A0A061I6Z8_CRIGR Loading...

Geminin coiled-coil domain containing

AlphaFold DB , UniProt , Accession A0A061I6Z8, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 339 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
1M44.7Very low38.7Very low239 Ų239163.2 Ų163.2100%1.17785%0.85SS**  095.90177.3176.6-102.100104.7
2E40.3Very low38.5Very low197 Ų197159.2 Ų159.292%0.92184%0.842SS**  trans-172.2141.1162.1-107.7167.1179.900108.6
3D38.3Very low38.1Very low167 Ų167157.5 Ų157.589%0.89385%0.849SS**PPolyproline II helixtrans-80.5149.5-145.8-85.6-49.1000115.9
4A40.4Very low37.8Very low80 Ų80159.9 Ų159.966%0.66185%0.851SS**PPolyproline II helixtrans-76.5126.7177.900000112.1F6A4-F6 PolarHBondContact O-N 3.4Å
5M40.5Very low37.7Very low188 Ų188159.5 Ų159.593%0.92685%0.85SS**PPolyproline II helixtrans-68.9119.4163.2-74.1-177.7160.500110.4
6F40.7Very low38.2Very low175 Ų175156.4 Ų156.477%0.76884%0.841SS**  trans-102.698.7162.3-86.2-81000109.6A4A4-F6 PolarHBondContact O-N 3.4Å
7Q39.5Very low38.1Very low184 Ų184159.6 Ų159.686%0.8684%0.84SS**  trans-93.7115.7153.6-77.5-173.7-1400107.4
8N31.8Very low37.8Very low135 Ų135161.5 Ų161.572%0.72284%0.841SS**  trans-119.299.1167.3-85.6-46.3000109
9S33.3Very low37.6Very low109 Ų109159.8 Ų159.876%0.76284%0.838SS**  trans-64.9121.1165.138.80000110.9
10I35.7Very low37.3Very low171 Ų171155.7 Ų155.788%0.87784%0.836SS**  trans-88.6111.7170.5-62173.5000107.8
11L40.6Very low37.1Very low150 Ų150151.8 Ų151.879%0.78583%0.832SS**PPolyproline II helixtrans-81.2150.5166.2-80.8161.1000110.2
12P36.3Very low36.8Very low115 Ų115149.2 Ų149.275%0.74782%0.817SS**PPolyproline II helixtrans-82.5131.4177.332.8-30.2000111.1
13C33.1Very low36.6Very low138 Ų138143.7 Ų143.793%0.93280%0.801SS**PPolyproline II helixtrans-78.8124.6171.7-890000111.1
14Q34Very low36.5Very low190 Ų190146.4 Ų146.489%0.88880%0.8SS**  trans-107.5156.3159.7-76.1-174.216.600110.3
15D37.1Very low36.2Very low154 Ų154150.1 Ų150.182%0.82481%0.809SS**  trans-44.4163.5-165.3-66.6-42.9000120.7
16P45.7Very low35.8Very low110 Ų110146.9 Ų146.971%0.71480%0.803SS**  -144.1131.9113.821.90.5000117.5
17Y36.7Very low36.3Very low211 Ų211143.1 Ų143.183%0.82780%0.796SS**  trans40128.8139.2-47.7-80.7000123.2
18F31.9Very low35.9Very low194 Ų194144.9 Ų144.985%0.85180%0.796SS**  -176.9118.1107-118.3-97.8000115.2
19V33.6Very low36.3Very low130 Ų130143.9 Ų143.979%0.78880%0.8SS**  trans30.4127.2136.6-167.90000122.3
20G32.8Very low36.2Very low77 Ų77145.4 Ų145.479%0.79481%0.805SS**  trans179.188153.600000112.2
21G32.5Very low36.2Very low74 Ų74143.4 Ų143.476%0.76380%0.801SS**  trans-79.8160.3-173.600000115.6
22Q38Very low35.8Very low185 Ų185142.7 Ų142.786%0.86480%0.803SS**  trans-152.6130143.9-111.1-178.544.200110.5
23S35.7Very low35.6Very low81 Ų81142.4 Ų142.457%0.56680%0.804SS**  trans-54.2147178.9520000114.7
24Y36.2Very low35.7Very low224 Ų224145.2 Ų145.288%0.87880%0.803SS**  -158.1142.7119.9-79.3-65.4000110.2
25N35.8Very low35.8Very low158 Ų158141.8 Ų141.885%0.84580%0.8SS**  trans-82.1165.8-174.4-91.5-67.1000113.5
26C31.2Very low35.9Very low119 Ų119139.8 Ų139.880%0.80480%0.799SS**  trans101.9150.7149.9-94.80000119
27P51Low35.7Very low97 Ų97140.7 Ų140.763%0.6380%0.801SS**  trans-116.6-167.4-13031.5-9.7000111.8
28Y31.6Very low35.8Very low220 Ų220137.4 Ų137.486%0.86380%0.798SS**  trans105.7109.4173.6-62.6-75.4000115.6
29S40.1Very low36.2Very low115 Ų115134 Ų13480%0.80479%0.793SS**  trans-63.7138.2159.9-50.20000111
30T30.4Very low36.8Very low141 Ų141131.4 Ų131.487%0.86578%0.781SS**  trans-162.2129.6133.912.40000111.7
31T36.4Very low37.9Very low128 Ų128137 Ų13779%0.78578%0.783SS**  trans-38.2138.6164.9-52.50000115.5
32T31.1Very low38.8Very low135 Ų135140.1 Ų140.183%0.82878%0.778SS**  trans-157.2107140.7-59.50000111.1
33S33.6Very low39.8Very low110 Ų110136.6 Ų136.677%0.76977%0.769SS**  trans27.6111.3145-54.30000121.7
34E34.8Very low40.3Very low197 Ų197144.5 Ų144.592%0.92179%0.787SS**  trans-88.1130.7150-68.7-176.2150.200109.4
35S34.8Very low40.8Very low117 Ų117139.3 Ų139.382%0.81878%0.778SS**  trans-93.495.4169.463.50000109.4
36S39.2Very low41.3Very low113 Ų113136.8 Ų136.879%0.7977%0.773SS**PPolyproline II helixtrans-76.312716459.10000109.1
37V42.4Very low41.9Very low128 Ų128140.6 Ų140.678%0.77678%0.776SS**PPolyproline II helixtrans-85116.3171.2179.70000107
38D39.7Very low41.9Very low142 Ų142147.9 Ų147.976%0.75979%0.791SS**PPolyproline II helixtrans-72.1119.2176.8-166.18.9000109.5
39V39.1Very low42.4Very low124 Ų124141.8 Ų141.875%0.75279%0.786SS**  trans-105.195.4176.3-157.20000107.1K41V39-K41 PolarHBondContact O-N 3.22Å
40S45.4Very low42.6Very low75 Ų75140.6 Ų140.652%0.52478%0.784SS.*  trans-62.3122.5171.5-72.70000109.4E42S40-E42 WeakPolarHBondContact CB-OE1 3.31Å
41K57.8Low43.2Very low194 Ų194139.5 Ų139.584%0.84378%0.782SS**  trans-91.985.3166.6-84.9-174.7174.4-178.90107.7V39 T43V39-K41 PolarHBondContact O-N 3.22Å; K41-T43 PolarHBondContact O-N 2.57Å; K41-T43 VanDerWaalsContact O-N 3.1Å
42E51.4Low43.5Very low139 Ų139141.5 Ų141.565%0.6579%0.787SS**  trans-74.6105.1170.9-43.185.2-164.300109.2S40 W44S40-E42 WeakPolarHBondContact CB-OE1 3.31Å; E42-W44 PolarHBondContact O-N 3.17Å
43T57.5Low44Very low111 Ų111142.5 Ų142.568%0.68179%0.786SS**  trans-77.2109.8177.3-640000108.8K41 V45K41-T43 PolarHBondContact O-N 2.57Å; K41-T43 VanDerWaalsContact O-N 3.1Å; T43-V45 HydrophobicContact CG2-CB 4Å; T43-V45 HydrophobicContact CG2-CG2 3.62Å; T43-V45 PolarHBondContact O-N 3.1Å
44W46.9Very low44.2Very low247 Ų247143.6 Ų143.694%0.93678%0.784SS**  trans-75.773.1170.9-71.473.9000110.3E42E42-W44 PolarHBondContact O-N 3.17Å
45V46.1Very low44.3Very low115 Ų115141.7 Ų141.770%0.69778%0.78SS**  trans-130.980.4170.2-179.70000107.7T43T43-V45 HydrophobicContact CG2-CB 4Å; T43-V45 HydrophobicContact CG2-CG2 3.62Å; T43-V45 PolarHBondContact O-N 3.1Å
46S46.8Very low44.6Very low106 Ų106139.9 Ų139.974%0.74177%0.772SS**  trans-156.7-1.2166.9-79.10000115.6W48S46-W48 PolarHBondContact O-N 3.5Å
47F44.3Very low44.3Very low198 Ų198142.2 Ų142.287%0.86877%0.77SS**SBendtrans-85.3-5.9-176.3-138.7-93.1000115.5
48W50.4Low44.3Very low250 Ų250141.6 Ų141.695%0.94777%0.769SS**SBendtrans-110.1-3.2-176.9-63.5106.6000114.9S46S46-W48 PolarHBondContact O-N 3.5Å
49A42.8Very low44.2Very low92 Ų92142.3 Ų142.376%0.7677%0.768SS**SBendtrans-93.72.7-174.100000114.8
50A44Very low44.1Very low91 Ų91145.2 Ų145.275%0.75277%0.773SS**SBendtrans-102.817.1-170.400000115.8
51S41.8Very low43.4Very low117 Ų117146 Ų14682%0.81878%0.784SS**SBendtrans-129.631.3174-73.90000114.9
52L42.9Very low42.7Very low171 Ų171142.5 Ų142.590%0.89578%0.781SS**  trans-134.671.1162.3-107108.7000109.3
53L42.2Very low41.9Very low156 Ų156144 Ų14482%0.81779%0.788SS**  trans-91.7103.1161.4-14676.3000108.2N55L53-N55 PolarHBondContact O-N 3.14Å
54D36.8Very low40.8Very low133 Ų133144.3 Ų144.371%0.71179%0.79SS**  trans-35.5117.7160-174.318.2000112A56D54-A56 WeakPolarHBondContact OD1-CB 3.41Å; D54-A56 PolarHBondContact OD1-N 3.18Å
55N37.8Very low40.1Very low157 Ų157141.6 Ų141.684%0.8479%0.788SS**  trans-116.165.8164.8-78.1-70.9000108.1L53L53-N55 PolarHBondContact O-N 3.14Å
56A41.6Very low39.8Very low78 Ų78145.2 Ų145.265%0.64580%0.797SS**  trans-90.196.1162.700000109.7D54D54-A56 WeakPolarHBondContact OD1-CB 3.41Å; D54-A56 PolarHBondContact OD1-N 3.18Å
57E31.8Very low39.4Very low162 Ų162144.2 Ų144.276%0.75780%0.795SS**  trans-140.3123.3156.7-169.7103.3-152.700109.1
58P43.5Very low39.1Very low116 Ų116140 Ų14075%0.75379%0.79SS**  trans-92.6112.1-179.432.8-27.7000111
59Q37.3Very low38.3Very low157 Ų157133 Ų13373%0.73478%0.778SS**  trans-138.197.9170.6-71.1-77.5-36.400111.1
60Q36Very low38.3Very low184 Ų184135.2 Ų135.286%0.8678%0.777SS**  trans42.1123.7145.7-58.2-157.4-41.100121.9
61A32.3Very low38.3Very low91 Ų91136.5 Ų136.575%0.75277%0.771SS**  trans-71.3158.215800000111.7
62P41.8Very low38.6Very low122 Ų122138.1 Ų138.179%0.79277%0.771SS**  -139.4129.289.428-9.4000115.8
63Q36.2Very low38.9Very low170 Ų170136.3 Ų136.379%0.79476%0.756SS**  trans53.8127.3130.4-67.8-78.6-1500121.7
64T32.8Very low39.5Very low117 Ų117134 Ų13472%0.71875%0.75SS**  trans88.998.9145.3-35.10000118.3
65Q33.7Very low40.3Very low190 Ų190132.3 Ų132.389%0.88874%0.744SS**  -169.8136.5105-130.1160.74.100112.1
66E38.5Very low40.9Very low191 Ų191132.5 Ų132.589%0.89374%0.744SS**  trans-60.5129.9178.8-60.4177.2147.900112.2
67A38.2Very low41.6Very low85 Ų85135.2 Ų135.270%0.70275%0.748SS**  trans-147.183.5147.300000106.6C69A67-C69 PolarHBondContact O-N 3.12Å
68S39.1Very low42.8Very low110 Ų110130.6 Ų130.677%0.76973%0.734SS**  trans-63.884.2162.455.70000108D70S68-D70 VanDerWaalsContact C-N 3.26Å; S68-D70 PolarHBondContact O-N 2.99Å; S68-D70 VanDerWaalsContact O-N 3.15Å
69C33.5Very low43.7Very low103 Ų103128.3 Ų128.370%0.69672%0.72SS**  trans-78.989.2160.8-70.20000106.7A67 L71A67-C69 PolarHBondContact O-N 3.12Å; C69-L71 PolarHBondContact O-N 3.39Å
70D42.5Very low45.3Very low138 Ų138124.4 Ų124.474%0.73871%0.71SS**  trans-54.488.2159.8-94.7-41000108.8S68S68-D70 VanDerWaalsContact C-N 3.26Å; S68-D70 PolarHBondContact O-N 2.99Å; S68-D70 VanDerWaalsContact O-N 3.15Å
71L43.1Very low47.2Very low118 Ų118123.8 Ų123.862%0.61870%0.7SS**  trans-115.177.3163.6-78.9162.7000106C69 F73C69-L71 PolarHBondContact O-N 3.39Å; L71-F73 HydrophobicContact CB-CD2 3.65Å; L71-F73 HydrophobicContact CB-CE2 3.63Å; L71-F73 HydrophobicContact CD1-CE2 3.94Å; L71-F73 HydrophobicContact CD2-CD2 4.31Å; L71-F73 HydrophobicContact CD2-CE2 3.61Å; L71-F73 HydrophobicContact CD2-CZ 3.94Å; L71-F73 HydrophobicContact CG-CD2 4.42Å; L71-F73 HydrophobicContact CG-CE2 3.91Å; L71-F73 PolarHBondContact O-N 3.18Å
72N49.7Very low49.6Very low152 Ų152125 Ų12581%0.81369%0.69SS**  trans-63.679.2160.2-76.9-72.7000107.9
73F48.4Very low51.7Low132 Ų132125 Ų12558%0.57968%0.679SS**  trans-82.2139.8165-79.9-75.8000108.7L71 V75L71-F73 HydrophobicContact CB-CD2 3.65Å; L71-F73 HydrophobicContact CB-CE2 3.63Å; L71-F73 HydrophobicContact CD1-CE2 3.94Å; L71-F73 HydrophobicContact CD2-CD2 4.31Å; L71-F73 HydrophobicContact CD2-CE2 3.61Å; L71-F73 HydrophobicContact CD2-CZ 3.94Å; L71-F73 HydrophobicContact CG-CD2 4.42Å; L71-F73 HydrophobicContact CG-CE2 3.91Å; L71-F73 PolarHBondContact O-N 3.18Å; F73-V75 HydrophobicContact CB-CB 4.21Å; F73-V75 HydrophobicContact CB-CG2 3.7Å; F73-V75 HydrophobicContact CG-CG2 4.39Å; F73-V75 PolarHBondContact O-N 2.8Å
74P53.9Low54.2Low107 Ų107119.4 Ų119.470%0.69566%0.662SS**THydrogen-bonded Turntrans-72.128.5172.532.1-34.4000112.9L76 D77P74-L76 VanDerWaalsContact C-N 3.25Å; P74-L76 PolarHBondContact O-N 3.18Å; P74-D77 PolarHBondContact O-N 2.99Å
75V54.3Low57.1Low98 Ų98117.9 Ų117.959%0.59465%0.647SS**Hα-helixtrans-70.8-22.4-176.11670000111.9F73 D77 S78F73-V75 HydrophobicContact CB-CB 4.21Å; F73-V75 HydrophobicContact CB-CG2 3.7Å; F73-V75 HydrophobicContact CG-CG2 4.39Å; F73-V75 PolarHBondContact O-N 2.8Å; V75-D77 VanDerWaalsContact C-N 3.26Å; V75-D77 PolarHBondContact O-N 2.92Å; V75-S78 PolarHBondContact O-N 3.06Å
76L50.4Low60Low161 Ų161114.7 Ų114.784%0.84364%0.635SS**Hα-helixtrans-66.1-27.9179.4-158.968.8000112.9P74P74-L76 VanDerWaalsContact C-N 3.25Å; P74-L76 PolarHBondContact O-N 3.18Å
77D56.6Low62.7Low135 Ų135109.3 Ų109.372%0.72262%0.619SS**Hα-helixtrans-87.2-25.5-178.2-123.312.4000113.1P74 V75 W81P74-D77 PolarHBondContact O-N 2.99Å; V75-D77 VanDerWaalsContact C-N 3.26Å; V75-D77 PolarHBondContact O-N 2.92Å; D77-W81 PolarHBondContact O-N 3.09Å
78S57.4Low65.5Low66 Ų66107.4 Ų107.446%0.46260%0.6SS.*Hα-helixtrans-73.3-36.8176.8-69.20000112.6V75 S80 W81 E82V75-S78 PolarHBondContact O-N 3.06Å; S78-S80 PolarHBondContact O-N 3.08Å; S78-W81 PolarHBondContact O-N 2.88Å; S78-E82 VanDerWaalsContact O-CG 3.32Å; S78-E82 WeakPolarHBondContact O-CG 3.33Å; S78-E82 PolarHBondContact O-N 3.24Å
79C61.3Low68.2Low68 Ų68107.2 Ų107.246%0.45959%0.587SS.*Hα-helixtrans-65.2-40.1-179.2-160.50000112.1E82 E83C79-E82 PolarHBondContact O-N 3.02Å; C79-E83 PolarHBondContact O-N 3.4Å
80S72.4Confident71.3Confident74 Ų74108.8 Ų108.852%0.51759%0.588SS.*Hα-helixtrans-68.2-37.5177.6-178.50000112.8S78 A84S78-S80 PolarHBondContact O-N 3.08Å; S80-A84 WeakPolarHBondContact O-CB 3.29Å; S80-A84 PolarHBondContact O-N 3.49Å
81W75.6Confident73.9Confident171 Ų171109.1 Ų109.165%0.64858%0.58SS**Hα-helixtrans-66.5-43174.8173.9-101.6000111.8D77 S78 A84 Q85D77-W81 PolarHBondContact O-N 3.09Å; S78-W81 PolarHBondContact O-N 2.88Å; W81-A84 PolarHBondContact O-N 3.03Å; W81-Q85 HydrophobicContact CD2-CG 4.35Å; W81-Q85 VanDerWaalsContact CH2-NE2 3.35Å; W81-Q85 HydrophobicContact CZ2-CG 4.2Å; W81-Q85 WeakPolarHBondContact O-CG 3.33Å; W81-Q85 PolarHBondContact O-N 3.06Å
82E81.9Confident76.6Confident116 Ų116110 Ų11054%0.54258%0.575SS.*Hα-helixtrans-62-43.6176.3-73170.2-170.600111.9S78 C79 A84 Q85 L86S78-E82 VanDerWaalsContact O-CG 3.32Å; S78-E82 WeakPolarHBondContact O-CG 3.33Å; S78-E82 PolarHBondContact O-N 3.24Å; C79-E82 PolarHBondContact O-N 3.02Å; E82-A84 PolarHBondContact O-N 3.49Å; E82-Q85 PolarHBondContact O-N 2.99Å; E82-L86 WeakPolarHBondContact O-CB 3.47Å; E82-L86 VanDerWaalsContact O-CG 3.31Å; E82-L86 WeakPolarHBondContact O-CG 3.34Å; E82-L86 PolarHBondContact O-N 2.97Å
83E85.2Confident78.9Confident123 Ų123107.2 Ų107.258%0.57556%0.56SS**Hα-helixtrans-62.6-38.9173.6-83.4180150.700112.9C79 L86 S87C79-E83 PolarHBondContact O-N 3.4Å; E83-L86 PolarHBondContact O-N 3.46Å; E83-S87 VanDerWaalsContact O-CB 3.3Å; E83-S87 WeakPolarHBondContact O-CB 3.44Å; E83-S87 PolarHBondContact O-N 2.88Å; E83-S87 PolarHBondContact O-OG 3.13Å
84A90.4Very high81.2Confident52 Ų52106.5 Ų106.543%0.4356%0.557SS.*Hα-helixtrans-66.7-39175.300000112S80 W81 E82 S87 S88S80-A84 WeakPolarHBondContact O-CB 3.29Å; S80-A84 PolarHBondContact O-N 3.49Å; W81-A84 PolarHBondContact O-N 3.03Å; E82-A84 PolarHBondContact O-N 3.49Å; A84-S87 PolarHBondContact O-N 3.42Å; A84-S88 WeakPolarHBondContact O-CB 3.21Å; A84-S88 PolarHBondContact O-N 2.71Å
85Q93.9Very high83.4Confident86 Ų86105.3 Ų105.340%0.40254%0.542SS..Hα-helixtrans-66.5-44.3174.6-70.4-53.8-53.600111.8W81 E82 S87 S88 Q89W81-Q85 HydrophobicContact CD2-CG 4.35Å; W81-Q85 VanDerWaalsContact CH2-NE2 3.35Å; W81-Q85 HydrophobicContact CZ2-CG 4.2Å; W81-Q85 WeakPolarHBondContact O-CG 3.33Å; W81-Q85 PolarHBondContact O-N 3.06Å; E82-Q85 PolarHBondContact O-N 2.99Å; Q85-S87 VanDerWaalsContact C-N 3.34Å; Q85-S87 PolarHBondContact O-N 3.42Å; Q85-S88 WeakPolarHBondContact O-CB 3.4Å; Q85-S88 PolarHBondContact O-N 3.48Å; Q85-Q89 WeakPolarHBondContact O-CB 3.22Å; Q85-Q89 PolarHBondContact O-N 3.23Å
86L93.8Very high85.5Confident122 Ų122106.2 Ų106.264%0.63954%0.543SS*.Hα-helixtrans-60.6-44.3174.8-73.7171.4000111E82 E83 S88 Q89 L90E82-L86 WeakPolarHBondContact O-CB 3.47Å; E82-L86 VanDerWaalsContact O-CG 3.31Å; E82-L86 WeakPolarHBondContact O-CG 3.34Å; E82-L86 PolarHBondContact O-N 2.97Å; E83-L86 PolarHBondContact O-N 3.46Å; L86-S88 PolarHBondContact O-N 3.32Å; L86-Q89 PolarHBondContact O-N 2.8Å; L86-L90 WeakPolarHBondContact O-CB 3.23Å; L86-L90 PolarHBondContact O-N 3.48Å
87S95.1Very high87.8Confident79 Ų79104.1 Ų104.155%0.55253%0.529SS*.Hα-helixtrans-61.8-42.9176.3-61.60000112.1E83 A84 Q85 Q89 L90 Y91E83-S87 VanDerWaalsContact O-CB 3.3Å; E83-S87 WeakPolarHBondContact O-CB 3.44Å; E83-S87 PolarHBondContact O-N 2.88Å; E83-S87 PolarHBondContact O-OG 3.13Å; A84-S87 PolarHBondContact O-N 3.42Å; Q85-S87 VanDerWaalsContact C-N 3.34Å; Q85-S87 PolarHBondContact O-N 3.42Å; S87-Q89 VanDerWaalsContact C-N 3.34Å; S87-Q89 PolarHBondContact O-N 3.46Å; S87-L90 PolarHBondContact O-N 3.43Å; S87-Y91 WeakPolarHBondContact O-CB 3.34Å; S87-Y91 PolarHBondContact O-N 3.14Å
88S96.1Very high89.8Confident44 Ų44101.5 Ų101.531%0.30852%0.515SS..Hα-helixtrans-61.1-43.4174.6-1740000111.7A84 Q85 L86 Y91 R92A84-S88 WeakPolarHBondContact O-CB 3.21Å; A84-S88 PolarHBondContact O-N 2.71Å; Q85-S88 WeakPolarHBondContact O-CB 3.4Å; Q85-S88 PolarHBondContact O-N 3.48Å; L86-S88 PolarHBondContact O-N 3.32Å; S88-Y91 PolarHBondContact O-N 3.18Å; S88-R92 PolarHBondContact O-N 3.04Å
89Q97Very high91.7Very high107 Ų107101.5 Ų101.550%0.551%0.512SS..Hα-helixtrans-69.5-38.8-179.9-169.561.510.500112.1Q85 L86 S87 Y91 R92 N93Q85-Q89 WeakPolarHBondContact O-CB 3.22Å; Q85-Q89 PolarHBondContact O-N 3.23Å; L86-Q89 PolarHBondContact O-N 2.8Å; S87-Q89 VanDerWaalsContact C-N 3.34Å; S87-Q89 PolarHBondContact O-N 3.46Å; Q89-Y91 VanDerWaalsContact C-N 3.33Å; Q89-Y91 PolarHBondContact O-N 2.99Å; Q89-R92 PolarHBondContact O-N 3.33Å; Q89-N93 WeakPolarHBondContact O-CB 3.48Å; Q89-N93 PolarHBondContact O-N 3.47Å
90L97.9Very high93.5Very high136 Ų136103 Ų10371%0.71252%0.515SS*.Hα-helixtrans-62.4-42.5174.9-147.194.4000110.9L86 S87 N93 K94L86-L90 WeakPolarHBondContact O-CB 3.23Å; L86-L90 PolarHBondContact O-N 3.48Å; S87-L90 PolarHBondContact O-N 3.43Å; L90-N93 PolarHBondContact O-N 3.01Å; L90-K94 PolarHBondContact O-N 3.02Å
91Y98.1Very high94.8Very high145 Ų145102.6 Ų102.657%0.56951%0.509SS*.Hα-helixtrans-63-45.3175.6-179.8-96.6000112S87 S88 Q89 N93 K94 Q95S87-Y91 WeakPolarHBondContact O-CB 3.34Å; S87-Y91 PolarHBondContact O-N 3.14Å; S88-Y91 PolarHBondContact O-N 3.18Å; Q89-Y91 VanDerWaalsContact C-N 3.33Å; Q89-Y91 PolarHBondContact O-N 2.99Å; Y91-N93 VanDerWaalsContact C-N 3.31Å; Y91-N93 PolarHBondContact O-N 3.14Å; Y91-K94 PolarHBondContact O-N 3.36Å; Y91-Q95 HydrophobicContact CD1-CG 4.24Å; Y91-Q95 HydrophobicContact CE1-CG 3.85Å; Y91-Q95 WeakPolarHBondContact O-CG 3.46Å; Y91-Q95 PolarHBondContact O-N 3Å; Y91-Q95 PolarHBondContact OH-NE2 2.81Å
92R98.3Very high95.9Very high136 Ų136100.2 Ų100.251%0.51351%0.505SS..Hα-helixtrans-59.9-42.7173.4-76.3-169-171.9110.92.5111.8S88 Q89 K94 Q95 L96S88-R92 PolarHBondContact O-N 3.04Å; Q89-R92 PolarHBondContact O-N 3.33Å; R92-K94 VanDerWaalsContact C-N 3.33Å; R92-K94 PolarHBondContact O-N 2.94Å; R92-Q95 WeakPolarHBondContact O-CB 3.34Å; R92-Q95 PolarHBondContact O-N 3.44Å; R92-L96 WeakPolarHBondContact O-CG 2.88Å; R92-L96 PolarHBondContact O-N 3.44Å
93N98.2Very high96.7Very high94 Ų9499.5 Ų99.550%0.50350%0.5SS..Hα-helixtrans-62.5-42.4179.2-167.8-91.2000111.3Q89 L90 Y91 Q95 L96 Q97Q89-N93 WeakPolarHBondContact O-CB 3.48Å; Q89-N93 PolarHBondContact O-N 3.47Å; L90-N93 PolarHBondContact O-N 3.01Å; Y91-N93 VanDerWaalsContact C-N 3.31Å; Y91-N93 PolarHBondContact O-N 3.14Å; N93-Q95 PolarHBondContact O-N 2.9Å; N93-L96 PolarHBondContact O-N 3.3Å; N93-Q97 WeakPolarHBondContact O-CB 3.43Å; N93-Q97 PolarHBondContact O-N 3Å
94K98.1Very high97.3Very high117 Ų11798.8 Ų98.851%0.50950%0.497SS..Hα-helixtrans-58.7-47.1173-171-174.3179.8-123.30112.1L90 Y91 R92 L96 Q97 D98L90-K94 PolarHBondContact O-N 3.02Å; Y91-K94 PolarHBondContact O-N 3.36Å; R92-K94 VanDerWaalsContact C-N 3.33Å; R92-K94 PolarHBondContact O-N 2.94Å; K94-L96 VanDerWaalsContact C-N 3.3Å; K94-L96 PolarHBondContact O-N 2.95Å; K94-Q97 WeakPolarHBondContact O-CB 3.34Å; K94-Q97 PolarHBondContact O-N 3.31Å; K94-Q97 VanDerWaalsContact O-N 3.13Å; K94-D98 PolarHBondContact O-N 3.12Å
95Q98.6Very high97.7Very high81 Ų81102.6 Ų102.638%0.37951%0.506SS..Hα-helixtrans-59.5-40.9176.6-71.4-72.6-32.600112.2Y91 R92 N93 Q97 D98 T99Y91-Q95 HydrophobicContact CD1-CG 4.24Å; Y91-Q95 HydrophobicContact CE1-CG 3.85Å; Y91-Q95 WeakPolarHBondContact O-CG 3.46Å; Y91-Q95 PolarHBondContact O-N 3Å; Y91-Q95 PolarHBondContact OH-NE2 2.81Å; R92-Q95 WeakPolarHBondContact O-CB 3.34Å; R92-Q95 PolarHBondContact O-N 3.44Å; N93-Q95 PolarHBondContact O-N 2.9Å; Q95-Q97 VanDerWaalsContact C-N 3.34Å; Q95-D98 PolarHBondContact O-N 3.12Å; Q95-T99 WeakPolarHBondContact O-CB 3.46Å; Q95-T99 PolarHBondContact O-N 2.85Å; Q95-T99 PolarHBondContact O-OG1 2.7Å
96L98.8Very high97.9Very high117 Ų117101.7 Ų101.761%0.61350%0.501SS*.Hα-helixtrans-66.2-38.2175.7-71.1173.1000111.7R92 N93 K94 T99 L100R92-L96 WeakPolarHBondContact O-CG 2.88Å; R92-L96 PolarHBondContact O-N 3.44Å; N93-L96 PolarHBondContact O-N 3.3Å; K94-L96 VanDerWaalsContact C-N 3.3Å; K94-L96 PolarHBondContact O-N 2.95Å; L96-T99 PolarHBondContact O-N 2.8Å; L96-L100 VanDerWaalsContact O-CB 3.28Å; L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 PolarHBondContact O-N 3.38Å
97Q98.6Very high98.1Very high118 Ų118100.5 Ų100.555%0.55150%0.495SS*.Hα-helixtrans-65.8-45.1176.2-169.8164.624.400111.5N93 K94 Q95 T99 L100 V101N93-Q97 WeakPolarHBondContact O-CB 3.43Å; N93-Q97 PolarHBondContact O-N 3Å; K94-Q97 WeakPolarHBondContact O-CB 3.34Å; K94-Q97 PolarHBondContact O-N 3.31Å; K94-Q97 VanDerWaalsContact O-N 3.13Å; Q95-Q97 VanDerWaalsContact C-N 3.34Å; Q97-T99 VanDerWaalsContact C-N 3.3Å; Q97-T99 PolarHBondContact O-N 2.89Å; Q97-L100 PolarHBondContact O-N 3.33Å; Q97-V101 WeakPolarHBondContact O-CG2 3.25Å; Q97-V101 PolarHBondContact O-N 2.88Å
98D98.6Very high98.3Very high80 Ų8099.7 Ų99.743%0.42849%0.494SS..Hα-helixtrans-59.4-43.3174.5-66.2-20.7000110.6K94 Q95 V101 Q102K94-D98 PolarHBondContact O-N 3.12Å; Q95-D98 PolarHBondContact O-N 3.12Å; D98-V101 PolarHBondContact O-N 3.19Å; D98-Q102 PolarHBondContact O-N 2.96Å; D98-Q102 VanDerWaalsContact O-N 3.08Å
99T98.6Very high98.4Very high65 Ų65104.7 Ų104.740%0.39951%0.506SS..Hα-helixtrans-65.6-39.4176.8-56.50000112.2Q95 L96 Q97 Q102 K103Q95-T99 WeakPolarHBondContact O-CB 3.46Å; Q95-T99 PolarHBondContact O-N 2.85Å; Q95-T99 PolarHBondContact O-OG1 2.7Å; L96-T99 PolarHBondContact O-N 2.8Å; Q97-T99 VanDerWaalsContact C-N 3.3Å; Q97-T99 PolarHBondContact O-N 2.89Å; T99-Q102 PolarHBondContact O-N 3.45Å; T99-K103 VanDerWaalsContact O-CG 3.28Å; T99-K103 WeakPolarHBondContact O-CG 3.33Å; T99-K103 PolarHBondContact O-N 2.99Å
100L98.7Very high98.5Very high99 Ų99103.6 Ų103.652%0.51850%0.503SS..Hα-helixtrans-63.3-48.2178.4177.563.2000110.5L96 Q97 Q102 K103 E104L96-L100 VanDerWaalsContact O-CB 3.28Å; L96-L100 WeakPolarHBondContact O-CB 3.43Å; L96-L100 PolarHBondContact O-N 3.38Å; Q97-L100 PolarHBondContact O-N 3.33Å; L100-Q102 VanDerWaalsContact C-N 3.31Å; L100-Q102 PolarHBondContact O-N 2.89Å; L100-K103 CarbonylContact O-C 3.59Å; L100-K103 WeakPolarHBondContact O-CA 2.93Å; L100-K103 WeakPolarHBondContact O-CB 3.49Å; L100-K103 PolarHBondContact O-N 2.9Å; L100-E104 WeakPolarHBondContact O-CG 3.34Å; L100-E104 PolarHBondContact O-N 2.75Å
101V98.6Very high98.5Very high66 Ų66103.5 Ų103.540%0.450%0.498SS..Hα-helixtrans-58.4-45.2176.8172.50000110.6Q97 D98 K103 E104 E105Q97-V101 WeakPolarHBondContact O-CG2 3.25Å; Q97-V101 PolarHBondContact O-N 2.88Å; D98-V101 PolarHBondContact O-N 3.19Å; V101-K103 VanDerWaalsContact C-N 3.26Å; V101-K103 PolarHBondContact O-N 3.48Å; V101-E104 PolarHBondContact O-N 2.8Å; V101-E104 VanDerWaalsContact O-N 3.17Å; V101-E105 PolarHBondContact O-N 2.82Å
102Q98.8Very high98.5Very high121 Ų121102.3 Ų102.357%0.56550%0.498SS*.Hα-helixtrans-58.4-38.9175.2-175.6-174.2-21.600112.3D98 T99 L100 E106D98-Q102 PolarHBondContact O-N 2.96Å; D98-Q102 VanDerWaalsContact O-N 3.08Å; T99-Q102 PolarHBondContact O-N 3.45Å; L100-Q102 VanDerWaalsContact C-N 3.31Å; L100-Q102 PolarHBondContact O-N 2.89Å; Q102-E106 PolarHBondContact O-N 2.81Å; Q102-E106 VanDerWaalsContact O-N 3.08Å
103K98.6Very high98.5Very high101 Ų101100.9 Ų100.944%0.43950%0.497SS..Hα-helixtrans-71.7-34.9177.9-70.9-73.2160.4-162.60112.5T99 L100 V101 E106 L107T99-K103 VanDerWaalsContact O-CG 3.28Å; T99-K103 WeakPolarHBondContact O-CG 3.33Å; T99-K103 PolarHBondContact O-N 2.99Å; L100-K103 CarbonylContact O-C 3.59Å; L100-K103 WeakPolarHBondContact O-CA 2.93Å; L100-K103 WeakPolarHBondContact O-CB 3.49Å; L100-K103 PolarHBondContact O-N 2.9Å; V101-K103 VanDerWaalsContact C-N 3.26Å; V101-K103 PolarHBondContact O-N 3.48Å; K103-E106 IonicContact NZ-OE2 3.82Å; K103-E106 PolarHBondContact NZ-OE2 2.9Å; K103-E106 PolarHBondContact O-N 2.7Å; K103-L107 WeakPolarHBondContact O-CB 3.1Å; K103-L107 VanDerWaalsContact O-CG 3.31Å; K103-L107 WeakPolarHBondContact O-CG 3.41Å; K103-L107 PolarHBondContact O-N 2.96Å
104E98.4Very high98.6Very high109 Ų109100 Ų10051%0.50949%0.492SS..Hα-helixtrans-64-41.8173.5-71.6176.7177.100111.7L100 V101 L107 A108L100-E104 WeakPolarHBondContact O-CG 3.34Å; L100-E104 PolarHBondContact O-N 2.75Å; V101-E104 PolarHBondContact O-N 2.8Å; V101-E104 VanDerWaalsContact O-N 3.17Å; E104-L107 PolarHBondContact O-N 3.21Å; E104-A108 PolarHBondContact O-N 2.89Å
105E98.4Very high98.6Very high131 Ų13198.4 Ų98.461%0.61249%0.489SS*.Hα-helixtrans-63.7-43.2174-69.7178.6177.300112.2V101 L107 A108 R109V101-E105 PolarHBondContact O-N 2.82Å; E105-L107 VanDerWaalsContact C-N 3.33Å; E105-L107 PolarHBondContact O-N 2.85Å; E105-A108 PolarHBondContact O-N 3.31Å; E105-R109 PolarHBondContact O-N 2.85Å
106E98.4Very high98.6Very high67 Ų6799.3 Ų99.331%0.31349%0.494SS..Hα-helixtrans-61.2-42175.6-179.9170.6-155.200111.6Q102 K103 R109 L110Q102-E106 PolarHBondContact O-N 2.81Å; Q102-E106 VanDerWaalsContact O-N 3.08Å; K103-E106 IonicContact NZ-OE2 3.82Å; K103-E106 PolarHBondContact NZ-OE2 2.9Å; K103-E106 PolarHBondContact O-N 2.7Å; E106-R109 PolarHBondContact O-N 3.21Å; E106-R109 IonicContact OE1-NH2 3.57Å; E106-L110 HydrophobicContact CG-CD1 4.29Å; E106-L110 WeakPolarHBondContact O-CG 3.47Å; E106-L110 PolarHBondContact O-N 3.24Å
107L98.6Very high98.5Very high98 Ų9898.4 Ų98.451%0.51349%0.489SS..Hα-helixtrans-63-42.4174.6-77.5170.3000111.9K103 E104 E105 R109 L110 H111K103-L107 WeakPolarHBondContact O-CB 3.1Å; K103-L107 VanDerWaalsContact O-CG 3.31Å; K103-L107 WeakPolarHBondContact O-CG 3.41Å; K103-L107 PolarHBondContact O-N 2.96Å; E104-L107 PolarHBondContact O-N 3.21Å; E105-L107 VanDerWaalsContact C-N 3.33Å; E105-L107 PolarHBondContact O-N 2.85Å; L107-R109 VanDerWaalsContact C-N 3.35Å; L107-R109 PolarHBondContact O-N 3.33Å; L107-L110 PolarHBondContact O-N 3.46Å; L107-H111 WeakPolarHBondContact O-CB 3.35Å; L107-H111 PolarHBondContact O-CD2 2.92Å; L107-H111 VanDerWaalsContact O-CD2 3.27Å; L107-H111 PolarHBondContact O-N 2.86Å
108A98.4Very high98.5Very high62 Ų62100.1 Ų100.151%0.51249%0.49SS..Hα-helixtrans-59.7-45.6176.900000111.4E104 E105 L110 H111 E112E104-A108 PolarHBondContact O-N 2.89Å; E105-A108 PolarHBondContact O-N 3.31Å; A108-L110 PolarHBondContact O-N 2.83Å; A108-H111 PolarHBondContact O-N 3.36Å; A108-E112 PolarHBondContact O-N 3.2Å
109R98.8Very high98.5Very high149 Ų149101.4 Ų101.456%0.56249%0.494SS*.Hα-helixtrans-61.2-44.4175.7-174.6-172.263.7-179.9-3.5112.2E105 E106 L107 E112 E113E105-R109 PolarHBondContact O-N 2.85Å; E106-R109 PolarHBondContact O-N 3.21Å; E106-R109 IonicContact OE1-NH2 3.57Å; L107-R109 VanDerWaalsContact C-N 3.35Å; L107-R109 PolarHBondContact O-N 3.33Å; R109-E112 PolarHBondContact O-N 3.25Å; R109-E113 PolarHBondContact O-N 3.48Å
110L98.8Very high98.4Very high83 Ų83106 Ų10644%0.43551%0.505SS..Hα-helixtrans-66.2-37.5178-74.6173.5000112.3E106 L107 A108 E112 E113 N114E106-L110 HydrophobicContact CG-CD1 4.29Å; E106-L110 WeakPolarHBondContact O-CG 3.47Å; E106-L110 PolarHBondContact O-N 3.24Å; L107-L110 PolarHBondContact O-N 3.46Å; A108-L110 PolarHBondContact O-N 2.83Å; L110-E112 VanDerWaalsContact C-N 3.34Å; L110-E113 PolarHBondContact O-N 3.42Å; L110-N114 WeakPolarHBondContact O-CB 3.09Å; L110-N114 PolarHBondContact O-N 3.46Å
111H98.6Very high98.4Very high135 Ų135106.5 Ų106.563%0.62551%0.507SS*.Hα-helixtrans-62.1-42.6174-92.7-68.5000111.8L107 A108 N114 N115L107-H111 WeakPolarHBondContact O-CB 3.35Å; L107-H111 PolarHBondContact O-CD2 2.92Å; L107-H111 VanDerWaalsContact O-CD2 3.27Å; L107-H111 PolarHBondContact O-N 2.86Å; A108-H111 PolarHBondContact O-N 3.36Å; H111-N114 PolarHBondContact O-N 3.46Å; H111-N115 PolarHBondContact O-N 2.95Å
112E98.4Very high98.3Very high119 Ų119108.1 Ų108.156%0.55651%0.514SS*.Hα-helixtrans-61.9-48175.1179.6171.2-154.900111.5A108 R109 L110 N114 N115 H116A108-E112 PolarHBondContact O-N 3.2Å; R109-E112 PolarHBondContact O-N 3.25Å; L110-E112 VanDerWaalsContact C-N 3.34Å; E112-N114 VanDerWaalsContact C-N 3.34Å; E112-N114 PolarHBondContact O-N 3.39Å; E112-N115 WeakPolarHBondContact O-CB 3.44Å; E112-N115 PolarHBondContact O-N 3.39Å; E112-N115 VanDerWaalsContact O-N 3.15Å; E112-H116 WeakPolarHBondContact CG-CE1 3.36Å; E112-H116 WeakPolarHBondContact CG-ND1 3.43Å; E112-H116 PolarHBondContact O-N 2.86Å; E112-H116 PolarHBondContact O-ND1 2.9Å; E112-H116 IonicContact OE1-CE1 2.75Å
113E98.4Very high98.2Very high107 Ų107105 Ų10550%0.551%0.505SS..Hα-helixtrans-60.9-42.2176.4-173.1-180172.200111.8R109 L110 N115 H116 L117R109-E113 PolarHBondContact O-N 3.48Å; L110-E113 PolarHBondContact O-N 3.42Å; E113-N115 VanDerWaalsContact C-N 3.25Å; E113-N115 PolarHBondContact O-N 3.47Å; E113-H116 WeakPolarHBondContact O-CB 3.26Å; E113-H116 PolarHBondContact O-N 2.95Å; E113-H116 VanDerWaalsContact O-N 3.14Å; E113-L117 HydrophobicContact CG-CD1 4.37Å; E113-L117 WeakPolarHBondContact O-CG 3.47Å; E113-L117 PolarHBondContact O-N 2.83Å
114N98.5Very high98Very high74 Ų74102.5 Ų102.540%0.39650%0.498SS..Hα-helixtrans-59.8-39.3176.1-162.6-92.8000111.5L110 H111 E112 L117 R118L110-N114 WeakPolarHBondContact O-CB 3.09Å; L110-N114 PolarHBondContact O-N 3.46Å; H111-N114 PolarHBondContact O-N 3.46Å; E112-N114 VanDerWaalsContact C-N 3.34Å; E112-N114 PolarHBondContact O-N 3.39Å; N114-L117 PolarHBondContact O-N 3.18Å; N114-R118 VanDerWaalsContact O-CG 3.28Å; N114-R118 WeakPolarHBondContact O-CG 3.24Å; N114-R118 PolarHBondContact O-N 2.91Å; N114-R118 PolarHBondContact OD1-NE 2.93Å; N114-R118 PolarHBondContact OD1-NH2 2.91Å
115N98.5Very high97.9Very high84 Ų84101.7 Ų101.745%0.44950%0.497SS..Hα-helixtrans-65.5-44.8175-167.523.5000111.5H111 E112 E113 L117 R118 Q119H111-N115 PolarHBondContact O-N 2.95Å; E112-N115 WeakPolarHBondContact O-CB 3.44Å; E112-N115 PolarHBondContact O-N 3.39Å; E112-N115 VanDerWaalsContact O-N 3.15Å; E113-N115 VanDerWaalsContact C-N 3.25Å; E113-N115 PolarHBondContact O-N 3.47Å; N115-L117 VanDerWaalsContact C-N 3.33Å; N115-L117 PolarHBondContact O-N 3.49Å; N115-R118 WeakPolarHBondContact O-CB 3.27Å; N115-R118 PolarHBondContact O-N 2.94Å; N115-Q119 WeakPolarHBondContact O-CG 3.36Å; N115-Q119 PolarHBondContact O-N 2.98Å
116H98.3Very high97.7Very high101 Ų10199.7 Ų99.747%0.46849%0.493SS..Hα-helixtrans-58.3-43.6174.8-74.894.4000112.1E112 E113 R118 Q119 Y120E112-H116 WeakPolarHBondContact CG-CE1 3.36Å; E112-H116 WeakPolarHBondContact CG-ND1 3.43Å; E112-H116 PolarHBondContact O-N 2.86Å; E112-H116 PolarHBondContact O-ND1 2.9Å; E112-H116 IonicContact OE1-CE1 2.75Å; E113-H116 WeakPolarHBondContact O-CB 3.26Å; E113-H116 PolarHBondContact O-N 2.95Å; E113-H116 VanDerWaalsContact O-N 3.14Å; H116-R118 PolarHBondContact O-N 2.88Å; H116-Q119 PolarHBondContact O-N 3.22Å; H116-Y120 WeakPolarHBondContact O-CB 3.36Å; H116-Y120 PolarHBondContact O-N 3.06Å
117L98.5Very high97.5Very high97 Ų97102.8 Ų102.851%0.50851%0.506SS..Hα-helixtrans-63.8-40.8176.8-71173.2000112.1E113 N114 N115 Y120 L121E113-L117 HydrophobicContact CG-CD1 4.37Å; E113-L117 WeakPolarHBondContact O-CG 3.47Å; E113-L117 PolarHBondContact O-N 2.83Å; N114-L117 PolarHBondContact O-N 3.18Å; N115-L117 VanDerWaalsContact C-N 3.33Å; N115-L117 PolarHBondContact O-N 3.49Å; L117-Y120 PolarHBondContact O-N 3.5Å; L117-L121 WeakPolarHBondContact O-CB 3.39Å; L117-L121 PolarHBondContact O-N 3.44Å
118R97.8Very high97.2Very high155 Ų155101.2 Ų101.259%0.58550%0.502SS*.Hα-helixtrans-62.3-44.8174.1-73169.9-175.6-99.70.6111.5N114 N115 H116 L121 N122N114-R118 VanDerWaalsContact O-CG 3.28Å; N114-R118 WeakPolarHBondContact O-CG 3.24Å; N114-R118 PolarHBondContact O-N 2.91Å; N114-R118 PolarHBondContact OD1-NE 2.93Å; N114-R118 PolarHBondContact OD1-NH2 2.91Å; N115-R118 WeakPolarHBondContact O-CB 3.27Å; N115-R118 PolarHBondContact O-N 2.94Å; H116-R118 PolarHBondContact O-N 2.88Å; R118-L121 PolarHBondContact O-N 2.87Å; R118-N122 WeakPolarHBondContact O-CB 3.28Å; R118-N122 VanDerWaalsContact O-CG 3.23Å; R118-N122 PolarHBondContact O-N 3.15Å; R118-N122 PolarHBondContact O-ND2 3.18Å
119Q97.9Very high96.9Very high107 Ų107103.1 Ų103.150%0.550%0.504SS..Hα-helixtrans-62.6-42.9176.3-70.31777.400111.6N115 H116 N122 S123N115-Q119 WeakPolarHBondContact O-CG 3.36Å; N115-Q119 PolarHBondContact O-N 2.98Å; H116-Q119 PolarHBondContact O-N 3.22Å; Q119-N122 PolarHBondContact O-N 3.4Å; Q119-S123 VanDerWaalsContact O-CB 3.25Å; Q119-S123 WeakPolarHBondContact O-CB 3.41Å; Q119-S123 PolarHBondContact O-N 2.92Å
120Y97.9Very high96.6Very high161 Ų161100.6 Ų100.663%0.63150%0.498SS*.Hα-helixtrans-61.4-46.8175.8178-97.8000111.8H116 L117 N122 S123 T124H116-Y120 WeakPolarHBondContact O-CB 3.36Å; H116-Y120 PolarHBondContact O-N 3.06Å; L117-Y120 PolarHBondContact O-N 3.5Å; Y120-N122 PolarHBondContact O-N 2.93Å; Y120-S123 PolarHBondContact O-N 2.88Å; Y120-T124 HydrophobicContact CD1-CG2 4.15Å; Y120-T124 HydrophobicContact CD2-CG2 4.18Å; Y120-T124 HydrophobicContact CE1-CG2 3.71Å; Y120-T124 HydrophobicContact CE2-CG2 3.76Å; Y120-T124 HydrophobicContact CG-CG2 4.37Å; Y120-T124 WeakPolarHBondContact O-CB 3.48Å; Y120-T124 VanDerWaalsContact O-CG2 3.32Å; Y120-T124 WeakPolarHBondContact O-CG2 3.39Å; Y120-T124 PolarHBondContact O-N 3.36Å; Y120-T124 PolarHBondContact O-OG1 2.83Å
121L97.4Very high96.3Very high110 Ų110101 Ų10158%0.57650%0.498SS*.Hα-helixtrans-61.8-45177.6-17863.8000111.6L117 R118 T124 L125L117-L121 WeakPolarHBondContact O-CB 3.39Å; L117-L121 PolarHBondContact O-N 3.44Å; R118-L121 PolarHBondContact O-N 2.87Å; L121-T124 WeakPolarHBondContact CA-OG1 3.28Å; L121-T124 PolarHBondContact O-N 2.82Å; L121-T124 PolarHBondContact O-OG1 3.32Å; L121-L125 VanDerWaalsContact O-CB 3.24Å; L121-L125 WeakPolarHBondContact O-CB 3.39Å; L121-L125 PolarHBondContact O-N 2.85Å
122N96.4Very high96Very high100 Ų100100.8 Ų100.854%0.53550%0.495SS..Hα-helixtrans-62.6-45.1177-72.8-27.1000111.2R118 Q119 Y120 L125 V126R118-N122 WeakPolarHBondContact O-CB 3.28Å; R118-N122 VanDerWaalsContact O-CG 3.23Å; R118-N122 PolarHBondContact O-N 3.15Å; R118-N122 PolarHBondContact O-ND2 3.18Å; Q119-N122 PolarHBondContact O-N 3.4Å; Y120-N122 PolarHBondContact O-N 2.93Å; N122-L125 PolarHBondContact O-N 3.21Å; N122-V126 WeakPolarHBondContact O-CB 3.06Å; N122-V126 WeakPolarHBondContact O-CG2 3.4Å; N122-V126 PolarHBondContact O-N 3.47Å
123S96.4Very high95.7Very high54 Ų5497.3 Ų97.338%0.37849%0.486SS..Hα-helixtrans-62.9-45.1178.2-175.50000112.2Q119 Y120 V126 K127Q119-S123 VanDerWaalsContact O-CB 3.25Å; Q119-S123 WeakPolarHBondContact O-CB 3.41Å; Q119-S123 PolarHBondContact O-N 2.92Å; Y120-S123 PolarHBondContact O-N 2.88Å; S123-V126 PolarHBondContact O-N 3.49Å; S123-K127 WeakPolarHBondContact O-CB 3.37Å; S123-K127 VanDerWaalsContact O-CG 3.29Å; S123-K127 WeakPolarHBondContact O-CG 3.25Å; S123-K127 PolarHBondContact O-N 2.72Å
124T95.3Very high95.4Very high49 Ų4996.5 Ų96.530%0.30148%0.481SS..Hα-helixtrans-67.2-41.3178.550.10000112.3Y120 L121 K127 C128Y120-T124 HydrophobicContact CD1-CG2 4.15Å; Y120-T124 HydrophobicContact CD2-CG2 4.18Å; Y120-T124 HydrophobicContact CE1-CG2 3.71Å; Y120-T124 HydrophobicContact CE2-CG2 3.76Å; Y120-T124 HydrophobicContact CG-CG2 4.37Å; Y120-T124 WeakPolarHBondContact O-CB 3.48Å; Y120-T124 VanDerWaalsContact O-CG2 3.32Å; Y120-T124 WeakPolarHBondContact O-CG2 3.39Å; Y120-T124 PolarHBondContact O-N 3.36Å; Y120-T124 PolarHBondContact O-OG1 2.83Å; L121-T124 WeakPolarHBondContact CA-OG1 3.28Å; L121-T124 PolarHBondContact O-N 2.82Å; L121-T124 PolarHBondContact O-OG1 3.32Å; T124-K127 PolarHBondContact O-N 3.16Å; T124-C128 WeakPolarHBondContact O-CB 3.32Å; T124-C128 PolarHBondContact O-N 3.33Å
125L95.7Very high95.1Very high92 Ų92100 Ų10048%0.48249%0.493SS..Hα-helixtrans-61.9-49.3174.7178.362.6000111.2L121 N122 K127 C128 L129L121-L125 VanDerWaalsContact O-CB 3.24Å; L121-L125 WeakPolarHBondContact O-CB 3.39Å; L121-L125 PolarHBondContact O-N 2.85Å; N122-L125 PolarHBondContact O-N 3.21Å; L125-K127 PolarHBondContact O-N 3.01Å; L125-C128 PolarHBondContact O-N 3.01Å; L125-L129 HydrophobicContact CD1-CD1 4.19Å; L125-L129 HydrophobicContact CD1-CG 4.22Å; L125-L129 HydrophobicContact CG-CD1 4.08Å; L125-L129 HydrophobicContact CG-CG 4.49Å; L125-L129 WeakPolarHBondContact O-CG 3.29Å; L125-L129 PolarHBondContact O-N 3.29Å
126V94.6Very high94.7Very high89 Ų89101.8 Ų101.854%0.53950%0.502SS..Hα-helixtrans-58.9-48.1178.4169.30000110.5N122 S123 C128 L129 E130N122-V126 WeakPolarHBondContact O-CB 3.06Å; N122-V126 WeakPolarHBondContact O-CG2 3.4Å; N122-V126 PolarHBondContact O-N 3.47Å; S123-V126 PolarHBondContact O-N 3.49Å; V126-C128 VanDerWaalsContact C-N 3.33Å; V126-C128 PolarHBondContact O-N 3.46Å; V126-L129 PolarHBondContact O-N 3.2Å; V126-E130 WeakPolarHBondContact O-CB 3.19Å; V126-E130 PolarHBondContact O-N 3.41Å
127K95.1Very high93.8Very high132 Ų132104.4 Ų104.457%0.57452%0.518SS*.Hα-helixtrans-58.6-43.1175.6-75.6176.8-179.4178.80112.2S123 T124 L125 E130 E131S123-K127 WeakPolarHBondContact O-CB 3.37Å; S123-K127 VanDerWaalsContact O-CG 3.29Å; S123-K127 WeakPolarHBondContact O-CG 3.25Å; S123-K127 PolarHBondContact O-N 2.72Å; T124-K127 PolarHBondContact O-N 3.16Å; L125-K127 PolarHBondContact O-N 3.01Å; K127-E130 PolarHBondContact O-N 3Å; K127-E131 WeakPolarHBondContact O-CB 3.42Å; K127-E131 WeakPolarHBondContact O-CG 3.4Å; K127-E131 PolarHBondContact O-N 3.15Å
128C92.3Very high92.8Very high65 Ų65104.6 Ų104.644%0.43953%0.528SS..Hα-helixtrans-63.7-42.7178.2-172.60000112.1T124 L125 V126 K132T124-C128 WeakPolarHBondContact O-CB 3.32Å; T124-C128 PolarHBondContact O-N 3.33Å; L125-C128 PolarHBondContact O-N 3.01Å; V126-C128 VanDerWaalsContact C-N 3.33Å; V126-C128 PolarHBondContact O-N 3.46Å; C128-K132 WeakPolarHBondContact O-CB 3.41Å; C128-K132 WeakPolarHBondContact O-CG 3.47Å; C128-K132 PolarHBondContact O-N 2.9Å
129L92.4Very high91.4Very high103 Ų10398.7 Ų98.754%0.53951%0.511SS..Hα-helixtrans-65.2-42.1176.7-70.5175000111.5L125 V126 K132 A133L125-L129 HydrophobicContact CD1-CD1 4.19Å; L125-L129 HydrophobicContact CD1-CG 4.22Å; L125-L129 HydrophobicContact CG-CD1 4.08Å; L125-L129 HydrophobicContact CG-CG 4.49Å; L125-L129 WeakPolarHBondContact O-CG 3.29Å; L125-L129 PolarHBondContact O-N 3.29Å; V126-L129 PolarHBondContact O-N 3.2Å; L129-K132 PolarHBondContact O-N 3.14Å; L129-A133 WeakPolarHBondContact O-CB 3.39Å; L129-A133 PolarHBondContact O-N 2.94Å
130E91.6Very high89.4Confident96 Ų9697.9 Ų97.945%0.44951%0.509SS..Hα-helixtrans-61.8-46.4176.7-167.9-170.2152.900111.3V126 K127 K132 A133 K134V126-E130 WeakPolarHBondContact O-CB 3.19Å; V126-E130 PolarHBondContact O-N 3.41Å; K127-E130 PolarHBondContact O-N 3Å; E130-K132 VanDerWaalsContact C-N 3.35Å; E130-K132 PolarHBondContact O-N 2.83Å; E130-A133 PolarHBondContact O-N 3.22Å; E130-K134 WeakPolarHBondContact O-CG 3.35Å; E130-K134 PolarHBondContact O-N 3.4Å; E130-K134 WeakPolarHBondContact OE1-CE 3.45Å; E130-K134 IonicContact OE1-NZ 2.76Å; E130-K134 PolarHBondContact OE1-NZ 3.43Å
131E92.6Very high87.5Confident91 Ų9197.6 Ų97.643%0.42551%0.514SS..Hα-helixtrans-64.8-37.8176.5-72.1-55.8122.800112.3K127 K134 K135K127-E131 WeakPolarHBondContact O-CB 3.42Å; K127-E131 WeakPolarHBondContact O-CG 3.4Å; K127-E131 PolarHBondContact O-N 3.15Å; E131-K134 PolarHBondContact O-N 3.5Å; E131-K134 WeakPolarHBondContact OE1-CD 3.34Å; E131-K134 IonicContact OE1-NZ 2.72Å; E131-K134 PolarHBondContact OE1-NZ 2.87Å; E131-K135 WeakPolarHBondContact O-CB 3.43Å; E131-K135 VanDerWaalsContact O-CG 3.27Å; E131-K135 WeakPolarHBondContact O-CG 3.39Å; E131-K135 PolarHBondContact O-N 2.88Å
132K92.9Very high85.4Confident131 Ų13198.8 Ų98.857%0.5752%0.515SS*.Hα-helixtrans-63.9-42.7172.1-79.4-175.3173.5-179.70111.6C128 L129 E130 K135 L136C128-K132 WeakPolarHBondContact O-CB 3.41Å; C128-K132 WeakPolarHBondContact O-CG 3.47Å; C128-K132 PolarHBondContact O-N 2.9Å; L129-K132 PolarHBondContact O-N 3.14Å; E130-K132 VanDerWaalsContact C-N 3.35Å; E130-K132 PolarHBondContact O-N 2.83Å; K132-K135 PolarHBondContact O-N 3.49Å; K132-L136 WeakPolarHBondContact O-CG 3.39Å; K132-L136 PolarHBondContact O-N 3.34Å
133A90.9Very high83.4Confident45 Ų4597.8 Ų97.837%0.37252%0.516SS..Hα-helixtrans-63.4-45.2176.300000111.5L129 E130 K135 L136 L137L129-A133 WeakPolarHBondContact O-CB 3.39Å; L129-A133 PolarHBondContact O-N 2.94Å; E130-A133 PolarHBondContact O-N 3.22Å; A133-K135 VanDerWaalsContact C-N 3.34Å; A133-K135 PolarHBondContact O-N 3.02Å; A133-L136 PolarHBondContact O-N 2.93Å; A133-L137 WeakPolarHBondContact O-CB 3.45Å; A133-L137 VanDerWaalsContact O-CG 3.26Å; A133-L137 WeakPolarHBondContact O-CG 3.36Å; A133-L137 PolarHBondContact O-N 3.46Å
134K92.4Very high81.5Confident91 Ų91102 Ų10240%0.39653%0.527SS..Hα-helixtrans-58.3-43.5173.7-73172.5-173.31600112E130 E131 L137 S138E130-K134 WeakPolarHBondContact O-CG 3.35Å; E130-K134 PolarHBondContact O-N 3.4Å; E130-K134 WeakPolarHBondContact OE1-CE 3.45Å; E130-K134 IonicContact OE1-NZ 2.76Å; E130-K134 PolarHBondContact OE1-NZ 3.43Å; E131-K134 PolarHBondContact O-N 3.5Å; E131-K134 WeakPolarHBondContact OE1-CD 3.34Å; E131-K134 IonicContact OE1-NZ 2.72Å; E131-K134 PolarHBondContact OE1-NZ 2.87Å; K134-L137 PolarHBondContact O-N 3.27Å; K134-S138 WeakPolarHBondContact O-CB 3.31Å; K134-S138 PolarHBondContact O-N 2.86Å
135K92.6Very high79.3Confident148 Ų148105 Ų10564%0.64355%0.546SS*.Hα-helixtrans-62.3-41.5175.5-75.3174.6-177.3-175.90112.3E131 K132 A133 S139E131-K135 WeakPolarHBondContact O-CB 3.43Å; E131-K135 VanDerWaalsContact O-CG 3.27Å; E131-K135 WeakPolarHBondContact O-CG 3.39Å; E131-K135 PolarHBondContact O-N 2.88Å; K132-K135 PolarHBondContact O-N 3.49Å; A133-K135 VanDerWaalsContact C-N 3.34Å; A133-K135 PolarHBondContact O-N 3.02Å; K135-S139 VanDerWaalsContact O-CB 3.25Å; K135-S139 WeakPolarHBondContact O-CB 3.49Å; K135-S139 PolarHBondContact O-N 3.12Å
136L88.9Confident77.1Confident120 Ų120105.1 Ų105.163%0.62855%0.553SS**Hα-helixtrans-66.6-37.9176.3-70.7174.1000112.5K132 A133K132-L136 WeakPolarHBondContact O-CG 3.39Å; K132-L136 PolarHBondContact O-N 3.34Å; A133-L136 PolarHBondContact O-N 2.93Å
137L81.2Confident74.8Confident156 Ų156103.8 Ų103.882%0.81756%0.557SS**Hα-helixtrans-78.6-29.8179.7-67.2169.8000113.1A133 K134A133-L137 WeakPolarHBondContact O-CB 3.45Å; A133-L137 VanDerWaalsContact O-CG 3.26Å; A133-L137 WeakPolarHBondContact O-CG 3.36Å; A133-L137 PolarHBondContact O-N 3.46Å; K134-L137 PolarHBondContact O-N 3.27Å
138S76.4Confident72.7Confident102 Ų102106 Ų10671%0.71357%0.567SS**Hα-helixtrans-85.7-20.1178.4-175.40000113K134 D140K134-S138 WeakPolarHBondContact O-CB 3.31Å; K134-S138 PolarHBondContact O-N 2.86Å; S138-D140 PolarHBondContact O-N 3.47Å
139S68.9Low70.8Confident31 Ų31110.2 Ų110.222%0.21758%0.584CS.*  trans-71.490.3173.1-178.10000110.6K135 E141 F142K135-S139 VanDerWaalsContact O-CB 3.25Å; K135-S139 WeakPolarHBondContact O-CB 3.49Å; K135-S139 PolarHBondContact O-N 3.12Å; S139-E141 PolarHBondContact O-N 3.31Å; S139-F142 PolarHBondContact O-N 3.29Å; S139-F142 WeakPolarHBondContact OG-CD2 3.44Å; S139-F142 VanDerWaalsContact OG-CE2 3.23Å; S139-F142 WeakPolarHBondContact OG-CE2 3.28Å
140D54.9Low69.1Low89 Ų89116.3 Ų116.348%0.47660%0.6SS.*Hα-helixtrans-56.7-7.5171.3-176.744.4000113.6S138 K144S138-D140 PolarHBondContact O-N 3.47Å; D140-K144 WeakPolarHBondContact OD2-CE 3.47Å; D140-K144 IonicContact OD2-NZ 2.7Å; D140-K144 PolarHBondContact OD2-NZ 3.02Å
141E58.6Low67.4Low155 Ų155121.3 Ų121.372%0.72462%0.62SS**Hα-helixtrans-74.2-26.1178.9-73.4166.3142.300113.1S139S139-E141 PolarHBondContact O-N 3.31Å
142F53.5Low65.1Low135 Ų135126.2 Ų126.259%0.59264%0.643SS**Hα-helixtrans-88.9-24.1178.4-57.8-76.4000113.6S139 C146S139-F142 PolarHBondContact O-N 3.29Å; S139-F142 WeakPolarHBondContact OG-CD2 3.44Å; S139-F142 VanDerWaalsContact OG-CE2 3.23Å; S139-F142 WeakPolarHBondContact OG-CE2 3.28Å; F142-C146 PolarHBondContact O-N 3.41Å
143S54.8Low63.2Low80 Ų80128.7 Ų128.756%0.55965%0.654SS**Hα-helixtrans-66.3-39.3176.8173.50000112.1V145 G147S143-V145 PolarHBondContact O-N 3.32Å; S143-G147 PolarHBondContact O-N 2.76Å
144K55.4Low61.3Low141 Ų141136.7 Ų136.761%0.61367%0.674SS**Hα-helixtrans-73.9-23-177.6-69.6177.4-173.3156.80114.2D140D140-K144 WeakPolarHBondContact OD2-CE 3.47Å; D140-K144 IonicContact OD2-NZ 2.7Å; D140-K144 PolarHBondContact OD2-NZ 3.02Å
145V49.9Very low59.1Low114 Ų114141.7 Ų141.769%0.69170%0.696SS**Hα-helixtrans-86.1-36.2178.8178.30000111.8S143S143-V145 PolarHBondContact O-N 3.32Å
146C48.3Very low56.5Low93 Ų93140.8 Ų140.863%0.62871%0.705SS**Hα-helixtrans-83.7-25.1-179.4-162.60000113.6F142 K148 L149F142-C146 PolarHBondContact O-N 3.41Å; C146-K148 PolarHBondContact O-N 3.41Å; C146-K148 VanDerWaalsContact O-N 3.14Å; C146-L149 PolarHBondContact O-N 2.99Å
147G47.1Very low53.8Low61 Ų61145 Ų14563%0.62972%0.718SS**THydrogen-bonded Turntrans-65.5-12.2176.400000115.2S143S143-G147 PolarHBondContact O-N 2.76Å
148K50.8Low51.7Low179 Ų179145.8 Ų145.878%0.77872%0.718SS**THydrogen-bonded Turntrans-84.2-11.9-177.8-76.8-87.2-173.4172.30114.7C146C146-K148 PolarHBondContact O-N 3.41Å; C146-K148 VanDerWaalsContact O-N 3.14Å
149L53.5Low49.5Very low153 Ų153148.1 Ų148.180%0.80172%0.717SS**SBendtrans-97.2-0.2-173.8-68175.4000115.3C146C146-L149 PolarHBondContact O-N 2.99Å
150R55.6Low47.9Very low232 Ų232155.6 Ų155.688%0.87574%0.741SS**SBendtrans-118.233.5-178.7-72.6-151.9-167.5-169.57.1115
151K56.5Low46.8Very low200 Ų200159.3 Ų159.387%0.8776%0.755SS**  trans-147.378.5161.9-70.5-152.7178.4-164.40112.8
152E43.1Very low45.7Very low194 Ų194157.3 Ų157.391%0.90776%0.758SS**  trans-155.298.3144.7-152.3158.5-177.100112
153K54Low45.5Very low184 Ų184156.9 Ų156.980%0.877%0.769SS**  trans-96108.8163.4-148.2-171.7-169.2-178.80105.3
154R51.3Low44.4Very low213 Ų213158.1 Ų158.180%0.80478%0.784SS**  trans148.2117.7136.7-78.1167.8-172.6121.8-5.6114.7
155K46.5Very low43.3Very low195 Ų195160 Ų16085%0.84880%0.795SS**  trans69.6133.2147-58.7-66.3-178.2177.60120.4
156P37Very low42.6Very low129 Ų129162.3 Ų162.384%0.83880%0.801SS**  trans-87.6129.517133.5-27.6000110.7
157K33Very low42.3Very low208 Ų208163.1 Ų163.190%0.90481%0.806SS**  trans-128.1113.8159.9-165.9163.4-178174.10108.5
158E35.7Very low42Very low173 Ų173169.5 Ų169.581%0.80882%0.819SS**  trans-66.7123.2175.1-173.7177.7-164.300109.8
159H31.6Very low41.3Very low152 Ų152166 Ų16670%0.70482%0.817SS**  trans-174.6116138.8-107.1-64.7000112.7
160R34.3Very low41.2Very low187 Ų187168.8 Ų168.871%0.70682%0.823SS**  trans14.9133.2150.1-53.1-174.8-155.3175.46.4120.2
161H31.4Very low40.8Very low168 Ų168163.6 Ų163.678%0.77882%0.817SS**  151.1119.7111.5-74.3-65.2000110.5
162S36.4Very low40Very low113 Ų113158.9 Ų158.979%0.7982%0.816SS**  trans-89.3-179.6164.541.20000109.9
163P48.8Very low40.4Very low126 Ų126158.4 Ų158.482%0.81881%0.81SS**  cis-138172.52.940-21.3000115.4
164A32.3Very low40.3Very low105 Ų105159 Ų15987%0.86881%0.807SS**  trans-162.2137.6152.400000112.4
165E31.6Very low39.9Very low181 Ų181154.6 Ų154.685%0.84680%0.8SS**  trans-73174.5-172.9-71171.2121.700116
166I36.8Very low39.9Very low162 Ų162150 Ų15083%0.83179%0.785SS**  trans107.7143.5155.3-50.9153.7000114.3
167P42Very low40.6Very low110 Ų110148 Ų14871%0.71477%0.773SS**  cis-123.2152-43.330.3-11.7000113.1S169P167-S169 PolarHBondContact O-N 3.41Å; P167-S169 VanDerWaalsContact O-N 3.14Å
168Q40.3Very low41.1Very low196 Ų196142.8 Ų142.892%0.91676%0.759SS**  trans-67105171.9-66-93.6-3400111.1K170Q168-K170 PolarHBondContact O-N 2.78Å
169S36Very low41.5Very low106 Ų106142 Ų14274%0.74176%0.755SS**  trans-82.1115.3168.550.70000110.3P167 T171P167-S169 PolarHBondContact O-N 3.41Å; P167-S169 VanDerWaalsContact O-N 3.14Å; S169-T171 PolarHBondContact O-N 3Å
170K51.4Low42Very low211 Ų211143.5 Ų143.592%0.91776%0.76SS**  trans-61.4108.8176.6-64.1170.1-180175.70109.8Q168Q168-K170 PolarHBondContact O-N 2.78Å
171T45.9Very low42.4Very low122 Ų122138.7 Ų138.775%0.74876%0.755SS**  trans-94.9120.2164.249.50000108.9S169 K173S169-T171 PolarHBondContact O-N 3Å; T171-K173 PolarHBondContact O-N 3.06Å; T171-K173 VanDerWaalsContact O-N 3.09Å
172A39.8Very low42.6Very low102 Ų102137.6 Ų137.684%0.84376%0.755SS**  trans-64.3106.317600000109.5R174A172-R174 PolarHBondContact O-N 3.34Å; A172-R174 VanDerWaalsContact O-N 3.08Å
173K52.5Low42.8Very low183 Ų183138.3 Ų138.380%0.79676%0.759SS**  trans-68.999.6167.4-70.6-178.9175.3-179.90108.2T171 N175T171-K173 PolarHBondContact O-N 3.06Å; T171-K173 VanDerWaalsContact O-N 3.09Å; K173-N175 PolarHBondContact O-N 3.16Å
174R50.7Low42.7Very low196 Ų196140.6 Ų140.674%0.7476%0.758SS**  trans-73.7103.8163.665.9-171.8-149.2102.75.2108A172 L176A172-R174 PolarHBondContact O-N 3.34Å; A172-R174 VanDerWaalsContact O-N 3.08Å; R174-L176 PolarHBondContact O-N 2.88Å
175N44.5Very low43.4Very low121 Ų121144.2 Ų144.265%0.64776%0.757SS**  trans-74.3120173-64.9-55.8000108.3K173 S177K173-N175 PolarHBondContact O-N 3.16Å; N175-S177 VanDerWaalsContact C-N 3.28Å
176L46.2Very low43.7Very low100 Ų100144.7 Ų144.752%0.52476%0.76SS.*  trans-91.118.9174-72.4172.2000112.5R174R174-L176 PolarHBondContact O-N 2.88Å
177S50.7Low44.1Very low85 Ų85143.6 Ų143.659%0.59476%0.761SS**  trans-86-5.9-175.752.20000114.5N175N175-S177 VanDerWaalsContact C-N 3.28Å
178T45.1Very low44.4Very low99 Ų99140.9 Ų140.961%0.60775%0.753SS**SBendtrans-92.1-17.5-173.6-340000113.8F180T178-F180 VanDerWaalsContact C-N 3.33Å; T178-F180 PolarHBondContact O-N 3.17Å
179E44.2Very low44.9Very low157 Ų157137.5 Ų137.573%0.73475%0.748SS**THydrogen-bonded Turntrans-79-12.3-175.5-71.1-171.9-179.400114.3
180F40.3Very low45.6Very low184 Ų184137.8 Ų137.881%0.80775%0.748SS**THydrogen-bonded Turntrans-96.12.6-179.7-66.6-75.2000114.6T178T178-F180 VanDerWaalsContact C-N 3.33Å; T178-F180 PolarHBondContact O-N 3.17Å
181S44.1Very low45.9Very low85 Ų85131.6 Ų131.659%0.59473%0.728SS**SBendtrans-101.20.2-175.9-57.90000115.4
182N34.8Very low46.9Very low146 Ų146130.4 Ų130.478%0.78172%0.717SS**THydrogen-bonded Turntrans-97.914.9-175.2-73.8-14.1000115.2
183C41.2Very low48Very low128 Ų128130 Ų13087%0.86571%0.706SS**THydrogen-bonded Turntrans-111.418.1176.3-650000113.7
184Q46.8Very low48.5Very low174 Ų174129.1 Ų129.181%0.81370%0.698SS**SBendtrans-117.947.3-179.6-16788.926.600111.4
185E45.7Very low49.3Very low180 Ų180121.6 Ų121.684%0.84167%0.674SS**  trans-163.667.5162.7-140.4168.9-179.700111
186Q38Very low50.4Low192 Ų192117.3 Ų117.390%0.89765%0.65SS**  trans-125.793.7162-74.8-94.619.500106G188Q186-G188 VanDerWaalsContact C-N 3.34Å; Q186-G188 PolarHBondContact O-N 3.03Å
187T46.9Very low51.1Low139 Ų139120.3 Ų120.385%0.85366%0.662SS**  trans-57.896.6172.1-14.50000107.8
188G47Very low51.4Low53 Ų53121.3 Ų121.355%0.54666%0.664SS.*  trans-62.5159.6172.800000110.9Q186 C190Q186-G188 VanDerWaalsContact C-N 3.34Å; Q186-G188 PolarHBondContact O-N 3.03Å; G188-C190 PolarHBondContact O-N 2.99Å; G188-C190 VanDerWaalsContact O-N 3.14Å
189P50.9Low51.9Low125 Ų125121.6 Ų121.681%0.81266%0.661SS**  trans-57.3122.5178.923.3-31.3000109.6V191P189-V191 PolarHBondContact O-N 3.29Å
190C51.3Low52.6Low111 Ų111117.2 Ų117.275%0.7566%0.659SS**  trans-56.7107.9177.2-178.10000108.5G188G188-C190 PolarHBondContact O-N 2.99Å; G188-C190 VanDerWaalsContact O-N 3.14Å
191V58.4Low53.4Low81 Ų81113.3 Ų113.349%0.49165%0.646SS.*  trans-73.4131.9172.8179.40000107.2P189 V195 L196P189-V191 PolarHBondContact O-N 3.29Å; V191-V195 HydrophobicContact CG1-CB 4.12Å; V191-V195 HydrophobicContact CG1-CG1 4.12Å; V191-L196 HydrophobicContact CG1-CD2 4.38Å; V191-L196 HydrophobicContact CG1-CG 4.4Å
192D66.9Low54.2Low98 Ų98117.8 Ų117.852%0.52466%0.655SS.*  trans-54.8132.9-173.9-74.1-46.4000112.1W194 V195 L196D192-W194 VanDerWaalsContact CB-CD1 3.49Å; D192-W194 PolarHBondContact O-N 3.4Å; D192-V195 HydrophobicContact CB-CG2 4.22Å; D192-V195 WeakPolarHBondContact O-CB 3.48Å; D192-V195 PolarHBondContact O-N 2.92Å; D192-L196 PolarHBondContact O-N 3.4Å
193P61.4Low55.2Low94 Ų94114 Ų11461%0.6164%0.635SS**Hα-helixtrans-56.3-28.4-174.1-2934.9000115.1L196 Q197P193-L196 PolarHBondContact O-N 3.49Å; P193-Q197 WeakPolarHBondContact O-CB 3.47Å; P193-Q197 PolarHBondContact O-N 3.08Å
194W62.5Low55.8Low163 Ų163114.5 Ų114.562%0.61763%0.628SS**Hα-helixtrans-71.4-30.1178.274.9-91.8000112.6D192 Q197 T198D192-W194 VanDerWaalsContact CB-CD1 3.49Å; D192-W194 PolarHBondContact O-N 3.4Å; W194-Q197 PolarHBondContact O-N 3.41Å; W194-T198 WeakPolarHBondContact O-CB 3.35Å; W194-T198 PolarHBondContact O-N 3.22Å; W194-T198 PolarHBondContact O-OG1 3.02Å
195V68.3Low56.1Low39 Ų39112.8 Ų112.824%0.23662%0.624CS.*Hα-helixtrans-68.5-43.9175.7177.70000109.3V191 D192 T198 L199V191-V195 HydrophobicContact CG1-CB 4.12Å; V191-V195 HydrophobicContact CG1-CG1 4.12Å; D192-V195 HydrophobicContact CB-CG2 4.22Å; D192-V195 WeakPolarHBondContact O-CB 3.48Å; D192-V195 PolarHBondContact O-N 2.92Å; V195-T198 PolarHBondContact O-N 2.92Å; V195-L199 HydrophobicContact CG1-CD1 3.78Å; V195-L199 HydrophobicContact CG1-CG 4.5Å; V195-L199 WeakPolarHBondContact O-CB 3.28Å; V195-L199 WeakPolarHBondContact O-CG 3.39Å; V195-L199 PolarHBondContact O-N 3.39Å
196L68.1Low56.4Low31 Ų31108.6 Ų108.616%0.16261%0.611CS.*Hα-helixtrans-61.5-45.5175-63.9176.9000110.9V191 D192 P193 L199 G200 L201 D203V191-L196 HydrophobicContact CG1-CD2 4.38Å; V191-L196 HydrophobicContact CG1-CG 4.4Å; D192-L196 PolarHBondContact O-N 3.4Å; P193-L196 PolarHBondContact O-N 3.49Å; L196-L199 CarbonylContact O-C 3.44Å; L196-L199 PolarHBondContact O-N 3.25Å; L196-G200 CarbonylContact O-C 3.54Å; L196-G200 PolarHBondContact O-N 3.47Å; L196-L201 CarbonylContact C-O 3.58Å; L196-L201 WeakPolarHBondContact CB-O 3.5Å; L196-L201 HydrophobicContact CD2-CB 3.95Å; L196-L201 PolarHBondContact O-N 3.45Å; L196-L201 VanDerWaalsContact O-O 3.12Å; L196-D203 HydrophobicContact CD1-CB 3.88Å
197Q61.5Low57.1Low163 Ų163104.7 Ų104.776%0.76260%0.595SS**Hα-helixtrans-64.4-41.4177.8-173.2173.7-0.800113.1P193 W194 L199 G200P193-Q197 WeakPolarHBondContact O-CB 3.47Å; P193-Q197 PolarHBondContact O-N 3.08Å; W194-Q197 PolarHBondContact O-N 3.41Å; Q197-L199 VanDerWaalsContact C-N 3.3Å; Q197-L199 PolarHBondContact O-N 3.02Å; Q197-G200 PolarHBondContact O-N 2.87Å
198T56.2Low56.9Low106 Ų106102.5 Ų102.565%0.6558%0.578SS**Hα-helixtrans-67.3-33.4178.6-55.50000111.7W194 V195W194-T198 WeakPolarHBondContact O-CB 3.35Å; W194-T198 PolarHBondContact O-N 3.22Å; W194-T198 PolarHBondContact O-OG1 3.02Å; V195-T198 PolarHBondContact O-N 2.92Å
199L56.4Low57.1Low104 Ų104107 Ų10755%0.54559%0.589SS.*THydrogen-bonded Turntrans-89.1-0.6177.5-62.2175.3000113.2V195 L196 Q197 L201V195-L199 HydrophobicContact CG1-CD1 3.78Å; V195-L199 HydrophobicContact CG1-CG 4.5Å; V195-L199 WeakPolarHBondContact O-CB 3.28Å; V195-L199 WeakPolarHBondContact O-CG 3.39Å; V195-L199 PolarHBondContact O-N 3.39Å; L196-L199 CarbonylContact O-C 3.44Å; L196-L199 PolarHBondContact O-N 3.25Å; Q197-L199 VanDerWaalsContact C-N 3.3Å; Q197-L199 PolarHBondContact O-N 3.02Å; L199-L201 HydrophobicContact CB-CD1 3.9Å; L199-L201 HydrophobicContact CB-CG 3.9Å; L199-L201 HydrophobicContact CD1-CD1 4.22Å; L199-L201 PolarHBondContact O-N 3.27Å
200G58.7Low56.9Low66 Ų66106.3 Ų106.368%0.6858%0.583SS**THydrogen-bonded Turntrans65.520-176.600000114.5L196 Q197L196-G200 CarbonylContact O-C 3.54Å; L196-G200 PolarHBondContact O-N 3.47Å; Q197-G200 PolarHBondContact O-N 2.87Å
201L56.8Low56.8Low101 Ų101107.1 Ų107.153%0.52958%0.58SS.*  trans-93.5148.4-180-57.1176.2000110.1L196 L199L196-L201 CarbonylContact C-O 3.58Å; L196-L201 WeakPolarHBondContact CB-O 3.5Å; L196-L201 HydrophobicContact CD2-CB 3.95Å; L196-L201 PolarHBondContact O-N 3.45Å; L196-L201 VanDerWaalsContact O-O 3.12Å; L199-L201 HydrophobicContact CB-CD1 3.9Å; L199-L201 HydrophobicContact CB-CG 3.9Å; L199-L201 HydrophobicContact CD1-CD1 4.22Å; L199-L201 PolarHBondContact O-N 3.27Å
202K61.1Low56.2Low180 Ų180108.7 Ų108.778%0.78359%0.592SS**  trans-108143.5173.6-67.2-178.2176.9-176.30109.7
203D55.1Low55.1Low67 Ų67107.6 Ų107.636%0.35860%0.596SS.*  trans-65.4148173.3-176.325000110.3L196 N205 T206L196-D203 HydrophobicContact CD1-CB 3.88Å; D203-N205 PolarHBondContact O-N 3.24Å; D203-N205 PolarHBondContact OD2-ND2 3.47Å; D203-T206 PolarHBondContact O-N 3.21Å
204L54.1Low54.1Low138 Ų138110.5 Ų110.572%0.72361%0.606SS**G310 helixtrans-55.9-25.6-179.1-155.380.4000112
205N51.8Low53Low137 Ų137113 Ų11373%0.73362%0.617SS**G310 helixtrans-89.31.1-177.4-54.2-55.2000114.5D203D203-N205 PolarHBondContact O-N 3.24Å; D203-N205 PolarHBondContact OD2-ND2 3.47Å
206T52.5Low51.5Low93 Ų93115.4 Ų115.457%0.57164%0.636SS**G310 helixtrans-119.314.2-177-18.30000113.5D203 D208D203-T206 PolarHBondContact O-N 3.21Å; T206-D208 VanDerWaalsContact C-N 3.28Å; T206-D208 PolarHBondContact O-N 2.8Å
207I52.6Low50.2Low109 Ų109118.4 Ų118.456%0.55967%0.665SS**  trans-73.491171.3-43.6175.6000107D209I207-D209 VanDerWaalsContact C-N 3.31Å; I207-D209 PolarHBondContact O-N 3.38Å
208D44Very low49.1Very low94 Ų94118.7 Ų118.750%0.50367%0.67SS.*  trans-7189.8170.5-174.59000108.9T206 T210 L211T206-D208 VanDerWaalsContact C-N 3.28Å; T206-D208 PolarHBondContact O-N 2.8Å; D208-T210 PolarHBondContact O-N 2.94Å; D208-T210 VanDerWaalsContact O-N 3.1Å; D208-T210 VanDerWaalsContact OD1-CB 3.31Å; D208-T210 WeakPolarHBondContact OD1-CB 3Å; D208-T210 WeakPolarHBondContact OD1-CG2 3.39Å; D208-T210 PolarHBondContact OD1-N 3.42Å; D208-T210 VanDerWaalsContact OD1-N 3.17Å; D208-T210 PolarHBondContact OD1-OG1 3.49Å; D208-T210 PolarHBondContact OD2-OG1 2.89Å; D208-L211 PolarHBondContact O-N 2.98Å
209D50.6Low47.9Very low146 Ų146116.8 Ų116.878%0.78167%0.665SS**THydrogen-bonded Turntrans-66.60.7175.9-79.9-24.6000112.9I207 L211I207-D209 VanDerWaalsContact C-N 3.31Å; I207-D209 PolarHBondContact O-N 3.38Å; D209-L211 VanDerWaalsContact C-N 3.29Å
210T46.3Very low47Very low111 Ų111117.2 Ų117.268%0.68168%0.677SS**THydrogen-bonded Turntrans-78.8-11.2174.370.80000113.6D208D208-T210 PolarHBondContact O-N 2.94Å; D208-T210 VanDerWaalsContact O-N 3.1Å; D208-T210 VanDerWaalsContact OD1-CB 3.31Å; D208-T210 WeakPolarHBondContact OD1-CB 3Å; D208-T210 WeakPolarHBondContact OD1-CG2 3.39Å; D208-T210 PolarHBondContact OD1-N 3.42Å; D208-T210 VanDerWaalsContact OD1-N 3.17Å; D208-T210 PolarHBondContact OD1-OG1 3.49Å; D208-T210 PolarHBondContact OD2-OG1 2.89Å
211L50.5Low45.9Very low129 Ų129121.4 Ų121.468%0.67568%0.678SS**SBendtrans-103.2116.5172-70.9169000109.9D208 D209 A213D208-L211 PolarHBondContact O-N 2.98Å; D209-L211 VanDerWaalsContact C-N 3.29Å; L211-A213 PolarHBondContact O-N 3.13Å
212P44.3Very low44.9Very low114 Ų114122.2 Ų122.274%0.7469%0.69SS**PPolyproline II helixtrans-58127.717522.4-29.9000109.1N214P212-N214 PolarHBondContact O-N 3.08Å
213A44.2Very low43.8Very low75 Ų75120.6 Ų120.662%0.6269%0.688SS**PPolyproline II helixtrans-47.5116.8176.800000109.3L211 Y215L211-A213 PolarHBondContact O-N 3.13Å; A213-Y215 VanDerWaalsContact C-N 3.27Å; A213-Y215 HydrophobicContact CB-CD2 4.48Å; A213-Y215 HydrophobicContact CB-CE2 4.2Å; A213-Y215 VanDerWaalsContact O-CD2 3.29Å; A213-Y215 WeakPolarHBondContact O-CD2 3.32Å; A213-Y215 PolarHBondContact O-N 2.78Å
214N40.8Very low43Very low155 Ų155124.6 Ų124.683%0.82971%0.708SS**  trans-71.584.2-171.8-135.5-41.1000109P212 S216P212-N214 PolarHBondContact O-N 3.08Å; N214-S216 PolarHBondContact O-N 3.49Å; N214-S216 VanDerWaalsContact O-N 3.13Å
215Y39.5Very low42.1Very low215 Ų215123.7 Ų123.784%0.84371%0.708SS**  trans-72.696.2165.4-74-85.7000107.3A213A213-Y215 VanDerWaalsContact C-N 3.27Å; A213-Y215 HydrophobicContact CB-CD2 4.48Å; A213-Y215 HydrophobicContact CB-CE2 4.2Å; A213-Y215 VanDerWaalsContact O-CD2 3.29Å; A213-Y215 WeakPolarHBondContact O-CD2 3.32Å; A213-Y215 PolarHBondContact O-N 2.78Å
216S37.3Very low41.2Very low89 Ų89122.6 Ų122.662%0.62271%0.708SS**  trans-141.4106.2163-74.80000109.1N214 I218N214-S216 PolarHBondContact O-N 3.49Å; N214-S216 VanDerWaalsContact O-N 3.13Å; S216-I218 PolarHBondContact O-N 3.38Å
217A38.9Very low40Very low94 Ų94121.8 Ų121.878%0.77772%0.718SS**  trans-54.2126.4155.100000108A219A217-A219 PolarHBondContact O-N 3.1Å
218I39.3Very low39Very low169 Ų169123.3 Ų123.387%0.86773%0.733SS**  trans8.185.1163.8-36.1172.9000114S216S216-I218 PolarHBondContact O-N 3.38Å
219A32Very low38.5Very low66 Ų66124.2 Ų124.255%0.54575%0.746SS.*  trans-104.8102.7156.200000106.1A217 H221A217-A219 PolarHBondContact O-N 3.1Å; A219-H221 VanDerWaalsContact C-N 3.31Å; A219-H221 PolarHBondContact O-N 3.3Å
220S37Very low37.7Very low114 Ų114122.6 Ų122.680%0.79775%0.747SS**  trans-62.690.9172.921.60000109.7
221H34.4Very low37.1Very low153 Ų153125.5 Ų125.571%0.70875%0.752SS**  trans-103.5122.5160.7-73.4-53.1000108.3A219 I223A219-H221 VanDerWaalsContact C-N 3.31Å; A219-H221 PolarHBondContact O-N 3.3Å; H221-I223 PolarHBondContact O-N 2.91Å
222P37.2Very low36.2Very low118 Ų118129.1 Ų129.177%0.76676%0.763SS**  trans-72.8100.1172.629.4-28.2000107.3I224P222-I224 PolarHBondContact O-N 3.27Å; P222-I224 VanDerWaalsContact O-N 3.12Å
223I38.3Very low35.6Very low147 Ų147131.7 Ų131.775%0.75477%0.77SS**  trans-72.6104.8167-68.2176.8000106.7H221 V225H221-I223 PolarHBondContact O-N 2.91Å; I223-V225 HydrophobicContact CG2-CG2 4.22Å; I223-V225 PolarHBondContact O-N 3.48Å
224I36.7Very low35.1Very low151 Ų151136.8 Ų136.877%0.77478%0.78SS**  trans-58.9110.7161.4-65.4166.8000106.8P222P222-I224 PolarHBondContact O-N 3.27Å; P222-I224 VanDerWaalsContact O-N 3.12Å
225V35.8Very low34.7Very low119 Ų119135.5 Ų135.572%0.72177%0.773SS**PPolyproline II helixtrans-90.9121.7165.9-176.70000107.4I223 G227I223-V225 HydrophobicContact CG2-CG2 4.22Å; I223-V225 PolarHBondContact O-N 3.48Å; V225-G227 PolarHBondContact O-N 2.86Å
226P33.6Very low34.4Very low114 Ų114130.8 Ų130.874%0.7477%0.767SS**PPolyproline II helixtrans-65.7125.5169.7-12.727.3000109.2
227G27.4Very low34.4Very low75 Ų75132.4 Ų132.477%0.77377%0.773SS**PPolyproline II helixtrans-63.9140.8-177.300000113.5V225V225-G227 PolarHBondContact O-N 2.86Å
228T31.6Very low34Very low142 Ų142131 Ų13187%0.87177%0.767SS**  trans-109.7127.9149.837.20000108.8
229S33.2Very low34Very low112 Ų112133.4 Ų133.478%0.78377%0.767SS**  trans-43.2139.6-174.159.10000116.8
230S33.3Very low34Very low113 Ų113134.4 Ų134.479%0.7978%0.775SS**  trans-141.4114.8132.6-170.60000108.4F232S230-F232 PolarHBondContact O-N 3.48Å
231Q33.8Very low34Very low171 Ų171136 Ų13680%0.79978%0.78SS**  trans-69.9119.4177.1-71.2165.1-9.100109
232F31.3Very low33.9Very low206 Ų206134.6 Ų134.690%0.90478%0.782SS**  trans-148.5112.3144.2-96.8-75.6000110.1S230S230-F232 PolarHBondContact O-N 3.48Å
233L31.8Very low33.6Very low168 Ų168133.9 Ų133.988%0.8878%0.78SS**  trans-64.5128.5164.7-91.1146.3000109.6
234H34.4Very low33.4Very low182 Ų182137.1 Ų137.184%0.84378%0.783SS**  -153137.8123.9-149.6-87.3000111.9
235D31.1Very low33.1Very low127 Ų127136.4 Ų136.468%0.67978%0.781SS**  trans-63.9153.1-172.8-160.25.5000113.9
236T33.8Very low33.1Very low117 Ų117139.6 Ų139.672%0.71879%0.788SS**  trans160.9105.3136-61.60000111.5
237V37Very low33.3Very low122 Ų122141.1 Ų141.174%0.73979%0.785SS**  trans42.3121.6139.8-165.80000117.7
238G30.2Very low33.7Very low64 Ų64145.5 Ų145.566%0.6679%0.789SS**  cis111.578.228.800000111
239Y39.7Very low33.9Very low221 Ų221143.9 Ų143.987%0.86778%0.775SS**  trans-157.1118.2148.733.3-93.7000111.3
240A33.3Very low34Very low86 Ų86148.5 Ų148.571%0.71178%0.777SS**  trans-69.5148.1164.900000110.5
241T36Very low33.7Very low148 Ų148146.8 Ų146.891%0.90878%0.777SS**  trans-150.6120.4131.8-5.90000110.5
242V32.2Very low33.6Very low124 Ų124142.1 Ų142.175%0.75278%0.775SS**  trans-87.5147.9174.2178.10000108.3
243S31.6Very low33.6Very low102 Ų102140.9 Ų140.971%0.71378%0.778SS**  trans141.5144.5140.5-73.50000111.2
244R33.3Very low33.7Very low215 Ų215144.3 Ų144.381%0.81178%0.779SS**  cis-174139.3-7.2162.2175.4-76.7175.8-3.7105.5
245D31.7Very low33.5Very low137 Ų137139 Ų13973%0.73377%0.767SS**  trans-16.2143.2155.2-97.5-38.3000118.4
246Q34.4Very low33.4Very low185 Ų185142 Ų14286%0.86478%0.776SS**  -157.6106.2129-115.2158.490.700112.9
247H37.8Very low33.1Very low147 Ų147140.6 Ų140.668%0.68178%0.776SS**  trans-76.5135.8158.1171.4-90.1000109.9
248L36.8Very low32.7Very low167 Ų167140.7 Ų140.787%0.87478%0.783SS**  trans-158.6135.9149.9-111.5138.6000111.6
249D35.2Very low32.6Very low107 Ų107145.1 Ų145.157%0.57279%0.791SS**  trans-107.2178.5-164.2-176.317.2000110.3
250Y34.5Very low32.2Very low210 Ų210141.4 Ų141.482%0.82479%0.791SS**  trans98.1126.4156.7-90.7-89.4000120.9
251G28.4Very low32.1Very low76 Ų76143.5 Ų143.578%0.78480%0.795SS**  trans153.972.7140.700000115.9
252G31.2Very low32.2Very low73 Ų73141.3 Ų141.375%0.75378%0.784SS**  trans-78.6160.2172.800000114.5
253N30.5Very low32Very low181 Ų181142.4 Ų142.497%0.96878%0.784SS**  trans-158.5147.4140.8-118.2-6.7000112.8
254R34.6Very low32Very low239 Ų239145.3 Ų145.390%0.90279%0.785SS**  trans-113.4161.8-162.8-172.8-175.6-148-128.14.5111.8
255A30.1Very low31.8Very low71 Ų71142.9 Ų142.959%0.58778%0.784SS**  trans93.7132158.900000114.6
256H30.1Very low32Very low190 Ų190143.7 Ų143.788%0.8878%0.783SS**  cis-147.7158.243.1-75.7-92.3000114.1
257A26.7Very low31.7Very low87 Ų87140 Ų14072%0.71977%0.769SS**  trans-73.1152.7177.900000113.9
258S29.6Very low31.3Very low125 Ų125138 Ų13887%0.87477%0.77SS**  trans-162.8124.7139.6-81.80000110.8
259N27.8Very low30.9Very low156 Ų156138.3 Ų138.383%0.83477%0.767SS**  trans-77.8132.7177.3-61.1-70.3000110.7
260V30.1Very low30.6Very low144 Ų144137.8 Ų137.887%0.87377%0.77SS**  trans-151.9112.5146.3-177.70000108.5
261T31.6Very low30.6Very low129 Ų129136.8 Ų136.879%0.79177%0.771SS**  trans-95.8161.8149.25.40000106.7
262P37.9Very low30.7Very low103 Ų103139 Ų13967%0.66978%0.775SS**  cis-152-169.141.330.4-2.4000116.2
263I27.4Very low30.7Very low146 Ų146146.5 Ų146.575%0.74978%0.78SS**  trans88.597.7155-48.2-177.3000115
264H33Very low30.8Very low163 Ų163146.1 Ų146.176%0.75578%0.777SS**  65.196.991.3-17883.7000113.7
265Q28.6Very low30.7Very low165 Ų165139.8 Ų139.877%0.77177%0.77SS**  trans-150112142.3-164.2164.9-7.300109.3D267Q265-D267 WeakPolarHBondContact CG-OD2 3.34Å; Q265-D267 PolarHBondContact NE2-OD2 2.88Å
266Q35.8Very low31Very low153 Ų153143.7 Ų143.772%0.71578%0.78SS**  trans-88.6104.8172.1-179.7146.817.200106.8
267D27.3Very low31.6Very low108 Ų108140 Ų14058%0.57877%0.773SS**  trans-124.8108.4166.2-80.9-42.8000109.8Q265 H269Q265-D267 WeakPolarHBondContact CG-OD2 3.34Å; Q265-D267 PolarHBondContact NE2-OD2 2.88Å; D267-H269 PolarHBondContact O-N 3.28Å
268C29.3Very low32.4Very low105 Ų105141.7 Ų141.771%0.70978%0.777SS**  trans-66.8117.5165.9-58.10000108.7
269H29.1Very low33Very low174 Ų174142.5 Ų142.581%0.80678%0.777SS**  trans-126.798157.2-71-58.4000109.7D267D267-H269 PolarHBondContact O-N 3.28Å
270C28.4Very low33.3Very low95 Ų95138.2 Ų138.264%0.64277%0.769SS**  trans-68.7145.2158.9-148.20000108.6
271F35.1Very low33.9Very low189 Ų189137.5 Ų137.583%0.82977%0.765SS**  trans75.5106.5168.9-46.9-71.8000118.3
272S30.8Very low34.2Very low124 Ų124139.9 Ų139.987%0.86777%0.767SS**  trans-155.7134.3150.9-77.50000105.9
273R30.5Very low34.2Very low230 Ų230141.2 Ų141.287%0.86877%0.773SS**  cis-171.3119.5-8.1-164.1176.4-175.6-144.54.7100.9S275R273-S275 PolarHBondContact O-N 2.82Å; R273-S275 VanDerWaalsContact O-N 3.15Å
274L33.8Very low34.5Very low172 Ų172141 Ų14190%0.90177%0.773SS**  trans-59.9116.1175.2-80.1153.5000108.8
275S31.1Very low34.9Very low107 Ų107138.1 Ų138.175%0.74877%0.768SS**  trans-116.3104.6167.363.20000109R273R273-S275 PolarHBondContact O-N 2.82Å; R273-S275 VanDerWaalsContact O-N 3.15Å
276N36.5Very low35.1Very low152 Ų152141.7 Ų141.781%0.81378%0.776SS**PPolyproline II helixtrans-74.7134.5167.9-67.2-32.5000109.6
277P44.4Very low35.3Very low113 Ų113142.9 Ų142.973%0.73478%0.782SS**PPolyproline II helixtrans-89156.1159.933.8-27.9000111
278P43.5Very low35.8Very low123 Ų123143.5 Ų143.580%0.79979%0.794SS**PPolyproline II helixtrans-80.5151.1-173.932.8-32.8000112.8G280P278-G280 PolarHBondContact O-N 3.43Å
279V42.2Very low36.4Very low142 Ų142142.3 Ų142.386%0.86179%0.792SS**  trans-19.1111.6166.4176.10000114.3
280G33.4Very low37Very low65 Ų65141.3 Ų141.367%0.6779%0.793SS**  trans-130.5109161.600000108.1P278 Q282P278-G280 PolarHBondContact O-N 3.43Å; G280-Q282 PolarHBondContact O-N 3.33Å
281V42.7Very low37.6Very low129 Ų129142 Ų14278%0.78279%0.794SS**  trans-68101.7175.9-174.60000107.5
282Q37Very low38Very low179 Ų179135.5 Ų135.584%0.83677%0.772SS**  trans-111.1107.8165.9-73.5-136.87200108.8G280 L284G280-Q282 PolarHBondContact O-N 3.33Å; Q282-L284 PolarHBondContact O-N 3.5Å; Q282-L284 VanDerWaalsContact O-N 3.16Å
283T38.8Very low38.8Very low131 Ų131136 Ų13680%0.80477%0.772SS**  trans-61.1106.8170.2-35.70000108.4
284L32.9Very low39.5Very low143 Ų143131 Ų13175%0.74976%0.763SS**  trans-78131.7173.8-137.886.9000108.8Q282 Y286Q282-L284 PolarHBondContact O-N 3.5Å; Q282-L284 VanDerWaalsContact O-N 3.16Å; L284-Y286 PolarHBondContact O-N 2.85Å
285P41.7Very low40.4Very low101 Ų101129.7 Ų129.766%0.65675%0.75SS**  trans-69.3134.1175.427.1-31.3000110H287P285-H287 PolarHBondContact O-N 3.48Å
286Y32.6Very low41.8Very low240 Ų240130.8 Ų130.894%0.94175%0.752SS**  trans-49.2109.3174.2-75.3-94.7000111L284 S288L284-Y286 PolarHBondContact O-N 2.85Å; Y286-S288 PolarHBondContact O-N 3.22Å
287H39.7Very low42.5Very low179 Ų179132.3 Ų132.383%0.82975%0.754SS**  trans-74.1103.1161.4-95.2-80.6000107.6P285 A289P285-H287 PolarHBondContact O-N 3.48Å; H287-A289 PolarHBondContact O-N 3.49Å; H287-A289 VanDerWaalsContact O-N 3.12Å
288S37.7Very low43.2Very low120 Ų120132.2 Ų132.284%0.83975%0.751SS**  trans-65.7107.3164.8-148.40000107.1Y286 D290Y286-S288 PolarHBondContact O-N 3.22Å; S288-D290 PolarHBondContact O-N 2.92Å; S288-D290 VanDerWaalsContact O-N 3.16Å
289A42.9Very low43.8Very low80 Ų80130.9 Ų130.966%0.66175%0.751SS**  trans-74.7103.5173.900000107.6H287 V291H287-A289 PolarHBondContact O-N 3.49Å; H287-A289 VanDerWaalsContact O-N 3.12Å; A289-V291 HydrophobicContact CB-CG2 4.33Å; A289-V291 PolarHBondContact O-N 2.99Å
290D42Very low44.1Very low154 Ų154132.4 Ų132.482%0.82475%0.746SS**  trans-6898.9165.3-143.9-8.8000107.1S288 S292S288-D290 PolarHBondContact O-N 2.92Å; S288-D290 VanDerWaalsContact O-N 3.16Å; D290-S292 PolarHBondContact O-N 3.4Å
291V40.7Very low45.3Very low108 Ų108134.9 Ų134.966%0.65575%0.754SS**  trans-82.794.7-177.4-176.80000108.3A289A289-V291 HydrophobicContact CB-CG2 4.33Å; A289-V291 PolarHBondContact O-N 2.99Å
292S43.3Very low46.3Very low54 Ų54134.2 Ų134.238%0.37875%0.75SS.*  trans-56.8132.3157.31650000109.2D290 N294D290-S292 PolarHBondContact O-N 3.4Å; S292-N294 PolarHBondContact O-N 3Å; S292-N294 PolarHBondContact OG-OD1 3.31Å
293P46.7Very low47.3Very low135 Ų135131.2 Ų131.288%0.87775%0.749SS**THydrogen-bonded Turntrans-73.19.9-166.829.3-35.2000115.2
294N45.8Very low48.6Very low125 Ų125129.2 Ų129.267%0.66873%0.732SS**THydrogen-bonded Turntrans-110.25.1-175.680.8-20.8000115.3S292 T296S292-N294 PolarHBondContact O-N 3Å; S292-N294 PolarHBondContact OG-OD1 3.31Å; N294-T296 PolarHBondContact O-N 3.01Å
295K52.4Low50Low144 Ų144125.8 Ų125.863%0.62672%0.721SS**  trans-88.592.1179.4-52.1180-173.5174.10108.2E297K295-E297 PolarHBondContact O-N 3.23Å
296T60.3Low50.8Low130 Ų130126.8 Ų126.880%0.79873%0.727SS**  trans-57.2104.9164.1-59.30000107.3N294 V298N294-T296 PolarHBondContact O-N 3.01Å; T296-V298 PolarHBondContact O-N 2.92Å
297E51.9Low51.8Low183 Ų183123.5 Ų123.586%0.85572%0.72SS**  trans-61.7105.4175.9-171.6176.1-17700107.9K295 A299K295-E297 PolarHBondContact O-N 3.23Å; E297-A299 PolarHBondContact O-N 2.95Å
298V58.2Low52.7Low111 Ų111117 Ų11767%0.67369%0.694SS**  trans-72.8101.5-179.9178.80000107.2T296 F300T296-V298 PolarHBondContact O-N 2.92Å; V298-F300 VanDerWaalsContact CG1-O 3.28Å; V298-F300 WeakPolarHBondContact CG1-O 3.48Å; V298-F300 PolarHBondContact O-N 3.48Å
299A57.8Low53.9Low96 Ų96118 Ų11879%0.79369%0.69SS**SBendtrans-67-16.4-176.600000114.1E297E297-A299 PolarHBondContact O-N 2.95Å
300F47.5Very low54.9Low174 Ų174116 Ų11676%0.76367%0.67SS**  trans-157.1137.8176.260.3-85.3000112.4V298V298-F300 VanDerWaalsContact CG1-O 3.28Å; V298-F300 WeakPolarHBondContact CG1-O 3.48Å; V298-F300 PolarHBondContact O-N 3.48Å
301S59.3Low55.9Low117 Ų117115.6 Ų115.682%0.81866%0.661SS**  trans-121134.6174.560.50000110.4
302T62.3Low57.1Low114 Ų114114.1 Ų114.170%0.69965%0.652SS**  trans-130.7132.6172.5-175.40000110.2
303S58.7Low57.9Low117 Ų117116.9 Ų116.982%0.81866%0.658SS**PPolyproline II helixtrans-86.3129.3176.558.10000109.8
304L65.8Low58.9Low88 Ų88114.2 Ų114.246%0.46164%0.643SS.*PPolyproline II helixtrans-101.1153.3175.4-62176.3000111.2C308 V310L304-C308 WeakPolarHBondContact CB-SG 3.4Å; L304-V310 HydrophobicContact CD1-CG2 3.7Å
305S62.6Low60.2Low72 Ų72113.3 Ų113.350%0.50363%0.633SS.*PPolyproline II helixtrans-69.2149.8177.968.70000111.3H307 C308S305-H307 PolarHBondContact O-N 3.36Å; S305-C308 PolarHBondContact O-N 3.36Å; S305-C308 VanDerWaalsContact O-N 3.12Å; S305-C308 PolarHBondContact O-SG 3.46Å
306P59.2Low61Low122 Ų122114 Ų11479%0.79264%0.638SS**THydrogen-bonded Turntrans-58.9-20.6-179.2-23.532.7000114.3
307H53.2Low61.8Low171 Ų171112.7 Ų112.779%0.79262%0.623SS**THydrogen-bonded Turntrans-101.95-175.8-55.8-61.9000113.7S305S305-H307 PolarHBondContact O-N 3.36Å
308C57.4Low62.9Low42 Ų42104 Ų10428%0.28458%0.583SS.*PPolyproline II helixtrans-84.4137.3174.877.50000110.7L304 S305L304-C308 WeakPolarHBondContact CB-SG 3.4Å; S305-C308 PolarHBondContact O-N 3.36Å; S305-C308 VanDerWaalsContact O-N 3.12Å; S305-C308 PolarHBondContact O-SG 3.46Å
309N63.3Low63.9Low141 Ų141101.8 Ų101.875%0.75457%0.565SS**PPolyproline II helixtrans-95119.6172.9-67.7-44.2000108.3
310V64Low64.9Low38 Ų3898.3 Ų98.323%0.2354%0.536CS..PPolyproline II helixtrans-84.8117.1170.4-167.80000107.7L304 V322 W330 F332L304-V310 HydrophobicContact CD1-CG2 3.7Å; V310-V322 HydrophobicContact CB-CG1 4.09Å; V310-V322 HydrophobicContact CG1-CB 4.14Å; V310-V322 HydrophobicContact CG1-CG1 3.44Å; V310-V322 VanDerWaalsContact CG1-CG1 3.44Å; V310-V322 HydrophobicContact CG1-CG2 3.91Å; V310-W330 HydrophobicContact CB-CD2 4.39Å; V310-W330 HydrophobicContact CB-CH2 4.19Å; V310-W330 HydrophobicContact CB-CZ2 4.03Å; V310-W330 HydrophobicContact CB-CZ3 4.44Å; V310-W330 HydrophobicContact CG2-CD2 3.97Å; V310-W330 VanDerWaalsContact CG2-CE2 3.47Å; V310-W330 HydrophobicContact CG2-CG 4.33Å; V310-W330 HydrophobicContact CG2-CH2 4.29Å; V310-W330 HydrophobicContact CG2-CZ2 3.63Å; V310-F332 HydrophobicContact CG1-CE1 3.88Å; V310-F332 HydrophobicContact CG1-CZ 4.11Å
311K64.3Low66.1Low146 Ų14693.9 Ų93.964%0.63552%0.517SS*.  trans-106131.8-178.4-68.3-174.2178.3-176.50110.7H313K311-H313 PolarHBondContact O-CD2 3.47Å; K311-H313 PolarHBondContact O-N 3.48Å
312T65.4Low67Low76 Ų7689.7 Ų89.747%0.46649%0.486SS..  trans-64.4122.7165.2-610000108.7A320T312-A320 WeakPolarHBondContact CG2-O 3.38Å
313H60.4Low67.6Low112 Ų11290.2 Ų90.252%0.51948%0.475SS..  trans-108.3131.7172.4-76.1-85.3000109.6K311 F315 A320K311-H313 PolarHBondContact O-CD2 3.47Å; K311-H313 PolarHBondContact O-N 3.48Å; H313-F315 HydrophobicContact CB-CD2 4.39Å; H313-F315 HydrophobicContact CB-CE2 3.62Å; H313-F315 HydrophobicContact CB-CZ 3.85Å; H313-A320 PolarHBondContact O-N 3.01Å
314S67.4Low68.5Low80 Ų8091.2 Ų91.256%0.55946%0.461SS*.EExtended strand (participates in β ladder)trans-94.7129.7169.2-67.50000109
315F72.8Confident68.9Low105 Ų10589 Ų8946%0.46145%0.45SS..EExtended strand (participates in β ladder)trans-112.1168173.8-58-95.1000109H313 Q317 G318 W334H313-F315 HydrophobicContact CB-CD2 4.39Å; H313-F315 HydrophobicContact CB-CE2 3.62Å; H313-F315 HydrophobicContact CB-CZ 3.85Å; F315-Q317 VanDerWaalsContact C-N 3.26Å; F315-Q317 PolarHBondContact O-N 3.01Å; F315-G318 CarbonylContact C-O 3.55Å; F315-G318 WeakPolarHBondContact CA-O 3.4Å; F315-G318 PolarHBondContact N-O 3.26Å; F315-G318 PolarHBondContact O-N 3.47Å; F315-W334 HydrophobicContact CB-CH2 4.02Å; F315-W334 AromaticContact CD2-CH2 3.8Å; F315-W334 HydrophobicContact CD2-CH2 3.8Å; F315-W334 AromaticContact CD2-CZ3 3.6Å; F315-W334 HydrophobicContact CD2-CZ3 3.6Å; F315-W334 HydrophobicContact CE2-CZ3 4.17Å; F315-W334 HydrophobicContact CG-CH2 4.21Å; F315-W334 HydrophobicContact CG-CZ3 4.45Å
316H68.7Low69.6Low158 Ų15894.6 Ų94.673%0.73147%0.468SS*.THydrogen-bonded Turntrans-69.1-29.4177.247.4-71.1000111.4
317Q77.1Confident70.4Confident103 Ų10396 Ų9648%0.48146%0.464SS..THydrogen-bonded Turntrans-79.9-8.4176.2-65.282.7-300114.8F315 W334 P336 K337F315-Q317 VanDerWaalsContact C-N 3.26Å; F315-Q317 PolarHBondContact O-N 3.01Å; Q317-W334 HydrophobicContact CB-CZ2 4.19Å; Q317-P336 WeakPolarHBondContact O-CA 3.36Å; Q317-K337 PolarHBondContact O-N 3.21Å
318G76.4Confident71.1Confident0 Ų089.9 Ų89.90%045%0.447CS..EExtended strand (participates in β ladder)trans158.5178.8-171.700000114.5F315 V335F315-G318 CarbonylContact C-O 3.55Å; F315-G318 WeakPolarHBondContact CA-O 3.4Å; F315-G318 PolarHBondContact N-O 3.26Å; F315-G318 PolarHBondContact O-N 3.47Å; G318-V335 CarbonylContact C-O 3.53Å; G318-V335 WeakPolarHBondContact CA-O 3.3Å
319Q77.4Confident71.8Confident66 Ų6689.5 Ų89.531%0.30845%0.45SS..EExtended strand (participates in β ladder)trans-119.7131.8-178.3-69.4179.9-17.700110.4F321 V335Q319-F321 HydrophobicContact CB-CE2 3.83Å; Q319-F321 HydrophobicContact CB-CZ 4.01Å; Q319-V335 PolarHBondContact N-O 3.4Å; Q319-V335 PolarHBondContact O-N 3.03Å
320A78.7Confident72.4Confident23 Ų2386.4 Ų86.419%0.1943%0.428CS..EExtended strand (participates in β ladder)trans-103.2110.217600000110.2T312 H313 W334T312-A320 WeakPolarHBondContact CG2-O 3.38Å; H313-A320 PolarHBondContact O-N 3.01Å; A320-W334 HydrophobicContact CB-CE3 3.78Å; A320-W334 HydrophobicContact CB-CZ3 3.96Å
321F73.1Confident73Confident80 Ų8088.5 Ų88.535%0.35143%0.434SS..EExtended strand (participates in β ladder)trans-91.7145.9175.2-58.9-85.9000111.2Q319 F332 T333 V335Q319-F321 HydrophobicContact CB-CE2 3.83Å; Q319-F321 HydrophobicContact CB-CZ 4.01Å; F321-F332 CarbonylContact O-C 3.44Å; F321-F332 WeakPolarHBondContact O-CA 3.44Å; F321-T333 PolarHBondContact N-O 3.15Å; F321-T333 PolarHBondContact O-N 2.85Å; F321-V335 HydrophobicContact CD2-CG2 3.99Å; F321-V335 HydrophobicContact CE2-CB 4.11Å; F321-V335 HydrophobicContact CE2-CG2 3.66Å
322V77.7Confident73.8Confident29 Ų2987.8 Ų87.818%0.17643%0.432CS..EExtended strand (participates in β ladder)trans-126.6125.1177-170.40000108.5V310 W330 K331 F332V310-V322 HydrophobicContact CB-CG1 4.09Å; V310-V322 HydrophobicContact CG1-CB 4.14Å; V310-V322 HydrophobicContact CG1-CG1 3.44Å; V310-V322 VanDerWaalsContact CG1-CG1 3.44Å; V310-V322 HydrophobicContact CG1-CG2 3.91Å; V322-W330 HydrophobicContact CG1-CB 4.44Å; V322-W330 HydrophobicContact CG1-CD2 4.12Å; V322-W330 HydrophobicContact CG1-CE3 3.43Å; V322-W330 VanDerWaalsContact CG1-CE3 3.43Å; V322-W330 HydrophobicContact CG1-CZ3 3.9Å; V322-K331 WeakPolarHBondContact CA-O 3.41Å; V322-F332 HydrophobicContact CB-CD1 4.48Å; V322-F332 HydrophobicContact CB-CE1 4.44Å; V322-F332 HydrophobicContact CG1-CD1 4.26Å; V322-F332 HydrophobicContact CG1-CE1 3.91Å; V322-F332 HydrophobicContact CG1-CZ 4.32Å; V322-F332 HydrophobicContact CG2-CD1 3.72Å; V322-F332 HydrophobicContact CG2-CE1 3.73Å
323R76.7Confident74.5Confident125 Ų12587.5 Ų87.547%0.47243%0.43SS..EExtended strand (participates in β ladder)trans-124.314817670-177.1-174.998.6-16.4111.3D325 W330 K331R323-D325 IonicContact NH1-OD1 3.75Å; R323-W330 CarbonylContact O-C 3.39Å; R323-W330 WeakPolarHBondContact O-CA 3.48Å; R323-K331 HydrophobicContact CG-CB 3.67Å; R323-K331 PolarHBondContact N-O 3.42Å; R323-K331 PolarHBondContact O-N 2.87Å
324R76.1Confident75.5Confident139 Ų13988.1 Ų88.153%0.52543%0.427SS..EExtended strand (participates in β ladder)trans-76.5145166.9-76.9-72.1-168.3169.3-0.2109.8G328 G329 W330R324-G328 PolarHBondContact NH1-O 3.32Å; R324-G329 CarbonylContact C-O 3.59Å; R324-G329 WeakPolarHBondContact CA-O 3.47Å; R324-G329 WeakPolarHBondContact CD-O 3.31Å; R324-W330 HydrophobicContact CG-CD2 4.3Å; R324-W330 HydrophobicContact CG-CE3 3.78Å; R324-W330 HydrophobicContact CG-CH2 3.94Å; R324-W330 HydrophobicContact CG-CZ2 4.42Å; R324-W330 HydrophobicContact CG-CZ3 3.6Å; R324-W330 VanDerWaalsContact CZ-NE1 3.28Å; R324-W330 VanDerWaalsContact NE-CH2 3.3Å
325D75.9Confident76.1Confident40 Ų4087.6 Ų87.621%0.21442%0.421CS..  trans-92.9161.2170-144.617.1000110.9R323 E327 G328 G329 K331R323-D325 IonicContact NH1-OD1 3.75Å; D325-E327 PolarHBondContact O-N 2.78Å; D325-E327 VanDerWaalsContact OD2-OE2 3.13Å; D325-G328 PolarHBondContact O-N 2.84Å; D325-G329 PolarHBondContact N-O 2.81Å; D325-K331 VanDerWaalsContact CG-CE 3.48Å; D325-K331 WeakPolarHBondContact OD1-CE 3.44Å; D325-K331 IonicContact OD1-NZ 2.7Å; D325-K331 PolarHBondContact OD1-NZ 3.49Å; D325-K331 WeakPolarHBondContact OD2-CE 3.37Å; D325-K331 IonicContact OD2-NZ 2.87Å; D325-K331 PolarHBondContact OD2-NZ 3.48Å
326E75.3Confident76.3Confident191 Ų19186.9 Ų86.989%0.89343%0.427SS*.THydrogen-bonded Turntrans-62.6-29.7177.4-65-179.6-17300111.5G328E326-G328 PolarHBondContact O-N 3.44Å
327E76.3Confident76.6Confident150 Ų15084.8 Ų84.870%0.70142%0.416SS*.THydrogen-bonded Turntrans-79.55.6174.1-6075.8-167.700113.3D325 G329D325-E327 PolarHBondContact O-N 2.78Å; D325-E327 VanDerWaalsContact OD2-OE2 3.13Å; E327-G329 VanDerWaalsContact C-N 3.3Å; E327-G329 PolarHBondContact O-N 2.8Å
328G69.6Low76.4Confident43 Ų4388.8 Ų88.844%0.44343%0.434SS..SBendtrans81.72.4179.400000115R324 D325 E326R324-G328 PolarHBondContact NH1-O 3.32Å; D325-G328 PolarHBondContact O-N 2.84Å; E326-G328 PolarHBondContact O-N 3.44Å
329G72Confident75.7Confident34 Ų3498.3 Ų98.335%0.35150%0.496SS..  trans-71.8177.3173.600000113.7R324 D325 E327R324-G329 CarbonylContact C-O 3.59Å; R324-G329 WeakPolarHBondContact CA-O 3.47Å; R324-G329 WeakPolarHBondContact CD-O 3.31Å; D325-G329 PolarHBondContact N-O 2.81Å; E327-G329 VanDerWaalsContact C-N 3.3Å; E327-G329 PolarHBondContact O-N 2.8Å
330W75.7Confident75.6Confident77 Ų7799.9 Ų99.929%0.29251%0.505SS..EExtended strand (participates in β ladder)trans-118.5133.2171-66.6102.7000109.9V310 V322 R323 R324 F332V310-W330 HydrophobicContact CB-CD2 4.39Å; V310-W330 HydrophobicContact CB-CH2 4.19Å; V310-W330 HydrophobicContact CB-CZ2 4.03Å; V310-W330 HydrophobicContact CB-CZ3 4.44Å; V310-W330 HydrophobicContact CG2-CD2 3.97Å; V310-W330 VanDerWaalsContact CG2-CE2 3.47Å; V310-W330 HydrophobicContact CG2-CG 4.33Å; V310-W330 HydrophobicContact CG2-CH2 4.29Å; V310-W330 HydrophobicContact CG2-CZ2 3.63Å; V322-W330 HydrophobicContact CG1-CB 4.44Å; V322-W330 HydrophobicContact CG1-CD2 4.12Å; V322-W330 HydrophobicContact CG1-CE3 3.43Å; V322-W330 VanDerWaalsContact CG1-CE3 3.43Å; V322-W330 HydrophobicContact CG1-CZ3 3.9Å; R323-W330 CarbonylContact O-C 3.39Å; R323-W330 WeakPolarHBondContact O-CA 3.48Å; R324-W330 HydrophobicContact CG-CD2 4.3Å; R324-W330 HydrophobicContact CG-CE3 3.78Å; R324-W330 HydrophobicContact CG-CH2 3.94Å; R324-W330 HydrophobicContact CG-CZ2 4.42Å; R324-W330 HydrophobicContact CG-CZ3 3.6Å; R324-W330 VanDerWaalsContact CZ-NE1 3.28Å; R324-W330 VanDerWaalsContact NE-CH2 3.3Å; W330-F332 HydrophobicContact CB-CE2 4.09Å; W330-F332 HydrophobicContact CB-CZ 4.32Å
331K75.9Confident75.4Confident81 Ų81103.9 Ų103.935%0.35252%0.522SS..EExtended strand (participates in β ladder)trans-112.8133.2174-74.4176.3172.4156.10109.6V322 R323 D325V322-K331 WeakPolarHBondContact CA-O 3.41Å; R323-K331 HydrophobicContact CG-CB 3.67Å; R323-K331 PolarHBondContact N-O 3.42Å; R323-K331 PolarHBondContact O-N 2.87Å; D325-K331 VanDerWaalsContact CG-CE 3.48Å; D325-K331 WeakPolarHBondContact OD1-CE 3.44Å; D325-K331 IonicContact OD1-NZ 2.7Å; D325-K331 PolarHBondContact OD1-NZ 3.49Å; D325-K331 WeakPolarHBondContact OD2-CE 3.37Å; D325-K331 IonicContact OD2-NZ 2.87Å; D325-K331 PolarHBondContact OD2-NZ 3.48Å
332F81.1Confident75.5Confident132 Ų132105.3 Ų105.358%0.57953%0.531SS*.EExtended strand (participates in β ladder)trans-106.4133.4-179.4-61.3-92.7000109.3V310 F321 V322 W330V310-F332 HydrophobicContact CG1-CE1 3.88Å; V310-F332 HydrophobicContact CG1-CZ 4.11Å; F321-F332 CarbonylContact O-C 3.44Å; F321-F332 WeakPolarHBondContact O-CA 3.44Å; V322-F332 HydrophobicContact CB-CD1 4.48Å; V322-F332 HydrophobicContact CB-CE1 4.44Å; V322-F332 HydrophobicContact CG1-CD1 4.26Å; V322-F332 HydrophobicContact CG1-CE1 3.91Å; V322-F332 HydrophobicContact CG1-CZ 4.32Å; V322-F332 HydrophobicContact CG2-CD1 3.72Å; V322-F332 HydrophobicContact CG2-CE1 3.73Å; W330-F332 HydrophobicContact CB-CE2 4.09Å; W330-F332 HydrophobicContact CB-CZ 4.32Å
333T79.5Confident75.4Confident69 Ų69109.8 Ų109.842%0.42355%0.552SS.*EExtended strand (participates in β ladder)trans-127.5118.1176.7-55.20000109F321F321-T333 PolarHBondContact N-O 3.15Å; F321-T333 PolarHBondContact O-N 2.85Å
334W82.4Confident75.3Confident125 Ų125108.8 Ų108.847%0.47356%0.557SS.*EExtended strand (participates in β ladder)trans-94.8125.2175.3178.5-104.6000110F315 Q317 A320F315-W334 HydrophobicContact CB-CH2 4.02Å; F315-W334 AromaticContact CD2-CH2 3.8Å; F315-W334 HydrophobicContact CD2-CH2 3.8Å; F315-W334 AromaticContact CD2-CZ3 3.6Å; F315-W334 HydrophobicContact CD2-CZ3 3.6Å; F315-W334 HydrophobicContact CE2-CZ3 4.17Å; F315-W334 HydrophobicContact CG-CH2 4.21Å; F315-W334 HydrophobicContact CG-CZ3 4.45Å; Q317-W334 HydrophobicContact CB-CZ2 4.19Å; A320-W334 HydrophobicContact CB-CE3 3.78Å; A320-W334 HydrophobicContact CB-CZ3 3.96Å
335V78.8Confident75.3Confident70 Ų70106.8 Ų106.842%0.42456%0.559SS.*EExtended strand (participates in β ladder)trans-112.9106.4171.7-178.30000107.9G318 Q319 F321G318-V335 CarbonylContact C-O 3.53Å; G318-V335 WeakPolarHBondContact CA-O 3.3Å; Q319-V335 PolarHBondContact N-O 3.4Å; Q319-V335 PolarHBondContact O-N 3.03Å; F321-V335 HydrophobicContact CD2-CG2 3.99Å; F321-V335 HydrophobicContact CE2-CB 4.11Å; F321-V335 HydrophobicContact CE2-CG2 3.66Å
336P78.4Confident75.2Confident89 Ų89111.6 Ų111.658%0.57858%0.584SS**EExtended strand (participates in β ladder)trans-66141.917625.8-29.9000110.1Q317Q317-P336 WeakPolarHBondContact O-CA 3.36Å
337K75Confident75.2Confident115 Ų115105.5 Ų105.550%0.556%0.56SS.*PPolyproline II helixtrans-84.8127.2165-80.1179.9174.7-176.50107.2Q317Q317-K337 PolarHBondContact O-N 3.21Å
338E72.2Confident75.1Confident186 Ų186101.8 Ų101.887%0.86955%0.549SS*.PPolyproline II helixtrans-58.6145.2171.5-75.2-174.3161.800110.1
339P61.1Low75.6Confident200 Ų200107.1 Ų107.1100%1.29956%0.558SS**  trans-65.10-173.926.2-34.4000114.4

Retrieved 339 of 339 residues in 156.7 ms (Link to these results)