SS**  trans40.9111.6159.4-55.5-130.691.600120.8
444N31.2Very low33.2Very low109 Ų109147.3 Ų147.358%0.58375%0.753SS**  75.413576-69.2-28.8000114.2
445F37Very low33.1Very low162 Ų162147.7 Ų147.771%0.71175%0.751SS**  cis-158.2132.30.8-106.4-50.5000111.9
446T32.7Very low32.9Very low127 Ų127146.5 Ų146.578%0.77975%0.746SS**  trans59.3166.6151.558.10000119.5
447A31.3Very low32.9Very low77 Ų77152 Ų15264%0.63675%0.754SS**  cis-149.3138.411.100000114.9
448F35.8Very low33.9Very low203 Ų203148.7 Ų148.789%0.8975%0.751SS**  trans52150151.8-57.7-63.6000125
449R33.9Very low34.5Very low238 Ų238144.2 Ų144.290%0.89875%0.745SS**  trans-113.2-129.8170.3-72.2-174.3179.2-159.84.3110.8
450P55.6Low34.3Very low114 Ų114144.8 Ų144.874%0.7475%0.748SS**  -129.2173.9-118.641.6-23000115.6
451V26.7Very low34.1Very low128 Ų128143.9 Ų143.978%0.77675%0.748SS**  trans-160.1127156.9135.70000105.7
452R29.7Very low33.2Very low213 Ų213147.2 Ų147.280%0.80475%0.754SS**  83115.853.8-80.8-171.2174.5-172.61.5114.8
453K29.1Very low33Very low179 Ų179143.2 Ų143.278%0.77875%0.745SS**  trans76121140.7-71.3-168.3171.8-165.10121
454S28.2Very low32.8Very low95 Ų95141.3 Ų141.366%0.66474%0.744SS**  81.7115.5120.1-65.90000121.7
455T28.7Very low32.8Very low115 Ų115144.5 Ų144.571%0.70676%0.755SS**  88130.1117-60.10000119.6
456D27.3Very low32.3Very low151 Ų151142 Ų14281%0.80775%0.753SS**  trans68.5144.7161.7-60.3-18.2000122.7
457Q26.9Very low32.3Very low178 Ų178143.2 Ų143.283%0.83275%0.75SS**  trans-97.3-157.2167.6-42.1174.5-8.800107.7
458P50.1Low32.3Very low110 Ų110147 Ų14771%0.71476%0.755SS**  cis-117.6-134.2-25.425.50.6000106.8
459P42.2Very low32Very low99 Ų99144.7 Ų144.764%0.64375%0.752SS**  cis-142.3-177.8-1045-26.3000117.6
460L27.3Very low31.8Very low153 Ų153136.7 Ų136.780%0.80174%0.744SS**  trans65.1147.7170.8-82.560.9000116
461L29.8Very low30.6Very low145 Ų145134.7 Ų134.776%0.75974%0.743SS**  cis-167.1167-22.1-110.5177.6000104.7
462Q29.5Very low30.8Very low172 Ų172136.6 Ų136.680%0.80475%0.749SS**  cis-123.5-162.88-58.3178.9-16.200109
463S26.5Very low30.9Very low83 Ų83131.7 Ų131.758%0.5875%0.748SS**  cis-152.4146.72.8-171.70000111.2
464T28.9Very low31.7Very low117 Ų117128.3 Ų128.372%0.71874%0.744SS**  trans41.8132.2149.651.10000121.4
465Q30.9Very low31.8Very low176 Ų176129.6 Ų129.682%0.82275%0.748SS**  cis-161.3165.5-11-165.2153.2-22.100110.3
466T28.4Very low31.8Very low109 Ų109128.8 Ų128.867%0.66975%0.747SS**  trans-56154.9-172.448.60000116
467Q31.6Very low32.3Very low152 Ų152128.5 Ų128.571%0.7174%0.744SS**  cis66.7146.745.5-132.5-164.93800111.3
468Q30.6Very low32.5Very low157 Ų157126.7 Ų126.773%0.73474%0.74SS**  cis-138.7166.922-78166.5-9.200110.1
469D30.3Very low31.7Very low154 Ų154127.8 Ų127.882%0.82474%0.744SS**  cis89.3137.226.9-165.232.5000116.2
470G29Very low31.4Very low71 Ų71128.6 Ų128.673%0.73275%0.748SS**  trans91.4132.9167.200000120.1
471G31.2Very low31.7Very low71 Ų71128.5 Ų128.573%0.73275%0.748SS**  trans115105.9142.600000120.4
472D29.8Very low32Very low168 Ų168130 Ų13090%0.89875%0.751SS**  trans46.4140.7135.8-55-35.1000125.2
473S32.2Very low32.4Very low111 Ų111127.4 Ų127.478%0.77674%0.743SS**  trans-62.6163.9158.8-63.90000112
474P47.2Very low32.9Very low108 Ų108127.5 Ų127.570%0.70174%0.743SS**  cis-154.4179.83640.5-16.7000120.1
475T29.3Very low33.1Very low121 Ų121132.1 Ų132.174%0.74275%0.749SS**  trans58.4116.4146.345.90000123.9
476S29.2Very low33.1Very low98 Ų98130.5 Ų130.569%0.68575%0.751SS**  92.5146115.480.80000123.5
477I37.8Very low33.9Very low146 Ų146130.3 Ų130.375%0.74975%0.751SS**  trans58.4155.2162.471.5166.9000119
478N31.7Very low33.7Very low140 Ų140129.3 Ų129.375%0.74975%0.751SS**  cis-168.6-177.3-28.9-96.7-15.9000106.8
479V32.4Very low33.6Very low132 Ų132129.8 Ų129.880%0.875%0.753SS**  trans72.9141.5161.7163.80000115.6
480T35.2Very low33.4Very low117 Ų117127.2 Ų127.272%0.71875%0.747SS**  cis-169.3167.8-17.535.60000106.9
481D34.2Very low33.4Very low151 Ų151131 Ų13181%0.80775%0.745SS**  cis-175-148.1-34-147.1-79.8000107.3
482E36.8Very low33.3Very low175 Ų175133.7 Ų133.782%0.81874%0.742SS**  trans79.2147.4165.1-63.3-141.1157.300120.2
483D36.6Very low33.5Very low119 Ų119131.8 Ų131.864%0.63673%0.732SS**  cis-167.9177.3-26.8-171.935.8000111.4
484S36.8Very low33.6Very low84 Ų84135.2 Ų135.259%0.58774%0.736SS**  trans101.495.7136-90.10000123.1
485Y34.4Very low32.7Very low214 Ų214133.6 Ų133.684%0.83974%0.738SS**  trans69.1160.1131.1-70.6-76.1000125.5
486V29.8Very low32.8Very low142 Ų142133.1 Ų133.186%0.86174%0.74SS**  trans-130.5-110.2179.3-161.40000111.3
487P46.3Very low33Very low105 Ų105136.3 Ų136.368%0.68275%0.749SS**  cis-134.6169.9-17.245-27000117.5
488N27.9Very low32.7Very low132 Ų132133.6 Ų133.671%0.70674%0.743SS**  trans44.2149.3145.6-92.927000127.7
489E28Very low32.6Very low166 Ų166134.5 Ų134.578%0.77675%0.748SS**  trans72.3148.4141.3-77.6171.899.100121.7
490C24.7Very low32.7Very low101 Ų101134.1 Ų134.168%0.68275%0.745SS**  cis-166.5-178.7-23.7-141.30000112.8
491H30.5Very low32.7Very low151 Ų151136.5 Ų136.570%0.69975%0.748SS**  trans76.6113.2160.2-77.4-62.9000123.4
492N27.8Very low33.1Very low126 Ų126136.9 Ų136.967%0.67475%0.751SS**  53.4144.2118.3-58.917.5000120.7
493N34.9Very low33Very low129 Ų129135.8 Ų135.869%0.6975%0.751SS**  cis-170.31751.5-116.228000107.7
494E35.1Very low33.1Very low183 Ų183135.8 Ų135.886%0.85576%0.755SS**  cis-135.3-170.2-0.6-62.5-164.514500109.6
495G28Very low33.3Very low73 Ų73135.1 Ų135.175%0.75376%0.761SS**  trans152.864.2159.900000119.4
496S31.2Very low33.4Very low111 Ų111133.3 Ų133.378%0.77676%0.764SS**  trans38.8114.9152.4-62.20000123.3
497L33.7Very low33.8Very low166 Ų166130.6 Ų130.687%0.86976%0.757SS**  trans67.1142.8142.2-52.9173.7000120.1
498S31Very low34.7Very low89 Ų89130.9 Ų130.962%0.62276%0.758SS**  cis-169158.6-17.152.60000112.5
499N28.7Very low35.1Very low159 Ų159131.3 Ų131.385%0.8576%0.76SS**  trans91.9113.8171-55.2-59.6000119.5
500T34.7Very low35.5Very low123 Ų123129.8 Ų129.876%0.75576%0.757SS**  trans-93.7-175.5160.7350000110.4
501E36.8Very low36Very low167 Ų167132.4 Ų132.478%0.7876%0.763SS**  cis-153.8165.6426.5-135.58300110.3
502D41.4Very low36.1Very low160 Ų160130.5 Ų130.586%0.85677%0.767SS**  trans-88.6176.3177.6-52.6-89.8000114
503D34.7Very low36.8Very low152 Ų152133.5 Ų133.581%0.81377%0.774SS**  165.9-168.3113.5-160.615000113.3
504T38.7Very low37Very low118 Ų118136.6 Ų136.672%0.72478%0.782SS**  trans-141.7122-137.6-45.90000116.3
505G40.2Very low37.7Very low70 Ų70133.6 Ų133.672%0.72278%0.778SS**  trans84.6175.2136.100000122.2
506I37.9Very low37.9Very low177 Ų177136.2 Ų136.291%0.90878%0.775SS**  trans74.6160.7167.5-45.3174.6000116.1
507A38.8Very low38.1Very low85 Ų85136.8 Ų136.870%0.70277%0.774SS**  trans-151.6-165.4-171.400000109.4
508P63.7Low38Very low110 Ų110135.6 Ų135.671%0.71477%0.768SS**  cis-137-166.7-16.240.5-21.4000114.9
509L36.5Very low38Very low141 Ų141137.1 Ų137.174%0.73877%0.774SS**  trans86.9133.8148.3-81.5170.4000123.8
510N36.4Very low37.9Very low134 Ų134133 Ų13372%0.71777%0.769SS**  trans69.4159.7160-54.3-43.6000116.5
511L34.5Very low38.5Very low156 Ų156133.2 Ų133.282%0.81777%0.772SS**  cis-145.2150.923.8-87.5169.8000115.1
512S34.1Very low38.1Very low111 Ų111130 Ų13078%0.77677%0.774SS**  trans72.4-172.3132.884.70000123.1
513K42.3Very low37.5Very low190 Ų190130 Ų13083%0.82677%0.769SS**  trans-155151.5-157.7-64.1179.1177.7176.40113.1
514K38.9Very low37.2Very low193 Ų193129.3 Ų129.384%0.83976%0.76SS**  trans68.1168.5163.2-70.1-168.3173.3-155.70115.8
515P48.9Very low36.9Very low121 Ų121131.2 Ų131.279%0.78676%0.761SS**  cis-128.3-160.16.543.9-26.8000115.7
516D32.9Very low36.5Very low128 Ų128132 Ų13268%0.68476%0.761SS**  trans-103.2-174.6-161.3-52.3-98.7000117
517T35.8Very low35.9Very low122 Ų122134.2 Ų134.275%0.74876%0.759SS**  trans81.5119.7153.860.70000123.2
518N30.4Very low35.7Very low142 Ų142138.9 Ų138.976%0.75976%0.764SS**  161.3164.3107.3-86.7-72.7000112.2
519T31.3Very low33.9Very low121 Ų121138.5 Ų138.574%0.74276%0.764SS**  cis-170.4122.1-42.2-80.60000111.6
520G27.8Very low33.7Very low71 Ų71137.8 Ų137.873%0.73277%0.765SS**  trans68.3-177.1158.900000119.8
521P45.6Very low33.5Very low129 Ų129136 Ų13684%0.83876%0.763SS**  cis-140.5178.1-9.242.9-25.5000117.5
522A30.1Very low33.4Very low98 Ų98137.3 Ų137.381%0.8176%0.762SS**  trans69.1159.5164.600000118.8
523H29Very low33.3Very low161 Ų161134.1 Ų134.175%0.74574%0.743SS**  cis-151.6157.21.3-146.8-60.5000110.6
524E27.7Very low32.7Very low137 Ų137130.1 Ų130.164%0.6473%0.727SS**  trans0.4163.5162.6-73.9-176.7129.500124.7
525H32.6Very low32.6Very low158 Ų158124.1 Ų124.173%0.73171%0.71SS**  cis-146165.617.6-98.9-41.7000112.4
526A30.5Very low31.8Very low88 Ų88124.5 Ų124.573%0.72770%0.701SS**  trans19138.4153.400000121.5
527Y27.1Very low31.9Very low223 Ų223124.6 Ų124.688%0.87570%0.701SS**  cis-146.2168.347.6-136.2-94.6000114.8
528K33Very low31.5Very low182 Ų182127.8 Ų127.879%0.79171%0.705SS**  trans-65.6151.7176-59.2167.5-178.6172.20110.6
529S26.5Very low31.9Very low102 Ų102126.7 Ų126.771%0.71370%0.699SS**  cis-153.6-169.613.4-136.90000109.1
530T32.1Very low32.2Very low126 Ų126127.6 Ų127.677%0.77369%0.694SS**  cis-156.5169.622-23.10000112.4
531S31.7Very low32.9Very low96 Ų96132.7 Ų132.767%0.67170%0.704SS**  trans-74.6165.5168.248.10000114.5
532K32.6Very low32.4Very low184 Ų184133.1 Ų133.180%0.870%0.695SS**  cis-166.4155.3-8.4-106.3173.2175.6-173.70105.1
533A32.7Very low32.9Very low44 Ų44135.8 Ų135.836%0.36470%0.695SS.*  cis128.7154.86.600000106L351 S352 P353L351-A533 CarbonylContact C-O 3.04Å; L351-A533 CarbonylContact O-C 2.95Å; L351-A533 PolarHBondContact O-N 3.24Å; L351-A533 VanDerWaalsContact O-N 3.17Å; S352-A533 PolarHBondContact N-O 3.41Å; P353-A533 WeakPolarHBondContact CD-O 3.29Å
534E29.9Very low34.1Very low106 Ų106132.7 Ų132.750%0.49568%0.683SS.*  trans155.8-170.2161158.1-64.3-134.500118.6L351 P353L351-E534 WeakPolarHBondContact CB-O 3.38Å; L351-E534 PolarHBondContact O-N 3.15Å; P353-E534 VanDerWaalsContact C-OE1 3.32Å; P353-E534 VanDerWaalsContact C-OE2 3.28Å; P353-E534 WeakPolarHBondContact CA-OE1 3.22Å; P353-E534 WeakPolarHBondContact CA-OE2 3.33Å; P353-E534 HydrophobicContact CB-CB 3.84Å; P353-E534 HydrophobicContact CB-CG 2.28Å; P353-E534 WeakPolarHBondContact CB-OE1 3.43Å; P353-E534 VanDerWaalsContact CD-OE1 3.27Å; P353-E534 WeakPolarHBondContact CD-OE1 3.29Å; P353-E534 WeakPolarHBondContact CD-OE2 3.3Å; P353-E534 HydrophobicContact CG-CB 3.33Å; P353-E534 HydrophobicContact CG-CG 2.3Å; P353-E534 WeakPolarHBondContact CG-OE1 3.29Å; P353-E534 WeakPolarHBondContact CG-OE2 3.4Å
535S36.3Very low35.4Very low68 Ų68129.5 Ų129.548%0.47667%0.674SS.*  trans-168.6134.3161.558.50000115.7S352 P353 S354S352-S535 CarbonylContact O-C 3.56Å; S352-S535 WeakPolarHBondContact O-CA 3.42Å; S352-S535 PolarHBondContact O-N 2.94Å; P353-S535 CarbonylContact C-O 2.91Å; P353-S535 VanDerWaalsContact CA-O 3.27Å; P353-S535 WeakPolarHBondContact CA-O 3.33Å; P353-S535 VanDerWaalsContact N-N 3.18Å; S354-S535 WeakPolarHBondContact CB-O 3.47Å; S354-S535 PolarHBondContact N-O 2.94Å; S354-S535 VanDerWaalsContact N-O 3.16Å; S354-S535 PolarHBondContact OG-O 3.46Å
536Q32.6Very low36Very low129 Ų129128.3 Ų128.360%0.60367%0.672SS**  trans-130.7149.9167.2-70.1-133.3-10.700112.7S352 P353S352-Q536 PolarHBondContact O-N 3.19Å; P353-Q536 VanDerWaalsContact O-CD 3.27Å; P353-Q536 WeakPolarHBondContact O-CG 3.31Å; P353-Q536 PolarHBondContact O-NE2 2.87Å
537N34.3Very low36.5Very low130 Ų130128.9 Ų128.970%0.69566%0.663SS**  trans-101.4149.1177.4-52.1-94.1000110
538F28.5Very low37.2Very low188 Ų188123.5 Ų123.583%0.82565%0.649SS**  -163.4179.4119.3-128.1-120.4000114.2
539L37.4Very low37.7Very low119 Ų119120.1 Ų120.162%0.62365%0.648SS**  trans-54.5162.2-174.1-9456.8000117.8
540E39.1Very low38.2Very low140 Ų140121 Ų12165%0.65465%0.649SS**  trans64.2111.1132.7-170.2162.8-149.200120.4
541L41.6Very low38.5Very low178 Ų178123.5 Ų123.593%0.93265%0.649SS**  trans-117.8113.4148.2-92.380.5000109
542Q35.8Very low38.7Very low139 Ų139126.3 Ų126.365%0.6566%0.656SS**  trans-78158.1151.6-76.9-168.93400110
543D40.5Very low39Very low153 Ų153121.9 Ų121.982%0.81865%0.648SS**  trans-75.5137.9-177-157.9-2.4000111.4P545D543-P545 WeakPolarHBondContact O-CD 3.07Å
544M54.1Low38.9Very low97 Ų97126.1 Ų126.148%0.47867%0.674SS.*  trans-120.394.4-166-168.360.859.700110.8I148I148-M544 HydrophobicContact CB-CE 4.08Å; I148-M544 HydrophobicContact CB-SD 4.33Å; I148-M544 HydrophobicContact CG2-CE 4Å; I148-M544 HydrophobicContact CG2-SD 3.67Å; I148-M544 WeakPolarHBondContact O-CE 3.19Å
545P55.1Low39.2Very low70 Ų70128.9 Ų128.946%0.45569%0.692SS.*PPolyproline II helixtrans-75.8154.8-173.426.7-28.8000112.9M150 D543M150-P545 PolarHBondContact N-O 2.95Å; M150-P545 VanDerWaalsContact N-O 3.11Å; M150-P545 CarbonylContact O-C 2.89Å; M150-P545 WeakPolarHBondContact O-CA 3.39Å; M150-P545 WeakPolarHBondContact O-CB 3.47Å; M150-P545 VanDerWaalsContact O-CG 3.27Å; M150-P545 WeakPolarHBondContact O-CG 3.43Å; D543-P545 WeakPolarHBondContact O-CD 3.07Å
546L44.8Very low39.1Very low133 Ų133132.7 Ų132.770%0.69671%0.713SS**PPolyproline II helixtrans-85.3125.2-170.5-93.771.9000113.5M150 Q151 L548M150-L546 CarbonylContact O-C 3.48Å; M150-L546 PolarHBondContact O-N 3.25Å; Q151-L546 CarbonylContact C-O 3.12Å; L546-L548 PolarHBondContact O-N 3.38Å
547N40Very low39Very low99 Ų99130.2 Ų130.253%0.52972%0.722SS.*PPolyproline II helixtrans-64.2119.4158.2-96.3-40.3000111.3M150 Q151M150-N547 HydrophobicContact CB-CB 4.43Å; M150-N547 WeakPolarHBondContact CB-OD1 3.21Å; M150-N547 WeakPolarHBondContact CG-ND2 3.34Å; M150-N547 PolarHBondContact SD-ND2 3.38Å; Q151-N547 PolarHBondContact O-OD1 3.09Å
548L41.7Very low38.8Very low111 Ų111129 Ų12958%0.58172%0.723SS**  trans-12091.6164.4-68.6179.1000109.8L546L546-L548 PolarHBondContact O-N 3.38Å
549S43.7Very low38.9Very low111 Ų111126.8 Ų126.878%0.77672%0.719SS**  trans-93.1105.6174.647.60000111.2
550V38.8Very low38.7Very low121 Ų121129.1 Ų129.173%0.73373%0.725SS**  trans-83.7125.5166.4-172.40000108
551K37Very low38.2Very low177 Ų177128.5 Ų128.577%0.7773%0.731SS**  trans-11169.6-165-169.1-165.2170.9-179.30112.5S553K551-S553 PolarHBondContact O-N 3.37Å; K551-S553 PolarHBondContact O-OG 3.07Å
552D35.5Very low37.7Very low155 Ų155123.4 Ų123.483%0.82971%0.714SS**  trans-73.4119.9171.5-70.2-43.4000110.6
553S39.3Very low37.4Very low91 Ų91125.6 Ų125.664%0.63672%0.722SS**  trans-114.492.1-168.9-59.10000111.1K551K551-S553 PolarHBondContact O-N 3.37Å; K551-S553 PolarHBondContact O-OG 3.07Å
554C30.9Very low36.9Very low133 Ų133127.1 Ų127.190%0.89972%0.724SS**  trans-136.8105.6169.8-74.20000109.4
555N36.9Very low35.6Very low164 Ų164127.8 Ų127.888%0.87774%0.738SS**  trans-153.790.5-176-159.23.4000113
556T33.1Very low34.9Very low149 Ų149130.1 Ų130.191%0.91475%0.753SS**  trans-165134.4168.334.40000106.6
557G30.5Very low34.1Very low77 Ų77128.6 Ų128.679%0.79476%0.76SS**  cis-158.4-164.8-16.900000106.2
558S30.3Very low33.9Very low103 Ų103133.1 Ų133.172%0.7278%0.777SS**  cis-170166.2-3.7-172.40000107.9
559L31.7Very low33.7Very low142 Ų142136 Ų13674%0.74379%0.788SS**  trans71.5149.9170.1-47.3-179.3000115.7
560K32.1Very low33.2Very low169 Ų169138.2 Ų138.274%0.73579%0.791SS**  cis-158.3148.8-0.3-126.5165.7-172.7176.30111.7
561T30Very low32.9Very low127 Ų127135.9 Ų135.978%0.77979%0.792SS**  trans16.5149.1142.459.80000121.2
562A29.8Very low32.8Very low71 Ų71132.6 Ų132.659%0.58780%0.797SS**  cis-167.6169.430.300000115.4
563F30Very low32.6Very low185 Ų185129.4 Ų129.481%0.81179%0.792SS**  trans34135.1156.1-46.2-65000120.9
564H29.9Very low32.3Very low185 Ų185132.2 Ų132.286%0.85681%0.806SS**  cis-157.2160.947.6-96.4-90.5000114.2
565S25.7Very low32.3Very low111 Ų111131.1 Ų131.178%0.77680%0.8SS**  trans-92.7-168171.1-25.70000111.7
566P42.2Very low33.1Very low118 Ų118128.6 Ų128.677%0.76679%0.793SS**  cis-124.11581.940.8-23.6000114.5
567A27.9Very low32.9Very low102 Ų102129.9 Ų129.984%0.84379%0.785SS**  83.6134.167.700000117.2
568H35.3Very low33.7Very low193 Ų193131.1 Ų131.189%0.89478%0.779SS**  trans-89.3158.5171.2-105.6-99.1000111.1
569E37.1Very low33.7Very low171 Ų171133 Ų13380%0.79978%0.777SS**  -179.2175.5125.8-110.9-164.4149.600116.8
570N33.8Very low33.7Very low158 Ų158133.3 Ų133.385%0.84578%0.779SS**  trans85.3135.4168.7-54.5-56.1000118.7
571G31.8Very low33.7Very low73 Ų73132.3 Ų132.375%0.75378%0.777SS**  cis174.2142.6-11.300000116.4
572A34.3Very low33.8Very low107 Ų107132.4 Ų132.488%0.88477%0.773SS**  trans38.7137.9155.100000125
573A32Very low33.9Very low88 Ų88134.1 Ų134.173%0.72778%0.781SS**  172111.9124.600000118.3
574T32.7Very low33.8Very low150 Ų150134.1 Ų134.192%0.9279%0.785SS**  trans56.9170139.746.30000125.7
575S31Very low33.9Very low110 Ų110128.7 Ų128.777%0.76977%0.772SS**  trans-139.1-156-163.160.10000111.9
576P54Low34.1Very low112 Ų112131 Ų13173%0.72778%0.776SS**  cis-145.5170.2-9.742-22.4000119.7
577K28.4Very low33.6Very low175 Ų175129.1 Ų129.176%0.76177%0.771SS**  trans59.4174.5150-106.2-162.2172.9-159.90120.7E579K577-E579 VanDerWaalsContact CE-OE1 3.25Å; K577-E579 WeakPolarHBondContact CE-OE1 3.34Å; K577-E579 IonicContact NZ-OE1 3.47Å; K577-E579 PolarHBondContact NZ-OE1 3.29Å
578P46.8Very low33.5Very low103 Ų103131 Ų13167%0.66978%0.776SS**  cis-137.3168.8-9.243.3-25.4000119.5
579E30.2Very low33.1Very low144 Ų144129 Ų12967%0.67377%0.772SS**  trans45.9120.3138.6-78136.6-119.700129.2K577K577-E579 VanDerWaalsContact CE-OE1 3.25Å; K577-E579 WeakPolarHBondContact CE-OE1 3.34Å; K577-E579 IonicContact NZ-OE1 3.47Å; K577-E579 PolarHBondContact NZ-OE1 3.29Å
580N31.9Very low33.5Very low148 Ų148125.3 Ų125.379%0.79176%0.763SS**  91.6155.6114.2-145.719.8000125.9
581E33.4Very low33.3Very low148 Ų148127.5 Ų127.569%0.69277%0.765SS**  trans81.6111.4157-58.6-141.978.700126.5
582N31.3Very low33.2Very low129 Ų129131 Ų13169%0.6977%0.766SS**  62.9115.6120.7-72.8-31.4000128.3
583S31.6Very low33.5Very low107 Ų107131 Ų13175%0.74876%0.757SS**  88166.1120.1810000124.3
584M28.8Very low33.4Very low185 Ų185133.4 Ų133.491%0.91176%0.756SS**  trans68.3153.3175.2-72.9-163164.100118.8
585A31.7Very low33.2Very low70 Ų70133.5 Ų133.558%0.57975%0.751SS**  cis-166.9166.1-23.800000111
586D29.2Very low33.1Very low159 Ų159134.4 Ų134.485%0.8576%0.757SS**  trans58.4169.6158.8-62.9-34000121.4
587A31.7Very low32Very low80 Ų80134 Ų13466%0.66176%0.763SS**  171.7118.9-60.400000109.8
588C27.1Very low31.9Very low141 Ų141129 Ų12995%0.95376%0.762SS**  trans-176.7154.3140.5-100.60000113.5
589N26.1Very low31Very low150 Ų150131.7 Ų131.780%0.80277%0.771SS**  trans-126.4-164.9171-142.9-11.6000105.1
590P44.8Very low31.3Very low94 Ų94133.8 Ų133.861%0.6178%0.778SS**  cis-125.3169-36.938.6-25.7000112.6
591K29.5Very low31.2Very low205 Ų205131.8 Ų131.889%0.89177%0.774SS**  179.7149.8125-101.7160.7-177173.40113.7
592N29.8Very low31.1Very low147 Ų147128.8 Ų128.879%0.78677%0.769SS**  trans-125.9149.2164.6-151.6-16.9000105.9
593P41.5Very low31Very low106 Ų106132.1 Ų132.169%0.68878%0.778SS**  -153.6140.5113.836-17.2000117.6
594I30.3Very low31.2Very low138 Ų138134.4 Ų134.471%0.70879%0.788SS**  67.9113.4128.6-59.5172.6000120
595N29.3Very low31.7Very low152 Ų152129.5 Ų129.581%0.81378%0.777SS**  trans38.5128.4139.2-48.4-7.3000122.1
596S28.7Very low32.1Very low129 Ų129134.2 Ų134.290%0.90279%0.786SS**  -173.7171.4106.7-159.20000112.8
597A29.5Very low32.7Very low103 Ų103136.1 Ų136.185%0.85178%0.781SS**  trans-78.8165.8-169.200000116.4
598G26.1Very low33.4Very low71 Ų71137.9 Ų137.973%0.73278%0.78SS**  trans177.896.9169.300000117.3
599D29.3Very low34.3Very low160 Ų160138 Ų13886%0.85677%0.766SS**  trans67170.9146.6-89.2-52.2000125.7
600K36Very low35.5Very low187 Ų187133.5 Ų133.581%0.81375%0.751SS**  trans-101.4-178.7-167.8-54.2163.5-175.2161.90110.4
601C29.3Very low35.8Very low107 Ų107133.8 Ų133.872%0.72374%0.743SS**  cis-162.2166.218.6-150.50000113.6
602S31.8Very low36.8Very low84 Ų84128.8 Ų128.859%0.58773%0.727SS**  trans18133151.561.40000122.9
603F29.8Very low38Very low200 Ų200127.8 Ų127.888%0.87772%0.721SS**  -179.9106126-98.5-60.6000113.6
604T34.8Very low38.7Very low155 Ų155131.1 Ų131.195%0.95172%0.719SS**  trans-152.562.4171.739.30000113.7
605A38.6Very low40.2Very low82 Ų82129.7 Ų129.768%0.67871%0.712SS**  trans-111.4-25.1179.600000115.7
606H40.3Very low41.6Very low168 Ų168126.9 Ų126.978%0.77870%0.696SS**SBendtrans-94.17.8-164.2-97.6-64.5000117.1
607R42.5Very low43.2Very low199 Ų199126.4 Ų126.475%0.75168%0.683SS**SBendtrans-79.3-23.2-170.1-160.2172.9-171.9178.23114.9
608N45.5Very low45Very low118 Ų118124.7 Ų124.763%0.63167%0.666SS**SBendtrans-82.3-42.9-158.5-60.5-10.3000114A610 Q611 D612N608-A610 VanDerWaalsContact C-N 3.27Å; N608-A610 PolarHBondContact O-N 3.28Å; N608-Q611 PolarHBondContact O-N 3.15Å; N608-D612 PolarHBondContact O-N 3.2Å
609E47.9Very low47.3Very low142 Ų142123.7 Ų123.766%0.66465%0.647SS**Hα-helixtrans-63-33.4-177.6-63.8176.3121.900112.5Q611 D612 L613E609-Q611 PolarHBondContact O-N 3Å; E609-D612 PolarHBondContact O-N 3.04Å; E609-L613 PolarHBondContact O-N 3.43Å
610A49.6Very low50Low57 Ų57119.7 Ų119.747%0.47163%0.625SS.*Hα-helixtrans-77.9-0.1177.600000114.5N608 R614N608-A610 VanDerWaalsContact C-N 3.27Å; N608-A610 PolarHBondContact O-N 3.28Å; A610-R614 PolarHBondContact O-NE 3.43Å; A610-R614 PolarHBondContact O-NH2 2.92Å; A610-R614 VanDerWaalsContact O-NH2 3.09Å
611Q52.8Low52.3Low99 Ų99116.8 Ų116.846%0.46361%0.614SS.*Hα-helixtrans-98.1-44.5164.4-68.3-172.2-91.400110.8N608 E609 L613 R614 I615N608-Q611 PolarHBondContact O-N 3.15Å; E609-Q611 PolarHBondContact O-N 3Å; Q611-L613 PolarHBondContact O-N 2.81Å; Q611-R614 PolarHBondContact O-N 3.47Å; Q611-I615 WeakPolarHBondContact O-CG1 3.17Å; Q611-I615 PolarHBondContact O-N 3.02Å
612D50.5Low55.2Low100 Ų100118.3 Ų118.354%0.53561%0.611SS.*Hα-helixtrans-58.7-46.1-175.6-15429.5000112.3N608 E609 R614 I615 I616N608-D612 PolarHBondContact O-N 3.2Å; E609-D612 PolarHBondContact O-N 3.04Å; D612-R614 VanDerWaalsContact C-N 3.27Å; D612-R614 PolarHBondContact O-N 3.38Å; D612-I615 PolarHBondContact O-N 3.17Å; D612-I615 VanDerWaalsContact O-N 3.13Å; D612-I616 WeakPolarHBondContact O-CG1 3.47Å; D612-I616 PolarHBondContact O-N 3.04Å
613L54.3Low58.1Low127 Ų127119.7 Ų119.767%0.66561%0.607SS**Hα-helixtrans-59.9-31.9175.9-68.1175.5000113.9E609 Q611 D617E609-L613 PolarHBondContact O-N 3.43Å; Q611-L613 PolarHBondContact O-N 2.81Å; L613-D617 PolarHBondContact O-N 3.03Å
614R56.3Low61.1Low175 Ų175116.7 Ų116.766%0.6660%0.595SS**Hα-helixtrans-82.4-26.1177.6-75-171.8-73.5172.8-3.9113.2A610 Q611 D612 S618A610-R614 PolarHBondContact O-NE 3.43Å; A610-R614 PolarHBondContact O-NH2 2.92Å; A610-R614 VanDerWaalsContact O-NH2 3.09Å; Q611-R614 PolarHBondContact O-N 3.47Å; D612-R614 VanDerWaalsContact C-N 3.27Å; D612-R614 PolarHBondContact O-N 3.38Å; R614-S618 VanDerWaalsContact O-CB 3.3Å; R614-S618 WeakPolarHBondContact O-CB 3.49Å; R614-S618 PolarHBondContact O-N 3.3Å; R614-S618 VanDerWaalsContact O-N 3.15Å
615I60.5Low63.9Low108 Ų108113.6 Ų113.655%0.55458%0.576SS**Hα-helixtrans-70.1-37.8172.1-66.8163.1000110Q611 D612 C619Q611-I615 WeakPolarHBondContact O-CG1 3.17Å; Q611-I615 PolarHBondContact O-N 3.02Å; D612-I615 PolarHBondContact O-N 3.17Å; D612-I615 VanDerWaalsContact O-N 3.13Å; I615-C619 VanDerWaalsContact O-CB 3.29Å; I615-C619 WeakPolarHBondContact O-CB 3.27Å; I615-C619 PolarHBondContact O-N 2.79Å; I615-C619 VanDerWaalsContact O-N 3.08Å
616I60.6Low66.5Low93 Ų93111.9 Ų111.948%0.47756%0.562SS.*Hα-helixtrans-64-49.8176-66.4163.6000111.2D612 C619 D620D612-I616 WeakPolarHBondContact O-CG1 3.47Å; D612-I616 PolarHBondContact O-N 3.04Å; I616-C619 WeakPolarHBondContact O-CB 3.09Å; I616-C619 PolarHBondContact O-N 2.94Å; I616-C619 VanDerWaalsContact O-N 3.16Å; I616-D620 PolarHBondContact O-N 3.41Å
617D61.1Low69Low119 Ų119106.3 Ų106.364%0.63655%0.545SS*.Hα-helixtrans-62.9-47.1-178.4-159.226.1000111.7L613 C619 D620 E621L613-D617 PolarHBondContact O-N 3.03Å; D617-C619 PolarHBondContact O-N 3.46Å; D617-D620 PolarHBondContact O-N 3.29Å; D617-E621 PolarHBondContact O-N 3.07Å
618S67.2Low71.4Confident68 Ų68100.7 Ų100.748%0.47653%0.533SS..Hα-helixtrans-59.8-32.4174.1-176.80000112.9R614 Q622R614-S618 VanDerWaalsContact O-CB 3.3Å; R614-S618 WeakPolarHBondContact O-CB 3.49Å; R614-S618 PolarHBondContact O-N 3.3Å; R614-S618 VanDerWaalsContact O-N 3.15Å; S618-Q622 VanDerWaalsContact O-CB 3.29Å; S618-Q622 WeakPolarHBondContact O-CB 3.39Å; S618-Q622 PolarHBondContact O-N 3.26Å
619C75.8Confident73.8Confident50 Ų5097 Ų9734%0.33852%0.519SS..Hα-helixtrans-69.4-33.1175.4-166.30000112.3I615 I616 D617 K623I615-C619 VanDerWaalsContact O-CB 3.29Å; I615-C619 WeakPolarHBondContact O-CB 3.27Å; I615-C619 PolarHBondContact O-N 2.79Å; I615-C619 VanDerWaalsContact O-N 3.08Å; I616-C619 WeakPolarHBondContact O-CB 3.09Å; I616-C619 PolarHBondContact O-N 2.94Å; I616-C619 VanDerWaalsContact O-N 3.16Å; D617-C619 PolarHBondContact O-N 3.46Å; C619-K623 WeakPolarHBondContact O-CD 3.4Å; C619-K623 WeakPolarHBondContact O-CE 3.42Å; C619-K623 WeakPolarHBondContact O-CG 3.41Å; C619-K623 PolarHBondContact O-N 2.95Å; C619-K623 VanDerWaalsContact O-N 3.13Å; C619-K623 WeakPolarHBondContact SG-CE 3.21Å; C619-K623 PolarHBondContact SG-NZ 2.98Å
620D84.1Confident76Confident75 Ų7595.8 Ų95.840%0.40152%0.516SS..Hα-helixtrans-80.1-34.9175.4-833.4000112.5I616 D617 Q622 K623 Q624I616-D620 PolarHBondContact O-N 3.41Å; D617-D620 PolarHBondContact O-N 3.29Å; D620-Q622 VanDerWaalsContact C-N 3.34Å; D620-K623 PolarHBondContact O-N 3.09Å; D620-K623 WeakPolarHBondContact OD1-CD 3.47Å; D620-K623 IonicContact OD1-NZ 3.07Å; D620-K623 PolarHBondContact OD1-NZ 3.05Å; D620-Q624 VanDerWaalsContact O-CG 3.3Å; D620-Q624 WeakPolarHBondContact O-CG 3.16Å; D620-Q624 PolarHBondContact O-N 3.14Å; D620-Q624 PolarHBondContact O-NE2 3.35Å
621E85.9Confident78Confident126 Ų12697.3 Ų97.359%0.58952%0.522SS*.Hα-helixtrans-60.3-43.1168-174.3-179.3-16200111.3D617 K623 Q624 T625D617-E621 PolarHBondContact O-N 3.07Å; E621-K623 PolarHBondContact O-N 3.07Å; E621-Q624 PolarHBondContact O-N 3.33Å; E621-T625 WeakPolarHBondContact O-CB 3.44Å; E621-T625 PolarHBondContact O-N 3.24Å; E621-T625 PolarHBondContact O-OG1 3.33Å
622Q90.3Very high79.8Confident140 Ų14098.5 Ų98.565%0.65453%0.528SS*.Hα-helixtrans-64.1-38.9175.8-168.4179.627.400112.1S618 D620 A626S618-Q622 VanDerWaalsContact O-CB 3.29Å; S618-Q622 WeakPolarHBondContact O-CB 3.39Å; S618-Q622 PolarHBondContact O-N 3.26Å; D620-Q622 VanDerWaalsContact C-N 3.34Å; Q622-A626 VanDerWaalsContact O-CB 3.29Å; Q622-A626 WeakPolarHBondContact O-CB 3.27Å; Q622-A626 PolarHBondContact O-N 3.1Å
623K91Very high81.6Confident113 Ų11399.9 Ų99.949%0.49153%0.534SS..Hα-helixtrans-65.2-42.6173.9-72.5161.4-148.8151.30112C619 D620 E621 A626 A627C619-K623 WeakPolarHBondContact O-CD 3.4Å; C619-K623 WeakPolarHBondContact O-CE 3.42Å; C619-K623 WeakPolarHBondContact O-CG 3.41Å; C619-K623 PolarHBondContact O-N 2.95Å; C619-K623 VanDerWaalsContact O-N 3.13Å; C619-K623 WeakPolarHBondContact SG-CE 3.21Å; C619-K623 PolarHBondContact SG-NZ 2.98Å; D620-K623 PolarHBondContact O-N 3.09Å; D620-K623 WeakPolarHBondContact OD1-CD 3.47Å; D620-K623 IonicContact OD1-NZ 3.07Å; D620-K623 PolarHBondContact OD1-NZ 3.05Å; E621-K623 PolarHBondContact O-N 3.07Å; K623-A626 PolarHBondContact O-N 3.17Å; K623-A627 WeakPolarHBondContact O-CB 3.45Å; K623-A627 PolarHBondContact O-N 3.38Å
624Q93.5Very high82.9Confident136 Ų13697.4 Ų97.464%0.63653%0.532SS*.Hα-helixtrans-63.4-46.1176.8-72.8173.361.500111D620 E621 A626 A627 V628D620-Q624 VanDerWaalsContact O-CG 3.3Å; D620-Q624 WeakPolarHBondContact O-CG 3.16Å; D620-Q624 PolarHBondContact O-N 3.14Å; D620-Q624 PolarHBondContact O-NE2 3.35Å; E621-Q624 PolarHBondContact O-N 3.33Å; Q624-A626 PolarHBondContact O-N 3.29Å; Q624-A627 PolarHBondContact O-N 3.29Å; Q624-V628 WeakPolarHBondContact O-CG2 3.25Å; Q624-V628 PolarHBondContact O-N 3.29Å
625T93.3Very high84Confident90 Ų9093 Ų9355%0.55253%0.533SS*.Hα-helixtrans-60-45.5175.7-56.50000111.7E621 A627 V628 A629E621-T625 WeakPolarHBondContact O-CB 3.44Å; E621-T625 PolarHBondContact O-N 3.24Å; E621-T625 PolarHBondContact O-OG1 3.33Å; T625-A627 PolarHBondContact O-N 3.45Å; T625-V628 PolarHBondContact O-N 3.35Å; T625-A629 WeakPolarHBondContact O-CB 2.99Å; T625-A629 PolarHBondContact O-N 3.21Å
626A93.1Very high84.7Confident47 Ų4797.1 Ų97.139%0.38854%0.543SS..Hα-helixtrans-64.4-38.1175.900000112.7Q622 K623 Q624 A629 L630Q622-A626 VanDerWaalsContact O-CB 3.29Å; Q622-A626 WeakPolarHBondContact O-CB 3.27Å; Q622-A626 PolarHBondContact O-N 3.1Å; K623-A626 PolarHBondContact O-N 3.17Å; Q624-A626 PolarHBondContact O-N 3.29Å; A626-A629 PolarHBondContact O-N 3.23Å; A626-L630 WeakPolarHBondContact O-CB 3.42Å; A626-L630 VanDerWaalsContact O-CG 3.29Å; A626-L630 WeakPolarHBondContact O-CG 3.05Å; A626-L630 PolarHBondContact O-N 3.24Å
627A93.1Very high84.6Confident50 Ų5097 Ų9741%0.41355%0.551SS.*Hα-helixtrans-65.7-42.6175.200000111.9K623 Q624 T625 L630 C631K623-A627 WeakPolarHBondContact O-CB 3.45Å; K623-A627 PolarHBondContact O-N 3.38Å; Q624-A627 PolarHBondContact O-N 3.29Å; T625-A627 PolarHBondContact O-N 3.45Å; A627-L630 PolarHBondContact O-N 3.13Å; A627-C631 WeakPolarHBondContact O-CB 2.63Å; A627-C631 PolarHBondContact O-N 3.2Å; A627-C631 PolarHBondContact O-SG 3.35Å
628V94.3Very high84.4Confident82 Ų8297.1 Ų97.150%0.49756%0.558SS.*Hα-helixtrans-62.2-45.5174.4171.20000111Q624 T625 L630 C631 Q632Q624-V628 WeakPolarHBondContact O-CG2 3.25Å; Q624-V628 PolarHBondContact O-N 3.29Å; T625-V628 PolarHBondContact O-N 3.35Å; V628-L630 PolarHBondContact O-N 3.48Å; V628-C631 PolarHBondContact O-N 3.44Å; V628-Q632 HydrophobicContact CG1-CG 4.48Å; V628-Q632 WeakPolarHBondContact O-CG 2.97Å; V628-Q632 PolarHBondContact O-N 3.11Å
629A94.6Very high83.5Confident40 Ų4099.2 Ų99.233%0.33157%0.573SS.*Hα-helixtrans-61.7-41.4176.700000112.5T625 A626 Q632 L633T625-A629 WeakPolarHBondContact O-CB 2.99Å; T625-A629 PolarHBondContact O-N 3.21Å; A626-A629 PolarHBondContact O-N 3.23Å; A629-Q632 PolarHBondContact O-N 3.31Å; A629-L633 WeakPolarHBondContact O-CG 3.14Å; A629-L633 PolarHBondContact O-N 2.89Å
630L93.9Very high82Confident117 Ų117106.2 Ų106.261%0.61360%0.597SS**Hα-helixtrans-66.5-37.4174.9-73.3170000112.5A626 A627 V628 L633 A634A626-L630 WeakPolarHBondContact O-CB 3.42Å; A626-L630 VanDerWaalsContact O-CG 3.29Å; A626-L630 WeakPolarHBondContact O-CG 3.05Å; A626-L630 PolarHBondContact O-N 3.24Å; A627-L630 PolarHBondContact O-N 3.13Å; V628-L630 PolarHBondContact O-N 3.48Å; L630-L633 PolarHBondContact O-N 3.27Å; L630-A634 WeakPolarHBondContact O-CB 2.59Å; L630-A634 PolarHBondContact O-N 3.36Å
631C91.4Very high80Confident88 Ų88107.2 Ų107.260%0.59562%0.616SS**Hα-helixtrans-65.9-39.6172.7-72.60000112A627 V628 A634 A635A627-C631 WeakPolarHBondContact O-CB 2.63Å; A627-C631 PolarHBondContact O-N 3.2Å; A627-C631 PolarHBondContact O-SG 3.35Å; V628-C631 PolarHBondContact O-N 3.44Å; C631-A634 PolarHBondContact O-N 3.34Å; C631-A635 WeakPolarHBondContact O-CB 3.34Å; C631-A635 PolarHBondContact O-N 3.23Å
632Q92.3Very high77.7Confident125 Ų125111.3 Ų111.358%0.58463%0.626SS**Hα-helixtrans-63.3-45.8173.6-74.2173.2-9.300111.3V628 A629 A634 A635 Y636V628-Q632 HydrophobicContact CG1-CG 4.48Å; V628-Q632 WeakPolarHBondContact O-CG 2.97Å; V628-Q632 PolarHBondContact O-N 3.11Å; A629-Q632 PolarHBondContact O-N 3.31Å; Q632-A634 VanDerWaalsContact C-N 3.32Å; Q632-A634 PolarHBondContact O-N 2.62Å; Q632-A635 PolarHBondContact O-N 2.91Å; Q632-Y636 WeakPolarHBondContact O-CB 3.27Å; Q632-Y636 PolarHBondContact O-N 3.05Å
633L88.3Confident75.4Confident128 Ų128113.7 Ų113.767%0.6764%0.639SS**Hα-helixtrans-63.6-33.8175.8-71.6168.9000113A629 L630A629-L633 WeakPolarHBondContact O-CG 3.14Å; A629-L633 PolarHBondContact O-N 2.89Å; L630-L633 PolarHBondContact O-N 3.27Å
634A79.9Confident72.7Confident75 Ų75113.6 Ų113.662%0.6264%0.644SS**Hα-helixtrans-72.8-36.3173.800000112.7L630 C631 Q632 Y636L630-A634 WeakPolarHBondContact O-CB 2.59Å; L630-A634 PolarHBondContact O-N 3.36Å; C631-A634 PolarHBondContact O-N 3.34Å; Q632-A634 VanDerWaalsContact C-N 3.32Å; Q632-A634 PolarHBondContact O-N 2.62Å; A634-Y636 VanDerWaalsContact C-N 3.33Å
635A79.8Confident70Confident82 Ų82114.7 Ų114.768%0.67866%0.655SS**Hα-helixtrans-69.1-32.1172.600000112C631 Q632 S637C631-A635 WeakPolarHBondContact O-CB 3.34Å; C631-A635 PolarHBondContact O-N 3.23Å; Q632-A635 PolarHBondContact O-N 2.91Å; A635-S637 PolarHBondContact O-N 3.34Å
636Y74.8Confident67.2Low196 Ų196119.6 Ų119.677%0.76967%0.671SS**  trans-75.952.9173.8-124.7-88.8000112.6Q632 A634 P638Q632-Y636 WeakPolarHBondContact O-CB 3.27Å; Q632-Y636 PolarHBondContact O-N 3.05Å; A634-Y636 VanDerWaalsContact C-N 3.33Å; Y636-P638 VanDerWaalsContact O-CD 3.31Å; Y636-P638 WeakPolarHBondContact O-CD 2.5Å
637S59.1Low64.4Low91 Ų91120.4 Ų120.464%0.63668%0.684SS**  trans-57.8119.3161.9-710000108.5A635 S639A635-S637 PolarHBondContact O-N 3.34Å; S637-S639 VanDerWaalsContact C-N 3.32Å; S637-S639 PolarHBondContact O-N 3.43Å
638P57.9Low61.6Low120 Ų120127.4 Ų127.478%0.77971%0.708SS**  trans-68.396175.527.6-32.9000108.2Y636 K640Y636-P638 VanDerWaalsContact O-CD 3.31Å; Y636-P638 WeakPolarHBondContact O-CD 2.5Å; P638-K640 PolarHBondContact O-N 3.36Å
639S46.7Very low58.5Low113 Ų113128.6 Ų128.679%0.7972%0.72SS**  trans-53.8125.2172.7-1740000107.9S637 A641S637-S639 VanDerWaalsContact C-N 3.32Å; S637-S639 PolarHBondContact O-N 3.43Å; S639-A641 PolarHBondContact O-N 2.76Å
640K45.2Very low55.9Low197 Ų197132.4 Ų132.486%0.85774%0.742SS**  trans-63.1104.3175.6-75.1-171.7175.7-174.20107.3P638 R642P638-K640 PolarHBondContact O-N 3.36Å; K640-R642 VanDerWaalsContact C-N 3.28Å; K640-R642 PolarHBondContact O-N 2.82Å
641A41.8Very low52.9Low96 Ų96135.7 Ų135.779%0.79375%0.754SS**  trans-59.494.1173.900000108.5S639 M643S639-A641 PolarHBondContact O-N 2.76Å; A641-M643 VanDerWaalsContact C-N 3.29Å; A641-M643 PolarHBondContact O-N 2.71Å
642R38.5Very low49.9Very low211 Ų211137.8 Ų137.880%0.79676%0.759SS**  trans-73.290.9176-178.2179.8176.9-167.6-8.8106.7K640 D644K640-R642 VanDerWaalsContact C-N 3.28Å; K640-R642 PolarHBondContact O-N 2.82Å; R642-D644 IonicContact CZ-OD2 2.66Å; R642-D644 IonicContact NE-OD2 2.62Å; R642-D644 PolarHBondContact NE-OD2 3.17Å; R642-D644 IonicContact NH2-OD2 2.6Å; R642-D644 PolarHBondContact NH2-OD2 2.69Å; R642-D644 PolarHBondContact O-N 3.16Å
643M41.2Very low46.7Very low191 Ų191137 Ų13794%0.94177%0.766SS**  trans-76.765.6177.2-162.4158.172.700110A641A641-M643 VanDerWaalsContact C-N 3.29Å; A641-M643 PolarHBondContact O-N 2.71Å
644D34.4Very low43.8Very low111 Ų111137.8 Ų137.859%0.59477%0.771SS**  trans-87.6153.5156.7-88.2-56.1000108.9R642R642-D644 IonicContact CZ-OD2 2.66Å; R642-D644 IonicContact NE-OD2 2.62Å; R642-D644 PolarHBondContact NE-OD2 3.17Å; R642-D644 IonicContact NH2-OD2 2.6Å; R642-D644 PolarHBondContact NH2-OD2 2.69Å; R642-D644 PolarHBondContact O-N 3.16Å
645N36.6Very low41.2Very low159 Ų159140.4 Ų140.485%0.8578%0.779SS**  trans-106175.3-156.9-156.3-6000112.6
646E34.9Very low38.8Very low193 Ų193142.4 Ų142.490%0.90279%0.788SS**  trans72.2149.3170.9-131.7162-173.700114.9
647G34.1Very low36.5Very low64 Ų64138.9 Ų138.966%0.6679%0.791SS**  trans-174.5179.9-170.900000114.7
648Q33.9Very low35.1Very low196 Ų196140.5 Ų140.592%0.91680%0.798SS**  trans-162.4148176.4-107.6152.755.800111.5
649S28.4Very low33.6Very low108 Ų108143.4 Ų143.476%0.75580%0.801SS**  trans28134.6160.5-153.50000121.7
650P40.2Very low32.7Very low120 Ų120142.1 Ų142.178%0.77980%0.797SS**  trans-75147.916633.9-34.7000111.7
651Q31.9Very low31.8Very low185 Ų185138.4 Ų138.486%0.86479%0.791SS**  trans-154158.2157.2-158.9153.913.200112.7
652D28.2Very low31.1Very low133 Ų133144.4 Ų144.471%0.71179%0.793SS**  trans-78.5153.1-158.5-48.9-94.5000117.3
653C25.5Very low30.5Very low108 Ų108140.8 Ų140.873%0.7379%0.789SS**  trans51.5158.5132.8-70.20000124.2
654N26.8Very low29.8Very low144 Ų144137 Ų13777%0.7778%0.782SS**  trans82.2100.8156.6-56.9-31.8000119.4
655T26.2Very low29.5Very low130 Ų130135.9 Ų135.980%0.79878%0.783SS**  12.7125.8125.854.80000118.9
656S29Very low28.9Very low124 Ų124136.7 Ų136.787%0.86778%0.782SS**  -165161.6118.342.80000111.7
657C27Very low28.7Very low123 Ų123131.3 Ų131.383%0.83177%0.77SS**  trans-122.8128.4172.8176.10000108.3
658T28.4Very low28.5Very low125 Ų125136.2 Ų136.277%0.76778%0.776SS**  trans169.8167.7162.521.70000107
659E25.8Very low28.3Very low181 Ų181132.9 Ų132.985%0.84676%0.764SS**  cis-161.6169.1-47.6179.9159.1-171.400106.7
660A28.5Very low28.3Very low86 Ų86133.5 Ų133.571%0.71176%0.763SS**  trans-64.7158.4-17100000116.2
661T26.7Very low27.9Very low119 Ų119135.4 Ų135.473%0.7376%0.762SS**  trans162.4110.5132.7-72.80000108.3
662R27.1Very low27.6Very low221 Ų221129.4 Ų129.483%0.83474%0.741SS**  85.4149.960.9-160.9-165.6-171.7177.72.9112.6
663N25.2Very low27.6Very low135 Ų135129.8 Ų129.872%0.72274%0.742SS**  trans85.4155.1174.2-46.3-31.9000115.2
664S26.8Very low27.8Very low111 Ų111132.1 Ų132.178%0.77674%0.743SS**  cis-172.4-172.6-29.5-164.80000109.1
665S27.8Very low28Very low89 Ų89134.5 Ų134.562%0.62275%0.746SS**  trans77.5111.5171.2-138.30000113.9
666E25.4Very low28.5Very low176 Ų176134 Ų13482%0.82274%0.743SS**  77.7156.575.6-70.6161.9109.300113.9
667A28.8Very low28.8Very low79 Ų79137.6 Ų137.665%0.65374%0.743SS**  cis-175.9177.5-2900000108
668Q31.4Very low29Very low168 Ų168135.3 Ų135.379%0.78574%0.74SS**  trans71.7117.6168.3-55.7-153.1-10400116.2
669D28.2Very low29.4Very low125 Ų125137.6 Ų137.667%0.66874%0.742SS**  87.5148.890.2-72-45.4000112.9
670T30Very low29.8Very low121 Ų121137.9 Ų137.974%0.74274%0.741SS**  cis-155.3-172.9-3.415.60000108.5
671Q31.1Very low30.1Very low160 Ų160145.5 Ų145.575%0.74875%0.751SS**  cis-154.9153.77.3-139.4-160.3102.400113.2
672S26.3Very low30.3Very low60 Ų60146.7 Ų146.742%0.4276%0.758SS.*  trans23.2130.8137.6-162.60000123.5
673N26.8Very low30.3Very low140 Ų140142.9 Ų142.975%0.74975%0.754SS**  177123.1101.4-93.3-78.1000108.8
674Q31.3Very low30.6Very low157 Ų157144.6 Ų144.673%0.73476%0.758SS**  cis88.4111.844.3-78.1-142.736.100116.9
675K31.2Very low30.9Very low195 Ų195145.9 Ų145.985%0.84875%0.75SS**  trans147.3150.2141.9-85.9169.7-178.1174.20110.7
676V35.3Very low31.1Very low120 Ų120148.8 Ų148.873%0.72775%0.754SS**  cis-167.2137.8-19.1120.70000104.6
677K35.1Very low31.4Very low198 Ų198144.6 Ų144.686%0.86174%0.744SS**  -179.3133.574.4-140.3153.9-172.8175.60105.3
678G32.8Very low31.7Very low76 Ų76146.9 Ų146.978%0.78475%0.749SS**  81.6142.289.700000113.6
679Q36.1Very low31.8Very low172 Ų172148.1 Ų148.180%0.80475%0.752SS**  cis-168.3163-7-160.3-172.1-9.400110.7
680K34Very low32Very low188 Ų188146.7 Ų146.782%0.81775%0.752SS**  trans85144.1161-81.3169.3-179.5174.50119.8
681R34Very low32.3Very low246 Ų246149.4 Ų149.493%0.92876%0.756SS**  trans-82.9162.1176.7-50160.9172.7165-6.6110.2
682T30.8Very low32.5Very low143 Ų143151 Ų15188%0.87776%0.764SS**  -164.2172.4115-1640000111.6
683N28.8Very low32.8Very low141 Ų141151.5 Ų151.575%0.75478%0.778SS**  trans-121.1-176.9-178.3-155.5-40.3000108.6
684Q30.1Very low33.3Very low171 Ų171151.3 Ų151.380%0.79978%0.783SS**  trans69.4156.3168.7-68-169.7-0.200118.1
685K33.6Very low33.9Very low139 Ų139153.4 Ų153.460%0.60479%0.789SS**  cis-174.9160.3-24.6-174.6178.4173.8-124.80108.2
686E32.3Very low34.2Very low150 Ų150155.2 Ų155.270%0.70179%0.791SS**  trans69.9154.3156.7-97.3150.6-175.900118.1
687S32.3Very low34.3Very low88 Ų88156 Ų15662%0.61580%0.796SS**  cis-154.7162.5-0.3610000113.8
688T33.3Very low34.5Very low126 Ų126156.7 Ų156.777%0.77379%0.793SS**  trans69.2149.6163.275.50000118.2
689K35.3Very low35.1Very low195 Ų195158.2 Ų158.285%0.84879%0.789SS**  cis-143.6160.5-4.1-142.4165.3-179.91740113
690S32.2Very low35.1Very low95 Ų95156.5 Ų156.566%0.66479%0.785SS**  trans-64.2175.2178.857.20000115.1
691Q36Very low35.2Very low177 Ų177154.3 Ų154.383%0.82778%0.782SS**  cis-140.8163.719.1-53.2170.9-74.700109.1
692Q35.3Very low35.4Very low194 Ų194148.5 Ų148.591%0.90778%0.778SS**  52139.951-62.1-171.53.800114.1
693G32.9Very low35.8Very low70 Ų70146.5 Ų146.572%0.72277%0.77SS**  cis-149-153.5-5.600000108.4
694T36.6Very low36.6Very low137 Ų137150.6 Ų150.684%0.8478%0.775SS**  cis-156.1158.316.751.90000111.8
695K43.3Very low37.2Very low201 Ų201147.9 Ų147.987%0.87477%0.77SS**  trans-84.1144.8172.3-57.5173.1-178.7175.30112.5
696R39Very low37.4Very low233 Ų233149.4 Ų149.488%0.87978%0.777SS**  trans-143.7119.9144.6-60.9-168.5-164.7-140.76.4106.1
697V35.6Very low37.9Very low137 Ų137148.3 Ų148.383%0.8378%0.781SS**  63.2119.474.1-178.70000112.1
698R40.2Very low38.3Very low212 Ų212150.8 Ų150.880%0.879%0.786SS**  trans-71.4155.9177.3-90.9-167.1-179.2-163.61.7112.2
699P45.6Very low38.8Very low108 Ų108156.5 Ų156.570%0.70179%0.793SS**  -107176.5119.132.4-34.6000112.2
700N36.7Very low39.1Very low135 Ų135156.8 Ų156.872%0.72280%0.795SS**  trans-124.5101.1-177.8173.760.4000108.8
701D36.3Very low39.9Very low143 Ų143163.7 Ų163.777%0.76581%0.806SS**  trans-114.9140.9-175.6-94.3-62.3000113.5
702C36.5Very low40.2Very low123 Ų123161.4 Ų161.483%0.83181%0.805SS**  trans-116.781.7-169.4-169.60000111.2
703S39.6Very low40.6Very low102 Ų102164 Ų16471%0.71381%0.806SS**  trans-113.7100.8178.851.70000112.2V705S703-V705 PolarHBondContact O-N 3.17Å
704R46Very low41.1Very low226 Ų226166.3 Ų166.385%0.85381%0.806SS**  trans-73.7108.4168.4-65.4-178.8-173172.25.2109.5
705V42Very low41.4Very low114 Ų114168.7 Ų168.769%0.69183%0.828SS**  trans-120.888.2169.6-167.80000110.1S703 T707S703-V705 PolarHBondContact O-N 3.17Å; V705-T707 HydrophobicContact CG1-CG2 4.11Å; V705-T707 PolarHBondContact O-N 3.02Å
706F38.1Very low41.3Very low171 Ų171167.1 Ų167.175%0.7583%0.826SS**  trans-78.594170.8-86-86.5000109.9L708F706-L708 HydrophobicContact CB-CD1 4.41Å; F706-L708 HydrophobicContact CB-CG 4.38Å; F706-L708 HydrophobicContact CD1-CD1 4.3Å; F706-L708 HydrophobicContact CD1-CG 4.37Å; F706-L708 PolarHBondContact O-N 3.46Å
707T43.1Very low41.5Very low128 Ų128163.6 Ų163.679%0.78582%0.823SS**  trans-75.255.1171.347.40000112.3V705 R709V705-T707 HydrophobicContact CG1-CG2 4.11Å; V705-T707 PolarHBondContact O-N 3.02Å; T707-R709 PolarHBondContact O-N 3.13Å
708L39.8Very low41.8Very low140 Ų140165.1 Ų165.173%0.73382%0.823SS**  trans-69.393.4173.6-76.5170.1000110.1F706 K710F706-L708 HydrophobicContact CB-CD1 4.41Å; F706-L708 HydrophobicContact CB-CG 4.38Å; F706-L708 HydrophobicContact CD1-CD1 4.3Å; F706-L708 HydrophobicContact CD1-CG 4.37Å; F706-L708 PolarHBondContact O-N 3.46Å; L708-K710 VanDerWaalsContact C-N 3.31Å; L708-K710 PolarHBondContact O-N 3.16Å
709R43.6Very low41.9Very low245 Ų245162.4 Ų162.493%0.92582%0.824SS**  trans-60.792.6163.5-88-176.3169.7162-2.9109.5T707 R711T707-R709 PolarHBondContact O-N 3.13Å; R709-R711 PolarHBondContact O-N 3.47Å
710K43.4Very low41.7Very low202 Ų202165.8 Ų165.888%0.87883%0.832SS**PPolyproline II helixtrans-56121.2159.9-73-176.7176.2-179.30107.6L708L708-K710 VanDerWaalsContact C-N 3.31Å; L708-K710 PolarHBondContact O-N 3.16Å
711R48.3Very low42Very low240 Ų240167.8 Ų167.891%0.90684%0.839SS**PPolyproline II helixtrans-84.1129.7156.6-71.3-176.6177.3174.4-2.2107.1R709R709-R711 PolarHBondContact O-N 3.47Å
712T43.2Very low42.4Very low129 Ų129169.6 Ų169.679%0.79185%0.845SS**PPolyproline II helixtrans-62.8141.7165.528.60000109.4
713R42.5Very low42.9Very low247 Ų247173.2 Ų173.293%0.93285%0.846SS**PPolyproline II helixtrans-73.3141.3150.1-82.1-174.5171.6-172.8-3.9107.1
714V43.4Very low43.1Very low119 Ų119179.1 Ų179.172%0.72186%0.857SS**  trans-119.4150.6157.9179.90000105.5
715S44Very low42.9Very low188 Ų188174.8 Ų174.8100%1.31586%0.857SS**  trans-27.10-176.454.90000115.3

Retrieved 715 of 715 residues in 250.1 ms (Link to these results)