A0A096NP55_PAPAN Loading...

Achaete-scute family bHLH transcription factor 2

AlphaFold DB (A0A2K5KIN7), UniProt , Accession A0A096NP55, Species PAPAN (Papio anubis, Olive baboon), Gene ASCL2, Length 193 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
1M41.2Very low54.2Low230 Ų230138.4 Ų138.4100%1.13386%0.862SS**  0630-58.4-168.916600106.9
2D43.9Very low54.6Low167 Ų167137.3 Ų137.389%0.89386%0.858SS**  72.499.187.3-74-71.1000111.7
3G48.3Very low54.6Low80 Ų80133.4 Ų133.483%0.82585%0.847SS**  trans-143.6101.6167.100000107.7
4G45.1Very low55.1Low78 Ų78133 Ų13380%0.80485%0.846SS**PPolyproline II helixtrans-74.7146.3-157.500000116.6
5A55.3Low54.9Low104 Ų104140.1 Ų140.186%0.8685%0.849SS**PPolyproline II helixtrans-83.4120.6164.200000109.8
6L64.1Low55.2Low164 Ų164140.3 Ų140.386%0.85985%0.85SS**PPolyproline II helixtrans-82.8134.6170.9-68.8171.6000110.3
7P59.7Low55.3Low123 Ų123138.5 Ų138.580%0.79984%0.843SS**PPolyproline II helixtrans-82.2125.6172.931.7-30.5000110.1
8R57.2Low54.8Low244 Ų244137.9 Ų137.992%0.92184%0.839SS**PPolyproline II helixtrans-99.7123.1168.7-79-177.7117.5-169.51.9110.5
9S50.9Low54.5Low118 Ų118136.9 Ų136.983%0.82584%0.838SS**PPolyproline II helixtrans-59.8151.1178.240.80000114.1
10A62.1Low53.8Low96 Ų96135.9 Ų135.979%0.79384%0.836SS**PPolyproline II helixtrans-63.2154.8178.100000114.2
11P68.4Low53.5Low118 Ų118134.3 Ų134.377%0.76684%0.837SS**PPolyproline II helixtrans-102.5157.7158.234.5-28.6000113.6
12P58.6Low53.7Low126 Ų126127.8 Ų127.882%0.81882%0.819SS**PPolyproline II helixtrans-89.5164.6-156.535.4-37.9000116.4
13A55.5Low54Low86 Ų86131.7 Ų131.771%0.71182%0.821SS**PPolyproline II helixtrans-60148.717900000115.1
14P61.8Low54.1Low128 Ų128139.3 Ų139.383%0.83183%0.825SS**PPolyproline II helixtrans-79.4127.6171.830-31.1000112.1
15R51.6Low54.6Low239 Ų239147 Ų14790%0.90283%0.83SS**PPolyproline II helixtrans-69.7130.2175.1-67.5167.7163.8-122.4-2.4110.5
16V59.9Low54.2Low143 Ų143148.2 Ų148.287%0.86783%0.829SS**PPolyproline II helixtrans-68.7133.5168.4-80.30000110.9
17P55.8Low53.8Low111 Ų111146.9 Ų146.972%0.72183%0.828SS**PPolyproline II helixtrans-101.7133.7175.737.6-30.3000112.3
18V47.1Very low53.1Low128 Ų128146.2 Ų146.278%0.77683%0.826SS**  trans59.8108146.1-111.20000120.4
19S49.2Very low53.1Low118 Ų118140.3 Ų140.383%0.82582%0.82SS**  trans-90.4107.7149.263.90000110
20C40Very low52.9Low116 Ų116142.9 Ų142.978%0.78482%0.818SS**  trans-103.491.3164.8-77.50000109.1A22C20-A22 PolarHBondContact O-N 3.42Å
21A47Very low52.6Low104 Ų104145.9 Ų145.986%0.8682%0.82SS**  trans-89.786.6169.100000109.5
22A45.9Very low52.1Low92 Ų92148.1 Ų148.176%0.7683%0.825SS**  trans-105.5106.4167.400000109.5C20 R24C20-A22 PolarHBondContact O-N 3.42Å; A22-R24 PolarHBondContact O-N 2.96Å
23R50.8Low52.1Low250 Ų250152.9 Ų152.994%0.94383%0.827SS**  trans-62.7117.7167.9-65.8173.1-175.8-95.50.4108.6
24R49.5Very low51.5Low239 Ų239155 Ų15590%0.90284%0.835SS**  trans-132.8111.1156.2-80.3-172.8147.1-118.6-3108.9A22A22-R24 PolarHBondContact O-N 2.96Å
25R55.3Low51Low240 Ų240154.9 Ų154.991%0.90684%0.837SS**  trans-66.1133.3166.4-82.7177.2155.5-178.2-6.1108.7
26P48.3Very low50.8Low129 Ų129153.5 Ų153.584%0.83883%0.832SS**  trans-90119159.729.1-21.9000109.9
27T55.9Low50.4Low136 Ų136157.7 Ų157.783%0.83483%0.832SS**  trans-88.7112.6160.343.40000108.2
28S43.5Very low50.3Low110 Ų110163.2 Ų163.277%0.76984%0.838SS**  trans165.1140.8144.2-166.40000110.4E30S28-E30 PolarHBondContact O-N 2.86Å
29P57.9Low50.8Low120 Ų120167.8 Ų167.878%0.77984%0.842SS**  trans-88.9102.3-17034.1-27.6000111.2
30E47.2Very low50.7Low171 Ų171167.7 Ų167.780%0.79984%0.838SS**  trans-114.457.5164.9-126-117.2130.800108.7S28S28-E30 PolarHBondContact O-N 2.86Å
31L54.4Low51.3Low159 Ų159166.7 Ų166.783%0.83284%0.838SS**  trans-85.998.5159.9-66.4179.9000105.7
32L59.1Low51.5Low166 Ų166167.8 Ų167.887%0.86984%0.835SS**SBendtrans-179.78.5147.9-93.8160000117.6
33R58.8Low51.8Low226 Ų226167.2 Ų167.285%0.85383%0.829SS**SBendtrans-134.1122.9160-79.9-171.8174.6156.5-0.6111.7
34C42.8Very low51.9Low130 Ų130163.9 Ų163.988%0.87883%0.825SS**  trans76.754.5-169.9-54.20000115.5R36C34-R36 PolarHBondContact O-N 2.91Å
35S50.7Low52.2Low125 Ų125158.9 Ų158.987%0.87482%0.821SS**  trans-61.686.7151.8-174.50000109.3R37S35-R37 PolarHBondContact O-N 3.49Å; S35-R37 VanDerWaalsContact O-N 3.09Å
36R48.3Very low52.1Low211 Ų211149.9 Ų149.980%0.79680%0.803SS**  trans-40.9106.5154.3-164175.6-153.7-1712.9108.2C34 R38C34-R36 PolarHBondContact O-N 2.91Å; R36-R38 PolarHBondContact O-N 3.45Å
37R51.6Low52.7Low230 Ų230146.3 Ų146.387%0.86879%0.789SS**  trans-58.191157.2-172-176.9-81.1-105.35.8105.8S35 R39S35-R37 PolarHBondContact O-N 3.49Å; S35-R37 VanDerWaalsContact O-N 3.09Å; R37-R39 PolarHBondContact O-N 3.49Å
38R53.8Low53.5Low228 Ų228143.9 Ų143.986%0.8678%0.778SS**  trans-56102.2169.3-82.2-177.1163.9-132.20.5106.8R36R36-R38 PolarHBondContact O-N 3.45Å
39R57.8Low55.6Low224 Ų224141.7 Ų141.785%0.84577%0.767SS**  trans-80.9147154.7-96.5-179.7161160.4-5.3107.9R37R37-R39 PolarHBondContact O-N 3.49Å
40P46.7Very low57Low115 Ų115138.2 Ų138.275%0.74775%0.748SS**  trans-65.9139.9-163.428-33.6000111.2T42P40-T42 PolarHBondContact O-N 3.47Å
41A52.8Low59Low96 Ų96132.2 Ų132.279%0.79373%0.727SS**SBendtrans-71.885.9175.100000110.1
42T50.7Low60.8Low127 Ų127128 Ų12878%0.77971%0.708SS**  trans-165.373.5159.547.10000109.6P40P40-T42 PolarHBondContact O-N 3.47Å
43A52.8Low62.5Low79 Ų79122.7 Ų122.765%0.65369%0.689SS**  trans-176.334.9158.700000112T45A43-T45 PolarHBondContact O-N 3.47Å
44E53Low64.1Low180 Ų180119.1 Ų119.184%0.84168%0.675SS**THydrogen-bonded Turntrans-81.366.5-179.1-65.5-65.3141.500110.5
45T54.1Low66.6Low134 Ų134122.3 Ų122.382%0.82267%0.669SS**THydrogen-bonded Turntrans-164.6-19.5158.1-12.70000113.4A43A43-T45 PolarHBondContact O-N 3.47Å
46G54.8Low68.9Low51 Ų51120.3 Ų120.353%0.52665%0.648SS.*Hα-helixtrans-92.4-24.4-174.300000116.6S48 A49G46-S48 PolarHBondContact O-N 2.8Å; G46-A49 PolarHBondContact O-N 3.5Å
47G61.2Low71.1Confident54 Ų54114.3 Ų114.356%0.55763%0.629SS**Hα-helixtrans-70.1-29.3-177.200000114.4A51G47-A51 PolarHBondContact O-N 2.86Å
48S72.5Confident73.2Confident86 Ų86112.1 Ų112.160%0.60162%0.621SS**Hα-helixtrans-66.3-43.4176.3-175.20000111.2G46 A50 A51 V52G46-S48 PolarHBondContact O-N 2.8Å; S48-A50 PolarHBondContact O-N 3.4Å; S48-A51 PolarHBondContact O-N 3.32Å; S48-V52 WeakPolarHBondContact O-CB 3.09Å; S48-V52 WeakPolarHBondContact O-CG2 3.44Å; S48-V52 PolarHBondContact O-N 3.16Å
49A87.1Confident75.3Confident64 Ų64105.5 Ų105.553%0.52960%0.6SS.*Hα-helixtrans-62.8-43.5-179.100000112.6G46 V52 A53G46-A49 PolarHBondContact O-N 3.5Å; A49-V52 PolarHBondContact O-N 3.39Å; A49-A53 WeakPolarHBondContact O-CB 3.29Å; A49-A53 PolarHBondContact O-N 3.41Å
50A88.1Confident77.2Confident46 Ų46102.8 Ų102.838%0.3859%0.589SS.*Hα-helixtrans-67.6-36.3177.800000112.7S48 R54S48-A50 PolarHBondContact O-N 3.4Å; A50-R54 WeakPolarHBondContact O-CG 3.24Å; A50-R54 PolarHBondContact O-N 3.14Å; A50-R54 VanDerWaalsContact O-N 3.14Å
51A88.2Confident79.5Confident45 Ų4599.4 Ų99.437%0.37257%0.565SS.*Hα-helixtrans-68.6-41.5174.800000112G47 S48 R54 R55G47-A51 PolarHBondContact O-N 2.86Å; S48-A51 PolarHBondContact O-N 3.32Å; A51-R54 PolarHBondContact O-N 2.85Å; A51-R55 PolarHBondContact O-N 3.44Å
52V92.4Very high81.6Confident70 Ų70101.1 Ų101.142%0.42455%0.551SS.*Hα-helixtrans-62.7-43.7174.2170.70000110.8S48 A49 R54 R55 N56S48-V52 WeakPolarHBondContact O-CB 3.09Å; S48-V52 WeakPolarHBondContact O-CG2 3.44Å; S48-V52 PolarHBondContact O-N 3.16Å; A49-V52 PolarHBondContact O-N 3.39Å; V52-R54 PolarHBondContact O-N 3.4Å; V52-R55 WeakPolarHBondContact O-CB 3.47Å; V52-R55 PolarHBondContact O-N 3.28Å; V52-R55 VanDerWaalsContact O-N 3.14Å; V52-N56 WeakPolarHBondContact O-CB 3.26Å; V52-N56 VanDerWaalsContact O-CG 3.3Å; V52-N56 PolarHBondContact O-N 3.44Å; V52-N56 PolarHBondContact O-OD1 3.05Å
53A93.5Very high83.8Confident56 Ų5697.6 Ų97.646%0.46353%0.529SS..Hα-helixtrans-57.9-47.6176.400000111.9A49 R55 N56 E57A49-A53 WeakPolarHBondContact O-CB 3.29Å; A49-A53 PolarHBondContact O-N 3.41Å; A53-R55 VanDerWaalsContact C-N 3.32Å; A53-R55 PolarHBondContact O-N 3.39Å; A53-N56 PolarHBondContact O-N 3.24Å; A53-E57 WeakPolarHBondContact O-CB 3.38Å; A53-E57 PolarHBondContact O-N 3.2Å
54R93.9Very high85.8Confident151 Ų15199.2 Ų99.257%0.5752%0.521SS*.Hα-helixtrans-61.4-37.7175.2-71.8-170-61.2-94.61.1112.8A50 A51 V52 R58A50-R54 WeakPolarHBondContact O-CG 3.24Å; A50-R54 PolarHBondContact O-N 3.14Å; A50-R54 VanDerWaalsContact O-N 3.14Å; A51-R54 PolarHBondContact O-N 2.85Å; V52-R54 PolarHBondContact O-N 3.4Å; R54-R58 VanDerWaalsContact O-CG 3.3Å; R54-R58 WeakPolarHBondContact O-CG 3.3Å; R54-R58 PolarHBondContact O-N 2.89Å
55R95.1Very high87.7Confident197 Ų19793.2 Ų93.274%0.74350%0.495SS*.Hα-helixtrans-66.6-45.1176.2-178.8179.6175.9140.50.5111.5A51 V52 A53 E57 R58 E59A51-R55 PolarHBondContact O-N 3.44Å; V52-R55 WeakPolarHBondContact O-CB 3.47Å; V52-R55 PolarHBondContact O-N 3.28Å; V52-R55 VanDerWaalsContact O-N 3.14Å; A53-R55 VanDerWaalsContact C-N 3.32Å; A53-R55 PolarHBondContact O-N 3.39Å; R55-E57 VanDerWaalsContact C-N 3.29Å; R55-E57 PolarHBondContact O-N 3.39Å; R55-R58 PolarHBondContact O-N 2.86Å; R55-E59 PolarHBondContact O-N 2.92Å; R55-E59 VanDerWaalsContact O-N 3.09Å
56N97.6Very high89.7Confident82 Ų8289.8 Ų89.844%0.43947%0.473SS..Hα-helixtrans-63.4-39.1179.5-71.7-4.5000111.4V52 A53 E59 R60V52-N56 WeakPolarHBondContact O-CB 3.26Å; V52-N56 VanDerWaalsContact O-CG 3.3Å; V52-N56 PolarHBondContact O-N 3.44Å; V52-N56 PolarHBondContact O-OD1 3.05Å; A53-N56 PolarHBondContact O-N 3.24Å; N56-E59 PolarHBondContact O-N 3.23Å; N56-R60 WeakPolarHBondContact O-CG 3.49Å; N56-R60 PolarHBondContact O-N 3.47Å
57E95Very high91.6Very high85 Ų8590.2 Ų90.240%0.39746%0.464SS..Hα-helixtrans-64.4-41.1177.5-166.352-140.400112.1A53 R55 E59 R60 N61A53-E57 WeakPolarHBondContact O-CB 3.38Å; A53-E57 PolarHBondContact O-N 3.2Å; R55-E57 VanDerWaalsContact C-N 3.29Å; R55-E57 PolarHBondContact O-N 3.39Å; E57-E59 VanDerWaalsContact C-N 3.31Å; E57-E59 PolarHBondContact O-N 2.88Å; E57-R60 PolarHBondContact O-N 2.97Å; E57-R60 IonicContact OE2-NH1 3.22Å; E57-R60 PolarHBondContact OE2-NH1 2.93Å; E57-N61 PolarHBondContact O-N 2.9Å
58R96.7Very high93.2Very high185 Ų18589.9 Ų89.970%0.69845%0.449SS*.Hα-helixtrans-59.8-42.2172.7-69170.3-174.5-164.7-0.9112R54 R55 N61 R62R54-R58 VanDerWaalsContact O-CG 3.3Å; R54-R58 WeakPolarHBondContact O-CG 3.3Å; R54-R58 PolarHBondContact O-N 2.89Å; R55-R58 PolarHBondContact O-N 2.86Å; R58-N61 PolarHBondContact O-N 3.27Å; R58-R62 WeakPolarHBondContact O-CB 3.29Å; R58-R62 PolarHBondContact O-N 3.47Å
59E96.8Very high94.3Very high88 Ų8887.2 Ų87.241%0.41144%0.435SS..Hα-helixtrans-68.3-38.3179.1-175.756-160.300112R55 N56 E57 N61 R62 V63R55-E59 PolarHBondContact O-N 2.92Å; R55-E59 VanDerWaalsContact O-N 3.09Å; N56-E59 PolarHBondContact O-N 3.23Å; E57-E59 VanDerWaalsContact C-N 3.31Å; E57-E59 PolarHBondContact O-N 2.88Å; E59-N61 VanDerWaalsContact C-N 3.34Å; E59-N61 PolarHBondContact O-N 3.2Å; E59-R62 PolarHBondContact O-N 3.34Å; E59-R62 IonicContact OE1-CZ 3.84Å; E59-R62 IonicContact OE1-NE 2.9Å; E59-R62 PolarHBondContact OE1-NE 3.38Å; E59-R62 VanDerWaalsContact OE1-NE 3.17Å; E59-R62 IonicContact OE1-NH2 3.89Å; E59-R62 PolarHBondContact OE1-NH2 2.99Å; E59-R62 IonicContact OE2-CZ 3.37Å; E59-R62 IonicContact OE2-NE 3.17Å; E59-R62 PolarHBondContact OE2-NE 3.47Å; E59-R62 IonicContact OE2-NH2 2.72Å; E59-V63 HydrophobicContact CG-CG2 4.46Å; E59-V63 WeakPolarHBondContact O-CB 3.37Å; E59-V63 WeakPolarHBondContact O-CG2 3.45Å; E59-V63 PolarHBondContact O-N 3.27Å; E59-V63 WeakPolarHBondContact OE1-CG2 3.36Å
60R97.6Very high94.6Very high167 Ų16785.8 Ų85.863%0.6342%0.417SS*.Hα-helixtrans-58.1-46.6171.9-74.2175.7178.5160.7-4.5111.5N56 E57 V63 K64N56-R60 WeakPolarHBondContact O-CG 3.49Å; N56-R60 PolarHBondContact O-N 3.47Å; E57-R60 PolarHBondContact O-N 2.97Å; E57-R60 IonicContact OE2-NH1 3.22Å; E57-R60 PolarHBondContact OE2-NH1 2.93Å; R60-V63 PolarHBondContact O-N 2.94Å; R60-K64 WeakPolarHBondContact O-CB 3.39Å; R60-K64 PolarHBondContact O-N 3.47Å
61N95.8Very high94.9Very high45 Ų4588.8 Ų88.824%0.24142%0.423CS..Hα-helixtrans-64.2-41.8178.1-72.8-23.5000112.4E57 R58 E59 V63 K64 L65E57-N61 PolarHBondContact O-N 2.9Å; R58-N61 PolarHBondContact O-N 3.27Å; E59-N61 VanDerWaalsContact C-N 3.34Å; E59-N61 PolarHBondContact O-N 3.2Å; N61-V63 PolarHBondContact O-N 3.28Å; N61-K64 WeakPolarHBondContact O-CB 3.32Å; N61-K64 PolarHBondContact O-N 3.44Å; N61-L65 PolarHBondContact O-N 3.32Å
62R96.7Very high95.1Very high132 Ų13287.3 Ų87.350%0.49841%0.411SS..Hα-helixtrans-60.1-46174.8-165.5-166.272.478.42.3111.7R58 E59 L65 V66R58-R62 WeakPolarHBondContact O-CB 3.29Å; R58-R62 PolarHBondContact O-N 3.47Å; E59-R62 PolarHBondContact O-N 3.34Å; E59-R62 IonicContact OE1-CZ 3.84Å; E59-R62 IonicContact OE1-NE 2.9Å; E59-R62 PolarHBondContact OE1-NE 3.38Å; E59-R62 VanDerWaalsContact OE1-NE 3.17Å; E59-R62 IonicContact OE1-NH2 3.89Å; E59-R62 PolarHBondContact OE1-NH2 2.99Å; E59-R62 IonicContact OE2-CZ 3.37Å; E59-R62 IonicContact OE2-NE 3.17Å; E59-R62 PolarHBondContact OE2-NE 3.47Å; E59-R62 IonicContact OE2-NH2 2.72Å; R62-L65 WeakPolarHBondContact O-CB 3.37Å; R62-L65 PolarHBondContact O-N 3.03Å; R62-V66 WeakPolarHBondContact O-CG2 3.47Å; R62-V66 PolarHBondContact O-N 3.05Å; R62-V66 VanDerWaalsContact O-N 3.13Å
63V97.1Very high95.3Very high52 Ų5286.7 Ų86.732%0.31541%0.405SS..Hα-helixtrans-67.5-37.6178.4172.50000111.4E59 R60 N61 L65 V66 N67E59-V63 HydrophobicContact CG-CG2 4.46Å; E59-V63 WeakPolarHBondContact O-CB 3.37Å; E59-V63 WeakPolarHBondContact O-CG2 3.45Å; E59-V63 PolarHBondContact O-N 3.27Å; E59-V63 WeakPolarHBondContact OE1-CG2 3.36Å; R60-V63 PolarHBondContact O-N 2.94Å; N61-V63 PolarHBondContact O-N 3.28Å; V63-L65 VanDerWaalsContact C-N 3.35Å; V63-L65 PolarHBondContact O-N 3.49Å; V63-V66 PolarHBondContact O-N 2.99Å; V63-N67 WeakPolarHBondContact O-CB 3.49Å; V63-N67 PolarHBondContact O-N 3.29Å; V63-N67 PolarHBondContact O-ND2 2.98Å
64K94.9Very high95.4Very high113 Ų11386 Ų8649%0.49139%0.39SS..Hα-helixtrans-56.7-48173.5-175.3-178.2176.5-175.80110.7R60 N61 V66 N67 L68R60-K64 WeakPolarHBondContact O-CB 3.39Å; R60-K64 PolarHBondContact O-N 3.47Å; N61-K64 WeakPolarHBondContact O-CB 3.32Å; N61-K64 PolarHBondContact O-N 3.44Å; K64-V66 PolarHBondContact O-N 2.69Å; K64-N67 PolarHBondContact O-N 3.33Å; K64-L68 HydrophobicContact CG-CD1 4.35Å; K64-L68 WeakPolarHBondContact O-CG 3.33Å; K64-L68 PolarHBondContact O-N 3.39Å
65L92.4Very high95.4Very high55 Ų5584.7 Ų84.729%0.28839%0.391SS..Hα-helixtrans-57.6-47.6175.3-83165.4000112.7N61 R62 V63 N67 L68 G69 L183 F186N61-L65 PolarHBondContact O-N 3.32Å; R62-L65 WeakPolarHBondContact O-CB 3.37Å; R62-L65 PolarHBondContact O-N 3.03Å; V63-L65 VanDerWaalsContact C-N 3.35Å; V63-L65 PolarHBondContact O-N 3.49Å; L65-N67 VanDerWaalsContact C-N 3.29Å; L65-N67 PolarHBondContact O-N 3.26Å; L65-L68 PolarHBondContact O-N 3.41Å; L65-G69 PolarHBondContact O-N 3.27Å; L65-L183 HydrophobicContact CD1-CD1 3.63Å; L65-L183 HydrophobicContact CD2-CD1 3.59Å; L65-L183 HydrophobicContact CG-CD1 3.32Å; L65-F186 HydrophobicContact CD2-CB 3.9Å
66V96.1Very high95.3Very high61 Ų6180.4 Ų80.437%0.3738%0.379SS..Hα-helixtrans-59.8-43.41781720000110.8R62 V63 K64 G69 F70R62-V66 WeakPolarHBondContact O-CG2 3.47Å; R62-V66 PolarHBondContact O-N 3.05Å; R62-V66 VanDerWaalsContact O-N 3.13Å; V63-V66 PolarHBondContact O-N 2.99Å; K64-V66 PolarHBondContact O-N 2.69Å; V66-G69 PolarHBondContact O-N 3.13Å; V66-F70 HydrophobicContact CG1-CD2 4.03Å; V66-F70 HydrophobicContact CG1-CE2 4.16Å; V66-F70 WeakPolarHBondContact O-CD2 3.33Å; V66-F70 PolarHBondContact O-N 2.8Å
67N95.8Very high95.2Very high60 Ų6077 Ų7732%0.32136%0.361SS..Hα-helixtrans-68.4-35.5-179.9-71.2-21.7000112.4V63 K64 L65 F70 Q71 K88V63-N67 WeakPolarHBondContact O-CB 3.49Å; V63-N67 PolarHBondContact O-N 3.29Å; V63-N67 PolarHBondContact O-ND2 2.98Å; K64-N67 PolarHBondContact O-N 3.33Å; L65-N67 VanDerWaalsContact C-N 3.29Å; L65-N67 PolarHBondContact O-N 3.26Å; N67-F70 PolarHBondContact O-N 3.26Å; N67-Q71 WeakPolarHBondContact O-CG 3.35Å; N67-Q71 PolarHBondContact O-N 3.12Å; N67-K88 PolarHBondContact OD1-NZ 3.01Å
68L94.3Very high95.1Very high48 Ų4875 Ų7525%0.25136%0.356SS..Hα-helixtrans-62.7-46.2171.4-73171.3000111.1K64 L65 F70 Q71 A72 L190K64-L68 HydrophobicContact CG-CD1 4.35Å; K64-L68 WeakPolarHBondContact O-CG 3.33Å; K64-L68 PolarHBondContact O-N 3.39Å; L65-L68 PolarHBondContact O-N 3.41Å; L68-F70 VanDerWaalsContact C-N 3.27Å; L68-F70 PolarHBondContact O-N 3.29Å; L68-Q71 WeakPolarHBondContact O-CA 3.4Å; L68-Q71 WeakPolarHBondContact O-CB 3.23Å; L68-Q71 PolarHBondContact O-N 3.11Å; L68-A72 PolarHBondContact O-N 3.32Å; L68-L190 HydrophobicContact CB-CD1 3.94Å
69G94.3Very high94.7Very high30 Ų3073.4 Ų73.431%0.30936%0.356SS..Hα-helixtrans-58-39174.600000112.8L65 V66 Q71 A72 L73L65-G69 PolarHBondContact O-N 3.27Å; V66-G69 PolarHBondContact O-N 3.13Å; G69-Q71 VanDerWaalsContact C-N 3.33Å; G69-Q71 PolarHBondContact O-N 3.16Å; G69-A72 PolarHBondContact O-N 3.4Å; G69-L73 WeakPolarHBondContact O-CB 3.24Å; G69-L73 PolarHBondContact O-N 2.75Å
70F95.4Very high94.1Very high34 Ų3469.5 Ų69.515%0.14934%0.339CS..Hα-helixtrans-66.2-31172.7-96.3-80.2000113.6V66 N67 L68 R74 K88 T91 L92V66-F70 HydrophobicContact CG1-CD2 4.03Å; V66-F70 HydrophobicContact CG1-CE2 4.16Å; V66-F70 WeakPolarHBondContact O-CD2 3.33Å; V66-F70 PolarHBondContact O-N 2.8Å; N67-F70 PolarHBondContact O-N 3.26Å; L68-F70 VanDerWaalsContact C-N 3.27Å; L68-F70 PolarHBondContact O-N 3.29Å; F70-R74 WeakPolarHBondContact O-CG 3.36Å; F70-R74 PolarHBondContact O-N 3.35Å; F70-R74 PolarHBondContact O-NH1 3.39Å; F70-K88 HydrophobicContact CD1-CB 4.32Å; F70-K88 HydrophobicContact CD1-CG 4.05Å; F70-K88 HydrophobicContact CD2-CD 4.45Å; F70-K88 HydrophobicContact CD2-CG 4.5Å; F70-K88 HydrophobicContact CE1-CB 3.69Å; F70-K88 HydrophobicContact CE1-CG 3.86Å; F70-K88 HydrophobicContact CE2-CD 4.15Å; F70-K88 HydrophobicContact CE2-CG 4.32Å; F70-K88 HydrophobicContact CG-CG 4.37Å; F70-K88 HydrophobicContact CZ-CB 3.89Å; F70-K88 HydrophobicContact CZ-CD 4.19Å; F70-K88 HydrophobicContact CZ-CG 4Å; F70-T91 HydrophobicContact CD1-CG2 4.33Å; F70-L92 HydrophobicContact CE1-CD1 4.45Å; F70-L92 HydrophobicContact CE1-CD2 4.13Å; F70-L92 HydrophobicContact CE1-CG 3.97Å; F70-L92 HydrophobicContact CZ-CD1 4.15Å; F70-L92 HydrophobicContact CZ-CD2 4.17Å; F70-L92 HydrophobicContact CZ-CG 4.11Å
71Q93.7Very high93.3Very high108 Ų10865.3 Ų65.351%0.50535%0.348SS..Hα-helixtrans-72-46.5175.2-72.6178.413.900111N67 L68 G69 L73 R74 Q75N67-Q71 WeakPolarHBondContact O-CG 3.35Å; N67-Q71 PolarHBondContact O-N 3.12Å; L68-Q71 WeakPolarHBondContact O-CA 3.4Å; L68-Q71 WeakPolarHBondContact O-CB 3.23Å; L68-Q71 PolarHBondContact O-N 3.11Å; G69-Q71 VanDerWaalsContact C-N 3.33Å; G69-Q71 PolarHBondContact O-N 3.16Å; Q71-L73 VanDerWaalsContact C-N 3.31Å; Q71-L73 PolarHBondContact O-N 2.96Å; Q71-R74 WeakPolarHBondContact O-CB 3.32Å; Q71-R74 PolarHBondContact O-N 3.32Å; Q71-Q75 PolarHBondContact O-N 3.37Å
72A92.9Very high92.6Very high14 Ų1465.6 Ų65.612%0.11636%0.356CS..Hα-helixtrans-58.4-44.617500000111.4L68 G69 R74 Q75 H76 L190L68-A72 PolarHBondContact O-N 3.32Å; G69-A72 PolarHBondContact O-N 3.4Å; A72-R74 VanDerWaalsContact C-N 3.25Å; A72-R74 PolarHBondContact O-N 2.94Å; A72-Q75 WeakPolarHBondContact O-CB 3.49Å; A72-Q75 PolarHBondContact O-N 3.34Å; A72-H76 PolarHBondContact O-CD2 2.92Å; A72-H76 VanDerWaalsContact O-CD2 3.28Å; A72-L190 HydrophobicContact CB-CB 4.48Å; A72-L190 HydrophobicContact CB-CD2 3.66Å
73L95.3Very high91.5Very high58 Ų5865.9 Ų65.930%0.30438%0.379SS..Hα-helixtrans-57.3-38.8175.6-17858.7000112.2G69 Q71 Q75 H76 V77 T91 L92 A95G69-L73 WeakPolarHBondContact O-CB 3.24Å; G69-L73 PolarHBondContact O-N 2.75Å; Q71-L73 VanDerWaalsContact C-N 3.31Å; Q71-L73 PolarHBondContact O-N 2.96Å; L73-Q75 PolarHBondContact O-N 3.03Å; L73-H76 PolarHBondContact O-N 2.92Å; L73-H76 VanDerWaalsContact O-N 3.13Å; L73-V77 HydrophobicContact CD1-CG2 3.9Å; L73-V77 HydrophobicContact CG-CG2 4.06Å; L73-V77 VanDerWaalsContact O-CG2 3.23Å; L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.41Å; L73-T91 HydrophobicContact CB-CG2 4.35Å; L73-T91 HydrophobicContact CD2-CG2 3.77Å; L73-T91 HydrophobicContact CG-CG2 3.82Å; L73-L92 HydrophobicContact CD2-CD2 4.33Å; L73-A95 HydrophobicContact CD1-CB 4.16Å; L73-A95 HydrophobicContact CD2-CB 4.41Å
74R95.6Very high91Very high40 Ų4072 Ų7215%0.15140%0.401CS..Hα-helixtrans-64.4-26.8177.3-74.9178.7-169.2107.3-7.1113.2F70 Q71 A72 H76 G80 L86 T91F70-R74 WeakPolarHBondContact O-CG 3.36Å; F70-R74 PolarHBondContact O-N 3.35Å; F70-R74 PolarHBondContact O-NH1 3.39Å; Q71-R74 WeakPolarHBondContact O-CB 3.32Å; Q71-R74 PolarHBondContact O-N 3.32Å; A72-R74 VanDerWaalsContact C-N 3.25Å; A72-R74 PolarHBondContact O-N 2.94Å; R74-H76 PolarHBondContact O-N 3.12Å; R74-G80 CarbonylContact O-C 3.32Å; R74-G80 WeakPolarHBondContact O-CA 3.38Å; R74-L86 VanDerWaalsContact CZ-O 3.29Å; R74-L86 PolarHBondContact NE-O 3.47Å; R74-L86 PolarHBondContact NH2-O 2.99Å; R74-T91 HydrophobicContact CG-CG2 3.81Å
75Q93.6Very high90.6Very high124 Ų12474.5 Ų74.558%0.57941%0.412SS*.Hα-helixtrans-67.5-25.9176.4-64.4169.7-42.500111.9Q71 A72 L73Q71-Q75 PolarHBondContact O-N 3.37Å; A72-Q75 WeakPolarHBondContact O-CB 3.49Å; A72-Q75 PolarHBondContact O-N 3.34Å; L73-Q75 PolarHBondContact O-N 3.03Å
76H93.9Very high90.7Very high108 Ų10873.4 Ų73.450%0.541%0.406SS..Hα-helixtrans-103.1-3-177-60.1-64.7000114.4A72 L73 R74 Y98A72-H76 PolarHBondContact O-CD2 2.92Å; A72-H76 VanDerWaalsContact O-CD2 3.28Å; L73-H76 PolarHBondContact O-N 2.92Å; L73-H76 VanDerWaalsContact O-N 3.13Å; R74-H76 PolarHBondContact O-N 3.12Å; H76-Y98 WeakPolarHBondContact O-CD1 3.4Å; H76-Y98 VanDerWaalsContact O-CE1 3.28Å; H76-Y98 WeakPolarHBondContact O-CE1 3.44Å
77V95.1Very high90.7Very high10 Ų1073 Ų736%0.06141%0.406CS..SBendtrans-103.1137.8-178.61740000109.3L73 H79 G80 L86 S94 A95L73-V77 HydrophobicContact CD1-CG2 3.9Å; L73-V77 HydrophobicContact CG-CG2 4.06Å; L73-V77 VanDerWaalsContact O-CG2 3.23Å; L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.41Å; V77-H79 PolarHBondContact O-N 3.16Å; V77-G80 PolarHBondContact O-N 2.86Å; V77-L86 HydrophobicContact CG1-CD1 4.43Å; V77-S94 VanDerWaalsContact CG1-CB 3.45Å; V77-S94 WeakPolarHBondContact CG1-OG 3.43Å; V77-A95 HydrophobicContact CG2-CB 3.73Å
78P93.8Very high90.7Very high44 Ų4474.8 Ų74.829%0.28641%0.411SS..THydrogen-bonded Turntrans-52135176.3-27.535000111.6G80 Y98P78-G80 PolarHBondContact O-N 2.92Å; P78-G80 VanDerWaalsContact O-N 3.12Å; P78-Y98 VanDerWaalsContact CD-CG 3.46Å; P78-Y98 HydrophobicContact CG-CD1 4.11Å; P78-Y98 HydrophobicContact CG-CD2 3.45Å; P78-Y98 VanDerWaalsContact CG-CD2 3.45Å; P78-Y98 HydrophobicContact CG-CE1 4.36Å; P78-Y98 HydrophobicContact CG-CE2 3.76Å; P78-Y98 HydrophobicContact CG-CG 3.65Å
79H86.9Confident90.9Very high151 Ų15176.2 Ų76.270%0.69942%0.422SS*.THydrogen-bonded Turntrans636.2-176.3-41.890.1000115.4V77 G81 A82V77-H79 PolarHBondContact O-N 3.16Å; H79-G81 VanDerWaalsContact C-N 3.35Å; H79-G81 PolarHBondContact O-N 3.06Å; H79-A82 VanDerWaalsContact O-CB 3.3Å; H79-A82 WeakPolarHBondContact O-CB 3.48Å; H79-A82 PolarHBondContact O-N 2.96Å
80G85.3Confident91Very high6 Ų679.5 Ų79.56%0.06243%0.429CS..THydrogen-bonded Turntrans-72.7-24.9-179.500000114.4R74 V77 P78R74-G80 CarbonylContact O-C 3.32Å; R74-G80 WeakPolarHBondContact O-CA 3.38Å; V77-G80 PolarHBondContact O-N 2.86Å; P78-G80 PolarHBondContact O-N 2.92Å; P78-G80 VanDerWaalsContact O-N 3.12Å
81G80.4Confident91.1Very high78 Ų7877.9 Ų77.980%0.80442%0.422SS*.THydrogen-bonded Turntrans-89.36.2171.800000115.2H79H79-G81 VanDerWaalsContact C-N 3.35Å; H79-G81 PolarHBondContact O-N 3.06Å
82A81.6Confident91.3Very high51 Ų5177 Ų7742%0.42142%0.42SS..SBendtrans-64.8159.318000000112.2H79 K84H79-A82 VanDerWaalsContact O-CB 3.3Å; H79-A82 WeakPolarHBondContact O-CB 3.48Å; H79-A82 PolarHBondContact O-N 2.96Å; A82-K84 CarbonylContact O-C 3.44Å; A82-K84 PolarHBondContact O-N 2.65Å
83S73.2Confident91.5Very high139 Ų13984.1 Ų84.197%0.97244%0.444SS*.SBendtrans-51-32.5178.1-178.90000112.8
84K86Confident91.6Very high180 Ų18082.5 Ų82.578%0.78344%0.438SS*.SBendtrans-96.1113.4169.2-168.7176-179.6-177.40110.8A82 L86A82-K84 CarbonylContact O-C 3.44Å; A82-K84 PolarHBondContact O-N 2.65Å; K84-L86 PolarHBondContact O-N 2.98Å
85K87.8Confident91.7Very high165 Ų16581.2 Ų81.272%0.71744%0.435SS*.PPolyproline II helixtrans-64.3128.3176-61.6179.2-177.5179.20110.8
86L93.1Very high91.9Very high33 Ų3378.7 Ų78.717%0.17343%0.428CS..PPolyproline II helixtrans-61143173.5-64.1177.4000111.8R74 V77 K84 E90 T91R74-L86 VanDerWaalsContact CZ-O 3.29Å; R74-L86 PolarHBondContact NE-O 3.47Å; R74-L86 PolarHBondContact NH2-O 2.99Å; V77-L86 HydrophobicContact CG1-CD1 4.43Å; K84-L86 PolarHBondContact O-N 2.98Å; L86-E90 HydrophobicContact CB-CB 4.3Å; L86-E90 HydrophobicContact CD2-CB 4.38Å; L86-T91 WeakPolarHBondContact CB-OG1 3.28Å
87S96.3Very high92.2Very high52 Ų5279.3 Ų79.336%0.36443%0.431SS..PPolyproline II helixtrans-68.4164.217171.20000111.8V89 E90 T91S87-V89 VanDerWaalsContact C-N 3.3Å; S87-V89 PolarHBondContact O-N 3.2Å; S87-E90 WeakPolarHBondContact CB-OE2 3.22Å; S87-E90 PolarHBondContact N-OE2 3.28Å; S87-E90 PolarHBondContact O-N 3.13Å; S87-E90 WeakPolarHBondContact OG-CB 3.27Å; S87-E90 WeakPolarHBondContact OG-CG 3.39Å; S87-E90 PolarHBondContact OG-N 3.23Å; S87-E90 PolarHBondContact OG-OE2 2.99Å; S87-T91 WeakPolarHBondContact O-CB 3.36Å; S87-T91 PolarHBondContact O-N 3.18Å; S87-T91 PolarHBondContact O-OG1 3.38Å
88K96.8Very high92.3Very high97 Ų9783.3 Ų83.342%0.42245%0.446SS..Hα-helixtrans-56.2-44.1179.7-69.3-173.9176.4-175.60112.1N67 F70 L92N67-K88 PolarHBondContact OD1-NZ 3.01Å; F70-K88 HydrophobicContact CD1-CB 4.32Å; F70-K88 HydrophobicContact CD1-CG 4.05Å; F70-K88 HydrophobicContact CD2-CD 4.45Å; F70-K88 HydrophobicContact CD2-CG 4.5Å; F70-K88 HydrophobicContact CE1-CB 3.69Å; F70-K88 HydrophobicContact CE1-CG 3.86Å; F70-K88 HydrophobicContact CE2-CD 4.15Å; F70-K88 HydrophobicContact CE2-CG 4.32Å; F70-K88 HydrophobicContact CG-CG 4.37Å; F70-K88 HydrophobicContact CZ-CB 3.89Å; F70-K88 HydrophobicContact CZ-CD 4.19Å; F70-K88 HydrophobicContact CZ-CG 4Å; K88-L92 VanDerWaalsContact O-CG 3.3Å; K88-L92 WeakPolarHBondContact O-CG 3.49Å; K88-L92 PolarHBondContact O-N 2.92Å; K88-L92 VanDerWaalsContact O-N 3.1Å
89V97.8Very high92.5Very high79 Ų7985.7 Ų85.748%0.47946%0.455SS..Hα-helixtrans-68.2-43.2-179.5176.60000111S87 L92 R93S87-V89 VanDerWaalsContact C-N 3.3Å; S87-V89 PolarHBondContact O-N 3.2Å; V89-L92 PolarHBondContact O-N 2.74Å; V89-R93 HydrophobicContact CG1-CG 4.42Å; V89-R93 WeakPolarHBondContact O-CG 3.48Å; V89-R93 PolarHBondContact O-N 3.24Å
90E96.7Very high93.1Very high99 Ų9985.9 Ų85.946%0.46345%0.45SS..Hα-helixtrans-63.9-43.4177.2-70.4163.6148.500111.8L86 S87 L92 R93 S94L86-E90 HydrophobicContact CB-CB 4.3Å; L86-E90 HydrophobicContact CD2-CB 4.38Å; S87-E90 WeakPolarHBondContact CB-OE2 3.22Å; S87-E90 PolarHBondContact N-OE2 3.28Å; S87-E90 PolarHBondContact O-N 3.13Å; S87-E90 WeakPolarHBondContact OG-CB 3.27Å; S87-E90 WeakPolarHBondContact OG-CG 3.39Å; S87-E90 PolarHBondContact OG-N 3.23Å; S87-E90 PolarHBondContact OG-OE2 2.99Å; E90-L92 VanDerWaalsContact C-N 3.32Å; E90-L92 PolarHBondContact O-N 2.78Å; E90-R93 PolarHBondContact O-N 3.17Å; E90-S94 VanDerWaalsContact O-CB 3.29Å; E90-S94 WeakPolarHBondContact O-CB 3.46Å; E90-S94 PolarHBondContact O-N 3.43Å
91T97Very high93.7Very high0 Ų087.3 Ų87.30%046%0.461CS..Hα-helixtrans-58.2-44.8175.6-56.70000111.1F70 L73 R74 L86 S87 A95F70-T91 HydrophobicContact CD1-CG2 4.33Å; L73-T91 HydrophobicContact CB-CG2 4.35Å; L73-T91 HydrophobicContact CD2-CG2 3.77Å; L73-T91 HydrophobicContact CG-CG2 3.82Å; R74-T91 HydrophobicContact CG-CG2 3.81Å; L86-T91 WeakPolarHBondContact CB-OG1 3.28Å; S87-T91 WeakPolarHBondContact O-CB 3.36Å; S87-T91 PolarHBondContact O-N 3.18Å; S87-T91 PolarHBondContact O-OG1 3.38Å; T91-A95 VanDerWaalsContact O-CB 3.3Å; T91-A95 WeakPolarHBondContact O-CB 3.43Å; T91-A95 PolarHBondContact O-N 3.43Å
92L98.1Very high94.5Very high89 Ų8987 Ų8747%0.46644%0.441SS..Hα-helixtrans-66.4-44.7178.4-68.5176.4000112.5F70 L73 K88 V89 E90 A95 V96F70-L92 HydrophobicContact CE1-CD1 4.45Å; F70-L92 HydrophobicContact CE1-CD2 4.13Å; F70-L92 HydrophobicContact CE1-CG 3.97Å; F70-L92 HydrophobicContact CZ-CD1 4.15Å; F70-L92 HydrophobicContact CZ-CD2 4.17Å; F70-L92 HydrophobicContact CZ-CG 4.11Å; L73-L92 HydrophobicContact CD2-CD2 4.33Å; K88-L92 VanDerWaalsContact O-CG 3.3Å; K88-L92 WeakPolarHBondContact O-CG 3.49Å; K88-L92 PolarHBondContact O-N 2.92Å; K88-L92 VanDerWaalsContact O-N 3.1Å; V89-L92 PolarHBondContact O-N 2.74Å; E90-L92 VanDerWaalsContact C-N 3.32Å; E90-L92 PolarHBondContact O-N 2.78Å; L92-A95 PolarHBondContact O-N 3.09Å; L92-V96 WeakPolarHBondContact O-CG2 3.47Å; L92-V96 PolarHBondContact O-N 3.37Å
93R97.9Very high95.3Very high164 Ų16490.3 Ų90.362%0.61945%0.448SS*.Hα-helixtrans-60.3-50.1177.8-73.4176.5-179.41720.5111V89 E90 A95 V96 E97V89-R93 HydrophobicContact CG1-CG 4.42Å; V89-R93 WeakPolarHBondContact O-CG 3.48Å; V89-R93 PolarHBondContact O-N 3.24Å; E90-R93 PolarHBondContact O-N 3.17Å; R93-A95 VanDerWaalsContact C-N 3.34Å; R93-A95 PolarHBondContact O-N 3.42Å; R93-V96 PolarHBondContact O-N 3.02Å; R93-E97 WeakPolarHBondContact O-CG 3.3Å; R93-E97 PolarHBondContact O-N 3.05Å
94S97.2Very high96.5Very high24 Ų2491 Ų9117%0.16843%0.429CS..Hα-helixtrans-65.3-35.6-179.1-173.60000112.3V77 E90 E97 Y98V77-S94 VanDerWaalsContact CG1-CB 3.45Å; V77-S94 WeakPolarHBondContact CG1-OG 3.43Å; E90-S94 VanDerWaalsContact O-CB 3.29Å; E90-S94 WeakPolarHBondContact O-CB 3.46Å; E90-S94 PolarHBondContact O-N 3.43Å; S94-E97 PolarHBondContact O-N 3.48Å; S94-Y98 VanDerWaalsContact O-CB 3.24Å; S94-Y98 WeakPolarHBondContact O-CB 3.44Å; S94-Y98 PolarHBondContact O-N 3.13Å
95A98.1Very high97.1Very high13 Ų1387.3 Ų87.311%0.10742%0.417CS..Hα-helixtrans-60.9-46.1173.300000112.6L73 V77 T91 L92 R93 Y98 I99L73-A95 HydrophobicContact CD1-CB 4.16Å; L73-A95 HydrophobicContact CD2-CB 4.41Å; V77-A95 HydrophobicContact CG2-CB 3.73Å; T91-A95 VanDerWaalsContact O-CB 3.3Å; T91-A95 WeakPolarHBondContact O-CB 3.43Å; T91-A95 PolarHBondContact O-N 3.43Å; L92-A95 PolarHBondContact O-N 3.09Å; R93-A95 VanDerWaalsContact C-N 3.34Å; R93-A95 PolarHBondContact O-N 3.42Å; A95-Y98 PolarHBondContact O-N 3.33Å; A95-I99 VanDerWaalsContact O-CG1 3.32Å; A95-I99 WeakPolarHBondContact O-CG1 3.37Å; A95-I99 PolarHBondContact O-N 3.33Å
96V98.3Very high97.5Very high71 Ų7184.4 Ų84.443%0.4341%0.409SS..Hα-helixtrans-63.6-44178.5173.10000111.1L92 R93 Y98 R100L92-V96 WeakPolarHBondContact O-CG2 3.47Å; L92-V96 PolarHBondContact O-N 3.37Å; R93-V96 PolarHBondContact O-N 3.02Å; V96-Y98 VanDerWaalsContact C-N 3.33Å; V96-R100 WeakPolarHBondContact O-CG 3.3Å; V96-R100 PolarHBondContact O-N 3.37Å; V96-R100 VanDerWaalsContact O-N 3.16Å
97E98.2Very high97.7Very high120 Ų12085.6 Ų85.656%0.56142%0.424SS*.Hα-helixtrans-62.7-41.2176.8-72.2169.2-173.100111.8R93 S94 R100 A101R93-E97 WeakPolarHBondContact O-CG 3.3Å; R93-E97 PolarHBondContact O-N 3.05Å; S94-E97 PolarHBondContact O-N 3.48Å; E97-R100 PolarHBondContact O-N 2.93Å; E97-A101 WeakPolarHBondContact O-CB 3.11Å; E97-A101 PolarHBondContact O-N 3.3Å
98Y98.3Very high97.6Very high94 Ų9488.9 Ų88.937%0.36943%0.433SS..Hα-helixtrans-66.8-43.9-179.9-171.8-135.3000112.1H76 P78 S94 A95 V96 R100 A101 L102H76-Y98 WeakPolarHBondContact O-CD1 3.4Å; H76-Y98 VanDerWaalsContact O-CE1 3.28Å; H76-Y98 WeakPolarHBondContact O-CE1 3.44Å; P78-Y98 VanDerWaalsContact CD-CG 3.46Å; P78-Y98 HydrophobicContact CG-CD1 4.11Å; P78-Y98 HydrophobicContact CG-CD2 3.45Å; P78-Y98 VanDerWaalsContact CG-CD2 3.45Å; P78-Y98 HydrophobicContact CG-CE1 4.36Å; P78-Y98 HydrophobicContact CG-CE2 3.76Å; P78-Y98 HydrophobicContact CG-CG 3.65Å; S94-Y98 VanDerWaalsContact O-CB 3.24Å; S94-Y98 WeakPolarHBondContact O-CB 3.44Å; S94-Y98 PolarHBondContact O-N 3.13Å; A95-Y98 PolarHBondContact O-N 3.33Å; V96-Y98 VanDerWaalsContact C-N 3.33Å; Y98-R100 VanDerWaalsContact C-N 3.31Å; Y98-R100 PolarHBondContact O-N 3.25Å; Y98-A101 WeakPolarHBondContact O-CB 3.42Å; Y98-A101 PolarHBondContact O-N 3.29Å; Y98-A101 VanDerWaalsContact O-N 3.12Å; Y98-L102 HydrophobicContact CD1-CD1 4.09Å; Y98-L102 HydrophobicContact CD2-CD1 4.45Å; Y98-L102 HydrophobicContact CD2-CG 4.2Å; Y98-L102 HydrophobicContact CE1-CD1 3.79Å; Y98-L102 HydrophobicContact CE1-CG 4.46Å; Y98-L102 HydrophobicContact CE2-CD1 4.16Å; Y98-L102 HydrophobicContact CE2-CD2 3.89Å; Y98-L102 HydrophobicContact CE2-CG 3.93Å; Y98-L102 HydrophobicContact CG-CD1 4.42Å; Y98-L102 WeakPolarHBondContact O-CG 3.4Å; Y98-L102 PolarHBondContact O-N 3.47Å
99I98.3Very high97.6Very high95 Ų9589.6 Ų89.649%0.48744%0.438SS..Hα-helixtrans-56.5-47.2173.7-67.5165.2000110.5A95 A101 L102 Q103A95-I99 VanDerWaalsContact O-CG1 3.32Å; A95-I99 WeakPolarHBondContact O-CG1 3.37Å; A95-I99 PolarHBondContact O-N 3.33Å; I99-A101 VanDerWaalsContact C-N 3.31Å; I99-A101 PolarHBondContact O-N 3.01Å; I99-L102 PolarHBondContact O-N 3.28Å; I99-Q103 HydrophobicContact CG2-CG 4.4Å; I99-Q103 WeakPolarHBondContact O-CB 3.39Å; I99-Q103 VanDerWaalsContact O-CG 3.29Å; I99-Q103 WeakPolarHBondContact O-CG 3.42Å; I99-Q103 PolarHBondContact O-N 3.47Å
100R98.5Very high97.4Very high155 Ų15589.7 Ų89.759%0.58544%0.435SS*.Hα-helixtrans-63.2-35.6177.9-70.6172.9177.9173.3-0.6112.7V96 E97 Y98 R104V96-R100 WeakPolarHBondContact O-CG 3.3Å; V96-R100 PolarHBondContact O-N 3.37Å; V96-R100 VanDerWaalsContact O-N 3.16Å; E97-R100 PolarHBondContact O-N 2.93Å; Y98-R100 VanDerWaalsContact C-N 3.31Å; Y98-R100 PolarHBondContact O-N 3.25Å; R100-R104 WeakPolarHBondContact O-CG 3.47Å; R100-R104 PolarHBondContact O-N 3.32Å; R100-R104 PolarHBondContact O-NE 2.91Å
101A98.2Very high97.1Very high36 Ų3687.7 Ų87.730%0.29844%0.436SS..Hα-helixtrans-67.6-45.9176.400000111.4E97 Y98 I99 Q103 R104 L105E97-A101 WeakPolarHBondContact O-CB 3.11Å; E97-A101 PolarHBondContact O-N 3.3Å; Y98-A101 WeakPolarHBondContact O-CB 3.42Å; Y98-A101 PolarHBondContact O-N 3.29Å; Y98-A101 VanDerWaalsContact O-N 3.12Å; I99-A101 VanDerWaalsContact C-N 3.31Å; I99-A101 PolarHBondContact O-N 3.01Å; A101-Q103 PolarHBondContact O-N 3.36Å; A101-R104 PolarHBondContact O-N 2.96Å; A101-L105 PolarHBondContact O-N 3.42Å
102L98.3Very high96.9Very high72 Ų7292.5 Ų92.538%0.37747%0.465SS..Hα-helixtrans-62.8-41.9177-66.7176.4000112Y98 I99 R104 L105 L106Y98-L102 HydrophobicContact CD1-CD1 4.09Å; Y98-L102 HydrophobicContact CD2-CD1 4.45Å; Y98-L102 HydrophobicContact CD2-CG 4.2Å; Y98-L102 HydrophobicContact CE1-CD1 3.79Å; Y98-L102 HydrophobicContact CE1-CG 4.46Å; Y98-L102 HydrophobicContact CE2-CD1 4.16Å; Y98-L102 HydrophobicContact CE2-CD2 3.89Å; Y98-L102 HydrophobicContact CE2-CG 3.93Å; Y98-L102 HydrophobicContact CG-CD1 4.42Å; Y98-L102 WeakPolarHBondContact O-CG 3.4Å; Y98-L102 PolarHBondContact O-N 3.47Å; I99-L102 PolarHBondContact O-N 3.28Å; L102-R104 VanDerWaalsContact C-N 3.34Å; L102-R104 PolarHBondContact O-N 2.86Å; L102-L105 PolarHBondContact O-N 2.93Å; L102-L106 WeakPolarHBondContact O-CG 3.34Å; L102-L106 PolarHBondContact O-N 3.48Å
103Q98.4Very high96.6Very high120 Ų12096.3 Ų96.356%0.56147%0.473SS*.Hα-helixtrans-60-41.9175.6-74.7172.3-22.900112.6I99 A101 A107I99-Q103 HydrophobicContact CG2-CG 4.4Å; I99-Q103 WeakPolarHBondContact O-CB 3.39Å; I99-Q103 VanDerWaalsContact O-CG 3.29Å; I99-Q103 WeakPolarHBondContact O-CG 3.42Å; I99-Q103 PolarHBondContact O-N 3.47Å; A101-Q103 PolarHBondContact O-N 3.36Å; Q103-A107 WeakPolarHBondContact O-CB 3.23Å; Q103-A107 PolarHBondContact O-N 2.94Å
104R98Very high96.1Very high153 Ų15393.9 Ų93.958%0.57747%0.473SS*.Hα-helixtrans-64.3-46.3175.8-75.8-177.8-69.3139.2-5.7111.8R100 A101 L102 L106 A107 E108R100-R104 WeakPolarHBondContact O-CG 3.47Å; R100-R104 PolarHBondContact O-N 3.32Å; R100-R104 PolarHBondContact O-NE 2.91Å; A101-R104 PolarHBondContact O-N 2.96Å; L102-R104 VanDerWaalsContact C-N 3.34Å; L102-R104 PolarHBondContact O-N 2.86Å; R104-L106 VanDerWaalsContact C-N 3.32Å; R104-L106 PolarHBondContact O-N 2.94Å; R104-A107 PolarHBondContact O-N 3.06Å; R104-E108 WeakPolarHBondContact O-CG 3.5Å; R104-E108 PolarHBondContact O-N 3.28Å
105L97.9Very high95.7Very high103 Ų10396.1 Ų96.154%0.53949%0.493SS..Hα-helixtrans-58.4-44.9178.5-171.8161.3000111.4A101 L102 E108 H109A101-L105 PolarHBondContact O-N 3.42Å; L102-L105 PolarHBondContact O-N 2.93Å; L105-E108 PolarHBondContact O-N 3.31Å; L105-H109 WeakPolarHBondContact O-CB 3.44Å; L105-H109 PolarHBondContact O-N 3.12Å
106L97.2Very high95Very high104 Ų104102 Ų10255%0.54552%0.522SS..Hα-helixtrans-63.6-44.5176.8-69.6173.6000112L102 R104 E108 H109 D110L102-L106 WeakPolarHBondContact O-CG 3.34Å; L102-L106 PolarHBondContact O-N 3.48Å; R104-L106 VanDerWaalsContact C-N 3.32Å; R104-L106 PolarHBondContact O-N 2.94Å; L106-E108 PolarHBondContact O-N 3.35Å; L106-H109 PolarHBondContact O-N 3.07Å; L106-D110 WeakPolarHBondContact O-CB 3.3Å; L106-D110 PolarHBondContact O-N 3.46Å
107A95.9Very high94.1Very high58 Ų58101.7 Ų101.748%0.47953%0.527SS..Hα-helixtrans-63.2-40.9178.300000112.6Q103 R104 D110 A111Q103-A107 WeakPolarHBondContact O-CB 3.23Å; Q103-A107 PolarHBondContact O-N 2.94Å; R104-A107 PolarHBondContact O-N 3.06Å; A107-D110 PolarHBondContact O-N 3.36Å; A107-A111 WeakPolarHBondContact O-CB 3.19Å; A107-A111 PolarHBondContact O-N 2.94Å
108E95.6Very high92.4Very high121 Ų12198.5 Ų98.557%0.56553%0.526SS*.Hα-helixtrans-62.3-45.9174.2-72.5168.2-159.700111R104 L105 L106 D110 A111 V112R104-E108 WeakPolarHBondContact O-CG 3.5Å; R104-E108 PolarHBondContact O-N 3.28Å; L105-E108 PolarHBondContact O-N 3.31Å; L106-E108 PolarHBondContact O-N 3.35Å; E108-D110 PolarHBondContact O-N 3.48Å; E108-A111 PolarHBondContact O-N 3.42Å; E108-V112 VanDerWaalsContact O-CG2 3.32Å; E108-V112 WeakPolarHBondContact O-CG2 3.48Å; E108-V112 PolarHBondContact O-N 3.25Å
109H95.1Very high90.7Very high111 Ų11197.1 Ų97.151%0.51454%0.54SS..Hα-helixtrans-62.4-42.1177.8-177.5-89.2000112.2L105 L106 V112 R113L105-H109 WeakPolarHBondContact O-CB 3.44Å; L105-H109 PolarHBondContact O-N 3.12Å; L106-H109 PolarHBondContact O-N 3.07Å; H109-V112 PolarHBondContact O-N 2.93Å; H109-R113 VanDerWaalsContact O-CB 3.3Å; H109-R113 WeakPolarHBondContact O-CB 3.36Å; H109-R113 PolarHBondContact O-N 3.37Å
110D93.7Very high88.6Confident81 Ų8199.8 Ų99.843%0.43355%0.554SS.*Hα-helixtrans-66-39.3175.9-72-20.5000111.8L106 A107 E108 R113 N114L106-D110 WeakPolarHBondContact O-CB 3.3Å; L106-D110 PolarHBondContact O-N 3.46Å; A107-D110 PolarHBondContact O-N 3.36Å; E108-D110 PolarHBondContact O-N 3.48Å; D110-R113 PolarHBondContact O-N 3.39Å; D110-N114 VanDerWaalsContact O-CB 3.26Å; D110-N114 WeakPolarHBondContact O-CB 3.34Å; D110-N114 PolarHBondContact O-N 2.75Å; D110-N114 PolarHBondContact O-ND2 3.29Å; D110-N114 VanDerWaalsContact O-ND2 3.14Å
111A91.8Very high86.5Confident58 Ų58102.3 Ų102.348%0.47956%0.564SS.*Hα-helixtrans-62.1-44.8174.500000111.7A107 E108 N114 A115A107-A111 WeakPolarHBondContact O-CB 3.19Å; A107-A111 PolarHBondContact O-N 2.94Å; E108-A111 PolarHBondContact O-N 3.42Å; A111-N114 PolarHBondContact O-N 3.14Å; A111-A115 WeakPolarHBondContact O-CB 3.47Å; A111-A115 PolarHBondContact O-N 3.45Å
112V92.1Very high84.4Confident101 Ų101105.2 Ų105.261%0.61258%0.58SS**Hα-helixtrans-64.2-44.9176.2173.30000111E108 H109 N114 A115 L116E108-V112 VanDerWaalsContact O-CG2 3.32Å; E108-V112 WeakPolarHBondContact O-CG2 3.48Å; E108-V112 PolarHBondContact O-N 3.25Å; H109-V112 PolarHBondContact O-N 2.93Å; V112-N114 VanDerWaalsContact C-N 3.33Å; V112-N114 PolarHBondContact O-N 3.03Å; V112-A115 PolarHBondContact O-N 3.09Å; V112-L116 WeakPolarHBondContact O-CB 3.32Å; V112-L116 PolarHBondContact O-N 3.14Å
113R91.4Very high82.3Confident168 Ų168107.5 Ų107.563%0.63460%0.599SS**Hα-helixtrans-60.7-42.3176.7-176.9177.1-179.3159.82.6111.7H109 D110 L116 A117H109-R113 VanDerWaalsContact O-CB 3.3Å; H109-R113 WeakPolarHBondContact O-CB 3.36Å; H109-R113 PolarHBondContact O-N 3.37Å; D110-R113 PolarHBondContact O-N 3.39Å; R113-L116 PolarHBondContact O-N 3.44Å; R113-A117 VanDerWaalsContact O-CB 3.24Å; R113-A117 WeakPolarHBondContact O-CB 3.49Å; R113-A117 PolarHBondContact O-N 3.22Å
114N88.8Confident80.2Confident113 Ų113105.8 Ų105.860%0.60461%0.605SS**Hα-helixtrans-69.4-37.4177.6-71.9-24.3000112.2D110 A111 V112 G118D110-N114 VanDerWaalsContact O-CB 3.26Å; D110-N114 WeakPolarHBondContact O-CB 3.34Å; D110-N114 PolarHBondContact O-N 2.75Å; D110-N114 PolarHBondContact O-ND2 3.29Å; D110-N114 VanDerWaalsContact O-ND2 3.14Å; A111-N114 PolarHBondContact O-N 3.14Å; V112-N114 VanDerWaalsContact C-N 3.33Å; V112-N114 PolarHBondContact O-N 3.03Å; N114-G118 WeakPolarHBondContact O-CA 3.43Å; N114-G118 PolarHBondContact O-N 3.21Å
115A86.8Confident78.1Confident72 Ų72105 Ų10560%0.59562%0.617SS**Hα-helixtrans-63.9-43.1173.800000111.4A111 V112 G118 G119A111-A115 WeakPolarHBondContact O-CB 3.47Å; A111-A115 PolarHBondContact O-N 3.45Å; V112-A115 PolarHBondContact O-N 3.09Å; A115-G118 PolarHBondContact O-N 3.35Å; A115-G119 PolarHBondContact O-N 2.72Å; A115-G119 VanDerWaalsContact O-N 3.16Å
116L83.5Confident76.3Confident137 Ų137111 Ų11172%0.71763%0.632SS**Hα-helixtrans-67.5-45.2177-175.463.2000112.1V112 R113 G118 G119V112-L116 WeakPolarHBondContact O-CB 3.32Å; V112-L116 PolarHBondContact O-N 3.14Å; R113-L116 PolarHBondContact O-N 3.44Å; L116-G118 VanDerWaalsContact C-N 3.33Å; L116-G119 PolarHBondContact O-N 3.39Å
117A80.3Confident74.2Confident64 Ų64111.8 Ų111.853%0.52964%0.644SS.*Hα-helixtrans-67.8-33.2177.200000112.5R113 G119 L120R113-A117 VanDerWaalsContact O-CB 3.24Å; R113-A117 WeakPolarHBondContact O-CB 3.49Å; R113-A117 PolarHBondContact O-N 3.22Å; A117-G119 VanDerWaalsContact C-N 3.3Å; A117-G119 PolarHBondContact O-N 2.9Å; A117-L120 PolarHBondContact O-N 3.4Å
118G63.3Low71.9Confident52 Ų52114.5 Ų114.554%0.53666%0.659SS.*Hα-helixtrans-70.9-22.4175.900000113.9N114 A115 L116 L120 R121N114-G118 WeakPolarHBondContact O-CA 3.43Å; N114-G118 PolarHBondContact O-N 3.21Å; A115-G118 PolarHBondContact O-N 3.35Å; L116-G118 VanDerWaalsContact C-N 3.33Å; G118-L120 VanDerWaalsContact C-N 3.26Å; G118-L120 PolarHBondContact O-N 2.93Å; G118-R121 PolarHBondContact O-N 3.17Å
119G60.8Low70.1Confident65 Ų65113.2 Ų113.267%0.6767%0.67SS**THydrogen-bonded Turntrans-72.1-12.7175.600000115A115 L116 A117A115-G119 PolarHBondContact O-N 2.72Å; A115-G119 VanDerWaalsContact O-N 3.16Å; L116-G119 PolarHBondContact O-N 3.39Å; A117-G119 VanDerWaalsContact C-N 3.3Å; A117-G119 PolarHBondContact O-N 2.9Å
120L55.5Low68Low151 Ų151113.9 Ų113.979%0.79168%0.684SS**THydrogen-bonded Turntrans-105.410.6177.5-69177.5000113.8A117 G118 P122A117-L120 PolarHBondContact O-N 3.4Å; G118-L120 VanDerWaalsContact C-N 3.26Å; G118-L120 PolarHBondContact O-N 2.93Å; L120-P122 WeakPolarHBondContact O-CD 3.49Å
121R53.2Low65.9Low209 Ų209121.9 Ų121.979%0.78971%0.708SS**  trans-78.2108.4171.8-159.2165.799.4-154.97.3108.1G118G118-R121 PolarHBondContact O-N 3.17Å
122P54.3Low63.7Low97 Ų97122.8 Ų122.863%0.6372%0.722SS**  trans-57.1145.6174.225.1-32.2000108.3L120 A124L120-P122 WeakPolarHBondContact O-CD 3.49Å; P122-A124 PolarHBondContact O-N 3.33Å
123P54.2Low61.7Low120 Ų120126.6 Ų126.678%0.77973%0.734SS**  trans-55.2114.817524.1-32.2000107.1V125P123-V125 PolarHBondContact O-N 2.95Å
124A53.6Low60Low83 Ų83124.4 Ų124.469%0.68674%0.741SS**  trans-57.1107.1174.600000106.8P122 R126P122-A124 PolarHBondContact O-N 3.33Å; A124-R126 PolarHBondContact O-N 2.95Å
125V55.3Low57.8Low136 Ų136122 Ų12282%0.82474%0.744SS**  trans-55.9109.7167.5178.40000105.4P123 P127P123-V125 PolarHBondContact O-N 2.95Å; V125-P127 VanDerWaalsContact O-CD 3.29Å; V125-P127 WeakPolarHBondContact O-CD 3.46Å
126R59.2Low56.1Low229 Ų229124.8 Ų124.886%0.86475%0.753SS**PPolyproline II helixtrans-62.6118.9176.7-63.1172.176-166.95.5107.2A124 S128A124-R126 PolarHBondContact O-N 2.95Å; R126-S128 PolarHBondContact O-N 3.46Å
127P54.5Low54.4Low122 Ų122124.8 Ų124.879%0.79276%0.759SS**PPolyproline II helixtrans-74.5123.5159.810.94.8000107.1V125V125-P127 VanDerWaalsContact O-CD 3.29Å; V125-P127 WeakPolarHBondContact O-CD 3.46Å
128S47.2Very low52.8Low114 Ų114126.4 Ų126.480%0.79777%0.772SS**PPolyproline II helixtrans-53.7136.1169.730.50000111.1R126R126-S128 PolarHBondContact O-N 3.46Å
129A56.4Low52Low95 Ų95131 Ų13179%0.78579%0.79SS**PPolyproline II helixtrans-63.1155.6172.200000112.3
130P51.1Low51.3Low125 Ų125132.3 Ų132.381%0.81279%0.794SS**  trans-107.6135.1138.630-19.3000110.7
131R51.3Low50.8Low249 Ų249129.4 Ų129.494%0.9479%0.792SS**  trans-55.1136.6169.2-82.8167.4148.9-166.6-5.8111.6
132G43.9Very low50.6Low76 Ų76124.4 Ų124.478%0.78479%0.789SS**  trans-157.8115.3155.900000109
133Q51.9Low50.9Low182 Ų182125.8 Ų125.885%0.8580%0.798SS**  trans-91.3-163-179.6-56.1-169.6-19.800111.8
134P55.1Low50.4Low121 Ų121125.6 Ų125.679%0.78680%0.799SS**  -116.2163-110.532.1-10.4000112.8
135G42.1Very low50.4Low64 Ų64133.5 Ų133.566%0.6681%0.811SS**  trans-157.4115.2175.200000113.1
136T51Low49.6Very low130 Ų130131.4 Ų131.480%0.79881%0.808SS**  trans70.9102.4149.168.20000120
137T48.4Very low48.8Very low136 Ų136126 Ų12683%0.83481%0.805SS**  52.9113.4129.157.60000120.1
138A47.4Very low48.4Very low98 Ų98125.2 Ų125.281%0.8180%0.803SS**  trans-57.6138.7159.200000113.2
139V46.3Very low48.7Very low150 Ų150125.6 Ų125.691%0.90981%0.805SS**  trans-145.1139.1141.4171.90000108.5
140A46.1Very low48.9Very low91 Ų91126.8 Ų126.875%0.75281%0.806SS**  trans-80.3174.2-172.400000114.8
141A44.8Very low48.6Very low90 Ų90124.6 Ų124.674%0.74481%0.806SS**  trans110.9111.5141.500000118.6
142S48.9Very low48.6Very low105 Ų105124.1 Ų124.173%0.73480%0.804SS**  trans69124.2136.3-55.20000121.1
143P59.8Low48.6Very low125 Ų125124 Ų12481%0.81280%0.803SS**  trans-96.7109148.532.2-22.9000110.3R145P143-R145 PolarHBondContact O-N 3.01Å
144S44.4Very low48.1Very low116 Ų116118.8 Ų118.881%0.81180%0.798SS**  trans-69.5122.3167.7-66.10000110
145R53Low47.8Very low250 Ų250118.5 Ų118.594%0.94380%0.799SS**  trans-80.4121.9167.8-58176.487.4-154.97.7107.6P143P143-R145 PolarHBondContact O-N 3.01Å
146A39Very low48Very low92 Ų92120.9 Ų120.976%0.7681%0.805SS**  trans-137.6130.817200000111
147S42.8Very low48.4Very low114 Ų114123.5 Ų123.580%0.79781%0.809SS**  trans62.2124.2153.8-147.30000116.9
148S46.7Very low48.7Very low106 Ų106123 Ų12374%0.74181%0.808SS**  -173.413460.322.20000110.4
149S51.6Low48.6Very low122 Ų122121.8 Ų121.885%0.85381%0.805SS**  trans-86.3137.9160.7-58.40000108.8
150P61.6Low48.5Very low121 Ų121120 Ų12079%0.78680%0.799SS**  trans-106.5109.115223.1-7.6000108.6
151G45.3Very low49Very low79 Ų79121.2 Ų121.281%0.81480%0.799SS**  trans-64.5134154.100000108.5
152R49.9Very low49Very low238 Ų238128.8 Ų128.890%0.89881%0.808SS**  trans-128.6100.7163-132.7179.8-167.5-80.91.9108.2
153G43.8Very low48.9Very low75 Ų75129.2 Ų129.277%0.77381%0.812SS**  trans-63140.6155.100000109
154G41.7Very low48.6Very low72 Ų72127.5 Ų127.574%0.74281%0.807SS**  trans-161.276.3179.300000108S156G154-S156 PolarHBondContact O-N 2.84Å
155S49.4Very low49.1Very low115 Ų115132.1 Ų132.180%0.80481%0.809SS**  trans-60.6124.6162.5176.70000108.2
156S47Very low48.9Very low114 Ų114125.4 Ų125.480%0.79780%0.8SS**  trans-154.4115.1159-70.60000107.4G154G154-S156 PolarHBondContact O-N 2.84Å
157E58.8Low50.2Low185 Ų185126.4 Ų126.486%0.86480%0.802SS**  trans-62.1140.1176.9-55.9-167.7109.800111.3
158P53.5Low50.6Low126 Ų126128 Ų12882%0.81880%0.801SS**  trans-87.6112.1153.329.7-25.6000108.7S160P158-S160 PolarHBondContact O-N 3.33Å
159G47.2Very low51.3Low72 Ų72130.8 Ų130.874%0.74281%0.808SS**PPolyproline II helixtrans-52.5130.1171.800000111.6
160S43Very low51.2Low113 Ų113130 Ų13079%0.7980%0.803SS**PPolyproline II helixtrans-67131.4177.7-163.80000110.5P158 R162P158-S160 PolarHBondContact O-N 3.33Å; S160-R162 PolarHBondContact O-N 3.29Å
161P57.5Low50.2Low116 Ų116127.7 Ų127.775%0.75380%0.8SS**PPolyproline II helixtrans-69.1129.717327-30.7000109.5S163P161-S163 PolarHBondContact O-N 2.92Å
162R44.8Very low50.1Low248 Ų248130.6 Ų130.694%0.93681%0.807SS**PPolyproline II helixtrans-62.2116.5167-78.6178.9151.5-140.8-3108.3S160 A164S160-R162 PolarHBondContact O-N 3.29Å; R162-A164 PolarHBondContact O-N 2.92Å
163S46.7Very low50.1Low115 Ų115128.1 Ų128.180%0.80481%0.805SS**  trans-75.3102.5166.9179.10000108.3P161P161-S163 PolarHBondContact O-N 2.92Å
164A52.1Low50.4Low88 Ų88127.6 Ų127.673%0.72780%0.8SS**  trans-77.2115.6151.100000105.9R162 S166R162-A164 PolarHBondContact O-N 2.92Å; A164-S166 PolarHBondContact O-N 3.47Å
165Y56.4Low51.2Low214 Ų214128.8 Ų128.884%0.83980%0.803SS**  trans-58.5121162.559-82.3000106.7
166S47.4Very low51.7Low108 Ų108127.7 Ų127.776%0.75579%0.787SS**  trans-128105.8157.3-159.60000105.4A164 D168A164-S166 PolarHBondContact O-N 3.47Å; S166-D168 PolarHBondContact O-N 2.92Å
167S67.8Low53Low114 Ų114125 Ų12580%0.79777%0.768SS**  trans-63.7120.4163.2-87.60000107.6
168D50.4Low53.4Low147 Ų147121 Ų12179%0.78676%0.759SS**  trans-147.7133.5143.6-101.3-60000108.4S166 S170S166-D168 PolarHBondContact O-N 2.92Å; D168-S170 PolarHBondContact O-N 3.05Å
169D61.5Low54Low164 Ų164117.7 Ų117.788%0.87774%0.742SS**  trans-63.1105.9175.4-177.8-108000108.5
170S48.9Very low55.1Low107 Ų107118.4 Ų118.475%0.74873%0.726SS**  trans-158.9108.5177.1-85.20000111.5D168D168-S170 PolarHBondContact O-N 3.05Å
171G41.6Very low56.5Low72 Ų72121.7 Ų121.774%0.74272%0.721SS**  trans58.9110.3151.700000116.8E173G171-E173 PolarHBondContact O-N 3.22Å
172C42.7Very low57.1Low140 Ų140122.3 Ų122.395%0.94671%0.714SS**  trans-66.661161-73.70000111.8G174C172-G174 PolarHBondContact O-N 3.41Å
173E49Very low58.1Low185 Ų185111.5 Ų111.586%0.86468%0.675SS**  trans-81.178.7152.6-82.2-74.1113.400105.7G171 A175G171-E173 PolarHBondContact O-N 3.22Å; E173-A175 PolarHBondContact O-N 3.1Å
174G51.3Low59.2Low64 Ų64110.6 Ų110.666%0.6666%0.66SS**  trans-60.1104.9175.800000108.5C172 L176C172-G174 PolarHBondContact O-N 3.41Å; G174-L176 PolarHBondContact O-N 3.34Å
175A57.9Low60.3Low97 Ų97111.7 Ų111.780%0.80265%0.654SS**  trans-47.8112.816800000107.7E173 S177E173-A175 PolarHBondContact O-N 3.1Å; A175-S177 PolarHBondContact O-N 2.88Å; A175-S177 VanDerWaalsContact O-N 3.16Å
176L59.6Low60.7Low93 Ų93106.7 Ų106.749%0.48764%0.636SS.*  trans-47.4126.1-176-67.3170.9000108.6G174 E180 L184G174-L176 PolarHBondContact O-N 3.34Å; L176-E180 HydrophobicContact CB-CB 4.29Å; L176-E180 HydrophobicContact CD2-CB 4.46Å; L176-L184 HydrophobicContact CD1-CD1 3.71Å
177S73.9Confident61.7Low57 Ų57103.3 Ų103.340%0.39961%0.613SS.*  trans-53.2143.4177.8174.20000108.4A175 A179 E180 R181A175-S177 PolarHBondContact O-N 2.88Å; A175-S177 VanDerWaalsContact O-N 3.16Å; S177-A179 PolarHBondContact O-N 2.92Å; S177-E180 PolarHBondContact N-OE2 2.85Å; S177-E180 WeakPolarHBondContact O-CA 3.45Å; S177-E180 WeakPolarHBondContact O-CB 3.39Å; S177-E180 PolarHBondContact O-N 3.29Å; S177-R181 PolarHBondContact O-N 3.02Å
178P68.9Low62Low102 Ų102101.6 Ų101.666%0.66260%0.601SS**Hα-helixtrans-48.4-34.4177.6-29.134.7000113.2R181 E182P178-R181 PolarHBondContact O-N 3.22Å; P178-E182 PolarHBondContact O-N 2.81Å
179A65Low63Low56 Ų56103.3 Ų103.346%0.46360%0.597SS.*Hα-helixtrans-69.1-33175.100000114S177 R181 L183S177-A179 PolarHBondContact O-N 2.92Å; A179-R181 VanDerWaalsContact C-N 3.34Å; A179-L183 VanDerWaalsContact O-CB 3.23Å; A179-L183 WeakPolarHBondContact O-CB 3.29Å; A179-L183 PolarHBondContact O-N 3.45Å
180E70.1Confident63.2Low87 Ų8797.8 Ų97.841%0.40757%0.567SS.*Hα-helixtrans-72.3-32.6174.4-66.2175141.700111L176 S177 L183 L184L176-E180 HydrophobicContact CB-CB 4.29Å; L176-E180 HydrophobicContact CD2-CB 4.46Å; S177-E180 PolarHBondContact N-OE2 2.85Å; S177-E180 WeakPolarHBondContact O-CA 3.45Å; S177-E180 WeakPolarHBondContact O-CB 3.39Å; S177-E180 PolarHBondContact O-N 3.29Å; E180-L183 WeakPolarHBondContact O-CB 3.38Å; E180-L183 PolarHBondContact O-N 2.86Å; E180-L184 WeakPolarHBondContact O-CB 3.48Å; E180-L184 WeakPolarHBondContact O-CD1 3.22Å; E180-L184 VanDerWaalsContact O-CG 3.22Å; E180-L184 WeakPolarHBondContact O-CG 3.3Å; E180-L184 PolarHBondContact O-N 2.88Å
181R73.7Confident63.6Low181 Ų18195.8 Ų95.868%0.68356%0.563SS**Hα-helixtrans-69.4-45.4175.9-129.7167.7-179.6-173.1-0.9112.3S177 P178 A179 L183 L184 D185S177-R181 PolarHBondContact O-N 3.02Å; P178-R181 PolarHBondContact O-N 3.22Å; A179-R181 VanDerWaalsContact C-N 3.34Å; R181-L183 VanDerWaalsContact C-N 3.3Å; R181-L183 PolarHBondContact O-N 3.4Å; R181-L184 PolarHBondContact O-N 3Å; R181-D185 PolarHBondContact O-N 3.46Å
182E68.5Low64.5Low130 Ų13095.2 Ų95.261%0.60756%0.557SS**Hα-helixtrans-61.1-40.6170.9-73.4-179.5-178.500111.5P178 L184 D185 F186P178-E182 PolarHBondContact O-N 2.81Å; E182-L184 VanDerWaalsContact C-N 3.29Å; E182-L184 PolarHBondContact O-N 3.25Å; E182-D185 PolarHBondContact O-N 3.28Å; E182-F186 WeakPolarHBondContact O-CD2 3.42Å; E182-F186 PolarHBondContact O-N 3.45Å
183L65.6Low64.8Low21 Ų2199.9 Ų99.911%0.1156%0.556CS.*Hα-helixtrans-60.5-40.2177.1-172.273.8000112L65 A179 E180 R181 S187L65-L183 HydrophobicContact CD1-CD1 3.63Å; L65-L183 HydrophobicContact CD2-CD1 3.59Å; L65-L183 HydrophobicContact CG-CD1 3.32Å; A179-L183 VanDerWaalsContact O-CB 3.23Å; A179-L183 WeakPolarHBondContact O-CB 3.29Å; A179-L183 PolarHBondContact O-N 3.45Å; E180-L183 WeakPolarHBondContact O-CB 3.38Å; E180-L183 PolarHBondContact O-N 2.86Å; R181-L183 VanDerWaalsContact C-N 3.3Å; R181-L183 PolarHBondContact O-N 3.4Å; L183-S187 VanDerWaalsContact O-CB 3.27Å; L183-S187 WeakPolarHBondContact O-CB 3.42Å; L183-S187 PolarHBondContact O-N 3.31Å; L183-S187 PolarHBondContact O-OG 2.67Å
184L69.9Low65.6Low96 Ų9695.6 Ų95.650%0.50354%0.541SS..Hα-helixtrans-70.7-39.6177.6-74.1165.6000112.1L176 E180 R181 E182 S187 S188L176-L184 HydrophobicContact CD1-CD1 3.71Å; E180-L184 WeakPolarHBondContact O-CB 3.48Å; E180-L184 WeakPolarHBondContact O-CD1 3.22Å; E180-L184 VanDerWaalsContact O-CG 3.22Å; E180-L184 WeakPolarHBondContact O-CG 3.3Å; E180-L184 PolarHBondContact O-N 2.88Å; R181-L184 PolarHBondContact O-N 3Å; E182-L184 VanDerWaalsContact C-N 3.29Å; E182-L184 PolarHBondContact O-N 3.25Å; L184-S187 PolarHBondContact O-N 3.48Å; L184-S188 WeakPolarHBondContact O-CB 3.2Å; L184-S188 PolarHBondContact O-N 3.29Å
185D75.4Confident66.4Low110 Ų11097.3 Ų97.359%0.58853%0.534SS*.Hα-helixtrans-61.6-50.7176.1-171.645.4000111.1R181 E182 S187 S188 W189R181-D185 PolarHBondContact O-N 3.46Å; E182-D185 PolarHBondContact O-N 3.28Å; D185-S187 VanDerWaalsContact C-N 3.3Å; D185-S187 PolarHBondContact O-N 2.85Å; D185-S188 PolarHBondContact O-N 2.93Å; D185-S188 VanDerWaalsContact O-N 3.13Å; D185-S188 PolarHBondContact O-OG 3.24Å; D185-W189 PolarHBondContact O-N 3.28Å
186F66.2Low66.8Low109 Ų10997.3 Ų97.348%0.47852%0.519SS..Hα-helixtrans-61.1-36.6174-86.8-77.2000113.1L65 E182 W189 L190L65-F186 HydrophobicContact CD2-CB 3.9Å; E182-F186 WeakPolarHBondContact O-CD2 3.42Å; E182-F186 PolarHBondContact O-N 3.45Å; F186-W189 HydrophobicContact CD1-CE3 4.44Å; F186-L190 WeakPolarHBondContact O-CG 3.17Å; F186-L190 PolarHBondContact O-N 2.83Å
187S68.6Low67.3Low38 Ų3897.5 Ų97.527%0.26652%0.521SS..Hα-helixtrans-70.7-34.1176.8-59.80000111.9L183 L184 D185 L190 G191L183-S187 VanDerWaalsContact O-CB 3.27Å; L183-S187 WeakPolarHBondContact O-CB 3.42Å; L183-S187 PolarHBondContact O-N 3.31Å; L183-S187 PolarHBondContact O-OG 2.67Å; L184-S187 PolarHBondContact O-N 3.48Å; D185-S187 VanDerWaalsContact C-N 3.3Å; D185-S187 PolarHBondContact O-N 2.85Å; S187-L190 PolarHBondContact O-N 3.43Å; S187-G191 PolarHBondContact O-N 3.32Å; S187-G191 VanDerWaalsContact O-N 3.11Å
188S73.6Confident66.8Low77 Ų77100.1 Ų100.154%0.53853%0.529SS..Hα-helixtrans-68.1-39176.3790000111.6L184 D185 L190 G191L184-S188 WeakPolarHBondContact O-CB 3.2Å; L184-S188 PolarHBondContact O-N 3.29Å; D185-S188 PolarHBondContact O-N 2.93Å; D185-S188 VanDerWaalsContact O-N 3.13Å; D185-S188 PolarHBondContact O-OG 3.24Å; S188-L190 VanDerWaalsContact C-N 3.29Å; S188-L190 PolarHBondContact O-N 2.91Å; S188-G191 PolarHBondContact O-N 3.42Å; S188-G191 VanDerWaalsContact O-N 3.12Å
189W70.9Confident66.7Low184 Ų18499.9 Ų99.970%0.69752%0.52SS*.Hα-helixtrans-60.6-38.2173.1-179.552.5000112.6D185 F186 G191D185-W189 PolarHBondContact O-N 3.28Å; F186-W189 HydrophobicContact CD1-CE3 4.44Å; W189-G191 VanDerWaalsContact C-N 3.34Å
190L65.9Low66.8Low48 Ų48103.1 Ų103.125%0.25152%0.524SS..Hα-helixtrans-77.1-16.7176.8-64.2173.4000113.8L68 A72 F186 S187 S188L68-L190 HydrophobicContact CB-CD1 3.94Å; A72-L190 HydrophobicContact CB-CB 4.48Å; A72-L190 HydrophobicContact CB-CD2 3.66Å; F186-L190 WeakPolarHBondContact O-CG 3.17Å; F186-L190 PolarHBondContact O-N 2.83Å; S187-L190 PolarHBondContact O-N 3.43Å; S188-L190 VanDerWaalsContact C-N 3.29Å; S188-L190 PolarHBondContact O-N 2.91Å
191G57.8Low66.6Low64 Ų64104.3 Ų104.366%0.6653%0.533SS*.THydrogen-bonded Turntrans-96.13.6-175.500000115.3S187 S188 W189S187-G191 PolarHBondContact O-N 3.32Å; S187-G191 VanDerWaalsContact O-N 3.11Å; S188-G191 PolarHBondContact O-N 3.42Å; S188-G191 VanDerWaalsContact O-N 3.12Å; W189-G191 VanDerWaalsContact C-N 3.34Å
192G58.9Low66Low60 Ų6097.9 Ų97.962%0.61952%0.521SS*.  trans-89.76.6-174.200000116.6
193Y50.4Low65.7Low238 Ų23895 Ų9593%0.93351%0.513SS*.  trans-130.40-176.6-70.8-77.9000113

Retrieved 193 of 193 residues in 80.8 ms (Link to these results)