A0A077ZL73_TRITR Loading...

Retroviral polymerase SH3-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZL73, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 115 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
1M69.2Low91.1Very high249 Ų249126.2 Ų126.2100%1.22763%0.632SS**  0137.70-143.1-176.6-7100107.5
2R84.4Confident91.5Very high224 Ų224116.9 Ų116.985%0.84559%0.589SS**  trans-94.1127.6179.9-174.8174.7178.3173.4-1109.6
3A89.4Confident91.5Very high98 Ų98117.8 Ų117.881%0.8160%0.596SS**  trans-64.9145.5172.100000110.4
4R92.2Very high91.5Very high150 Ų150122.3 Ų122.357%0.56661%0.609SS**  trans-115.6145.7178.3-60.3178.6-163.31621.3109.2V22 L29R4-V22 HydrophobicContact CB-CG1 4.27Å; R4-L29 VanDerWaalsContact NH1-CD1 3.26Å
5K93.4Very high91.3Very high168 Ų168118.4 Ų118.473%0.7361%0.613SS**  trans-96.9139173-169.7174.2-178.9177.10109.1
6G94.1Very high91.3Very high32 Ų32121.9 Ų121.933%0.3362%0.622SS.*  trans-156.1178.5177.600000111.8W21G6-W21 CarbonylContact C-O 3.46Å; G6-W21 WeakPolarHBondContact CA-O 3.35Å
7L94.6Very high91.6Very high111 Ų111115.5 Ų115.558%0.58159%0.593SS**EExtended strand (participates in β ladder)trans-98132.9177.6-68.5132.8000108.9V9 I20 W21L7-V9 PolarHBondContact O-N 3.04Å; L7-I20 CarbonylContact O-C 3.6Å; L7-I20 WeakPolarHBondContact O-CA 3.45Å; L7-W21 PolarHBondContact N-O 3.4Å; L7-W21 PolarHBondContact O-N 3.2Å
8L95.5Very high91.8Very high93 Ų93112.9 Ų112.949%0.48758%0.575SS.*EExtended strand (participates in β ladder)trans-65.7121.7170.1175.963.4000108.5W18 I20 F36L8-W18 HydrophobicContact CD1-CB 4.01Å; L8-W18 HydrophobicContact CD1-CD2 4.4Å; L8-W18 HydrophobicContact CD1-CE3 3.9Å; L8-W18 HydrophobicContact CD1-CG 4.47Å; L8-I20 HydrophobicContact CB-CD1 4.38Å; L8-I20 HydrophobicContact CD1-CD1 3.87Å; L8-F36 HydrophobicContact CB-CE1 4.33Å; L8-F36 HydrophobicContact CD1-CE1 4.12Å; L8-F36 HydrophobicContact CD2-CE1 3.84Å; L8-F36 HydrophobicContact CD2-CZ 4.5Å; L8-F36 HydrophobicContact CG-CE1 4.31Å
9V96.2Very high92.1Very high82 Ų82111.3 Ų111.350%0.49756%0.561SS.*EExtended strand (participates in β ladder)trans-117.8-0.9179.5-61.40000113.4L7 R19 W21 V28L7-V9 PolarHBondContact O-N 3.04Å; V9-R19 HydrophobicContact CG2-CB 3.73Å; V9-R19 WeakPolarHBondContact CG2-O 3.48Å; V9-R19 PolarHBondContact N-O 3.06Å; V9-W21 HydrophobicContact CG1-CB 3.68Å; V9-V28 HydrophobicContact CG2-CG1 4.01Å; V9-V28 HydrophobicContact CG2-CG2 4.42Å
10G96.4Very high92.3Very high26 Ų26106.9 Ų106.927%0.26854%0.538SS..EExtended strand (participates in β ladder)trans148.1-162.817300000113.6R19G10-R19 PolarHBondContact N-O 3.13Å; G10-R19 PolarHBondContact O-N 3.12Å
11Y96.8Very high92.5Very high155 Ų155106.2 Ų106.261%0.60853%0.53SS*.EExtended strand (participates in β ladder)trans-88155176.2-67.6-82.4000111.9W18 R19Y11-W18 AromaticContact CD1-CE3 3.86Å; Y11-W18 HydrophobicContact CD1-CE3 3.86Å; Y11-W18 HydrophobicContact CD1-CH2 4.31Å; Y11-W18 AromaticContact CD1-CZ3 3.6Å; Y11-W18 HydrophobicContact CD1-CZ3 3.6Å; Y11-W18 AromaticContact CE1-CE3 3.85Å; Y11-W18 HydrophobicContact CE1-CE3 3.85Å; Y11-W18 AromaticContact CE1-CH2 3.56Å; Y11-W18 HydrophobicContact CE1-CH2 3.56Å; Y11-W18 AromaticContact CE1-CZ3 3.09Å; Y11-W18 HydrophobicContact CE1-CZ3 3.09Å; Y11-W18 AromaticContact CZ-CZ3 3.64Å; Y11-R19 WeakPolarHBondContact O-CD 3.34Å; Y11-R19 VanDerWaalsContact O-CG 3.27Å; Y11-R19 WeakPolarHBondContact O-CG 3.41Å
12A95.5Very high93.8Very high15 Ų1594.6 Ų94.612%0.12447%0.473CS..  trans-57.2140.5171.700000111.2K14 G17 E30A12-K14 VanDerWaalsContact C-N 3.28Å; A12-K14 PolarHBondContact O-N 2.94Å; A12-G17 PolarHBondContact N-O 3.09Å; A12-E30 HydrophobicContact CB-CG 4.14Å
13L92Very high94.3Very high129 Ų12987.3 Ų87.368%0.67545%0.454SS*.SBendtrans-68.5-31.4178.5-64.6179000111.7E30L13-E30 PolarHBondContact N-OE1 3.15Å
14K91.3Very high94.6Very high180 Ų18089.5 Ų89.578%0.78345%0.448SS*.SBendtrans-127.9119.8179-66.9-176.2179.5178.30110.6A12A12-K14 VanDerWaalsContact C-N 3.28Å; A12-K14 PolarHBondContact O-N 2.94Å
15G89.1Confident94.7Very high64 Ų6485.5 Ų85.566%0.6644%0.437SS*.SBendtrans78.2-156.4175.500000113.5
16K91.1Very high94.9Very high175 Ų17585.2 Ų85.276%0.76144%0.439SS*.SBendtrans-89.4137.5-179.2-58.5-176.9-179-1760109.6R32K16-R32 WeakPolarHBondContact O-CD 3.16Å; K16-R32 WeakPolarHBondContact O-CG 3.16Å; K16-R32 PolarHBondContact O-NE 3.05Å
17G95.5Very high95Very high13 Ų1387.9 Ų87.913%0.13444%0.442CS..  trans148.6-175.7174.500000113.1A12A12-G17 PolarHBondContact N-O 3.09Å
18W96.5Very high95.1Very high69 Ų6985.2 Ų85.226%0.26143%0.431SS..EExtended strand (participates in β ladder)trans-121.6144.9-174.8-48.9104.7000110.4L8 Y11 I20 E30 S31 F36L8-W18 HydrophobicContact CD1-CB 4.01Å; L8-W18 HydrophobicContact CD1-CD2 4.4Å; L8-W18 HydrophobicContact CD1-CE3 3.9Å; L8-W18 HydrophobicContact CD1-CG 4.47Å; Y11-W18 AromaticContact CD1-CE3 3.86Å; Y11-W18 HydrophobicContact CD1-CE3 3.86Å; Y11-W18 HydrophobicContact CD1-CH2 4.31Å; Y11-W18 AromaticContact CD1-CZ3 3.6Å; Y11-W18 HydrophobicContact CD1-CZ3 3.6Å; Y11-W18 AromaticContact CE1-CE3 3.85Å; Y11-W18 HydrophobicContact CE1-CE3 3.85Å; Y11-W18 AromaticContact CE1-CH2 3.56Å; Y11-W18 HydrophobicContact CE1-CH2 3.56Å; Y11-W18 AromaticContact CE1-CZ3 3.09Å; Y11-W18 HydrophobicContact CE1-CZ3 3.09Å; Y11-W18 AromaticContact CZ-CZ3 3.64Å; W18-I20 HydrophobicContact CB-CD1 3.85Å; W18-I20 HydrophobicContact CB-CG1 4.33Å; W18-E30 CarbonylContact O-C 3.59Å; W18-E30 VanDerWaalsContact O-CA 3.28Å; W18-E30 WeakPolarHBondContact O-CA 3.05Å; W18-S31 PolarHBondContact N-O 3.36Å; W18-S31 PolarHBondContact O-N 2.92Å; W18-F36 AromaticContact CD1-CZ 3.94Å; W18-F36 HydrophobicContact CD2-CE2 4.46Å; W18-F36 AromaticContact CD2-CZ 3.75Å; W18-F36 HydrophobicContact CD2-CZ 3.75Å; W18-F36 AromaticContact CE2-CE2 3.93Å; W18-F36 AromaticContact CE2-CZ 3.68Å; W18-F36 HydrophobicContact CE3-CZ 4.28Å; W18-F36 AromaticContact CG-CZ 3.92Å; W18-F36 HydrophobicContact CG-CZ 3.92Å; W18-F36 HydrophobicContact CZ2-CE2 4.15Å; W18-F36 HydrophobicContact CZ2-CZ 4.17Å; W18-F36 AromaticContact NE1-CE2 3.9Å; W18-F36 AromaticContact NE1-CZ 3.79Å
19R97Very high95Very high82 Ų8283 Ų8331%0.30942%0.419SS..EExtended strand (participates in β ladder)trans-94.2121.5167-73.5-178.481.3-168.80.4108.5V9 G10 Y11 V28 L29 E30V9-R19 HydrophobicContact CG2-CB 3.73Å; V9-R19 WeakPolarHBondContact CG2-O 3.48Å; V9-R19 PolarHBondContact N-O 3.06Å; G10-R19 PolarHBondContact N-O 3.13Å; G10-R19 PolarHBondContact O-N 3.12Å; Y11-R19 WeakPolarHBondContact O-CD 3.34Å; Y11-R19 VanDerWaalsContact O-CG 3.27Å; Y11-R19 WeakPolarHBondContact O-CG 3.41Å; R19-V28 HydrophobicContact CB-CG1 3.7Å; R19-V28 HydrophobicContact CG-CG1 4.1Å; R19-L29 CarbonylContact C-O 3.53Å; R19-L29 WeakPolarHBondContact CA-O 3.5Å; R19-E30 HydrophobicContact CG-CG 3.76Å
20I96Very high95Very high22 Ų2283.6 Ų83.611%0.11342%0.416CS..EExtended strand (participates in β ladder)trans-119.7118.9-176.6-51.3-58.9000108.4L7 L8 W18 V22 V28 L29L7-I20 CarbonylContact O-C 3.6Å; L7-I20 WeakPolarHBondContact O-CA 3.45Å; L8-I20 HydrophobicContact CB-CD1 4.38Å; L8-I20 HydrophobicContact CD1-CD1 3.87Å; W18-I20 HydrophobicContact CB-CD1 3.85Å; W18-I20 HydrophobicContact CB-CG1 4.33Å; I20-V22 HydrophobicContact CG2-CG2 4.28Å; I20-V22 PolarHBondContact O-N 3.07Å; I20-V28 WeakPolarHBondContact O-CA 3.15Å; I20-L29 PolarHBondContact N-O 3.29Å; I20-L29 PolarHBondContact O-N 3.21Å
21W97.1Very high94.8Very high94 Ų9484.4 Ų84.436%0.35642%0.418SS..EExtended strand (participates in β ladder)trans-75.2119.8168.9173.8-107.9000109.5G6 L7 V9 Q26 Q27 V28G6-W21 CarbonylContact C-O 3.46Å; G6-W21 WeakPolarHBondContact CA-O 3.35Å; L7-W21 PolarHBondContact N-O 3.4Å; L7-W21 PolarHBondContact O-N 3.2Å; V9-W21 HydrophobicContact CG1-CB 3.68Å; W21-Q26 HydrophobicContact CH2-CB 4.12Å; W21-Q26 VanDerWaalsContact CH2-O 3.29Å; W21-Q26 WeakPolarHBondContact CH2-O 3.44Å; W21-Q26 HydrophobicContact CZ2-CB 4.39Å; W21-Q26 WeakPolarHBondContact CZ3-O 3.45Å; W21-Q27 VanDerWaalsContact CE3-C 3.43Å; W21-V28 HydrophobicContact CE3-CG2 3.7Å; W21-V28 HydrophobicContact CZ3-CG2 4.33Å
22V96Very high94.7Very high4 Ų485.6 Ų85.62%0.02442%0.422CS..EExtended strand (participates in β ladder)trans-106105.5179-177.50000108.7R4 I20 E24 L25 Q26 Q27 L29R4-V22 HydrophobicContact CB-CG1 4.27Å; I20-V22 HydrophobicContact CG2-CG2 4.28Å; I20-V22 PolarHBondContact O-N 3.07Å; V22-E24 VanDerWaalsContact C-N 3.3Å; V22-E24 HydrophobicContact CG1-CB 4.32Å; V22-E24 PolarHBondContact O-N 2.82Å; V22-L25 HydrophobicContact CB-CB 4.36Å; V22-L25 HydrophobicContact CB-CD1 4.44Å; V22-L25 HydrophobicContact CG1-CB 4.16Å; V22-L25 HydrophobicContact CG1-CD1 3.98Å; V22-L25 HydrophobicContact CG1-CG 3.99Å; V22-L25 PolarHBondContact O-N 2.91Å; V22-L25 VanDerWaalsContact O-N 3.1Å; V22-Q26 PolarHBondContact O-N 3.39Å; V22-Q27 PolarHBondContact N-O 3.46Å; V22-L29 HydrophobicContact CG2-CD1 3.79Å; V22-L29 HydrophobicContact CG2-CG 4.21Å
23P94.9Very high94.6Very high71 Ų7192.2 Ų92.246%0.46146%0.455SS..G310 helixtrans-63.4-35.4-173.324.5-33.7000112.6L25 Q26P23-L25 PolarHBondContact O-N 2.98Å; P23-L25 VanDerWaalsContact O-N 3.13Å; P23-Q26 PolarHBondContact O-N 3.47Å
24E94.8Very high94.5Very high145 Ų14588.1 Ų88.168%0.67844%0.436SS*.G310 helixtrans-58.4-26.4177.2-65.1176.9-111.800113.1V22V22-E24 VanDerWaalsContact C-N 3.3Å; V22-E24 HydrophobicContact CG1-CB 4.32Å; V22-E24 PolarHBondContact O-N 2.82Å
25L95.3Very high94.5Very high65 Ų6585.9 Ų85.934%0.3444%0.438SS..G310 helixtrans-114.6-1.3-174.4-63.9178.8000113.3V22 P23 Q27 L29V22-L25 HydrophobicContact CB-CB 4.36Å; V22-L25 HydrophobicContact CB-CD1 4.44Å; V22-L25 HydrophobicContact CG1-CB 4.16Å; V22-L25 HydrophobicContact CG1-CD1 3.98Å; V22-L25 HydrophobicContact CG1-CG 3.99Å; V22-L25 PolarHBondContact O-N 2.91Å; V22-L25 VanDerWaalsContact O-N 3.1Å; P23-L25 PolarHBondContact O-N 2.98Å; P23-L25 VanDerWaalsContact O-N 3.13Å; L25-Q27 HydrophobicContact CB-CG 3.68Å; L25-Q27 HydrophobicContact CD1-CG 4.5Å; L25-Q27 PolarHBondContact O-N 2.79Å; L25-Q27 VanDerWaalsContact O-N 3.09Å; L25-Q27 PolarHBondContact O-NE2 3.45Å; L25-L29 HydrophobicContact CD1-CD1 4.24Å
26Q97Very high94.6Very high163 Ų16388 Ų8876%0.76243%0.429SS*.THydrogen-bonded Turntrans43.841.8-174.3-62.2-176.9-41.600113.2W21 V22 P23W21-Q26 HydrophobicContact CH2-CB 4.12Å; W21-Q26 VanDerWaalsContact CH2-O 3.29Å; W21-Q26 WeakPolarHBondContact CH2-O 3.44Å; W21-Q26 HydrophobicContact CZ2-CB 4.39Å; W21-Q26 WeakPolarHBondContact CZ3-O 3.45Å; V22-Q26 PolarHBondContact O-N 3.39Å; P23-Q26 PolarHBondContact O-N 3.47Å
27Q97Very high94.4Very high87 Ų8785.7 Ų85.741%0.40743%0.429SS..EExtended strand (participates in β ladder)trans-144155.9-177.170.8-170.9-94.700112.5W21 V22 L25 L29W21-Q27 VanDerWaalsContact CE3-C 3.43Å; V22-Q27 PolarHBondContact N-O 3.46Å; L25-Q27 HydrophobicContact CB-CG 3.68Å; L25-Q27 HydrophobicContact CD1-CG 4.5Å; L25-Q27 PolarHBondContact O-N 2.79Å; L25-Q27 VanDerWaalsContact O-N 3.09Å; L25-Q27 PolarHBondContact O-NE2 3.45Å; Q27-L29 HydrophobicContact CG-CD2 3.97Å; Q27-L29 HydrophobicContact CG-CG 4.18Å
28V96.1Very high93.9Very high55 Ų5593 Ų9333%0.33346%0.46SS..EExtended strand (participates in β ladder)trans-91.5124169.7-178.30000108.9V9 R19 I20 W21V9-V28 HydrophobicContact CG2-CG1 4.01Å; V9-V28 HydrophobicContact CG2-CG2 4.42Å; R19-V28 HydrophobicContact CB-CG1 3.7Å; R19-V28 HydrophobicContact CG-CG1 4.1Å; I20-V28 WeakPolarHBondContact O-CA 3.15Å; W21-V28 HydrophobicContact CE3-CG2 3.7Å; W21-V28 HydrophobicContact CZ3-CG2 4.33Å
29L94.2Very high93.1Very high46 Ų4698.3 Ų98.324%0.24148%0.484CS..EExtended strand (participates in β ladder)trans-106.6144.1174.1-62.1178.9000110.3R4 R19 I20 V22 L25 Q27R4-L29 VanDerWaalsContact NH1-CD1 3.26Å; R19-L29 CarbonylContact C-O 3.53Å; R19-L29 WeakPolarHBondContact CA-O 3.5Å; I20-L29 PolarHBondContact N-O 3.29Å; I20-L29 PolarHBondContact O-N 3.21Å; V22-L29 HydrophobicContact CG2-CD1 3.79Å; V22-L29 HydrophobicContact CG2-CG 4.21Å; L25-L29 HydrophobicContact CD1-CD1 4.24Å; Q27-L29 HydrophobicContact CG-CD2 3.97Å; Q27-L29 HydrophobicContact CG-CG 4.18Å
30E95.1Very high91.8Very high95 Ų95100 Ų10044%0.44451%0.505SS..EExtended strand (participates in β ladder)trans-93.6128.8165.9-72.3-174.1176.800109.9A12 L13 W18 R19A12-E30 HydrophobicContact CB-CG 4.14Å; L13-E30 PolarHBondContact N-OE1 3.15Å; W18-E30 CarbonylContact O-C 3.59Å; W18-E30 VanDerWaalsContact O-CA 3.28Å; W18-E30 WeakPolarHBondContact O-CA 3.05Å; R19-E30 HydrophobicContact CG-CG 3.76Å
31S92.7Very high90.2Very high44 Ų44103.5 Ų103.531%0.30853%0.527SS..EExtended strand (participates in β ladder)trans-145.1144.7174.2-175.90000111.4W18 D33W18-S31 PolarHBondContact N-O 3.36Å; W18-S31 PolarHBondContact O-N 2.92Å; S31-D33 PolarHBondContact OG-N 3.33Å; S31-D33 VanDerWaalsContact OG-N 3.11Å; S31-D33 PolarHBondContact OG-O 3.17Å
32R94.5Very high88.5Confident180 Ų180104.9 Ų104.968%0.67955%0.545SS*.SBendtrans-92.2-25.2168.3-68.2179.7-176.7176.33.2112.1K16 C34K16-R32 WeakPolarHBondContact O-CD 3.16Å; K16-R32 WeakPolarHBondContact O-CG 3.16Å; K16-R32 PolarHBondContact O-NE 3.05Å; R32-C34 PolarHBondContact O-N 3.47Å
33D92.8Very high86.7Confident153 Ų153109.6 Ų109.682%0.81858%0.576SS**  trans-96.984.5-174.9-158.3-109.1000108.1S31S31-D33 PolarHBondContact OG-N 3.33Å; S31-D33 VanDerWaalsContact OG-N 3.11Å; S31-D33 PolarHBondContact OG-O 3.17Å
34C90.1Very high85Confident43 Ų43112 Ų11229%0.29159%0.591SS.*  trans-133.4137.1-179-66.70000109.6R32 F36R32-C34 PolarHBondContact O-N 3.47Å; C34-F36 HydrophobicContact CB-CZ 4.5Å
35V91.8Very high82.9Confident134 Ų134115.7 Ų115.781%0.81261%0.605SS**  trans-106.5122.4169-179.70000107.7
36F90.8Very high81.2Confident109 Ų109114.9 Ų114.948%0.47861%0.612SS.*  trans-83.3124.7177.1-63-76000109.7L8 W18 C34L8-F36 HydrophobicContact CB-CE1 4.33Å; L8-F36 HydrophobicContact CD1-CE1 4.12Å; L8-F36 HydrophobicContact CD2-CE1 3.84Å; L8-F36 HydrophobicContact CD2-CZ 4.5Å; L8-F36 HydrophobicContact CG-CE1 4.31Å; W18-F36 AromaticContact CD1-CZ 3.94Å; W18-F36 HydrophobicContact CD2-CE2 4.46Å; W18-F36 AromaticContact CD2-CZ 3.75Å; W18-F36 HydrophobicContact CD2-CZ 3.75Å; W18-F36 AromaticContact CE2-CE2 3.93Å; W18-F36 AromaticContact CE2-CZ 3.68Å; W18-F36 HydrophobicContact CE3-CZ 4.28Å; W18-F36 AromaticContact CG-CZ 3.92Å; W18-F36 HydrophobicContact CG-CZ 3.92Å; W18-F36 HydrophobicContact CZ2-CE2 4.15Å; W18-F36 HydrophobicContact CZ2-CZ 4.17Å; W18-F36 AromaticContact NE1-CE2 3.9Å; W18-F36 AromaticContact NE1-CZ 3.79Å; C34-F36 HydrophobicContact CB-CZ 4.5Å
37V87.1Confident79.1Confident125 Ų125113.3 Ų113.376%0.75862%0.616SS**  trans-107.594.4173.3-175.80000106.8
38E84.2Confident76.8Confident167 Ų167115.2 Ų115.278%0.7864%0.639SS**  trans-67.3133.1170.2-168.3176.6138.300108.8T40E38-T40 PolarHBondContact O-N 2.69Å; E38-T40 VanDerWaalsContact O-N 3.15Å
39K81.5Confident74.9Confident180 Ų180118.4 Ų118.478%0.78366%0.659SS**  trans-74.5104.3165-71.2-179-179.5-179.50106T41K39-T41 PolarHBondContact O-N 2.92Å
40T68.8Low73Confident119 Ų119125.5 Ų125.573%0.7369%0.691SS**  trans-63.591.5166.446.60000108.1E38 V42E38-T40 PolarHBondContact O-N 2.69Å; E38-T40 VanDerWaalsContact O-N 3.15Å; T40-V42 VanDerWaalsContact C-N 3.29Å; T40-V42 PolarHBondContact O-N 2.88Å; T40-V42 VanDerWaalsContact O-N 3.1Å
41T63.3Low70.8Confident95 Ų95128.3 Ų128.358%0.58371%0.709SS**  trans-72.396.9158.653.40000105.1K39 P43K39-T41 PolarHBondContact O-N 2.92Å; T41-P43 VanDerWaalsContact O-CD 3.3Å; T41-P43 WeakPolarHBondContact O-CD 3.27Å; T41-P43 VanDerWaalsContact O-N 3.09Å
42V61.3Low68.7Low122 Ų122129.9 Ų129.974%0.73973%0.732SS**PPolyproline II helixtrans-56.6117.5162.6-1730000104.6T40 P44T40-V42 VanDerWaalsContact C-N 3.29Å; T40-V42 PolarHBondContact O-N 2.88Å; T40-V42 VanDerWaalsContact O-N 3.1Å; V42-P44 VanDerWaalsContact O-N 3.17Å
43P58.5Low66.8Low104 Ų104127.1 Ų127.168%0.67573%0.731SS**PPolyproline II helixtrans-57128.4178.422.2-30.8000106.9T41 K45T41-P43 VanDerWaalsContact O-CD 3.3Å; T41-P43 WeakPolarHBondContact O-CD 3.27Å; T41-P43 VanDerWaalsContact O-N 3.09Å; P43-K45 PolarHBondContact O-N 3.47Å
44P57.2Low64.8Low120 Ų120127 Ų12778%0.77973%0.725SS**PPolyproline II helixtrans-57.4121.5176.623.1-30.8000107.3V42 G46V42-P44 VanDerWaalsContact O-N 3.17Å; P44-G46 PolarHBondContact O-N 2.81Å
45K51.5Low63.2Low224 Ų224132.3 Ų132.397%0.97475%0.749SS**SBendtrans-7175.5172.6-169.6176.9-179.4175.50107.6P43P43-K45 PolarHBondContact O-N 3.47Å
46G59.2Low61.3Low47 Ų47129.9 Ų129.949%0.48574%0.738SS.*SBendtrans-145.2155.3179.500000109.5P44 S48P44-G46 PolarHBondContact O-N 2.81Å; G46-S48 PolarHBondContact O-N 3.38Å
47P53.8Low59.5Low130 Ų130132.4 Ų132.484%0.84475%0.749SS**  trans-61.6127.6-172.226.8-33.1000110.3T49P47-T49 PolarHBondContact O-N 3.38Å
48S48.9Very low58.1Low127 Ų127132.2 Ų132.289%0.88875%0.748SS**  trans-38.3114.8-178.4-70.50000113.2G46G46-S48 PolarHBondContact O-N 3.38Å
49T55.4Low56.4Low123 Ų123128 Ų12876%0.75574%0.737SS**  trans-121.9137.7144.4-39.70000105.2P47 D51P47-T49 PolarHBondContact O-N 3.38Å; T49-D51 PolarHBondContact O-N 3.06Å
50E53.8Low54.8Low194 Ų194125.9 Ų125.991%0.90774%0.742SS**  trans-64.582.9-162.5-172.4174.883.800113.7
51D50.5Low54.1Low154 Ų154124 Ų12482%0.82475%0.747SS**  trans-102.486.6171.9-79.9-81.4000110.1T49 N53T49-D51 PolarHBondContact O-N 3.06Å; D51-N53 PolarHBondContact O-N 3.11Å
52G47.7Very low53.2Low77 Ų77122.3 Ų122.379%0.79475%0.747SS**  trans-68.596.6-176.700000113.5
53N54.5Low52.9Low123 Ų123125.4 Ų125.466%0.65875%0.754SS**  trans-93.973.4154.4-170.434000109.1D51D51-N53 PolarHBondContact O-N 3.11Å
54H50.9Low52.8Low151 Ų151126.6 Ų126.670%0.69976%0.762SS**  trans-112.4101.3176.3-165.5-83.4000110.1S56H54-S56 VanDerWaalsContact C-N 3.33Å; H54-S56 WeakPolarHBondContact ND1-CB 3.39Å; H54-S56 PolarHBondContact ND1-N 2.89Å; H54-S56 PolarHBondContact O-N 3.39Å
55I56.9Low52.5Low154 Ų154128.6 Ų128.679%0.7977%0.765SS**  trans-76.989.9166.6-60159.3000106.5
56S52.6Low52.3Low83 Ų83121.6 Ų121.658%0.5875%0.749SS**PPolyproline II helixtrans-84.2119.3167.640.30000109.6H54H54-S56 VanDerWaalsContact C-N 3.33Å; H54-S56 WeakPolarHBondContact ND1-CB 3.39Å; H54-S56 PolarHBondContact ND1-N 2.89Å; H54-S56 PolarHBondContact O-N 3.39Å
57F51.4Low51.9Low161 Ų161125.2 Ų125.271%0.70676%0.758SS**PPolyproline II helixtrans-96.2116.5168.5-167.5-92.1000108.7
58V57.6Low52Low121 Ų121127.7 Ų127.773%0.73376%0.763SS**PPolyproline II helixtrans-102.5122.3172.6-178.40000107.8
59S49.5Very low51.9Low80 Ų80128.1 Ų128.156%0.55975%0.754SS**PPolyproline II helixtrans-77.7142.7178.6-62.50000110.7G61S59-G61 PolarHBondContact O-N 2.96Å
60P48.4Very low51.6Low134 Ų134127.8 Ų127.887%0.8776%0.757SS**THydrogen-bonded Turntrans-73106.8178.430.7-30.4000108.2
61G52.6Low51.4Low81 Ų81128.3 Ų128.384%0.83576%0.756SS**THydrogen-bonded Turntrans157.5-5.3-17600000114.9S59S59-G61 PolarHBondContact O-N 2.96Å
62G45.4Very low51Low58 Ų58127.1 Ų127.160%0.59876%0.757SS**  trans-102105.9169.500000110.9P64G62-P64 WeakPolarHBondContact O-CD 3.19Å
63E54.5Low50.8Low188 Ų188131.2 Ų131.288%0.87976%0.755SS**  trans-66123.2159.7-62.1176.695.100107.4D65E63-D65 PolarHBondContact O-N 3.31Å; E63-D65 VanDerWaalsContact O-N 3.12Å
64P56.7Low50.5Low129 Ų129133.6 Ų133.684%0.83876%0.762SS**  trans-74.2101.7165.128.6-28.3000107.6G62G62-P64 WeakPolarHBondContact O-CD 3.19Å
65D49.8Very low50.6Low161 Ų161135 Ų13586%0.86177%0.769SS**  trans-52.4147.5171.1-159.4-120.5000110.9E63E63-D65 PolarHBondContact O-N 3.31Å; E63-D65 VanDerWaalsContact O-N 3.12Å
66A48.5Very low50.1Low77 Ų77136.9 Ų136.964%0.63678%0.776SS**SBendtrans-58.8174.8-17100000114.7
67D50.2Low49.7Very low123 Ų123136.2 Ų136.266%0.65878%0.783SS**  trans85.578.2169.9-79.1-92.9000118.1
68L56.7Low49.2Very low183 Ų183135.2 Ų135.296%0.95879%0.785SS**  trans-134.988.8138.4-73.7-179.8000110.7
69I46.9Very low48.8Very low136 Ų136137.9 Ų137.970%0.69779%0.79SS**  trans-47.1135.5165.6-66.2154.1000111.8
70S48.9Very low48.6Very low116 Ų116143 Ų14381%0.81181%0.805SS**  174.5104127.9-740000112.8
71K48.6Very low48.4Very low205 Ų205145 Ų14589%0.89180%0.803SS**  trans-100.4151151.7-93.3-163.9174-172.80106.9
72P43.6Very low48.2Very low129 Ų129146.7 Ų146.784%0.83880%0.799SS**  -157.6174.567.238.5-16.1000116.8
73H42.2Very low48.1Very low163 Ų163148.8 Ų148.876%0.75580%0.802SS**  trans163.3104.4149.5-163.658.3000108.8
74E48.3Very low47.6Very low172 Ų172146.8 Ų146.880%0.80480%0.803SS**  75.1148.375.8-74.9-166.1109.400117.4
75E54.3Low47Very low182 Ų182150.8 Ų150.885%0.8581%0.807SS**  trans95.9109.3178.5-149.9176.6132.200115.9
76M46Very low46.6Very low192 Ų192146.7 Ų146.795%0.94680%0.803SS**  cis102.9122.431.9-165.9175-9000113.3
77G42.7Very low46.5Very low70 Ų70152.5 Ų152.572%0.72282%0.817SS**  trans122.888.9165.300000114.9
78N42.5Very low45.8Very low140 Ų140150.3 Ų150.375%0.74982%0.823SS**  83.9122.683.3-163.834.9000114.5
79E48.7Very low45.1Very low177 Ų177146.5 Ų146.583%0.82781%0.807SS**  159.2103128.7-82179.595.200114.2
80Q45.8Very low44.8Very low188 Ų188148 Ų14888%0.87981%0.811SS**  trans26.8131147.7-70.8173.61.400125.3
81E43Very low44.8Very low176 Ų176150.6 Ų150.682%0.82282%0.816SS**  trans-68.6165.5160-104.5-172.3100.500113.6
82P48.2Very low45.1Very low116 Ų116149.6 Ų149.675%0.75382%0.815SS**  -159-163.588.245.5-22.9000115
83P44.5Very low45.2Very low102 Ų102148.9 Ų148.966%0.66281%0.81SS**  -113.1162.9-96.735.2-17.4000112.4
84T43.8Very low45.7Very low146 Ų146145.6 Ų145.690%0.89681%0.811SS**  trans-155.4121.2155.4-5.40000114
85K44.5Very low45.5Very low213 Ų213144.6 Ų144.693%0.92681%0.806SS**  trans-57.2145.9164.7-74.3172.8170.7179.10110.8
86G41.4Very low45.6Very low75 Ų75142.3 Ų142.377%0.77380%0.804SS**  trans16797.6160.600000111.2G88G86-G88 PolarHBondContact O-N 2.86Å
87E45.2Very low46.2Very low199 Ų199139.4 Ų139.493%0.9379%0.788SS**  trans-61.2120.9-176.6-71.3162.283.600112.9
88G36.6Very low47Very low76 Ų76141.7 Ų141.778%0.78479%0.79SS**  69.169.512400000119.3G86G86-G88 PolarHBondContact O-N 2.86Å
89T42.5Very low48.1Very low103 Ų103140.3 Ų140.363%0.63279%0.787SS**  trans-148.2134.4160.1-28.90000111.8
90E39.7Very low48.7Very low169 Ų169136.4 Ų136.479%0.7977%0.772SS**  trans44.3115.2147.864.6-157.933.600120.9
91N48.8Very low49.5Very low169 Ų169131.2 Ų131.290%0.90476%0.761SS**  trans-137111.3154.8-83.1-77.1000111.1
92E54.5Low50.5Low185 Ų185132.3 Ų132.386%0.86476%0.757SS**  trans-62.5163.1164.1-105.3-177.875.200112.1
93P46.7Very low51Low114 Ų114129.7 Ų129.774%0.7474%0.742SS**  trans-80.5130.4-157.832-33.9000113.1E95P93-E95 PolarHBondContact O-N 2.83Å
94A51.7Low51.8Low93 Ų93129.5 Ų129.577%0.76974%0.735SS**  trans-71.6108.3166.100000109.8V96A94-V96 PolarHBondContact O-N 3.09Å
95E44.9Very low52.9Low152 Ų152127.1 Ų127.171%0.7172%0.716SS**  trans-65.197.4172.7-172.1168.2103.500110P93 H97P93-E95 PolarHBondContact O-N 2.83Å; E95-H97 PolarHBondContact O-N 2.87Å; E95-H97 VanDerWaalsContact O-N 3.13Å; E95-H97 IonicContact OE1-CE1 2.94Å; E95-H97 PolarHBondContact OE1-CE1 3.46Å; E95-H97 IonicContact OE1-ND1 3.87Å; E95-H97 IonicContact OE1-NE2 3.15Å; E95-H97 PolarHBondContact OE1-NE2 2.92Å; E95-H97 VanDerWaalsContact OE1-NE2 3.15Å
96V57.1Low53.9Low134 Ų134123.9 Ų123.981%0.81271%0.706SS**  trans-77.693.4171.4-178.90000107.8A94A94-V96 PolarHBondContact O-N 3.09Å
97H58Low54.9Low131 Ų131128.2 Ų128.261%0.60670%0.699SS**  trans-59.5128.9172.5-73.1-79.4000110.2E95 T99E95-H97 PolarHBondContact O-N 2.87Å; E95-H97 VanDerWaalsContact O-N 3.13Å; E95-H97 IonicContact OE1-CE1 2.94Å; E95-H97 PolarHBondContact OE1-CE1 3.46Å; E95-H97 IonicContact OE1-ND1 3.87Å; E95-H97 IonicContact OE1-NE2 3.15Å; E95-H97 PolarHBondContact OE1-NE2 2.92Å; E95-H97 VanDerWaalsContact OE1-NE2 3.15Å; H97-T99 PolarHBondContact O-N 3.05Å; H97-T99 VanDerWaalsContact O-N 3.09Å
98P58.6Low55.7Low118 Ų118123.8 Ų123.877%0.76668%0.682SS**  trans-63117.6172.925.8-31.4000107.9D100P98-D100 VanDerWaalsContact C-N 3.35Å; P98-D100 PolarHBondContact O-N 3.3Å
99T65Low56.8Low110 Ų110126.3 Ų126.368%0.67568%0.675SS**  trans-67100.5170.1-57.90000106.8H97 A101H97-T99 PolarHBondContact O-N 3.05Å; H97-T99 VanDerWaalsContact O-N 3.09Å; T99-A101 PolarHBondContact O-N 3.26Å
100D62.7Low57.8Low96 Ų96125.2 Ų125.251%0.51368%0.676SS.*  trans-57130179-173.5-83.4000109.5P98 R102 S103P98-D100 VanDerWaalsContact C-N 3.35Å; P98-D100 PolarHBondContact O-N 3.3Å; D100-R102 PolarHBondContact O-N 2.89Å; D100-R102 WeakPolarHBondContact OD1-CA 3.32Å; D100-R102 WeakPolarHBondContact OD1-CB 3.45Å; D100-R102 WeakPolarHBondContact OD1-CG 3.29Å; D100-R102 PolarHBondContact OD1-N 3.1Å; D100-S103 WeakPolarHBondContact O-CB 3.42Å; D100-S103 PolarHBondContact O-N 3.32Å
101A63.1Low58.8Low79 Ų79124 Ų12465%0.65368%0.675SS**Hα-helixtrans-55.8-22.3-177.500000112.8T99 L104 L105T99-A101 PolarHBondContact O-N 3.26Å; A101-L104 PolarHBondContact O-N 3.06Å; A101-L105 WeakPolarHBondContact O-CB 3.28Å; A101-L105 PolarHBondContact O-N 3.18Å
102R62.4Low59.2Low198 Ų198124.2 Ų124.275%0.74767%0.67SS**Hα-helixtrans-69.2-32.8173.3-59.6174.1121.9175.5-0.4112.5D100 L104 L105 M106D100-R102 PolarHBondContact O-N 2.89Å; D100-R102 WeakPolarHBondContact OD1-CA 3.32Å; D100-R102 WeakPolarHBondContact OD1-CB 3.45Å; D100-R102 WeakPolarHBondContact OD1-CG 3.29Å; D100-R102 PolarHBondContact OD1-N 3.1Å; R102-L104 VanDerWaalsContact C-N 3.33Å; R102-L105 PolarHBondContact O-N 3.28Å; R102-M106 WeakPolarHBondContact O-CG 3.3Å; R102-M106 PolarHBondContact O-N 3.13Å
103S59.4Low59.3Low61 Ų61121.9 Ų121.943%0.42767%0.668SS.*Hα-helixtrans-71.6-30.6177.8-1610000111.9D100 R107D100-S103 WeakPolarHBondContact O-CB 3.42Å; D100-S103 PolarHBondContact O-N 3.32Å; S103-R107 PolarHBondContact O-N 3.17Å
104L61.3Low60Low99 Ų99122.4 Ų122.452%0.51867%0.669SS.*Hα-helixtrans-74.6-39.9173.7-165.567.4000111.3A101 R102 M106 R107 N108A101-L104 PolarHBondContact O-N 3.06Å; R102-L104 VanDerWaalsContact C-N 3.33Å; L104-M106 PolarHBondContact O-N 2.92Å; L104-R107 PolarHBondContact O-N 2.81Å; L104-N108 PolarHBondContact O-N 2.79Å
105L67.3Low59.8Low95 Ų95127.2 Ų127.250%0.49769%0.692SS.*Hα-helixtrans-63.2-40176.7-169.663.5000112.3A101 R102 N108 M109A101-L105 WeakPolarHBondContact O-CB 3.28Å; A101-L105 PolarHBondContact O-N 3.18Å; R102-L105 PolarHBondContact O-N 3.28Å; L105-N108 PolarHBondContact O-N 3.15Å; L105-M109 HydrophobicContact CD1-CE 3.67Å; L105-M109 HydrophobicContact CD2-CE 3.86Å; L105-M109 HydrophobicContact CG-CE 3.52Å; L105-M109 HydrophobicContact CG-SD 4.36Å; L105-M109 WeakPolarHBondContact O-CG 3.04Å; L105-M109 PolarHBondContact O-N 3.1Å
106M65.7Low60.6Low146 Ų146126 Ų12672%0.71969%0.692SS**Hα-helixtrans-67.7-33.7176.6-73-112.1-9200113.1R102 L104 N108 A110R102-M106 WeakPolarHBondContact O-CG 3.3Å; R102-M106 PolarHBondContact O-N 3.13Å; L104-M106 PolarHBondContact O-N 2.92Å; M106-N108 VanDerWaalsContact C-N 3.35Å; M106-A110 PolarHBondContact O-N 3.05Å
107R62.3Low60.8Low166 Ų166125.5 Ų125.563%0.62669%0.685SS**Hα-helixtrans-65.5-37.9173.6-90.5179.7170.8134.4-2.5112.2S103 L104S103-R107 PolarHBondContact O-N 3.17Å; L104-R107 PolarHBondContact O-N 2.81Å
108N60.9Low60.9Low105 Ų105125.2 Ų125.256%0.56169%0.69SS**Hα-helixtrans-74.6-29.2-179.6-68.4-13.7000112.9L104 L105 M106L104-N108 PolarHBondContact O-N 2.79Å; L105-N108 PolarHBondContact O-N 3.15Å; M106-N108 VanDerWaalsContact C-N 3.35Å
109M60.6Low61.1Low130 Ų130125.6 Ų125.664%0.6469%0.685SS**Hα-helixtrans-78-18.2176.9-67.2177.5-179.600113.8L105L105-M109 HydrophobicContact CD1-CE 3.67Å; L105-M109 HydrophobicContact CD2-CE 3.86Å; L105-M109 HydrophobicContact CG-CE 3.52Å; L105-M109 HydrophobicContact CG-SD 4.36Å; L105-M109 WeakPolarHBondContact O-CG 3.04Å; L105-M109 PolarHBondContact O-N 3.1Å
110A63.4Low60.8Low80 Ų80126.6 Ų126.666%0.66169%0.686SS**THydrogen-bonded Turntrans-86.8-5.8-176.900000114.1M106M106-A110 PolarHBondContact O-N 3.05Å
111L61Low60.7Low144 Ų144128.7 Ų128.775%0.75470%0.697SS**SBendtrans-98.91.6-172-105.4124.7000115.2
112E56.5Low60.5Low173 Ų173132.2 Ų132.281%0.80870%0.7SS**  trans-116.977.5-178.8-65.9-17098.900111.9
113V57.5Low60.4Low135 Ų135127.2 Ų127.282%0.81870%0.697SS**  trans-146.5104.1159.1-151.20000109.4
114T59.8Low60.4Low126 Ų126132.7 Ų132.777%0.77372%0.719SS**  trans-160.8139.3165.3-1.30000106.1
115P49.2Very low60.4Low193 Ų193135.7 Ų135.7100%1.25374%0.738SS**  -94.4053.933.3-37.8000116.4

Retrieved 115 of 115 residues in 108.3 ms (Link to these results)