A0A096MUH8_PAPAN Loading...

BAG family molecular chaperone regulator 4

Inhibits the chaperone activity of HSP70/HSC70 by promoting substrate release. Prevents constitutive TNFRSF1A signaling. Negative regulator of PRKN translocation to damaged mitochondria.

AlphaFold DB , UniProt , Accession A0A096MUH8, Species PAPAN (Papio anubis, Olive baboon), Gene BAG4, Length 457 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
1M41.6Very low46.3Very low229 Ų229152.4 Ų152.4100%1.12884%0.838SS**  086.40-56.7173.594.300104.9
2S38.9Very low45.9Very low125 Ų125149.7 Ų149.787%0.87484%0.838SS**  cis69.6125.646.1-35.20000110.4
3A45.1Very low45.6Very low94 Ų94151.1 Ų151.178%0.77784%0.842SS**  cis-140166.58.200000109.8
4L47.8Very low45Very low146 Ų146145.4 Ų145.476%0.76484%0.835SS**  cis77.988.322.8-167.283.1000117.3
5R55Low45.2Very low247 Ų247143.2 Ų143.293%0.93283%0.828SS**  trans-156.5134.2131.8-63.2-159.6-175.2-137.4-0.6106.7
6R49.5Very low45Very low222 Ų222144.8 Ų144.884%0.83883%0.825SS**  cis81.190.515.3-150.6-176.8-155.7-106.34116.3
7S45.8Very low44.8Very low130 Ų130150.4 Ų150.491%0.90983%0.832SS**  trans-155.7139150.4-166.40000108.1
8G40.7Very low44.5Very low56 Ų56145.6 Ų145.658%0.57782%0.822SS**  cis-174.8141-6.600000112.9
9Y41.6Very low44.3Very low234 Ų234148.8 Ų148.892%0.91882%0.82SS**  trans57.6135.5161.8-73.1-85.2000122
10G43.3Very low44.2Very low64 Ų64151.9 Ų151.966%0.6682%0.82SS**  trans-114.2-142.9168.700000111.5
11P60.1Low44.1Very low129 Ų129155 Ų15584%0.83882%0.822SS**  trans-92.6171.7-144.937.4-40.1000116.1
12S41.4Very low43.9Very low120 Ų120147.4 Ų147.484%0.83980%0.802SS**  trans-136.2138.9164.7-64.40000111.3
13D41.7Very low44.6Very low168 Ų168148 Ų14890%0.89880%0.803SS**  trans-76165.6173.8-51.2-98000113.4
14G38Very low44.4Very low72 Ų72147.2 Ų147.274%0.74280%0.804SS**  trans178.611817300000113.1
15P47.4Very low44.3Very low112 Ų112144.4 Ų144.473%0.72781%0.811SS**  trans-116.5173.7-162.743.1-36.3000116
16H42.6Very low43.8Very low168 Ų168135.7 Ų135.778%0.77880%0.798SS**  trans41.5125.9156.1-62.5-60.6000120.2
17Y41.8Very low43.9Very low241 Ų241133 Ų13395%0.94580%0.801SS**  -168.4168.1101.1-97.7-70000108.7
18G38.9Very low44.2Very low64 Ų64132.4 Ų132.466%0.6679%0.791SS**  trans-146.2-178.1-177.300000113.4
19R40.6Very low44.7Very low206 Ų206134.8 Ų134.878%0.77780%0.796SS**  trans66.9119.1179.6177.6-169.5-73.8-168.4-2.9114.4
20Y42.8Very low45.2Very low210 Ų210130 Ų13082%0.82479%0.791SS**  -158.7162.6108.4-115.8-84.8000111.6
21Y42.1Very low45.5Very low217 Ų217135 Ų13585%0.85180%0.797SS**  trans-88.9155.6-176.6-83.8-114000111.6
22G37.6Very low45.7Very low70 Ų70133.9 Ų133.972%0.72279%0.79SS**  trans141157.8141.700000116
23P52.8Low46.4Very low137 Ų137133.7 Ų133.789%0.8979%0.786SS**  trans-113.3150.8-14638.2-28.5000114.5
24G41.3Very low47.1Very low78 Ų78131 Ų13180%0.80478%0.778SS**  trans-142.5128.5165.800000109.4
25G46.1Very low47.8Very low88 Ų88131.9 Ų131.991%0.90777%0.77SS**  trans-77.8158.1-18000000112.8
26G42.7Very low47.8Very low64 Ų64135 Ų13566%0.6678%0.779SS**  trans172.378.1-178.700000111.4V28G26-V28 PolarHBondContact O-N 3.43Å
27D53.2Low48Very low166 Ų166136.4 Ų136.489%0.88878%0.779SS**  trans-58.9115.3176-66.6-99.2000111.5
28V51.4Low48.4Very low117 Ų117130.6 Ų130.671%0.70977%0.771SS**  trans-128101.2170.4-177.20000108.3G26 V30G26-V28 PolarHBondContact O-N 3.43Å; V28-V30 PolarHBondContact O-N 3.08Å
29P51.6Low48.7Very low105 Ų105135.9 Ų135.968%0.68278%0.784SS**  trans-62.6108.7172.4-2334.7000110.4H31P29-H31 PolarHBondContact O-N 2.94Å
30V52.5Low48.8Very low134 Ų134136.8 Ų136.881%0.81279%0.787SS**  trans-7198.9173.2-179.20000108.2V28 P32V28-V30 PolarHBondContact O-N 3.08Å; V30-P32 WeakPolarHBondContact O-CD 3.36Å
31H49.6Very low48.9Very low168 Ų168132.2 Ų132.278%0.77878%0.783SS**PPolyproline II helixtrans-62122.4171.7-80-97.7000109.8P29P29-H31 PolarHBondContact O-N 2.94Å
32P64.3Low49Very low106 Ų106128.5 Ų128.569%0.68877%0.773SS**PPolyproline II helixtrans-67.6150167.429.9-33.8000109.8V30V30-P32 WeakPolarHBondContact O-CD 3.36Å
33P55.8Low49.8Very low117 Ų117129.7 Ų129.776%0.7677%0.768SS**PPolyproline II helixtrans-64148.4175.728.1-34.7000110.9
34P56.3Low49.6Very low112 Ų112128.5 Ų128.573%0.72776%0.761SS**PPolyproline II helixtrans-65.6145.9178.328.5-35000111.1L36P34-L36 PolarHBondContact O-N 2.74Å
35P52.7Low49.7Very low90 Ų90132 Ų13258%0.58476%0.756SS**PPolyproline II helixtrans-65.1135.7175.527.8-34.1000110.6Y37P35-Y37 HydrophobicContact CG-CE2 4.11Å; P35-Y37 WeakPolarHBondContact O-CD2 3.47Å; P35-Y37 PolarHBondContact O-N 3.46Å
36L47.7Very low49.7Very low176 Ų176132 Ų13292%0.92174%0.74SS**  trans-71.497.1169.5-69.7172.2000108.9P34P34-L36 PolarHBondContact O-N 2.74Å
37Y46.2Very low50.4Low198 Ų198133.2 Ų133.278%0.77674%0.736SS**  trans-61.3133.4170.4-67.9-85.3000110P35P35-Y37 HydrophobicContact CG-CE2 4.11Å; P35-Y37 WeakPolarHBondContact O-CD2 3.47Å; P35-Y37 PolarHBondContact O-N 3.46Å
38P49.9Very low50.2Low120 Ų120131.9 Ų131.978%0.77973%0.727SS**  trans-56.3143.7167-23.634.2000110.7R40P38-R40 PolarHBondContact O-N 3.13Å
39L45.9Very low50.1Low175 Ų175128.9 Ų128.992%0.91671%0.712SS**  trans-59.6105.6172.1-88.9154.6000109.4P41L39-P41 WeakPolarHBondContact O-CD 3.2Å
40R42Very low50.3Low225 Ų225127 Ų12785%0.84969%0.691SS**PPolyproline II helixtrans-58.1125171.1-173.9-175.3-169.5-179.84.5108P38 E42P38-R40 PolarHBondContact O-N 3.13Å; R40-E42 PolarHBondContact O-N 2.61Å
41P44.5Very low50.5Low113 Ų113126 Ų12673%0.73467%0.673SS**PPolyproline II helixtrans-56.1126.6169.9-24.434.6000109.6L39L39-P41 WeakPolarHBondContact O-CD 3.2Å
42E45.8Very low50.4Low140 Ų140123.3 Ų123.365%0.65467%0.668SS**PPolyproline II helixtrans-63.2123.8169-173.5177.5144.300107.4R40 Q45R40-E42 PolarHBondContact O-N 2.61Å; E42-Q45 PolarHBondContact OE1-NE2 3.09Å
43P53.6Low49.6Very low95 Ų95128.8 Ų128.862%0.61768%0.675SS**PPolyproline II helixtrans-63.3134.9171.228-32.8000107.8Q45P43-Q45 PolarHBondContact O-N 3.44Å; P43-Q45 VanDerWaalsContact O-N 3.08Å
44P47.7Very low48.9Very low112 Ų112126.7 Ų126.773%0.72767%0.674SS**PPolyproline II helixtrans-54.6122.7179.923.8-33.6000108.8
45Q43.7Very low48Very low152 Ų152124.6 Ų124.671%0.7167%0.673SS**PPolyproline II helixtrans-60.3127.2-171.6-63.9-162.511.800109.6E42 P43E42-Q45 PolarHBondContact OE1-NE2 3.09Å; P43-Q45 PolarHBondContact O-N 3.44Å; P43-Q45 VanDerWaalsContact O-N 3.08Å
46P46.9Very low47.3Very low86 Ų86123.5 Ų123.556%0.55868%0.678SS**PPolyproline II helixtrans-60.7141.8177.626.6-34000108.7I48 Y392P46-I48 PolarHBondContact O-N 3.49Å; P46-Y392 HydrophobicContact CB-CE1 4.15Å
47P56.6Low47.3Very low91 Ų91121.2 Ų121.259%0.59167%0.674SS**PPolyproline II helixtrans-54.7129.1172.124.5-33000108.7S49 Y392P47-S49 PolarHBondContact O-N 3.1Å; P47-Y392 HydrophobicContact CG-CD2 4.32Å
48I50.2Low47Very low137 Ų137116.1 Ų116.170%0.70367%0.673SS**PPolyproline II helixtrans-48.7116.4-172.1-59.2167.2000109.5P46 W50P46-I48 PolarHBondContact O-N 3.49Å; I48-W50 PolarHBondContact O-N 3.08Å
49S48.2Very low46.4Very low54 Ų54119 Ų11938%0.37868%0.676SS.*  trans-50.6114.1-178.91790000109.5P47 R51 V52P47-S49 PolarHBondContact O-N 3.1Å; S49-R51 PolarHBondContact O-N 3.2Å; S49-V52 WeakPolarHBondContact O-CB 3.5Å; S49-V52 WeakPolarHBondContact O-CG2 3.39Å; S49-V52 PolarHBondContact O-N 3.13Å
50W56.6Low46.1Very low65 Ų65117.3 Ų117.325%0.24667%0.673CS.*G310 helixtrans-70.2-11.9-164.154.9-96.9000112.5I48 V52 R53 E396 A408 L411 L412I48-W50 PolarHBondContact O-N 3.08Å; W50-V52 PolarHBondContact O-N 3.26Å; W50-V52 VanDerWaalsContact O-N 3.09Å; W50-R53 WeakPolarHBondContact O-CB 3.29Å; W50-R53 PolarHBondContact O-N 2.63Å; W50-E396 VanDerWaalsContact NE1-CD 3.29Å; W50-E396 PolarHBondContact NE1-OE1 3.17Å; W50-E396 VanDerWaalsContact NE1-OE1 3.17Å; W50-E396 PolarHBondContact NE1-OE2 3.46Å; W50-A408 HydrophobicContact CH2-CB 4.05Å; W50-L411 HydrophobicContact CD2-CD2 3.67Å; W50-L411 HydrophobicContact CE3-CD2 3.53Å; W50-L411 HydrophobicContact CG-CD2 4.38Å; W50-L411 HydrophobicContact CH2-CD2 3.99Å; W50-L411 HydrophobicContact CZ2-CD2 4.11Å; W50-L411 HydrophobicContact CZ3-CD2 3.7Å; W50-L412 HydrophobicContact CZ2-CD2 4.38Å; W50-L412 HydrophobicContact CZ2-CG 4.49Å
51R55.5Low45.7Very low113 Ų113112.1 Ų112.143%0.42667%0.667SS.*G310 helixtrans-48.2-31.8164.9-59.7-169.5-173.7-72.73.5111.9S49 E399S49-R51 PolarHBondContact O-N 3.2Å; R51-E399 IonicContact CZ-OE2 2.81Å; R51-E399 VanDerWaalsContact CZ-OE2 3.26Å; R51-E399 IonicContact NE-OE2 2.76Å; R51-E399 PolarHBondContact NE-OE2 2.96Å; R51-E399 VanDerWaalsContact NE-OE2 3.08Å; R51-E399 IonicContact NH2-OE2 3.51Å; R51-E399 PolarHBondContact NH2-OE2 3.03Å
52V49.2Very low45.3Very low112 Ų112117.9 Ų117.968%0.67967%0.674SS**G310 helixtrans-74.2-21.2178.8-178.50000113.5S49 W50 G54S49-V52 WeakPolarHBondContact O-CB 3.5Å; S49-V52 WeakPolarHBondContact O-CG2 3.39Å; S49-V52 PolarHBondContact O-N 3.13Å; W50-V52 PolarHBondContact O-N 3.26Å; W50-V52 VanDerWaalsContact O-N 3.09Å; V52-G54 PolarHBondContact O-N 2.92Å
53R46.7Very low44.7Very low221 Ų221119.8 Ų119.883%0.83469%0.688SS**G310 helixtrans-79.31.1-175.1-167.9173.1-76.8-95.53.3113.8W50W50-R53 WeakPolarHBondContact O-CB 3.29Å; W50-R53 PolarHBondContact O-N 2.63Å
54G40.6Very low43.7Very low73 Ų73118 Ų11875%0.75369%0.686SS**G310 helixtrans-143.534.7-167.200000116.4V52V52-G54 PolarHBondContact O-N 2.92Å
55G37Very low43.1Very low68 Ų68122.4 Ų122.470%0.70170%0.697SS**  trans-129.2138.3175.800000112.9
56G39.3Very low42.6Very low67 Ų67119 Ų11969%0.69170%0.704SS**  trans-71.8177.9162.200000111.6A58G56-A58 PolarHBondContact O-N 2.87Å
57P46.8Very low42Very low129 Ų129118.9 Ų118.984%0.83872%0.718SS**  trans-59.2126.3178.626.1-34.1000110.6E59P57-E59 PolarHBondContact O-N 2.79Å
58A39.6Very low41.1Very low90 Ų90118.8 Ų118.874%0.74473%0.733SS**  trans-65.7129.6178.500000110.6G56 T60G56-A58 PolarHBondContact O-N 2.87Å; A58-T60 PolarHBondContact O-N 3.42Å
59E37.8Very low40.4Very low181 Ų181115.9 Ų115.985%0.84674%0.737SS**  trans-77.388-175.5-62.6177.6124.900110.7P57 T61P57-E59 PolarHBondContact O-N 2.79Å; E59-T61 PolarHBondContact O-N 2.67Å; E59-T61 PolarHBondContact O-OG1 3.22Å
60T39.3Very low39.9Very low139 Ų139120.5 Ų120.585%0.85376%0.757SS**  trans-64.593.7-179.3-46.20000111.2A58 W62A58-T60 PolarHBondContact O-N 3.42Å; T60-W62 PolarHBondContact O-N 2.69Å
61T34.3Very low38.9Very low117 Ų117121 Ų12172%0.71878%0.783SS**  trans-75.4107.4-175.5-64.20000111E59E59-T61 PolarHBondContact O-N 2.67Å; E59-T61 PolarHBondContact O-OG1 3.22Å
62W35.3Very low37.9Very low233 Ų233124.7 Ų124.788%0.88380%0.798SS**  trans38.4112.7159.6-61.3107000119.4T60T60-W62 PolarHBondContact O-N 2.69Å
63L34.5Very low37.2Very low181 Ų181129.4 Ų129.495%0.94881%0.805SS**  trans-128119.8136.8-138172.7000106.4
64G32Very low36.6Very low57 Ų57123.5 Ų123.559%0.58880%0.798SS**  trans-127.6126.2-172.700000112
65E35.5Very low36.3Very low204 Ų204125.7 Ų125.795%0.95380%0.802SS**  trans-146.4156.8156-139.3167.698.300109.6
66G33.2Very low36.1Very low82 Ų82126.5 Ų126.585%0.84581%0.81SS**  trans-85.2168.7-159.300000116.3
67G33Very low35.8Very low83 Ų83127.3 Ų127.386%0.85682%0.818SS**  trans168.996.3171.900000112.4
68G38.3Very low35.1Very low88 Ų88125.2 Ų125.291%0.90781%0.812SS**  trans-82.3149.2168.600000111.3
69G34.6Very low34.9Very low76 Ų76131.9 Ų131.978%0.78482%0.818SS**  trans-171.6102.5177.300000113
70D38.8Very low35.2Very low151 Ų151128.5 Ų128.581%0.80781%0.811SS**  trans-71.5132.8174.4-60.6-76.2000111.4Y72D70-Y72 HydrophobicContact CB-CE2 4.37Å
71G35.2Very low35.3Very low77 Ų77130 Ų13079%0.79481%0.809SS**  trans-145.274.6-167.100000114.3
72Y35.2Very low35.8Very low189 Ų189129.9 Ų129.974%0.74181%0.81SS**  trans-54.7138.4-172.3-57.7-94000118D70D70-Y72 HydrophobicContact CB-CE2 4.37Å
73Y35Very low35.6Very low212 Ų212122 Ų12283%0.83180%0.801SS**  trans68.2153.7159.9-63.8-65.9000118.2
74S34.3Very low36Very low96 Ų96126 Ų12667%0.67180%0.803SS**  cis-152.315012.8-147.60000115.4
75S34.1Very low36.1Very low120 Ų120127.9 Ų127.984%0.83981%0.813SS**  trans39123.4149.1-61.70000122.6
76G32.3Very low36.4Very low85 Ų85122.6 Ų122.688%0.87681%0.814SS**  trans-175.560.2167.800000118.5
77G32.5Very low36.3Very low84 Ų84121.6 Ų121.687%0.86680%0.803SS**  trans93.4138.7164.900000116.3
78A32.8Very low36.9Very low84 Ų84123.4 Ų123.469%0.69480%0.803SS**  trans-139.6118.2-177.100000111.7
79W34.2Very low36.9Very low231 Ų231128 Ų12888%0.87580%0.8SS**  trans63.3164.5152.7-62.4119.8000117.4
80P45.3Very low37.2Very low109 Ų109132.8 Ų132.871%0.70880%0.802SS**  cis-126163.412.342.2-27.8000117.1
81E41.9Very low37.4Very low170 Ų170134.5 Ų134.579%0.79481%0.805SS**  trans-79.1138.2154.6178.3-179.1116.100109.9
82P43.4Very low37.7Very low116 Ų116139.3 Ų139.375%0.75381%0.807SS**  trans-129.5113.1160.334.6-19.7000113.4
83G30.6Very low38.5Very low66 Ų66135.2 Ų135.268%0.6880%0.803SS**  trans75.7120.3130.800000119.1A85G83-A85 PolarHBondContact O-N 2.78Å
84R43.3Very low39.1Very low266 Ų266130.7 Ų130.7100%1.00480%0.8SS**  trans-62.7118.4158.3-67.6-177.9176.7-158.4-1.3110.3
85A33.7Very low39.4Very low97 Ų97135.1 Ų135.180%0.80280%0.804SS**  trans-128.7137.3161.600000109.2G83 G87G83-A85 PolarHBondContact O-N 2.78Å; A85-G87 PolarHBondContact O-N 2.76Å
86G42.6Very low40.3Very low93 Ų93135.6 Ų135.696%0.95980%0.804SS**  trans-77.3120176.700000110.9
87G31.9Very low40.8Very low60 Ų60137 Ų13762%0.61980%0.8SS**  trans-145.3115.1176.200000110.9A85 H89A85-G87 PolarHBondContact O-N 2.76Å; G87-H89 PolarHBondContact O-N 3.37Å
88S44.1Very low41.1Very low122 Ų122143.2 Ų143.285%0.85380%0.799SS**  trans-81.282.6-177.554.40000111.5Q90S88-Q90 PolarHBondContact O-N 3.21Å
89H39.8Very low41.6Very low184 Ų184144.7 Ų144.785%0.85280%0.795SS**  trans-80.794.1168.3-85.5-87.1000110.7G87 E91G87-H89 PolarHBondContact O-N 3.37Å; H89-E91 PolarHBondContact O-N 2.83Å
90Q39.9Very low42.1Very low177 Ų177139.1 Ų139.183%0.82779%0.791SS**  trans-81.8101.5169-178.1173.543.900108.8S88 Q92S88-Q90 PolarHBondContact O-N 3.21Å; Q90-Q92 PolarHBondContact O-N 3.35Å
91E42.5Very low42.2Very low187 Ų187138.8 Ų138.887%0.87478%0.784SS**PPolyproline II helixtrans-61.4127.8170.5-70.7-171.386.700110.1H89H89-E91 PolarHBondContact O-N 2.83Å
92Q41.2Very low42.5Very low178 Ų178140 Ų14083%0.83278%0.783SS**PPolyproline II helixtrans-82.7129177.7-71.3-173.1-26.500110.2Q90Q90-Q92 PolarHBondContact O-N 3.35Å
93P53Low42.4Very low102 Ų102145.7 Ų145.766%0.66279%0.789SS**PPolyproline II helixtrans-68.2144.3168.529.6-33.7000110.1Y95P93-Y95 PolarHBondContact O-N 3.45Å
94P47.6Very low43Very low118 Ų118149.4 Ų149.477%0.76679%0.793SS**SBendtrans-72.510.4-169.528.4-36.1000115.9
95Y40.8Very low42.5Very low189 Ų189141.5 Ų141.574%0.74178%0.779SS**  trans-137.8105.2178.6-73.5-79.4000111.2P93 S97P93-Y95 PolarHBondContact O-N 3.45Å; Y95-S97 VanDerWaalsContact C-N 3.25Å; Y95-S97 PolarHBondContact O-N 3.04Å
96P52.3Low43Very low130 Ų130142.6 Ų142.684%0.84478%0.781SS**THydrogen-bonded Turntrans-78.1-2.6-174.831.6-36.5000114.6
97S43Very low43Very low114 Ų114143 Ų14380%0.79778%0.775SS**THydrogen-bonded Turntrans-1015.6-167.5-500000115.3Y95Y95-S97 VanDerWaalsContact C-N 3.25Å; Y95-S97 PolarHBondContact O-N 3.04Å
98Y40.3Very low43.6Very low214 Ų214151.7 Ų151.784%0.83979%0.789SS**  trans-114.4120.3179-122.3-92.7000112
99N43.3Very low43.3Very low115 Ų115151.8 Ų151.862%0.61579%0.789SS**  trans-82.7117.3-178.6-176.9-7.1000110.8N101N99-N101 PolarHBondContact O-N 3.27Å; N99-N101 WeakPolarHBondContact OD1-CB 3.25Å; N99-N101 PolarHBondContact OD1-N 3.44Å; N99-N101 PolarHBondContact OD1-ND2 3.06Å
100S44.2Very low43Very low114 Ų114154 Ų15480%0.79779%0.79SS**G310 helixtrans-62.2-8.3-177.1-157.60000115.1Y102S100-Y102 PolarHBondContact O-N 2.99Å
101N46.9Very low43Very low103 Ų103149.4 Ų149.455%0.55178%0.783SS**G310 helixtrans-83.2-2.9-175.5-68-76.8000115.4N99 W103 N104N99-N101 PolarHBondContact O-N 3.27Å; N99-N101 WeakPolarHBondContact OD1-CB 3.25Å; N99-N101 PolarHBondContact OD1-N 3.44Å; N99-N101 PolarHBondContact OD1-ND2 3.06Å; N101-W103 PolarHBondContact O-N 3.25Å; N101-N104 PolarHBondContact O-N 2.86Å
102Y48.9Very low43Very low196 Ų196146.4 Ų146.477%0.76978%0.78SS**G310 helixtrans-62.1-29.5-175.6-157.4-93.5000113.7S100S100-Y102 PolarHBondContact O-N 2.99Å
103W39.7Very low42.7Very low234 Ų234148.1 Ų148.189%0.88678%0.78SS**G310 helixtrans-94-7.4-179.5-77.2103.9000115.3N101N101-W103 PolarHBondContact O-N 3.25Å
104N43.7Very low41.9Very low144 Ų144148.6 Ų148.677%0.7778%0.783SS**  trans-121.245.3-179.4-87.7-56.2000112.5N101N101-N104 PolarHBondContact O-N 2.86Å
105S32.7Very low41.3Very low100 Ų100148.2 Ų148.270%0.69978%0.783SS**  trans-92.2107.6166.1-70.60000110.2A107S105-A107 PolarHBondContact O-N 3.28Å
106S45.6Very low41.3Very low120 Ų120145.1 Ų145.184%0.83978%0.784SS**PPolyproline II helixtrans-50.5127.6175.5-51.90000111.1R108S106-R108 PolarHBondContact O-N 3.31Å; S106-R108 VanDerWaalsContact O-N 3.14Å
107A42Very low40.6Very low101 Ų101149 Ų14984%0.83578%0.783SS**PPolyproline II helixtrans-57.6118.4-170.800000112.1S105 S109S105-A107 PolarHBondContact O-N 3.28Å; A107-S109 PolarHBondContact O-N 3.43Å
108R43.6Very low40.5Very low244 Ų244149.4 Ų149.492%0.92178%0.783SS**PPolyproline II helixtrans-64.8127.5167.5-71.7-175.2176-173.3-0.8108.7S106 R110S106-R108 PolarHBondContact O-N 3.31Å; S106-R108 VanDerWaalsContact O-N 3.14Å; R108-R110 PolarHBondContact O-N 2.95Å; R108-R110 VanDerWaalsContact O-N 3.13Å
109S37.6Very low40.5Very low123 Ų123146 Ų14686%0.8678%0.784SS**  trans-60.8114177.436.40000110.8A107A107-S109 PolarHBondContact O-N 3.43Å
110R34.1Very low40.3Very low231 Ų231151.5 Ų151.587%0.87280%0.796SS**PPolyproline II helixtrans-75.7122.6174.6-170.4179.5-174.1-173.42.2108.8R108R108-R110 PolarHBondContact O-N 2.95Å; R108-R110 VanDerWaalsContact O-N 3.13Å
111A41.1Very low40.4Very low81 Ų81151.7 Ų151.767%0.66980%0.795SS**PPolyproline II helixtrans-61.4139.317700000111.2
112P41.6Very low39.9Very low124 Ų124155.9 Ų155.981%0.80581%0.811SS**PPolyproline II helixtrans-64142.9174.2-21.433.4000112.2
113Y35.7Very low39.6Very low214 Ų214154.6 Ų154.684%0.83982%0.817SS**PPolyproline II helixtrans-75.9138.4167-117.7-101.2000109.6S115Y113-S115 PolarHBondContact O-N 3.32Å
114P35.1Very low39.3Very low111 Ų111151.8 Ų151.872%0.72181%0.813SS**PPolyproline II helixtrans-70.3125.1169.629.3-32.5000109.9
115S36.1Very low39.2Very low110 Ų110148.4 Ų148.477%0.76981%0.813SS**PPolyproline II helixtrans-103.6120.1174-1730000110Y113Y113-S115 PolarHBondContact O-N 3.32Å
116T40.2Very low39.4Very low125 Ų125152.8 Ų152.877%0.76782%0.822SS**  trans-10574.2-173.5-49.90000111.1
117Y36.6Very low38.8Very low210 Ų210151.8 Ų151.882%0.82482%0.815SS**  trans-138.9133.5167.3-87-79.9000111.3
118P42.4Very low38.5Very low123 Ų123154.8 Ų154.880%0.79982%0.816SS**PPolyproline II helixtrans-77.5135.2-176.830.5-34.3000112.3
119V39.7Very low38.2Very low142 Ų142149.1 Ų149.186%0.86180%0.804SS**PPolyproline II helixtrans-66.9135169173.90000109.6
120R39.2Very low38Very low231 Ų231148.9 Ų148.987%0.87280%0.803SS**PPolyproline II helixtrans-100.7134.7174-169.2174.6-174163.42.3109.6
121P46.5Very low37.8Very low118 Ų118147.8 Ų147.877%0.76680%0.8SS**PPolyproline II helixtrans-61.8158.7-178.7-26.235.8000115
122E36.3Very low37.6Very low191 Ų191149.9 Ų149.989%0.89381%0.805SS**PPolyproline II helixtrans-64160.1-178.1-59.3165.4107.900113.4
123L42.5Very low37.4Very low169 Ų169151 Ų15189%0.88580%0.804SS**  trans-141.9113.2167.6-124.2167.8000111.4
124Q34.2Very low37.4Very low175 Ų175144.2 Ų144.282%0.81880%0.799SS**  trans-6.5123.8170-146.668.28.300118
125G40.3Very low37.4Very low74 Ų74143.4 Ų143.476%0.76380%0.802SS**  trans-72163.5-17700000115.9
126Q37.4Very low37.3Very low191 Ų191149.8 Ų149.889%0.89381%0.811SS**  trans-133.6132.3168.7-63.9-176-2.100108.7
127S33.5Very low37.2Very low99 Ų99147.2 Ų147.269%0.69281%0.809SS**  trans-81.4118.517645.20000110.6N129S127-N129 PolarHBondContact O-N 2.97Å; S127-N129 VanDerWaalsContact O-N 3.08Å
128L35Very low37.7Very low164 Ų164142.9 Ų142.986%0.85981%0.806SS**  trans-82.387.6177.2-164.270.4000110.1
129N37.8Very low37.4Very low125 Ų125142.5 Ų142.567%0.66880%0.802SS**PPolyproline II helixtrans-66150.7176.4-70.4-44.2000112S127 Y131S127-N129 PolarHBondContact O-N 2.97Å; S127-N129 VanDerWaalsContact O-N 3.08Å; N129-Y131 PolarHBondContact O-N 2.63Å
130S32Very low37.1Very low119 Ų119145.8 Ų145.883%0.83280%0.8SS**PPolyproline II helixtrans-60.1126.8-175.1-47.90000113.4
131Y31.3Very low37.7Very low208 Ų208140.5 Ų140.582%0.81680%0.796SS**PPolyproline II helixtrans-80.1119.8167.1-81.6-86.9000110.7N129N129-Y131 PolarHBondContact O-N 2.63Å
132T35.6Very low38.3Very low125 Ų125140.7 Ų140.777%0.76780%0.797SS**  trans-131.8126.9165.71790000109.6
133N37.1Very low38.2Very low148 Ų148135.1 Ų135.179%0.79179%0.791SS**  trans-105.4137.1162.5-57.3-72.9000105.2
134G37.7Very low38.2Very low71 Ų71133.4 Ų133.473%0.73279%0.79SS**  cis92.5127.225.200000109.8
135A33.9Very low38.2Very low93 Ų93128.5 Ų128.577%0.76979%0.787SS**  cis-163.2156-7.500000110.3
136Y35.1Very low38Very low245 Ų245129.3 Ų129.396%0.96179%0.786SS**  trans-148.2128.5157.7-91.3-76.3000110.3
137G36.5Very low37.9Very low70 Ų70128.5 Ų128.572%0.72279%0.788SS**  trans-101.5-169.9169.400000111.8
138P46.9Very low37.9Very low119 Ų119130.2 Ų130.277%0.77379%0.794SS**  cis-144.6138.740.237-15.8000119.2
139T36.1Very low37.9Very low116 Ų116127.5 Ų127.571%0.71280%0.796SS**  60.890.3118.3-41.10000122.6
140Y34.3Very low37.5Very low211 Ų211126.5 Ų126.583%0.82780%0.798SS**  trans65.2166.6140.3-73.6-63.1000120.3
141P52.2Low37.6Very low120 Ų120132.3 Ų132.378%0.77980%0.804SS**  cis-124.4174.51642.9-27.9000117.4
142P59.3Low37.7Very low121 Ų121128 Ų12879%0.78680%0.804SS**  trans-93.6157.8-177.836.7-35.1000114.8
143G32.8Very low37.5Very low75 Ų75126 Ų12677%0.77381%0.807SS**  trans-152.3163.4173.200000113
144P44.2Very low37.4Very low133 Ų133122.6 Ų122.686%0.86480%0.8SS**  trans-122.9160.5-150.340.6-29000117
145G33.7Very low37.2Very low72 Ų72129.4 Ų129.474%0.74281%0.805SS**  103.4127.1129.900000118.9
146A36.3Very low37.3Very low90 Ų90135.9 Ų135.974%0.74481%0.812SS**  trans50126.7150.100000120.8
147N34.1Very low37.3Very low175 Ų175128.3 Ų128.394%0.93680%0.8SS**  -149126.9129-101.2-52.1000110.3
148T33.3Very low37.9Very low134 Ų134130.6 Ų130.682%0.82280%0.802SS**  trans-110.4128.1178.650.40000110
149A35.1Very low37.2Very low108 Ų108128.1 Ų128.189%0.89380%0.797SS**  trans-143.9105.4167.300000109.7
150S30.9Very low37.1Very low104 Ų104133.9 Ų133.973%0.72781%0.808SS**  trans-82.8148.8176.5-54.30000111.3
151Y33.5Very low37.3Very low241 Ų241129.6 Ų129.695%0.94580%0.804SS**  trans-131.1134.8148-111.6-88.5000109.5
152S33.6Very low36.4Very low118 Ų118131.8 Ų131.883%0.82580%0.804SS**  trans-98.7148-172.5-58.50000111.6
153G31.7Very low35Very low81 Ų81130.3 Ų130.384%0.83579%0.793SS**  trans176.279.1175.400000112.6
154A34Very low35Very low77 Ų77132 Ų13264%0.63679%0.792SS**  trans-91.4156.4175.900000111.7
155Y34.8Very low34.3Very low215 Ų215136.4 Ų136.484%0.84379%0.793SS**  159.3159.7116.1-82.5-63.6000112.5
156Y34.3Very low34.4Very low229 Ų229138.5 Ų138.590%0.89880%0.797SS**  trans74.7106.4174.5-71.5-77.8000120.7
157A35.7Very low34.2Very low86 Ų86140 Ų14071%0.71180%0.797SS**  trans-118.1-175.4140.300000106.4
158P49.8Very low34.2Very low118 Ų118140.4 Ų140.477%0.76679%0.793SS**  cis-137.9165.21.742-24.9000117
159G32.4Very low34.5Very low66 Ų66140.5 Ų140.568%0.6879%0.793SS**  56.8127.3128.800000123.2
160Y33.7Very low35.2Very low237 Ų237141.2 Ų141.293%0.92979%0.789SS**  trans-139.7168.4149.3-86.3-71.5000110.8
161T37.2Very low35.2Very low121 Ų121141 Ų14174%0.74279%0.787SS**  trans-138.8169.6-166.858.70000113.6
162Q33.8Very low35.2Very low167 Ų167134.8 Ų134.878%0.7878%0.775SS**  trans97.5130.9151.1-77-170.188.700123.4
163T30.1Very low35.1Very low90 Ų90137.9 Ų137.955%0.55277%0.769SS**  trans64.4107.1138.756.30000123.5
164S33.8Very low35.1Very low109 Ų109143.6 Ų143.676%0.76277%0.766SS**  40.8121.8105.1-46.80000121.5
165Y28.7Very low34.9Very low226 Ų226145.3 Ų145.389%0.88677%0.773SS**  trans-138.4157.2147.5-70.5-74.6000110.9
166S34.7Very low34.7Very low117 Ų117140.9 Ų140.982%0.81877%0.773SS**  trans-140.4143.4180-178.60000109.1
167T34Very low34.5Very low122 Ų122133.2 Ų133.275%0.74876%0.764SS**  trans-150.497.3-176.5-51.50000111.9
168E33Very low34.3Very low183 Ų183136.5 Ų136.586%0.85577%0.77SS**  trans16.4150.8140.247.8-168.597.500123.2
169V38.6Very low33.7Very low135 Ų135136.5 Ų136.582%0.81877%0.773SS**  trans-121.4151.9-178.1-162.50000109.7
170P51.1Low34.4Very low124 Ų124139 Ų13981%0.80578%0.777SS**  trans-140.4105.6138.233.5-17.4000115.9
171S31.3Very low34.4Very low99 Ų99134 Ų13469%0.69277%0.771SS**  45.7143126.2-160.80000123.7
172T32Very low34.9Very low111 Ų111134 Ų13468%0.68177%0.773SS**  trans85105.8147.4-4.20000120
173Y32.3Very low35Very low183 Ų183132.5 Ų132.572%0.71878%0.775SS**  -165.9136101.6-125.2-121000114.7
174R31.3Very low35.1Very low201 Ų201133.4 Ų133.476%0.75879%0.785SS**  trans48.1123.9160.7-69.2-172.8-165.5-72.7-4.5122.7
175S30.3Very low35.1Very low112 Ų112138.9 Ų138.978%0.78379%0.789SS**  trans-58.8176.2148.8-18.90000112.7
176S29.8Very low35.1Very low122 Ų122139.8 Ų139.885%0.85379%0.791SS**  cis-169.3151.513.530.70000110.3
177G30.5Very low35Very low69 Ų69141.7 Ų141.771%0.71179%0.791SS**  trans179.197.4169.400000116.6
178N32.8Very low34.8Very low155 Ų155146.4 Ų146.483%0.82980%0.796SS**  trans44.795.1152-59.111.6000120.9
179S36.6Very low35.4Very low117 Ų117143.2 Ų143.282%0.81879%0.791SS**  47.3164.7109.7-35.70000121.6
180P46.1Very low35Very low119 Ų119145.3 Ų145.377%0.77379%0.792SS**  -130.6159-94.933.7-13.6000115.7
181T35.4Very low34.3Very low133 Ų133148 Ų14882%0.81679%0.794SS**  trans-96.8119.9168.141.70000111.6V183T181-V183 PolarHBondContact O-N 3.27Å
182P47.3Very low34.3Very low119 Ų119150.2 Ų150.277%0.77380%0.798SS**  trans-84.9110.9176.731.6-32000111.8
183V35.1Very low34.3Very low136 Ų136149.3 Ų149.382%0.82480%0.796SS**  trans-106.4105.1163.1175.80000108.4T181T181-V183 PolarHBondContact O-N 3.27Å
184S33.1Very low34.1Very low110 Ų110148.5 Ų148.577%0.76980%0.798SS**  trans-101.7100.8179.2-62.70000111.1
185R33.4Very low34.1Very low223 Ų223144 Ų14484%0.84279%0.793SS**  trans-98.7125.2166-173.3-177-69.4-132.92.3108.6
186W28.6Very low34Very low245 Ų245147.5 Ų147.593%0.92880%0.797SS**  trans-66.5136-177.2-59.888.2000112.3
187I32.3Very low34.2Very low157 Ų157145.8 Ų145.881%0.80579%0.791SS**  trans-136.3139.4168.6-70.1-174.2000109.3
188Y31Very low35.2Very low221 Ų221148.1 Ų148.187%0.86779%0.793SS**PPolyproline II helixtrans-69.3140.2176.7-112.5-106.8000112
189P43.8Very low36.5Very low116 Ų116145.5 Ų145.575%0.75379%0.785SS**PPolyproline II helixtrans-80.7119.9166.831.7-30.9000110.9
190Q31.4Very low36.4Very low179 Ų179147.4 Ų147.484%0.83679%0.785SS**PPolyproline II helixtrans-90.3140160.3-124-97.2-7400107.8
191Q36.4Very low35.6Very low180 Ų180153.6 Ų153.684%0.84179%0.792SS**  trans-104.3132.9175.7-75.4-174.2-3400110.2
192D31.3Very low35.4Very low147 Ų147150.6 Ų150.679%0.78679%0.788SS**  trans-140.6173.3154.8-142.5-46.5000109.3
193C30.8Very low34.7Very low92 Ų92153.3 Ų153.362%0.62279%0.791SS**  trans-104.5-172.4-138.7-58.70000116.2
194Q29.2Very low34.7Very low166 Ų166152.5 Ų152.578%0.77679%0.786SS**  trans87.1139.4159.8-50.5-57.4-44.400116.9
195T30.9Very low35.5Very low105 Ų105153.2 Ų153.264%0.64479%0.788SS**  cis-165.7169.8-21-120.90000113.7
196E28.8Very low35.3Very low186 Ų186145.6 Ų145.687%0.86978%0.778SS**  trans72.8166.4166.3-141.2129.1112.500119.8
197A33.8Very low35.6Very low87 Ų87145 Ų14572%0.71978%0.778SS**  trans-143.3-159.2-164.400000111
198P51.2Low36.3Very low117 Ų117143 Ų14376%0.7678%0.775SS**  trans-121.2-144.4-133.541.7-19.7000110.6
199P59.8Low36.4Very low101 Ų101137.4 Ų137.466%0.65677%0.774SS**  cis-132.6-173.5-17.328.1-4.4000114.1
200L35.3Very low36.1Very low156 Ų156137.6 Ų137.682%0.81778%0.778SS**  156.5154.9116.5-81.9176.6000116.5
201R29.6Very low36.6Very low249 Ų249137.8 Ų137.894%0.9478%0.779SS**  trans78.8118.9151.6-99.2-178.7-179.1-169.41.8121.7
202G30.8Very low36.3Very low71 Ų71137 Ų13773%0.73278%0.781SS**  trans177.5141.8160.300000110.6
203Q32.5Very low36.9Very low175 Ų175135.7 Ų135.782%0.81878%0.781SS**  trans-128.2125.3-170.4-69.5-84.633.500113.1
204V35Very low37.1Very low120 Ų120134.7 Ų134.773%0.72779%0.785SS**  34.5143.6109.2-178.10000118.4
205P49.1Very low37.5Very low125 Ų125135.8 Ų135.881%0.81279%0.793SS**  cis-137.9-172.3-18.540.5-22.4000115.8
206G30Very low37.9Very low62 Ų62137.4 Ų137.464%0.63980%0.803SS**  trans162.182.5149.800000122.6
207Y35.4Very low38.5Very low233 Ų233136.6 Ų136.691%0.91480%0.803SS**  trans55.4172.8154.3-67.1-79.8000119.5
208P45.3Very low39Very low115 Ų115137.9 Ų137.975%0.74781%0.805SS**  -123.7162.5-77.935.4-18.5000114.5
209A33.3Very low38.2Very low103 Ų103141 Ų14185%0.85181%0.809SS**PPolyproline II helixtrans-81.8140.9174.400000112.6
210S37.2Very low37Very low120 Ų120146 Ų14684%0.83982%0.816SS**PPolyproline II helixtrans-84.2150.1178.149.60000113
211Q41.8Very low37.6Very low184 Ų184144.3 Ų144.386%0.8681%0.814SS**PPolyproline II helixtrans-88.9149.5174.9-63.3175.6-500111.2
212N31.2Very low37.8Very low163 Ų163143.8 Ų143.887%0.87281%0.814SS**  trans-146.6147.5145.1-122.6-105.4000110.4
213P44.6Very low38Very low120 Ų120144.1 Ų144.178%0.77982%0.817SS**  trans-105.7170.1-166.140.3-34.4000113.9
214G33.5Very low38.1Very low70 Ų70143.9 Ų143.972%0.72282%0.821SS**  trans110.489.8156.800000116
215M39Very low38.2Very low190 Ų190140.3 Ų140.394%0.93681%0.809SS**  -167140.2101.8-91.8-55.7168.200109.7
216T39.4Very low37.4Very low139 Ų139141.9 Ų141.985%0.85381%0.811SS**PPolyproline II helixtrans-102.5118.6-173.447.30000112.2
217L40.5Very low37.5Very low168 Ų168150.5 Ų150.588%0.8882%0.824SS**PPolyproline II helixtrans-84.6140.8163.8-123.969000109.4H219L217-H219 PolarHBondContact O-N 2.86Å
218P45.1Very low37.4Very low115 Ų115144.1 Ų144.175%0.74781%0.814SS**PPolyproline II helixtrans-71.5122.9-176.927.6-34000111.9
219H34.1Very low37.2Very low183 Ų183145.2 Ų145.285%0.84782%0.818SS**PPolyproline II helixtrans-83.6117.4175.5-163.2-63.3000109.8L217L217-H219 PolarHBondContact O-N 2.86Å
220Y33.8Very low37.9Very low206 Ų206145.1 Ų145.181%0.80881%0.809SS**PPolyproline II helixtrans-66.5132.1171-84.8-94.8000110Y222Y220-Y222 PolarHBondContact O-N 3.03Å
221P48.8Very low37.8Very low119 Ų119148.2 Ų148.277%0.77381%0.81SS**  trans-86.3110.1175.131.9-31000110.6
222Y33.2Very low37.4Very low239 Ų239144.9 Ų144.994%0.93781%0.807SS**  trans-82.6128.9153.8-115.5-90.5000107.9Y220Y220-Y222 PolarHBondContact O-N 3.03Å
223G34.9Very low37.4Very low78 Ų78140.7 Ų140.780%0.80480%0.802SS**  trans-81.4124.6-178.500000112.3
224D35.5Very low37.3Very low169 Ų169141 Ų14190%0.90480%0.804SS**  trans-114.3155.6155.2-16811.8000108.7
225G35.6Very low37.3Very low46 Ų46144.2 Ų144.247%0.47481%0.81SS.*  trans-113.4168.5-150.800000118.2
226N34.1Very low37Very low158 Ų158141.4 Ų141.485%0.84580%0.803SS**  trans83104.1149.3-44.3-59.9000119.1
227R32.1Very low36.8Very low242 Ų242143.9 Ų143.991%0.91380%0.797SS**  -169.4120.9120-105170.4-170.2-127.21.1114.7
228S32Very low37.1Very low100 Ų100141.5 Ų141.570%0.69979%0.791SS**  trans56.3103.6137.7-50.60000123.1
229V41.2Very low36.4Very low137 Ų137141.7 Ų141.783%0.8378%0.782SS**  55.9135.8113.3170.30000120.1
230P48.4Very low36.3Very low102 Ų102141.3 Ų141.366%0.66278%0.781SS**  cis-140.7-169.5-25.541.3-21.7000114.6
231Q34.1Very low36.3Very low184 Ų184137.6 Ų137.686%0.8678%0.775SS**  trans65.5156.2161.1-77.5-178.3-22.700117.8
232S33.3Very low35.6Very low114 Ų114136 Ų13680%0.79777%0.772SS**  cis-161.6164.6-14.249.90000110.4
233G32.8Very low35.4Very low75 Ų75135.9 Ų135.977%0.77377%0.77SS**  trans123.7138.5166.400000116.1
234P42.8Very low35.3Very low126 Ų126136.7 Ų136.782%0.81877%0.769SS**  trans-116.2155.8-175.540.3-31.4000115.6
235T33.3Very low35.3Very low138 Ų138134.4 Ų134.485%0.84777%0.766SS**  trans-137.2101.4159.1-61.20000112
236V32.8Very low35.7Very low131 Ų131138.2 Ų138.279%0.79478%0.783SS**  trans34.9117.9135.6-174.30000119.9
237R34.8Very low35.7Very low192 Ų192134.1 Ų134.173%0.72578%0.778SS**  trans-79.9152.9160.9-149.1-171.9-179.2119.2-8.7109.6Q239R237-Q239 HydrophobicContact CG-CB 4.19Å; R237-Q239 VanDerWaalsContact CZ-OE1 3.24Å
238P46.4Very low35.7Very low117 Ų117126.7 Ų126.776%0.7677%0.769SS**  -140.6150.691.840.4-26.4000111.7
239Q31.2Very low35.8Very low120 Ų120133.5 Ų133.556%0.56178%0.781SS**  cis6689.638.9-161.880.415.500110.8R237R237-Q239 HydrophobicContact CG-CB 4.19Å; R237-Q239 VanDerWaalsContact CZ-OE1 3.24Å
240E31.1Very low35.5Very low174 Ų174130.8 Ų130.881%0.81378%0.78SS**  -167.1171.88056.4-139.3148.500109
241D33.8Very low34.8Very low129 Ų129135.3 Ų135.369%0.6979%0.794SS**  cis-147.1164.729.9-148.8-31.6000111.5W243D241-W243 PolarHBondContact OD1-NE1 2.98Å
242A33.2Very low34.8Very low86 Ų86130.2 Ų130.271%0.71179%0.792SS**  trans-140.9108.6-173.600000113.1
243W29.9Very low34.9Very low236 Ų236128.6 Ų128.689%0.89479%0.793SS**  trans-130.1114.1174.5-72.794.9000112.1D241D241-W243 PolarHBondContact OD1-NE1 2.98Å
244A33.7Very low35Very low94 Ų94135.2 Ų135.278%0.77780%0.795SS**  trans-96.3151.7170.400000110.8
245S34.8Very low34.8Very low122 Ų122138.5 Ų138.585%0.85379%0.792SS**  trans-75.4150.9-169-40.80000114.8
246P44.1Very low35.3Very low125 Ų125137 Ų13781%0.81278%0.784SS**  trans-106.8128.4158.935-27.2000113.3
247G34.4Very low35.3Very low73 Ų73142.3 Ų142.375%0.75379%0.79SS**  trans55101.113800000122.1
248A31.9Very low35.8Very low86 Ų86138.5 Ų138.571%0.71179%0.791SS**  trans37.2122.7131.600000121.8
249Y34.6Very low35.1Very low243 Ų243138.9 Ų138.995%0.95380%0.796SS**  167.6132.5112.1-95.3-72.6000109.9
250G33.3Very low35.1Very low79 Ų79138.9 Ų138.981%0.81481%0.809SS**  trans163.1118.4175.500000115.1
251M33.9Very low35.5Very low197 Ų197135.3 Ų135.397%0.9781%0.809SS**  trans-59.9148.4-178.1-94.4-75.4-150.400116.2
252G34.3Very low36.1Very low78 Ų78135.4 Ų135.480%0.80482%0.817SS**  97.881.3126.200000119.5
253G36.3Very low35.9Very low80 Ų80137 Ų13783%0.82582%0.823SS**  trans-151.9147.5163.200000110.7
254R35Very low36.2Very low214 Ų214129.6 Ų129.681%0.80881%0.813SS**  trans-110.2125.8-170.7-69.8-159.4-165.8-118.912.6114.2
255Y38Very low37Very low195 Ų195130.7 Ų130.777%0.76581%0.812SS**  trans67.2152.2153.1-59.4-45.1000116
256P44.3Very low37.8Very low105 Ų105130.9 Ų130.968%0.68281%0.81SS**  cis-146.717946.545.2-25.5000119.1
257W32.8Very low37.2Very low243 Ų243128.3 Ų128.392%0.9281%0.806SS**  trans51.4117.8164.3-64.3104.5000120.4
258P44.5Very low37Very low113 Ų113132.3 Ų132.373%0.73481%0.81SS**  trans-95.5126.1165.834.6-28.4000112.8
259S32.2Very low37.1Very low125 Ų125135.1 Ų135.187%0.87481%0.812SS**  trans-82.5138.6154.5-68.70000109.3
260S32Very low37.1Very low119 Ų119133.1 Ų133.183%0.83280%0.804SS**  trans-154.4110174.9-740000112.1
261A39Very low37Very low99 Ų99137 Ų13782%0.81880%0.803SS**  trans-116.5133.2160.400000107.8
262P45.1Very low36.8Very low132 Ų132133.4 Ų133.486%0.85779%0.793SS**  trans-82.9146.4-172.831.8-34.7000113.5
263S30.7Very low36.5Very low119 Ų119138.3 Ų138.383%0.83280%0.795SS**  trans-93.4167.5159.5-151.20000107.9
264A35.5Very low36.4Very low81 Ų81139.1 Ų139.167%0.66979%0.788SS**  cis-153.9-139.12400000112.3
265P50.9Low36.3Very low117 Ų117135.8 Ų135.876%0.7679%0.791SS**  -128.3-146.8-128.443.4-19.7000111.5
266P51.7Low36Very low126 Ų126131.9 Ų131.982%0.81879%0.793SS**  cis-133.2173.2-14.740.6-23.7000116.1
267G31.3Very low36Very low70 Ų70131.9 Ų131.972%0.72279%0.792SS**  trans175.9135.8164.300000112.8
268N30.1Very low36.2Very low158 Ų158131.4 Ų131.485%0.84579%0.791SS**  trans-132.9161.7-175-78.6-43.7000112.8
269L33.3Very low36.2Very low145 Ų145132 Ų13276%0.75979%0.794SS**  trans110.2144.8150.2-56.5179.3000119.1
270Y35.8Very low36.1Very low200 Ų200131.2 Ų131.278%0.78479%0.789SS**  trans69.7121.1175.4-62.4-80.2000115.5
271M31Very low36.2Very low160 Ų160131.1 Ų131.179%0.78879%0.788SS**  69.7130.766.5-66.5-82.4-175.500111.4
272T28.3Very low35.8Very low122 Ų122130.2 Ų130.275%0.74879%0.789SS**  cis-152.4179.216.4-34.20000110.9
273E28.7Very low35.4Very low182 Ų182129.7 Ų129.785%0.8579%0.788SS**  trans102.6133.3145-155.8157.7123.700120
274S33.3Very low36Very low97 Ų97129.5 Ų129.568%0.67878%0.784SS**  trans-80.5144.4-176.4-46.20000112.8
275T33.4Very low35.8Very low144 Ų144135 Ų13588%0.88380%0.796SS**  179.1158.7112.326.90000112.7
276S32.8Very low35.1Very low113 Ų113134.9 Ų134.979%0.7980%0.798SS**  trans-99.6-175.4175.2-44.50000110.2
277P44.1Very low34.8Very low104 Ų104134.1 Ų134.168%0.67579%0.793SS**  -131.7125.1-101.434.8-14.4000115.4
278W36.5Very low35.3Very low234 Ų234136.8 Ų136.889%0.88680%0.797SS**  trans63.9164.9175.9-51.692.2000113.8
279P45.4Very low35.7Very low125 Ų125134.4 Ų134.481%0.81279%0.793SS**  -122.816460.836.4-24.3000114.3
280S30.1Very low36.4Very low109 Ų109133.2 Ų133.276%0.76279%0.794SS**  trans-98.1131168.3-1800000111
281S33Very low36.8Very low117 Ų117129.8 Ų129.882%0.81880%0.796SS**  trans-156.7146.5159.768.90000110.4
282G30.2Very low36.9Very low80 Ų80130.5 Ų130.583%0.82580%0.802SS**  trans104.480.217300000116.3
283S37.5Very low37.2Very low120 Ų120133.8 Ų133.884%0.83981%0.809SS**  trans-75.6159.4139.9-69.20000108.8
284P42.8Very low37.5Very low115 Ų115133.9 Ų133.975%0.74781%0.81SS**  cis-138.3158.720.840.8-24.2000117.1
285Q31.1Very low38.1Very low198 Ų198134.5 Ų134.593%0.92581%0.811SS**  trans-169.3161.3137.8-111.5165.5-13.500113.1
286S37.3Very low37.9Very low114 Ų114135.6 Ų135.680%0.79780%0.804SS**PPolyproline II helixtrans-97172.5-175.7-54.50000111.7
287P45.5Very low37.7Very low110 Ų110136.5 Ų136.571%0.71480%0.8SS**PPolyproline II helixtrans-90.3164-144.836.2-39.4000116.3
288P40.7Very low37.1Very low126 Ų126137.4 Ų137.482%0.81881%0.809SS**PPolyproline II helixtrans-85.7126.416233.7-30.3000111.8
289S39.7Very low36.7Very low108 Ų108131.7 Ų131.776%0.75580%0.804SS**PPolyproline II helixtrans-90145.9171.9-550000112
290P47Very low35.9Very low119 Ų119135.1 Ų135.177%0.77380%0.803SS**PPolyproline II helixtrans-70.4161.9157.831.4-32.6000111.1
291P43.4Very low36.6Very low128 Ų128135.7 Ų135.783%0.83180%0.803SS**PPolyproline II helixtrans-88.4160.9-152.333.3-37.7000116.7
292L33.5Very low36.3Very low175 Ų175139.2 Ų139.292%0.91680%0.8SS**PPolyproline II helixtrans-67.8144.7171.6-68.1158.4000112.5
293Q34.5Very low36.5Very low192 Ų192139 Ų13990%0.89779%0.786SS**  trans-134.7114.6154.8-73.1-166.51.300110.9
294Q36.3Very low36.2Very low184 Ų184141 Ų14186%0.8678%0.782SS**  trans-163163.9164-90.8-153.30.800107.5
295P46Very low35.6Very low109 Ų109140.2 Ų140.271%0.70878%0.779SS**  cis-109.7-160.30.427-4000110.4
296K28Very low35.6Very low168 Ų168138.7 Ų138.773%0.7377%0.772SS**  cis-175.6147.738.8-178159.9171.71680116.3
297D29.5Very low35.6Very low131 Ų131141.3 Ų141.370%0.70177%0.772SS**  trans74142.7157-69.1-6.2000124.7
298S31.1Very low34.8Very low124 Ų124140.2 Ų140.287%0.86777%0.767SS**  trans66.9133.6170.4-76.70000119.5
299S29.1Very low34.7Very low114 Ų114142.7 Ų142.780%0.79777%0.77SS**  cis-152.7156.7-3.1-176.30000112.1
300Y28.4Very low34.2Very low197 Ų197145.1 Ų145.177%0.77377%0.774SS**  trans-80.9167.9169.1-101.3-98.8000111.4
301P43.9Very low33.5Very low120 Ų120150.3 Ų150.378%0.77978%0.778SS**  cis-115.315339.113.411.3000115.1
302Y27Very low33.1Very low192 Ų192152 Ų15275%0.75378%0.775SS**  64119.865.6-156.6-104.7000113.2
303S34.1Very low33Very low75 Ų75150.5 Ų150.552%0.52477%0.768SS.*  cis-139.8-152.16.9-1520000109.3
304Q30.5Very low33Very low161 Ų161149.1 Ų149.175%0.75276%0.759SS**  cis-161.8158.48.2-156.1165.2-47.500111.5
305S31.3Very low33Very low99 Ų99145.8 Ų145.869%0.69275%0.753SS**  trans56.7122.8162.4440000118.5
306E31.3Very low32.4Very low167 Ų167147 Ų14778%0.7876%0.763SS**  cis106139.141.8-89.8-77.1103.900111.6
307Q36.2Very low32.5Very low169 Ų169144.3 Ų144.379%0.7977%0.765SS**  trans63.8127174.4-59.8177.21100116.9
308S29.1Very low32.8Very low87 Ų87144.2 Ų144.261%0.60877%0.769SS**  cis108.6109.316.276.90000114.6
309M38.4Very low33Very low178 Ų178147 Ų14788%0.87777%0.768SS**  trans52.9112.2145.2-48176-15000119.2
310N28.7Very low33.1Very low159 Ų159149 Ų14985%0.8577%0.765SS**  trans-149.4170.2136.9-134.1-80.6000114.2
311R32.9Very low33.4Very low227 Ų227150 Ų15086%0.85777%0.769SS**  trans-110.5131.9-174-48.2-177.678.6179.74.3108.9N313R311-N313 PolarHBondContact O-N 2.91Å
312H35.6Very low32.8Very low164 Ų164151.6 Ų151.676%0.75977%0.766SS**  trans-74.391.8175.7-81.1-76.1000111.6F314H312-F314 HydrophobicContact CB-CD2 4.22Å; H312-F314 HydrophobicContact CB-CE2 3.72Å; H312-F314 HydrophobicContact CB-CZ 4.27Å; H312-F314 AromaticContact CG-CE2 3.96Å; H312-F314 AromaticContact ND1-CE2 3.75Å; H312-F314 AromaticContact ND1-CZ 3.36Å; H312-F314 WeakPolarHBondContact ND1-CZ 3.42Å
313N31.3Very low33Very low143 Ų143148 Ų14877%0.76577%0.769SS**  trans-85.9135.2155.4-173.631.4000108.3R311R311-N313 PolarHBondContact O-N 2.91Å
314F34.8Very low32.9Very low164 Ų164150.3 Ų150.372%0.71979%0.785SS**  trans-128.9109.8178.9-76.6-66.7000110.5H312H312-F314 HydrophobicContact CB-CD2 4.22Å; H312-F314 HydrophobicContact CB-CE2 3.72Å; H312-F314 HydrophobicContact CB-CZ 4.27Å; H312-F314 AromaticContact CG-CE2 3.96Å; H312-F314 AromaticContact ND1-CE2 3.75Å; H312-F314 AromaticContact ND1-CZ 3.36Å; H312-F314 WeakPolarHBondContact ND1-CZ 3.42Å
315P36.1Very low32.8Very low114 Ų114146.2 Ų146.274%0.7479%0.786SS**PPolyproline II helixtrans-79.2136168.132.2-31.6000110.3S317P315-S317 PolarHBondContact O-N 2.97Å
316C32.6Very low33Very low133 Ų133147.6 Ų147.690%0.89979%0.791SS**PPolyproline II helixtrans-75.1120.2164.2-93.70000109.3
317S31.3Very low33.1Very low113 Ų113145.4 Ų145.479%0.7979%0.788SS**PPolyproline II helixtrans-87.6137172.3-167.30000110.3P315P315-S317 PolarHBondContact O-N 2.97Å
318V34.9Very low32.8Very low129 Ų129144 Ų14478%0.78279%0.786SS**PPolyproline II helixtrans-101.6128.4174.9175.80000108.4Q320V318-Q320 PolarHBondContact O-N 3.4Å; V318-Q320 VanDerWaalsContact O-N 3.13Å
319H35.7Very low32.9Very low182 Ų182146.8 Ų146.884%0.84379%0.794SS**  trans-72.5102.8172.4-76.2-85000110.3
320Q31.4Very low32.7Very low156 Ų156145.1 Ų145.173%0.72979%0.789SS**  trans-72.7123.3165.8-178168.8-12.300109.2V318 E322V318-Q320 PolarHBondContact O-N 3.4Å; V318-Q320 VanDerWaalsContact O-N 3.13Å; Q320-E322 PolarHBondContact NE2-OE2 2.71Å
321Y33.3Very low32.8Very low217 Ų217144.1 Ų144.185%0.85178%0.784SS**  trans-89.2118.117151.5-86.1000108.3
322E32.9Very low33Very low154 Ų154138.3 Ų138.372%0.7278%0.778SS**  trans-149.9111.2172.3-142.4168.7125.700111.5Q320Q320-E322 PolarHBondContact NE2-OE2 2.71Å
323S31.5Very low33Very low118 Ų118137.7 Ų137.783%0.82578%0.78SS**  trans-169.7138.1176.4-80.60000107.6
324S32Very low33.1Very low122 Ų122138.2 Ų138.285%0.85378%0.782SS**  cis-139.9148.68.8-59.40000112.5
325G28.2Very low33.4Very low75 Ų75138.3 Ų138.377%0.77379%0.789SS**  trans-112.9136.8159.200000109.9
326T33.8Very low33.4Very low129 Ų129139.7 Ų139.779%0.79179%0.79SS**  trans-65146.2-171.3-174.30000115.1
327V35.1Very low33.4Very low121 Ų121138.3 Ų138.373%0.73378%0.781SS**  -163.2121.8127.5-95.80000112.8
328N30.1Very low33.4Very low139 Ų139141.2 Ų141.274%0.74378%0.782SS**  trans60.2154.4138.5-56-20.7000123.3
329N31Very low33.4Very low146 Ų146140.2 Ų140.278%0.78178%0.776SS**  trans-77.9-179.2175.9-33.7-60.3000111
330D32.8Very low33.4Very low143 Ų143141 Ų14177%0.76578%0.78SS**  cis-163.8166.331.9-133.6-51.3000114.1
331D32.1Very low33.6Very low138 Ų138144 Ų14474%0.73879%0.786SS**  trans68.2154.8154.8-155.9-114.5000124.3
332S36.6Very low33.9Very low105 Ų105139.1 Ų139.173%0.73478%0.784SS**  trans86111.2158.3-81.60000122.2
333D34.9Very low34.1Very low151 Ų151136.3 Ų136.381%0.80779%0.787SS**  trans-63.1168.4177-90.5-76.1000119.3
334L33.9Very low34.5Very low154 Ų154139 Ų13981%0.80679%0.787SS**  trans69.4138.4161.3-66.3155.5000116.2
335L41.8Very low35.3Very low165 Ų165139.1 Ų139.186%0.86478%0.784SS**  cis-142.218040.2-79.2167.8000115
336D35.9Very low36Very low144 Ų144144.8 Ų144.877%0.7779%0.791SS**  trans-67.4168.8-165.3-162.649.3000119.3
337C32.8Very low36.2Very low104 Ų104147.1 Ų147.170%0.70380%0.798SS**  trans-23.2156.4170.9-69.30000119.9
338Q31.7Very low36.3Very low173 Ų173152.7 Ų152.781%0.80881%0.807SS**  -172.6162.873.5-156.6-175.3-18.200114.8
339V34.4Very low36.5Very low108 Ų108149.2 Ų149.266%0.65580%0.804SS**  trans54.495.5165.6-810000119.7
340Q36Very low36.5Very low198 Ų198150 Ų15093%0.92581%0.808SS**  trans-83.3135.7143.5-66.7169.5-70.300109.6
341Y35.5Very low36.6Very low219 Ų219148 Ų14886%0.85981%0.812SS**  trans-108.8102.6165-107.8-89.6000109.3
342S37.9Very low36.7Very low116 Ų116147.9 Ų147.981%0.81182%0.816SS**  trans-116134.1163.9-172.80000108.1
343A38.8Very low36.6Very low95 Ų95147.1 Ų147.179%0.78581%0.811SS**  trans-136.5101-17500000110.2
344E39.8Very low36.6Very low175 Ų175147.3 Ų147.382%0.81881%0.812SS**  trans-106.1131.7172.8-164.2175.3149.300109Q346E344-Q346 PolarHBondContact O-N 2.69Å
345P47.9Very low36.6Very low123 Ų123147.9 Ų147.980%0.79981%0.81SS**PPolyproline II helixtrans-75.1121.8-171.528.9-34.3000112.1
346Q42.9Very low36.7Very low195 Ų195145.4 Ų145.491%0.91180%0.804SS**PPolyproline II helixtrans-75.1151.9-177.1-68.3-172.1-7.400114E344E344-Q346 PolarHBondContact O-N 2.69Å
347L38.5Very low36.3Very low178 Ų178144.2 Ų144.293%0.93280%0.797SS**PPolyproline II helixtrans-69.3154.2-178.1-84.5156.6000114.2
348Y36.2Very low36.3Very low237 Ų237145.8 Ų145.893%0.92980%0.799SS**PPolyproline II helixtrans-94.9131.8167.7-163.5-86.8000109.7
349G34.3Very low36.6Very low67 Ų67146.5 Ų146.569%0.69180%0.802SS**  trans129.793.7170.400000114.5
350N32.4Very low36.5Very low162 Ų162147.7 Ų147.787%0.86681%0.805SS**  trans-134.9113.8174.148.9-12.6000111.3
351A33.3Very low36.5Very low101 Ų101147 Ų14784%0.83580%0.802SS**  trans-144134.4169.900000110.5
352T35.8Very low36.2Very low136 Ų136141.5 Ų141.583%0.83480%0.795SS**  trans-41.7157.7167.9360000116.2
353S34.8Very low36.1Very low89 Ų89141.9 Ų141.962%0.62280%0.798SS**  cis-166.6177.3-2.251.30000112.4
354D32.9Very low35.7Very low155 Ų155142.7 Ų142.783%0.82980%0.798SS**  trans69.5134.5155.5-61.3-60.6000119.7
355H34.8Very low35.5Very low165 Ų165141.7 Ų141.776%0.76480%0.797SS**  trans-124.4141.7175.9179.944.2000108.3N357H355-N357 PolarHBondContact CE1-N 3.33Å
356P43.4Very low35.3Very low113 Ų113141.9 Ų141.973%0.73480%0.799SS**  trans-142.1133.1131.933.6-18.9000115.3
357N28.7Very low34.9Very low119 Ų119141.4 Ų141.464%0.63680%0.797SS**  72.1102.8129.2-164.449.8000120.4H355H355-N357 PolarHBondContact CE1-N 3.33Å
358N32.4Very low35Very low137 Ų137140.9 Ų140.973%0.73379%0.789SS**  trans40.4112.8142.4-69.5-72.5000120.8
359Q37Very low35.2Very low189 Ų189140.9 Ų140.988%0.88379%0.788SS**  -158.2164.9120-118.2173.8-1.100112.9
360D32.3Very low35.6Very low133 Ų133142.9 Ų142.971%0.71179%0.786SS**  trans-66.6138.2-166.1-50.3-112000115.6
361Q36.2Very low36.4Very low182 Ų182140.7 Ų140.785%0.8578%0.781SS**  -176.2157.9116.6-103.6155.4104.900116.2
362S30.6Very low36.7Very low104 Ų104140.5 Ų140.573%0.72777%0.773SS**  trans48102.7154.760.70000118.9
363S34.4Very low37.2Very low124 Ų124141.3 Ų141.387%0.86777%0.772SS**  trans-56131.3149.952.10000112.1
364S31.8Very low38.1Very low113 Ų113145.4 Ų145.479%0.7978%0.782SS**  trans-128.3123.8156.449.50000109.2
365L35.9Very low39.6Very low153 Ų153143.2 Ų143.280%0.80178%0.779SS**  trans-68.9160.1166.9-107.381.1000109.4E367L365-E367 PolarHBondContact O-N 3.12Å
366P42.1Very low41.7Very low127 Ų127138.2 Ų138.283%0.82576%0.76SS**  trans-61.4106.4160.5-1429.2000108.2E368P366-E368 PolarHBondContact O-N 3.45Å
367E35.3Very low43.6Very low186 Ų186135.4 Ų135.487%0.86974%0.742SS**  trans-66.5121.6-179-165.516310500109.6L365 R369L365-E367 PolarHBondContact O-N 3.12Å; E367-R369 PolarHBondContact O-N 2.87Å
368E41Very low46.5Very low166 Ų166134.8 Ų134.878%0.77674%0.744SS**  trans-55.5118.8177.4-177.3174.397.900109P366 V370P366-E368 PolarHBondContact O-N 3.45Å; E368-V370 PolarHBondContact O-N 2.97Å
369R40.8Very low49.4Very low238 Ų238129.1 Ų129.190%0.89872%0.715SS**  trans-73.276.6176.4-72.1-159-165.992.8-1110.5E367 P371E367-R369 PolarHBondContact O-N 2.87Å; R369-P371 VanDerWaalsContact O-CD 3.26Å; R369-P371 WeakPolarHBondContact O-CD 3.44Å
370V41.8Very low52.1Low109 Ų109121.5 Ų121.566%0.66168%0.68SS**  trans-58.5114.1160.2-158.90000106.7E368 S372E368-V370 PolarHBondContact O-N 2.97Å; V370-S372 PolarHBondContact O-N 3.41Å; V370-S372 VanDerWaalsContact O-N 3.11Å
371P50.1Low55.1Low115 Ų115120.8 Ų120.875%0.74767%0.671SS**  trans-70.1114.4-176.227.1-32.4000109R369 N373R369-P371 VanDerWaalsContact O-CD 3.26Å; R369-P371 WeakPolarHBondContact O-CD 3.44Å; P371-N373 PolarHBondContact O-N 2.88Å
372S39.2Very low57.9Low97 Ų97117.5 Ų117.568%0.67865%0.654SS**  trans-48.9126.7-173.6-175.30000112.2V370 E374V370-S372 PolarHBondContact O-N 3.41Å; V370-S372 VanDerWaalsContact O-N 3.11Å; S372-E374 PolarHBondContact O-N 3.42Å
373N46.4Very low61Low153 Ų153112.7 Ų112.782%0.81862%0.62SS**THydrogen-bonded Turntrans-78.237.9-163.753-76.5000114.5P371P371-N373 PolarHBondContact O-N 2.88Å
374E53.3Low63.9Low176 Ų176110.6 Ų110.682%0.82260%0.598SS**THydrogen-bonded Turntrans-13316.6-178.8-145.6-169.8127.100114.3S372S372-E374 PolarHBondContact O-N 3.42Å
375S64.8Low67Low109 Ų109109.5 Ų109.576%0.76258%0.58SS**  trans-134.311.1-178.3-131.30000117.3P377S375-P377 WeakPolarHBondContact O-CD 3.08Å
376T78Confident69.9Low60 Ų60102.3 Ų102.337%0.36854%0.542SS..  trans-67.3118.2172.6-35.20000110.1I380 K381 I384T376-I380 HydrophobicContact CG2-CB 3.93Å; T376-I380 HydrophobicContact CG2-CG2 3.5Å; T376-I380 VanDerWaalsContact CG2-CG2 3.5Å; T376-K381 HydrophobicContact CG2-CG 3.94Å; T376-K381 VanDerWaalsContact O-CE 3.25Å; T376-K381 WeakPolarHBondContact O-CE 3.35Å; T376-I384 HydrophobicContact CG2-CD1 4.4Å
377P84.1Confident72.5Confident54 Ų5499 Ų9935%0.35152%0.518SS..  trans-67152.2-177.127.5-34.6000111.1S375 S379 I380 K381S375-P377 WeakPolarHBondContact O-CD 3.08Å; P377-S379 PolarHBondContact O-N 3.1Å; P377-S379 VanDerWaalsContact O-N 3.12Å; P377-I380 HydrophobicContact CG-CB 4.02Å; P377-I380 HydrophobicContact CG-CG1 3.67Å; P377-I380 PolarHBondContact O-N 3.48Å; P377-K381 PolarHBondContact O-N 2.93Å
378P90.1Very high75.4Confident105 Ų10594.8 Ų94.868%0.68250%0.498SS*.Hα-helixtrans-62.2-26.1-17224.5-34.6000113.4K382P378-K382 WeakPolarHBondContact O-CG 3.31Å; P378-K382 PolarHBondContact O-N 2.66Å; P378-K382 VanDerWaalsContact O-N 3.07Å
379S92.1Very high78.1Confident19 Ų1989 Ų8913%0.13347%0.47CS..Hα-helixtrans-67.9-45.5172.748.30000112.9P377 K381 K382 I383 E427 V434P377-S379 PolarHBondContact O-N 3.1Å; P377-S379 VanDerWaalsContact O-N 3.12Å; S379-K381 VanDerWaalsContact C-N 3.34Å; S379-K381 PolarHBondContact O-N 3.34Å; S379-K382 WeakPolarHBondContact O-CB 3.16Å; S379-K382 PolarHBondContact O-N 3.08Å; S379-I383 WeakPolarHBondContact O-CG1 3.47Å; S379-I383 PolarHBondContact O-N 3.26Å; S379-E427 VanDerWaalsContact CB-O 3.28Å; S379-E427 WeakPolarHBondContact CB-O 3.44Å; S379-V434 WeakPolarHBondContact OG-CG2 3.36Å
380I94.5Very high80.8Confident29 Ų2977.8 Ų77.815%0.14943%0.428CS..Hα-helixtrans-62.5-41.3172-66.9-67.7000110.6T376 P377 K382 I383 I384 V434 A437T376-I380 HydrophobicContact CG2-CB 3.93Å; T376-I380 HydrophobicContact CG2-CG2 3.5Å; T376-I380 VanDerWaalsContact CG2-CG2 3.5Å; P377-I380 HydrophobicContact CG-CB 4.02Å; P377-I380 HydrophobicContact CG-CG1 3.67Å; P377-I380 PolarHBondContact O-N 3.48Å; I380-K382 VanDerWaalsContact C-N 3.29Å; I380-K382 PolarHBondContact O-N 2.86Å; I380-I383 HydrophobicContact CD1-CD1 4.35Å; I380-I383 PolarHBondContact O-N 2.94Å; I380-I383 VanDerWaalsContact O-N 3.09Å; I380-I384 HydrophobicContact CG2-CD1 3.66Å; I380-I384 HydrophobicContact CG2-CG1 4.14Å; I380-I384 WeakPolarHBondContact O-CG1 3.33Å; I380-I384 PolarHBondContact O-N 3.41Å; I380-V434 HydrophobicContact CD1-CB 4.37Å; I380-V434 HydrophobicContact CD1-CG2 4.08Å; I380-V434 HydrophobicContact CG1-CG2 4.03Å; I380-A437 HydrophobicContact CD1-CB 3.91Å
381K94Very high83.4Confident118 Ų11876.8 Ų76.851%0.51342%0.416SS..Hα-helixtrans-58.3-39.8176.1-66.8-172.5175.9-179.20112.2T376 P377 S379 H385T376-K381 HydrophobicContact CG2-CG 3.94Å; T376-K381 VanDerWaalsContact O-CE 3.25Å; T376-K381 WeakPolarHBondContact O-CE 3.35Å; P377-K381 PolarHBondContact O-N 2.93Å; S379-K381 VanDerWaalsContact C-N 3.34Å; S379-K381 PolarHBondContact O-N 3.34Å; K381-H385 PolarHBondContact O-N 3.37Å; K381-H385 VanDerWaalsContact O-N 3.12Å
382K95.5Very high85.6Confident113 Ų11375.5 Ų75.549%0.49140%0.397SS..Hα-helixtrans-64-45.4171.4-74.2-176.2174.7-167.90112.7P378 S379 I380 I384 H385 V386 V426P378-K382 WeakPolarHBondContact O-CG 3.31Å; P378-K382 PolarHBondContact O-N 2.66Å; P378-K382 VanDerWaalsContact O-N 3.07Å; S379-K382 WeakPolarHBondContact O-CB 3.16Å; S379-K382 PolarHBondContact O-N 3.08Å; I380-K382 VanDerWaalsContact C-N 3.29Å; I380-K382 PolarHBondContact O-N 2.86Å; K382-I384 PolarHBondContact O-N 3.27Å; K382-H385 PolarHBondContact O-N 2.87Å; K382-V386 PolarHBondContact O-N 3.5Å; K382-V426 HydrophobicContact CB-CG2 3.88Å; K382-V426 HydrophobicContact CD-CG2 4.08Å
383I96.4Very high88.4Confident3 Ų371 Ų712%0.01537%0.366CS..Hα-helixtrans-62.5-42.6-179.7-65.7160.3000110.9S379 I380 V386 L387 L423 V426 V434 A437 R438 A441S379-I383 WeakPolarHBondContact O-CG1 3.47Å; S379-I383 PolarHBondContact O-N 3.26Å; I380-I383 HydrophobicContact CD1-CD1 4.35Å; I380-I383 PolarHBondContact O-N 2.94Å; I380-I383 VanDerWaalsContact O-N 3.09Å; I383-V386 PolarHBondContact O-N 3.36Å; I383-L387 HydrophobicContact CG2-CD1 4.05Å; I383-L387 WeakPolarHBondContact O-CB 3.43Å; I383-L387 WeakPolarHBondContact O-CG 3.35Å; I383-L387 PolarHBondContact O-N 2.9Å; I383-L423 HydrophobicContact CB-CD1 4.34Å; I383-L423 HydrophobicContact CG1-CD1 3.82Å; I383-L423 HydrophobicContact CG2-CD1 4.2Å; I383-V426 HydrophobicContact CD1-CG1 4.04Å; I383-V426 HydrophobicContact CG1-CB 4.47Å; I383-V426 HydrophobicContact CG1-CG1 4.06Å; I383-V426 HydrophobicContact CG1-CG2 4.3Å; I383-V434 HydrophobicContact CD1-CG1 3.69Å; I383-A437 HydrophobicContact CD1-CB 4.3Å; I383-A437 HydrophobicContact CG2-CB 4.08Å; I383-R438 HydrophobicContact CD1-CB 3.95Å; I383-A441 HydrophobicContact CG2-CB 4.19Å
384I95.9Very high90.8Very high79 Ų7966.1 Ų66.141%0.40534%0.338SS..Hα-helixtrans-58.2-48.6173.3-67.9167.2000110.2T376 I380 K382 V386 L387 E388T376-I384 HydrophobicContact CG2-CD1 4.4Å; I380-I384 HydrophobicContact CG2-CD1 3.66Å; I380-I384 HydrophobicContact CG2-CG1 4.14Å; I380-I384 WeakPolarHBondContact O-CG1 3.33Å; I380-I384 PolarHBondContact O-N 3.41Å; K382-I384 PolarHBondContact O-N 3.27Å; I384-V386 VanDerWaalsContact C-N 3.33Å; I384-V386 PolarHBondContact O-N 3.04Å; I384-L387 CarbonylContact O-C 3.58Å; I384-L387 WeakPolarHBondContact O-CA 3.4Å; I384-L387 WeakPolarHBondContact O-CB 3.23Å; I384-L387 PolarHBondContact O-N 3.29Å; I384-E388 WeakPolarHBondContact O-CG 3.31Å; I384-E388 PolarHBondContact O-N 3Å
385H96.1Very high92.9Very high91 Ų9164.2 Ų64.242%0.42133%0.329SS..Hα-helixtrans-65.8-32.8-179.2-171.251.4000113.8K381 K382 E388 K389K381-H385 PolarHBondContact O-N 3.37Å; K381-H385 VanDerWaalsContact O-N 3.12Å; K382-H385 PolarHBondContact O-N 2.87Å; H385-E388 WeakPolarHBondContact CA-OE2 3.49Å; H385-E388 IonicContact CE1-OE2 3.8Å; H385-E388 IonicContact CG-OE2 3.75Å; H385-E388 IonicContact ND1-OE2 2.82Å; H385-E388 PolarHBondContact ND1-OE2 2.95Å; H385-K389 WeakPolarHBondContact NE2-CE 3.14Å; H385-K389 WeakPolarHBondContact O-CG 3.37Å; H385-K389 PolarHBondContact O-N 3.49Å
386V96.6Very high94.4Very high1 Ų160.6 Ų60.61%0.00630%0.3CS..Hα-helixtrans-67.4-43.5169.4174.10000110.7K382 I383 I384 E388 K389 V390 E419 E422 L423 I445K382-V386 PolarHBondContact O-N 3.5Å; I383-V386 PolarHBondContact O-N 3.36Å; I384-V386 VanDerWaalsContact C-N 3.33Å; I384-V386 PolarHBondContact O-N 3.04Å; V386-E388 VanDerWaalsContact C-N 3.29Å; V386-E388 PolarHBondContact O-N 3.26Å; V386-K389 PolarHBondContact O-N 2.94Å; V386-V390 HydrophobicContact CG1-CG2 3.96Å; V386-V390 WeakPolarHBondContact O-CB 3.43Å; V386-V390 WeakPolarHBondContact O-CG2 3.14Å; V386-V390 PolarHBondContact O-N 3.13Å; V386-E419 HydrophobicContact CG1-CB 4.13Å; V386-E419 HydrophobicContact CG1-CG 4.24Å; V386-E422 HydrophobicContact CG2-CB 4.34Å; V386-E422 HydrophobicContact CG2-CG 4.17Å; V386-L423 HydrophobicContact CG1-CB 4.25Å; V386-I445 HydrophobicContact CG1-CD1 4.39Å
387L96.3Very high95.3Very high59 Ų5957.7 Ų57.731%0.30928%0.282SS..Hα-helixtrans-60.7-35.4176.9-78.1169.2000112.8I383 I384 V390 Q391 A441 K444I383-L387 HydrophobicContact CG2-CD1 4.05Å; I383-L387 WeakPolarHBondContact O-CB 3.43Å; I383-L387 WeakPolarHBondContact O-CG 3.35Å; I383-L387 PolarHBondContact O-N 2.9Å; I384-L387 CarbonylContact O-C 3.58Å; I384-L387 WeakPolarHBondContact O-CA 3.4Å; I384-L387 WeakPolarHBondContact O-CB 3.23Å; I384-L387 PolarHBondContact O-N 3.29Å; L387-V390 PolarHBondContact O-N 2.99Å; L387-Q391 WeakPolarHBondContact O-CB 3.22Å; L387-Q391 PolarHBondContact O-N 3.04Å; L387-A441 HydrophobicContact CD1-CB 4.26Å; L387-A441 HydrophobicContact CD2-CB 3.65Å; L387-A441 HydrophobicContact CG-CB 3.87Å; L387-K444 HydrophobicContact CD2-CD 4.37Å
388E97.3Very high95.9Very high96 Ų9660.3 Ų60.345%0.44929%0.29SS..Hα-helixtrans-58.5-54.2170.9-70.2165.6173.800111.1I384 H385 V386 V390 Q391 Y392I384-E388 WeakPolarHBondContact O-CG 3.31Å; I384-E388 PolarHBondContact O-N 3Å; H385-E388 WeakPolarHBondContact CA-OE2 3.49Å; H385-E388 IonicContact CE1-OE2 3.8Å; H385-E388 IonicContact CG-OE2 3.75Å; H385-E388 IonicContact ND1-OE2 2.82Å; H385-E388 PolarHBondContact ND1-OE2 2.95Å; V386-E388 VanDerWaalsContact C-N 3.29Å; V386-E388 PolarHBondContact O-N 3.26Å; E388-V390 VanDerWaalsContact C-N 3.32Å; E388-V390 PolarHBondContact O-N 2.99Å; E388-Q391 WeakPolarHBondContact O-CB 3.34Å; E388-Q391 PolarHBondContact O-N 2.72Å; E388-Q391 VanDerWaalsContact O-N 3.12Å; E388-Y392 WeakPolarHBondContact O-CD2 3.32Å; E388-Y392 PolarHBondContact O-N 3.41Å
389K96.8Very high96.2Very high46 Ų4661 Ų6120%0.228%0.284CS..Hα-helixtrans-57.1-45.7176.9-62.4171.2-174.9175.40111.9H385 V386 Q391 Y392 L393 E419 E422H385-K389 WeakPolarHBondContact NE2-CE 3.14Å; H385-K389 WeakPolarHBondContact O-CG 3.37Å; H385-K389 PolarHBondContact O-N 3.49Å; V386-K389 PolarHBondContact O-N 2.94Å; K389-Q391 PolarHBondContact O-N 3.16Å; K389-Y392 PolarHBondContact O-N 2.74Å; K389-L393 PolarHBondContact O-N 3.21Å; K389-E419 HydrophobicContact CB-CG 3.93Å; K389-E419 HydrophobicContact CD-CG 3.78Å; K389-E419 VanDerWaalsContact CD-OE1 3.29Å; K389-E419 WeakPolarHBondContact CD-OE1 3.36Å; K389-E419 IonicContact NZ-OE1 2.72Å; K389-E419 PolarHBondContact NZ-OE1 3.38Å; K389-E422 IonicContact NZ-OE1 3.08Å; K389-E422 PolarHBondContact NZ-OE1 3.24Å; K389-E422 IonicContact NZ-OE2 3.35Å; K389-E422 PolarHBondContact NZ-OE2 3.38Å
390V97.4Very high96.4Very high1 Ų160.5 Ų60.51%0.00628%0.279CS..Hα-helixtrans-64.3-30.1179.7171.50000111.4V386 L387 E388 L393 E394 E419 K444 I445 I448V386-V390 HydrophobicContact CG1-CG2 3.96Å; V386-V390 WeakPolarHBondContact O-CB 3.43Å; V386-V390 WeakPolarHBondContact O-CG2 3.14Å; V386-V390 PolarHBondContact O-N 3.13Å; L387-V390 PolarHBondContact O-N 2.99Å; E388-V390 VanDerWaalsContact C-N 3.32Å; E388-V390 PolarHBondContact O-N 2.99Å; V390-L393 PolarHBondContact O-N 3.31Å; V390-E394 WeakPolarHBondContact O-CB 3.42Å; V390-E394 PolarHBondContact O-N 2.83Å; V390-E419 HydrophobicContact CG2-CB 4.07Å; V390-E419 HydrophobicContact CG2-CG 4.23Å; V390-K444 HydrophobicContact CG1-CD 4.27Å; V390-K444 HydrophobicContact CG1-CG 4.07Å; V390-I445 HydrophobicContact CB-CG1 4.41Å; V390-I445 HydrophobicContact CG1-CG1 3.88Å; V390-I445 HydrophobicContact CG2-CD1 3.91Å; V390-I445 HydrophobicContact CG2-CG1 3.56Å; V390-I448 HydrophobicContact CG1-CD1 3.4Å; V390-I448 VanDerWaalsContact CG1-CD1 3.4Å
391Q97.7Very high96.3Very high88 Ų8865.7 Ų65.741%0.41131%0.312SS..Hα-helixtrans-68.8-36.6174.4-170.456.175.100112.7L387 E388 K389 E394 Q395L387-Q391 WeakPolarHBondContact O-CB 3.22Å; L387-Q391 PolarHBondContact O-N 3.04Å; E388-Q391 WeakPolarHBondContact O-CB 3.34Å; E388-Q391 PolarHBondContact O-N 2.72Å; E388-Q391 VanDerWaalsContact O-N 3.12Å; K389-Q391 PolarHBondContact O-N 3.16Å; Q391-E394 PolarHBondContact NE2-OE2 2.84Å; Q391-E394 PolarHBondContact OE1-OE2 3.46Å; Q391-Q395 PolarHBondContact O-N 2.9Å
392Y96.2Very high96.3Very high88 Ų8861 Ų6135%0.34530%0.297SS..Hα-helixtrans-69.8-43.3172-63.2-69.3000111.5P46 P47 E388 K389 E394 Q395 E396P46-Y392 HydrophobicContact CB-CE1 4.15Å; P47-Y392 HydrophobicContact CG-CD2 4.32Å; E388-Y392 WeakPolarHBondContact O-CD2 3.32Å; E388-Y392 PolarHBondContact O-N 3.41Å; K389-Y392 PolarHBondContact O-N 2.74Å; Y392-E394 VanDerWaalsContact C-N 3.32Å; Y392-E394 PolarHBondContact O-N 3Å; Y392-Q395 WeakPolarHBondContact O-CB 3.3Å; Y392-Q395 PolarHBondContact O-N 3.12Å; Y392-Q395 VanDerWaalsContact O-N 3.12Å; Y392-E396 PolarHBondContact O-N 3.46Å
393L96.3Very high96.2Very high4 Ų461.3 Ų61.32%0.02130%0.298CS..Hα-helixtrans-62.8-36.3176.2-69.4168.2000112.4K389 V390 Q395 E396 V397 L412 M415 L416 E419K389-L393 PolarHBondContact O-N 3.21Å; V390-L393 PolarHBondContact O-N 3.31Å; L393-Q395 VanDerWaalsContact C-N 3.31Å; L393-Q395 PolarHBondContact O-N 3.36Å; L393-E396 PolarHBondContact O-N 3.3Å; L393-V397 WeakPolarHBondContact O-CB 3.43Å; L393-V397 VanDerWaalsContact O-CG2 3.28Å; L393-V397 WeakPolarHBondContact O-CG2 3.35Å; L393-V397 PolarHBondContact O-N 3.43Å; L393-L412 HydrophobicContact CD2-CD2 4.01Å; L393-M415 HydrophobicContact CD1-CB 3.96Å; L393-M415 HydrophobicContact CD2-CB 3.78Å; L393-M415 HydrophobicContact CD2-CE 4.04Å; L393-M415 HydrophobicContact CD2-SD 4.13Å; L393-L416 HydrophobicContact CB-CD2 3.84Å; L393-L416 HydrophobicContact CB-CG 4.33Å; L393-L416 HydrophobicContact CD1-CD2 3.95Å; L393-L416 HydrophobicContact CD1-CG 4.17Å; L393-E419 HydrophobicContact CD1-CG 4.41Å
394E97.5Very high96.2Very high49 Ų4964.8 Ų64.823%0.22931%0.313CS..Hα-helixtrans-60.4-39.7172.5-176.2169.8-117.500112.3V390 Q391 Y392 E398 K444 I448V390-E394 WeakPolarHBondContact O-CB 3.42Å; V390-E394 PolarHBondContact O-N 2.83Å; Q391-E394 PolarHBondContact NE2-OE2 2.84Å; Q391-E394 PolarHBondContact OE1-OE2 3.46Å; Y392-E394 VanDerWaalsContact C-N 3.32Å; Y392-E394 PolarHBondContact O-N 3Å; E394-E398 PolarHBondContact O-N 3.22Å; E394-K444 WeakPolarHBondContact OE1-CE 3.46Å; E394-K444 IonicContact OE1-NZ 3.96Å; E394-K444 WeakPolarHBondContact OE2-CE 3.39Å; E394-K444 IonicContact OE2-NZ 3.22Å; E394-K444 PolarHBondContact OE2-NZ 3.43Å; E394-I448 HydrophobicContact CB-CD1 3.72Å; E394-I448 HydrophobicContact CB-CG1 4.07Å; E394-I448 HydrophobicContact CG-CD1 4.11Å; E394-I448 HydrophobicContact CG-CG1 4.03Å
395Q97.4Very high96.1Very high137 Ų13765.7 Ų65.764%0.6432%0.322SS*.Hα-helixtrans-70.3-41.8175.7-175180-3.100111.7Q391 Y392 L393 V397 E398 E399Q391-Q395 PolarHBondContact O-N 2.9Å; Y392-Q395 WeakPolarHBondContact O-CB 3.3Å; Y392-Q395 PolarHBondContact O-N 3.12Å; Y392-Q395 VanDerWaalsContact O-N 3.12Å; L393-Q395 VanDerWaalsContact C-N 3.31Å; L393-Q395 PolarHBondContact O-N 3.36Å; Q395-V397 VanDerWaalsContact C-N 3.32Å; Q395-V397 PolarHBondContact O-N 3.02Å; Q395-E398 CarbonylContact O-C 3.59Å; Q395-E398 PolarHBondContact O-N 3.48Å; Q395-E398 VanDerWaalsContact O-N 3.1Å; Q395-E399 PolarHBondContact O-N 3.22Å
396E96.4Very high96.1Very high32 Ų3264.2 Ų64.215%0.1532%0.318CS..Hα-helixtrans-66.4-34.1175.7-68.7-171.9159.900112.1W50 Y392 L393 E398 E399 F400 L412W50-E396 VanDerWaalsContact NE1-CD 3.29Å; W50-E396 PolarHBondContact NE1-OE1 3.17Å; W50-E396 VanDerWaalsContact NE1-OE1 3.17Å; W50-E396 PolarHBondContact NE1-OE2 3.46Å; Y392-E396 PolarHBondContact O-N 3.46Å; L393-E396 PolarHBondContact O-N 3.3Å; E396-E398 VanDerWaalsContact C-N 3.35Å; E396-E399 PolarHBondContact O-N 3.31Å; E396-F400 WeakPolarHBondContact O-CB 3.28Å; E396-F400 PolarHBondContact O-N 3.09Å; E396-L412 HydrophobicContact CB-CD2 3.77Å
397V96.9Very high96.1Very high0 Ų072.4 Ų72.40%035%0.353CS..Hα-helixtrans-67.9-33169.7169.80000111.4L393 Q395 F400 L412 L416 I448 K451 L452 K455L393-V397 WeakPolarHBondContact O-CB 3.43Å; L393-V397 VanDerWaalsContact O-CG2 3.28Å; L393-V397 WeakPolarHBondContact O-CG2 3.35Å; L393-V397 PolarHBondContact O-N 3.43Å; Q395-V397 VanDerWaalsContact C-N 3.32Å; Q395-V397 PolarHBondContact O-N 3.02Å; V397-F400 PolarHBondContact O-N 2.86Å; V397-L412 HydrophobicContact CG2-CB 4.48Å; V397-L412 HydrophobicContact CG2-CD1 4.19Å; V397-L412 HydrophobicContact CG2-CD2 4.42Å; V397-L416 HydrophobicContact CG2-CD1 4.15Å; V397-I448 HydrophobicContact CB-CG2 4.07Å; V397-I448 HydrophobicContact CG1-CG2 4.22Å; V397-I448 HydrophobicContact CG2-CG2 3.84Å; V397-K451 HydrophobicContact CG1-CB 4.34Å; V397-K451 HydrophobicContact CG1-CD 4.18Å; V397-K451 HydrophobicContact CG1-CG 4.08Å; V397-L452 HydrophobicContact CG1-CB 3.89Å; V397-L452 HydrophobicContact CG2-CB 4.08Å; V397-L452 HydrophobicContact CG2-CD1 4.24Å; V397-L452 HydrophobicContact CG2-CD2 4.27Å; V397-L452 HydrophobicContact CG2-CG 4.41Å; V397-K455 HydrophobicContact CG1-CD 4.43Å; V397-K455 WeakPolarHBondContact O-CD 3.47Å; V397-K455 VanDerWaalsContact O-CE 3.31Å; V397-K455 WeakPolarHBondContact O-CE 3.42Å; V397-K455 PolarHBondContact O-NZ 3.2Å
398E96.5Very high96.1Very high108 Ų10870.9 Ų70.951%0.50535%0.349SS..Hα-helixtrans-71.3-35.1172.8-163.773.6-6800112.9E394 Q395 E396 F400 K451 K455E394-E398 PolarHBondContact O-N 3.22Å; Q395-E398 CarbonylContact O-C 3.59Å; Q395-E398 PolarHBondContact O-N 3.48Å; Q395-E398 VanDerWaalsContact O-N 3.1Å; E396-E398 VanDerWaalsContact C-N 3.35Å; E398-F400 VanDerWaalsContact C-N 3.35Å; E398-K451 WeakPolarHBondContact OE1-CE 3.49Å; E398-K451 IonicContact OE1-NZ 2.63Å; E398-K451 PolarHBondContact OE1-NZ 2.81Å; E398-K451 WeakPolarHBondContact OE2-CE 3.41Å; E398-K451 IonicContact OE2-NZ 3.43Å; E398-K451 PolarHBondContact OE2-NZ 3.43Å; E398-K455 VanDerWaalsContact C-NZ 3.27Å; E398-K455 PolarHBondContact O-NZ 3.36Å; E398-K455 IonicContact OE1-NZ 2.67Å
399E95.9Very high96.1Very high120 Ų12066.5 Ų66.556%0.56133%0.329SS*.Hα-helixtrans-74.2-24.7170.9-163.4-173.1-143.500112.3R51 Q395 E396 V401R51-E399 IonicContact CZ-OE2 2.81Å; R51-E399 VanDerWaalsContact CZ-OE2 3.26Å; R51-E399 IonicContact NE-OE2 2.76Å; R51-E399 PolarHBondContact NE-OE2 2.96Å; R51-E399 VanDerWaalsContact NE-OE2 3.08Å; R51-E399 IonicContact NH2-OE2 3.51Å; R51-E399 PolarHBondContact NH2-OE2 3.03Å; Q395-E399 PolarHBondContact O-N 3.22Å; E396-E399 PolarHBondContact O-N 3.31Å; E399-V401 PolarHBondContact O-N 3.48Å
400F96.4Very high96.1Very high8 Ų871.3 Ų71.34%0.03535%0.346CS..  trans-59.9122.1-174.2179-95.4000112.7E396 V397 E398 G402 A408 Y409 L412 L452 K455E396-F400 WeakPolarHBondContact O-CB 3.28Å; E396-F400 PolarHBondContact O-N 3.09Å; V397-F400 PolarHBondContact O-N 2.86Å; E398-F400 VanDerWaalsContact C-N 3.35Å; F400-G402 VanDerWaalsContact CZ-C 3.5Å; F400-A408 HydrophobicContact CD2-CB 4.35Å; F400-A408 HydrophobicContact CE2-CB 3.95Å; F400-Y409 HydrophobicContact CE1-CD2 4.34Å; F400-Y409 HydrophobicContact CZ-CD2 4.36Å; F400-L412 HydrophobicContact CB-CD1 4.04Å; F400-L412 HydrophobicContact CD2-CD1 3.79Å; F400-L412 HydrophobicContact CG-CD1 4.07Å; F400-L452 HydrophobicContact CD1-CD1 3.9Å; F400-L452 HydrophobicContact CE1-CD1 4.19Å; F400-L452 HydrophobicContact CG-CD1 4.2Å; F400-K455 HydrophobicContact CD1-CB 4.15Å; F400-K455 PolarHBondContact O-NZ 3.05Å
401V93.1Very high96.1Very high138 Ų13873.5 Ų73.584%0.83636%0.357SS*.  trans-130.3118167.8179.90000106.6E399E399-V401 PolarHBondContact O-N 3.48Å
402G93.1Very high96.1Very high19 Ų1969.4 Ų69.420%0.19634%0.338CS..SBendtrans166.4-167.9-17200000110.6F400 D406 K455F400-G402 VanDerWaalsContact CZ-C 3.5Å; G402-D406 WeakPolarHBondContact CA-OD2 3.31Å; G402-K455 VanDerWaalsContact O-O 3.09Å
403K94.4Very high96.2Very high120 Ų12068.5 Ų68.552%0.52234%0.337SS..  trans-122.9163.5-175-63.7-174.1177.9-169.50113.1T405 D406 Y409 G456K403-T405 WeakPolarHBondContact CB-OG1 3.35Å; K403-T405 PolarHBondContact O-N 3.01Å; K403-D406 PolarHBondContact N-OD2 2.89Å; K403-D406 WeakPolarHBondContact O-CB 3.4Å; K403-D406 PolarHBondContact O-N 2.73Å; K403-Y409 VanDerWaalsContact O-CB 3.31Å; K403-Y409 WeakPolarHBondContact O-CB 3.35Å; K403-G456 CarbonylContact C-O 3.46Å; K403-G456 VanDerWaalsContact CA-O 3.25Å; K403-G456 WeakPolarHBondContact CA-O 3.4Å
404K95.4Very high96.2Very high77 Ų7774.5 Ų74.534%0.33537%0.365SS..THydrogen-bonded Turntrans-60.2-8.6172.3-55.5-166.476.9178.80114.3Y409 W410 E453 G456K404-Y409 HydrophobicContact CB-CD1 4.34Å; K404-Y409 HydrophobicContact CB-CE1 4.29Å; K404-Y409 HydrophobicContact CB-CE2 4.44Å; K404-Y409 HydrophobicContact CD-CE2 4.46Å; K404-Y409 VanDerWaalsContact CE-CZ 3.46Å; K404-Y409 WeakPolarHBondContact CE-OH 3.39Å; K404-Y409 HydrophobicContact CG-CD2 4.22Å; K404-Y409 HydrophobicContact CG-CE1 4.37Å; K404-Y409 HydrophobicContact CG-CE2 3.81Å; K404-W410 PolarHBondContact O-NE1 3.42Å; K404-E453 IonicContact NZ-OE1 3.75Å; K404-E453 PolarHBondContact NZ-OE1 3.24Å; K404-G456 WeakPolarHBondContact CG-O 3.37Å; K404-G456 PolarHBondContact N-O 3.32Å
405T94.5Very high96.2Very high97 Ų9774.8 Ų74.860%0.59537%0.367SS*.THydrogen-bonded Turntrans-85.9-13.9172.148.10000114.2K403K403-T405 WeakPolarHBondContact CB-OG1 3.35Å; K403-T405 PolarHBondContact O-N 3.01Å
406D96.4Very high96.3Very high60 Ų6068.2 Ų68.232%0.32134%0.336SS..SBendtrans-92139.1-164.5-58.6-6.8000110.2G402 K403 A408 Y409 W410G402-D406 WeakPolarHBondContact CA-OD2 3.31Å; K403-D406 PolarHBondContact N-OD2 2.89Å; K403-D406 WeakPolarHBondContact O-CB 3.4Å; K403-D406 PolarHBondContact O-N 2.73Å; D406-A408 PolarHBondContact O-N 3.17Å; D406-Y409 WeakPolarHBondContact O-CA 3.26Å; D406-Y409 WeakPolarHBondContact O-CB 3.4Å; D406-Y409 PolarHBondContact O-N 3.05Å; D406-W410 PolarHBondContact O-N 2.97Å
407K96.7Very high96.3Very high173 Ų17369.6 Ų69.675%0.75235%0.347SS*.Hα-helixtrans-56-29.5-177.9-174.7178.3177.3-174.90113.3L411K407-L411 WeakPolarHBondContact O-CB 3.41Å; K407-L411 PolarHBondContact O-N 3.49Å
408A95.8Very high96.3Very high28 Ų2875 Ų7523%0.23137%0.371CS..Hα-helixtrans-69.2-34.4175.200000112.9W50 F400 D406 L412W50-A408 HydrophobicContact CH2-CB 4.05Å; F400-A408 HydrophobicContact CD2-CB 4.35Å; F400-A408 HydrophobicContact CE2-CB 3.95Å; D406-A408 PolarHBondContact O-N 3.17Å; A408-L412 VanDerWaalsContact O-CG 3.31Å; A408-L412 WeakPolarHBondContact O-CG 3.4Å; A408-L412 PolarHBondContact O-N 2.85Å; A408-L412 VanDerWaalsContact O-N 3.13Å
409Y97.4Very high96.4Very high4 Ų470 Ų702%0.01635%0.347CS..Hα-helixtrans-64.3-51172.3175.7-80.2000110.1F400 K403 K404 D406 L411 L412 E413 L452F400-Y409 HydrophobicContact CE1-CD2 4.34Å; F400-Y409 HydrophobicContact CZ-CD2 4.36Å; K403-Y409 VanDerWaalsContact O-CB 3.31Å; K403-Y409 WeakPolarHBondContact O-CB 3.35Å; K404-Y409 HydrophobicContact CB-CD1 4.34Å; K404-Y409 HydrophobicContact CB-CE1 4.29Å; K404-Y409 HydrophobicContact CB-CE2 4.44Å; K404-Y409 HydrophobicContact CD-CE2 4.46Å; K404-Y409 VanDerWaalsContact CE-CZ 3.46Å; K404-Y409 WeakPolarHBondContact CE-OH 3.39Å; K404-Y409 HydrophobicContact CG-CD2 4.22Å; K404-Y409 HydrophobicContact CG-CE1 4.37Å; K404-Y409 HydrophobicContact CG-CE2 3.81Å; D406-Y409 WeakPolarHBondContact O-CA 3.26Å; D406-Y409 WeakPolarHBondContact O-CB 3.4Å; D406-Y409 PolarHBondContact O-N 3.05Å; Y409-L411 VanDerWaalsContact C-N 3.29Å; Y409-L411 PolarHBondContact O-N 3.12Å; Y409-L412 PolarHBondContact O-N 3.07Å; Y409-E413 HydrophobicContact CE1-CB 4.3Å; Y409-E413 VanDerWaalsContact CE1-CD 3.45Å; Y409-E413 HydrophobicContact CE1-CG 4.47Å; Y409-E413 VanDerWaalsContact CE1-OE1 3.23Å; Y409-E413 WeakPolarHBondContact CE1-OE1 3.44Å; Y409-E413 WeakPolarHBondContact CE1-OE2 3.31Å; Y409-E413 VanDerWaalsContact CZ-OE1 3.3Å; Y409-E413 WeakPolarHBondContact O-CB 3.4Å; Y409-E413 PolarHBondContact O-N 3.25Å; Y409-E413 PolarHBondContact OH-OE1 3.37Å; Y409-L452 HydrophobicContact CD2-CD1 3.63Å; Y409-L452 HydrophobicContact CD2-CD2 4.5Å; Y409-L452 HydrophobicContact CD2-CG 3.82Å; Y409-L452 HydrophobicContact CE2-CD1 3.93Å; Y409-L452 HydrophobicContact CE2-CD2 4.34Å; Y409-L452 HydrophobicContact CE2-CG 3.6Å; Y409-L452 HydrophobicContact CG-CD1 4.45Å
410W97.3Very high96.4Very high146 Ų14666.4 Ų66.455%0.55333%0.332SS*.Hα-helixtrans-60.7-36.6179.8-61.2-26.9000112.8K404 D406 E414K404-W410 PolarHBondContact O-NE1 3.42Å; D406-W410 PolarHBondContact O-N 2.97Å; W410-E414 WeakPolarHBondContact O-CB 3.22Å; W410-E414 PolarHBondContact O-N 2.81Å
411L96.9Very high96.4Very high47 Ų4772 Ų7225%0.24636%0.361CS..Hα-helixtrans-70.2-40.3177.9-177.160.5000112.5W50 K407 Y409 E413 E414 M415W50-L411 HydrophobicContact CD2-CD2 3.67Å; W50-L411 HydrophobicContact CE3-CD2 3.53Å; W50-L411 HydrophobicContact CG-CD2 4.38Å; W50-L411 HydrophobicContact CH2-CD2 3.99Å; W50-L411 HydrophobicContact CZ2-CD2 4.11Å; W50-L411 HydrophobicContact CZ3-CD2 3.7Å; K407-L411 WeakPolarHBondContact O-CB 3.41Å; K407-L411 PolarHBondContact O-N 3.49Å; Y409-L411 VanDerWaalsContact C-N 3.29Å; Y409-L411 PolarHBondContact O-N 3.12Å; L411-E413 VanDerWaalsContact C-N 3.35Å; L411-E414 PolarHBondContact O-N 3.01Å; L411-M415 HydrophobicContact CD1-CG 4.34Å; L411-M415 HydrophobicContact CD1-SD 4.5Å; L411-M415 WeakPolarHBondContact O-CB 3.45Å; L411-M415 WeakPolarHBondContact O-CG 3.36Å; L411-M415 PolarHBondContact O-N 2.98Å
412L97.4Very high96.5Very high3 Ų368.7 Ų68.72%0.01634%0.337CS..Hα-helixtrans-65.1-40.3174.8-71.3168.8000111.2W50 L393 E396 V397 F400 A408 Y409 M415 L416 L452W50-L412 HydrophobicContact CZ2-CD2 4.38Å; W50-L412 HydrophobicContact CZ2-CG 4.49Å; L393-L412 HydrophobicContact CD2-CD2 4.01Å; E396-L412 HydrophobicContact CB-CD2 3.77Å; V397-L412 HydrophobicContact CG2-CB 4.48Å; V397-L412 HydrophobicContact CG2-CD1 4.19Å; V397-L412 HydrophobicContact CG2-CD2 4.42Å; F400-L412 HydrophobicContact CB-CD1 4.04Å; F400-L412 HydrophobicContact CD2-CD1 3.79Å; F400-L412 HydrophobicContact CG-CD1 4.07Å; A408-L412 VanDerWaalsContact O-CG 3.31Å; A408-L412 WeakPolarHBondContact O-CG 3.4Å; A408-L412 PolarHBondContact O-N 2.85Å; A408-L412 VanDerWaalsContact O-N 3.13Å; Y409-L412 PolarHBondContact O-N 3.07Å; L412-M415 PolarHBondContact O-N 2.92Å; L412-L416 WeakPolarHBondContact O-CB 3.43Å; L412-L416 WeakPolarHBondContact O-CD1 3.21Å; L412-L416 VanDerWaalsContact O-CG 3.26Å; L412-L416 WeakPolarHBondContact O-CG 3.4Å; L412-L416 PolarHBondContact O-N 3.44Å; L412-L452 HydrophobicContact CB-CD1 4.41Å; L412-L452 HydrophobicContact CB-CD2 3.62Å; L412-L452 HydrophobicContact CD1-CD1 4.15Å
413E97.4Very high96.6Very high68 Ų6867.8 Ų67.832%0.31833%0.327SS..Hα-helixtrans-65.7-43.1175-170.1172.9-110.400112Y409 L411 T417 L449 L452Y409-E413 HydrophobicContact CE1-CB 4.3Å; Y409-E413 VanDerWaalsContact CE1-CD 3.45Å; Y409-E413 HydrophobicContact CE1-CG 4.47Å; Y409-E413 VanDerWaalsContact CE1-OE1 3.23Å; Y409-E413 WeakPolarHBondContact CE1-OE1 3.44Å; Y409-E413 WeakPolarHBondContact CE1-OE2 3.31Å; Y409-E413 VanDerWaalsContact CZ-OE1 3.3Å; Y409-E413 WeakPolarHBondContact O-CB 3.4Å; Y409-E413 PolarHBondContact O-N 3.25Å; Y409-E413 PolarHBondContact OH-OE1 3.37Å; L411-E413 VanDerWaalsContact C-N 3.35Å; E413-T417 WeakPolarHBondContact O-CB 3.4Å; E413-T417 VanDerWaalsContact O-CG2 3.31Å; E413-T417 WeakPolarHBondContact O-CG2 3.43Å; E413-T417 PolarHBondContact O-N 2.96Å; E413-T417 PolarHBondContact O-OG1 3.11Å; E413-L449 HydrophobicContact CG-CD2 4.24Å; E413-L452 HydrophobicContact CB-CD2 4.25Å
414E97.9Very high96.6Very high130 Ų13066.6 Ų66.661%0.60733%0.327SS*.Hα-helixtrans-62.1-42.9174.3-179.9176.8-134.200112W410 L411 T417 K418W410-E414 WeakPolarHBondContact O-CB 3.22Å; W410-E414 PolarHBondContact O-N 2.81Å; L411-E414 PolarHBondContact O-N 3.01Å; E414-T417 PolarHBondContact O-OG1 2.92Å; E414-K418 WeakPolarHBondContact O-CB 3.16Å; E414-K418 PolarHBondContact O-N 2.97Å
415M97.8Very high96.5Very high55 Ų5566.6 Ų66.627%0.27134%0.337SS..Hα-helixtrans-68.5-50.5176.9-71.9-170.66700111.9L393 L411 L412 T417 K418 E419L393-M415 HydrophobicContact CD1-CB 3.96Å; L393-M415 HydrophobicContact CD2-CB 3.78Å; L393-M415 HydrophobicContact CD2-CE 4.04Å; L393-M415 HydrophobicContact CD2-SD 4.13Å; L411-M415 HydrophobicContact CD1-CG 4.34Å; L411-M415 HydrophobicContact CD1-SD 4.5Å; L411-M415 WeakPolarHBondContact O-CB 3.45Å; L411-M415 WeakPolarHBondContact O-CG 3.36Å; L411-M415 PolarHBondContact O-N 2.98Å; L412-M415 PolarHBondContact O-N 2.92Å; M415-T417 VanDerWaalsContact C-N 3.28Å; M415-T417 PolarHBondContact O-N 3.13Å; M415-K418 WeakPolarHBondContact O-CB 3.41Å; M415-K418 PolarHBondContact O-N 2.93Å; M415-K418 VanDerWaalsContact O-N 3.07Å; M415-E419 PolarHBondContact O-N 3.39Å
416L97.7Very high96.5Very high0 Ų062.1 Ų62.10%031%0.309CS..Hα-helixtrans-57.8-39.3178.3-73.8163.8000112.6L393 V397 L412 L420 I445 I448 L449 L452L393-L416 HydrophobicContact CB-CD2 3.84Å; L393-L416 HydrophobicContact CB-CG 4.33Å; L393-L416 HydrophobicContact CD1-CD2 3.95Å; L393-L416 HydrophobicContact CD1-CG 4.17Å; V397-L416 HydrophobicContact CG2-CD1 4.15Å; L412-L416 WeakPolarHBondContact O-CB 3.43Å; L412-L416 WeakPolarHBondContact O-CD1 3.21Å; L412-L416 VanDerWaalsContact O-CG 3.26Å; L412-L416 WeakPolarHBondContact O-CG 3.4Å; L412-L416 PolarHBondContact O-N 3.44Å; L416-L420 PolarHBondContact O-N 3.04Å; L416-L420 VanDerWaalsContact O-N 3.12Å; L416-I445 HydrophobicContact CB-CG2 4.34Å; L416-I445 HydrophobicContact CD2-CG2 4.41Å; L416-I445 WeakPolarHBondContact O-CG2 3.29Å; L416-I448 HydrophobicContact CD1-CG2 3.74Å; L416-I448 HydrophobicContact CD2-CB 4.19Å; L416-I448 HydrophobicContact CD2-CG2 3.79Å; L416-I448 HydrophobicContact CG-CG2 4.44Å; L416-L449 HydrophobicContact CB-CD1 4.42Å; L416-L449 HydrophobicContact CB-CD2 3.67Å; L416-L449 HydrophobicContact CB-CG 3.93Å; L416-L449 HydrophobicContact CD1-CD2 3.81Å; L416-L449 HydrophobicContact CD1-CG 4.11Å; L416-L449 HydrophobicContact CG-CD2 4.39Å; L416-L452 HydrophobicContact CD1-CD2 4.07Å
417T97.6Very high96.3Very high61 Ų6165.9 Ų65.937%0.37432%0.324SS..Hα-helixtrans-73.6-32.117653.50000113.2E413 E414 M415 L420 L421 L449E413-T417 WeakPolarHBondContact O-CB 3.4Å; E413-T417 VanDerWaalsContact O-CG2 3.31Å; E413-T417 WeakPolarHBondContact O-CG2 3.43Å; E413-T417 PolarHBondContact O-N 2.96Å; E413-T417 PolarHBondContact O-OG1 3.11Å; E414-T417 PolarHBondContact O-OG1 2.92Å; M415-T417 VanDerWaalsContact C-N 3.28Å; M415-T417 PolarHBondContact O-N 3.13Å; T417-L420 WeakPolarHBondContact O-CB 3.47Å; T417-L420 PolarHBondContact O-N 3.25Å; T417-L421 WeakPolarHBondContact O-CG 3.43Å; T417-L421 PolarHBondContact O-N 3.06Å; T417-L421 VanDerWaalsContact O-N 3.11Å; T417-L449 HydrophobicContact CG2-CD1 4.26Å; T417-L449 HydrophobicContact CG2-CD2 4.48Å
418K97.7Very high95.9Very high113 Ų11358.1 Ų58.149%0.49129%0.292SS..Hα-helixtrans-66.6-44.9171177.4-164.3167-150.20112.3E414 M415 L420 L421 E422E414-K418 WeakPolarHBondContact O-CB 3.16Å; E414-K418 PolarHBondContact O-N 2.97Å; M415-K418 WeakPolarHBondContact O-CB 3.41Å; M415-K418 PolarHBondContact O-N 2.93Å; M415-K418 VanDerWaalsContact O-N 3.07Å; K418-L420 PolarHBondContact O-N 3.34Å; K418-L421 WeakPolarHBondContact O-CB 3.29Å; K418-L421 PolarHBondContact O-N 3.07Å; K418-L421 VanDerWaalsContact O-N 3.13Å; K418-E422 PolarHBondContact O-N 3.13Å
419E97.4Very high95.3Very high2 Ų259.6 Ų59.61%0.00931%0.309CS..Hα-helixtrans-62.3-32.8175.2-9659.1-110.100111.4V386 K389 V390 L393 M415 E422 L423V386-E419 HydrophobicContact CG1-CB 4.13Å; V386-E419 HydrophobicContact CG1-CG 4.24Å; K389-E419 HydrophobicContact CB-CG 3.93Å; K389-E419 HydrophobicContact CD-CG 3.78Å; K389-E419 VanDerWaalsContact CD-OE1 3.29Å; K389-E419 WeakPolarHBondContact CD-OE1 3.36Å; K389-E419 IonicContact NZ-OE1 2.72Å; K389-E419 PolarHBondContact NZ-OE1 3.38Å; V390-E419 HydrophobicContact CG2-CB 4.07Å; V390-E419 HydrophobicContact CG2-CG 4.23Å; L393-E419 HydrophobicContact CD1-CG 4.41Å; M415-E419 PolarHBondContact O-N 3.39Å; E419-E422 PolarHBondContact O-N 3.36Å; E419-L423 VanDerWaalsContact O-CB 3.29Å; E419-L423 WeakPolarHBondContact O-CB 3.36Å; E419-L423 PolarHBondContact O-N 2.88Å
420L96.6Very high94.9Very high46 Ų4661.5 Ų61.524%0.24133%0.33CS..Hα-helixtrans-64.4-43170.9-166.6156.3000112.3L416 T417 K418 L423 D424 I445L416-L420 PolarHBondContact O-N 3.04Å; L416-L420 VanDerWaalsContact O-N 3.12Å; T417-L420 WeakPolarHBondContact O-CB 3.47Å; T417-L420 PolarHBondContact O-N 3.25Å; K418-L420 PolarHBondContact O-N 3.34Å; L420-L423 WeakPolarHBondContact O-CB 3.47Å; L420-L423 PolarHBondContact O-N 3.48Å; L420-D424 PolarHBondContact O-N 2.9Å; L420-I445 HydrophobicContact CB-CD1 4.3Å; L420-I445 HydrophobicContact CB-CG2 4.21Å; L420-I445 HydrophobicContact CD1-CG2 4.15Å
421L96.3Very high94.7Very high126 Ų12659.9 Ų59.966%0.6633%0.329SS*.Hα-helixtrans-66.4-39.6176.2-70.5165.4000112.3T417 K418 L423 S425T417-L421 WeakPolarHBondContact O-CG 3.43Å; T417-L421 PolarHBondContact O-N 3.06Å; T417-L421 VanDerWaalsContact O-N 3.11Å; K418-L421 WeakPolarHBondContact O-CB 3.29Å; K418-L421 PolarHBondContact O-N 3.07Å; K418-L421 VanDerWaalsContact O-N 3.13Å; L421-L423 VanDerWaalsContact C-N 3.28Å; L421-L423 PolarHBondContact O-N 2.87Å; L421-S425 PolarHBondContact O-N 3.09Å
422E95.4Very high94.5Very high68 Ų6863.2 Ų63.232%0.31835%0.347SS..Hα-helixtrans-62.3-39.1174.1-166.2175.4128.700111V386 K389 K418 E419 S425V386-E422 HydrophobicContact CG2-CB 4.34Å; V386-E422 HydrophobicContact CG2-CG 4.17Å; K389-E422 IonicContact NZ-OE1 3.08Å; K389-E422 PolarHBondContact NZ-OE1 3.24Å; K389-E422 IonicContact NZ-OE2 3.35Å; K389-E422 PolarHBondContact NZ-OE2 3.38Å; K418-E422 PolarHBondContact O-N 3.13Å; E419-E422 PolarHBondContact O-N 3.36Å; E422-S425 PolarHBondContact O-OG 3.21Å
423L95.5Very high94.3Very high0 Ų066.6 Ų66.60%037%0.371CS..Hα-helixtrans-69.6-41.2178-175.362.1000113.9I383 V386 E419 L420 L421 S425 V426 R438 A441 V442 I445I383-L423 HydrophobicContact CB-CD1 4.34Å; I383-L423 HydrophobicContact CG1-CD1 3.82Å; I383-L423 HydrophobicContact CG2-CD1 4.2Å; V386-L423 HydrophobicContact CG1-CB 4.25Å; E419-L423 VanDerWaalsContact O-CB 3.29Å; E419-L423 WeakPolarHBondContact O-CB 3.36Å; E419-L423 PolarHBondContact O-N 2.88Å; L420-L423 WeakPolarHBondContact O-CB 3.47Å; L420-L423 PolarHBondContact O-N 3.48Å; L421-L423 VanDerWaalsContact C-N 3.28Å; L421-L423 PolarHBondContact O-N 2.87Å; L423-S425 VanDerWaalsContact C-N 3.27Å; L423-S425 PolarHBondContact O-N 3.01Å; L423-V426 VanDerWaalsContact O-CB 3.29Å; L423-V426 WeakPolarHBondContact O-CB 3.41Å; L423-V426 WeakPolarHBondContact O-CG2 3.49Å; L423-V426 PolarHBondContact O-N 2.93Å; L423-V426 VanDerWaalsContact O-N 3.13Å; L423-R438 HydrophobicContact CD1-CG 3.92Å; L423-R438 HydrophobicContact CG-CG 3.98Å; L423-A441 HydrophobicContact CD1-CB 4.03Å; L423-A441 HydrophobicContact CD2-CB 3.48Å; L423-A441 VanDerWaalsContact CD2-CB 3.48Å; L423-A441 HydrophobicContact CG-CB 4.42Å; L423-V442 HydrophobicContact CD2-CB 4.36Å; L423-V442 HydrophobicContact CD2-CG2 3.53Å; L423-V442 HydrophobicContact CG-CG2 4.22Å; L423-I445 HydrophobicContact CD2-CD1 3.81Å
424D94.2Very high94.1Very high94 Ų9463.3 Ų63.350%0.50336%0.356SS..Hα-helixtrans-68.6-28.6177.6-169.950.9000112.1L420 V426 R438L420-D424 PolarHBondContact O-N 2.9Å; D424-V426 PolarHBondContact O-N 3.35Å; D424-V426 VanDerWaalsContact O-N 3.09Å; D424-R438 PolarHBondContact O-NH1 3.13Å; D424-R438 IonicContact OD1-CZ 3.56Å; D424-R438 IonicContact OD1-NH1 2.66Å; D424-R438 IonicContact OD1-NH2 3.26Å; D424-R438 PolarHBondContact OD1-NH2 3.43Å
425S93.8Very high94Very high78 Ų7863 Ų6355%0.54535%0.349SS..THydrogen-bonded Turntrans-64.4-7.5171.287.90000114.6L421 E422 L423 E427L421-S425 PolarHBondContact O-N 3.09Å; E422-S425 PolarHBondContact O-OG 3.21Å; L423-S425 VanDerWaalsContact C-N 3.27Å; L423-S425 PolarHBondContact O-N 3.01Å; S425-E427 PolarHBondContact O-N 3.19Å
426V93.3Very high93.9Very high2 Ų264.4 Ų64.41%0.01236%0.355CS..  trans-77.6105.3176.3-176.90000110.2K382 I383 L423 D424 V434 R438K382-V426 HydrophobicContact CB-CG2 3.88Å; K382-V426 HydrophobicContact CD-CG2 4.08Å; I383-V426 HydrophobicContact CD1-CG1 4.04Å; I383-V426 HydrophobicContact CG1-CB 4.47Å; I383-V426 HydrophobicContact CG1-CG1 4.06Å; I383-V426 HydrophobicContact CG1-CG2 4.3Å; L423-V426 VanDerWaalsContact O-CB 3.29Å; L423-V426 WeakPolarHBondContact O-CB 3.41Å; L423-V426 WeakPolarHBondContact O-CG2 3.49Å; L423-V426 PolarHBondContact O-N 2.93Å; L423-V426 VanDerWaalsContact O-N 3.13Å; D424-V426 PolarHBondContact O-N 3.35Å; D424-V426 VanDerWaalsContact O-N 3.09Å; V426-V434 HydrophobicContact CG1-CG1 4.31Å; V426-R438 PolarHBondContact O-NH1 2.66Å
427E91.3Very high93.8Very high139 Ų13965.5 Ų65.565%0.6536%0.364SS*.  trans-61.3137.6166.6-179.151.6-104.200110.9S379 S425 G429S379-E427 VanDerWaalsContact CB-O 3.28Å; S379-E427 WeakPolarHBondContact CB-O 3.44Å; S425-E427 PolarHBondContact O-N 3.19Å; E427-G429 PolarHBondContact OE1-N 3.31Å
428T88.8Confident93.8Very high10 Ų1065.6 Ų65.66%0.06136%0.358CS..  trans-97.3-25.2-176.462.50000113G430 Q431 V434 R435T428-G430 PolarHBondContact O-N 2.97Å; T428-G430 VanDerWaalsContact O-N 3.11Å; T428-Q431 WeakPolarHBondContact O-CB 3.19Å; T428-Q431 PolarHBondContact O-N 3Å; T428-V434 HydrophobicContact CG2-CG1 4.14Å; T428-R435 HydrophobicContact CG2-CG 3.91Å; T428-R435 PolarHBondContact OG1-NH1 3.46Å
429G84.7Confident93.8Very high59 Ų5966.4 Ų66.461%0.60836%0.361SS*.THydrogen-bonded Turntrans59.723177.500000114.2E427 Q431E427-G429 PolarHBondContact OE1-N 3.31Å; G429-Q431 VanDerWaalsContact C-N 3.32Å
430G88.2Confident93.8Very high44 Ų4471.6 Ų71.645%0.45439%0.385SS..THydrogen-bonded Turntrans80.21.6-173.200000115.5T428 D432T428-G430 PolarHBondContact O-N 2.97Å; T428-G430 VanDerWaalsContact O-N 3.11Å; G430-D432 PolarHBondContact O-N 2.93Å
431Q92.6Very high93.8Very high112 Ų11269.4 Ų69.452%0.52337%0.374SS..  trans-82.2112.4-178.4-62.7-66.7-43.400111.7T428 G429 S433 V434 R435T428-Q431 WeakPolarHBondContact O-CB 3.19Å; T428-Q431 PolarHBondContact O-N 3Å; G429-Q431 VanDerWaalsContact C-N 3.32Å; Q431-S433 VanDerWaalsContact C-N 3.31Å; Q431-S433 PolarHBondContact O-N 3.46Å; Q431-V434 HydrophobicContact CB-CB 4.11Å; Q431-V434 HydrophobicContact CB-CG2 3.5Å; Q431-V434 HydrophobicContact CG-CG2 4.33Å; Q431-V434 WeakPolarHBondContact O-CB 3.46Å; Q431-V434 PolarHBondContact O-N 2.93Å; Q431-R435 PolarHBondContact O-N 3.04Å
432D93Very high93.9Very high117 Ų11765 Ų6563%0.62635%0.352SS*.Hα-helixtrans-66.4-29.4-176.3-65-48.7000113.8G430 V434 R435 Q436G430-D432 PolarHBondContact O-N 2.93Å; D432-V434 VanDerWaalsContact C-N 3.3Å; D432-V434 PolarHBondContact O-N 3.09Å; D432-R435 PolarHBondContact O-N 3.25Å; D432-R435 WeakPolarHBondContact OD1-CD 3.42Å; D432-R435 IonicContact OD1-NE 2.69Å; D432-Q436 WeakPolarHBondContact O-CB 3.09Å; D432-Q436 PolarHBondContact O-N 3.31Å
433S92.6Very high94Very high74 Ų7464.8 Ų64.852%0.51736%0.358SS..Hα-helixtrans-60.1-39.7170.454.40000112.2Q431 A437Q431-S433 VanDerWaalsContact C-N 3.31Å; Q431-S433 PolarHBondContact O-N 3.46Å; S433-A437 WeakPolarHBondContact O-CB 3.42Å; S433-A437 PolarHBondContact O-N 2.72Å
434V94.6Very high94.1Very high0 Ų067.3 Ų67.30%037%0.368CS..Hα-helixtrans-69.7-42.1174.8-170.10000110.4S379 I380 I383 V426 T428 Q431 D432 Q436 R438S379-V434 WeakPolarHBondContact OG-CG2 3.36Å; I380-V434 HydrophobicContact CD1-CB 4.37Å; I380-V434 HydrophobicContact CD1-CG2 4.08Å; I380-V434 HydrophobicContact CG1-CG2 4.03Å; I383-V434 HydrophobicContact CD1-CG1 3.69Å; V426-V434 HydrophobicContact CG1-CG1 4.31Å; T428-V434 HydrophobicContact CG2-CG1 4.14Å; Q431-V434 HydrophobicContact CB-CB 4.11Å; Q431-V434 HydrophobicContact CB-CG2 3.5Å; Q431-V434 HydrophobicContact CG-CG2 4.33Å; Q431-V434 WeakPolarHBondContact O-CB 3.46Å; Q431-V434 PolarHBondContact O-N 2.93Å; D432-V434 VanDerWaalsContact C-N 3.3Å; D432-V434 PolarHBondContact O-N 3.09Å; V434-Q436 PolarHBondContact O-N 2.76Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 PolarHBondContact O-N 3.22Å
435R95.8Very high94.3Very high122 Ų12262.8 Ų62.846%0.4634%0.344SS..Hα-helixtrans-59.5-45.8176.5-64.8-176.1-176.1-70.30111.8T428 Q431 D432 K439T428-R435 HydrophobicContact CG2-CG 3.91Å; T428-R435 PolarHBondContact OG1-NH1 3.46Å; Q431-R435 PolarHBondContact O-N 3.04Å; D432-R435 PolarHBondContact O-N 3.25Å; D432-R435 WeakPolarHBondContact OD1-CD 3.42Å; D432-R435 IonicContact OD1-NE 2.69Å; R435-K439 WeakPolarHBondContact O-CB 3.43Å; R435-K439 PolarHBondContact O-N 3.11Å
436Q95.8Very high94.5Very high85 Ų8564 Ų6440%0.39734%0.342SS..Hα-helixtrans-69.5-49.1-178.5-177.761.814.600111.4D432 V434 R438 K439 E440D432-Q436 WeakPolarHBondContact O-CB 3.09Å; D432-Q436 PolarHBondContact O-N 3.31Å; V434-Q436 PolarHBondContact O-N 2.76Å; Q436-R438 VanDerWaalsContact C-N 3.27Å; Q436-R438 PolarHBondContact O-N 3.09Å; Q436-K439 WeakPolarHBondContact O-CB 3.46Å; Q436-K439 PolarHBondContact O-N 3.35Å; Q436-K439 VanDerWaalsContact O-N 3.09Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.44Å; Q436-E440 PolarHBondContact NE2-OE1 3.18Å; Q436-E440 WeakPolarHBondContact O-CG 3.29Å; Q436-E440 PolarHBondContact O-N 3.24Å
437A95.7Very high94.7Very high23 Ų2366.5 Ų66.519%0.1936%0.362CS..Hα-helixtrans-59.6-38.4176.700000112.2I380 I383 S433 A441I380-A437 HydrophobicContact CD1-CB 3.91Å; I383-A437 HydrophobicContact CD1-CB 4.3Å; I383-A437 HydrophobicContact CG2-CB 4.08Å; S433-A437 WeakPolarHBondContact O-CB 3.42Å; S433-A437 PolarHBondContact O-N 2.72Å; A437-A441 WeakPolarHBondContact O-CB 3.33Å; A437-A441 PolarHBondContact O-N 2.83Å
438R96.9Very high95.1Very high64 Ų6460 Ų6024%0.24233%0.332CS..Hα-helixtrans-64.5-43.6174.2-163.8178.990.5139.126.4111.8I383 L423 D424 V426 V434 Q436 A441 V442I383-R438 HydrophobicContact CD1-CB 3.95Å; L423-R438 HydrophobicContact CD1-CG 3.92Å; L423-R438 HydrophobicContact CG-CG 3.98Å; D424-R438 PolarHBondContact O-NH1 3.13Å; D424-R438 IonicContact OD1-CZ 3.56Å; D424-R438 IonicContact OD1-NH1 2.66Å; D424-R438 IonicContact OD1-NH2 3.26Å; D424-R438 PolarHBondContact OD1-NH2 3.43Å; V426-R438 PolarHBondContact O-NH1 2.66Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 PolarHBondContact O-N 3.22Å; Q436-R438 VanDerWaalsContact C-N 3.27Å; Q436-R438 PolarHBondContact O-N 3.09Å; R438-A441 PolarHBondContact O-N 2.82Å; R438-V442 WeakPolarHBondContact O-CG2 3.33Å; R438-V442 PolarHBondContact O-N 3.04Å
439K97.3Very high95.5Very high130 Ų13061.2 Ų61.257%0.56534%0.338SS*.Hα-helixtrans-62.1-47176.4178.3-173.3168.7-168.40111.7R435 Q436 A441 V442 C443R435-K439 WeakPolarHBondContact O-CB 3.43Å; R435-K439 PolarHBondContact O-N 3.11Å; Q436-K439 WeakPolarHBondContact O-CB 3.46Å; Q436-K439 PolarHBondContact O-N 3.35Å; Q436-K439 VanDerWaalsContact O-N 3.09Å; K439-A441 PolarHBondContact O-N 3.24Å; K439-V442 PolarHBondContact O-N 3.3Å; K439-C443 PolarHBondContact O-N 3.14Å; K439-C443 PolarHBondContact O-SG 3.12Å; K439-C443 VanDerWaalsContact O-SG 3.35Å
440E97.4Very high96.1Very high110 Ų11063.3 Ų63.351%0.51433%0.332SS..Hα-helixtrans-61.2-43.6178.2-72.5168.6178.400111.6Q436 C443 K444Q436-E440 WeakPolarHBondContact CG-OE1 3.44Å; Q436-E440 PolarHBondContact NE2-OE1 3.18Å; Q436-E440 WeakPolarHBondContact O-CG 3.29Å; Q436-E440 PolarHBondContact O-N 3.24Å; E440-C443 PolarHBondContact O-N 3.34Å; E440-K444 PolarHBondContact O-N 3.27Å
441A97.3Very high96.5Very high1 Ų164 Ų641%0.00832%0.322CS..Hα-helixtrans-64.1-39175.200000112.9I383 L387 L423 A437 R438 K439 K444 I445I383-A441 HydrophobicContact CG2-CB 4.19Å; L387-A441 HydrophobicContact CD1-CB 4.26Å; L387-A441 HydrophobicContact CD2-CB 3.65Å; L387-A441 HydrophobicContact CG-CB 3.87Å; L423-A441 HydrophobicContact CD1-CB 4.03Å; L423-A441 HydrophobicContact CD2-CB 3.48Å; L423-A441 VanDerWaalsContact CD2-CB 3.48Å; L423-A441 HydrophobicContact CG-CB 4.42Å; A437-A441 WeakPolarHBondContact O-CB 3.33Å; A437-A441 PolarHBondContact O-N 2.83Å; R438-A441 PolarHBondContact O-N 2.82Å; K439-A441 PolarHBondContact O-N 3.24Å; A441-K444 PolarHBondContact O-N 3.07Å; A441-I445 WeakPolarHBondContact O-CG1 3.47Å; A441-I445 PolarHBondContact O-N 3.2Å
442V97.9Very high96.7Very high32 Ų3258.7 Ų58.719%0.19430%0.297CS..Hα-helixtrans-62.3-46172.1169.20000110.9L423 R438 K439 K444 I445 Q446L423-V442 HydrophobicContact CD2-CB 4.36Å; L423-V442 HydrophobicContact CD2-CG2 3.53Å; L423-V442 HydrophobicContact CG-CG2 4.22Å; R438-V442 WeakPolarHBondContact O-CG2 3.33Å; R438-V442 PolarHBondContact O-N 3.04Å; K439-V442 PolarHBondContact O-N 3.3Å; V442-K444 VanDerWaalsContact C-N 3.31Å; V442-K444 PolarHBondContact O-N 3.26Å; V442-I445 PolarHBondContact O-N 3Å; V442-Q446 HydrophobicContact CG1-CG 4.41Å; V442-Q446 WeakPolarHBondContact O-CG 3.34Å; V442-Q446 PolarHBondContact O-N 3.49Å
443C97.8Very high96.8Very high65 Ų6557.5 Ų57.544%0.43929%0.288SS..Hα-helixtrans-61.2-38.8177.5-69.30000112.2K439 E440 Q446 A447K439-C443 PolarHBondContact O-N 3.14Å; K439-C443 PolarHBondContact O-SG 3.12Å; K439-C443 VanDerWaalsContact O-SG 3.35Å; E440-C443 PolarHBondContact O-N 3.34Å; C443-Q446 PolarHBondContact O-N 3.04Å; C443-A447 PolarHBondContact O-N 3.12Å
444K97.9Very high97Very high52 Ų5260 Ų6023%0.22629%0.29CS..Hα-helixtrans-63-48.4174.7-178.7164.9-177.6161.50111.7L387 V390 E394 E440 A441 V442 Q446 A447 I448L387-K444 HydrophobicContact CD2-CD 4.37Å; V390-K444 HydrophobicContact CG1-CD 4.27Å; V390-K444 HydrophobicContact CG1-CG 4.07Å; E394-K444 WeakPolarHBondContact OE1-CE 3.46Å; E394-K444 IonicContact OE1-NZ 3.96Å; E394-K444 WeakPolarHBondContact OE2-CE 3.39Å; E394-K444 IonicContact OE2-NZ 3.22Å; E394-K444 PolarHBondContact OE2-NZ 3.43Å; E440-K444 PolarHBondContact O-N 3.27Å; A441-K444 PolarHBondContact O-N 3.07Å; V442-K444 VanDerWaalsContact C-N 3.31Å; V442-K444 PolarHBondContact O-N 3.26Å; K444-Q446 VanDerWaalsContact C-N 3.3Å; K444-Q446 PolarHBondContact O-N 3.22Å; K444-A447 PolarHBondContact O-N 3.11Å; K444-I448 HydrophobicContact CD-CD1 4.48Å; K444-I448 HydrophobicContact CG-CD1 3.75Å; K444-I448 HydrophobicContact CG-CG1 4.49Å; K444-I448 WeakPolarHBondContact O-CD1 3.45Å; K444-I448 VanDerWaalsContact O-CG1 3.3Å; K444-I448 WeakPolarHBondContact O-CG1 3.47Å; K444-I448 PolarHBondContact O-N 3.26Å
445I97.8Very high96.9Very high0 Ų062.9 Ų62.90%030%0.302CS..Hα-helixtrans-58.8-43177.8-65.8161.3000111.2V386 V390 L416 L420 L423 A441 V442 I448 L449V386-I445 HydrophobicContact CG1-CD1 4.39Å; V390-I445 HydrophobicContact CB-CG1 4.41Å; V390-I445 HydrophobicContact CG1-CG1 3.88Å; V390-I445 HydrophobicContact CG2-CD1 3.91Å; V390-I445 HydrophobicContact CG2-CG1 3.56Å; L416-I445 HydrophobicContact CB-CG2 4.34Å; L416-I445 HydrophobicContact CD2-CG2 4.41Å; L416-I445 WeakPolarHBondContact O-CG2 3.29Å; L420-I445 HydrophobicContact CB-CD1 4.3Å; L420-I445 HydrophobicContact CB-CG2 4.21Å; L420-I445 HydrophobicContact CD1-CG2 4.15Å; L423-I445 HydrophobicContact CD2-CD1 3.81Å; A441-I445 WeakPolarHBondContact O-CG1 3.47Å; A441-I445 PolarHBondContact O-N 3.2Å; V442-I445 PolarHBondContact O-N 3Å; I445-I448 PolarHBondContact O-N 2.84Å; I445-L449 HydrophobicContact CG2-CD1 4.06Å; I445-L449 PolarHBondContact O-N 2.98Å
446Q98.2Very high96.5Very high104 Ų10457.2 Ų57.249%0.48628%0.281SS..Hα-helixtrans-62.8-42.7178-73.2175-13.100112.5V442 C443 K444 I448 L449 E450V442-Q446 HydrophobicContact CG1-CG 4.41Å; V442-Q446 WeakPolarHBondContact O-CG 3.34Å; V442-Q446 PolarHBondContact O-N 3.49Å; C443-Q446 PolarHBondContact O-N 3.04Å; K444-Q446 VanDerWaalsContact C-N 3.3Å; K444-Q446 PolarHBondContact O-N 3.22Å; Q446-I448 VanDerWaalsContact C-N 3.32Å; Q446-I448 PolarHBondContact O-N 3.08Å; Q446-L449 PolarHBondContact O-N 3.46Å; Q446-E450 PolarHBondContact O-N 2.77Å
447A98.2Very high95.9Very high54 Ų5461.5 Ų61.545%0.44631%0.306SS..Hα-helixtrans-63.8-35.9175.800000112.6C443 K444 K451C443-A447 PolarHBondContact O-N 3.12Å; K444-A447 PolarHBondContact O-N 3.11Å; A447-K451 WeakPolarHBondContact O-CB 3.36Å; A447-K451 PolarHBondContact O-N 3.23Å
448I97.8Very high95.9Very high1 Ų163.5 Ų63.51%0.00531%0.312CS..Hα-helixtrans-71.4-38.7176.7-60.9158000111.1V390 E394 V397 L416 K444 I445 Q446 K451 L452V390-I448 HydrophobicContact CG1-CD1 3.4Å; V390-I448 VanDerWaalsContact CG1-CD1 3.4Å; E394-I448 HydrophobicContact CB-CD1 3.72Å; E394-I448 HydrophobicContact CB-CG1 4.07Å; E394-I448 HydrophobicContact CG-CD1 4.11Å; E394-I448 HydrophobicContact CG-CG1 4.03Å; V397-I448 HydrophobicContact CB-CG2 4.07Å; V397-I448 HydrophobicContact CG1-CG2 4.22Å; V397-I448 HydrophobicContact CG2-CG2 3.84Å; L416-I448 HydrophobicContact CD1-CG2 3.74Å; L416-I448 HydrophobicContact CD2-CB 4.19Å; L416-I448 HydrophobicContact CD2-CG2 3.79Å; L416-I448 HydrophobicContact CG-CG2 4.44Å; K444-I448 HydrophobicContact CD-CD1 4.48Å; K444-I448 HydrophobicContact CG-CD1 3.75Å; K444-I448 HydrophobicContact CG-CG1 4.49Å; K444-I448 WeakPolarHBondContact O-CD1 3.45Å; K444-I448 VanDerWaalsContact O-CG1 3.3Å; K444-I448 WeakPolarHBondContact O-CG1 3.47Å; K444-I448 PolarHBondContact O-N 3.26Å; I445-I448 PolarHBondContact O-N 2.84Å; Q446-I448 VanDerWaalsContact C-N 3.32Å; Q446-I448 PolarHBondContact O-N 3.08Å; I448-K451 WeakPolarHBondContact O-CB 3.5Å; I448-K451 PolarHBondContact O-N 2.98Å; I448-L452 WeakPolarHBondContact O-CB 3.26Å; I448-L452 PolarHBondContact O-N 3.49Å
449L97.4Very high95.8Very high36 Ų3663.4 Ų63.419%0.18832%0.316CS..Hα-helixtrans-62.2-43.7172.4-77.5167.1000111.8E413 L416 T417 I445 Q446 K451 L452 E453E413-L449 HydrophobicContact CG-CD2 4.24Å; L416-L449 HydrophobicContact CB-CD1 4.42Å; L416-L449 HydrophobicContact CB-CD2 3.67Å; L416-L449 HydrophobicContact CB-CG 3.93Å; L416-L449 HydrophobicContact CD1-CD2 3.81Å; L416-L449 HydrophobicContact CD1-CG 4.11Å; L416-L449 HydrophobicContact CG-CD2 4.39Å; T417-L449 HydrophobicContact CG2-CD1 4.26Å; T417-L449 HydrophobicContact CG2-CD2 4.48Å; I445-L449 HydrophobicContact CG2-CD1 4.06Å; I445-L449 PolarHBondContact O-N 2.98Å; Q446-L449 PolarHBondContact O-N 3.46Å; L449-K451 VanDerWaalsContact C-N 3.31Å; L449-K451 PolarHBondContact O-N 3.19Å; L449-L452 PolarHBondContact O-N 3.48Å; L449-E453 PolarHBondContact O-N 3.04Å
450E97.6Very high95.8Very high104 Ų10459.7 Ų59.749%0.48630%0.302SS..Hα-helixtrans-63.4-37175.5-163.4-164.9155.700111.9Q446 K454Q446-E450 PolarHBondContact O-N 2.77Å; E450-K454 VanDerWaalsContact CD-NZ 3.32Å; E450-K454 WeakPolarHBondContact O-CD 3.34Å; E450-K454 VanDerWaalsContact O-CG 3.29Å; E450-K454 WeakPolarHBondContact O-CG 3.45Å; E450-K454 PolarHBondContact O-N 2.91Å; E450-K454 VanDerWaalsContact O-N 3.09Å; E450-K454 WeakPolarHBondContact OE1-CE 3.28Å; E450-K454 IonicContact OE1-NZ 2.61Å; E450-K454 PolarHBondContact OE1-NZ 3.06Å
451K97.2Very high95.7Very high59 Ų5956.8 Ų56.826%0.25729%0.289SS..Hα-helixtrans-66.7-42174.3-174.3-178.1-175.4179.10112.1V397 E398 A447 I448 L449 K454 K455V397-K451 HydrophobicContact CG1-CB 4.34Å; V397-K451 HydrophobicContact CG1-CD 4.18Å; V397-K451 HydrophobicContact CG1-CG 4.08Å; E398-K451 WeakPolarHBondContact OE1-CE 3.49Å; E398-K451 IonicContact OE1-NZ 2.63Å; E398-K451 PolarHBondContact OE1-NZ 2.81Å; E398-K451 WeakPolarHBondContact OE2-CE 3.41Å; E398-K451 IonicContact OE2-NZ 3.43Å; E398-K451 PolarHBondContact OE2-NZ 3.43Å; A447-K451 WeakPolarHBondContact O-CB 3.36Å; A447-K451 PolarHBondContact O-N 3.23Å; I448-K451 WeakPolarHBondContact O-CB 3.5Å; I448-K451 PolarHBondContact O-N 2.98Å; L449-K451 VanDerWaalsContact C-N 3.31Å; L449-K451 PolarHBondContact O-N 3.19Å; K451-K454 PolarHBondContact O-N 3.36Å; K451-K455 WeakPolarHBondContact O-CG 3.25Å; K451-K455 PolarHBondContact O-N 2.94Å; K451-K455 VanDerWaalsContact O-N 3.1Å
452L97Very high95.6Very high0 Ų060.3 Ų60.30%031%0.307CS..Hα-helixtrans-63.6-44.4175.3175.957.1000111.2V397 F400 Y409 L412 E413 L416 I448 L449 K454 K455 G456V397-L452 HydrophobicContact CG1-CB 3.89Å; V397-L452 HydrophobicContact CG2-CB 4.08Å; V397-L452 HydrophobicContact CG2-CD1 4.24Å; V397-L452 HydrophobicContact CG2-CD2 4.27Å; V397-L452 HydrophobicContact CG2-CG 4.41Å; F400-L452 HydrophobicContact CD1-CD1 3.9Å; F400-L452 HydrophobicContact CE1-CD1 4.19Å; F400-L452 HydrophobicContact CG-CD1 4.2Å; Y409-L452 HydrophobicContact CD2-CD1 3.63Å; Y409-L452 HydrophobicContact CD2-CD2 4.5Å; Y409-L452 HydrophobicContact CD2-CG 3.82Å; Y409-L452 HydrophobicContact CE2-CD1 3.93Å; Y409-L452 HydrophobicContact CE2-CD2 4.34Å; Y409-L452 HydrophobicContact CE2-CG 3.6Å; Y409-L452 HydrophobicContact CG-CD1 4.45Å; L412-L452 HydrophobicContact CB-CD1 4.41Å; L412-L452 HydrophobicContact CB-CD2 3.62Å; L412-L452 HydrophobicContact CD1-CD1 4.15Å; E413-L452 HydrophobicContact CB-CD2 4.25Å; L416-L452 HydrophobicContact CD1-CD2 4.07Å; I448-L452 WeakPolarHBondContact O-CB 3.26Å; I448-L452 PolarHBondContact O-N 3.49Å; L449-L452 PolarHBondContact O-N 3.48Å; L452-K454 PolarHBondContact O-N 3.43Å; L452-K455 PolarHBondContact O-N 3.47Å; L452-G456 PolarHBondContact O-N 3.01Å; L452-G456 VanDerWaalsContact O-N 3.13Å
453E95.4Very high95.4Very high92 Ų9262.1 Ų62.143%0.4332%0.315SS..Hα-helixtrans-57.8-49174.4173.2159-122.500111.8K404 L449 K455 G456K404-E453 IonicContact NZ-OE1 3.75Å; K404-E453 PolarHBondContact NZ-OE1 3.24Å; L449-E453 PolarHBondContact O-N 3.04Å; E453-K455 PolarHBondContact O-N 3.27Å; E453-G456 PolarHBondContact O-N 3.19Å; E453-G456 VanDerWaalsContact O-N 3.08Å
454K95.5Very high95.2Very high127 Ų12761.9 Ų61.955%0.55231%0.306SS*.Hα-helixtrans-59.7-31.4177.7-72.8166.4-174.9167.60113.4E450 K451 L452E450-K454 VanDerWaalsContact CD-NZ 3.32Å; E450-K454 WeakPolarHBondContact O-CD 3.34Å; E450-K454 VanDerWaalsContact O-CG 3.29Å; E450-K454 WeakPolarHBondContact O-CG 3.45Å; E450-K454 PolarHBondContact O-N 2.91Å; E450-K454 VanDerWaalsContact O-N 3.09Å; E450-K454 WeakPolarHBondContact OE1-CE 3.28Å; E450-K454 IonicContact OE1-NZ 2.61Å; E450-K454 PolarHBondContact OE1-NZ 3.06Å; K451-K454 PolarHBondContact O-N 3.36Å; L452-K454 PolarHBondContact O-N 3.43Å
455K92.8Very high95Very high60 Ų6062.7 Ų62.726%0.26131%0.312SS..Hα-helixtrans-82-13.7177.5-78.8178.2137.3-125.60114.3V397 E398 F400 G402 K451 L452 E453V397-K455 HydrophobicContact CG1-CD 4.43Å; V397-K455 WeakPolarHBondContact O-CD 3.47Å; V397-K455 VanDerWaalsContact O-CE 3.31Å; V397-K455 WeakPolarHBondContact O-CE 3.42Å; V397-K455 PolarHBondContact O-NZ 3.2Å; E398-K455 VanDerWaalsContact C-NZ 3.27Å; E398-K455 PolarHBondContact O-NZ 3.36Å; E398-K455 IonicContact OE1-NZ 2.67Å; F400-K455 HydrophobicContact CD1-CB 4.15Å; F400-K455 PolarHBondContact O-NZ 3.05Å; G402-K455 VanDerWaalsContact O-O 3.09Å; K451-K455 WeakPolarHBondContact O-CG 3.25Å; K451-K455 PolarHBondContact O-N 2.94Å; K451-K455 VanDerWaalsContact O-N 3.1Å; L452-K455 PolarHBondContact O-N 3.47Å; E453-K455 PolarHBondContact O-N 3.27Å
456G87.5Confident94.8Very high2 Ų267.9 Ų67.92%0.02134%0.338CS..THydrogen-bonded Turntrans-94.13.6-177.900000115.9K403 K404 L452 E453K403-G456 CarbonylContact C-O 3.46Å; K403-G456 VanDerWaalsContact CA-O 3.25Å; K403-G456 WeakPolarHBondContact CA-O 3.4Å; K404-G456 WeakPolarHBondContact CG-O 3.37Å; K404-G456 PolarHBondContact N-O 3.32Å; L452-G456 PolarHBondContact O-N 3.01Å; L452-G456 VanDerWaalsContact O-N 3.13Å; E453-G456 PolarHBondContact O-N 3.19Å; E453-G456 VanDerWaalsContact O-N 3.08Å
457L83.3Confident94.5Very high176 Ų17664.6 Ų64.692%0.92132%0.324SS*.  trans-73.20-173.3-62.7175.3000113.8

Retrieved 457 of 457 residues in 88.6 ms (Link to these results)