A0A5K4FD41_SCHMA Loading...

YKR005C-like protein

AlphaFold DB , UniProt , Accession A0A5K4FD41, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 171 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M55.2Low76Confident245 Ų245139.1 Ų139.1100%1.20775%0.749SS**  0129.10-78.2166.4123.900107.5
2A71.7Confident74.9Confident81 Ų81137.9 Ų137.967%0.66975%0.75SS**PPolyproline II helixtrans-79.7124.4174.200000108.8
3Q80.9Confident73.7Confident195 Ų195139.7 Ų139.791%0.91175%0.747SS**PPolyproline II helixtrans-85116.3174.7-170.7160.35.800108.1
4Y81.5Confident72.7Confident201 Ų201140.8 Ų140.879%0.78875%0.745SS**PPolyproline II helixtrans-79.8145173.9-68.9-80.4000109.7
5P78.4Confident71.6Confident103 Ų103140.1 Ų140.167%0.66974%0.742SS**PPolyproline II helixtrans-61.6140.217425.7-32.4000110.2L7P5-L7 PolarHBondContact O-N 3.38Å; P5-L7 VanDerWaalsContact O-N 3.12Å
6D81.7Confident70.7Confident116 Ų116139.4 Ų139.462%0.6274%0.739SS**  trans-71.3105.5177.1-175.36000109.8N8 G9D6-N8 PolarHBondContact O-N 2.94Å; D6-N8 WeakPolarHBondContact OD1-CB 3.35Å; D6-N8 PolarHBondContact OD1-N 3.17Å; D6-G9 PolarHBondContact O-N 3.36Å
7L80.8Confident69.9Low158 Ų158140.8 Ų140.883%0.82774%0.74SS**THydrogen-bonded Turntrans-70.1-10.9177.6-61.6176.5000113P5P5-L7 PolarHBondContact O-N 3.38Å; P5-L7 VanDerWaalsContact O-N 3.12Å
8N82.4Confident69.6Low150 Ų150140.9 Ų140.980%0.80273%0.734SS**THydrogen-bonded Turntrans-100.80.9177.4-53.9-59.1000112.7D6D6-N8 PolarHBondContact O-N 2.94Å; D6-N8 WeakPolarHBondContact OD1-CB 3.35Å; D6-N8 PolarHBondContact OD1-N 3.17Å
9G75.4Confident69.8Low25 Ų25136.6 Ų136.626%0.25872%0.716SS.*SBendtrans-64153.417200000111.3D6 I11D6-G9 PolarHBondContact O-N 3.36Å; G9-I11 PolarHBondContact O-N 3.13Å
10P76.6Confident70.6Confident125 Ų125134.8 Ų134.881%0.81271%0.711SS**  trans-55.9125.1173.121-29.1000109.6T12P10-T12 PolarHBondContact O-N 3.29Å
11I71.3Confident71.3Confident131 Ų131134 Ų13467%0.67271%0.707SS**  trans-65.3106.3175.7-60.1171.7000107.2G9 F13G9-I11 PolarHBondContact O-N 3.13Å; I11-F13 HydrophobicContact CB-CE2 4.22Å; I11-F13 HydrophobicContact CB-CZ 4.42Å; I11-F13 HydrophobicContact CG2-CD1 4.27Å; I11-F13 HydrophobicContact CG2-CD2 4.15Å; I11-F13 HydrophobicContact CG2-CE1 3.97Å; I11-F13 HydrophobicContact CG2-CE2 3.84Å; I11-F13 HydrophobicContact CG2-CG 4.36Å; I11-F13 HydrophobicContact CG2-CZ 3.75Å; I11-F13 PolarHBondContact O-N 3.39Å; I11-F13 VanDerWaalsContact O-N 3.17Å
12T63.1Low72.9Confident125 Ų125128.1 Ų128.177%0.76768%0.677SS**  trans-74.7101.8166.351.50000107.4P10 E14P10-T12 PolarHBondContact O-N 3.29Å; T12-E14 PolarHBondContact O-N 3.34Å; T12-E14 VanDerWaalsContact O-N 3.14Å
13F59.6Low73.6Confident161 Ų161129.3 Ų129.371%0.70667%0.668SS**  trans-70.2103.6159.9-61.4-81.3000105.8I11 N15I11-F13 HydrophobicContact CB-CE2 4.22Å; I11-F13 HydrophobicContact CB-CZ 4.42Å; I11-F13 HydrophobicContact CG2-CD1 4.27Å; I11-F13 HydrophobicContact CG2-CD2 4.15Å; I11-F13 HydrophobicContact CG2-CE1 3.97Å; I11-F13 HydrophobicContact CG2-CE2 3.84Å; I11-F13 HydrophobicContact CG2-CG 4.36Å; I11-F13 HydrophobicContact CG2-CZ 3.75Å; I11-F13 PolarHBondContact O-N 3.39Å; I11-F13 VanDerWaalsContact O-N 3.17Å; F13-N15 VanDerWaalsContact C-N 3.31Å; F13-N15 PolarHBondContact O-N 3.14Å
14E59.5Low74.1Confident155 Ų155124 Ų12472%0.72465%0.646SS**  trans-56.8108.4156.5-79.8-179.6167.700105.2T12 N16T12-E14 PolarHBondContact O-N 3.34Å; T12-E14 VanDerWaalsContact O-N 3.14Å; E14-N16 PolarHBondContact O-N 2.99Å
15N55.9Low74.7Confident131 Ų131121.8 Ų121.870%0.70164%0.64SS**  trans-63.981.7169-81.8-10.7000106.7F13 E17F13-N15 VanDerWaalsContact C-N 3.31Å; F13-N15 PolarHBondContact O-N 3.14Å; N15-E17 PolarHBondContact O-N 3.14Å
16N56.7Low75.4Confident128 Ų128118.6 Ų118.668%0.68463%0.626SS**  trans-73.255.1162.8-76.8-23.7000107.9E14 K18E14-N16 PolarHBondContact O-N 2.99Å; N16-K18 PolarHBondContact O-N 2.89Å
17E57.9Low76Confident163 Ų163117.6 Ų117.676%0.76262%0.618SS**  trans-67.184.2154.5-70-174.7-176.500104.8N15 S19N15-E17 PolarHBondContact O-N 3.14Å; E17-S19 PolarHBondContact O-N 3.49Å
18K64.2Low76.8Confident144 Ų144114.7 Ų114.763%0.62660%0.602SS**  trans-49.8117.9165.2-68.5-176.3177.5-170.70105.1N16 V20N16-K18 PolarHBondContact O-N 2.89Å; K18-V20 PolarHBondContact O-N 3.32Å
19S73.5Confident77.4Confident58 Ų58113.1 Ų113.141%0.40659%0.59SS.*  trans-51.5141.8177.21780000107.5E17 D21 E22 E23E17-S19 PolarHBondContact O-N 3.49Å; S19-D21 PolarHBondContact O-N 3.35Å; S19-D21 PolarHBondContact OG-N 3.28Å; S19-D21 PolarHBondContact OG-OD2 3.44Å; S19-E22 WeakPolarHBondContact O-CA 3.48Å; S19-E22 WeakPolarHBondContact O-CB 3.49Å; S19-E22 PolarHBondContact O-N 2.98Å; S19-E23 PolarHBondContact O-N 3.4Å
20V86.7Confident78.3Confident101 Ų101114.6 Ų114.661%0.61260%0.6SS**Hα-helixtrans-47.9-34.5172.6175.60000109.9K18 E23 L24K18-V20 PolarHBondContact O-N 3.32Å; V20-E23 PolarHBondContact O-N 2.9Å; V20-L24 HydrophobicContact CG1-CD1 3.88Å; V20-L24 HydrophobicContact CG1-CG 4.3Å; V20-L24 WeakPolarHBondContact O-CB 3.44Å; V20-L24 WeakPolarHBondContact O-CG 3.44Å; V20-L24 PolarHBondContact O-N 3.05Å
21D85.3Confident79.3Confident117 Ų117112.7 Ų112.763%0.62658%0.583SS**Hα-helixtrans-65-40.9175.9-56.2-35.5000113.5S19 K25S19-D21 PolarHBondContact O-N 3.35Å; S19-D21 PolarHBondContact OG-N 3.28Å; S19-D21 PolarHBondContact OG-OD2 3.44Å; D21-K25 VanDerWaalsContact O-CB 3.24Å; D21-K25 WeakPolarHBondContact O-CB 3.43Å; D21-K25 PolarHBondContact O-N 3.04Å
22E87.6Confident80.4Confident122 Ų122111.9 Ų111.957%0.5758%0.576SS**Hα-helixtrans-69.5-40.2178.4-170.2-177.9-175.200110.8S19 K25 G26S19-E22 WeakPolarHBondContact O-CA 3.48Å; S19-E22 WeakPolarHBondContact O-CB 3.49Å; S19-E22 PolarHBondContact O-N 2.98Å; E22-K25 PolarHBondContact O-N 2.93Å; E22-G26 PolarHBondContact O-N 3.4Å
23E87Confident81.9Confident106 Ų106111 Ų11150%0.49557%0.566SS.*Hα-helixtrans-61.9-50.1173.5-175-179.9174.600111.1S19 V20 K25 G26 Q27S19-E23 PolarHBondContact O-N 3.4Å; V20-E23 PolarHBondContact O-N 2.9Å; E23-K25 VanDerWaalsContact C-N 3.34Å; E23-K25 PolarHBondContact O-N 3.28Å; E23-G26 PolarHBondContact O-N 2.93Å; E23-Q27 WeakPolarHBondContact O-CG 3.39Å; E23-Q27 PolarHBondContact O-N 3.02Å; E23-Q27 PolarHBondContact OE1-NE2 2.93Å
24L92Very high83.6Confident84 Ų84111.3 Ų111.344%0.4456%0.563SS.*Hα-helixtrans-59.4-44.2177.8-74.8172.8000111.5V20 G26 Q27 I28V20-L24 HydrophobicContact CG1-CD1 3.88Å; V20-L24 HydrophobicContact CG1-CG 4.3Å; V20-L24 WeakPolarHBondContact O-CB 3.44Å; V20-L24 WeakPolarHBondContact O-CG 3.44Å; V20-L24 PolarHBondContact O-N 3.05Å; L24-G26 VanDerWaalsContact C-N 3.34Å; L24-G26 PolarHBondContact O-N 3.39Å; L24-Q27 PolarHBondContact O-N 3.43Å; L24-I28 VanDerWaalsContact O-CG1 3.28Å; L24-I28 WeakPolarHBondContact O-CG1 3.29Å; L24-I28 PolarHBondContact O-N 2.88Å
25K93Very high85.2Confident154 Ų154108.9 Ų108.967%0.6755%0.554SS**Hα-helixtrans-59.6-44.4176.1-174.5176.4-178.3176.80111.7D21 E22 E23 I28 Q29D21-K25 VanDerWaalsContact O-CB 3.24Å; D21-K25 WeakPolarHBondContact O-CB 3.43Å; D21-K25 PolarHBondContact O-N 3.04Å; E22-K25 PolarHBondContact O-N 2.93Å; E23-K25 VanDerWaalsContact C-N 3.34Å; E23-K25 PolarHBondContact O-N 3.28Å; K25-I28 PolarHBondContact O-N 3.14Å; K25-Q29 WeakPolarHBondContact O-CB 3.35Å; K25-Q29 PolarHBondContact O-N 3Å
26G93.4Very high87Confident36 Ų36107 Ų10737%0.37155%0.547SS..Hα-helixtrans-62.6-40.7175.700000112.8E22 E23 L24 A30E22-G26 PolarHBondContact O-N 3.4Å; E23-G26 PolarHBondContact O-N 2.93Å; L24-G26 VanDerWaalsContact C-N 3.34Å; L24-G26 PolarHBondContact O-N 3.39Å; G26-A30 WeakPolarHBondContact O-CB 3.43Å; G26-A30 PolarHBondContact O-N 3.35Å
27Q95.3Very high88.7Confident96 Ų96105.8 Ų105.845%0.44954%0.54SS..Hα-helixtrans-66.5-41.2176.2-69.7-177.12900112.4E23 L24 A30 N31E23-Q27 WeakPolarHBondContact O-CG 3.39Å; E23-Q27 PolarHBondContact O-N 3.02Å; E23-Q27 PolarHBondContact OE1-NE2 2.93Å; L24-Q27 PolarHBondContact O-N 3.43Å; Q27-A30 PolarHBondContact O-N 3.07Å; Q27-N31 PolarHBondContact O-N 3.25Å; Q27-N31 PolarHBondContact O-ND2 3.21Å
28I95.7Very high90.4Very high97 Ų97102.1 Ų102.150%0.49753%0.525SS..Hα-helixtrans-59.7-51.7175.3-70.5164.6000109.7L24 K25 A30 N31 E32L24-I28 VanDerWaalsContact O-CG1 3.28Å; L24-I28 WeakPolarHBondContact O-CG1 3.29Å; L24-I28 PolarHBondContact O-N 2.88Å; K25-I28 PolarHBondContact O-N 3.14Å; I28-A30 VanDerWaalsContact C-N 3.3Å; I28-A30 PolarHBondContact O-N 3.34Å; I28-N31 WeakPolarHBondContact O-CB 3.43Å; I28-N31 PolarHBondContact O-N 3.37Å; I28-E32 HydrophobicContact CG2-CG 4.45Å; I28-E32 WeakPolarHBondContact O-CG 3.47Å; I28-E32 PolarHBondContact O-N 3.47Å
29Q95.8Very high91.8Very high117 Ų11799.8 Ų99.855%0.54752%0.522SS..Hα-helixtrans-59-40.8179.2-170.8-178.611.800112.1K25 N31 E32 L33K25-Q29 WeakPolarHBondContact O-CB 3.35Å; K25-Q29 PolarHBondContact O-N 3Å; Q29-N31 VanDerWaalsContact C-N 3.33Å; Q29-N31 PolarHBondContact O-N 3.29Å; Q29-E32 PolarHBondContact O-N 3.22Å; Q29-L33 WeakPolarHBondContact O-CG 3.42Å; Q29-L33 PolarHBondContact O-N 3.04Å; Q29-L33 VanDerWaalsContact O-N 3.15Å
30A94Very high92.7Very high55 Ų55101.1 Ų101.146%0.45552%0.523SS..Hα-helixtrans-63.5-38.5175.700000112.3G26 Q27 I28 R34G26-A30 WeakPolarHBondContact O-CB 3.43Å; G26-A30 PolarHBondContact O-N 3.35Å; Q27-A30 PolarHBondContact O-N 3.07Å; I28-A30 VanDerWaalsContact C-N 3.3Å; I28-A30 PolarHBondContact O-N 3.34Å; A30-R34 WeakPolarHBondContact O-CB 3.39Å; A30-R34 PolarHBondContact O-N 3.35Å
31N97.5Very high93.1Very high85 Ų85101.6 Ų101.646%0.45552%0.518SS..Hα-helixtrans-70.1-37.8177-75.6-28.1000112.4Q27 I28 Q29 L33 R34 I35Q27-N31 PolarHBondContact O-N 3.25Å; Q27-N31 PolarHBondContact O-ND2 3.21Å; I28-N31 WeakPolarHBondContact O-CB 3.43Å; I28-N31 PolarHBondContact O-N 3.37Å; Q29-N31 VanDerWaalsContact C-N 3.33Å; Q29-N31 PolarHBondContact O-N 3.29Å; N31-L33 PolarHBondContact O-N 3.02Å; N31-R34 WeakPolarHBondContact O-CB 3.4Å; N31-R34 PolarHBondContact O-N 2.77Å; N31-I35 VanDerWaalsContact O-CG1 3.3Å; N31-I35 WeakPolarHBondContact O-CG1 3.38Å; N31-I35 PolarHBondContact O-N 2.96Å
32E94.2Very high93.4Very high114 Ų11498.9 Ų98.953%0.53351%0.506SS..Hα-helixtrans-59.8-45.5173.9-71173.1167.300111.9I28 Q29 R34 I35 T36I28-E32 HydrophobicContact CG2-CG 4.45Å; I28-E32 WeakPolarHBondContact O-CG 3.47Å; I28-E32 PolarHBondContact O-N 3.47Å; Q29-E32 PolarHBondContact O-N 3.22Å; E32-R34 VanDerWaalsContact C-N 3.33Å; E32-R34 PolarHBondContact O-N 3.26Å; E32-I35 PolarHBondContact O-N 3.39Å; E32-T36 PolarHBondContact O-N 2.95Å; E32-T36 PolarHBondContact O-OG1 2.92Å
33L95.5Very high93.6Very high108 Ų10899.5 Ų99.557%0.56551%0.507SS*.Hα-helixtrans-62.4-41.7175.4-70.3172.9000111.5Q29 N31 T36 L37Q29-L33 WeakPolarHBondContact O-CG 3.42Å; Q29-L33 PolarHBondContact O-N 3.04Å; Q29-L33 VanDerWaalsContact O-N 3.15Å; N31-L33 PolarHBondContact O-N 3.02Å; L33-T36 PolarHBondContact O-N 3.07Å; L33-L37 WeakPolarHBondContact O-CG 3.35Å; L33-L37 PolarHBondContact O-N 3.06Å
34R94.6Very high93.7Very high166 Ų166102 Ų10263%0.62651%0.511SS*.Hα-helixtrans-62.1-44.1176.4-175.5178.9179.7179.1-0.1111.9A30 N31 E32 T36 L37 L38A30-R34 WeakPolarHBondContact O-CB 3.39Å; A30-R34 PolarHBondContact O-N 3.35Å; N31-R34 WeakPolarHBondContact O-CB 3.4Å; N31-R34 PolarHBondContact O-N 2.77Å; E32-R34 VanDerWaalsContact C-N 3.33Å; E32-R34 PolarHBondContact O-N 3.26Å; R34-T36 VanDerWaalsContact C-N 3.35Å; R34-L37 PolarHBondContact O-N 3.46Å; R34-L38 HydrophobicContact CG-CD1 4.35Å; R34-L38 WeakPolarHBondContact O-CG 3.43Å; R34-L38 PolarHBondContact O-N 2.86Å; R34-L38 VanDerWaalsContact O-N 3.08Å
35I93.2Very high93.8Very high105 Ų105104 Ų10454%0.53852%0.522SS..Hα-helixtrans-60.8-46.3176.2-70.3164.9000110.1N31 E32 L37 L38 V39N31-I35 VanDerWaalsContact O-CG1 3.3Å; N31-I35 WeakPolarHBondContact O-CG1 3.38Å; N31-I35 PolarHBondContact O-N 2.96Å; E32-I35 PolarHBondContact O-N 3.39Å; I35-L37 VanDerWaalsContact C-N 3.33Å; I35-L37 PolarHBondContact O-N 2.87Å; I35-L38 PolarHBondContact O-N 3.04Å; I35-L38 VanDerWaalsContact O-N 3.13Å; I35-V39 HydrophobicContact CG2-CG2 4.32Å; I35-V39 WeakPolarHBondContact O-CG2 3.4Å; I35-V39 PolarHBondContact O-N 3.43Å
36T93Very high93.8Very high91 Ų91103.6 Ų103.656%0.55852%0.516SS*.Hα-helixtrans-56.4-45.8178.4-58.10000111.9E32 L33 R34 L38 V39 E40E32-T36 PolarHBondContact O-N 2.95Å; E32-T36 PolarHBondContact O-OG1 2.92Å; L33-T36 PolarHBondContact O-N 3.07Å; R34-T36 VanDerWaalsContact C-N 3.35Å; T36-L38 PolarHBondContact O-N 3.22Å; T36-V39 PolarHBondContact O-N 3.44Å; T36-E40 PolarHBondContact O-N 3.18Å
37L94Very high93.6Very high103 Ų103106 Ų10654%0.53952%0.521SS..Hα-helixtrans-62.4-42.7176.5-74167.4000112.4L33 R34 I35 E40 Q41L33-L37 WeakPolarHBondContact O-CG 3.35Å; L33-L37 PolarHBondContact O-N 3.06Å; R34-L37 PolarHBondContact O-N 3.46Å; I35-L37 VanDerWaalsContact C-N 3.33Å; I35-L37 PolarHBondContact O-N 2.87Å; L37-E40 PolarHBondContact O-N 3.21Å; L37-Q41 WeakPolarHBondContact O-CG 3.37Å; L37-Q41 PolarHBondContact O-N 3.34Å
38L93.9Very high93.2Very high86 Ų86103.7 Ų103.745%0.4552%0.518SS..Hα-helixtrans-65-38.9178.4-72.2171.3000112.1R34 I35 T36 Q41 T42R34-L38 HydrophobicContact CG-CD1 4.35Å; R34-L38 WeakPolarHBondContact O-CG 3.43Å; R34-L38 PolarHBondContact O-N 2.86Å; R34-L38 VanDerWaalsContact O-N 3.08Å; I35-L38 PolarHBondContact O-N 3.04Å; I35-L38 VanDerWaalsContact O-N 3.13Å; T36-L38 PolarHBondContact O-N 3.22Å; L38-Q41 PolarHBondContact O-N 3.35Å; L38-T42 WeakPolarHBondContact O-CB 3.49Å; L38-T42 PolarHBondContact O-N 2.95Å; L38-T42 PolarHBondContact O-OG1 3.35Å
39V93.1Very high92.9Very high94 Ų94104 Ų10457%0.5752%0.52SS*.Hα-helixtrans-62.1-44.9174.7170.10000110.5I35 T36 T42 K43I35-V39 HydrophobicContact CG2-CG2 4.32Å; I35-V39 WeakPolarHBondContact O-CG2 3.4Å; I35-V39 PolarHBondContact O-N 3.43Å; T36-V39 PolarHBondContact O-N 3.44Å; V39-T42 PolarHBondContact O-N 2.82Å; V39-K43 PolarHBondContact O-N 3.49Å
40E92.2Very high92.4Very high87 Ų87103.1 Ų103.141%0.40752%0.518SS..Hα-helixtrans-64.7-43.5177.9-160.7-165.2165.500112.2T36 L37 T42 K43 R44T36-E40 PolarHBondContact O-N 3.18Å; L37-E40 PolarHBondContact O-N 3.21Å; E40-T42 VanDerWaalsContact C-N 3.33Å; E40-T42 PolarHBondContact O-N 2.79Å; E40-K43 WeakPolarHBondContact O-CB 3.46Å; E40-K43 PolarHBondContact O-N 2.92Å; E40-R44 WeakPolarHBondContact O-CG 3.46Å; E40-R44 PolarHBondContact O-N 3.46Å; E40-R44 IonicContact OE1-CZ 3.36Å; E40-R44 IonicContact OE1-NE 3.29Å; E40-R44 PolarHBondContact OE1-NE 3.17Å; E40-R44 IonicContact OE1-NH2 2.66Å; E40-R44 PolarHBondContact OE1-NH2 2.99Å; E40-R44 IonicContact OE2-NH2 3.78Å
41Q94.6Very high91.9Very high110 Ų110105.1 Ų105.151%0.51453%0.525SS..Hα-helixtrans-59.3-44.6174.7-74.8178.4-10.300111.6L37 L38 K43 R44 L45L37-Q41 WeakPolarHBondContact O-CG 3.37Å; L37-Q41 PolarHBondContact O-N 3.34Å; L38-Q41 PolarHBondContact O-N 3.35Å; Q41-K43 VanDerWaalsContact C-N 3.31Å; Q41-K43 PolarHBondContact O-N 3.34Å; Q41-R44 PolarHBondContact O-N 3.44Å; Q41-L45 WeakPolarHBondContact O-CG 3.3Å; Q41-L45 PolarHBondContact O-N 3.41Å
42T93Very high91.3Very high60 Ų60106.2 Ų106.237%0.36853%0.529SS..Hα-helixtrans-59.8-42.8176.6-58.40000111.1L38 V39 E40 R44 L45 R46L38-T42 WeakPolarHBondContact O-CB 3.49Å; L38-T42 PolarHBondContact O-N 2.95Å; L38-T42 PolarHBondContact O-OG1 3.35Å; V39-T42 PolarHBondContact O-N 2.82Å; E40-T42 VanDerWaalsContact C-N 3.33Å; E40-T42 PolarHBondContact O-N 2.79Å; T42-R44 PolarHBondContact O-N 2.95Å; T42-L45 PolarHBondContact O-N 3.44Å; T42-R46 WeakPolarHBondContact O-CG 3.48Å; T42-R46 PolarHBondContact O-N 2.66Å
43K91.7Very high90.7Very high136 Ų136103.1 Ų103.159%0.59152%0.516SS*.Hα-helixtrans-60.7-44175.3-174.7178.6-179.7177.60111.9V39 E40 Q41 R46 N47V39-K43 PolarHBondContact O-N 3.49Å; E40-K43 WeakPolarHBondContact O-CB 3.46Å; E40-K43 PolarHBondContact O-N 2.92Å; Q41-K43 VanDerWaalsContact C-N 3.31Å; Q41-K43 PolarHBondContact O-N 3.34Å; K43-R46 PolarHBondContact O-N 3.29Å; K43-N47 VanDerWaalsContact O-CG 3.31Å; K43-N47 PolarHBondContact O-N 3.3Å
44R88.5Confident89.8Confident158 Ų158102.7 Ų102.760%0.59652%0.515SS*.Hα-helixtrans-63.4-42.4177.3-68175-173.6-167.33.4111.9E40 Q41 T42 N47 A48E40-R44 WeakPolarHBondContact O-CG 3.46Å; E40-R44 PolarHBondContact O-N 3.46Å; E40-R44 IonicContact OE1-CZ 3.36Å; E40-R44 IonicContact OE1-NE 3.29Å; E40-R44 PolarHBondContact OE1-NE 3.17Å; E40-R44 IonicContact OE1-NH2 2.66Å; E40-R44 PolarHBondContact OE1-NH2 2.99Å; E40-R44 IonicContact OE2-NH2 3.78Å; Q41-R44 PolarHBondContact O-N 3.44Å; T42-R44 PolarHBondContact O-N 2.95Å; R44-N47 PolarHBondContact O-N 2.94Å; R44-A48 PolarHBondContact O-N 2.94Å
45L94.8Very high88.9Confident126 Ų126101.2 Ų101.266%0.6651%0.513SS*.Hα-helixtrans-65.2-43.1177.2-70.9174.3000112.1Q41 T42 N47 A48 L49Q41-L45 WeakPolarHBondContact O-CG 3.3Å; Q41-L45 PolarHBondContact O-N 3.41Å; T42-L45 PolarHBondContact O-N 3.44Å; L45-N47 VanDerWaalsContact C-N 3.34Å; L45-N47 PolarHBondContact O-N 3.22Å; L45-A48 PolarHBondContact O-N 2.97Å; L45-L49 PolarHBondContact O-N 3.03Å
46R91.2Very high87.9Confident146 Ų146101.6 Ų101.655%0.55151%0.507SS*.Hα-helixtrans-59.5-44.9174.3-74.4177.9-179.9160-0111.7T42 K43 A48 L49 L50T42-R46 WeakPolarHBondContact O-CG 3.48Å; T42-R46 PolarHBondContact O-N 2.66Å; K43-R46 PolarHBondContact O-N 3.29Å; R46-A48 VanDerWaalsContact C-N 3.35Å; R46-A48 PolarHBondContact O-N 3.12Å; R46-L49 WeakPolarHBondContact O-CB 3.43Å; R46-L49 PolarHBondContact O-N 3.08Å; R46-L50 WeakPolarHBondContact O-CG 3.37Å; R46-L50 PolarHBondContact O-N 3.39Å
47N89.6Confident86.5Confident87 Ų87101.8 Ų101.847%0.46550%0.502SS..Hα-helixtrans-62.6-40.8175.8-71-7.9000112.2K43 R44 L45 L49 L50 V51K43-N47 VanDerWaalsContact O-CG 3.31Å; K43-N47 PolarHBondContact O-N 3.3Å; R44-N47 PolarHBondContact O-N 2.94Å; L45-N47 VanDerWaalsContact C-N 3.34Å; L45-N47 PolarHBondContact O-N 3.22Å; N47-L49 VanDerWaalsContact C-N 3.34Å; N47-L50 PolarHBondContact O-N 3.32Å; N47-V51 WeakPolarHBondContact O-CG2 3.43Å; N47-V51 PolarHBondContact O-N 3.1Å; N47-V51 VanDerWaalsContact O-N 3.07Å
48A87.4Confident85.1Confident47 Ų47102.4 Ų102.439%0.38851%0.506SS..Hα-helixtrans-63.2-40.317600000112R44 L45 R46 V51 I52R44-A48 PolarHBondContact O-N 2.94Å; L45-A48 PolarHBondContact O-N 2.97Å; R46-A48 VanDerWaalsContact C-N 3.35Å; R46-A48 PolarHBondContact O-N 3.12Å; A48-V51 PolarHBondContact O-N 2.8Å; A48-I52 VanDerWaalsContact O-CG1 3.29Å; A48-I52 WeakPolarHBondContact O-CG1 3.28Å; A48-I52 PolarHBondContact O-N 3.07Å
49L88.5Confident83.5Confident103 Ų103103.7 Ų103.754%0.53951%0.511SS..Hα-helixtrans-60.5-45.6175-170.781.3000111.5L45 R46 N47 I52 N53L45-L49 PolarHBondContact O-N 3.03Å; R46-L49 WeakPolarHBondContact O-CB 3.43Å; R46-L49 PolarHBondContact O-N 3.08Å; N47-L49 VanDerWaalsContact C-N 3.34Å; L49-I52 PolarHBondContact O-N 3.5Å; L49-N53 WeakPolarHBondContact O-CB 3.35Å; L49-N53 PolarHBondContact O-N 3.13Å
50L86.2Confident81.8Confident99 Ų99102.7 Ų102.752%0.51850%0.502SS..Hα-helixtrans-58.3-48.7176-68.2173.2000111.4R46 N47 I52 N53 D54R46-L50 WeakPolarHBondContact O-CG 3.37Å; R46-L50 PolarHBondContact O-N 3.39Å; N47-L50 PolarHBondContact O-N 3.32Å; L50-I52 VanDerWaalsContact C-N 3.31Å; L50-I52 PolarHBondContact O-N 3.37Å; L50-N53 PolarHBondContact O-N 2.93Å; L50-N53 VanDerWaalsContact O-N 3.14Å; L50-D54 PolarHBondContact O-N 3.36Å
51V83.9Confident80Confident97 Ų97104.8 Ų104.859%0.58852%0.516SS*.Hα-helixtrans-60.1-39.7178172.40000112.2N47 A48 K55N47-V51 WeakPolarHBondContact O-CG2 3.43Å; N47-V51 PolarHBondContact O-N 3.1Å; N47-V51 VanDerWaalsContact O-N 3.07Å; A48-V51 PolarHBondContact O-N 2.8Å; V51-K55 WeakPolarHBondContact O-CB 3.44Å; V51-K55 PolarHBondContact O-N 3.03Å; V51-K55 VanDerWaalsContact O-N 3.07Å
52I83.6Confident78.1Confident107 Ų107105.9 Ų105.955%0.54953%0.526SS..Hα-helixtrans-65.8-44.1176.2-69.5165.5000110.6A48 L49 L50 K55 R56A48-I52 VanDerWaalsContact O-CG1 3.29Å; A48-I52 WeakPolarHBondContact O-CG1 3.28Å; A48-I52 PolarHBondContact O-N 3.07Å; L49-I52 PolarHBondContact O-N 3.5Å; L50-I52 VanDerWaalsContact C-N 3.31Å; L50-I52 PolarHBondContact O-N 3.37Å; I52-K55 PolarHBondContact O-N 2.92Å; I52-R56 WeakPolarHBondContact O-CB 3.49Å; I52-R56 PolarHBondContact O-N 3.03Å
53N82.1Confident76.2Confident49 Ų49110.5 Ų110.526%0.26254%0.543SS..Hα-helixtrans-64-45.7179.1-75.9-20.6000111.7L49 L50 K55 R56 Q57L49-N53 WeakPolarHBondContact O-CB 3.35Å; L49-N53 PolarHBondContact O-N 3.13Å; L50-N53 PolarHBondContact O-N 2.93Å; L50-N53 VanDerWaalsContact O-N 3.14Å; N53-K55 VanDerWaalsContact C-N 3.31Å; N53-K55 PolarHBondContact O-N 3.07Å; N53-R56 WeakPolarHBondContact O-CB 3.21Å; N53-R56 PolarHBondContact O-N 2.92Å; N53-R56 VanDerWaalsContact O-N 3.14Å; N53-R56 PolarHBondContact OD1-NH2 2.91Å; N53-Q57 WeakPolarHBondContact O-CG 3.35Å; N53-Q57 PolarHBondContact O-N 3.4Å
54D77.1Confident73.8Confident99 Ų99110.7 Ų110.753%0.52955%0.551SS.*Hα-helixtrans-59.4-42.9175.6-68.7-16.9000111.3L50 R56 Q57 N58L50-D54 PolarHBondContact O-N 3.36Å; D54-R56 PolarHBondContact O-N 3.36Å; D54-Q57 PolarHBondContact O-N 3.49Å; D54-N58 WeakPolarHBondContact O-CB 3.24Å; D54-N58 PolarHBondContact O-N 2.88Å; D54-N58 PolarHBondContact O-ND2 3.06Å
55K76Confident71.6Confident135 Ų135110.2 Ų110.259%0.58756%0.56SS**Hα-helixtrans-65.4-38176.5-170.4177.4179-175.90112.1V51 I52 N53 N58 M59V51-K55 WeakPolarHBondContact O-CB 3.44Å; V51-K55 PolarHBondContact O-N 3.03Å; V51-K55 VanDerWaalsContact O-N 3.07Å; I52-K55 PolarHBondContact O-N 2.92Å; N53-K55 VanDerWaalsContact C-N 3.31Å; N53-K55 PolarHBondContact O-N 3.07Å; K55-N58 PolarHBondContact O-N 3.23Å; K55-M59 HydrophobicContact CG-CE 4.26Å; K55-M59 WeakPolarHBondContact O-CG 3.49Å; K55-M59 PolarHBondContact O-N 3.03Å
56R71.5Confident68.9Low113 Ų113113.4 Ų113.443%0.42657%0.571SS.*Hα-helixtrans-65.6-42.9176.3-172.6177.865.1-173.8-0.6111.2I52 N53 D54 M59 N60I52-R56 WeakPolarHBondContact O-CB 3.49Å; I52-R56 PolarHBondContact O-N 3.03Å; N53-R56 WeakPolarHBondContact O-CB 3.21Å; N53-R56 PolarHBondContact O-N 2.92Å; N53-R56 VanDerWaalsContact O-N 3.14Å; N53-R56 PolarHBondContact OD1-NH2 2.91Å; D54-R56 PolarHBondContact O-N 3.36Å; R56-M59 PolarHBondContact O-N 3.47Å; R56-N60 WeakPolarHBondContact O-CB 3.48Å; R56-N60 PolarHBondContact O-N 3.33Å
57Q64.4Low66.9Low96 Ų96112.4 Ų112.445%0.44958%0.576SS.*Hα-helixtrans-63-42.7175.2-64.8-60.4-10.900111.6N53 D54 M59 N60 N61N53-Q57 WeakPolarHBondContact O-CG 3.35Å; N53-Q57 PolarHBondContact O-N 3.4Å; D54-Q57 PolarHBondContact O-N 3.49Å; Q57-M59 VanDerWaalsContact C-N 3.29Å; Q57-M59 PolarHBondContact O-N 3Å; Q57-N60 PolarHBondContact O-N 3.33Å; Q57-N61 WeakPolarHBondContact O-CB 3.45Å; Q57-N61 VanDerWaalsContact O-CG 3.29Å; Q57-N61 PolarHBondContact O-N 3.06Å
58N63.8Low64.6Low115 Ų115117.4 Ų117.462%0.61560%0.596SS**Hα-helixtrans-65.5-29.5177.3-70.6-22.4000113.4D54 K55D54-N58 WeakPolarHBondContact O-CB 3.24Å; D54-N58 PolarHBondContact O-N 2.88Å; D54-N58 PolarHBondContact O-ND2 3.06Å; K55-N58 PolarHBondContact O-N 3.23Å
59M60.6Low62.6Low114 Ų114121.9 Ų121.956%0.56261%0.607SS**Hα-helixtrans-80.5-39174.4-69.9-172.9-55.600112.2K55 R56 Q57 N62K55-M59 HydrophobicContact CG-CE 4.26Å; K55-M59 WeakPolarHBondContact O-CG 3.49Å; K55-M59 PolarHBondContact O-N 3.03Å; R56-M59 PolarHBondContact O-N 3.47Å; Q57-M59 VanDerWaalsContact C-N 3.29Å; Q57-M59 PolarHBondContact O-N 3Å; M59-N62 PolarHBondContact O-N 2.98Å
60N56.6Low60.6Low72 Ų72125.8 Ų125.839%0.38563%0.625SS.*Hα-helixtrans-68.7-33.4179-79.46.2000112.7R56 Q57 N62 H63R56-N60 WeakPolarHBondContact O-CB 3.48Å; R56-N60 PolarHBondContact O-N 3.33Å; Q57-N60 PolarHBondContact O-N 3.33Å; N60-N62 PolarHBondContact O-N 3.47Å; N60-N62 VanDerWaalsContact O-N 3.13Å; N60-H63 PolarHBondContact O-N 2.93Å
61N55.2Low58.9Low131 Ų131129.5 Ų129.570%0.70164%0.64SS**THydrogen-bonded Turntrans-68.2-10177-72.6-11.3000113.9Q57Q57-N61 WeakPolarHBondContact O-CB 3.45Å; Q57-N61 VanDerWaalsContact O-CG 3.29Å; Q57-N61 PolarHBondContact O-N 3.06Å
62N55.1Low57.2Low133 Ų133132.9 Ų132.971%0.71165%0.649SS**THydrogen-bonded Turntrans-102.9-3.9-178.4-121.7-5.2000113.6M59 N60M59-N62 PolarHBondContact O-N 2.98Å; N60-N62 PolarHBondContact O-N 3.47Å; N60-N62 VanDerWaalsContact O-N 3.13Å
63H51.4Low55.2Low157 Ų157134.4 Ų134.473%0.72766%0.658SS**SBendtrans-135.390.2178.3-80.430.9000109.2N60N60-H63 PolarHBondContact O-N 2.93Å
64N41.2Very low53.6Low141 Ų141136.8 Ų136.875%0.75468%0.675SS**  trans34.9115.1146.7-56.3-22.3000118.3
65N42.4Very low52Low148 Ų148140.4 Ų140.479%0.79169%0.688SS**SBendtrans64.4112.7139.5-55.2-16.3000117.8
66E39Very low50.6Low193 Ų193140.1 Ų140.190%0.90269%0.693SS**  trans68.978.1142.5-151.4171.3-138.200116.9
67I49Very low49.4Very low125 Ų125142.6 Ų142.664%0.64171%0.713SS**  trans-133.6104.3154.6-54.5179.5000109F69I67-F69 HydrophobicContact CB-CD2 4.45Å; I67-F69 HydrophobicContact CB-CE2 3.92Å; I67-F69 HydrophobicContact CB-CZ 4.45Å; I67-F69 HydrophobicContact CG2-CD2 3.89Å; I67-F69 HydrophobicContact CG2-CE1 4.16Å; I67-F69 HydrophobicContact CG2-CE2 3.38Å; I67-F69 HydrophobicContact CG2-CG 4.48Å; I67-F69 HydrophobicContact CG2-CZ 3.54Å; I67-F69 PolarHBondContact O-N 3.15Å
68Q41.4Very low48.6Very low192 Ų192142.6 Ų142.690%0.89772%0.724SS**  trans-63116.4164.9-75.8175.8-8.300108.8
69F46.1Very low48.1Very low141 Ų141142.4 Ų142.462%0.61873%0.729SS**  trans-101.5114.9164-74.1-77.9000108.3I67 E71I67-F69 HydrophobicContact CB-CD2 4.45Å; I67-F69 HydrophobicContact CB-CE2 3.92Å; I67-F69 HydrophobicContact CB-CZ 4.45Å; I67-F69 HydrophobicContact CG2-CD2 3.89Å; I67-F69 HydrophobicContact CG2-CE1 4.16Å; I67-F69 HydrophobicContact CG2-CE2 3.38Å; I67-F69 HydrophobicContact CG2-CG 4.48Å; I67-F69 HydrophobicContact CG2-CZ 3.54Å; I67-F69 PolarHBondContact O-N 3.15Å; F69-E71 PolarHBondContact O-N 3.18Å
70M45.3Very low47.5Very low184 Ų184146.1 Ų146.191%0.90674%0.742SS**  trans-53.5127.5170.3-73.2-89.9-75.800109.5E72M70-E72 PolarHBondContact O-N 3.36Å
71E50.7Low47.2Very low178 Ų178148.4 Ų148.483%0.83275%0.753SS**  trans-71.194.9177.4-150.2166.2-151.900108.4F69 N73F69-E71 PolarHBondContact O-N 3.18Å; E71-N73 PolarHBondContact O-N 3.4Å
72E47.9Very low46.8Very low168 Ų168148.3 Ų148.379%0.78575%0.753SS**  trans-78.899.8171.1-165.1174-15800107.7M70 T74M70-E72 PolarHBondContact O-N 3.36Å; E72-T74 HydrophobicContact CG-CG2 4.41Å; E72-T74 PolarHBondContact O-N 3.04Å
73N42.3Very low46.4Very low139 Ų139150.4 Ų150.474%0.74376%0.758SS**  trans-59.682.8171.7-71.5-30.7000110.1E71 E75E71-N73 PolarHBondContact O-N 3.4Å; N73-E75 PolarHBondContact O-N 3.36Å
74T47.8Very low46.3Very low99 Ų99147.4 Ų147.461%0.60775%0.754SS**  trans-78.873.1166.261.20000108.4E72 L76E72-T74 HydrophobicContact CG-CG2 4.41Å; E72-T74 PolarHBondContact O-N 3.04Å; T74-L76 PolarHBondContact O-N 2.87Å
75E43.8Very low46.5Very low174 Ų174148.3 Ų148.381%0.81376%0.757SS**  trans-63.280.2156.1-84.3-174.8161.500107.6N73 L77N73-E75 PolarHBondContact O-N 3.36Å; E75-L77 VanDerWaalsContact C-N 3.31Å; E75-L77 PolarHBondContact O-N 3.04Å
76L47.3Very low46.6Very low130 Ų130149.1 Ų149.168%0.68176%0.761SS**  trans-68.798.2167.1-67.1176.7000106.4T74 S78T74-L76 PolarHBondContact O-N 2.87Å; L76-S78 VanDerWaalsContact C-N 3.35Å; L76-S78 PolarHBondContact O-N 3.38Å
77L45.9Very low46.9Very low164 Ų164145 Ų14586%0.85975%0.754SS**  trans-41.8101.4166.1-91.684.9000108.4E75E75-L77 VanDerWaalsContact C-N 3.31Å; E75-L77 PolarHBondContact O-N 3.04Å
78S48.9Very low46.4Very low96 Ų96145.8 Ų145.867%0.67176%0.759SS**  trans-68.8126.3166.3-66.60000106.1L76 K80L76-S78 VanDerWaalsContact C-N 3.35Å; L76-S78 PolarHBondContact O-N 3.38Å; S78-K80 PolarHBondContact O-N 3.21Å
79P51.6Low46.5Very low111 Ų111143.6 Ų143.672%0.72175%0.754SS**  trans-58.7118.1166.8-10.524000106.1I81P79-I81 VanDerWaalsContact C-N 3.3Å; P79-I81 PolarHBondContact O-N 3.37Å
80K48.5Very low46.2Very low193 Ų193143.5 Ų143.584%0.83976%0.759SS**  trans-60.1101.1163.2-93.8170.1172.6173.60105.8S78 D82S78-K80 PolarHBondContact O-N 3.21Å; K80-D82 PolarHBondContact O-N 3.44Å
81I51.4Low46.2Very low119 Ų119142.1 Ų142.161%0.6176%0.756SS**  trans-82.5102.9167.7-63.7168.4000104.2P79 H83P79-I81 VanDerWaalsContact C-N 3.3Å; P79-I81 PolarHBondContact O-N 3.37Å; I81-H83 PolarHBondContact O-CD2 3.31Å; I81-H83 PolarHBondContact O-N 3.01Å
82D45.2Very low45.8Very low130 Ų130139.9 Ų139.970%0.69575%0.75SS**  trans-64.9104.8169.9-69.3-30.4000107.7K80 S84K80-D82 PolarHBondContact O-N 3.44Å; D82-S84 PolarHBondContact O-N 2.91Å
83H47.4Very low45.4Very low177 Ų177139.1 Ų139.182%0.81975%0.751SS**  trans-74.868.8175-55.9-67.6000109.4I81I81-H83 PolarHBondContact O-CD2 3.31Å; I81-H83 PolarHBondContact O-N 3.01Å
84S48.3Very low45.3Very low94 Ų94140 Ų14066%0.65776%0.755SS**  trans-143.942.8-176.768.30000113.6D82D82-S84 PolarHBondContact O-N 2.91Å
85I45.5Very low44.8Very low159 Ų159142.9 Ų142.982%0.81577%0.767SS**  trans-148.360.7166.4-42.6174.2000110.1
86L45.4Very low44.4Very low165 Ų165138 Ų13886%0.86476%0.764SS**  trans-147.561.1161-74.8179.4000107.7
87S45Very low43.6Very low108 Ų108140 Ų14076%0.75578%0.776SS**  trans-97.2100.8157.4-66.90000105.7D89S87-D89 PolarHBondContact O-N 3.21Å
88D39.4Very low43.3Very low140 Ų140136.6 Ų136.675%0.74977%0.771SS**  trans-62.485164.8-76.2-37.1000108.3N90D88-N90 PolarHBondContact O-N 3.01Å
89D43.1Very low42.7Very low147 Ų147139 Ų13979%0.78678%0.782SS**  trans-77.377.1164.7-80.5-18.1000108.4S87 N91S87-D89 PolarHBondContact O-N 3.21Å; D89-N91 VanDerWaalsContact C-N 3.3Å; D89-N91 PolarHBondContact O-N 2.96Å
90N39.8Very low42.2Very low138 Ų138138.1 Ų138.174%0.73878%0.778SS**  trans-64.994.4153.9-76.9-47.7000107.6D88D88-N90 PolarHBondContact O-N 3.01Å
91N44.8Very low41.7Very low155 Ų155136.6 Ų136.683%0.82978%0.778SS**  trans-128.4103.4160-110.8-13.8000110.9D89D89-N91 VanDerWaalsContact C-N 3.3Å; D89-N91 PolarHBondContact O-N 2.96Å
92N43.2Very low41.4Very low132 Ų132138 Ų13871%0.70679%0.785SS**  trans-55.6142.3164-62.8-62.8000110.3
93N39.1Very low41.3Very low151 Ų151141.5 Ų141.581%0.80779%0.788SS**  trans50.7106148.1-48.9-28.6000116.9
94D40.5Very low41Very low157 Ų157138.9 Ų138.984%0.8479%0.787SS**  -174.3149.1113.5-140.8-13.9000110.3
95D37.3Very low40.2Very low160 Ų160140.9 Ų140.986%0.85679%0.79SS**  trans-60.2136.2179.1-67.6-57.4000112.8
96G35.3Very low39.9Very low73 Ų73138.5 Ų138.575%0.75379%0.788SS**  trans146.9115.6160.400000115.8
97D30.9Very low39.9Very low172 Ų172139.5 Ų139.592%0.9279%0.793SS**  trans20.7111.3146.6-85-26.2000118.3
98A39.4Very low39.5Very low92 Ų92139.6 Ų139.676%0.7679%0.794SS**  172.5117.3117.700000111.2S100A98-S100 PolarHBondContact O-N 3.5Å
99T35.7Very low39.5Very low146 Ų146137.6 Ų137.690%0.89679%0.791SS**  trans-47.6120.9158.650.40000112.1
100S41.3Very low39.3Very low92 Ų92138.6 Ų138.664%0.64380%0.795SS**  trans-154.2101.2148.659.50000111.6A98 I102A98-S100 PolarHBondContact O-N 3.5Å; S100-I102 PolarHBondContact O-N 3.36Å
101I37.4Very low39.4Very low162 Ų162138.3 Ų138.383%0.83179%0.794SS**  trans-73.299.9164.5-62.7168.4000106.1R103I101-R103 PolarHBondContact O-N 2.9Å
102I45.9Very low39Very low149 Ų149137.9 Ų137.976%0.76479%0.791SS**  trans-78.9105.6177.5-60.5175.6000108.6S100S100-I102 PolarHBondContact O-N 3.36Å
103R42Very low39.1Very low202 Ų202140.4 Ų140.476%0.76280%0.801SS**  trans-86.9128168.7-73.8179.3170.3-162.9-2.4109.8I101 N105I101-R103 PolarHBondContact O-N 2.9Å; R103-N105 PolarHBondContact O-N 3.38Å
104P40.8Very low39.2Very low123 Ų123138.2 Ų138.280%0.79980%0.798SS**  trans-90.281167.734.2-28.6000109.8
105N33.4Very low39.3Very low135 Ų135135.1 Ų135.172%0.72279%0.788SS**  trans-115.388.8159.7-84.7-1.9000107.2R103R103-N105 PolarHBondContact O-N 3.38Å
106S39.1Very low39.7Very low110 Ų110134.2 Ų134.277%0.76978%0.784SS**  trans178.888.3160.8-77.10000110.2
107L43.6Very low40.1Very low186 Ų186139.1 Ų139.197%0.97479%0.792SS**  trans-122.683156.4-74175000107.5
108S37.6Very low40.9Very low109 Ų109141.4 Ų141.476%0.76279%0.788SS**  trans-87.9139.6165.851.70000110
109S38.5Very low41Very low99 Ų99142.8 Ų142.869%0.69279%0.792SS**  trans72.793.3164.7-132.60000117.5D111S109-D111 PolarHBondContact O-N 2.9Å; S109-D111 PolarHBondContact OG-OD2 2.87Å
110L39.7Very low41.8Very low167 Ų167142.3 Ų142.387%0.87479%0.789SS**  trans-83.196.5161.7-159.892.1000107.7
111D42Very low42.1Very low133 Ų133147.3 Ų147.371%0.71180%0.799SS**  trans-95.4112.7169.4-77.4-49.5000109.9S109 M113S109-D111 PolarHBondContact O-N 2.9Å; S109-D111 PolarHBondContact OG-OD2 2.87Å; D111-M113 PolarHBondContact O-N 3Å
112N37.5Very low42.6Very low145 Ų145147.4 Ų147.478%0.77580%0.796SS**  trans-49.2118.6173.3-95.1-23.5000111.7
113M45Very low42.7Very low185 Ų185148.1 Ų148.191%0.91180%0.801SS**  trans-130.3122.9155.5-74-63.6145.100111.1D111D111-M113 PolarHBondContact O-N 3Å
114S40.8Very low43.1Very low106 Ų106145.2 Ų145.274%0.74180%0.801SS**  trans-67.5148.4-170.9-176.30000114
115S42.6Very low43.5Very low91 Ų91145.1 Ų145.164%0.63680%0.802SS**  trans46.1121.5143.262.70000120.3
116D45.3Very low44.3Very low142 Ų142149.7 Ų149.776%0.75981%0.809SS**  -165.2105.4126.4-94.8-19.9000111.6R118D116-R118 PolarHBondContact O-N 3.34Å
117N43.1Very low44.8Very low175 Ų175151.6 Ų151.694%0.93681%0.809SS**  trans-70.5101.3171.1-71-32.6000109.6
118R47.7Very low45.2Very low221 Ų221153 Ų15383%0.83480%0.801SS**  trans-102.7104.1165.9-74.5-168.7179.6-163.71.5110.9D116 V120D116-R118 PolarHBondContact O-N 3.34Å; R118-V120 PolarHBondContact O-N 3.47Å
119S43.1Very low45.7Very low120 Ų120156.5 Ų156.584%0.83981%0.805SS**  trans-52.1118.1164.8164.70000111.4
120V50.7Low46.8Very low137 Ų137159.5 Ų159.583%0.8381%0.806SS**  trans-112.2127.8170-174.40000109R118R118-V120 PolarHBondContact O-N 3.47Å
121K48.7Very low47.2Very low197 Ų197158.2 Ų158.286%0.85781%0.805SS**  trans-64.7153.6-171.7-72.4172.6170.9178.20113.7
122E48.1Very low47.6Very low164 Ų164161.5 Ų161.577%0.76681%0.809SS**  trans-62.2133-177.9-61.7142.9170.200114.4
123D48.5Very low48.4Very low163 Ų163161.2 Ų161.287%0.87281%0.813SS**  trans-106.7105.5156.2-89.8-28.7000109.4C125D123-C125 PolarHBondContact O-N 3.48Å
124N49.9Very low48.7Very low141 Ų141162.3 Ų162.375%0.75481%0.813SS**  trans-73.985.8-176.3-76.8-47.4000112.3R126N124-R126 PolarHBondContact O-N 3.43Å; N124-R126 VanDerWaalsContact O-N 3.07Å
125C48.3Very low49.2Very low121 Ų121161.7 Ų161.782%0.81881%0.808SS**  trans-72.895.8164.8-94.40000110.5D123 I127D123-C125 PolarHBondContact O-N 3.48Å; C125-I127 PolarHBondContact O-N 2.99Å
126R50.5Low49.5Very low232 Ų232164.5 Ų164.588%0.87582%0.816SS**  trans-62.887.9179.3-172176.8-178.1174.90.3112.2N124 R128N124-R126 PolarHBondContact O-N 3.43Å; N124-R126 VanDerWaalsContact O-N 3.07Å; R126-R128 PolarHBondContact O-N 2.82Å
127I49.4Very low49.6Very low150 Ų150164.2 Ų164.277%0.76981%0.813SS**  trans-74110.7169.4-63.4167.9000108.6C125 Q129C125-I127 PolarHBondContact O-N 2.99Å; I127-Q129 PolarHBondContact O-N 3.06Å; I127-Q129 VanDerWaalsContact O-N 3.12Å
128R51.4Low49.8Very low214 Ų214161.8 Ų161.881%0.80880%0.8SS**  trans-69.4102.1171.7-67.2175.6109.9-100.45.3109.2R126R126-R128 PolarHBondContact O-N 2.82Å
129Q49.5Very low49.7Very low183 Ų183157.4 Ų157.486%0.85580%0.803SS**PPolyproline II helixtrans-68.5128.1167.6-66.9-174.11.700109.6I127I127-Q129 PolarHBondContact O-N 3.06Å; I127-Q129 VanDerWaalsContact O-N 3.12Å
130K60.6Low49.7Very low163 Ų163155.8 Ų155.871%0.70979%0.792SS**PPolyproline II helixtrans-88.7117.1169.2-69.1-177.3179.8179.60108.4Y132K130-Y132 HydrophobicContact CB-CE2 4.27Å
131T49.2Very low49.3Very low140 Ų140158.3 Ų158.386%0.85980%0.795SS**PPolyproline II helixtrans-75.6118.8167.317.90000109.4
132Y49Very low49.2Very low202 Ų202155.2 Ų155.279%0.79279%0.792SS**  trans-92.9115.4165.3-69.1-85.5000108.2K130K130-Y132 HydrophobicContact CB-CE2 4.27Å
133T54.8Low48.9Very low138 Ų138155.4 Ų155.485%0.84780%0.798SS**PPolyproline II helixtrans-68.3128.8169.638.30000109.2S135T133-S135 PolarHBondContact O-N 2.86Å
134K52.1Low48.6Very low209 Ų209150.6 Ų150.691%0.90979%0.787SS**PPolyproline II helixtrans-60.1128.6172.5-91.6-178.9172-177.50109.3
135S51.3Low48.3Very low92 Ų92151.6 Ų151.664%0.64379%0.792SS**PPolyproline II helixtrans-69.2129.1162.750.70000109.2T133 I137T133-S135 PolarHBondContact O-N 2.86Å; S135-I137 PolarHBondContact O-N 2.72Å; S135-I137 VanDerWaalsContact O-N 3.17Å
136N47.6Very low48.6Very low151 Ų151153.3 Ų153.381%0.80779%0.788SS**  trans-78.891.7173.1-156.714.2000107.1
137I47.8Very low48.9Very low136 Ų136147.7 Ų147.770%0.69778%0.782SS**  trans-89.8111.4175.6-58174.1000106.7S135 S139S135-I137 PolarHBondContact O-N 2.72Å; S135-I137 VanDerWaalsContact O-N 3.17Å; I137-S139 PolarHBondContact O-N 2.88Å
138N48.2Very low49.1Very low123 Ų123147 Ų14766%0.65878%0.78SS**  trans-61.2126.3177.4-64.3-19.4000109.8S140N138-S140 VanDerWaalsContact C-N 3.29Å; N138-S140 PolarHBondContact O-N 2.95Å
139S44.9Very low49.6Very low130 Ų130142.6 Ų142.691%0.90978%0.776SS**SBendtrans-74.275.4-179.6-46.60000111.5I137I137-S139 PolarHBondContact O-N 2.88Å
140S43.6Very low50.4Low86 Ų86141.4 Ų141.460%0.60177%0.771SS**  trans-160.1128161.856.40000106.9N138N138-S140 VanDerWaalsContact C-N 3.29Å; N138-S140 PolarHBondContact O-N 2.95Å
141E41.4Very low51.1Low190 Ų190140.2 Ų140.289%0.88877%0.771SS**  trans9370.9-174.9-51.6175.5-176.200114.9
142V47.7Very low52.2Low132 Ų132145 Ų14580%0.877%0.774SS**  trans-114.472.5157-169.90000107.9
143N41.8Very low53.4Low168 Ų168140.9 Ų140.990%0.89877%0.774SS**  trans-133.7104.5162.6-16011.3000106.9
144G42.2Very low54.3Low61 Ų61136 Ų13663%0.62975%0.752SS**SBendtrans112.9115.7173.200000115.8
145N43.2Very low55.3Low162 Ų162131.7 Ų131.787%0.86675%0.745SS**  trans63.874.4149.2-59.8-8.3000118.1
146H53.8Low55.6Low157 Ų157134.4 Ų134.473%0.72775%0.752SS**  trans-74.7137.6149.9-68.4-62.7000109.7N148H146-N148 PolarHBondContact O-N 3.14Å; H146-N148 VanDerWaalsContact O-N 3.14Å
147P57.4Low56Low115 Ų115133.8 Ų133.875%0.74775%0.754SS**  trans-60.8121.3172.225.6-31.4000108.4V149P147-V149 PolarHBondContact O-N 3.17Å
148N54.4Low56.2Low135 Ų135132.2 Ų132.272%0.72275%0.751SS**  trans-52.2107-176.4-155.79.4000110.1H146 Q150H146-N148 PolarHBondContact O-N 3.14Å; H146-N148 VanDerWaalsContact O-N 3.14Å; N148-Q150 PolarHBondContact O-N 3.17Å
149V60.6Low56.3Low122 Ų122138 Ų13874%0.73976%0.764SS**  trans-71.990.2167.3178.70000106.2P147 L151P147-V149 PolarHBondContact O-N 3.17Å; V149-L151 HydrophobicContact CG1-CD2 4.47Å; V149-L151 PolarHBondContact O-N 3.01Å
150Q66.9Low56.6Low158 Ų158141.1 Ų141.174%0.73876%0.761SS**  trans-72.295.2176.6-163.497.330.300108.5N148N148-Q150 PolarHBondContact O-N 3.17Å
151L74.3Confident56.5Low137 Ų137140.8 Ų140.872%0.71777%0.771SS**  trans-68134.1166.9-67.1171.5000108.7V149 S153V149-L151 HydrophobicContact CG1-CD2 4.47Å; V149-L151 PolarHBondContact O-N 3.01Å; L151-S153 PolarHBondContact O-N 3.28Å
152W73.5Confident56.9Low241 Ų241136.5 Ų136.591%0.91376%0.762SS**  trans-68.5118.6176.617925.2000110.3G154W152-G154 VanDerWaalsContact C-N 3.33Å; W152-G154 PolarHBondContact O-N 2.91Å
153S74.1Confident57.1Low115 Ų115135.2 Ų135.280%0.80476%0.759SS**  trans-87.111.1-175.6-390000115.2L151L151-S153 PolarHBondContact O-N 3.28Å
154G73.7Confident57.3Low36 Ų36138.2 Ų138.237%0.37176%0.758SS.*  trans65.8178.2-173.700000114.1W152W152-G154 VanDerWaalsContact C-N 3.33Å; W152-G154 PolarHBondContact O-N 2.91Å
155P72.2Confident58Low118 Ų118141 Ų14177%0.76676%0.764SS**  trans-71.7128.2179.426.9-31.3000111.7T157P155-T157 PolarHBondContact O-N 3.29Å
156N58.2Low58.8Low150 Ų150142.1 Ų142.180%0.80276%0.764SS**  trans-69.3111.2179-129.1-21.1000110.2T158N156-T158 PolarHBondContact O-N 3.5Å
157T56Low58.9Low137 Ų137140 Ų14084%0.8477%0.767SS**  trans-8244.817454.90000111.5P155 R159P155-T157 PolarHBondContact O-N 3.29Å; T157-R159 PolarHBondContact O-N 3.12Å
158T52.7Low58.9Low104 Ų104144 Ų14464%0.63877%0.773SS**  trans-81.592.6170.4-24.30000108.2N156 K160N156-T158 PolarHBondContact O-N 3.5Å; T158-K160 PolarHBondContact O-N 3.22Å
159R49.2Very low59Low243 Ų243147.3 Ų147.392%0.91778%0.781SS**  trans-46100.9167.6-169.6-177.1-152.6-140.15.7108.6T157 G161T157-R159 PolarHBondContact O-N 3.12Å; R159-G161 VanDerWaalsContact C-N 3.3Å; R159-G161 PolarHBondContact O-N 3.26Å
160K52.7Low59Low197 Ų197153 Ų15386%0.85779%0.789SS**  trans-65.296.7168.8-77-151.5178.7-174.40107.5T158 S162T158-K160 PolarHBondContact O-N 3.22Å; K160-S162 PolarHBondContact O-N 3.34Å; K160-S162 VanDerWaalsContact O-N 3.1Å
161G40.9Very low58.6Low78 Ų78158.8 Ų158.880%0.80481%0.812SS**  trans-65100.1159.400000108.3R159R159-G161 VanDerWaalsContact C-N 3.3Å; R159-G161 PolarHBondContact O-N 3.26Å
162S49.4Very low57.8Low100 Ų100159.9 Ų159.970%0.69982%0.817SS**  trans-103.9102.316455.10000108.9K160K160-S162 PolarHBondContact O-N 3.34Å; K160-S162 VanDerWaalsContact O-N 3.1Å
163S51Low57Low106 Ų106155.6 Ų155.674%0.74181%0.812SS**  trans46.198.9143.758.70000118.5
164R48Very low56Low231 Ų231157.9 Ų157.987%0.87281%0.812SS**PPolyproline II helixtrans-60.3130.9152.8-175.4177.8177.5-168.10.8109.2Q166R164-Q166 PolarHBondContact O-N 3.19Å
165P56.9Low55Low118 Ų118165.1 Ų165.177%0.76684%0.838SS**PPolyproline II helixtrans-69125.4172.427.1-30.3000109S167P165-S167 PolarHBondContact O-N 2.9Å
166Q58.1Low53.9Low186 Ų186168 Ų16887%0.86984%0.842SS**PPolyproline II helixtrans-70119.4170-74.7-146.6-18.200109.7R164 K168R164-Q166 PolarHBondContact O-N 3.19Å; Q166-K168 PolarHBondContact O-N 2.95Å
167S55.7Low53.6Low113 Ų113169.2 Ų169.279%0.7985%0.845SS**  trans-65.8108.3166.3270000109.6P165 K169P165-S167 PolarHBondContact O-N 2.9Å; S167-K169 PolarHBondContact O-N 3.33Å
168K57.4Low53.4Low198 Ų198171.5 Ų171.586%0.86185%0.845SS**  trans-71.3102.4166.7-73.4-177.6178.7174.80109Q166 R170Q166-K168 PolarHBondContact O-N 2.95Å; K168-R170 PolarHBondContact O-N 3.07Å
169K58.4Low53.5Low206 Ų206176.7 Ų176.790%0.89686%0.861SS**  trans-73.1112.8153.3-98.2-176174.1-179.20107.3S167S167-K169 PolarHBondContact O-N 3.33Å
170R59.9Low53.8Low241 Ų241171.2 Ų171.291%0.90986%0.857SS**  trans-83.1143.5160.4-85.8-177.8145.7170-7.1108.8K168K168-R170 PolarHBondContact O-N 3.07Å
171K57.7Low54Low280 Ų280168.8 Ų168.8100%1.21786%0.857SS**  trans-55.80179.9-159.9178.2-173.3-178.90112.3

Retrieved 171 of 171 residues in 24.9 ms (Link to these results)