A0A096MRT7_PAPAN Loading...

ATP-binding cassette sub-family B member 6

AlphaFold DB , UniProt , Accession A0A096MRT7, Species PAPAN (Papio anubis, Olive baboon), Gene ABCB6, Length 904 aa.

						>A0A096MRT7_PAPAN|A0A096MRT7|ABCB6
MGTLVGAGGGHVGGATAVELGASPKPSIPVGLQSAEGSQAQSERGRAQTAALSPGRRPRIAMVTVGNYCEAEGPVGPAWMQDGLSPCFFFTLVPSTRMALGALALVLALPCRPRERPAGTDSLSWGAGPRVSPYVLQLLLATFQVALPLAGLAGRVGTARGAPLPSYLLLASVLESLAGACGLWLLVVERSQARQRLAMGIWIKFRHSPGLLLLWTVAFAAENLALVSWNSPQWWWARADLGQQVQFSLWVLRYVVSGGLFVLGLWAPGLRPQSYTLQVHEEDQDVERSQVQSTAQQSTWRDFGRKLRLLSGYLWPRGSPALQLVVLICLGLMGLERALNVLVPIFYRNIVNLLTEKAPWSSLAWTVTSYVFLKFLQGGGTGSTGFVSNLRTFLWIRVQQFTSRRVELRIFSHLHELSLRWHLGRRTGEVLRIADRGTSSVTGLLSYLVFNVIPTLADIVIGIIYFSMFFNAWFGLIVFLCMSLYLTLTIVVTEWRTKFRRAMNTQENATRARAVDSLLNFETVKYYNAESYEVERYREAIIKYQGLEWKSSASLVLLNQTQNLVIGLGLLAGSLLCAYFVSEQKLQVGDYVLFGTYIIQLYMPLNWFGTYYRMIQTNFIDMENMFDLLKEETEVKDLPGAGPLRFQKGRIEFENVHFSYADGRETLQDVSFTVMPGQTLALVGPSGAGKSTILRLLFRFYDISSGCIRIDGQDISQVTQASLRSHIGVVPQDTVLFNDTIADNIRYGRVTAGNDEVEAAAQAAGIHDAIMAFPEGYRTQVGERGLKLSGGEKQRVAIARTILKAPDIILLDEATSALDTSNERAIQASLAKVCANRTTIVVAHRLSTVVNADQILVIKDGCIVERGRHEALLSRGGVYADMWQLQQQGQEETSEDTMPQTMER
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	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
1	M	31	Very low	28.4	Very low	255 Å²	255	122.4 Å²	122.4	100%	1.256	85%	0.852	S	S	*	*				0	134.8	0	-109.7	152.5	161.7	0	0	107.5
2	G	31.5	Very low	28.4	Very low	67 Å²	67	123.9 Å²	123.9	69%	0.691	85%	0.852	S	S	*	*			trans	-114	-173.7	-148.2	0	0	0	0	0	118.6
3	T	31.2	Very low	28.2	Very low	129 Å²	129	120.3 Å²	120.3	79%	0.791	85%	0.848	S	S	*	*			trans	69.7	133.9	144.4	32.4	0	0	0	0	118.2
4	L	28.8	Very low	28	Very low	155 Å²	155	117.9 Å²	117.9	81%	0.812	85%	0.85	S	S	*	*			cis	-142	145	29.7	-83	114.1	0	0	0	110.5
5	V	32	Very low	27.9	Very low	134 Å²	134	116.9 Å²	116.9	81%	0.812	85%	0.85	S	S	*	*				87.4	120.1	62.7	172.2	0	0	0	0	115.5
6	G	26.6	Very low	27.8	Very low	73 Å²	73	118.8 Å²	118.8	75%	0.753	85%	0.854	S	S	*	*			trans	116.5	140.5	157.1	0	0	0	0	0	116.4
7	A	28	Very low	27.7	Very low	106 Å²	106	117.2 Å²	117.2	88%	0.876	85%	0.849	S	S	*	*			cis	-173.7	142.6	-32.2	0	0	0	0	0	109.8
8	G	25	Very low	27.7	Very low	87 Å²	87	117.6 Å²	117.6	90%	0.897	84%	0.843	S	S	*	*			trans	94.1	134.3	153.6	0	0	0	0	0	119.2
9	G	24.9	Very low	27.7	Very low	87 Å²	87	120.4 Å²	120.4	90%	0.897	84%	0.841	S	S	*	*			trans	131.3	106.8	168.2	0	0	0	0	0	113.3
10	G	26.3	Very low	27.7	Very low	73 Å²	73	121.8 Å²	121.8	75%	0.753	84%	0.837	S	S	*	*			trans	-125.2	170.3	-171.6	0	0	0	0	0	116.1
11	H	27.1	Very low	27.5	Very low	180 Å²	180	119.5 Å²	119.5	83%	0.833	83%	0.834	S	S	*	*			trans	61.6	115.2	160.1	-78.2	-54.3	0	0	0	122.4
12	V	27.8	Very low	27.3	Very low	141 Å²	141	111.5 Å²	111.5	86%	0.855	81%	0.808	S	S	*	*				50	123.3	115.9	179.9	0	0	0	0	119.2
13	G	26	Very low	27	Very low	77 Å²	77	113.9 Å²	113.9	79%	0.794	81%	0.814	S	S	*	*			trans	148	117.2	151.5	0	0	0	0	0	113.7
14	G	25.6	Very low	27.6	Very low	86 Å²	86	113.7 Å²	113.7	89%	0.887	82%	0.815	S	S	*	*			trans	-153.8	54.8	-177.4	0	0	0	0	0	113.3
15	A	26.3	Very low	27.6	Very low	103 Å²	103	115.6 Å²	115.6	85%	0.851	82%	0.817	S	S	*	*			trans	-102.4	140.7	167.1	0	0	0	0	0	109.3
16	T	26.4	Very low	27.9	Very low	148 Å²	148	115 Å²	115	91%	0.908	82%	0.816	S	S	*	*			trans	-108.3	127.4	-179.3	36.6	0	0	0	0	111.8
17	A	26.2	Very low	27.8	Very low	92 Å²	92	116 Å²	116	76%	0.76	81%	0.812	S	S	*	*			trans	-143.8	132.7	174.7	0	0	0	0	0	111.5
18	V	27.3	Very low	27.8	Very low	124 Å²	124	118.7 Å²	118.7	75%	0.752	81%	0.81	S	S	*	*				45.8	116.5	129.5	-176	0	0	0	0	120.2
19	E	28.1	Very low	28.5	Very low	171 Å²	171	120.1 Å²	120.1	80%	0.799	80%	0.803	S	S	*	*			trans	63.5	162.7	150.4	-73.9	179.8	174	0	0	118.8
20	L	27.7	Very low	28.7	Very low	147 Å²	147	122.7 Å²	122.7	77%	0.77	80%	0.801	S	S	*	*			cis	-156.7	168.6	16.7	-134.1	152.5	0	0	0	109.7	A22	L20-A22 HydrophobicContact CD2-CB 4.47Å
21	G	23.2	Very low	28.6	Very low	74 Å²	74	122.8 Å²	122.8	76%	0.763	80%	0.802	S	S	*	*			trans	-154.9	125.8	166.9	0	0	0	0	0	112.7
22	A	26.4	Very low	28.5	Very low	87 Å²	87	121.5 Å²	121.5	72%	0.719	80%	0.8	S	S	*	*			trans	-157	149	-174.2	0	0	0	0	0	113.8	L20	L20-A22 HydrophobicContact CD2-CB 4.47Å
23	S	26.3	Very low	28.5	Very low	117 Å²	117	123.1 Å²	123.1	82%	0.818	80%	0.799	S	S	*	*			trans	136.6	156.9	153.1	-70.1	0	0	0	0	113.8
24	P	43.9	Very low	28.4	Very low	126 Å²	126	124.4 Å²	124.4	82%	0.818	80%	0.796	S	S	*	*			cis	-135.2	-179.2	-25.8	33.3	-13	0	0	0	115.4
25	K	28.4	Very low	28.4	Very low	195 Å²	195	124.6 Å²	124.6	85%	0.848	79%	0.789	S	S	*	*			trans	-73.1	160.4	174.5	-84.1	177.7	173.5	175.4	0	114.1
26	P	38.4	Very low	28.4	Very low	122 Å²	122	128.7 Å²	128.7	79%	0.792	79%	0.79	S	S	*	*				-146	-170.4	84.8	32.2	-10.6	0	0	0	115
27	S	25.2	Very low	28.3	Very low	94 Å²	94	125.2 Å²	125.2	66%	0.657	78%	0.784	S	S	*	*				-172	142.7	-60.7	61.1	0	0	0	0	113.4
28	I	27.4	Very low	28.2	Very low	162 Å²	162	125.5 Å²	125.5	83%	0.831	78%	0.78	S	S	*	*			trans	70.5	156.4	157.3	-68.6	171.6	0	0	0	115.7
29	P	38.7	Very low	28.2	Very low	117 Å²	117	128 Å²	128	76%	0.76	78%	0.784	S	S	*	*			cis	-125	179.4	5.3	20.1	5.3	0	0	0	117.7
30	V	29.4	Very low	28.1	Very low	140 Å²	140	124.4 Å²	124.4	85%	0.848	78%	0.783	S	S	*	*			trans	-97.7	149	162.6	169.6	0	0	0	0	110
31	G	24.6	Very low	28.1	Very low	76 Å²	76	125.5 Å²	125.5	78%	0.784	78%	0.784	S	S	*	*			trans	-137.3	154.5	171.5	0	0	0	0	0	112.4
32	L	26.2	Very low	28.3	Very low	152 Å²	152	126.2 Å²	126.2	80%	0.796	78%	0.777	S	S	*	*			trans	-126.2	158.3	-167.3	-118.2	150.3	0	0	0	111
33	Q	26.4	Very low	28.6	Very low	176 Å²	176	128.2 Å²	128.2	82%	0.822	77%	0.772	S	S	*	*			trans	68.8	150.6	165.6	-71.6	168.9	-18.2	0	0	116.2
34	S	24.3	Very low	28.7	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	77%	0.774	S	S	*	*			cis	-173.3	165.3	-4.6	44.1	0	0	0	0	111.3
35	A	25.7	Very low	27.9	Very low	90 Å²	90	131.2 Å²	131.2	74%	0.744	77%	0.774	S	S	*	*			trans	70.7	155.5	159.4	0	0	0	0	0	117
36	E	25.5	Very low	27.9	Very low	189 Å²	189	133.9 Å²	133.9	88%	0.883	78%	0.778	S	S	*	*			cis	-161	153.3	1.8	-142.1	168.6	-158.1	0	0	112.7
37	G	24.5	Very low	27.4	Very low	75 Å²	75	132.1 Å²	132.1	77%	0.773	77%	0.774	S	S	*	*			trans	70.7	157.6	156.2	0	0	0	0	0	120.4
38	S	25.1	Very low	27.6	Very low	98 Å²	98	136.4 Å²	136.4	69%	0.685	78%	0.784	S	S	*	*			cis	-164.7	148.4	-20.1	-169.3	0	0	0	0	111
39	Q	26.6	Very low	27.7	Very low	177 Å²	177	135.3 Å²	135.3	83%	0.827	79%	0.785	S	S	*	*			trans	33.1	131.5	151.2	-65.8	168.7	-19.4	0	0	120.6
40	A	26.1	Very low	27.1	Very low	94 Å²	94	134 Å²	134	78%	0.777	78%	0.784	S	S	*	*				175.5	177.4	67.9	0	0	0	0	0	109.7
41	Q	28.5	Very low	27	Very low	170 Å²	170	131.4 Å²	131.4	79%	0.794	78%	0.777	S	S	*	*			cis	-171.7	162.1	-40.6	-175.1	167.5	3.6	0	0	107.7
42	S	27	Very low	27.2	Very low	89 Å²	89	136 Å²	136	62%	0.622	78%	0.783	S	S	*	*			trans	73.4	145.6	166.9	-86	0	0	0	0	119.1
43	E	31.7	Very low	27.5	Very low	130 Å²	130	133.7 Å²	133.7	61%	0.607	78%	0.779	S	S	*	*			cis	-162.5	149.4	-11.5	-127.7	172.5	128.2	0	0	115.4
44	R	29.4	Very low	28.2	Very low	228 Å²	228	130.9 Å²	130.9	86%	0.86	78%	0.776	S	S	*	*			trans	43.9	132.2	143.6	-79	169.1	-174.2	163.4	-5.5	123.6
45	G	27.4	Very low	28.7	Very low	78 Å²	78	129.5 Å²	129.5	80%	0.804	78%	0.778	S	S	*	*			trans	-170.2	102.3	151.7	0	0	0	0	0	114.4
46	R	27.3	Very low	29	Very low	250 Å²	250	137.4 Å²	137.4	94%	0.943	79%	0.789	S	S	*	*			trans	-43.1	144.3	178.5	-71.1	168.9	174.5	157.3	-3.8	114.7
47	A	27.9	Very low	29.5	Very low	86 Å²	86	139.5 Å²	139.5	71%	0.711	79%	0.789	S	S	*	*			cis	99.2	122.6	36.6	0	0	0	0	0	115.7
48	Q	29.6	Very low	30.1	Very low	183 Å²	183	142.1 Å²	142.1	86%	0.855	79%	0.792	S	S	*	*			trans	86.4	149.3	147.4	-75.3	-178.4	-20.9	0	0	124.4
49	T	29	Very low	30.6	Very low	139 Å²	139	149 Å²	149	85%	0.853	80%	0.803	S	S	*	*			trans	63.3	141.4	164.6	54.9	0	0	0	0	120.3
50	A	27.3	Very low	31.2	Very low	90 Å²	90	148.4 Å²	148.4	74%	0.744	80%	0.804	S	S	*	*			cis	-165.1	150.2	-15.5	0	0	0	0	0	112.2
51	A	27.7	Very low	31.8	Very low	86 Å²	86	147.8 Å²	147.8	71%	0.711	80%	0.799	S	S	*	*			trans	53.6	136.4	141	0	0	0	0	0	124.6
52	L	28.1	Very low	32.5	Very low	173 Å²	173	148.2 Å²	148.2	91%	0.906	80%	0.803	S	S	*	*			trans	89.1	144.5	147.2	-70.4	154.9	0	0	0	121.1
53	S	33.3	Very low	33.6	Very low	102 Å²	102	146.7 Å²	146.7	71%	0.713	79%	0.79	S	S	*	*			trans	-100.1	-175.3	-167.1	62.7	0	0	0	0	110.8
54	P	40.7	Very low	34.6	Very low	117 Å²	117	144.7 Å²	144.7	76%	0.76	79%	0.787	S	S	*	*			cis	-143.1	161.5	13.7	40.8	-20.4	0	0	0	119.5
55	G	34.5	Very low	35.9	Very low	75 Å²	75	138.5 Å²	138.5	77%	0.773	77%	0.774	S	S	*	*			trans	58.1	112.3	138.8	0	0	0	0	0	121.9
56	R	32.5	Very low	37.4	Very low	257 Å²	257	135.9 Å²	135.9	97%	0.97	75%	0.747	S	S	*	*			trans	-158.9	155.5	143.3	-109.6	162.8	-168.3	-165.6	2.9	112
57	R	35.3	Very low	39	Very low	233 Å²	233	129.1 Å²	129.1	88%	0.879	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-61.2	153.8	-170.4	-63.5	175.9	-178.2	172.5	-0.7	113.6	R59	R57-R59 PolarHBondContact O-N 3.34Å
58	P	36.2	Very low	40.6	Very low	130 Å²	130	131.4 Å²	131.4	84%	0.844	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-63.5	132.4	176.1	27.1	-34.8	0	0	0	111.5
59	R	36.2	Very low	42.2	Very low	241 Å²	241	124.3 Å²	124.3	91%	0.909	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-83.2	135.7	168.8	-77.2	-178.7	169.6	178.6	-4.1	109.6	R57 A61	R57-R59 PolarHBondContact O-N 3.34Å; R59-A61 PolarHBondContact O-N 3.23Å
60	I	40	Very low	43.2	Very low	165 Å²	165	124.9 Å²	124.9	85%	0.846	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-66.8	125.2	166.4	-61	168.6	0	0	0	107.4	M62	I60-M62 PolarHBondContact O-N 3.49Å
61	A	39.1	Very low	44.3	Very low	81 Å²	81	125.5 Å²	125.5	67%	0.669	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-74.2	121.7	174.1	0	0	0	0	0	109.6	R59	R59-A61 PolarHBondContact O-N 3.23Å
62	M	43.3	Very low	45.4	Very low	179 Å²	179	125 Å²	125	88%	0.882	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-76.8	131.1	171.1	-72.9	-178.8	172.8	0	0	109.7	I60	I60-M62 PolarHBondContact O-N 3.49Å
63	V	48.9	Very low	46.4	Very low	58 Å²	58	119.9 Å²	119.9	35%	0.352	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-87.7	127.5	175.2	-179.7	0	0	0	0	109.2	L164	V63-L164 HydrophobicContact CG1-CB 4.37Å; V63-L164 HydrophobicContact CG1-CD1 3.88Å; V63-L164 HydrophobicContact CG1-CG 3.94Å
64	T	53.2	Low	47	Very low	88 Å²	88	121 Å²	121	54%	0.54	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-86.8	143.9	174.5	46.6	0	0	0	0	110.9	P163 L164	T64-P163 CarbonylContact O-C 3.56Å; T64-P163 VanDerWaalsContact O-CA 3.22Å; T64-P163 WeakPolarHBondContact O-CA 3.35Å; T64-L164 PolarHBondContact O-N 3.32Å
65	V	57.4	Low	47.4	Very low	97 Å²	97	121.4 Å²	121.4	59%	0.588	67%	0.666	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.9	130.7	176.4	-179.1	0	0	0	0	109.1
66	G	58.4	Low	47.9	Very low	23 Å²	23	121 Å²	121	24%	0.237	66%	0.662	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.8	164.8	-179.8	0	0	0	0	0	114.5	L164 S166	G66-L164 PolarHBondContact N-O 2.87Å; G66-S166 PolarHBondContact O-OG 3.37Å; G66-S166 VanDerWaalsContact O-OG 3.14Å
67	N	59.8	Low	48.9	Very low	108 Å²	108	113.3 Å²	113.3	58%	0.578	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-59.3	157.8	177.4	-74.8	-13.7	0	0	0	113	C69 E70	N67-C69 PolarHBondContact O-N 2.93Å; N67-E70 HydrophobicContact CB-CG 4.08Å; N67-E70 VanDerWaalsContact CB-OE2 3.27Å; N67-E70 WeakPolarHBondContact CB-OE2 3.36Å; N67-E70 VanDerWaalsContact ND2-CD 3.34Å; N67-E70 PolarHBondContact ND2-OE1 3.28Å; N67-E70 PolarHBondContact ND2-OE2 3.09Å
68	Y	62.1	Low	49.6	Very low	135 Å²	135	103.3 Å²	103.3	53%	0.529	61%	0.612	S	S	.	*	S	Bend	trans	-79	79.7	-172.8	-163.4	-92.9	0	0	0	111.4
69	C	63.2	Low	50.6	Low	33 Å²	33	105.3 Å²	105.3	22%	0.223	60%	0.603	C	S	.	*	S	Bend	trans	69.1	55	175.7	-53.3	0	0	0	0	117.1	N67 C87 Y167	N67-C69 PolarHBondContact O-N 2.93Å; C69-C87 HydrophobicContact CB-CB 3.99Å; C69-C87 WeakPolarHBondContact CB-SG 3.47Å; C69-C87 WeakPolarHBondContact SG-CB 3.4Å; C69-C87 CovalentContact SG-SG 2.04Å; C69-C87 PolarHBondContact SG-SG 2.93Å; C69-Y167 WeakPolarHBondContact SG-CD1 3.38Å; C69-Y167 VanDerWaalsContact SG-CE1 3.59Å
70	E	50.1	Low	51.4	Low	151 Å²	151	100 Å²	100	71%	0.706	59%	0.59	S	S	*	*			trans	-84.2	-8.6	170.6	-75.5	-179	146.7	0	0	115	N67 E72	N67-E70 HydrophobicContact CB-CG 4.08Å; N67-E70 VanDerWaalsContact CB-OE2 3.27Å; N67-E70 WeakPolarHBondContact CB-OE2 3.36Å; N67-E70 VanDerWaalsContact ND2-CD 3.34Å; N67-E70 PolarHBondContact ND2-OE1 3.28Å; N67-E70 PolarHBondContact ND2-OE2 3.09Å; E70-E72 VanDerWaalsContact C-N 3.31Å; E70-E72 PolarHBondContact O-N 3.46Å
71	A	49.7	Very low	52.1	Low	103 Å²	103	100.7 Å²	100.7	85%	0.851	59%	0.59	S	S	*	*	S	Bend	trans	-76.1	-15.6	-176.2	0	0	0	0	0	114.3
72	E	51.8	Low	52.9	Low	75 Å²	75	101.4 Å²	101.4	35%	0.35	58%	0.583	S	S	.	*	S	Bend	trans	-138.1	131.8	-178.8	-66.2	175.5	176	0	0	108.3	E70 S85	E70-E72 VanDerWaalsContact C-N 3.31Å; E70-E72 PolarHBondContact O-N 3.46Å; E72-S85 WeakPolarHBondContact OE2-CB 3.23Å
73	G	48.4	Very low	53.8	Low	66 Å²	66	94.2 Å²	94.2	68%	0.68	55%	0.554	S	S	*	*			trans	-65.2	179.2	-171	0	0	0	0	0	115.6	V75	G73-V75 PolarHBondContact O-N 3.4Å
74	P	45.3	Very low	54.7	Low	127 Å²	127	91.7 Å²	91.7	83%	0.825	54%	0.539	S	S	*	.	S	Bend	trans	-67.8	94.7	-166.5	28.1	-36.6	0	0	0	113.4	G76	P74-G76 WeakPolarHBondContact O-CA 3.47Å; P74-G76 PolarHBondContact O-N 2.86Å
75	V	50.3	Low	55.6	Low	124 Å²	124	88.8 Å²	88.8	75%	0.752	52%	0.522	S	S	*	.	S	Bend	trans	51.2	-1.2	156.8	-156.6	0	0	0	0	117.6	G73	G73-V75 PolarHBondContact O-N 3.4Å
76	G	45.5	Very low	56.4	Low	67 Å²	67	85 Å²	85	69%	0.691	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-40.4	-157.7	0	0	0	0	0	116.6	P74	P74-G76 WeakPolarHBondContact O-CA 3.47Å; P74-G76 PolarHBondContact O-N 2.86Å
77	P	51.9	Low	57.1	Low	96 Å²	96	85.2 Å²	85.2	62%	0.623	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	45.8	-179.9	40.2	-29.1	0	0	0	112.5	W79 M80	P77-W79 PolarHBondContact O-N 2.97Å; P77-M80 PolarHBondContact O-N 2.8Å
78	A	51.3	Low	57.7	Low	22 Å²	22	83.5 Å²	83.5	18%	0.182	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	7.2	-174.2	0	0	0	0	0	116.9
79	W	57.2	Low	58.4	Low	173 Å²	173	77.6 Å²	77.6	66%	0.655	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.8	-13.4	-174.3	-76.4	81.7	0	0	0	115.3	P77 L84	P77-W79 PolarHBondContact O-N 2.97Å; W79-L84 HydrophobicContact CD2-CD2 4.41Å; W79-L84 HydrophobicContact CH2-CD2 4.45Å; W79-L84 HydrophobicContact CZ2-CD2 3.92Å
80	M	52.1	Low	59.1	Low	129 Å²	129	77 Å²	77	64%	0.635	46%	0.455	S	S	*	.	S	Bend	trans	-106.6	-1.2	-154.3	-142.5	-172.3	-72.6	0	0	117.2	P77 W360	P77-M80 PolarHBondContact O-N 2.8Å; M80-W360 HydrophobicContact CE-CD2 4.5Å
81	Q	54.2	Low	60.4	Low	179 Å²	179	71.6 Å²	71.6	84%	0.836	43%	0.432	S	S	*	.	S	Bend	trans	-131.7	-54.8	176.7	-70.2	-176.3	-25.3	0	0	113.9
82	D	55.8	Low	61.8	Low	97 Å²	97	70.5 Å²	70.5	52%	0.519	41%	0.412	S	S	.	.	S	Bend	trans	-128.9	28.2	-173.7	-67.5	-67	0	0	0	115	S231	D82-S231 WeakPolarHBondContact O-CB 3.21Å; D82-S231 PolarHBondContact O-OG 3.08Å
83	G	63.7	Low	63.2	Low	27 Å²	27	67.6 Å²	67.6	28%	0.278	40%	0.399	S	S	.	.	S	Bend	trans	85.2	-159.3	-179.1	0	0	0	0	0	114.3
84	L	68	Low	64.7	Low	6 Å²	6	64.4 Å²	64.4	3%	0.031	37%	0.366	C	S	.	.	S	Bend	trans	-74.8	133.8	-179.6	-67.6	173.4	0	0	0	111.1	W79 F88 F89 L224 S228 W234	W79-L84 HydrophobicContact CD2-CD2 4.41Å; W79-L84 HydrophobicContact CH2-CD2 4.45Å; W79-L84 HydrophobicContact CZ2-CD2 3.92Å; L84-F88 HydrophobicContact CD2-CD1 4.18Å; L84-F88 HydrophobicContact CD2-CE1 4.29Å; L84-F89 HydrophobicContact CD1-CD2 4.26Å; L84-L224 HydrophobicContact CD1-CD1 3.99Å; L84-L224 HydrophobicContact CD1-CD2 3.96Å; L84-L224 HydrophobicContact CD1-CG 3.73Å; L84-S228 PolarHBondContact N-OG 3.46Å; L84-S228 PolarHBondContact O-OG 3.29Å; L84-W234 HydrophobicContact CB-CZ2 4.42Å; L84-W234 WeakPolarHBondContact O-CZ2 3.12Å; L84-W234 PolarHBondContact O-NE1 3.23Å
85	S	71.8	Confident	66.5	Low	27 Å²	27	60.8 Å²	60.8	19%	0.189	34%	0.344	C	S	.	.			trans	-66.6	139.5	172.9	55.1	0	0	0	0	111.8	E72 C87 F88 F89	E72-S85 WeakPolarHBondContact OE2-CB 3.23Å; S85-C87 VanDerWaalsContact C-N 3.26Å; S85-C87 PolarHBondContact O-N 3.04Å; S85-F88 PolarHBondContact O-N 2.7Å; S85-F88 VanDerWaalsContact OG-CB 3.23Å; S85-F88 WeakPolarHBondContact OG-CB 3.2Å; S85-F89 PolarHBondContact O-N 2.72Å
86	P	73.1	Confident	68	Low	18 Å²	18	57.7 Å²	57.7	12%	0.117	33%	0.325	C	S	.	.	H	α-helix	trans	-56.8	-37.8	176.5	-27	35.6	0	0	0	113.1	F88 F89 F90 Q233	P86-F88 PolarHBondContact O-N 3.41Å; P86-F89 PolarHBondContact O-N 2.76Å; P86-F90 HydrophobicContact CB-CD2 4.25Å; P86-F90 HydrophobicContact CB-CE2 4.4Å; P86-F90 WeakPolarHBondContact O-CB 3.34Å; P86-F90 WeakPolarHBondContact O-CD2 3.47Å; P86-F90 PolarHBondContact O-N 2.99Å; P86-Q233 HydrophobicContact CG-CB 4.36Å
87	C	72.9	Confident	69.7	Low	26 Å²	26	54.8 Å²	54.8	18%	0.176	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-45.9	176.9	177.2	0	0	0	0	112	C69 S85 T91 Y167	C69-C87 HydrophobicContact CB-CB 3.99Å; C69-C87 WeakPolarHBondContact CB-SG 3.47Å; C69-C87 WeakPolarHBondContact SG-CB 3.4Å; C69-C87 CovalentContact SG-SG 2.04Å; C69-C87 PolarHBondContact SG-SG 2.93Å; S85-C87 VanDerWaalsContact C-N 3.26Å; S85-C87 PolarHBondContact O-N 3.04Å; C87-T91 WeakPolarHBondContact O-CB 3.44Å; C87-T91 VanDerWaalsContact O-CG2 3.29Å; C87-T91 WeakPolarHBondContact O-CG2 3.16Å; C87-T91 PolarHBondContact O-N 3.19Å; C87-T91 PolarHBondContact O-OG1 3.22Å; C87-Y167 HydrophobicContact CB-CE1 4.29Å
88	F	73.4	Confident	71.3	Confident	72 Å²	72	52.5 Å²	52.5	32%	0.316	28%	0.275	S	S	.	.	H	α-helix	trans	-68.3	-43.6	179.6	-178.7	-103.4	0	0	0	111.9	L84 S85 P86 T91 L92	L84-F88 HydrophobicContact CD2-CD1 4.18Å; L84-F88 HydrophobicContact CD2-CE1 4.29Å; S85-F88 PolarHBondContact O-N 2.7Å; S85-F88 VanDerWaalsContact OG-CB 3.23Å; S85-F88 WeakPolarHBondContact OG-CB 3.2Å; P86-F88 PolarHBondContact O-N 3.41Å; F88-T91 PolarHBondContact O-N 3.17Å; F88-T91 PolarHBondContact O-OG1 3.43Å; F88-T91 VanDerWaalsContact O-OG1 3.13Å; F88-L92 HydrophobicContact CE1-CD2 3.84Å; F88-L92 HydrophobicContact CE2-CD2 4.44Å; F88-L92 HydrophobicContact CZ-CD2 3.71Å; F88-L92 VanDerWaalsContact O-CB 3.32Å; F88-L92 WeakPolarHBondContact O-CB 3.47Å; F88-L92 PolarHBondContact O-N 3.04Å
89	F	77.1	Confident	72.8	Confident	11 Å²	11	54.4 Å²	54.4	5%	0.048	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-52.5	178.2	-178.2	-91.9	0	0	0	112.3	L84 S85 P86 T91 V93 L224 A225 W234	L84-F89 HydrophobicContact CD1-CD2 4.26Å; S85-F89 PolarHBondContact O-N 2.72Å; P86-F89 PolarHBondContact O-N 2.76Å; F89-T91 PolarHBondContact O-N 2.91Å; F89-V93 HydrophobicContact CD2-CG2 4.17Å; F89-V93 HydrophobicContact CE2-CG2 4.03Å; F89-V93 HydrophobicContact CZ-CG2 4.29Å; F89-V93 WeakPolarHBondContact O-CB 3.37Å; F89-V93 PolarHBondContact O-N 3.29Å; F89-V93 VanDerWaalsContact O-N 3.14Å; F89-L224 HydrophobicContact CD2-CD2 4.21Å; F89-L224 HydrophobicContact CD2-CG 4.47Å; F89-L224 HydrophobicContact CE2-CB 4.1Å; F89-L224 HydrophobicContact CE2-CD2 4.07Å; F89-L224 HydrophobicContact CE2-CG 4.14Å; F89-A225 HydrophobicContact CZ-CB 4.3Å; F89-W234 HydrophobicContact CB-CH2 4.21Å; F89-W234 HydrophobicContact CB-CZ2 4.23Å; F89-W234 AromaticContact CD1-CH2 3.88Å; F89-W234 HydrophobicContact CD1-CH2 3.88Å; F89-W234 AromaticContact CD2-CH2 3.91Å; F89-W234 HydrophobicContact CD2-CH2 3.91Å; F89-W234 HydrophobicContact CE1-CH2 4.2Å; F89-W234 HydrophobicContact CE2-CH2 4.22Å; F89-W234 AromaticContact CG-CH2 3.73Å; F89-W234 HydrophobicContact CG-CH2 3.73Å; F89-W234 HydrophobicContact CG-CZ2 4.24Å; F89-W234 HydrophobicContact CZ-CH2 4.36Å
90	F	77.1	Confident	73.9	Confident	21 Å²	21	48.8 Å²	48.8	9%	0.092	27%	0.273	C	S	.	.	H	α-helix	trans	-73.9	-6	-177.7	-71.7	-64.1	0	0	0	114.1	P86 P94 Y167 L168 A171 W235	P86-F90 HydrophobicContact CB-CD2 4.25Å; P86-F90 HydrophobicContact CB-CE2 4.4Å; P86-F90 WeakPolarHBondContact O-CB 3.34Å; P86-F90 WeakPolarHBondContact O-CD2 3.47Å; P86-F90 PolarHBondContact O-N 2.99Å; F90-P94 VanDerWaalsContact O-CD 3.28Å; F90-P94 WeakPolarHBondContact O-CD 3.15Å; F90-P94 VanDerWaalsContact O-CG 3.27Å; F90-P94 WeakPolarHBondContact O-CG 3.32Å; F90-Y167 HydrophobicContact CB-CD2 4.06Å; F90-Y167 HydrophobicContact CB-CE2 4.05Å; F90-Y167 HydrophobicContact CD2-CE2 4.36Å; F90-L168 HydrophobicContact CB-CD2 4.39Å; F90-L168 HydrophobicContact CD2-CD2 4.05Å; F90-L168 HydrophobicContact CG-CD2 4.13Å; F90-A171 HydrophobicContact CB-CB 4.11Å; F90-A171 WeakPolarHBondContact O-CB 3.4Å; F90-W235 HydrophobicContact CE2-CH2 4.38Å; F90-W235 HydrophobicContact CE2-CZ3 4.02Å; F90-W235 AromaticContact CZ-CH2 3.8Å; F90-W235 HydrophobicContact CZ-CH2 3.8Å; F90-W235 AromaticContact CZ-CZ3 3.77Å; F90-W235 HydrophobicContact CZ-CZ3 3.77Å
91	T	77.6	Confident	75.2	Confident	38 Å²	38	42.7 Å²	42.7	23%	0.233	24%	0.244	C	C	.	.	H	α-helix	trans	-100.4	-42.2	171.8	50.6	0	0	0	0	112.4	C87 F88 F89 S95	C87-T91 WeakPolarHBondContact O-CB 3.44Å; C87-T91 VanDerWaalsContact O-CG2 3.29Å; C87-T91 WeakPolarHBondContact O-CG2 3.16Å; C87-T91 PolarHBondContact O-N 3.19Å; C87-T91 PolarHBondContact O-OG1 3.22Å; F88-T91 PolarHBondContact O-N 3.17Å; F88-T91 PolarHBondContact O-OG1 3.43Å; F88-T91 VanDerWaalsContact O-OG1 3.13Å; F89-T91 PolarHBondContact O-N 2.91Å; T91-S95 WeakPolarHBondContact O-CB 3.35Å; T91-S95 PolarHBondContact O-OG 3.02Å
92	L	80.1	Confident	76.5	Confident	80 Å²	80	36.1 Å²	36.1	42%	0.419	22%	0.22	S	C	.	.	H	α-helix	trans	-73.5	-43.1	-178	-174.9	67.6	0	0	0	113.2	F88 S95 T96	F88-L92 HydrophobicContact CE1-CD2 3.84Å; F88-L92 HydrophobicContact CE2-CD2 4.44Å; F88-L92 HydrophobicContact CZ-CD2 3.71Å; F88-L92 VanDerWaalsContact O-CB 3.32Å; F88-L92 WeakPolarHBondContact O-CB 3.47Å; F88-L92 PolarHBondContact O-N 3.04Å; L92-S95 PolarHBondContact O-OG 2.91Å; L92-S95 VanDerWaalsContact O-OG 3.06Å; L92-T96 HydrophobicContact CD1-CG2 4.05Å; L92-T96 HydrophobicContact CG-CG2 4.4Å; L92-T96 WeakPolarHBondContact O-CB 3.42Å; L92-T96 VanDerWaalsContact O-CG2 3.3Å; L92-T96 WeakPolarHBondContact O-CG2 3.5Å; L92-T96 PolarHBondContact O-N 2.99Å; L92-T96 VanDerWaalsContact O-N 3.07Å; L92-T96 PolarHBondContact O-OG1 3.08Å
93	V	80.3	Confident	77.8	Confident	13 Å²	13	36.3 Å²	36.3	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-66.7	-47.4	-175.9	166.5	0	0	0	0	112.4	F89 T96 R97 A221	F89-V93 HydrophobicContact CD2-CG2 4.17Å; F89-V93 HydrophobicContact CE2-CG2 4.03Å; F89-V93 HydrophobicContact CZ-CG2 4.29Å; F89-V93 WeakPolarHBondContact O-CB 3.37Å; F89-V93 PolarHBondContact O-N 3.29Å; F89-V93 VanDerWaalsContact O-N 3.14Å; V93-T96 PolarHBondContact O-OG1 3.21Å; V93-T96 VanDerWaalsContact O-OG1 3.07Å; V93-R97 PolarHBondContact O-N 3.24Å; V93-R97 VanDerWaalsContact O-N 3.11Å; V93-A221 HydrophobicContact CG1-CB 3.53Å; V93-A221 HydrophobicContact CG2-CB 4.27Å
94	P	80.6	Confident	78.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.8	-38.2	-179.6	-25.2	39.4	0	0	0	113	F90 M98 A171 L174 E175	F90-P94 VanDerWaalsContact O-CD 3.28Å; F90-P94 WeakPolarHBondContact O-CD 3.15Å; F90-P94 VanDerWaalsContact O-CG 3.27Å; F90-P94 WeakPolarHBondContact O-CG 3.32Å; P94-M98 VanDerWaalsContact O-CB 3.29Å; P94-M98 WeakPolarHBondContact O-CB 3.43Å; P94-M98 PolarHBondContact O-N 2.98Å; P94-A171 HydrophobicContact CG-CB 4.03Å; P94-L174 HydrophobicContact CB-CB 3.59Å; P94-L174 HydrophobicContact CB-CD1 4.32Å; P94-E175 HydrophobicContact CB-CG 3.67Å; P94-E175 HydrophobicContact CG-CG 3.62Å
95	S	81.9	Confident	78.8	Confident	51 Å²	51	37.3 Å²	37.3	36%	0.357	22%	0.222	S	C	.	.	H	α-helix	trans	-66.9	-43.6	179.3	57.1	0	0	0	0	112.2	T91 L92 M98 A99	T91-S95 WeakPolarHBondContact O-CB 3.35Å; T91-S95 PolarHBondContact O-OG 3.02Å; L92-S95 PolarHBondContact O-OG 2.91Å; L92-S95 VanDerWaalsContact O-OG 3.06Å; S95-M98 PolarHBondContact O-N 2.92Å; S95-A99 WeakPolarHBondContact O-CB 3.36Å; S95-A99 PolarHBondContact O-N 3.24Å
96	T	82.6	Confident	79.2	Confident	58 Å²	58	40.4 Å²	40.4	36%	0.356	24%	0.239	S	C	.	.	H	α-helix	trans	-65.6	-43.2	175.8	51.4	0	0	0	0	112.4	L92 V93 M98 A99 L100	L92-T96 HydrophobicContact CD1-CG2 4.05Å; L92-T96 HydrophobicContact CG-CG2 4.4Å; L92-T96 WeakPolarHBondContact O-CB 3.42Å; L92-T96 VanDerWaalsContact O-CG2 3.3Å; L92-T96 WeakPolarHBondContact O-CG2 3.5Å; L92-T96 PolarHBondContact O-N 2.99Å; L92-T96 VanDerWaalsContact O-N 3.07Å; L92-T96 PolarHBondContact O-OG1 3.08Å; V93-T96 PolarHBondContact O-OG1 3.21Å; V93-T96 VanDerWaalsContact O-OG1 3.07Å; T96-M98 PolarHBondContact O-N 3.47Å; T96-A99 PolarHBondContact O-N 3.36Å; T96-L100 WeakPolarHBondContact O-CG 3.38Å; T96-L100 PolarHBondContact O-N 2.94Å
97	R	81.7	Confident	79.2	Confident	7 Å²	7	45.1 Å²	45.1	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-41.4	173.7	-77.1	-171.9	70.4	174.3	2.1	112.5	V93 G101 Q144 A178 V217	V93-R97 PolarHBondContact O-N 3.24Å; V93-R97 VanDerWaalsContact O-N 3.11Å; R97-G101 PolarHBondContact O-N 3.37Å; R97-Q144 VanDerWaalsContact NH2-CD 3.32Å; R97-Q144 VanDerWaalsContact NH2-NE2 3.17Å; R97-A178 HydrophobicContact CB-CB 4Å; R97-V217 HydrophobicContact CG-CG1 3.83Å
98	M	84.6	Confident	78.9	Confident	47 Å²	47	45.1 Å²	45.1	23%	0.232	26%	0.264	C	S	.	.	H	α-helix	trans	-67	-42.4	178.4	-175.5	59.2	-178.4	0	0	111.8	P94 S95 T96 L100 G101 A102 L174 L177 A178	P94-M98 VanDerWaalsContact O-CB 3.29Å; P94-M98 WeakPolarHBondContact O-CB 3.43Å; P94-M98 PolarHBondContact O-N 2.98Å; S95-M98 PolarHBondContact O-N 2.92Å; T96-M98 PolarHBondContact O-N 3.47Å; M98-L100 PolarHBondContact O-N 3.05Å; M98-G101 PolarHBondContact O-N 3.22Å; M98-A102 WeakPolarHBondContact O-CB 3.48Å; M98-A102 PolarHBondContact O-N 3.34Å; M98-L174 HydrophobicContact CB-CD2 4.26Å; M98-L174 HydrophobicContact CG-CD2 4.03Å; M98-L177 HydrophobicContact CE-CB 3.87Å; M98-L177 HydrophobicContact CE-CD1 4.28Å; M98-L177 HydrophobicContact SD-CB 3.69Å; M98-A178 HydrophobicContact CB-CB 4.31Å; M98-A178 HydrophobicContact SD-CB 4.33Å
99	A	83.4	Confident	78.5	Confident	63 Å²	63	45.8 Å²	45.8	52%	0.521	27%	0.271	S	S	.	.	H	α-helix	trans	-61.2	-44.4	176.3	0	0	0	0	0	112.3	S95 T96 A102 L103	S95-A99 WeakPolarHBondContact O-CB 3.36Å; S95-A99 PolarHBondContact O-N 3.24Å; T96-A99 PolarHBondContact O-N 3.36Å; A99-A102 PolarHBondContact O-N 3.07Å; A99-L103 WeakPolarHBondContact O-CB 3.43Å; A99-L103 PolarHBondContact O-N 3.48Å
100	L	80.8	Confident	77.7	Confident	54 Å²	54	50.4 Å²	50.4	28%	0.283	30%	0.302	S	S	.	.	H	α-helix	trans	-66.3	-40.5	175.4	-69.4	174.1	0	0	0	112.4	T96 M98 L103 A104 L213 V217	T96-L100 WeakPolarHBondContact O-CG 3.38Å; T96-L100 PolarHBondContact O-N 2.94Å; M98-L100 PolarHBondContact O-N 3.05Å; L100-L103 PolarHBondContact O-N 2.76Å; L100-A104 WeakPolarHBondContact O-CB 3.35Å; L100-A104 PolarHBondContact O-N 2.88Å; L100-L213 HydrophobicContact CD2-CD2 4.09Å; L100-V217 HydrophobicContact CD1-CB 4.41Å; L100-V217 HydrophobicContact CD1-CG1 4.29Å; L100-V217 HydrophobicContact CD1-CG2 3.87Å
101	G	79.3	Confident	76.6	Confident	2 Å²	2	52.6 Å²	52.6	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-62.2	-43.8	175.4	0	0	0	0	0	112.6	R97 M98 L105	R97-G101 PolarHBondContact O-N 3.37Å; M98-G101 PolarHBondContact O-N 3.22Å; G101-L105 VanDerWaalsContact O-CB 3.3Å; G101-L105 WeakPolarHBondContact O-CB 3.38Å; G101-L105 PolarHBondContact O-N 3.17Å
102	A	81.1	Confident	75.4	Confident	41 Å²	41	60.3 Å²	60.3	34%	0.339	34%	0.344	S	S	.	.	H	α-helix	trans	-64.6	-43.8	175.3	0	0	0	0	0	112	M98 A99 L105 V106	M98-A102 WeakPolarHBondContact O-CB 3.48Å; M98-A102 PolarHBondContact O-N 3.34Å; A99-A102 PolarHBondContact O-N 3.07Å; A102-L105 PolarHBondContact O-N 3.13Å; A102-V106 WeakPolarHBondContact O-CG2 3.5Å; A102-V106 PolarHBondContact O-N 3.01Å
103	L	81.9	Confident	74	Confident	100 Å²	100	60.4 Å²	60.4	52%	0.524	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-46.3	176.6	-178.2	66.8	0	0	0	111.9	A99 L100 L105 V106 L107	A99-L103 WeakPolarHBondContact O-CB 3.43Å; A99-L103 PolarHBondContact O-N 3.48Å; L100-L103 PolarHBondContact O-N 2.76Å; L103-L105 VanDerWaalsContact C-N 3.28Å; L103-L105 PolarHBondContact O-N 2.85Å; L103-V106 PolarHBondContact O-N 2.98Å; L103-L107 HydrophobicContact CD1-CD1 4.38Å; L103-L107 HydrophobicContact CG-CD1 4.16Å; L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 2.84Å
104	A	77.6	Confident	72.4	Confident	14 Å²	14	72 Å²	72	12%	0.116	39%	0.392	C	S	.	.	H	α-helix	trans	-60.7	-38.7	176.3	0	0	0	0	0	112	L100 L107 A108 L185	L100-A104 WeakPolarHBondContact O-CB 3.35Å; L100-A104 PolarHBondContact O-N 2.88Å; A104-L107 PolarHBondContact O-N 3.3Å; A104-A108 WeakPolarHBondContact O-CB 3.37Å; A104-A108 PolarHBondContact O-N 3.15Å; A104-L185 HydrophobicContact CB-CD1 4.13Å
105	L	75.9	Confident	70.7	Confident	41 Å²	41	80.4 Å²	80.4	22%	0.215	43%	0.431	C	S	.	.	H	α-helix	trans	-67.5	-43.7	177.4	-170.3	140	0	0	0	112.1	G101 A102 L103 L107 A108 L109 C181 W184	G101-L105 VanDerWaalsContact O-CB 3.3Å; G101-L105 WeakPolarHBondContact O-CB 3.38Å; G101-L105 PolarHBondContact O-N 3.17Å; A102-L105 PolarHBondContact O-N 3.13Å; L103-L105 VanDerWaalsContact C-N 3.28Å; L103-L105 PolarHBondContact O-N 2.85Å; L105-L107 VanDerWaalsContact C-N 3.35Å; L105-L107 PolarHBondContact O-N 3.36Å; L105-A108 PolarHBondContact O-N 3.4Å; L105-L109 HydrophobicContact CD2-CD1 3.94Å; L105-L109 HydrophobicContact CD2-CG 4.48Å; L105-L109 WeakPolarHBondContact O-CG 3.5Å; L105-L109 PolarHBondContact O-N 3.16Å; L105-L109 VanDerWaalsContact O-N 3.17Å; L105-C181 HydrophobicContact CD1-CB 4.4Å; L105-W184 HydrophobicContact CD1-CD2 4.23Å; L105-W184 HydrophobicContact CD1-CE3 3.47Å; L105-W184 VanDerWaalsContact CD1-CE3 3.47Å; L105-W184 HydrophobicContact CD1-CH2 4.45Å; L105-W184 HydrophobicContact CD1-CZ3 3.62Å; L105-W184 HydrophobicContact CD2-CZ3 4.43Å; L105-W184 HydrophobicContact CG-CE3 4Å; L105-W184 HydrophobicContact CG-CH2 4.37Å; L105-W184 HydrophobicContact CG-CZ3 3.62Å
106	V	79.4	Confident	68.9	Low	91 Å²	91	89.3 Å²	89.3	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-62.3	-40.3	174.7	170.4	0	0	0	0	111.6	A102 L103 A108 P110	A102-V106 WeakPolarHBondContact O-CG2 3.5Å; A102-V106 PolarHBondContact O-N 3.01Å; L103-V106 PolarHBondContact O-N 2.98Å; V106-A108 VanDerWaalsContact C-N 3.31Å; V106-A108 PolarHBondContact O-N 3.38Å; V106-P110 WeakPolarHBondContact O-CD 3.33Å
107	L	73.1	Confident	66.9	Low	118 Å²	118	90.7 Å²	90.7	62%	0.618	47%	0.467	S	S	*	.	H	α-helix	trans	-70.5	-24.8	176.5	-68.4	171.5	0	0	0	113.4	L103 A104 L105	L103-L107 HydrophobicContact CD1-CD1 4.38Å; L103-L107 HydrophobicContact CG-CD1 4.16Å; L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 2.84Å; A104-L107 PolarHBondContact O-N 3.3Å; L105-L107 VanDerWaalsContact C-N 3.35Å; L105-L107 PolarHBondContact O-N 3.36Å
108	A	66.5	Low	65	Low	25 Å²	25	95.6 Å²	95.6	21%	0.207	51%	0.509	C	S	.	.	H	α-helix	trans	-82.9	-25.6	178.2	0	0	0	0	0	114	A104 L105 V106 C111 L185	A104-A108 WeakPolarHBondContact O-CB 3.37Å; A104-A108 PolarHBondContact O-N 3.15Å; L105-A108 PolarHBondContact O-N 3.4Å; V106-A108 VanDerWaalsContact C-N 3.31Å; V106-A108 PolarHBondContact O-N 3.38Å; A108-C111 PolarHBondContact O-N 2.86Å; A108-L185 HydrophobicContact CB-CD1 3.98Å
109	L	66.6	Low	63.1	Low	87 Å²	87	97.1 Å²	97.1	46%	0.455	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-62.4	-41.9	-176.8	-79.2	167.3	0	0	0	114.8	L105 C111 W184	L105-L109 HydrophobicContact CD2-CD1 3.94Å; L105-L109 HydrophobicContact CD2-CG 4.48Å; L105-L109 WeakPolarHBondContact O-CG 3.5Å; L105-L109 PolarHBondContact O-N 3.16Å; L105-L109 VanDerWaalsContact O-N 3.17Å; L109-C111 PolarHBondContact O-N 3.38Å; L109-W184 HydrophobicContact CD2-CH2 4.02Å
110	P	59.4	Low	61	Low	107 Å²	107	99.9 Å²	99.9	70%	0.695	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-64.8	-22.1	177	-23.9	34.2	0	0	0	114.4	V106 R112	V106-P110 WeakPolarHBondContact O-CD 3.33Å; P110-R112 PolarHBondContact O-N 3.44Å; P110-R112 VanDerWaalsContact O-N 3.11Å
111	C	54.1	Low	59.1	Low	68 Å²	68	104.9 Å²	104.9	46%	0.459	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-77.6	12.5	-177.6	-65.7	0	0	0	0	114.3	A108 L109 P113	A108-C111 PolarHBondContact O-N 2.86Å; L109-C111 PolarHBondContact O-N 3.38Å; C111-P113 WeakPolarHBondContact O-CD 3.43Å
112	R	53.2	Low	57.4	Low	199 Å²	199	110.4 Å²	110.4	75%	0.751	61%	0.613	S	S	*	*			trans	-92	99	176.8	-163.4	177.9	-163.4	172.1	4.7	109.3	P110 R114	P110-R112 PolarHBondContact O-N 3.44Å; P110-R112 VanDerWaalsContact O-N 3.11Å; R112-R114 PolarHBondContact O-N 3.5Å
113	P	50.8	Low	55.6	Low	82 Å²	82	114.8 Å²	114.8	53%	0.532	63%	0.629	S	S	.	*			trans	-59.9	134.4	176.6	25.8	-34	0	0	0	109.6	C111 E115	C111-P113 WeakPolarHBondContact O-CD 3.43Å; P113-E115 VanDerWaalsContact C-N 3.3Å
114	R	45.9	Very low	53.7	Low	256 Å²	256	113.9 Å²	113.9	97%	0.966	63%	0.632	S	S	*	*			trans	-86.3	-4.2	-177.6	-166	166.5	178.3	159.3	-1.7	112.9	R112	R112-R114 PolarHBondContact O-N 3.5Å
115	E	44.2	Very low	52.1	Low	177 Å²	177	124.4 Å²	124.4	83%	0.827	67%	0.669	S	S	*	*			trans	-93.6	113.1	-178.8	-70.1	171.8	173.2	0	0	110.5	P113	P113-E115 VanDerWaalsContact C-N 3.3Å
116	R	44.6	Very low	50.4	Low	238 Å²	238	125.7 Å²	125.7	90%	0.898	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-88.3	123.2	157.6	-72.3	178.4	174.8	170.9	-3.1	107	A118	R116-A118 PolarHBondContact O-N 3.4Å
117	P	41.7	Very low	48.5	Very low	88 Å²	88	124.7 Å²	124.7	57%	0.571	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-60.5	134	163.5	-18.4	31.6	0	0	0	109.1
118	A	40.8	Very low	47.3	Very low	110 Å²	110	120.1 Å²	120.1	91%	0.909	67%	0.674	S	S	*	*	S	Bend	trans	-71.9	131.2	167	0	0	0	0	0	108.7	R116	R116-A118 PolarHBondContact O-N 3.4Å
119	G	45	Very low	46.2	Very low	79 Å²	79	123 Å²	123	81%	0.814	69%	0.691	S	S	*	*			trans	98.4	47.8	173.5	0	0	0	0	0	116.6
120	T	39.4	Very low	45.5	Very low	120 Å²	120	130 Å²	130	74%	0.736	71%	0.711	S	S	*	*			trans	-128.5	117.4	155.3	39.1	0	0	0	0	110
121	D	40.9	Very low	45.8	Very low	159 Å²	159	126.3 Å²	126.3	85%	0.85	69%	0.687	S	S	*	*			trans	-64	158.2	177.3	-78.7	-46.6	0	0	0	112.1	L123	D121-L123 PolarHBondContact O-N 3.23Å
122	S	42.8	Very low	46.5	Very low	119 Å²	119	127.5 Å²	127.5	83%	0.832	70%	0.695	S	S	*	*			trans	-58.3	99.8	-170.9	55.5	0	0	0	0	113.4	S124	S122-S124 PolarHBondContact O-N 3.45Å; S122-S124 VanDerWaalsContact O-N 3.08Å
123	L	44.4	Very low	47.5	Very low	132 Å²	132	119.9 Å²	119.9	69%	0.691	67%	0.672	S	S	*	*			trans	-61.4	113	163.8	-119	91.4	0	0	0	108.9	D121	D121-L123 PolarHBondContact O-N 3.23Å
124	S	42.5	Very low	48.7	Very low	81 Å²	81	117.2 Å²	117.2	57%	0.566	65%	0.652	S	S	*	*			trans	-64.5	143.1	-177.8	70.2	0	0	0	0	111.2	S122 G126 A127	S122-S124 PolarHBondContact O-N 3.45Å; S122-S124 VanDerWaalsContact O-N 3.08Å; S124-G126 PolarHBondContact O-N 3.13Å; S124-A127 PolarHBondContact O-N 2.9Å
125	W	42.9	Very low	50.4	Low	236 Å²	236	108.4 Å²	108.4	89%	0.894	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-16	-174.7	-82.9	79.8	0	0	0	114.5
126	G	40.8	Very low	52.3	Low	67 Å²	67	103.9 Å²	103.9	69%	0.691	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-20.7	-179.6	0	0	0	0	0	116	S124 G128	S124-G126 PolarHBondContact O-N 3.13Å; G126-G128 VanDerWaalsContact C-N 3.28Å; G126-G128 PolarHBondContact O-N 2.77Å
127	A	39.6	Very low	54.2	Low	71 Å²	71	92.7 Å²	92.7	59%	0.587	57%	0.565	S	S	*	*			trans	-82.7	61.2	-172.6	0	0	0	0	0	113.2	S124	S124-A127 PolarHBondContact O-N 2.9Å
128	G	46.7	Very low	56.3	Low	22 Å²	22	91.3 Å²	91.3	23%	0.227	55%	0.553	C	S	.	*	S	Bend	trans	-156.2	132.2	172.8	0	0	0	0	0	112	G126 R130	G126-G128 VanDerWaalsContact C-N 3.28Å; G126-G128 PolarHBondContact O-N 2.77Å; G128-R130 PolarHBondContact O-N 3.04Å
129	P	44.8	Very low	58.5	Low	85 Å²	85	90.1 Å²	90.1	55%	0.552	53%	0.53	S	S	*	.			trans	-60	127.5	-171.7	14.5	-24	0	0	0	112.3	V131 L270	P129-V131 VanDerWaalsContact C-N 3.3Å; P129-V131 PolarHBondContact O-N 3.06Å; P129-L270 HydrophobicContact CB-CD2 3.91Å; P129-L270 HydrophobicContact CG-CD1 3.72Å; P129-L270 HydrophobicContact CG-CD2 3.59Å; P129-L270 HydrophobicContact CG-CG 4.3Å
130	R	51.9	Low	60.5	Low	234 Å²	234	87.7 Å²	87.7	88%	0.883	50%	0.498	S	S	*	.			trans	-74.2	80.8	179.3	-68.3	-178.3	180	173.8	-0.2	109.8	G128 S132	G128-R130 PolarHBondContact O-N 3.04Å; R130-S132 PolarHBondContact O-N 3Å
131	V	64.2	Low	62.8	Low	30 Å²	30	82 Å²	82	18%	0.182	46%	0.464	C	S	.	.			trans	-62.6	105.3	169.1	-117.8	0	0	0	0	109.1	P129 P133 Y134 V135 L270	P129-V131 VanDerWaalsContact C-N 3.3Å; P129-V131 PolarHBondContact O-N 3.06Å; V131-P133 VanDerWaalsContact C-N 3.28Å; V131-P133 HydrophobicContact CB-CG 4.23Å; V131-P133 HydrophobicContact CG1-CG 4.08Å; V131-Y134 PolarHBondContact O-N 3.17Å; V131-V135 PolarHBondContact O-N 3.42Å; V131-L270 HydrophobicContact CG1-CD2 3.96Å; V131-L270 HydrophobicContact CG1-CG 4.38Å; V131-L270 HydrophobicContact CG2-CD1 4.25Å; V131-L270 HydrophobicContact CG2-CD2 3.89Å; V131-L270 HydrophobicContact CG2-CG 3.74Å
132	S	69.2	Low	65	Low	92 Å²	92	77.2 Å²	77.2	64%	0.643	44%	0.44	S	S	*	.	H	α-helix	trans	-37	-50.1	169.4	175.8	0	0	0	0	113.8	R130 Y134 V135 L136	R130-S132 PolarHBondContact O-N 3Å; S132-Y134 VanDerWaalsContact C-N 3.32Å; S132-Y134 PolarHBondContact O-N 2.81Å; S132-V135 PolarHBondContact O-N 3.08Å; S132-V135 VanDerWaalsContact O-N 3.11Å; S132-L136 PolarHBondContact O-N 3.3Å
133	P	73.8	Confident	67.2	Low	40 Å²	40	76.9 Å²	76.9	26%	0.26	42%	0.424	S	S	.	.	H	α-helix	trans	-65.1	-25.1	-179.1	25.6	-38	0	0	0	115.3	V131 Q137 P268	V131-P133 VanDerWaalsContact C-N 3.28Å; V131-P133 HydrophobicContact CB-CG 4.23Å; V131-P133 HydrophobicContact CG1-CG 4.08Å; P133-Q137 WeakPolarHBondContact O-CG 3.47Å; P133-Q137 PolarHBondContact O-N 3.15Å; P133-P268 HydrophobicContact CB-CB 3.67Å; P133-P268 HydrophobicContact CB-CG 3.77Å; P133-P268 HydrophobicContact CG-CB 3.66Å; P133-P268 HydrophobicContact CG-CG 4.25Å
134	Y	76.7	Confident	69.2	Low	26 Å²	26	71.1 Å²	71.1	10%	0.102	39%	0.394	C	S	.	.	H	α-helix	trans	-75.8	-36.6	172.3	176.6	-97.5	0	0	0	112	V131 S132 L136 Q137 L138 L186 R190	V131-Y134 PolarHBondContact O-N 3.17Å; S132-Y134 VanDerWaalsContact C-N 3.32Å; S132-Y134 PolarHBondContact O-N 2.81Å; Y134-L136 PolarHBondContact O-N 3.34Å; Y134-Q137 PolarHBondContact O-N 2.9Å; Y134-L138 HydrophobicContact CE1-CB 4.49Å; Y134-L138 WeakPolarHBondContact O-CB 3.46Å; Y134-L138 PolarHBondContact O-N 3.02Å; Y134-L186 HydrophobicContact CE2-CD1 3.81Å; Y134-L186 HydrophobicContact CE2-CD2 4.31Å; Y134-L186 HydrophobicContact CE2-CG 3.96Å; Y134-R190 VanDerWaalsContact CD1-NH1 3.31Å; Y134-R190 HydrophobicContact CE2-CB 4.47Å; Y134-R190 WeakPolarHBondContact OH-CD 3.35Å
135	V	80.8	Confident	71.4	Confident	71 Å²	71	68.9 Å²	68.9	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-61.8	-40.6	173.4	-177.7	0	0	0	0	109.2	V131 S132 L138 L139	V131-V135 PolarHBondContact O-N 3.42Å; S132-V135 PolarHBondContact O-N 3.08Å; S132-V135 VanDerWaalsContact O-N 3.11Å; V135-L138 PolarHBondContact O-N 3.29Å; V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 HydrophobicContact CG1-CG 4.48Å; V135-L139 WeakPolarHBondContact O-CB 3.14Å; V135-L139 VanDerWaalsContact O-CG 3.27Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.47Å
136	L	84.1	Confident	73.4	Confident	82 Å²	82	60.1 Å²	60.1	43%	0.429	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-46.7	172.3	-174.5	62	0	0	0	112.6	S132 Y134 L138 L139 L140 L263	S132-L136 PolarHBondContact O-N 3.3Å; Y134-L136 PolarHBondContact O-N 3.34Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L136-L138 PolarHBondContact O-N 3.2Å; L136-L139 PolarHBondContact O-N 3.08Å; L136-L140 HydrophobicContact CD1-CD1 4.24Å; L136-L140 HydrophobicContact CD1-CG 4.3Å; L136-L140 HydrophobicContact CG-CD1 4.06Å; L136-L140 WeakPolarHBondContact O-CB 3.36Å; L136-L140 VanDerWaalsContact O-CG 3.28Å; L136-L140 WeakPolarHBondContact O-CG 3.33Å; L136-L140 PolarHBondContact O-N 2.9Å; L136-L263 HydrophobicContact CB-CD1 4.47Å; L136-L263 HydrophobicContact CD2-CD1 3.85Å; L136-L263 HydrophobicContact CG-CD1 3.88Å
137	Q	84.3	Confident	75.6	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.009	33%	0.325	C	S	.	.	H	α-helix	trans	-57	-44.8	173.5	-77.7	-179.8	-45.1	0	0	112.3	P133 Y134 A141 L186 H207 L260 L263	P133-Q137 WeakPolarHBondContact O-CG 3.47Å; P133-Q137 PolarHBondContact O-N 3.15Å; Y134-Q137 PolarHBondContact O-N 2.9Å; Q137-A141 VanDerWaalsContact O-CB 3.26Å; Q137-A141 WeakPolarHBondContact O-CB 3.45Å; Q137-A141 PolarHBondContact O-N 3.26Å; Q137-L186 HydrophobicContact CB-CD2 4.32Å; Q137-H207 PolarHBondContact NE2-NE2 3.11Å; Q137-L260 WeakPolarHBondContact O-CD2 3.49Å; Q137-L263 HydrophobicContact CG-CB 3.69Å; Q137-L263 HydrophobicContact CG-CD1 3.97Å; Q137-L263 HydrophobicContact CG-CG 4.38Å; Q137-L263 PolarHBondContact NE2-O 3.38Å
138	L	85.8	Confident	77.6	Confident	60 Å²	60	54.6 Å²	54.6	31%	0.314	30%	0.299	S	S	.	.	H	α-helix	trans	-64.4	-45	179.9	-169.6	73.2	0	0	0	111.2	Y134 V135 L136 A141 T142 L183 V187	Y134-L138 HydrophobicContact CE1-CB 4.49Å; Y134-L138 WeakPolarHBondContact O-CB 3.46Å; Y134-L138 PolarHBondContact O-N 3.02Å; V135-L138 PolarHBondContact O-N 3.29Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L136-L138 PolarHBondContact O-N 3.2Å; L138-A141 PolarHBondContact O-N 3.07Å; L138-T142 WeakPolarHBondContact O-CG2 3.49Å; L138-T142 PolarHBondContact O-N 3.29Å; L138-T142 PolarHBondContact O-OG1 3.35Å; L138-L183 HydrophobicContact CD1-CD1 3.67Å; L138-V187 HydrophobicContact CD1-CG2 4.08Å
139	L	87.5	Confident	79.3	Confident	85 Å²	85	57.8 Å²	57.8	45%	0.445	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-50	176.4	-73.1	170.1	0	0	0	111.5	V135 L136 A141 T142 F143	V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 HydrophobicContact CG1-CG 4.48Å; V135-L139 WeakPolarHBondContact O-CB 3.14Å; V135-L139 VanDerWaalsContact O-CG 3.27Å; V135-L139 WeakPolarHBondContact O-CG 3.4Å; V135-L139 PolarHBondContact O-N 3.47Å; L136-L139 PolarHBondContact O-N 3.08Å; L139-A141 VanDerWaalsContact C-N 3.31Å; L139-A141 PolarHBondContact O-N 2.84Å; L139-T142 WeakPolarHBondContact CA-OG1 3.38Å; L139-T142 PolarHBondContact O-N 2.9Å; L139-T142 VanDerWaalsContact O-N 3.15Å; L139-T142 PolarHBondContact O-OG1 2.86Å; L139-F143 WeakPolarHBondContact O-CD2 3.42Å; L139-F143 PolarHBondContact O-N 3.01Å
140	L	88.5	Confident	81	Confident	27 Å²	27	55.9 Å²	55.9	14%	0.141	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-39.9	177.5	-66.2	171.6	0	0	0	111.7	L136 T142 F143 Q144 V256 L260 L263	L136-L140 HydrophobicContact CD1-CD1 4.24Å; L136-L140 HydrophobicContact CD1-CG 4.3Å; L136-L140 HydrophobicContact CG-CD1 4.06Å; L136-L140 WeakPolarHBondContact O-CB 3.36Å; L136-L140 VanDerWaalsContact O-CG 3.28Å; L136-L140 WeakPolarHBondContact O-CG 3.33Å; L136-L140 PolarHBondContact O-N 2.9Å; L140-T142 PolarHBondContact O-N 2.88Å; L140-F143 PolarHBondContact O-N 3.37Å; L140-Q144 PolarHBondContact O-N 2.85Å; L140-V256 HydrophobicContact CB-CG1 4.33Å; L140-V256 HydrophobicContact CD2-CB 4.48Å; L140-V256 HydrophobicContact CD2-CG1 4.42Å; L140-V256 HydrophobicContact CD2-CG2 4.06Å; L140-V256 VanDerWaalsContact O-CG1 3.24Å; L140-V256 WeakPolarHBondContact O-CG1 3.46Å; L140-L260 HydrophobicContact CB-CD1 4.28Å; L140-L260 HydrophobicContact CB-CD2 3.73Å; L140-L260 HydrophobicContact CB-CG 3.74Å; L140-L263 HydrophobicContact CD1-CD1 3.72Å
141	A	86.5	Confident	82.2	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-64.7	-37.7	175.5	0	0	0	0	0	112.1	Q137 L138 L139 Q144 V145 L183 L186 L260	Q137-A141 VanDerWaalsContact O-CB 3.26Å; Q137-A141 WeakPolarHBondContact O-CB 3.45Å; Q137-A141 PolarHBondContact O-N 3.26Å; L138-A141 PolarHBondContact O-N 3.07Å; L139-A141 VanDerWaalsContact C-N 3.31Å; L139-A141 PolarHBondContact O-N 2.84Å; A141-Q144 WeakPolarHBondContact O-CB 3.37Å; A141-Q144 PolarHBondContact O-N 2.64Å; A141-V145 PolarHBondContact O-N 2.73Å; A141-L183 HydrophobicContact CB-CB 4.42Å; A141-L183 HydrophobicContact CB-CD1 3.69Å; A141-L186 HydrophobicContact CB-CD2 4.34Å; A141-L260 HydrophobicContact CB-CD2 4.16Å
142	T	88.3	Confident	83	Confident	58 Å²	58	45.8 Å²	45.8	36%	0.356	27%	0.268	S	S	.	.	H	α-helix	trans	-67.3	-39.5	172.5	55.5	0	0	0	0	112.8	L138 L139 L140 Q144 V145 A146 L183	L138-T142 WeakPolarHBondContact O-CG2 3.49Å; L138-T142 PolarHBondContact O-N 3.29Å; L138-T142 PolarHBondContact O-OG1 3.35Å; L139-T142 WeakPolarHBondContact CA-OG1 3.38Å; L139-T142 PolarHBondContact O-N 2.9Å; L139-T142 VanDerWaalsContact O-N 3.15Å; L139-T142 PolarHBondContact O-OG1 2.86Å; L140-T142 PolarHBondContact O-N 2.88Å; T142-Q144 VanDerWaalsContact C-N 3.3Å; T142-Q144 PolarHBondContact O-N 2.75Å; T142-V145 PolarHBondContact O-N 3.24Å; T142-V145 VanDerWaalsContact O-N 3.15Å; T142-A146 PolarHBondContact O-N 2.82Å; T142-L183 HydrophobicContact CG2-CD1 3.98Å; T142-L183 HydrophobicContact CG2-CD2 3.8Å
143	F	88.4	Confident	83.5	Confident	112 Å²	112	44.4 Å²	44.4	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-61.6	-39.2	173.1	-74.5	-57.4	0	0	0	111.8	L139 L140 V145 A146 L147 V256	L139-F143 WeakPolarHBondContact O-CD2 3.42Å; L139-F143 PolarHBondContact O-N 3.01Å; L140-F143 PolarHBondContact O-N 3.37Å; F143-V145 PolarHBondContact O-N 3.01Å; F143-A146 PolarHBondContact O-N 2.83Å; F143-A146 VanDerWaalsContact O-N 3.08Å; F143-L147 HydrophobicContact CB-CD1 4.41Å; F143-L147 VanDerWaalsContact O-CG 3.23Å; F143-L147 WeakPolarHBondContact O-CG 3.34Å; F143-L147 PolarHBondContact O-N 3.09Å; F143-V256 HydrophobicContact CB-CG1 4.21Å; F143-V256 HydrophobicContact CB-CG2 4.16Å
144	Q	85.8	Confident	83.4	Confident	12 Å²	12	43.4 Å²	43.4	6%	0.056	26%	0.26	C	S	.	.	H	α-helix	trans	-60.5	-26.2	176.8	-156.3	-161.4	-110.9	0	0	113.2	R97 L140 A141 T142 P148 V256 L260	R97-Q144 VanDerWaalsContact NH2-CD 3.32Å; R97-Q144 VanDerWaalsContact NH2-NE2 3.17Å; L140-Q144 PolarHBondContact O-N 2.85Å; A141-Q144 WeakPolarHBondContact O-CB 3.37Å; A141-Q144 PolarHBondContact O-N 2.64Å; T142-Q144 VanDerWaalsContact C-N 3.3Å; T142-Q144 PolarHBondContact O-N 2.75Å; Q144-P148 WeakPolarHBondContact O-CD 3.46Å; Q144-V256 HydrophobicContact CB-CG1 4.12Å; Q144-L260 HydrophobicContact CB-CD1 4.1Å; Q144-L260 HydrophobicContact CG-CD1 4.31Å
145	V	88.6	Confident	83.2	Confident	34 Å²	34	44.6 Å²	44.6	21%	0.206	26%	0.264	C	S	.	.	H	α-helix	trans	-78.8	-38.2	173.5	-180	0	0	0	0	112	A141 T142 F143 S176 G179 A180 L183	A141-V145 PolarHBondContact O-N 2.73Å; T142-V145 PolarHBondContact O-N 3.24Å; T142-V145 VanDerWaalsContact O-N 3.15Å; F143-V145 PolarHBondContact O-N 3.01Å; V145-S176 PolarHBondContact O-OG 3.19Å; V145-G179 VanDerWaalsContact CG2-C 3.47Å; V145-A180 HydrophobicContact CG2-CB 4.39Å; V145-L183 HydrophobicContact CG2-CD2 4.34Å
146	A	85.6	Confident	83	Confident	51 Å²	51	44.4 Å²	44.4	42%	0.421	26%	0.263	S	S	.	.	H	α-helix	trans	-82	-32.4	-173.2	0	0	0	0	0	114	T142 F143 L149 A150	T142-A146 PolarHBondContact O-N 2.82Å; F143-A146 PolarHBondContact O-N 2.83Å; F143-A146 VanDerWaalsContact O-N 3.08Å; A146-L149 PolarHBondContact O-N 3.44Å; A146-A150 PolarHBondContact O-N 2.98Å
147	L	85.8	Confident	82.3	Confident	16 Å²	16	43.9 Å²	43.9	8%	0.084	28%	0.278	C	S	.	.	H	α-helix	trans	-59.8	-39.7	-174.5	-74	166.1	0	0	0	115	F143 L149 A150 G151 L252 R253 V256	F143-L147 HydrophobicContact CB-CD1 4.41Å; F143-L147 VanDerWaalsContact O-CG 3.23Å; F143-L147 WeakPolarHBondContact O-CG 3.34Å; F143-L147 PolarHBondContact O-N 3.09Å; L147-L149 VanDerWaalsContact C-N 3.3Å; L147-L149 PolarHBondContact O-N 2.93Å; L147-A150 PolarHBondContact O-N 3.3Å; L147-G151 PolarHBondContact O-N 3.01Å; L147-L252 HydrophobicContact CD1-CG 4.31Å; L147-L252 HydrophobicContact CD2-CB 4.47Å; L147-L252 HydrophobicContact CD2-CD2 3.55Å; L147-L252 HydrophobicContact CD2-CG 3.84Å; L147-R253 HydrophobicContact CB-CG 3.92Å; L147-R253 HydrophobicContact CD1-CG 3.94Å; L147-R253 HydrophobicContact CG-CG 4.41Å; L147-V256 HydrophobicContact CD1-CB 4.26Å; L147-V256 HydrophobicContact CD1-CG1 4.47Å; L147-V256 HydrophobicContact CD1-CG2 4.07Å
148	P	82.9	Confident	81.6	Confident	6 Å²	6	46.1 Å²	46.1	4%	0.039	29%	0.291	C	S	.	.	H	α-helix	trans	-64	-31.7	176	-22.7	34.1	0	0	0	113.9	Q144 L152 S172 E175	Q144-P148 WeakPolarHBondContact O-CD 3.46Å; P148-L152 PolarHBondContact O-N 2.98Å; P148-S172 WeakPolarHBondContact O-CB 3.11Å; P148-S172 PolarHBondContact O-OG 2.9Å; P148-E175 HydrophobicContact CB-CB 3.92Å; P148-E175 HydrophobicContact CG-CB 3.65Å
149	L	82.1	Confident	80.5	Confident	89 Å²	89	44.5 Å²	44.5	47%	0.466	29%	0.287	S	S	.	.	H	α-helix	trans	-76.8	-39.6	176	-61.6	173.7	0	0	0	111.5	A146 L147 G151 L152 A153	A146-L149 PolarHBondContact O-N 3.44Å; L147-L149 VanDerWaalsContact C-N 3.3Å; L147-L149 PolarHBondContact O-N 2.93Å; L149-G151 VanDerWaalsContact C-N 3.31Å; L149-G151 PolarHBondContact O-N 2.97Å; L149-L152 PolarHBondContact O-N 3.46Å; L149-A153 PolarHBondContact O-N 3.37Å
150	A	81.1	Confident	79.2	Confident	45 Å²	45	52.5 Å²	52.5	37%	0.372	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-38.9	172.5	0	0	0	0	0	111.8	A146 L147 A153 G154	A146-A150 PolarHBondContact O-N 2.98Å; L147-A150 PolarHBondContact O-N 3.3Å; A150-A153 PolarHBondContact O-N 3.49Å; A150-G154 PolarHBondContact O-N 2.94Å
151	G	77.4	Confident	77.7	Confident	18 Å²	18	53.4 Å²	53.4	19%	0.186	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-39.5	173.2	0	0	0	0	0	113.9	L147 L149 G154 R155	L147-G151 PolarHBondContact O-N 3.01Å; L149-G151 VanDerWaalsContact C-N 3.31Å; L149-G151 PolarHBondContact O-N 2.97Å; G151-G154 PolarHBondContact O-N 2.79Å; G151-R155 WeakPolarHBondContact O-CG 3.42Å; G151-R155 PolarHBondContact O-N 2.78Å; G151-R155 VanDerWaalsContact O-N 3.09Å
152	L	80.1	Confident	76.4	Confident	34 Å²	34	56 Å²	56	18%	0.178	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-48.6	173.1	-178.7	64.2	0	0	0	111.3	P148 L149 G154 R155 V156 L169	P148-L152 PolarHBondContact O-N 2.98Å; L149-L152 PolarHBondContact O-N 3.46Å; L152-G154 VanDerWaalsContact C-N 3.33Å; L152-G154 PolarHBondContact O-N 2.86Å; L152-R155 PolarHBondContact O-N 2.85Å; L152-R155 VanDerWaalsContact O-N 3.14Å; L152-V156 WeakPolarHBondContact O-CG2 3.38Å; L152-V156 PolarHBondContact O-N 2.87Å; L152-L169 HydrophobicContact CD1-CD2 3.76Å; L152-L169 HydrophobicContact CD2-CD2 3.78Å; L152-L169 HydrophobicContact CG-CD2 4.36Å
153	A	78.8	Confident	75.3	Confident	63 Å²	63	57 Å²	57	52%	0.521	36%	0.356	S	S	.	.	H	α-helix	trans	-60.2	-40.7	177.7	0	0	0	0	0	112.5	L149 A150 R155 V156 G157	L149-A153 PolarHBondContact O-N 3.37Å; A150-A153 PolarHBondContact O-N 3.49Å; A153-R155 VanDerWaalsContact C-N 3.34Å; A153-R155 PolarHBondContact O-N 3.18Å; A153-V156 PolarHBondContact O-N 3.09Å; A153-G157 PolarHBondContact O-N 2.92Å
154	G	73.6	Confident	74.4	Confident	20 Å²	20	53 Å²	53	21%	0.206	34%	0.34	C	S	.	.	H	α-helix	trans	-62.6	-36.5	174.4	0	0	0	0	0	113.4	A150 G151 L152 T158	A150-G154 PolarHBondContact O-N 2.94Å; G151-G154 PolarHBondContact O-N 2.79Å; L152-G154 VanDerWaalsContact C-N 3.33Å; L152-G154 PolarHBondContact O-N 2.86Å; G154-T158 WeakPolarHBondContact O-CG2 3.42Å; G154-T158 PolarHBondContact O-N 2.83Å; G154-T158 VanDerWaalsContact O-N 3.16Å; G154-T158 PolarHBondContact O-OG1 2.83Å
155	R	72.2	Confident	73.8	Confident	50 Å²	50	54.4 Å²	54.4	19%	0.189	35%	0.35	C	S	.	.	H	α-helix	trans	-71	-39.8	174.2	-72.8	-175.7	179.5	-159.4	0.1	112.4	G151 L152 A153 T158 A159 L168	G151-R155 WeakPolarHBondContact O-CG 3.42Å; G151-R155 PolarHBondContact O-N 2.78Å; G151-R155 VanDerWaalsContact O-N 3.09Å; L152-R155 PolarHBondContact O-N 2.85Å; L152-R155 VanDerWaalsContact O-N 3.14Å; A153-R155 VanDerWaalsContact C-N 3.34Å; A153-R155 PolarHBondContact O-N 3.18Å; R155-T158 PolarHBondContact O-N 2.89Å; R155-T158 PolarHBondContact O-OG1 3.05Å; R155-A159 WeakPolarHBondContact O-CB 3.49Å; R155-A159 PolarHBondContact O-N 3.45Å; R155-L168 VanDerWaalsContact NH1-CD1 3.28Å
156	V	75.6	Confident	73	Confident	68 Å²	68	54.3 Å²	54.3	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-44	173.1	176.9	0	0	0	0	111.1	L152 A153 T158 L164	L152-V156 WeakPolarHBondContact O-CG2 3.38Å; L152-V156 PolarHBondContact O-N 2.87Å; A153-V156 PolarHBondContact O-N 3.09Å; V156-T158 VanDerWaalsContact C-N 3.32Å; V156-T158 PolarHBondContact O-N 3.03Å; V156-L164 HydrophobicContact CG2-CD1 3.72Å
157	G	70	Confident	72.5	Confident	71 Å²	71	53.2 Å²	53.2	73%	0.732	34%	0.336	S	S	*	.	H	α-helix	trans	-71.3	-20.3	-179.2	0	0	0	0	0	115.3	A153	A153-G157 PolarHBondContact O-N 2.92Å
158	T	69.5	Low	72	Confident	48 Å²	48	53.4 Å²	53.4	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-99.6	-16.7	178	49.7	0	0	0	0	113.6	G154 R155 V156 R160	G154-T158 WeakPolarHBondContact O-CG2 3.42Å; G154-T158 PolarHBondContact O-N 2.83Å; G154-T158 VanDerWaalsContact O-N 3.16Å; G154-T158 PolarHBondContact O-OG1 2.83Å; R155-T158 PolarHBondContact O-N 2.89Å; R155-T158 PolarHBondContact O-OG1 3.05Å; V156-T158 VanDerWaalsContact C-N 3.32Å; V156-T158 PolarHBondContact O-N 3.03Å; T158-R160 PolarHBondContact O-N 3.33Å; T158-R160 VanDerWaalsContact O-N 3.11Å
159	A	62.8	Low	71.8	Confident	26 Å²	26	56.7 Å²	56.7	22%	0.215	35%	0.353	C	S	.	.			trans	-71.7	100.5	175.2	0	0	0	0	0	111.5	R155 G161 L164	R155-A159 WeakPolarHBondContact O-CB 3.49Å; R155-A159 PolarHBondContact O-N 3.45Å; A159-G161 PolarHBondContact O-N 3.36Å; A159-L164 HydrophobicContact CB-CD2 4.47Å
160	R	59.2	Low	71.8	Confident	253 Å²	253	56.4 Å²	56.4	96%	0.955	35%	0.352	S	S	*	.	S	Bend	trans	-73.4	55.1	174.4	-64.8	-177.8	177.6	173.6	-0	112.6	T158	T158-R160 PolarHBondContact O-N 3.33Å; T158-R160 VanDerWaalsContact O-N 3.11Å
161	G	57.4	Low	71.8	Confident	47 Å²	47	54.4 Å²	54.4	49%	0.485	34%	0.336	S	S	.	.	S	Bend	trans	82.8	8.2	179.5	0	0	0	0	0	115.9	A159	A159-G161 PolarHBondContact O-N 3.36Å
162	A	60.3	Low	72	Confident	55 Å²	55	54.2 Å²	54.2	46%	0.455	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-73.7	144.1	172.1	0	0	0	0	0	111.2	L164	A162-L164 PolarHBondContact O-N 2.83Å
163	P	64.4	Low	72.3	Confident	80 Å²	80	56.2 Å²	56.2	52%	0.519	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-68	133	179.8	27.3	-33.9	0	0	0	111.3	T64	T64-P163 CarbonylContact O-C 3.56Å; T64-P163 VanDerWaalsContact O-CA 3.22Å; T64-P163 WeakPolarHBondContact O-CA 3.35Å
164	L	70.3	Confident	72.6	Confident	28 Å²	28	55.1 Å²	55.1	15%	0.147	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.6	176.9	-75.5	175.6	0	0	0	110.7	V63 T64 G66 V156 A159 A162 S166	V63-L164 HydrophobicContact CG1-CB 4.37Å; V63-L164 HydrophobicContact CG1-CD1 3.88Å; V63-L164 HydrophobicContact CG1-CG 3.94Å; T64-L164 PolarHBondContact O-N 3.32Å; G66-L164 PolarHBondContact N-O 2.87Å; V156-L164 HydrophobicContact CG2-CD1 3.72Å; A159-L164 HydrophobicContact CB-CD2 4.47Å; A162-L164 PolarHBondContact O-N 2.83Å; L164-S166 PolarHBondContact O-N 3.06Å
165	P	72.1	Confident	73.1	Confident	41 Å²	41	54.5 Å²	54.5	27%	0.266	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	131.3	173.4	-23.3	32.1	0	0	0	113	Y167 L168	P165-Y167 VanDerWaalsContact C-N 3.28Å; P165-Y167 HydrophobicContact CB-CD1 3.47Å; P165-Y167 VanDerWaalsContact CB-CD1 3.47Å; P165-Y167 HydrophobicContact CB-CE1 3.2Å; P165-Y167 HydrophobicContact CB-CG 4.44Å; P165-Y167 HydrophobicContact CG-CE1 3.94Å; P165-Y167 PolarHBondContact O-N 2.93Å; P165-L168 HydrophobicContact CB-CD1 4.35Å; P165-L168 HydrophobicContact CG-CD1 4.28Å; P165-L168 PolarHBondContact O-N 3.03Å
166	S	71.8	Confident	73.8	Confident	32 Å²	32	52.7 Å²	52.7	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-60.3	-30.2	-177.7	42.4	0	0	0	0	114.5	G66 L164 L168 L169	G66-S166 PolarHBondContact O-OG 3.37Å; G66-S166 VanDerWaalsContact O-OG 3.14Å; L164-S166 PolarHBondContact O-N 3.06Å; S166-L168 PolarHBondContact O-N 3.3Å; S166-L169 PolarHBondContact O-N 3.07Å
167	Y	74.6	Confident	74.3	Confident	28 Å²	28	53.4 Å²	53.4	11%	0.11	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-26.2	178.1	71.2	-96.9	0	0	0	113.6	C69 C87 F90 P165 L170 A171	C69-Y167 WeakPolarHBondContact SG-CD1 3.38Å; C69-Y167 VanDerWaalsContact SG-CE1 3.59Å; C87-Y167 HydrophobicContact CB-CE1 4.29Å; F90-Y167 HydrophobicContact CB-CD2 4.06Å; F90-Y167 HydrophobicContact CB-CE2 4.05Å; F90-Y167 HydrophobicContact CD2-CE2 4.36Å; P165-Y167 VanDerWaalsContact C-N 3.28Å; P165-Y167 HydrophobicContact CB-CD1 3.47Å; P165-Y167 VanDerWaalsContact CB-CD1 3.47Å; P165-Y167 HydrophobicContact CB-CE1 3.2Å; P165-Y167 HydrophobicContact CB-CG 4.44Å; P165-Y167 HydrophobicContact CG-CE1 3.94Å; P165-Y167 PolarHBondContact O-N 2.93Å; Y167-L170 PolarHBondContact O-N 2.73Å; Y167-A171 WeakPolarHBondContact O-CB 3.16Å; Y167-A171 PolarHBondContact O-N 2.96Å
168	L	74.9	Confident	75	Confident	19 Å²	19	50 Å²	50	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-73.2	-32.4	-179.8	-70	169.3	0	0	0	113.1	F90 R155 P165 S166 S172	F90-L168 HydrophobicContact CB-CD2 4.39Å; F90-L168 HydrophobicContact CD2-CD2 4.05Å; F90-L168 HydrophobicContact CG-CD2 4.13Å; R155-L168 VanDerWaalsContact NH1-CD1 3.28Å; P165-L168 HydrophobicContact CB-CD1 4.35Å; P165-L168 HydrophobicContact CG-CD1 4.28Å; P165-L168 PolarHBondContact O-N 3.03Å; S166-L168 PolarHBondContact O-N 3.3Å; L168-S172 PolarHBondContact O-N 3.24Å; L168-S172 VanDerWaalsContact O-N 3.1Å
169	L	80.3	Confident	75.7	Confident	75 Å²	75	47.8 Å²	47.8	39%	0.393	27%	0.269	S	S	.	.	H	α-helix	trans	-65.2	-46.1	173.3	-68.5	166.5	0	0	0	110.1	L152 S166 V173	L152-L169 HydrophobicContact CD1-CD2 3.76Å; L152-L169 HydrophobicContact CD2-CD2 3.78Å; L152-L169 HydrophobicContact CG-CD2 4.36Å; S166-L169 PolarHBondContact O-N 3.07Å; L169-V173 WeakPolarHBondContact O-CG2 3.5Å; L169-V173 PolarHBondContact O-N 3.12Å
170	L	81.2	Confident	76.9	Confident	84 Å²	84	48.5 Å²	48.5	44%	0.44	28%	0.275	S	S	.	.	H	α-helix	trans	-62.7	-42.9	176.9	-175.4	62.7	0	0	0	111.7	Y167 V173 L174	Y167-L170 PolarHBondContact O-N 2.73Å; L170-V173 PolarHBondContact O-N 3.46Å; L170-L174 HydrophobicContact CD1-CD1 4.11Å; L170-L174 HydrophobicContact CD1-CG 4.29Å; L170-L174 HydrophobicContact CG-CD1 3.95Å; L170-L174 WeakPolarHBondContact O-CB 3.46Å; L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.95Å
171	A	81.1	Confident	78.2	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-57.1	-55.9	176.7	0	0	0	0	0	112.1	F90 P94 Y167 V173 L174 E175	F90-A171 HydrophobicContact CB-CB 4.11Å; F90-A171 WeakPolarHBondContact O-CB 3.4Å; P94-A171 HydrophobicContact CG-CB 4.03Å; Y167-A171 WeakPolarHBondContact O-CB 3.16Å; Y167-A171 PolarHBondContact O-N 2.96Å; A171-V173 VanDerWaalsContact C-N 3.3Å; A171-V173 PolarHBondContact O-N 3.47Å; A171-L174 PolarHBondContact O-N 3.16Å; A171-E175 WeakPolarHBondContact O-CG 3.39Å; A171-E175 PolarHBondContact O-N 2.83Å
172	S	82.9	Confident	79.5	Confident	14 Å²	14	35.3 Å²	35.3	10%	0.098	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-38.8	-179.6	-75	0	0	0	0	112.7	P148 L168 S176	P148-S172 WeakPolarHBondContact O-CB 3.11Å; P148-S172 PolarHBondContact O-OG 2.9Å; L168-S172 PolarHBondContact O-N 3.24Å; L168-S172 VanDerWaalsContact O-N 3.1Å; S172-S176 WeakPolarHBondContact O-CB 3.35Å; S172-S176 PolarHBondContact O-N 3.38Å; S172-S176 VanDerWaalsContact O-N 3.1Å; S172-S176 PolarHBondContact O-OG 3.25Å
173	V	85.8	Confident	80.8	Confident	76 Å²	76	34.6 Å²	34.6	46%	0.461	20%	0.202	S	C	.	.	H	α-helix	trans	-65.9	-47.7	177.1	170.8	0	0	0	0	111.3	L169 L170 A171 E175 S176 L177	L169-V173 WeakPolarHBondContact O-CG2 3.5Å; L169-V173 PolarHBondContact O-N 3.12Å; L170-V173 PolarHBondContact O-N 3.46Å; A171-V173 VanDerWaalsContact C-N 3.3Å; A171-V173 PolarHBondContact O-N 3.47Å; V173-E175 PolarHBondContact O-N 3.3Å; V173-S176 PolarHBondContact O-N 2.84Å; V173-L177 HydrophobicContact CG1-CD1 3.86Å; V173-L177 HydrophobicContact CG1-CG 4.44Å; V173-L177 WeakPolarHBondContact O-CB 3.36Å; V173-L177 VanDerWaalsContact O-CG 3.29Å; V173-L177 WeakPolarHBondContact O-CG 3.4Å; V173-L177 PolarHBondContact O-N 3.33Å
174	L	85.3	Confident	81.8	Confident	39 Å²	39	36.1 Å²	36.1	20%	0.204	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-38.6	179.9	-71.7	173.4	0	0	0	112.4	P94 M98 L170 A171 A178	P94-L174 HydrophobicContact CB-CB 3.59Å; P94-L174 HydrophobicContact CB-CD1 4.32Å; M98-L174 HydrophobicContact CB-CD2 4.26Å; M98-L174 HydrophobicContact CG-CD2 4.03Å; L170-L174 HydrophobicContact CD1-CD1 4.11Å; L170-L174 HydrophobicContact CD1-CG 4.29Å; L170-L174 HydrophobicContact CG-CD1 3.95Å; L170-L174 WeakPolarHBondContact O-CB 3.46Å; L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.95Å; A171-L174 PolarHBondContact O-N 3.16Å; L174-A178 WeakPolarHBondContact O-CB 3.46Å; L174-A178 PolarHBondContact O-N 3.25Å
175	E	83.2	Confident	82.4	Confident	7 Å²	7	35.1 Å²	35.1	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-44.1	176.1	-69	-168.9	134.5	0	0	112.7	P94 P148 A171 V173 A178 G179 R253	P94-E175 HydrophobicContact CB-CG 3.67Å; P94-E175 HydrophobicContact CG-CG 3.62Å; P148-E175 HydrophobicContact CB-CB 3.92Å; P148-E175 HydrophobicContact CG-CB 3.65Å; A171-E175 WeakPolarHBondContact O-CG 3.39Å; A171-E175 PolarHBondContact O-N 2.83Å; V173-E175 PolarHBondContact O-N 3.3Å; E175-A178 PolarHBondContact O-N 2.88Å; E175-G179 PolarHBondContact O-N 3.47Å; E175-R253 VanDerWaalsContact CD-NH2 3.35Å; E175-R253 IonicContact OE1-CZ 2.87Å; E175-R253 IonicContact OE1-NH1 3.18Å; E175-R253 IonicContact OE1-NH2 3.58Å; E175-R253 PolarHBondContact OE1-NH2 2.66Å; E175-R253 IonicContact OE2-CZ 3.96Å; E175-R253 IonicContact OE2-NH1 2.69Å; E175-R253 PolarHBondContact OE2-NH1 3.28Å; E175-R253 IonicContact OE2-NH2 3.79Å; E175-R253 PolarHBondContact OE2-NH2 3.09Å
176	S	87.3	Confident	83	Confident	13 Å²	13	33.2 Å²	33.2	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-65.5	-37.6	176.9	-73.7	0	0	0	0	112.1	V145 S172 V173 G179 A180	V145-S176 PolarHBondContact O-OG 3.19Å; S172-S176 WeakPolarHBondContact O-CB 3.35Å; S172-S176 PolarHBondContact O-N 3.38Å; S172-S176 VanDerWaalsContact O-N 3.1Å; S172-S176 PolarHBondContact O-OG 3.25Å; V173-S176 PolarHBondContact O-N 2.84Å; S176-G179 PolarHBondContact O-N 2.97Å; S176-A180 WeakPolarHBondContact O-CB 3.26Å; S176-A180 PolarHBondContact O-N 3.01Å
177	L	86.8	Confident	83.6	Confident	83 Å²	83	35.1 Å²	35.1	44%	0.435	19%	0.19	S	C	.	.	H	α-helix	trans	-65	-46.2	173.1	-72.2	171.9	0	0	0	111.9	M98 V173 G179 A180 C181	M98-L177 HydrophobicContact CE-CB 3.87Å; M98-L177 HydrophobicContact CE-CD1 4.28Å; M98-L177 HydrophobicContact SD-CB 3.69Å; V173-L177 HydrophobicContact CG1-CD1 3.86Å; V173-L177 HydrophobicContact CG1-CG 4.44Å; V173-L177 WeakPolarHBondContact O-CB 3.36Å; V173-L177 VanDerWaalsContact O-CG 3.29Å; V173-L177 WeakPolarHBondContact O-CG 3.4Å; V173-L177 PolarHBondContact O-N 3.33Å; L177-G179 VanDerWaalsContact C-N 3.3Å; L177-G179 PolarHBondContact O-N 3.49Å; L177-A180 PolarHBondContact O-N 3.13Å; L177-A180 VanDerWaalsContact O-N 3.11Å; L177-C181 PolarHBondContact O-N 3.1Å; L177-C181 PolarHBondContact O-SG 2.99Å; L177-C181 VanDerWaalsContact O-SG 3.39Å
178	A	84.4	Confident	83.9	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-39.2	176.2	0	0	0	0	0	112	R97 M98 L174 E175 G182	R97-A178 HydrophobicContact CB-CB 4Å; M98-A178 HydrophobicContact CB-CB 4.31Å; M98-A178 HydrophobicContact SD-CB 4.33Å; L174-A178 WeakPolarHBondContact O-CB 3.46Å; L174-A178 PolarHBondContact O-N 3.25Å; E175-A178 PolarHBondContact O-N 2.88Å; A178-G182 PolarHBondContact O-N 3.18Å; A178-G182 VanDerWaalsContact O-N 3.17Å
179	G	84.8	Confident	84	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-42.4	172	0	0	0	0	0	112.7	V145 E175 S176 L177 G182 L183	V145-G179 VanDerWaalsContact CG2-C 3.47Å; E175-G179 PolarHBondContact O-N 3.47Å; S176-G179 PolarHBondContact O-N 2.97Å; L177-G179 VanDerWaalsContact C-N 3.3Å; L177-G179 PolarHBondContact O-N 3.49Å; G179-G182 PolarHBondContact O-N 3.44Å; G179-L183 PolarHBondContact O-N 3.39Å
180	A	87.9	Confident	83.8	Confident	41 Å²	41	35.2 Å²	35.2	34%	0.339	19%	0.188	S	C	.	.	H	α-helix	trans	-66.5	-39	179.3	0	0	0	0	0	111.8	V145 S176 L177 G182 L183 W184	V145-A180 HydrophobicContact CG2-CB 4.39Å; S176-A180 WeakPolarHBondContact O-CB 3.26Å; S176-A180 PolarHBondContact O-N 3.01Å; L177-A180 PolarHBondContact O-N 3.13Å; L177-A180 VanDerWaalsContact O-N 3.11Å; A180-G182 VanDerWaalsContact C-N 3.34Å; A180-G182 PolarHBondContact O-N 3.48Å; A180-L183 PolarHBondContact O-N 3.35Å; A180-W184 VanDerWaalsContact O-CB 3.29Å; A180-W184 WeakPolarHBondContact O-CB 3.39Å; A180-W184 PolarHBondContact O-N 2.93Å
181	C	85.8	Confident	83.5	Confident	24 Å²	24	33.9 Å²	33.9	16%	0.162	19%	0.186	C	C	.	.	H	α-helix	trans	-58.4	-44.5	171	-68.6	0	0	0	0	111.8	L105 L177 W184 L185	L105-C181 HydrophobicContact CD1-CB 4.4Å; L177-C181 PolarHBondContact O-N 3.1Å; L177-C181 PolarHBondContact O-SG 2.99Å; L177-C181 VanDerWaalsContact O-SG 3.39Å; C181-W184 PolarHBondContact O-N 3.17Å; C181-L185 VanDerWaalsContact O-CB 3.27Å; C181-L185 WeakPolarHBondContact O-CB 3.44Å; C181-L185 PolarHBondContact O-N 3.33Å
182	G	84.4	Confident	83.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-44.7	176.6	0	0	0	0	0	113.6	A178 G179 A180 L185 L186 L211	A178-G182 PolarHBondContact O-N 3.18Å; A178-G182 VanDerWaalsContact O-N 3.17Å; G179-G182 PolarHBondContact O-N 3.44Å; A180-G182 VanDerWaalsContact C-N 3.34Å; A180-G182 PolarHBondContact O-N 3.48Å; G182-L185 PolarHBondContact O-N 2.95Å; G182-L186 WeakPolarHBondContact O-CB 3.26Å; G182-L186 PolarHBondContact O-N 3.36Å; G182-L211 WeakPolarHBondContact O-CD1 3.36Å
183	L	87.5	Confident	82.3	Confident	39 Å²	39	35.6 Å²	35.6	20%	0.204	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-45	175.5	177.3	66	0	0	0	111.6	L138 A141 T142 V145 G179 A180 L186 V187	L138-L183 HydrophobicContact CD1-CD1 3.67Å; A141-L183 HydrophobicContact CB-CB 4.42Å; A141-L183 HydrophobicContact CB-CD1 3.69Å; T142-L183 HydrophobicContact CG2-CD1 3.98Å; T142-L183 HydrophobicContact CG2-CD2 3.8Å; V145-L183 HydrophobicContact CG2-CD2 4.34Å; G179-L183 PolarHBondContact O-N 3.39Å; A180-L183 PolarHBondContact O-N 3.35Å; L183-L186 PolarHBondContact O-N 3.33Å; L183-V187 WeakPolarHBondContact O-CG2 3.48Å; L183-V187 PolarHBondContact O-N 2.68Å
184	W	86	Confident	81.4	Confident	113 Å²	113	36.5 Å²	36.5	43%	0.428	19%	0.19	S	C	.	.	H	α-helix	trans	-62.2	-45	177.5	-175.8	85.4	0	0	0	111.5	L105 L109 A180 C181 L186 V187 V188	L105-W184 HydrophobicContact CD1-CD2 4.23Å; L105-W184 HydrophobicContact CD1-CE3 3.47Å; L105-W184 VanDerWaalsContact CD1-CE3 3.47Å; L105-W184 HydrophobicContact CD1-CH2 4.45Å; L105-W184 HydrophobicContact CD1-CZ3 3.62Å; L105-W184 HydrophobicContact CD2-CZ3 4.43Å; L105-W184 HydrophobicContact CG-CE3 4Å; L105-W184 HydrophobicContact CG-CH2 4.37Å; L105-W184 HydrophobicContact CG-CZ3 3.62Å; L109-W184 HydrophobicContact CD2-CH2 4.02Å; A180-W184 VanDerWaalsContact O-CB 3.29Å; A180-W184 WeakPolarHBondContact O-CB 3.39Å; A180-W184 PolarHBondContact O-N 2.93Å; C181-W184 PolarHBondContact O-N 3.17Å; W184-L186 PolarHBondContact O-N 2.68Å; W184-V187 PolarHBondContact O-N 3.15Å; W184-V187 VanDerWaalsContact O-N 3.13Å; W184-V188 HydrophobicContact CD2-CG2 3.86Å; W184-V188 HydrophobicContact CE3-CG2 3.91Å; W184-V188 HydrophobicContact CH2-CG2 3.99Å; W184-V188 HydrophobicContact CZ2-CG2 3.92Å; W184-V188 HydrophobicContact CZ3-CG2 3.96Å; W184-V188 WeakPolarHBondContact O-CG2 3.5Å; W184-V188 PolarHBondContact O-N 3.14Å
185	L	82.6	Confident	80.6	Confident	6 Å²	6	40 Å²	40	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-37	-178.6	-162.2	138	0	0	0	112	A104 A108 C181 G182 V187 V188 E189 S208 L211	A104-L185 HydrophobicContact CB-CD1 4.13Å; A108-L185 HydrophobicContact CB-CD1 3.98Å; C181-L185 VanDerWaalsContact O-CB 3.27Å; C181-L185 WeakPolarHBondContact O-CB 3.44Å; C181-L185 PolarHBondContact O-N 3.33Å; G182-L185 PolarHBondContact O-N 2.95Å; L185-V187 VanDerWaalsContact C-N 3.33Å; L185-V187 PolarHBondContact O-N 3.3Å; L185-V188 PolarHBondContact O-N 3.27Å; L185-E189 HydrophobicContact CD2-CG 4.35Å; L185-E189 VanDerWaalsContact CD2-OE1 3.29Å; L185-E189 WeakPolarHBondContact CD2-OE1 3.29Å; L185-E189 WeakPolarHBondContact O-CG 3.49Å; L185-E189 PolarHBondContact O-N 3.09Å; L185-S208 WeakPolarHBondContact CD2-OG 3.37Å; L185-L211 HydrophobicContact CD2-CB 3.65Å; L185-L211 HydrophobicContact CD2-CD1 4.09Å; L185-L211 HydrophobicContact CD2-CD2 4.37Å; L185-L211 HydrophobicContact CD2-CG 4.25Å
186	L	85.1	Confident	79.7	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-38	169.9	176	62.6	0	0	0	113	Y134 Q137 A141 G182 L183 W184 R190 L211 W215	Y134-L186 HydrophobicContact CE2-CD1 3.81Å; Y134-L186 HydrophobicContact CE2-CD2 4.31Å; Y134-L186 HydrophobicContact CE2-CG 3.96Å; Q137-L186 HydrophobicContact CB-CD2 4.32Å; A141-L186 HydrophobicContact CB-CD2 4.34Å; G182-L186 WeakPolarHBondContact O-CB 3.26Å; G182-L186 PolarHBondContact O-N 3.36Å; L183-L186 PolarHBondContact O-N 3.33Å; W184-L186 PolarHBondContact O-N 2.68Å; L186-R190 PolarHBondContact O-N 3.21Å; L186-L211 HydrophobicContact CB-CD2 4.01Å; L186-L211 HydrophobicContact CD1-CD2 4.02Å; L186-W215 HydrophobicContact CD1-CH2 4.08Å; L186-W215 HydrophobicContact CD2-CH2 4.39Å; L186-W215 HydrophobicContact CD2-CZ2 4.21Å
187	V	84.1	Confident	78.5	Confident	71 Å²	71	48.4 Å²	48.4	43%	0.43	24%	0.241	S	C	.	.	H	α-helix	trans	-72.5	-42.7	176.4	172.2	0	0	0	0	110.9	L138 L183 W184 L185 R190 S191	L138-V187 HydrophobicContact CD1-CG2 4.08Å; L183-V187 WeakPolarHBondContact O-CG2 3.48Å; L183-V187 PolarHBondContact O-N 2.68Å; W184-V187 PolarHBondContact O-N 3.15Å; W184-V187 VanDerWaalsContact O-N 3.13Å; L185-V187 VanDerWaalsContact C-N 3.33Å; L185-V187 PolarHBondContact O-N 3.3Å; V187-R190 PolarHBondContact O-N 2.91Å; V187-S191 PolarHBondContact O-N 3.04Å
188	V	80.9	Confident	77.3	Confident	27 Å²	27	48 Å²	48	16%	0.164	25%	0.25	C	C	.	.	H	α-helix	trans	-60.4	-50.4	177.2	170.6	0	0	0	0	111.3	W184 L185 R190 S191 Q192	W184-V188 HydrophobicContact CD2-CG2 3.86Å; W184-V188 HydrophobicContact CE3-CG2 3.91Å; W184-V188 HydrophobicContact CH2-CG2 3.99Å; W184-V188 HydrophobicContact CZ2-CG2 3.92Å; W184-V188 HydrophobicContact CZ3-CG2 3.96Å; W184-V188 WeakPolarHBondContact O-CG2 3.5Å; W184-V188 PolarHBondContact O-N 3.14Å; L185-V188 PolarHBondContact O-N 3.27Å; V188-R190 VanDerWaalsContact C-N 3.34Å; V188-R190 PolarHBondContact O-N 2.71Å; V188-S191 PolarHBondContact O-N 3.36Å; V188-S191 VanDerWaalsContact O-N 3.12Å; V188-S191 PolarHBondContact O-OG 2.98Å; V188-Q192 HydrophobicContact CG1-CG 4.37Å; V188-Q192 WeakPolarHBondContact O-CG 3.26Å; V188-Q192 PolarHBondContact O-N 2.91Å
189	E	77.8	Confident	76.1	Confident	33 Å²	33	52.8 Å²	52.8	15%	0.154	27%	0.273	C	S	.	.	H	α-helix	trans	-53.3	-48.6	177.2	-77.5	179.4	-171.8	0	0	112.1	L185 S191 Q192 A193 H207 S208	L185-E189 HydrophobicContact CD2-CG 4.35Å; L185-E189 VanDerWaalsContact CD2-OE1 3.29Å; L185-E189 WeakPolarHBondContact CD2-OE1 3.29Å; L185-E189 WeakPolarHBondContact O-CG 3.49Å; L185-E189 PolarHBondContact O-N 3.09Å; E189-S191 VanDerWaalsContact C-N 3.34Å; E189-S191 PolarHBondContact O-N 3.05Å; E189-Q192 PolarHBondContact O-N 2.92Å; E189-A193 WeakPolarHBondContact O-CB 3.42Å; E189-A193 PolarHBondContact O-N 2.95Å; E189-H207 WeakPolarHBondContact OE2-CA 3.48Å; E189-H207 IonicContact OE2-CG 3.2Å; E189-H207 IonicContact OE2-ND1 2.62Å; E189-H207 PolarHBondContact OE2-ND1 3.45Å; E189-S208 WeakPolarHBondContact OE1-CA 3.36Å; E189-S208 WeakPolarHBondContact OE1-CB 3.42Å; E189-S208 PolarHBondContact OE1-N 3.2Å; E189-S208 PolarHBondContact OE1-OG 2.85Å
190	R	75.9	Confident	74.5	Confident	64 Å²	64	55.6 Å²	55.6	24%	0.242	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-37.5	179.5	-175.5	175.5	178.6	103.8	-8.1	112.1	Y134 L186 V187 V188 R194	Y134-R190 VanDerWaalsContact CD1-NH1 3.31Å; Y134-R190 HydrophobicContact CE2-CB 4.47Å; Y134-R190 WeakPolarHBondContact OH-CD 3.35Å; L186-R190 PolarHBondContact O-N 3.21Å; V187-R190 PolarHBondContact O-N 2.91Å; V188-R190 VanDerWaalsContact C-N 3.34Å; V188-R190 PolarHBondContact O-N 2.71Å; R190-R194 WeakPolarHBondContact O-CB 3.18Å; R190-R194 PolarHBondContact O-N 3.02Å
191	S	74.8	Confident	72.9	Confident	56 Å²	56	57.8 Å²	57.8	39%	0.392	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-45.1	176.5	74.6	0	0	0	0	112.2	V187 V188 E189 A193 R194 Q195	V187-S191 PolarHBondContact O-N 3.04Å; V188-S191 PolarHBondContact O-N 3.36Å; V188-S191 VanDerWaalsContact O-N 3.12Å; V188-S191 PolarHBondContact O-OG 2.98Å; E189-S191 VanDerWaalsContact C-N 3.34Å; E189-S191 PolarHBondContact O-N 3.05Å; S191-A193 PolarHBondContact O-N 3.46Å; S191-R194 PolarHBondContact O-N 2.71Å; S191-Q195 WeakPolarHBondContact O-CG 3.42Å; S191-Q195 PolarHBondContact O-N 3.31Å
192	Q	71.3	Confident	71.3	Confident	37 Å²	37	65.8 Å²	65.8	17%	0.173	34%	0.335	C	S	.	.	H	α-helix	trans	-62.2	-44	176.6	-71.2	179.1	-2.7	0	0	111.3	V188 E189 Q195 R196	V188-Q192 HydrophobicContact CG1-CG 4.37Å; V188-Q192 WeakPolarHBondContact O-CG 3.26Å; V188-Q192 PolarHBondContact O-N 2.91Å; E189-Q192 PolarHBondContact O-N 2.92Å; Q192-Q195 WeakPolarHBondContact O-CB 3.43Å; Q192-Q195 PolarHBondContact O-N 3.28Å; Q192-R196 WeakPolarHBondContact O-CG 3.21Å; Q192-R196 PolarHBondContact O-N 3.3Å
193	A	66.8	Low	69.9	Low	17 Å²	17	68.5 Å²	68.5	14%	0.14	35%	0.349	C	S	.	.	H	α-helix	trans	-70.7	-33.7	-179	0	0	0	0	0	112.4	E189 S191 R196 L197 F205	E189-A193 WeakPolarHBondContact O-CB 3.42Å; E189-A193 PolarHBondContact O-N 2.95Å; S191-A193 PolarHBondContact O-N 3.46Å; A193-R196 PolarHBondContact O-N 2.84Å; A193-L197 WeakPolarHBondContact O-CG 3.47Å; A193-L197 PolarHBondContact O-N 3.2Å; A193-F205 HydrophobicContact CB-CD1 4.15Å; A193-F205 HydrophobicContact CB-CE1 3.27Å; A193-F205 HydrophobicContact CB-CE2 4.3Å; A193-F205 HydrophobicContact CB-CZ 3.37Å
194	R	67.9	Low	68.3	Low	94 Å²	94	75.3 Å²	75.3	36%	0.355	38%	0.377	S	S	.	.	H	α-helix	trans	-63.1	-40.6	168.6	-177.8	-177.6	-80.5	-167.8	-9.9	111.7	R190 S191 A198	R190-R194 WeakPolarHBondContact O-CB 3.18Å; R190-R194 PolarHBondContact O-N 3.02Å; S191-R194 PolarHBondContact O-N 2.71Å; R194-A198 PolarHBondContact O-N 3.12Å
195	Q	66.9	Low	67	Low	114 Å²	114	73.5 Å²	73.5	53%	0.533	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-43.2	175	-73.5	174.1	-32.5	0	0	112.1	S191 Q192 A198 M199	S191-Q195 WeakPolarHBondContact O-CG 3.42Å; S191-Q195 PolarHBondContact O-N 3.31Å; Q192-Q195 WeakPolarHBondContact O-CB 3.43Å; Q192-Q195 PolarHBondContact O-N 3.28Å; Q195-A198 WeakPolarHBondContact O-CB 3.38Å; Q195-A198 PolarHBondContact O-N 3.04Å; Q195-M199 WeakPolarHBondContact O-CG 3.49Å; Q195-M199 PolarHBondContact O-N 3.13Å
196	R	64.6	Low	66.1	Low	101 Å²	101	83 Å²	83	38%	0.381	41%	0.407	S	S	.	.	H	α-helix	trans	-67.2	-36.4	178.5	-67.5	-175.6	-171.6	174.5	0.6	112.9	Q192 A193 M199 G200 I201 I203	Q192-R196 WeakPolarHBondContact O-CG 3.21Å; Q192-R196 PolarHBondContact O-N 3.3Å; A193-R196 PolarHBondContact O-N 2.84Å; R196-M199 HydrophobicContact CB-CE 4.41Å; R196-M199 HydrophobicContact CG-CE 3.93Å; R196-M199 CarbonylContact O-C 3.6Å; R196-M199 PolarHBondContact O-N 2.92Å; R196-G200 PolarHBondContact O-N 3.33Å; R196-I201 HydrophobicContact CB-CB 4.46Å; R196-I201 PolarHBondContact O-N 2.94Å; R196-I203 HydrophobicContact CB-CD1 3.61Å; R196-I203 HydrophobicContact CG-CD1 4.07Å
197	L	63.2	Low	65.6	Low	94 Å²	94	84.1 Å²	84.1	49%	0.492	41%	0.413	S	S	.	.	H	α-helix	trans	-61.3	-41.6	168.6	-77.2	169.9	0	0	0	112.3	A193 M199 G200 F205	A193-L197 WeakPolarHBondContact O-CG 3.47Å; A193-L197 PolarHBondContact O-N 3.2Å; L197-M199 PolarHBondContact O-N 3.1Å; L197-G200 PolarHBondContact O-N 2.94Å; L197-F205 HydrophobicContact CD1-CE2 3.83Å; L197-F205 HydrophobicContact CD1-CZ 3.76Å; L197-F205 HydrophobicContact CG-CE2 4.29Å; L197-F205 HydrophobicContact CG-CZ 4.48Å
198	A	60.6	Low	65.2	Low	74 Å²	74	82.5 Å²	82.5	61%	0.612	40%	0.404	S	S	*	.	H	α-helix	trans	-66.1	-22.5	175.5	0	0	0	0	0	113.2	R194 Q195 G200	R194-A198 PolarHBondContact O-N 3.12Å; Q195-A198 WeakPolarHBondContact O-CB 3.38Å; Q195-A198 PolarHBondContact O-N 3.04Å; A198-G200 VanDerWaalsContact C-N 3.31Å
199	M	58.3	Low	64.9	Low	101 Å²	101	86.4 Å²	86.4	50%	0.498	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	9.7	171	-65.2	-177.2	-68.6	0	0	113.2	Q195 R196 L197 I201	Q195-M199 WeakPolarHBondContact O-CG 3.49Å; Q195-M199 PolarHBondContact O-N 3.13Å; R196-M199 HydrophobicContact CB-CE 4.41Å; R196-M199 HydrophobicContact CG-CE 3.93Å; R196-M199 CarbonylContact O-C 3.6Å; R196-M199 PolarHBondContact O-N 2.92Å; L197-M199 PolarHBondContact O-N 3.1Å; M199-I201 HydrophobicContact CB-CD1 4.2Å; M199-I201 HydrophobicContact CB-CG1 4.21Å; M199-I201 PolarHBondContact O-N 2.69Å
200	G	52.1	Low	64.8	Low	60 Å²	60	85.8 Å²	85.8	62%	0.619	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	4.6	-179.8	0	0	0	0	0	115.2	R196 L197 A198 W202	R196-G200 PolarHBondContact O-N 3.33Å; L197-G200 PolarHBondContact O-N 2.94Å; A198-G200 VanDerWaalsContact C-N 3.31Å; G200-W202 PolarHBondContact O-N 2.86Å
201	I	54.3	Low	65.1	Low	87 Å²	87	82.8 Å²	82.8	45%	0.446	42%	0.421	S	S	.	.			trans	-83.1	111.3	-175.2	-54.5	174.7	0	0	0	109.5	R196 M199 I203	R196-I201 HydrophobicContact CB-CB 4.46Å; R196-I201 PolarHBondContact O-N 2.94Å; M199-I201 HydrophobicContact CB-CD1 4.2Å; M199-I201 HydrophobicContact CB-CG1 4.21Å; M199-I201 PolarHBondContact O-N 2.69Å; I201-I203 HydrophobicContact CG2-CD1 4.37Å; I201-I203 HydrophobicContact CG2-CG1 4.19Å
202	W	52.3	Low	65.5	Low	191 Å²	191	82.4 Å²	82.4	72%	0.723	42%	0.415	S	S	*	.			trans	-68.8	129.1	175.5	-97.7	87.3	0	0	0	112.3	G200 P272	G200-W202 PolarHBondContact O-N 2.86Å; W202-P272 HydrophobicContact CH2-CB 3.73Å; W202-P272 HydrophobicContact CH2-CG 3.58Å; W202-P272 HydrophobicContact CZ2-CB 4.36Å; W202-P272 HydrophobicContact CZ2-CG 4.3Å; W202-P272 HydrophobicContact CZ3-CG 3.95Å
203	I	55.4	Low	66	Low	57 Å²	57	84.6 Å²	84.6	29%	0.292	43%	0.427	S	S	.	.			trans	-139.6	130.9	-178.6	-60	174.8	0	0	0	110.3	R196 I201 F205	R196-I203 HydrophobicContact CB-CD1 3.61Å; R196-I203 HydrophobicContact CG-CD1 4.07Å; I201-I203 HydrophobicContact CG2-CD1 4.37Å; I201-I203 HydrophobicContact CG2-CG1 4.19Å; I203-F205 PolarHBondContact O-N 2.94Å; I203-F205 VanDerWaalsContact O-N 3.13Å
204	K	54.5	Low	66.8	Low	183 Å²	183	84 Å²	84	80%	0.796	42%	0.422	S	S	*	.			trans	-72.9	99.9	167.6	-168.3	169.4	-170.9	167	0	108.8	R206	K204-R206 PolarHBondContact O-N 3.16Å
205	F	58.8	Low	67.7	Low	74 Å²	74	79.6 Å²	79.6	33%	0.325	41%	0.405	S	S	.	.			trans	-56	120.6	-178.4	-87	-109.6	0	0	0	111.3	A193 L197 I203	A193-F205 HydrophobicContact CB-CD1 4.15Å; A193-F205 HydrophobicContact CB-CE1 3.27Å; A193-F205 HydrophobicContact CB-CE2 4.3Å; A193-F205 HydrophobicContact CB-CZ 3.37Å; L197-F205 HydrophobicContact CD1-CE2 3.83Å; L197-F205 HydrophobicContact CD1-CZ 3.76Å; L197-F205 HydrophobicContact CG-CE2 4.29Å; L197-F205 HydrophobicContact CG-CZ 4.48Å; I203-F205 PolarHBondContact O-N 2.94Å; I203-F205 VanDerWaalsContact O-N 3.13Å
206	R	63.4	Low	68.6	Low	206 Å²	206	76.5 Å²	76.5	78%	0.777	39%	0.394	S	S	*	.			trans	-138.9	140	167.1	-79.6	-178.8	159.7	173.4	-7.7	107.2	K204	K204-R206 PolarHBondContact O-N 3.16Å
207	H	74.2	Confident	69.6	Low	26 Å²	26	73.5 Å²	73.5	12%	0.12	39%	0.387	C	S	.	.			trans	-61.5	153	169	-70.6	-61.4	0	0	0	110.4	Q137 E189 L211 L212 G264	Q137-H207 PolarHBondContact NE2-NE2 3.11Å; E189-H207 WeakPolarHBondContact OE2-CA 3.48Å; E189-H207 IonicContact OE2-CG 3.2Å; E189-H207 IonicContact OE2-ND1 2.62Å; E189-H207 PolarHBondContact OE2-ND1 3.45Å; H207-L211 HydrophobicContact CB-CD2 4.29Å; H207-L212 HydrophobicContact CB-CD1 4.34Å; H207-L212 HydrophobicContact CB-CD2 4.03Å; H207-L212 HydrophobicContact CB-CG 3.93Å; H207-G264 PolarHBondContact CD2-O 2.82Å
208	S	75	Confident	70.6	Confident	37 Å²	37	69 Å²	69	26%	0.259	36%	0.363	S	S	.	.			trans	-62.6	150.2	175.7	68.2	0	0	0	0	110.7	L185 E189 G210 L211 L212	L185-S208 WeakPolarHBondContact CD2-OG 3.37Å; E189-S208 WeakPolarHBondContact OE1-CA 3.36Å; E189-S208 WeakPolarHBondContact OE1-CB 3.42Å; E189-S208 PolarHBondContact OE1-N 3.2Å; E189-S208 PolarHBondContact OE1-OG 2.85Å; S208-G210 PolarHBondContact O-N 3.44Å; S208-L211 PolarHBondContact O-N 3.28Å; S208-L211 VanDerWaalsContact O-N 3.17Å; S208-L211 PolarHBondContact OG-N 2.87Å; S208-L211 VanDerWaalsContact OG-N 3.11Å; S208-L212 WeakPolarHBondContact O-CG 3.23Å; S208-L212 PolarHBondContact O-N 3.12Å; S208-L212 VanDerWaalsContact O-N 3.1Å
209	P	75.1	Confident	71.8	Confident	109 Å²	109	67.7 Å²	67.7	71%	0.708	34%	0.344	S	S	*	.	H	α-helix	trans	-58.6	-28.3	172.7	24	-33.9	0	0	0	112	L213	P209-L213 WeakPolarHBondContact O-CB 3.46Å; P209-L213 PolarHBondContact O-N 3.02Å
210	G	76.6	Confident	73.1	Confident	20 Å²	20	65.7 Å²	65.7	21%	0.206	34%	0.343	C	S	.	.	H	α-helix	trans	-66.3	-44.3	174.9	0	0	0	0	0	113.3	S208 L214	S208-G210 PolarHBondContact O-N 3.44Å; G210-L214 WeakPolarHBondContact O-CB 3.27Å; G210-L214 PolarHBondContact O-N 3.23Å
211	L	81.4	Confident	74.5	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-65.9	-44.4	176.6	-169.8	57.9	0	0	0	111.8	G182 L185 L186 H207 S208 L214 W215	G182-L211 WeakPolarHBondContact O-CD1 3.36Å; L185-L211 HydrophobicContact CD2-CB 3.65Å; L185-L211 HydrophobicContact CD2-CD1 4.09Å; L185-L211 HydrophobicContact CD2-CD2 4.37Å; L185-L211 HydrophobicContact CD2-CG 4.25Å; L186-L211 HydrophobicContact CB-CD2 4.01Å; L186-L211 HydrophobicContact CD1-CD2 4.02Å; H207-L211 HydrophobicContact CB-CD2 4.29Å; S208-L211 PolarHBondContact O-N 3.28Å; S208-L211 VanDerWaalsContact O-N 3.17Å; S208-L211 PolarHBondContact OG-N 2.87Å; S208-L211 VanDerWaalsContact OG-N 3.11Å; L211-L214 PolarHBondContact O-N 2.71Å; L211-W215 HydrophobicContact CD1-CD2 4.43Å; L211-W215 HydrophobicContact CD1-CH2 4.27Å; L211-W215 HydrophobicContact CD1-CZ2 3.85Å; L211-W215 HydrophobicContact CD2-CH2 3.61Å; L211-W215 HydrophobicContact CD2-CZ2 4.01Å; L211-W215 HydrophobicContact CD2-CZ3 3.96Å; L211-W215 HydrophobicContact CG-CD2 4.24Å; L211-W215 HydrophobicContact CG-CE3 4.12Å; L211-W215 HydrophobicContact CG-CH2 3.81Å; L211-W215 HydrophobicContact CG-CZ2 3.9Å; L211-W215 HydrophobicContact CG-CZ3 3.89Å; L211-W215 PolarHBondContact O-N 2.98Å; L211-W215 VanDerWaalsContact O-N 3.12Å
212	L	82.3	Confident	76	Confident	48 Å²	48	59.4 Å²	59.4	25%	0.251	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-45.4	177.3	-67.8	173.4	0	0	0	111.2	H207 S208 L214 W215 T216 G264	H207-L212 HydrophobicContact CB-CD1 4.34Å; H207-L212 HydrophobicContact CB-CD2 4.03Å; H207-L212 HydrophobicContact CB-CG 3.93Å; S208-L212 WeakPolarHBondContact O-CG 3.23Å; S208-L212 PolarHBondContact O-N 3.12Å; S208-L212 VanDerWaalsContact O-N 3.1Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 2.84Å; L212-W215 HydrophobicContact CD2-CE3 4.42Å; L212-W215 PolarHBondContact O-N 2.83Å; L212-T216 WeakPolarHBondContact O-CG2 3.47Å; L212-T216 PolarHBondContact O-N 2.87Å; L212-G264 WeakPolarHBondContact CD2-O 3.5Å
213	L	81.9	Confident	77.5	Confident	82 Å²	82	52.7 Å²	52.7	43%	0.429	28%	0.275	S	S	.	.	H	α-helix	trans	-61.3	-38.6	176.3	-175.5	66.6	0	0	0	112.1	L100 P209 W215 T216 V217	L100-L213 HydrophobicContact CD2-CD2 4.09Å; P209-L213 WeakPolarHBondContact O-CB 3.46Å; P209-L213 PolarHBondContact O-N 3.02Å; L213-W215 VanDerWaalsContact C-N 3.33Å; L213-W215 PolarHBondContact O-N 2.93Å; L213-T216 WeakPolarHBondContact CA-OG1 3.37Å; L213-T216 PolarHBondContact O-N 3.38Å; L213-T216 PolarHBondContact O-OG1 3.37Å; L213-V217 HydrophobicContact CD1-CG2 4.23Å; L213-V217 HydrophobicContact CG-CG2 4.47Å; L213-V217 WeakPolarHBondContact O-CB 3.33Å; L213-V217 VanDerWaalsContact O-CG2 3.28Å; L213-V217 WeakPolarHBondContact O-CG2 3.43Å; L213-V217 PolarHBondContact O-N 2.72Å
214	L	83.9	Confident	78.6	Confident	5 Å²	5	52.9 Å²	52.9	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-38.1	176.8	-173.9	67.4	0	0	0	112	G210 L211 L212 A218	G210-L214 WeakPolarHBondContact O-CB 3.27Å; G210-L214 PolarHBondContact O-N 3.23Å; L211-L214 PolarHBondContact O-N 2.71Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 2.84Å; L214-A218 WeakPolarHBondContact O-CB 3.27Å; L214-A218 PolarHBondContact O-N 2.89Å
215	W	87.4	Confident	79.6	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-78.5	-32.5	175.4	-66.7	-31.2	0	0	0	113.6	L186 L211 L212 L213 A218 F219 L260	L186-W215 HydrophobicContact CD1-CH2 4.08Å; L186-W215 HydrophobicContact CD2-CH2 4.39Å; L186-W215 HydrophobicContact CD2-CZ2 4.21Å; L211-W215 HydrophobicContact CD1-CD2 4.43Å; L211-W215 HydrophobicContact CD1-CH2 4.27Å; L211-W215 HydrophobicContact CD1-CZ2 3.85Å; L211-W215 HydrophobicContact CD2-CH2 3.61Å; L211-W215 HydrophobicContact CD2-CZ2 4.01Å; L211-W215 HydrophobicContact CD2-CZ3 3.96Å; L211-W215 HydrophobicContact CG-CD2 4.24Å; L211-W215 HydrophobicContact CG-CE3 4.12Å; L211-W215 HydrophobicContact CG-CH2 3.81Å; L211-W215 HydrophobicContact CG-CZ2 3.9Å; L211-W215 HydrophobicContact CG-CZ3 3.89Å; L211-W215 PolarHBondContact O-N 2.98Å; L211-W215 VanDerWaalsContact O-N 3.12Å; L212-W215 HydrophobicContact CD2-CE3 4.42Å; L212-W215 PolarHBondContact O-N 2.83Å; L213-W215 VanDerWaalsContact C-N 3.33Å; L213-W215 PolarHBondContact O-N 2.93Å; W215-A218 WeakPolarHBondContact O-CB 3.5Å; W215-A218 PolarHBondContact O-N 2.91Å; W215-F219 PolarHBondContact O-N 3.15Å; W215-L260 HydrophobicContact CD2-CB 4.27Å; W215-L260 HydrophobicContact CG-CB 4.14Å; W215-L260 HydrophobicContact CZ2-CD2 4.01Å
216	T	85.4	Confident	80.6	Confident	49 Å²	49	43.6 Å²	43.6	30%	0.301	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-44.3	173.8	66.9	0	0	0	0	110.7	L212 L213 A218 F219 A220 F261	L212-T216 WeakPolarHBondContact O-CG2 3.47Å; L212-T216 PolarHBondContact O-N 2.87Å; L213-T216 WeakPolarHBondContact CA-OG1 3.37Å; L213-T216 PolarHBondContact O-N 3.38Å; L213-T216 PolarHBondContact O-OG1 3.37Å; T216-A218 VanDerWaalsContact C-N 3.32Å; T216-A218 PolarHBondContact O-N 2.99Å; T216-F219 PolarHBondContact O-N 3.25Å; T216-A220 VanDerWaalsContact O-CB 3.3Å; T216-A220 WeakPolarHBondContact O-CB 3.35Å; T216-A220 PolarHBondContact O-N 2.93Å; T216-F261 HydrophobicContact CG2-CD2 3.79Å; T216-F261 HydrophobicContact CG2-CE2 3.55Å
217	V	84.7	Confident	81.1	Confident	37 Å²	37	37.8 Å²	37.8	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-67.4	-34	175.6	175.9	0	0	0	0	111.2	R97 L100 L213 A221	R97-V217 HydrophobicContact CG-CG1 3.83Å; L100-V217 HydrophobicContact CD1-CB 4.41Å; L100-V217 HydrophobicContact CD1-CG1 4.29Å; L100-V217 HydrophobicContact CD1-CG2 3.87Å; L213-V217 HydrophobicContact CD1-CG2 4.23Å; L213-V217 HydrophobicContact CG-CG2 4.47Å; L213-V217 WeakPolarHBondContact O-CB 3.33Å; L213-V217 VanDerWaalsContact O-CG2 3.28Å; L213-V217 WeakPolarHBondContact O-CG2 3.43Å; L213-V217 PolarHBondContact O-N 2.72Å; V217-A221 VanDerWaalsContact O-CB 3.29Å; V217-A221 WeakPolarHBondContact O-CB 3.49Å; V217-A221 PolarHBondContact O-N 3.04Å
218	A	84.2	Confident	81	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.7	-54.3	170.3	0	0	0	0	0	111.9	L214 W215 T216 A221 E222	L214-A218 WeakPolarHBondContact O-CB 3.27Å; L214-A218 PolarHBondContact O-N 2.89Å; W215-A218 WeakPolarHBondContact O-CB 3.5Å; W215-A218 PolarHBondContact O-N 2.91Å; T216-A218 VanDerWaalsContact C-N 3.32Å; T216-A218 PolarHBondContact O-N 2.99Å; A218-A221 PolarHBondContact O-N 2.82Å; A218-E222 PolarHBondContact O-N 2.79Å
219	F	87.7	Confident	81	Confident	47 Å²	47	41.6 Å²	41.6	21%	0.206	23%	0.234	C	C	.	.	H	α-helix	trans	-68.8	-40.5	-177.2	-177	-119.8	0	0	0	112	W215 T216 A221 E222 N223 Y254 G258 F261	W215-F219 PolarHBondContact O-N 3.15Å; T216-F219 PolarHBondContact O-N 3.25Å; F219-A221 VanDerWaalsContact C-N 3.3Å; F219-A221 PolarHBondContact O-N 2.72Å; F219-E222 PolarHBondContact O-N 3.01Å; F219-N223 WeakPolarHBondContact CE2-ND2 3.46Å; F219-N223 WeakPolarHBondContact CZ-ND2 3.42Å; F219-N223 PolarHBondContact O-N 3.43Å; F219-N223 VanDerWaalsContact O-N 3.14Å; F219-N223 PolarHBondContact O-ND2 3.12Å; F219-Y254 HydrophobicContact CE2-CD2 4.49Å; F219-Y254 HydrophobicContact CE2-CE1 4.28Å; F219-Y254 AromaticContact CE2-CE2 3.93Å; F219-Y254 HydrophobicContact CE2-CE2 3.93Å; F219-Y254 AromaticContact CE2-CZ 3.81Å; F219-G258 VanDerWaalsContact CD2-CA 3.45Å; F219-F261 HydrophobicContact CB-CB 4.11Å; F219-F261 HydrophobicContact CB-CG 4.37Å; F219-F261 AromaticContact CD1-CD1 3.75Å; F219-F261 HydrophobicContact CD1-CD1 3.75Å; F219-F261 HydrophobicContact CD1-CE1 4.13Å; F219-F261 HydrophobicContact CD1-CG 4.2Å; F219-F261 HydrophobicContact CE1-CD1 4.14Å; F219-F261 HydrophobicContact CE1-CE1 4.33Å; F219-F261 HydrophobicContact CG-CB 4.36Å; F219-F261 HydrophobicContact CG-CD1 4.32Å; F219-F261 HydrophobicContact CG-CG 4.44Å
220	A	84.3	Confident	80.6	Confident	58 Å²	58	43.6 Å²	43.6	48%	0.479	24%	0.239	S	C	.	.	H	α-helix	trans	-60.5	-38.2	175.4	0	0	0	0	0	112.5	T216 N223 L224	T216-A220 VanDerWaalsContact O-CB 3.3Å; T216-A220 WeakPolarHBondContact O-CB 3.35Å; T216-A220 PolarHBondContact O-N 2.93Å; A220-N223 PolarHBondContact O-N 2.96Å; A220-L224 PolarHBondContact O-N 2.99Å
221	A	81.8	Confident	80.2	Confident	9 Å²	9	43 Å²	43	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-41.8	176.7	0	0	0	0	0	113.3	V93 V217 A218 F219 N223 L224	V93-A221 HydrophobicContact CG1-CB 3.53Å; V93-A221 HydrophobicContact CG2-CB 4.27Å; V217-A221 VanDerWaalsContact O-CB 3.29Å; V217-A221 WeakPolarHBondContact O-CB 3.49Å; V217-A221 PolarHBondContact O-N 3.04Å; A218-A221 PolarHBondContact O-N 2.82Å; F219-A221 VanDerWaalsContact C-N 3.3Å; F219-A221 PolarHBondContact O-N 2.72Å; A221-N223 VanDerWaalsContact C-N 3.26Å; A221-N223 PolarHBondContact O-N 3.36Å; A221-L224 WeakPolarHBondContact O-CB 3.43Å; A221-L224 PolarHBondContact O-N 2.69Å
222	E	85.9	Confident	79.4	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.028	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-28.6	176.2	-58.6	-61.8	165	0	0	112.1	A218 F219 W250 R253 Y254	A218-E222 PolarHBondContact O-N 2.79Å; F219-E222 PolarHBondContact O-N 3.01Å; E222-W250 PolarHBondContact O-NE1 3.44Å; E222-R253 IonicContact OE1-CZ 3.57Å; E222-R253 IonicContact OE1-NE 3.54Å; E222-R253 PolarHBondContact OE1-NE 3.46Å; E222-R253 IonicContact OE1-NH2 2.68Å; E222-R253 PolarHBondContact OE1-NH2 3.13Å; E222-R253 IonicContact OE2-NE 3.8Å; E222-Y254 HydrophobicContact CB-CD2 3.93Å
223	N	83.4	Confident	78.8	Confident	50 Å²	50	50.8 Å²	50.8	27%	0.267	27%	0.274	S	S	.	.	H	α-helix	trans	-73.2	-34.2	171.6	-79.7	-91	0	0	0	112.5	F219 A220 A221 A225 L226	F219-N223 WeakPolarHBondContact CE2-ND2 3.46Å; F219-N223 WeakPolarHBondContact CZ-ND2 3.42Å; F219-N223 PolarHBondContact O-N 3.43Å; F219-N223 VanDerWaalsContact O-N 3.14Å; F219-N223 PolarHBondContact O-ND2 3.12Å; A220-N223 PolarHBondContact O-N 2.96Å; A221-N223 VanDerWaalsContact C-N 3.26Å; A221-N223 PolarHBondContact O-N 3.36Å; N223-A225 PolarHBondContact O-N 3.35Å; N223-L226 VanDerWaalsContact O-CB 3.25Å; N223-L226 WeakPolarHBondContact O-CB 3.48Å; N223-L226 WeakPolarHBondContact O-CG 3.49Å; N223-L226 PolarHBondContact O-N 2.87Å
224	L	79.2	Confident	78.3	Confident	61 Å²	61	47 Å²	47	32%	0.319	25%	0.254	S	S	.	.	H	α-helix	trans	-61.6	-26.4	179.9	-174.7	67.9	0	0	0	112.4	L84 F89 A220 A221 L226 V227	L84-L224 HydrophobicContact CD1-CD1 3.99Å; L84-L224 HydrophobicContact CD1-CD2 3.96Å; L84-L224 HydrophobicContact CD1-CG 3.73Å; F89-L224 HydrophobicContact CD2-CD2 4.21Å; F89-L224 HydrophobicContact CD2-CG 4.47Å; F89-L224 HydrophobicContact CE2-CB 4.1Å; F89-L224 HydrophobicContact CE2-CD2 4.07Å; F89-L224 HydrophobicContact CE2-CG 4.14Å; A220-L224 PolarHBondContact O-N 2.99Å; A221-L224 WeakPolarHBondContact O-CB 3.43Å; A221-L224 PolarHBondContact O-N 2.69Å; L224-L226 PolarHBondContact O-N 2.76Å; L224-V227 HydrophobicContact CD1-CG2 4.08Å; L224-V227 WeakPolarHBondContact O-CB 3.32Å; L224-V227 WeakPolarHBondContact O-CG2 3.49Å; L224-V227 PolarHBondContact O-N 3.06Å; L224-V227 VanDerWaalsContact O-N 3.17Å
225	A	75.9	Confident	78	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-59	-26.3	171.7	0	0	0	0	0	113.9	F89 N223 V227 S228 W234 W236	F89-A225 HydrophobicContact CZ-CB 4.3Å; N223-A225 PolarHBondContact O-N 3.35Å; A225-V227 PolarHBondContact O-N 3.49Å; A225-S228 PolarHBondContact O-N 3.11Å; A225-W234 HydrophobicContact CB-CH2 4.3Å; A225-W234 HydrophobicContact CB-CZ3 3.68Å; A225-W236 HydrophobicContact CB-CZ2 4.49Å; A225-W236 WeakPolarHBondContact O-CZ2 3.48Å
226	L	79.1	Confident	77.6	Confident	63 Å²	63	48.7 Å²	48.7	33%	0.33	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-69.9	-20.2	178.4	-62	168.1	0	0	0	112.8	N223 L224 S228 W229 W236 W250	N223-L226 VanDerWaalsContact O-CB 3.25Å; N223-L226 WeakPolarHBondContact O-CB 3.48Å; N223-L226 WeakPolarHBondContact O-CG 3.49Å; N223-L226 PolarHBondContact O-N 2.87Å; L224-L226 PolarHBondContact O-N 2.76Å; L226-S228 PolarHBondContact O-N 3.21Å; L226-W229 HydrophobicContact CD2-CE3 3.9Å; L226-W229 HydrophobicContact CD2-CZ3 4.02Å; L226-W229 WeakPolarHBondContact O-CB 3.18Å; L226-W229 PolarHBondContact O-N 2.94Å; L226-W236 HydrophobicContact CD2-CH2 3.63Å; L226-W236 HydrophobicContact CD2-CZ2 4.14Å; L226-W236 HydrophobicContact CD2-CZ3 4.39Å; L226-W250 HydrophobicContact CD2-CH2 3.95Å; L226-W250 HydrophobicContact CD2-CZ2 4.07Å; L226-W250 HydrophobicContact CG-CZ2 4.4Å
227	V	73.5	Confident	77	Confident	83 Å²	83	49.6 Å²	49.6	50%	0.503	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-62.9	-29.1	176.3	179.5	0	0	0	0	111.3	L224 A225	L224-V227 HydrophobicContact CD1-CG2 4.08Å; L224-V227 WeakPolarHBondContact O-CB 3.32Å; L224-V227 WeakPolarHBondContact O-CG2 3.49Å; L224-V227 PolarHBondContact O-N 3.06Å; L224-V227 VanDerWaalsContact O-N 3.17Å; A225-V227 PolarHBondContact O-N 3.49Å
228	S	72	Confident	76.6	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.014	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-95.1	23.5	178.6	-58.3	0	0	0	0	113.6	L84 A225 L226 N230 S231 W234 W236	L84-S228 PolarHBondContact N-OG 3.46Å; L84-S228 PolarHBondContact O-OG 3.29Å; A225-S228 PolarHBondContact O-N 3.11Å; L226-S228 PolarHBondContact O-N 3.21Å; S228-N230 VanDerWaalsContact C-N 3.3Å; S228-N230 PolarHBondContact O-N 3.03Å; S228-S231 WeakPolarHBondContact O-CB 3.48Å; S228-S231 PolarHBondContact O-N 3.16Å; S228-W234 VanDerWaalsContact CB-CE2 3.41Å; S228-W234 PolarHBondContact OG-NE1 3.01Å; S228-W236 PolarHBondContact O-NE1 2.76Å
229	W	75.1	Confident	75.9	Confident	142 Å²	142	57.5 Å²	57.5	54%	0.538	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-39.8	-175.2	-176.4	-82.2	0	0	0	114.4	L226 S231 W236	L226-W229 HydrophobicContact CD2-CE3 3.9Å; L226-W229 HydrophobicContact CD2-CZ3 4.02Å; L226-W229 WeakPolarHBondContact O-CB 3.18Å; L226-W229 PolarHBondContact O-N 2.94Å; W229-S231 VanDerWaalsContact C-N 3.33Å; W229-W236 HydrophobicContact CD2-CD2 4.35Å; W229-W236 HydrophobicContact CD2-CE3 4.17Å; W229-W236 HydrophobicContact CE3-CD2 4Å; W229-W236 AromaticContact CE3-CE3 3.57Å; W229-W236 HydrophobicContact CE3-CE3 3.57Å; W229-W236 AromaticContact CE3-CH2 3.88Å; W229-W236 HydrophobicContact CE3-CH2 3.88Å; W229-W236 HydrophobicContact CE3-CZ2 4.25Å; W229-W236 AromaticContact CE3-CZ3 3.49Å; W229-W236 HydrophobicContact CE3-CZ3 3.49Å; W229-W236 VanDerWaalsContact CE3-CZ3 3.49Å; W229-W236 HydrophobicContact CH2-CE3 4.18Å; W229-W236 HydrophobicContact CH2-CZ3 4.11Å; W229-W236 HydrophobicContact CZ3-CD2 4.47Å; W229-W236 AromaticContact CZ3-CE3 3.59Å; W229-W236 HydrophobicContact CZ3-CE3 3.59Å; W229-W236 AromaticContact CZ3-CH2 3.93Å; W229-W236 HydrophobicContact CZ3-CH2 3.93Å; W229-W236 AromaticContact CZ3-CZ3 3.26Å; W229-W236 HydrophobicContact CZ3-CZ3 3.26Å; W229-W236 WeakPolarHBondContact O-CB 3.46Å
230	N	66.1	Low	75.3	Confident	150 Å²	150	60.3 Å²	60.3	80%	0.802	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	1.4	179.4	-73.8	-11.4	0	0	0	113.9	S228	S228-N230 VanDerWaalsContact C-N 3.3Å; S228-N230 PolarHBondContact O-N 3.03Å
231	S	69.6	Low	74.9	Confident	7 Å²	7	63.4 Å²	63.4	5%	0.049	34%	0.341	C	S	.	.			trans	-77.8	125.2	-173.3	-165.1	0	0	0	0	112.1	D82 S228 W229 Q233 W234	D82-S231 WeakPolarHBondContact O-CB 3.21Å; D82-S231 PolarHBondContact O-OG 3.08Å; S228-S231 WeakPolarHBondContact O-CB 3.48Å; S228-S231 PolarHBondContact O-N 3.16Å; W229-S231 VanDerWaalsContact C-N 3.33Å; S231-Q233 PolarHBondContact O-N 3.08Å; S231-W234 VanDerWaalsContact CB-CD1 3.49Å; S231-W234 PolarHBondContact O-N 2.94Å
232	P	64.8	Low	74.4	Confident	89 Å²	89	63.7 Å²	63.7	58%	0.578	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-17	176.3	29.2	-35	0	0	0	113	W234	P232-W234 PolarHBondContact O-N 3.17Å
233	Q	68.2	Low	73.9	Confident	124 Å²	124	65.2 Å²	65.2	58%	0.579	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-12.3	175.4	-64.3	-67.7	-8.4	0	0	113.3	P86 S231	P86-Q233 HydrophobicContact CG-CB 4.36Å; S231-Q233 PolarHBondContact O-N 3.08Å
234	W	72.9	Confident	73.7	Confident	3 Å²	3	67.5 Å²	67.5	1%	0.011	36%	0.36	C	S	.	.	S	Bend	trans	-106.6	160.4	-174.9	-74.4	68	0	0	0	112	L84 F89 A225 S228 S231 P232 W236	L84-W234 HydrophobicContact CB-CZ2 4.42Å; L84-W234 WeakPolarHBondContact O-CZ2 3.12Å; L84-W234 PolarHBondContact O-NE1 3.23Å; F89-W234 HydrophobicContact CB-CH2 4.21Å; F89-W234 HydrophobicContact CB-CZ2 4.23Å; F89-W234 AromaticContact CD1-CH2 3.88Å; F89-W234 HydrophobicContact CD1-CH2 3.88Å; F89-W234 AromaticContact CD2-CH2 3.91Å; F89-W234 HydrophobicContact CD2-CH2 3.91Å; F89-W234 HydrophobicContact CE1-CH2 4.2Å; F89-W234 HydrophobicContact CE2-CH2 4.22Å; F89-W234 AromaticContact CG-CH2 3.73Å; F89-W234 HydrophobicContact CG-CH2 3.73Å; F89-W234 HydrophobicContact CG-CZ2 4.24Å; F89-W234 HydrophobicContact CZ-CH2 4.36Å; A225-W234 HydrophobicContact CB-CH2 4.3Å; A225-W234 HydrophobicContact CB-CZ3 3.68Å; S228-W234 VanDerWaalsContact CB-CE2 3.41Å; S228-W234 PolarHBondContact OG-NE1 3.01Å; S231-W234 VanDerWaalsContact CB-CD1 3.49Å; S231-W234 PolarHBondContact O-N 2.94Å; P232-W234 PolarHBondContact O-N 3.17Å; W234-W236 VanDerWaalsContact CB-CD1 3.45Å; W234-W236 HydrophobicContact CB-CG 4.45Å; W234-W236 PolarHBondContact O-N 2.84Å
235	W	77.7	Confident	73.8	Confident	15 Å²	15	66.8 Å²	66.8	6%	0.057	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-71.6	10.1	-175.3	54.1	79.7	0	0	0	115.1	F90 Q243 Q246 W250	F90-W235 HydrophobicContact CE2-CH2 4.38Å; F90-W235 HydrophobicContact CE2-CZ3 4.02Å; F90-W235 AromaticContact CZ-CH2 3.8Å; F90-W235 HydrophobicContact CZ-CH2 3.8Å; F90-W235 AromaticContact CZ-CZ3 3.77Å; F90-W235 HydrophobicContact CZ-CZ3 3.77Å; W235-Q243 HydrophobicContact CB-CB 4.19Å; W235-Q246 HydrophobicContact CB-CB 3.89Å; W235-Q246 HydrophobicContact CD2-CB 4.27Å; W235-Q246 HydrophobicContact CG-CB 4.01Å; W235-W250 HydrophobicContact CZ2-CB 4.2Å; W235-W250 HydrophobicContact CZ2-CG 4.06Å; W235-W250 AromaticContact NE1-CG 3.9Å
236	W	79.2	Confident	73.8	Confident	27 Å²	27	69.1 Å²	69.1	10%	0.102	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-68.9	-33.5	-179.2	-59.5	115.3	0	0	0	113.2	A225 L226 S228 W229 W234 R238 F247 W250	A225-W236 HydrophobicContact CB-CZ2 4.49Å; A225-W236 WeakPolarHBondContact O-CZ2 3.48Å; L226-W236 HydrophobicContact CD2-CH2 3.63Å; L226-W236 HydrophobicContact CD2-CZ2 4.14Å; L226-W236 HydrophobicContact CD2-CZ3 4.39Å; S228-W236 PolarHBondContact O-NE1 2.76Å; W229-W236 HydrophobicContact CD2-CD2 4.35Å; W229-W236 HydrophobicContact CD2-CE3 4.17Å; W229-W236 HydrophobicContact CE3-CD2 4Å; W229-W236 AromaticContact CE3-CE3 3.57Å; W229-W236 HydrophobicContact CE3-CE3 3.57Å; W229-W236 AromaticContact CE3-CH2 3.88Å; W229-W236 HydrophobicContact CE3-CH2 3.88Å; W229-W236 HydrophobicContact CE3-CZ2 4.25Å; W229-W236 AromaticContact CE3-CZ3 3.49Å; W229-W236 HydrophobicContact CE3-CZ3 3.49Å; W229-W236 VanDerWaalsContact CE3-CZ3 3.49Å; W229-W236 HydrophobicContact CH2-CE3 4.18Å; W229-W236 HydrophobicContact CH2-CZ3 4.11Å; W229-W236 HydrophobicContact CZ3-CD2 4.47Å; W229-W236 AromaticContact CZ3-CE3 3.59Å; W229-W236 HydrophobicContact CZ3-CE3 3.59Å; W229-W236 AromaticContact CZ3-CH2 3.93Å; W229-W236 HydrophobicContact CZ3-CH2 3.93Å; W229-W236 AromaticContact CZ3-CZ3 3.26Å; W229-W236 HydrophobicContact CZ3-CZ3 3.26Å; W229-W236 WeakPolarHBondContact O-CB 3.46Å; W234-W236 VanDerWaalsContact CB-CD1 3.45Å; W234-W236 HydrophobicContact CB-CG 4.45Å; W234-W236 PolarHBondContact O-N 2.84Å; W236-R238 VanDerWaalsContact C-N 3.31Å; W236-R238 PolarHBondContact O-N 3.37Å; W236-F247 HydrophobicContact CE3-CD2 4.13Å; W236-F247 AromaticContact CE3-CE2 3.85Å; W236-F247 HydrophobicContact CE3-CE2 3.85Å; W236-F247 HydrophobicContact CZ3-CD2 4.2Å; W236-F247 AromaticContact CZ3-CE2 3.66Å; W236-F247 HydrophobicContact CZ3-CE2 3.66Å; W236-W250 HydrophobicContact CH2-CD2 4.23Å; W236-W250 AromaticContact CH2-CE3 3.97Å; W236-W250 HydrophobicContact CH2-CE3 3.97Å; W236-W250 AromaticContact CH2-CH2 3.59Å; W236-W250 HydrophobicContact CH2-CH2 3.59Å; W236-W250 AromaticContact CH2-CZ2 3.82Å; W236-W250 HydrophobicContact CH2-CZ2 3.82Å; W236-W250 AromaticContact CH2-CZ3 3.64Å; W236-W250 HydrophobicContact CH2-CZ3 3.64Å; W236-W250 HydrophobicContact CZ3-CE3 4.24Å; W236-W250 HydrophobicContact CZ3-CH2 4.13Å; W236-W250 AromaticContact CZ3-CZ3 3.83Å; W236-W250 HydrophobicContact CZ3-CZ3 3.83Å
237	A	72.1	Confident	74	Confident	68 Å²	68	68 Å²	68	56%	0.562	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-70.5	-21.9	-178.5	0	0	0	0	0	114.3	A239	A237-A239 PolarHBondContact O-N 3.48Å
238	R	75.6	Confident	74.5	Confident	124 Å²	124	67.1 Å²	67.1	47%	0.468	36%	0.359	S	S	.	.			trans	51.8	25.4	178.9	-57.6	-176.9	-169.7	161.8	7.1	115.5	W236 D240 Q243 Q244	W236-R238 VanDerWaalsContact C-N 3.31Å; W236-R238 PolarHBondContact O-N 3.37Å; R238-D240 PolarHBondContact O-N 3.04Å; R238-Q243 VanDerWaalsContact N-OE1 3.13Å; R238-Q244 HydrophobicContact CB-CG 4.01Å; R238-Q244 PolarHBondContact O-NE2 2.94Å; R238-Q244 VanDerWaalsContact O-NE2 3.09Å
239	A	70.7	Confident	75	Confident	79 Å²	79	68.9 Å²	68.9	65%	0.653	37%	0.368	S	S	*	.			trans	-65.6	-39.3	-175.8	0	0	0	0	0	112.2	A237	A237-A239 PolarHBondContact O-N 3.48Å
240	D	74.5	Confident	75.5	Confident	106 Å²	106	63.4 Å²	63.4	57%	0.567	35%	0.348	S	S	*	.	S	Bend	trans	-106	152.9	179.6	-75.2	-53.1	0	0	0	113.1	R238 G242 Q243 Q244	R238-D240 PolarHBondContact O-N 3.04Å; D240-G242 PolarHBondContact O-N 3.4Å; D240-G242 VanDerWaalsContact O-N 3.15Å; D240-Q243 HydrophobicContact CB-CG 4.35Å; D240-Q243 WeakPolarHBondContact O-CA 3.41Å; D240-Q243 WeakPolarHBondContact O-CB 3.48Å; D240-Q243 PolarHBondContact O-N 3.22Å; D240-Q244 PolarHBondContact O-N 3.07Å
241	L	74.7	Confident	76.5	Confident	124 Å²	124	59 Å²	59	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-53.1	-35.7	170.6	-159.2	94.9	0	0	0	111.9	Q244 V245	L241-Q244 PolarHBondContact O-N 2.98Å; L241-V245 WeakPolarHBondContact O-CG2 3.4Å; L241-V245 PolarHBondContact O-N 2.95Å; L241-V245 VanDerWaalsContact O-N 3.08Å
242	G	72.1	Confident	77.3	Confident	15 Å²	15	62.7 Å²	62.7	16%	0.155	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-36.5	174.9	0	0	0	0	0	113.6	D240 Q246	D240-G242 PolarHBondContact O-N 3.4Å; D240-G242 VanDerWaalsContact O-N 3.15Å; G242-Q246 VanDerWaalsContact O-CG 3.24Å; G242-Q246 WeakPolarHBondContact O-CG 3.45Å; G242-Q246 PolarHBondContact O-N 3.37Å; G242-Q246 PolarHBondContact O-NE2 3.2Å
243	Q	75.9	Confident	78.4	Confident	38 Å²	38	60.4 Å²	60.4	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-71.4	-39.1	174.3	-67.3	-176.8	-8.3	0	0	111.1	W235 R238 D240 V245 Q246 F247	W235-Q243 HydrophobicContact CB-CB 4.19Å; R238-Q243 VanDerWaalsContact N-OE1 3.13Å; D240-Q243 HydrophobicContact CB-CG 4.35Å; D240-Q243 WeakPolarHBondContact O-CA 3.41Å; D240-Q243 WeakPolarHBondContact O-CB 3.48Å; D240-Q243 PolarHBondContact O-N 3.22Å; Q243-V245 PolarHBondContact O-N 3.31Å; Q243-Q246 PolarHBondContact O-N 2.77Å; Q243-F247 WeakPolarHBondContact O-CB 3.44Å; Q243-F247 PolarHBondContact O-N 3.31Å
244	Q	79.4	Confident	79.3	Confident	97 Å²	97	57.9 Å²	57.9	45%	0.453	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-41.8	177.3	-67.2	175.1	9.2	0	0	112.4	R238 D240 L241 F247 S248	R238-Q244 HydrophobicContact CB-CG 4.01Å; R238-Q244 PolarHBondContact O-NE2 2.94Å; R238-Q244 VanDerWaalsContact O-NE2 3.09Å; D240-Q244 PolarHBondContact O-N 3.07Å; L241-Q244 PolarHBondContact O-N 2.98Å; Q244-F247 PolarHBondContact O-N 3.44Å; Q244-S248 PolarHBondContact O-N 3.3Å; Q244-S248 VanDerWaalsContact O-N 3.13Å; Q244-S248 PolarHBondContact O-OG 3.04Å
245	V	80	Confident	80.1	Confident	47 Å²	47	62 Å²	62	29%	0.285	34%	0.336	S	S	.	.	H	α-helix	trans	-67.3	-36.2	174.4	172.2	0	0	0	0	112.1	L241 Q243 S248 L249	L241-V245 WeakPolarHBondContact O-CG2 3.4Å; L241-V245 PolarHBondContact O-N 2.95Å; L241-V245 VanDerWaalsContact O-N 3.08Å; Q243-V245 PolarHBondContact O-N 3.31Å; V245-S248 PolarHBondContact O-OG 3.05Å; V245-S248 VanDerWaalsContact O-OG 3.06Å; V245-L249 HydrophobicContact CG1-CD1 4.05Å; V245-L249 WeakPolarHBondContact O-CB 3.27Å; V245-L249 VanDerWaalsContact O-CG 3.32Å; V245-L249 WeakPolarHBondContact O-CG 3.37Å; V245-L249 PolarHBondContact O-N 3.36Å
246	Q	77.3	Confident	80.7	Confident	49 Å²	49	61.6 Å²	61.6	23%	0.229	34%	0.335	C	S	.	.	H	α-helix	trans	-69.7	-40.6	176.1	-72.5	176.1	44.6	0	0	112.3	W235 G242 Q243 L249 W250	W235-Q246 HydrophobicContact CB-CB 3.89Å; W235-Q246 HydrophobicContact CD2-CB 4.27Å; W235-Q246 HydrophobicContact CG-CB 4.01Å; G242-Q246 VanDerWaalsContact O-CG 3.24Å; G242-Q246 WeakPolarHBondContact O-CG 3.45Å; G242-Q246 PolarHBondContact O-N 3.37Å; G242-Q246 PolarHBondContact O-NE2 3.2Å; Q243-Q246 PolarHBondContact O-N 2.77Å; Q246-L249 PolarHBondContact O-N 3.22Å; Q246-W250 WeakPolarHBondContact O-CB 3.34Å; Q246-W250 PolarHBondContact O-N 3.24Å
247	F	82.3	Confident	81	Confident	39 Å²	39	60.4 Å²	60.4	17%	0.171	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-46.2	175.3	-179.2	-86.1	0	0	0	111.7	W236 Q243 Q244 L249 W250 V251	W236-F247 HydrophobicContact CE3-CD2 4.13Å; W236-F247 AromaticContact CE3-CE2 3.85Å; W236-F247 HydrophobicContact CE3-CE2 3.85Å; W236-F247 HydrophobicContact CZ3-CD2 4.2Å; W236-F247 AromaticContact CZ3-CE2 3.66Å; W236-F247 HydrophobicContact CZ3-CE2 3.66Å; Q243-F247 WeakPolarHBondContact O-CB 3.44Å; Q243-F247 PolarHBondContact O-N 3.31Å; Q244-F247 PolarHBondContact O-N 3.44Å; F247-L249 PolarHBondContact O-N 3.34Å; F247-W250 HydrophobicContact CE2-CE3 4.34Å; F247-W250 HydrophobicContact CE2-CZ3 4.28Å; F247-W250 HydrophobicContact CZ-CZ3 4.47Å; F247-W250 PolarHBondContact O-N 3.22Å; F247-V251 HydrophobicContact CD1-CG2 4.13Å; F247-V251 HydrophobicContact CE1-CG2 3.55Å; F247-V251 HydrophobicContact CZ-CG2 3.78Å; F247-V251 WeakPolarHBondContact O-CG2 3.42Å; F247-V251 PolarHBondContact O-N 2.8Å
248	S	83.6	Confident	81.8	Confident	64 Å²	64	57.8 Å²	57.8	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-66.9	-37.2	-179.7	62.9	0	0	0	0	112.9	Q244 V245 V251 L252	Q244-S248 PolarHBondContact O-N 3.3Å; Q244-S248 VanDerWaalsContact O-N 3.13Å; Q244-S248 PolarHBondContact O-OG 3.04Å; V245-S248 PolarHBondContact O-OG 3.05Å; V245-S248 VanDerWaalsContact O-OG 3.06Å; S248-V251 PolarHBondContact O-N 3.38Å; S248-L252 PolarHBondContact O-N 2.9Å; S248-L252 VanDerWaalsContact O-N 3.09Å
249	L	83	Confident	82.3	Confident	39 Å²	39	52.9 Å²	52.9	20%	0.204	30%	0.298	C	S	.	.	H	α-helix	trans	-68.9	-36.1	173.9	-71.8	172.3	0	0	0	112.9	V245 Q246 F247 L252 R253	V245-L249 HydrophobicContact CG1-CD1 4.05Å; V245-L249 WeakPolarHBondContact O-CB 3.27Å; V245-L249 VanDerWaalsContact O-CG 3.32Å; V245-L249 WeakPolarHBondContact O-CG 3.37Å; V245-L249 PolarHBondContact O-N 3.36Å; Q246-L249 PolarHBondContact O-N 3.22Å; F247-L249 PolarHBondContact O-N 3.34Å; L249-L252 PolarHBondContact O-N 3.2Å; L249-R253 WeakPolarHBondContact O-CG 3.27Å; L249-R253 PolarHBondContact O-N 3.41Å
250	W	86.6	Confident	83.1	Confident	28 Å²	28	49.1 Å²	49.1	11%	0.106	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-45.3	172.2	170.9	77.4	0	0	0	111.6	E222 L226 W235 W236 Q246 F247 L252 R253 Y254	E222-W250 PolarHBondContact O-NE1 3.44Å; L226-W250 HydrophobicContact CD2-CH2 3.95Å; L226-W250 HydrophobicContact CD2-CZ2 4.07Å; L226-W250 HydrophobicContact CG-CZ2 4.4Å; W235-W250 HydrophobicContact CZ2-CB 4.2Å; W235-W250 HydrophobicContact CZ2-CG 4.06Å; W235-W250 AromaticContact NE1-CG 3.9Å; W236-W250 HydrophobicContact CH2-CD2 4.23Å; W236-W250 AromaticContact CH2-CE3 3.97Å; W236-W250 HydrophobicContact CH2-CE3 3.97Å; W236-W250 AromaticContact CH2-CH2 3.59Å; W236-W250 HydrophobicContact CH2-CH2 3.59Å; W236-W250 AromaticContact CH2-CZ2 3.82Å; W236-W250 HydrophobicContact CH2-CZ2 3.82Å; W236-W250 AromaticContact CH2-CZ3 3.64Å; W236-W250 HydrophobicContact CH2-CZ3 3.64Å; W236-W250 HydrophobicContact CZ3-CE3 4.24Å; W236-W250 HydrophobicContact CZ3-CH2 4.13Å; W236-W250 AromaticContact CZ3-CZ3 3.83Å; W236-W250 HydrophobicContact CZ3-CZ3 3.83Å; Q246-W250 WeakPolarHBondContact O-CB 3.34Å; Q246-W250 PolarHBondContact O-N 3.24Å; F247-W250 HydrophobicContact CE2-CE3 4.34Å; F247-W250 HydrophobicContact CE2-CZ3 4.28Å; F247-W250 HydrophobicContact CZ-CZ3 4.47Å; F247-W250 PolarHBondContact O-N 3.22Å; W250-L252 VanDerWaalsContact C-N 3.27Å; W250-L252 PolarHBondContact O-N 2.84Å; W250-R253 PolarHBondContact O-N 3.24Å; W250-R253 VanDerWaalsContact O-N 3.14Å; W250-Y254 HydrophobicContact CH2-CD2 4.49Å; W250-Y254 AromaticContact CZ2-CD2 3.96Å; W250-Y254 HydrophobicContact CZ2-CD2 3.96Å; W250-Y254 HydrophobicContact CZ2-CG 4.4Å; W250-Y254 WeakPolarHBondContact O-CB 3.29Å; W250-Y254 PolarHBondContact O-N 2.61Å
251	V	85.9	Confident	83.7	Confident	56 Å²	56	46.6 Å²	46.6	34%	0.339	25%	0.251	S	S	.	.	H	α-helix	trans	-56.3	-43.1	174.3	170.6	0	0	0	0	111.1	F247 S248 Y254 V255	F247-V251 HydrophobicContact CD1-CG2 4.13Å; F247-V251 HydrophobicContact CE1-CG2 3.55Å; F247-V251 HydrophobicContact CZ-CG2 3.78Å; F247-V251 WeakPolarHBondContact O-CG2 3.42Å; F247-V251 PolarHBondContact O-N 2.8Å; S248-V251 PolarHBondContact O-N 3.38Å; V251-Y254 PolarHBondContact O-N 3.35Å; V251-V255 WeakPolarHBondContact O-CG2 3.34Å; V251-V255 PolarHBondContact O-N 3.49Å
252	L	87.1	Confident	84.2	Confident	86 Å²	86	44.8 Å²	44.8	45%	0.45	25%	0.245	S	C	.	.	H	α-helix	trans	-65.2	-41	178.1	-173.4	56.3	0	0	0	112.3	L147 S248 L249 W250 V256	L147-L252 HydrophobicContact CD1-CG 4.31Å; L147-L252 HydrophobicContact CD2-CB 4.47Å; L147-L252 HydrophobicContact CD2-CD2 3.55Å; L147-L252 HydrophobicContact CD2-CG 3.84Å; S248-L252 PolarHBondContact O-N 2.9Å; S248-L252 VanDerWaalsContact O-N 3.09Å; L249-L252 PolarHBondContact O-N 3.2Å; W250-L252 VanDerWaalsContact C-N 3.27Å; W250-L252 PolarHBondContact O-N 2.84Å; L252-V256 HydrophobicContact CD1-CG2 4.5Å; L252-V256 WeakPolarHBondContact O-CB 3.41Å; L252-V256 VanDerWaalsContact O-CG2 3.31Å; L252-V256 WeakPolarHBondContact O-CG2 3.47Å; L252-V256 PolarHBondContact O-N 3.37Å
253	R	86.7	Confident	84.7	Confident	40 Å²	40	45.3 Å²	45.3	15%	0.151	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-40.1	173.4	-74.2	173.1	58.4	136.1	4.6	113	L147 E175 E222 L249 W250 V256 S257	L147-R253 HydrophobicContact CB-CG 3.92Å; L147-R253 HydrophobicContact CD1-CG 3.94Å; L147-R253 HydrophobicContact CG-CG 4.41Å; E175-R253 VanDerWaalsContact CD-NH2 3.35Å; E175-R253 IonicContact OE1-CZ 2.87Å; E175-R253 IonicContact OE1-NH1 3.18Å; E175-R253 IonicContact OE1-NH2 3.58Å; E175-R253 PolarHBondContact OE1-NH2 2.66Å; E175-R253 IonicContact OE2-CZ 3.96Å; E175-R253 IonicContact OE2-NH1 2.69Å; E175-R253 PolarHBondContact OE2-NH1 3.28Å; E175-R253 IonicContact OE2-NH2 3.79Å; E175-R253 PolarHBondContact OE2-NH2 3.09Å; E222-R253 IonicContact OE1-CZ 3.57Å; E222-R253 IonicContact OE1-NE 3.54Å; E222-R253 PolarHBondContact OE1-NE 3.46Å; E222-R253 IonicContact OE1-NH2 2.68Å; E222-R253 PolarHBondContact OE1-NH2 3.13Å; E222-R253 IonicContact OE2-NE 3.8Å; L249-R253 WeakPolarHBondContact O-CG 3.27Å; L249-R253 PolarHBondContact O-N 3.41Å; W250-R253 PolarHBondContact O-N 3.24Å; W250-R253 VanDerWaalsContact O-N 3.14Å; R253-V256 PolarHBondContact O-N 2.88Å; R253-S257 VanDerWaalsContact O-CB 3.3Å; R253-S257 WeakPolarHBondContact O-CB 3.39Å; R253-S257 PolarHBondContact O-N 3.43Å; R253-S257 PolarHBondContact O-OG 3.17Å
254	Y	88.2	Confident	84.7	Confident	72 Å²	72	43.6 Å²	43.6	28%	0.282	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-48.1	177	-175.6	-88.7	0	0	0	111.2	F219 E222 W250 V251 S257 G258	F219-Y254 HydrophobicContact CE2-CD2 4.49Å; F219-Y254 HydrophobicContact CE2-CE1 4.28Å; F219-Y254 AromaticContact CE2-CE2 3.93Å; F219-Y254 HydrophobicContact CE2-CE2 3.93Å; F219-Y254 AromaticContact CE2-CZ 3.81Å; E222-Y254 HydrophobicContact CB-CD2 3.93Å; W250-Y254 HydrophobicContact CH2-CD2 4.49Å; W250-Y254 AromaticContact CZ2-CD2 3.96Å; W250-Y254 HydrophobicContact CZ2-CD2 3.96Å; W250-Y254 HydrophobicContact CZ2-CG 4.4Å; W250-Y254 WeakPolarHBondContact O-CB 3.29Å; W250-Y254 PolarHBondContact O-N 2.61Å; V251-Y254 PolarHBondContact O-N 3.35Å; Y254-S257 PolarHBondContact O-N 3.04Å; Y254-G258 PolarHBondContact O-N 2.99Å
255	V	90	Very high	84.6	Confident	90 Å²	90	44.3 Å²	44.3	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-44	176.7	172.4	0	0	0	0	111.7	V251 G259	V251-V255 WeakPolarHBondContact O-CG2 3.34Å; V251-V255 PolarHBondContact O-N 3.49Å; V255-G259 PolarHBondContact O-N 3Å
256	V	89.1	Confident	84.1	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.036	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-45.4	179.1	168.6	0	0	0	0	111.9	L140 F143 Q144 L147 L252 R253 G259 L260	L140-V256 HydrophobicContact CB-CG1 4.33Å; L140-V256 HydrophobicContact CD2-CB 4.48Å; L140-V256 HydrophobicContact CD2-CG1 4.42Å; L140-V256 HydrophobicContact CD2-CG2 4.06Å; L140-V256 VanDerWaalsContact O-CG1 3.24Å; L140-V256 WeakPolarHBondContact O-CG1 3.46Å; F143-V256 HydrophobicContact CB-CG1 4.21Å; F143-V256 HydrophobicContact CB-CG2 4.16Å; Q144-V256 HydrophobicContact CB-CG1 4.12Å; L147-V256 HydrophobicContact CD1-CB 4.26Å; L147-V256 HydrophobicContact CD1-CG1 4.47Å; L147-V256 HydrophobicContact CD1-CG2 4.07Å; L252-V256 HydrophobicContact CD1-CG2 4.5Å; L252-V256 WeakPolarHBondContact O-CB 3.41Å; L252-V256 VanDerWaalsContact O-CG2 3.31Å; L252-V256 WeakPolarHBondContact O-CG2 3.47Å; L252-V256 PolarHBondContact O-N 3.37Å; R253-V256 PolarHBondContact O-N 2.88Å; V256-G259 PolarHBondContact O-N 2.99Å; V256-L260 HydrophobicContact CG1-CD1 4.25Å; V256-L260 WeakPolarHBondContact O-CG 3.42Å; V256-L260 PolarHBondContact O-N 3.4Å
257	S	87.1	Confident	83.6	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-69	-40	-179.8	-55.7	0	0	0	0	112	R253 Y254 L260 F261	R253-S257 VanDerWaalsContact O-CB 3.3Å; R253-S257 WeakPolarHBondContact O-CB 3.39Å; R253-S257 PolarHBondContact O-N 3.43Å; R253-S257 PolarHBondContact O-OG 3.17Å; Y254-S257 PolarHBondContact O-N 3.04Å; S257-L260 PolarHBondContact O-N 3.33Å; S257-F261 WeakPolarHBondContact O-CB 3.45Å; S257-F261 PolarHBondContact O-N 3.19Å
258	G	87.4	Confident	82.3	Confident	12 Å²	12	49.5 Å²	49.5	12%	0.124	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-41.7	173.5	0	0	0	0	0	112.6	F219 Y254 F261 V262	F219-G258 VanDerWaalsContact CD2-CA 3.45Å; Y254-G258 PolarHBondContact O-N 2.99Å; G258-F261 PolarHBondContact O-N 3.01Å; G258-V262 WeakPolarHBondContact O-CG2 3.33Å; G258-V262 PolarHBondContact O-N 3.03Å
259	G	86.6	Confident	80.8	Confident	22 Å²	22	47.7 Å²	47.7	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-43.6	174.5	0	0	0	0	0	112.8	V255 V256 L263	V255-G259 PolarHBondContact O-N 3Å; V256-G259 PolarHBondContact O-N 2.99Å; G259-L263 VanDerWaalsContact O-CB 3.3Å; G259-L263 WeakPolarHBondContact O-CB 3.31Å; G259-L263 WeakPolarHBondContact O-CD1 3.47Å; G259-L263 VanDerWaalsContact O-CG 3.26Å; G259-L263 WeakPolarHBondContact O-CG 3.18Å; G259-L263 PolarHBondContact O-N 2.72Å
260	L	86.9	Confident	79	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.9	-41.2	174.3	-76	169	0	0	0	112.8	Q137 L140 A141 Q144 W215 V256 S257 G264	Q137-L260 WeakPolarHBondContact O-CD2 3.49Å; L140-L260 HydrophobicContact CB-CD1 4.28Å; L140-L260 HydrophobicContact CB-CD2 3.73Å; L140-L260 HydrophobicContact CB-CG 3.74Å; A141-L260 HydrophobicContact CB-CD2 4.16Å; Q144-L260 HydrophobicContact CB-CD1 4.1Å; Q144-L260 HydrophobicContact CG-CD1 4.31Å; W215-L260 HydrophobicContact CD2-CB 4.27Å; W215-L260 HydrophobicContact CG-CB 4.14Å; W215-L260 HydrophobicContact CZ2-CD2 4.01Å; V256-L260 HydrophobicContact CG1-CD1 4.25Å; V256-L260 WeakPolarHBondContact O-CG 3.42Å; V256-L260 PolarHBondContact O-N 3.4Å; S257-L260 PolarHBondContact O-N 3.33Å; L260-G264 WeakPolarHBondContact O-CA 3.41Å; L260-G264 PolarHBondContact O-N 2.98Å
261	F	87.6	Confident	76.7	Confident	52 Å²	52	59.7 Å²	59.7	23%	0.228	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-50.5	175.8	171.1	-114.3	0	0	0	111.9	T216 F219 S257 G258 G264 L265	T216-F261 HydrophobicContact CG2-CD2 3.79Å; T216-F261 HydrophobicContact CG2-CE2 3.55Å; F219-F261 HydrophobicContact CB-CB 4.11Å; F219-F261 HydrophobicContact CB-CG 4.37Å; F219-F261 AromaticContact CD1-CD1 3.75Å; F219-F261 HydrophobicContact CD1-CD1 3.75Å; F219-F261 HydrophobicContact CD1-CE1 4.13Å; F219-F261 HydrophobicContact CD1-CG 4.2Å; F219-F261 HydrophobicContact CE1-CD1 4.14Å; F219-F261 HydrophobicContact CE1-CE1 4.33Å; F219-F261 HydrophobicContact CG-CB 4.36Å; F219-F261 HydrophobicContact CG-CD1 4.32Å; F219-F261 HydrophobicContact CG-CG 4.44Å; S257-F261 WeakPolarHBondContact O-CB 3.45Å; S257-F261 PolarHBondContact O-N 3.19Å; G258-F261 PolarHBondContact O-N 3.01Å; F261-G264 PolarHBondContact O-N 3.31Å; F261-L265 HydrophobicContact CD2-CD1 4.41Å; F261-L265 HydrophobicContact CD2-CG 4.47Å; F261-L265 HydrophobicContact CE1-CD1 3.95Å; F261-L265 HydrophobicContact CE2-CD1 3.8Å; F261-L265 HydrophobicContact CE2-CD2 4.44Å; F261-L265 HydrophobicContact CE2-CG 4.11Å; F261-L265 HydrophobicContact CZ-CD1 3.55Å; F261-L265 HydrophobicContact CZ-CG 4.37Å; F261-L265 WeakPolarHBondContact O-CG 3.42Å; F261-L265 PolarHBondContact O-N 3.15Å
262	V	85.1	Confident	74.5	Confident	87 Å²	87	60.8 Å²	60.8	53%	0.527	31%	0.31	S	S	.	.	H	α-helix	trans	-63.8	-47.9	179.6	172.6	0	0	0	0	111.5	G258 G264 L265 W266	G258-V262 WeakPolarHBondContact O-CG2 3.33Å; G258-V262 PolarHBondContact O-N 3.03Å; V262-G264 VanDerWaalsContact C-N 3.29Å; V262-G264 PolarHBondContact O-N 3.47Å; V262-L265 PolarHBondContact O-N 2.68Å; V262-W266 PolarHBondContact O-N 2.96Å; V262-W266 VanDerWaalsContact O-N 3.08Å
263	L	82.1	Confident	72	Confident	25 Å²	25	65 Å²	65	13%	0.131	33%	0.327	C	S	.	.	H	α-helix	trans	-65.7	-32.9	177	-69.2	168.2	0	0	0	112	L136 Q137 L140 G259 W266 A267 P268	L136-L263 HydrophobicContact CB-CD1 4.47Å; L136-L263 HydrophobicContact CD2-CD1 3.85Å; L136-L263 HydrophobicContact CG-CD1 3.88Å; Q137-L263 HydrophobicContact CG-CB 3.69Å; Q137-L263 HydrophobicContact CG-CD1 3.97Å; Q137-L263 HydrophobicContact CG-CG 4.38Å; Q137-L263 PolarHBondContact NE2-O 3.38Å; L140-L263 HydrophobicContact CD1-CD1 3.72Å; G259-L263 VanDerWaalsContact O-CB 3.3Å; G259-L263 WeakPolarHBondContact O-CB 3.31Å; G259-L263 WeakPolarHBondContact O-CD1 3.47Å; G259-L263 VanDerWaalsContact O-CG 3.26Å; G259-L263 WeakPolarHBondContact O-CG 3.18Å; G259-L263 PolarHBondContact O-N 2.72Å; L263-W266 PolarHBondContact O-N 3.45Å; L263-A267 PolarHBondContact O-N 2.87Å; L263-P268 WeakPolarHBondContact O-CD 3.37Å
264	G	77.8	Confident	69.4	Low	2 Å²	2	67 Å²	67	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-46.7	174	0	0	0	0	0	112.4	H207 L212 L260 F261 V262 W266 A267	H207-G264 PolarHBondContact CD2-O 2.82Å; L212-G264 WeakPolarHBondContact CD2-O 3.5Å; L260-G264 WeakPolarHBondContact O-CA 3.41Å; L260-G264 PolarHBondContact O-N 2.98Å; F261-G264 PolarHBondContact O-N 3.31Å; V262-G264 VanDerWaalsContact C-N 3.29Å; V262-G264 PolarHBondContact O-N 3.47Å; G264-W266 VanDerWaalsContact C-N 3.27Å; G264-W266 PolarHBondContact O-N 2.93Å; G264-A267 PolarHBondContact O-N 3.4Å
265	L	76.3	Confident	66.9	Low	113 Å²	113	74.2 Å²	74.2	59%	0.592	38%	0.375	S	S	*	.	H	α-helix	trans	-61.9	-34.1	173.8	-70	177.9	0	0	0	112.7	F261 V262	F261-L265 HydrophobicContact CD2-CD1 4.41Å; F261-L265 HydrophobicContact CD2-CG 4.47Å; F261-L265 HydrophobicContact CE1-CD1 3.95Å; F261-L265 HydrophobicContact CE2-CD1 3.8Å; F261-L265 HydrophobicContact CE2-CD2 4.44Å; F261-L265 HydrophobicContact CE2-CG 4.11Å; F261-L265 HydrophobicContact CZ-CD1 3.55Å; F261-L265 HydrophobicContact CZ-CG 4.37Å; F261-L265 WeakPolarHBondContact O-CG 3.42Å; F261-L265 PolarHBondContact O-N 3.15Å; V262-L265 PolarHBondContact O-N 2.68Å
266	W	70.1	Confident	64	Low	202 Å²	202	74.5 Å²	74.5	77%	0.765	38%	0.378	S	S	*	.	H	α-helix	trans	-77.1	-18.6	177.5	-117.1	50.6	0	0	0	114.4	V262 L263 G264	V262-W266 PolarHBondContact O-N 2.96Å; V262-W266 VanDerWaalsContact O-N 3.08Å; L263-W266 PolarHBondContact O-N 3.45Å; G264-W266 VanDerWaalsContact C-N 3.27Å; G264-W266 PolarHBondContact O-N 2.93Å
267	A	65.4	Low	61.4	Low	22 Å²	22	82.1 Å²	82.1	18%	0.182	42%	0.417	C	S	.	.			trans	37.7	63.6	-179.4	0	0	0	0	0	114.2	L263 G264 G269	L263-A267 PolarHBondContact O-N 2.87Å; G264-A267 PolarHBondContact O-N 3.4Å; A267-G269 PolarHBondContact O-N 3.49Å
268	P	56.4	Low	58.7	Low	19 Å²	19	89 Å²	89	12%	0.123	45%	0.449	C	S	.	.			trans	-77	59.9	-167.1	33.9	-39.1	0	0	0	113.9	P133 L263	P133-P268 HydrophobicContact CB-CB 3.67Å; P133-P268 HydrophobicContact CB-CG 3.77Å; P133-P268 HydrophobicContact CG-CB 3.66Å; P133-P268 HydrophobicContact CG-CG 4.25Å; L263-P268 WeakPolarHBondContact O-CD 3.37Å
269	G	51.2	Low	56	Low	26 Å²	26	94.1 Å²	94.1	27%	0.268	48%	0.477	S	S	.	.			trans	-97	105.1	167.5	0	0	0	0	0	110.7	A267	A267-G269 PolarHBondContact O-N 3.49Å
270	L	46.1	Very low	53.1	Low	77 Å²	77	98.1 Å²	98.1	40%	0.403	49%	0.49	S	S	.	.			trans	20.1	105.4	160.3	-65.5	162.9	0	0	0	116.4	P129 V131 P272	P129-L270 HydrophobicContact CB-CD2 3.91Å; P129-L270 HydrophobicContact CG-CD1 3.72Å; P129-L270 HydrophobicContact CG-CD2 3.59Å; P129-L270 HydrophobicContact CG-CG 4.3Å; V131-L270 HydrophobicContact CG1-CD2 3.96Å; V131-L270 HydrophobicContact CG1-CG 4.38Å; V131-L270 HydrophobicContact CG2-CD1 4.25Å; V131-L270 HydrophobicContact CG2-CD2 3.89Å; V131-L270 HydrophobicContact CG2-CG 3.74Å; L270-P272 VanDerWaalsContact O-CD 3.24Å; L270-P272 WeakPolarHBondContact O-CD 3.46Å
271	R	38.7	Very low	50.5	Low	242 Å²	242	107.1 Å²	107.1	91%	0.913	53%	0.532	S	S	*	.			trans	-74.1	121	162.8	-61.6	179.6	-177.8	-177.1	0.3	109.5
272	P	38.5	Very low	47.7	Very low	80 Å²	80	111.2 Å²	111.2	52%	0.519	55%	0.552	S	S	.	*			trans	-77.9	133.4	141.6	2.4	18.8	0	0	0	106.8	W202 L270 S274	W202-P272 HydrophobicContact CH2-CB 3.73Å; W202-P272 HydrophobicContact CH2-CG 3.58Å; W202-P272 HydrophobicContact CZ2-CB 4.36Å; W202-P272 HydrophobicContact CZ2-CG 4.3Å; W202-P272 HydrophobicContact CZ3-CG 3.95Å; L270-P272 VanDerWaalsContact O-CD 3.24Å; L270-P272 WeakPolarHBondContact O-CD 3.46Å; P272-S274 PolarHBondContact O-N 3.02Å
273	Q	34	Very low	45.1	Very low	175 Å²	175	113.6 Å²	113.6	82%	0.818	56%	0.562	S	S	*	*			trans	-68.7	115	178.4	-171.7	165.5	-11.4	0	0	108.7	Y275	Q273-Y275 PolarHBondContact O-N 3.1Å; Q273-Y275 VanDerWaalsContact O-N 3.16Å
274	S	31.9	Very low	42.6	Very low	82 Å²	82	119.6 Å²	119.6	57%	0.573	59%	0.589	S	S	*	*			trans	-77.2	101.9	-176.2	53.2	0	0	0	0	110.9	P272 T276	P272-S274 PolarHBondContact O-N 3.02Å; S274-T276 PolarHBondContact O-N 2.61Å
275	Y	37.3	Very low	40.4	Very low	223 Å²	223	125.9 Å²	125.9	88%	0.875	62%	0.622	S	S	*	*			trans	-71.9	72.8	148.3	23.8	-101.1	0	0	0	108.3	Q273 L277	Q273-Y275 PolarHBondContact O-N 3.1Å; Q273-Y275 VanDerWaalsContact O-N 3.16Å; Y275-L277 PolarHBondContact O-N 3.21Å
276	T	29.2	Very low	38.4	Very low	96 Å²	96	123 Å²	123	59%	0.589	61%	0.61	S	S	*	*			trans	-72.6	105.2	159.2	37.2	0	0	0	0	107.3	S274 Q278	S274-T276 PolarHBondContact O-N 2.61Å; T276-Q278 PolarHBondContact O-N 2.83Å
277	L	34	Very low	36.6	Very low	165 Å²	165	118.2 Å²	118.2	86%	0.864	60%	0.596	S	S	*	*			trans	-55.2	96	146.1	-107	153	0	0	0	106.2	Y275 V279	Y275-L277 PolarHBondContact O-N 3.21Å; L277-V279 VanDerWaalsContact C-N 3.27Å; L277-V279 PolarHBondContact O-N 3.5Å
278	Q	30.1	Very low	35.2	Very low	148 Å²	148	124.9 Å²	124.9	69%	0.692	62%	0.616	S	S	*	*			trans	-68.6	96.4	163.8	-76.4	-176.4	-94	0	0	106	T276 H280	T276-Q278 PolarHBondContact O-N 2.83Å; Q278-H280 VanDerWaalsContact C-N 3.34Å; Q278-H280 PolarHBondContact O-N 2.9Å
279	V	30.1	Very low	33.9	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.715	63%	0.628	S	S	*	*			trans	-61.9	105.1	156.6	179.2	0	0	0	0	105.3	L277 E281	L277-V279 VanDerWaalsContact C-N 3.27Å; L277-V279 PolarHBondContact O-N 3.5Å; V279-E281 HydrophobicContact CG1-CG 4.44Å; V279-E281 PolarHBondContact O-N 3.49Å
280	H	27.4	Very low	33	Very low	107 Å²	107	132.2 Å²	132.2	50%	0.495	65%	0.647	S	S	.	*			trans	-68.3	99.1	168.9	-96.7	-83.8	0	0	0	107.7	Q278 E282	Q278-H280 VanDerWaalsContact C-N 3.34Å; Q278-H280 PolarHBondContact O-N 2.9Å; H280-E282 IonicContact CE1-OE2 2.9Å; H280-E282 PolarHBondContact CE1-OE2 2.95Å; H280-E282 IonicContact ND1-OE2 3.62Å; H280-E282 PolarHBondContact ND1-OE2 3.17Å; H280-E282 PolarHBondContact O-N 3.08Å
281	E	31.1	Very low	32.4	Very low	189 Å²	189	132.6 Å²	132.6	88%	0.883	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	28.2	162.1	-78	-174.6	131	0	0	112.1	V279	V279-E281 HydrophobicContact CG1-CG 4.44Å; V279-E281 PolarHBondContact O-N 3.49Å
282	E	29.8	Very low	32	Very low	137 Å²	137	129.1 Å²	129.1	64%	0.64	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-10.6	173.5	-71.8	-179.2	130	0	0	112.6	H280 Q284	H280-E282 IonicContact CE1-OE2 2.9Å; H280-E282 PolarHBondContact CE1-OE2 2.95Å; H280-E282 IonicContact ND1-OE2 3.62Å; H280-E282 PolarHBondContact ND1-OE2 3.17Å; H280-E282 PolarHBondContact O-N 3.08Å; E282-Q284 PolarHBondContact O-N 3.13Å; E282-Q284 VanDerWaalsContact O-N 3.16Å
283	D	29	Very low	31.6	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	26	-179.3	-76.7	-31.8	0	0	0	114.6
284	Q	30.8	Very low	31.4	Very low	152 Å²	152	128.8 Å²	128.8	71%	0.71	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	-2.8	168	-77.9	-167.2	-64.2	0	0	114.7	E282 R784	E282-Q284 PolarHBondContact O-N 3.13Å; E282-Q284 VanDerWaalsContact O-N 3.16Å; Q284-R784 VanDerWaalsContact NE2-NH2 3.16Å
285	D	30.5	Very low	31.4	Very low	133 Å²	133	128.4 Å²	128.4	71%	0.711	66%	0.663	S	S	*	*	S	Bend	trans	-96.6	7.6	-176.9	-110.3	-11.9	0	0	0	114.5
286	V	34.9	Very low	31.4	Very low	54 Å²	54	127.8 Å²	127.8	33%	0.327	67%	0.668	S	S	.	*			trans	-118.3	47.6	-172.4	-142	0	0	0	0	115.1	R511 V515	V286-R511 HydrophobicContact CG1-CB 4.41Å; V286-V515 HydrophobicContact CB-CG2 3.92Å; V286-V515 HydrophobicContact CG1-CG2 3.37Å
287	E	31.2	Very low	32	Very low	101 Å²	101	129.8 Å²	129.8	47%	0.472	67%	0.67	S	S	.	*	S	Bend	trans	-135.2	130.4	150.6	-87	-146.3	120.5	0	0	114.7	V515	E287-V515 HydrophobicContact CG-CG1 4.49Å
288	R	36.8	Very low	32.6	Very low	161 Å²	161	125.3 Å²	125.3	61%	0.608	65%	0.653	S	S	*	*			trans	59.4	72.7	149.8	-58	175	-161	-146	0.6	117.3	Q290	R288-Q290 PolarHBondContact O-N 3.16Å
289	S	30.3	Very low	33.9	Very low	53 Å²	53	119.6 Å²	119.6	37%	0.371	63%	0.628	S	S	.	*			trans	-69.1	78.2	153.6	-67.9	0	0	0	0	111.9	R432 N508	S289-R432 PolarHBondContact OG-NH2 3.31Å; S289-N508 WeakPolarHBondContact CB-OD1 3.45Å; S289-N508 PolarHBondContact OG-OD1 3.09Å
290	Q	31.6	Very low	35.3	Very low	146 Å²	146	118.8 Å²	118.8	68%	0.682	61%	0.613	S	S	*	*			trans	-112.6	102.4	150.1	-89.3	-176.9	-32.6	0	0	107.6	R288	R288-Q290 PolarHBondContact O-N 3.16Å
291	V	32.8	Very low	36.8	Very low	85 Å²	85	122 Å²	122	52%	0.515	62%	0.62	S	S	.	*			trans	-121.7	122.2	155.6	176.8	0	0	0	0	105.2
292	Q	30.7	Very low	38.3	Very low	170 Å²	170	117.8 Å²	117.8	79%	0.794	60%	0.604	S	S	*	*			trans	-60.2	141.1	-177.5	-74.9	163.1	-57.2	0	0	110.6	T294	Q292-T294 PolarHBondContact O-N 2.85Å
293	S	30.6	Very low	40.3	Very low	129 Å²	129	113.9 Å²	113.9	90%	0.902	59%	0.585	S	S	*	*			trans	-74.8	74.1	169.8	56.5	0	0	0	0	110
294	T	30.1	Very low	42.3	Very low	119 Å²	119	109.7 Å²	109.7	73%	0.73	57%	0.574	S	S	*	*			trans	-80.1	129.3	178.8	-39.9	0	0	0	0	110.3	Q292	Q292-T294 PolarHBondContact O-N 2.85Å
295	A	30.9	Very low	44.4	Very low	74 Å²	74	110.7 Å²	110.7	61%	0.612	57%	0.571	S	S	*	*			trans	57.1	110.4	168.3	0	0	0	0	0	118.5	Q297	A295-Q297 HydrophobicContact CB-CG 4.38Å; A295-Q297 PolarHBondContact O-N 2.94Å
296	Q	37.9	Very low	46.4	Very low	209 Å²	209	105.5 Å²	105.5	98%	0.977	54%	0.542	S	S	*	.			trans	-73.8	61.5	169.1	-170.3	168.3	-24.6	0	0	111.8
297	Q	40.5	Very low	48.2	Very low	138 Å²	138	106.5 Å²	106.5	65%	0.645	55%	0.546	S	S	*	.			trans	-97.6	141.5	172.3	-66.5	-166.9	7.2	0	0	111.2	A295 T299	A295-Q297 HydrophobicContact CB-CG 4.38Å; A295-Q297 PolarHBondContact O-N 2.94Å; Q297-T299 PolarHBondContact O-N 2.82Å
298	S	48.6	Very low	50.4	Low	72 Å²	72	111.1 Å²	111.1	50%	0.503	56%	0.559	S	S	.	*			trans	-62	122.9	177.4	176.2	0	0	0	0	110.2	W300 R301	S298-W300 PolarHBondContact O-N 3.32Å; S298-R301 PolarHBondContact O-N 3.09Å
299	T	56.1	Low	52.2	Low	28 Å²	28	107.5 Å²	107.5	17%	0.172	55%	0.551	C	S	.	*	T	Hydrogen-bonded Turn	trans	-57.6	-17.9	-179.1	-33.4	0	0	0	0	113.2	Q297 Q616 F619 I620	Q297-T299 PolarHBondContact O-N 2.82Å; T299-Q616 HydrophobicContact CG2-CB 4.29Å; T299-Q616 HydrophobicContact CG2-CG 4.27Å; T299-F619 HydrophobicContact CG2-CB 3.8Å; T299-F619 HydrophobicContact CG2-CD2 4.49Å; T299-F619 HydrophobicContact CG2-CG 4.48Å; T299-I620 HydrophobicContact CG2-CG1 4.45Å
300	W	60.8	Low	54.1	Low	101 Å²	101	105.4 Å²	105.4	38%	0.383	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-8.5	179.4	-63.6	104.7	0	0	0	114.6	S298 D302 F303 Y612 I615	S298-W300 PolarHBondContact O-N 3.32Å; W300-D302 PolarHBondContact O-N 3.4Å; W300-F303 HydrophobicContact CE3-CB 4.42Å; W300-F303 AromaticContact CE3-CD2 3.63Å; W300-F303 HydrophobicContact CE3-CD2 3.63Å; W300-F303 HydrophobicContact CE3-CE2 4.1Å; W300-F303 HydrophobicContact CE3-CG 4.1Å; W300-F303 HydrophobicContact CH2-CE2 4.39Å; W300-F303 AromaticContact CZ3-CD2 3.53Å; W300-F303 HydrophobicContact CZ3-CD2 3.53Å; W300-F303 AromaticContact CZ3-CE2 3.48Å; W300-F303 HydrophobicContact CZ3-CE2 3.48Å; W300-F303 VanDerWaalsContact CZ3-CE2 3.48Å; W300-F303 HydrophobicContact CZ3-CG 4.25Å; W300-F303 HydrophobicContact CZ3-CZ 4.18Å; W300-F303 PolarHBondContact O-N 3.2Å; W300-Y612 AromaticContact CE2-CE2 3.95Å; W300-Y612 HydrophobicContact CZ2-CD2 4.02Å; W300-Y612 AromaticContact CZ2-CE2 3.51Å; W300-Y612 HydrophobicContact CZ2-CE2 3.51Å; W300-Y612 AromaticContact NE1-CE2 3.8Å; W300-Y612 AromaticContact NE1-CZ 3.84Å; W300-Y612 PolarHBondContact NE1-OH 3.15Å; W300-I615 HydrophobicContact CH2-CG2 4.38Å
301	R	58.2	Low	56.1	Low	173 Å²	173	101.4 Å²	101.4	65%	0.653	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	138.1	168.6	-96.4	-177.4	169.6	158.9	-2.3	109.3	S298 F303	S298-R301 PolarHBondContact O-N 3.09Å; R301-F303 PolarHBondContact O-N 2.89Å; R301-F303 VanDerWaalsContact O-N 3.12Å
302	D	63.3	Low	58	Low	101 Å²	101	98.9 Å²	98.9	54%	0.54	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	21.9	-178.9	-64.6	-6.3	0	0	0	116.1	W300 G304 R305 K306	W300-D302 PolarHBondContact O-N 3.4Å; D302-G304 PolarHBondContact O-N 3.43Å; D302-G304 VanDerWaalsContact O-N 3.1Å; D302-R305 HydrophobicContact CB-CB 4.21Å; D302-R305 WeakPolarHBondContact O-CA 3.37Å; D302-R305 WeakPolarHBondContact O-CB 3.22Å; D302-R305 PolarHBondContact O-N 3Å; D302-K306 PolarHBondContact O-N 2.95Å
303	F	69.9	Low	59.9	Low	56 Å²	56	93.4 Å²	93.4	25%	0.246	49%	0.487	C	S	.	.	H	α-helix	trans	-48.5	-42.1	177	178.7	-92.7	0	0	0	112.7	W300 R301 R305 K306 L307 L448 F619	W300-F303 HydrophobicContact CE3-CB 4.42Å; W300-F303 AromaticContact CE3-CD2 3.63Å; W300-F303 HydrophobicContact CE3-CD2 3.63Å; W300-F303 HydrophobicContact CE3-CE2 4.1Å; W300-F303 HydrophobicContact CE3-CG 4.1Å; W300-F303 HydrophobicContact CH2-CE2 4.39Å; W300-F303 AromaticContact CZ3-CD2 3.53Å; W300-F303 HydrophobicContact CZ3-CD2 3.53Å; W300-F303 AromaticContact CZ3-CE2 3.48Å; W300-F303 HydrophobicContact CZ3-CE2 3.48Å; W300-F303 VanDerWaalsContact CZ3-CE2 3.48Å; W300-F303 HydrophobicContact CZ3-CG 4.25Å; W300-F303 HydrophobicContact CZ3-CZ 4.18Å; W300-F303 PolarHBondContact O-N 3.2Å; R301-F303 PolarHBondContact O-N 2.89Å; R301-F303 VanDerWaalsContact O-N 3.12Å; F303-R305 PolarHBondContact O-N 3.42Å; F303-K306 PolarHBondContact O-N 3.42Å; F303-L307 HydrophobicContact CE1-CD2 4.21Å; F303-L307 HydrophobicContact CZ-CD1 4.26Å; F303-L307 WeakPolarHBondContact O-CB 3.45Å; F303-L307 PolarHBondContact O-N 3.48Å; F303-L448 HydrophobicContact CZ-CD1 4.38Å; F303-F619 HydrophobicContact CD2-CE1 4.44Å; F303-F619 AromaticContact CD2-CE2 3.68Å; F303-F619 HydrophobicContact CD2-CE2 3.68Å; F303-F619 AromaticContact CD2-CZ 3.45Å; F303-F619 HydrophobicContact CD2-CZ 3.45Å; F303-F619 VanDerWaalsContact CD2-CZ 3.45Å; F303-F619 AromaticContact CE2-CE2 3.58Å; F303-F619 HydrophobicContact CE2-CE2 3.58Å; F303-F619 AromaticContact CE2-CZ 3.41Å; F303-F619 HydrophobicContact CE2-CZ 3.41Å; F303-F619 VanDerWaalsContact CE2-CZ 3.41Å
304	G	71.6	Confident	61.8	Low	49 Å²	49	89.4 Å²	89.4	51%	0.505	46%	0.456	S	S	.	.	H	α-helix	trans	-64.9	-32.8	176.8	0	0	0	0	0	114.5	D302 R308	D302-G304 PolarHBondContact O-N 3.43Å; D302-G304 VanDerWaalsContact O-N 3.1Å; G304-R308 WeakPolarHBondContact O-CB 3.41Å; G304-R308 PolarHBondContact O-N 3.09Å; G304-R308 VanDerWaalsContact O-N 3.1Å
305	R	74.8	Confident	64.2	Low	173 Å²	173	88.9 Å²	88.9	65%	0.653	44%	0.44	S	S	*	.	H	α-helix	trans	-72.8	-44.4	173.5	-174.4	-177.8	-179.6	-176.9	1.3	110.3	D302 F303 L307 R308 L309	D302-R305 HydrophobicContact CB-CB 4.21Å; D302-R305 WeakPolarHBondContact O-CA 3.37Å; D302-R305 WeakPolarHBondContact O-CB 3.22Å; D302-R305 PolarHBondContact O-N 3Å; F303-R305 PolarHBondContact O-N 3.42Å; R305-L307 PolarHBondContact O-N 3.19Å; R305-R308 PolarHBondContact O-N 3.45Å; R305-L309 WeakPolarHBondContact O-CG 3.36Å; R305-L309 PolarHBondContact O-N 3.17Å
306	K	73.5	Confident	66.4	Low	23 Å²	23	85.4 Å²	85.4	10%	0.1	41%	0.411	C	S	.	.	H	α-helix	trans	-60.4	-44.6	176.7	-64	-178.3	179.5	-176	0	111.1	D302 F303 R308 L309 L310 F619 M622 E623	D302-K306 PolarHBondContact O-N 2.95Å; F303-K306 PolarHBondContact O-N 3.42Å; K306-R308 PolarHBondContact O-N 3.42Å; K306-L309 PolarHBondContact O-N 3.26Å; K306-L310 WeakPolarHBondContact O-CG 3.25Å; K306-L310 PolarHBondContact O-N 2.89Å; K306-F619 HydrophobicContact CB-CD1 4.42Å; K306-F619 HydrophobicContact CB-CE1 3.82Å; K306-F619 HydrophobicContact CD-CD1 3.91Å; K306-F619 HydrophobicContact CD-CE1 4.09Å; K306-M622 HydrophobicContact CB-CE 4.24Å; K306-M622 HydrophobicContact CD-CE 4.47Å; K306-M622 HydrophobicContact CG-CE 4.48Å; K306-E623 WeakPolarHBondContact CE-OE1 3.46Å; K306-E623 IonicContact NZ-OE1 3.92Å; K306-E623 PolarHBondContact NZ-OE1 3.36Å; K306-E623 IonicContact NZ-OE2 3.44Å; K306-E623 PolarHBondContact NZ-OE2 3.38Å
307	L	72.2	Confident	68	Low	76 Å²	76	84 Å²	84	40%	0.398	40%	0.398	S	S	.	.	H	α-helix	trans	-65.4	-36.6	175.7	-157.5	77.2	0	0	0	113	F303 R305 L310 S311 L448	F303-L307 HydrophobicContact CE1-CD2 4.21Å; F303-L307 HydrophobicContact CZ-CD1 4.26Å; F303-L307 WeakPolarHBondContact O-CB 3.45Å; F303-L307 PolarHBondContact O-N 3.48Å; R305-L307 PolarHBondContact O-N 3.19Å; L307-L310 PolarHBondContact O-N 3.44Å; L307-S311 PolarHBondContact O-N 2.84Å; L307-L448 HydrophobicContact CD1-CD1 3.71Å
308	R	78	Confident	69.7	Low	197 Å²	197	81.3 Å²	81.3	74%	0.743	41%	0.407	S	S	*	.	H	α-helix	trans	-67.6	-35.2	174.8	-171.3	-175.4	-62.2	171.8	0.4	112.6	G304 R305 K306 S311	G304-R308 WeakPolarHBondContact O-CB 3.41Å; G304-R308 PolarHBondContact O-N 3.09Å; G304-R308 VanDerWaalsContact O-N 3.1Å; R305-R308 PolarHBondContact O-N 3.45Å; K306-R308 PolarHBondContact O-N 3.42Å; R308-S311 PolarHBondContact O-OG 2.69Å
309	L	73.3	Confident	71.4	Confident	86 Å²	86	79.3 Å²	79.3	45%	0.45	39%	0.393	S	S	.	.	H	α-helix	trans	-65.4	-46.8	172.3	-70.5	167.8	0	0	0	110.4	R305 K306 S311 G312 Y313	R305-L309 WeakPolarHBondContact O-CG 3.36Å; R305-L309 PolarHBondContact O-N 3.17Å; K306-L309 PolarHBondContact O-N 3.26Å; L309-S311 VanDerWaalsContact C-N 3.33Å; L309-S311 PolarHBondContact O-N 3.49Å; L309-G312 PolarHBondContact O-N 3.28Å; L309-Y313 VanDerWaalsContact O-CD2 3.28Å; L309-Y313 WeakPolarHBondContact O-CD2 3.47Å
310	L	71.4	Confident	72.9	Confident	9 Å²	9	83 Å²	83	5%	0.047	42%	0.417	C	S	.	.	H	α-helix	trans	-58.9	-38.4	177.4	-74.7	162	0	0	0	113.3	K306 L307 G312 Y313 L314 V441 L444 M622	K306-L310 WeakPolarHBondContact O-CG 3.25Å; K306-L310 PolarHBondContact O-N 2.89Å; L307-L310 PolarHBondContact O-N 3.44Å; L310-G312 PolarHBondContact O-N 3.32Å; L310-G312 VanDerWaalsContact O-N 3.14Å; L310-Y313 PolarHBondContact O-N 3.11Å; L310-L314 WeakPolarHBondContact O-CB 3.36Å; L310-L314 PolarHBondContact O-N 2.89Å; L310-V441 HydrophobicContact CD2-CG1 4.01Å; L310-V441 HydrophobicContact CD2-CG2 4.48Å; L310-L444 HydrophobicContact CD1-CD2 3.42Å; L310-L444 VanDerWaalsContact CD1-CD2 3.42Å; L310-M622 HydrophobicContact CD1-SD 4.01Å; L310-M622 HydrophobicContact CD2-SD 3.75Å; L310-M622 HydrophobicContact CG-SD 4.01Å
311	S	72.3	Confident	74.3	Confident	62 Å²	62	81.4 Å²	81.4	43%	0.434	43%	0.425	S	S	.	.	H	α-helix	trans	-59	-27.2	179.1	75.9	0	0	0	0	113.4	L307 R308 L309 L314 W315	L307-S311 PolarHBondContact O-N 2.84Å; R308-S311 PolarHBondContact O-OG 2.69Å; L309-S311 VanDerWaalsContact C-N 3.33Å; L309-S311 PolarHBondContact O-N 3.49Å; S311-L314 WeakPolarHBondContact O-CB 3.43Å; S311-W315 PolarHBondContact O-N 2.84Å
312	G	73.1	Confident	75.7	Confident	32 Å²	32	74.7 Å²	74.7	33%	0.33	40%	0.402	S	S	.	.	H	α-helix	trans	-70.5	-25.8	173.6	0	0	0	0	0	115	L309 L310	L309-G312 PolarHBondContact O-N 3.28Å; L310-G312 PolarHBondContact O-N 3.32Å; L310-G312 VanDerWaalsContact O-N 3.14Å
313	Y	71.9	Confident	77	Confident	55 Å²	55	72.1 Å²	72.1	22%	0.216	39%	0.387	C	S	.	.	H	α-helix	trans	-93.4	-22	175.7	-63.3	-84.8	0	0	0	112.8	L309 L310 T402 V406 R409 F626	L309-Y313 VanDerWaalsContact O-CD2 3.28Å; L309-Y313 WeakPolarHBondContact O-CD2 3.47Å; L310-Y313 PolarHBondContact O-N 3.11Å; Y313-T402 WeakPolarHBondContact O-CG2 3.45Å; Y313-T402 PolarHBondContact O-OG1 3.35Å; Y313-T402 VanDerWaalsContact O-OG1 3.11Å; Y313-V406 HydrophobicContact CD1-CG2 3.75Å; Y313-V406 HydrophobicContact CE1-CG2 4.11Å; Y313-R409 PolarHBondContact OH-NH1 2.94Å; Y313-F626 HydrophobicContact CE2-CE1 4.22Å; Y313-F626 HydrophobicContact CE2-CZ 4.01Å
314	L	68.9	Low	78	Confident	45 Å²	45	74.5 Å²	74.5	24%	0.236	40%	0.401	C	S	.	.	H	α-helix	trans	-65.9	-37	175.2	-136	165.7	0	0	0	112.4	L310 S311 P316 W395 L445	L310-L314 WeakPolarHBondContact O-CB 3.36Å; L310-L314 PolarHBondContact O-N 2.89Å; S311-L314 WeakPolarHBondContact O-CB 3.43Å; L314-P316 WeakPolarHBondContact O-CD 3.41Å; L314-W395 HydrophobicContact CD2-CH2 4.13Å; L314-L445 HydrophobicContact CD1-CD1 3.38Å; L314-L445 HydrophobicContact CD2-CD1 3.9Å; L314-L445 HydrophobicContact CD2-CD2 4.34Å; L314-L445 HydrophobicContact CG-CD1 3.35Å; L314-L445 HydrophobicContact CG-CD2 3.85Å; L314-L445 HydrophobicContact CG-CG 4.24Å
315	W	80.4	Confident	79	Confident	107 Å²	107	73.3 Å²	73.3	41%	0.405	38%	0.384	S	S	.	.	S	Bend	trans	-92.8	111.6	-178.9	-166.7	-92.2	0	0	0	110.7	S311 R317 Q323	S311-W315 PolarHBondContact O-N 2.84Å; W315-R317 VanDerWaalsContact C-N 3.33Å; W315-R317 PolarHBondContact O-N 3.06Å; W315-Q323 HydrophobicContact CD2-CG 4.47Å; W315-Q323 HydrophobicContact CH2-CB 4.33Å; W315-Q323 HydrophobicContact CZ2-CB 3.87Å; W315-Q323 HydrophobicContact CZ2-CG 3.79Å; W315-Q323 VanDerWaalsContact NE1-CD 3.27Å
316	P	77.3	Confident	79.8	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	36%	0.355	C	S	.	.			trans	-70.3	87.5	179.8	27.3	-32.7	0	0	0	110.8	L314 G318 L322 Q323 V326 F401	L314-P316 WeakPolarHBondContact O-CD 3.41Å; P316-G318 PolarHBondContact O-N 3.48Å; P316-L322 HydrophobicContact CB-CB 3.86Å; P316-L322 HydrophobicContact CB-CD1 4.18Å; P316-L322 HydrophobicContact CG-CB 3.56Å; P316-Q323 HydrophobicContact CG-CG 4.01Å; P316-Q323 PolarHBondContact O-NE2 2.96Å; P316-V326 HydrophobicContact CG-CG2 4.36Å; P316-F401 HydrophobicContact CB-CD1 3.85Å; P316-F401 HydrophobicContact CB-CE1 3.69Å; P316-F401 HydrophobicContact CB-CZ 4.42Å
317	R	72.7	Confident	80.6	Confident	181 Å²	181	68.8 Å²	68.8	68%	0.683	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	127.4	173.1	-65.4	-178.2	-178.1	178	0.5	109.3	W315	W315-R317 VanDerWaalsContact C-N 3.33Å; W315-R317 PolarHBondContact O-N 3.06Å
318	G	75.3	Confident	81.6	Confident	81 Å²	81	68.7 Å²	68.7	84%	0.835	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.6	-7.1	177.2	0	0	0	0	0	116.5	P316	P316-G318 PolarHBondContact O-N 3.48Å
319	S	84.6	Confident	82.3	Confident	30 Å²	30	59.4 Å²	59.4	21%	0.21	34%	0.338	C	S	.	.			trans	-141.6	115	171.6	59	0	0	0	0	113	A321 L322 Q323	S319-A321 VanDerWaalsContact C-N 3.27Å; S319-A321 PolarHBondContact O-N 2.75Å; S319-L322 PolarHBondContact O-N 3.17Å; S319-L322 WeakPolarHBondContact OG-CD1 3.34Å; S319-L322 WeakPolarHBondContact OG-CG 3.46Å; S319-Q323 WeakPolarHBondContact O-CG 3.33Å; S319-Q323 PolarHBondContact O-N 2.94Å
320	P	87.4	Confident	83.1	Confident	106 Å²	106	59 Å²	59	69%	0.688	34%	0.336	S	S	*	.	H	α-helix	trans	-67.5	-28.7	-178.5	26.8	-33.9	0	0	0	112.3	L322 Q323 L324	P320-L322 PolarHBondContact O-N 3.25Å; P320-Q323 PolarHBondContact O-N 2.86Å; P320-L324 PolarHBondContact O-N 2.94Å
321	A	89.4	Confident	84.2	Confident	66 Å²	66	60.8 Å²	60.8	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-41.5	176.4	0	0	0	0	0	112.8	S319 L324 V325	S319-A321 VanDerWaalsContact C-N 3.27Å; S319-A321 PolarHBondContact O-N 2.75Å; A321-L324 PolarHBondContact O-N 2.77Å; A321-V325 WeakPolarHBondContact O-CG2 3.17Å; A321-V325 PolarHBondContact O-N 3.11Å; A321-V325 VanDerWaalsContact O-N 3.1Å
322	L	88.6	Confident	85.1	Confident	32 Å²	32	59 Å²	59	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-72.7	-32	176.3	-65.8	-176.6	0	0	0	112	P316 S319 P320 V325 V326 R397 F401	P316-L322 HydrophobicContact CB-CB 3.86Å; P316-L322 HydrophobicContact CB-CD1 4.18Å; P316-L322 HydrophobicContact CG-CB 3.56Å; S319-L322 PolarHBondContact O-N 3.17Å; S319-L322 WeakPolarHBondContact OG-CD1 3.34Å; S319-L322 WeakPolarHBondContact OG-CG 3.46Å; P320-L322 PolarHBondContact O-N 3.25Å; L322-V325 PolarHBondContact O-N 2.92Å; L322-V326 WeakPolarHBondContact O-CG2 3.46Å; L322-V326 PolarHBondContact O-N 3.42Å; L322-R397 HydrophobicContact CD2-CB 4.49Å; L322-F401 HydrophobicContact CD1-CB 3.84Å; L322-F401 HydrophobicContact CD1-CD1 4.17Å; L322-F401 HydrophobicContact CD1-CD2 3.56Å; L322-F401 HydrophobicContact CD1-CE2 4.14Å; L322-F401 HydrophobicContact CD1-CG 3.58Å
323	Q	90.6	Very high	85.9	Confident	47 Å²	47	59.1 Å²	59.1	22%	0.22	34%	0.335	C	S	.	.	H	α-helix	trans	-64.8	-42.4	174	-64.2	171.2	10.1	0	0	111.1	W315 P316 S319 P320 V325 V326 L327	W315-Q323 HydrophobicContact CD2-CG 4.47Å; W315-Q323 HydrophobicContact CH2-CB 4.33Å; W315-Q323 HydrophobicContact CZ2-CB 3.87Å; W315-Q323 HydrophobicContact CZ2-CG 3.79Å; W315-Q323 VanDerWaalsContact NE1-CD 3.27Å; P316-Q323 HydrophobicContact CG-CG 4.01Å; P316-Q323 PolarHBondContact O-NE2 2.96Å; S319-Q323 WeakPolarHBondContact O-CG 3.33Å; S319-Q323 PolarHBondContact O-N 2.94Å; P320-Q323 PolarHBondContact O-N 2.86Å; Q323-V325 VanDerWaalsContact C-N 3.33Å; Q323-V325 PolarHBondContact O-N 3.22Å; Q323-V326 PolarHBondContact O-N 2.95Å; Q323-L327 WeakPolarHBondContact O-CG 3.29Å; Q323-L327 PolarHBondContact O-N 2.96Å
324	L	91.6	Very high	86.9	Confident	106 Å²	106	58.5 Å²	58.5	56%	0.555	35%	0.345	S	S	*	.	H	α-helix	trans	-60.4	-41.6	172.3	-175.4	67	0	0	0	111.8	P320 A321 V326 L327 I328	P320-L324 PolarHBondContact O-N 2.94Å; A321-L324 PolarHBondContact O-N 2.77Å; L324-V326 VanDerWaalsContact C-N 3.35Å; L324-V326 PolarHBondContact O-N 3.12Å; L324-L327 PolarHBondContact O-N 3.35Å; L324-I328 HydrophobicContact CG-CD1 4.02Å; L324-I328 VanDerWaalsContact O-CG1 3.3Å; L324-I328 WeakPolarHBondContact O-CG1 3.31Å; L324-I328 PolarHBondContact O-N 2.73Å
325	V	91.7	Very high	88	Confident	25 Å²	25	60.1 Å²	60.1	15%	0.152	35%	0.354	C	S	.	.	H	α-helix	trans	-61.1	-41.2	174.9	171	0	0	0	0	111.8	A321 L322 Q323 I328 C329 L394 V398	A321-V325 WeakPolarHBondContact O-CG2 3.17Å; A321-V325 PolarHBondContact O-N 3.11Å; A321-V325 VanDerWaalsContact O-N 3.1Å; L322-V325 PolarHBondContact O-N 2.92Å; Q323-V325 VanDerWaalsContact C-N 3.33Å; Q323-V325 PolarHBondContact O-N 3.22Å; V325-I328 PolarHBondContact O-N 3.01Å; V325-C329 PolarHBondContact O-N 2.9Å; V325-C329 PolarHBondContact O-SG 3Å; V325-C329 VanDerWaalsContact O-SG 3.37Å; V325-L394 HydrophobicContact CG1-CB 4.06Å; V325-L394 WeakPolarHBondContact CG1-O 3.26Å; V325-V398 HydrophobicContact CG1-CG2 3.9Å
326	V	90.8	Very high	88.4	Confident	6 Å²	6	56.2 Å²	56.2	4%	0.036	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-44.6	174.2	172.9	0	0	0	0	111.3	P316 L322 Q323 L324 I328 C329 L330 W395 V398	P316-V326 HydrophobicContact CG-CG2 4.36Å; L322-V326 WeakPolarHBondContact O-CG2 3.46Å; L322-V326 PolarHBondContact O-N 3.42Å; Q323-V326 PolarHBondContact O-N 2.95Å; L324-V326 VanDerWaalsContact C-N 3.35Å; L324-V326 PolarHBondContact O-N 3.12Å; V326-I328 PolarHBondContact O-N 3.35Å; V326-C329 PolarHBondContact O-N 3.38Å; V326-L330 HydrophobicContact CG1-CD1 4.33Å; V326-L330 WeakPolarHBondContact O-CG 3.42Å; V326-L330 PolarHBondContact O-N 3.44Å; V326-W395 HydrophobicContact CG2-CZ3 4.39Å; V326-V398 HydrophobicContact CG2-CB 4.47Å; V326-V398 HydrophobicContact CG2-CG1 3.79Å; V326-V398 HydrophobicContact CG2-CG2 3.82Å
327	L	91.5	Very high	89	Confident	94 Å²	94	57.5 Å²	57.5	49%	0.492	34%	0.344	S	S	.	.	H	α-helix	trans	-62.5	-40.7	176.4	-67	173.5	0	0	0	112.2	Q323 L324 L330 G331	Q323-L327 WeakPolarHBondContact O-CG 3.29Å; Q323-L327 PolarHBondContact O-N 2.96Å; L324-L327 PolarHBondContact O-N 3.35Å; L327-L330 PolarHBondContact O-N 3.42Å; L327-G331 PolarHBondContact O-N 2.92Å
328	I	93.8	Very high	89.9	Confident	75 Å²	75	51 Å²	51	39%	0.385	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-43.6	173.8	-67.7	164.2	0	0	0	110.5	L324 V325 V326 L330 G331 L332 L394	L324-I328 HydrophobicContact CG-CD1 4.02Å; L324-I328 VanDerWaalsContact O-CG1 3.3Å; L324-I328 WeakPolarHBondContact O-CG1 3.31Å; L324-I328 PolarHBondContact O-N 2.73Å; V325-I328 PolarHBondContact O-N 3.01Å; V326-I328 PolarHBondContact O-N 3.35Å; I328-L330 VanDerWaalsContact C-N 3.32Å; I328-L330 PolarHBondContact O-N 2.92Å; I328-G331 PolarHBondContact O-N 3.19Å; I328-L332 HydrophobicContact CG2-CD1 4.04Å; I328-L332 HydrophobicContact CG2-CG 4.27Å; I328-L332 WeakPolarHBondContact O-CB 3.45Å; I328-L332 WeakPolarHBondContact O-CG 3.27Å; I328-L332 PolarHBondContact O-N 2.8Å; I328-L394 HydrophobicContact CG2-CD1 3.68Å
329	C	92.1	Very high	90.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.007	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-37.9	176.5	-73.6	0	0	0	0	112.8	V325 V326 M333 R391 L394	V325-C329 PolarHBondContact O-N 2.9Å; V325-C329 PolarHBondContact O-SG 3Å; V325-C329 VanDerWaalsContact O-SG 3.37Å; V326-C329 PolarHBondContact O-N 3.38Å; C329-M333 WeakPolarHBondContact O-CB 3.38Å; C329-M333 PolarHBondContact O-N 3.37Å; C329-R391 HydrophobicContact CB-CG 4.21Å; C329-R391 WeakPolarHBondContact O-CD 3.39Å; C329-L394 VanDerWaalsContact SG-CB 3.59Å
330	L	90.7	Very high	90.8	Very high	77 Å²	77	46.7 Å²	46.7	40%	0.403	29%	0.285	S	S	.	.	H	α-helix	trans	-68.5	-39.5	173.6	-67.9	172.2	0	0	0	111.9	V326 L327 I328 M333 G334	V326-L330 HydrophobicContact CG1-CD1 4.33Å; V326-L330 WeakPolarHBondContact O-CG 3.42Å; V326-L330 PolarHBondContact O-N 3.44Å; L327-L330 PolarHBondContact O-N 3.42Å; I328-L330 VanDerWaalsContact C-N 3.32Å; I328-L330 PolarHBondContact O-N 2.92Å; L330-M333 HydrophobicContact CD2-CE 4.16Å; L330-M333 WeakPolarHBondContact O-CB 3.31Å; L330-M333 PolarHBondContact O-N 3.27Å; L330-G334 PolarHBondContact O-N 3.01Å
331	G	92.9	Very high	91	Very high	48 Å²	48	42.9 Å²	42.9	50%	0.495	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-45.1	173.2	0	0	0	0	0	112.8	L327 I328 M333 G334 L335	L327-G331 PolarHBondContact O-N 2.92Å; I328-G331 PolarHBondContact O-N 3.19Å; G331-M333 VanDerWaalsContact C-N 3.31Å; G331-M333 PolarHBondContact O-N 2.91Å; G331-G334 PolarHBondContact O-N 3.27Å; G331-L335 PolarHBondContact O-N 3.19Å
332	L	92.1	Very high	91.1	Very high	24 Å²	24	43.1 Å²	43.1	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-35.9	174.2	-69.3	174.6	0	0	0	112	I328 L335 E336 V387 L390 R391 L394	I328-L332 HydrophobicContact CG2-CD1 4.04Å; I328-L332 HydrophobicContact CG2-CG 4.27Å; I328-L332 WeakPolarHBondContact O-CB 3.45Å; I328-L332 WeakPolarHBondContact O-CG 3.27Å; I328-L332 PolarHBondContact O-N 2.8Å; L332-L335 HydrophobicContact CD2-CD2 4.41Å; L332-L335 PolarHBondContact O-N 3.27Å; L332-E336 WeakPolarHBondContact O-CB 3.3Å; L332-E336 PolarHBondContact O-N 2.73Å; L332-V387 HydrophobicContact CB-CG1 4.2Å; L332-V387 HydrophobicContact CD2-CG1 4.22Å; L332-V387 WeakPolarHBondContact O-CG1 3.43Å; L332-L390 HydrophobicContact CD1-CD2 4.27Å; L332-L390 HydrophobicContact CD1-CG 4.13Å; L332-L390 HydrophobicContact CD2-CD2 4.48Å; L332-R391 HydrophobicContact CB-CB 4.13Å; L332-R391 HydrophobicContact CB-CG 4.4Å; L332-R391 HydrophobicContact CD1-CB 4.09Å; L332-L394 HydrophobicContact CD1-CD1 3.87Å
333	M	90.8	Very high	91.2	Very high	35 Å²	35	41.9 Å²	41.9	17%	0.172	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-43.4	173.6	-172.4	-176.3	80.1	0	0	111.5	C329 L330 G331 E336 R337 V449 F450 P454	C329-M333 WeakPolarHBondContact O-CB 3.38Å; C329-M333 PolarHBondContact O-N 3.37Å; L330-M333 HydrophobicContact CD2-CE 4.16Å; L330-M333 WeakPolarHBondContact O-CB 3.31Å; L330-M333 PolarHBondContact O-N 3.27Å; G331-M333 VanDerWaalsContact C-N 3.31Å; G331-M333 PolarHBondContact O-N 2.91Å; M333-E336 VanDerWaalsContact O-CB 3.32Å; M333-E336 WeakPolarHBondContact O-CB 3.49Å; M333-E336 PolarHBondContact O-N 3.18Å; M333-R337 WeakPolarHBondContact O-CG 3.35Å; M333-R337 PolarHBondContact O-N 3.46Å; M333-V449 HydrophobicContact SD-CG1 4.44Å; M333-V449 VanDerWaalsContact SD-O 3.36Å; M333-F450 HydrophobicContact SD-CD1 4.46Å; M333-P454 HydrophobicContact CG-CG 4.12Å; M333-P454 HydrophobicContact SD-CG 3.72Å
334	G	91.8	Very high	91.2	Very high	41 Å²	41	39.8 Å²	39.8	42%	0.423	24%	0.236	S	C	.	.	H	α-helix	trans	-61.5	-43.9	173.3	0	0	0	0	0	112.8	L330 G331 E336 R337 A338	L330-G334 PolarHBondContact O-N 3.01Å; G331-G334 PolarHBondContact O-N 3.27Å; G334-E336 VanDerWaalsContact C-N 3.31Å; G334-E336 PolarHBondContact O-N 3.06Å; G334-R337 WeakPolarHBondContact O-CB 3.46Å; G334-R337 PolarHBondContact O-N 3.39Å; G334-R337 VanDerWaalsContact O-N 3.16Å; G334-A338 PolarHBondContact O-N 3.2Å; G334-A338 VanDerWaalsContact O-N 3.12Å
335	L	91.9	Very high	91.2	Very high	80 Å²	80	36.6 Å²	36.6	42%	0.419	22%	0.219	S	C	.	.	H	α-helix	trans	-59.7	-40.4	173.6	179.4	63	0	0	0	111.9	G331 L332 R337 A338 L339 V387	G331-L335 PolarHBondContact O-N 3.19Å; L332-L335 HydrophobicContact CD2-CD2 4.41Å; L332-L335 PolarHBondContact O-N 3.27Å; L335-R337 VanDerWaalsContact C-N 3.28Å; L335-R337 PolarHBondContact O-N 3.4Å; L335-A338 PolarHBondContact O-N 3.04Å; L335-L339 HydrophobicContact CD1-CD1 4.48Å; L335-L339 HydrophobicContact CD1-CG 4.35Å; L335-L339 HydrophobicContact CG-CD1 4.08Å; L335-L339 HydrophobicContact CG-CG 4.41Å; L335-L339 VanDerWaalsContact O-CG 3.31Å; L335-L339 WeakPolarHBondContact O-CG 3.31Å; L335-L339 PolarHBondContact O-N 3.4Å; L335-V387 HydrophobicContact CD2-CG1 4.37Å; L335-V387 HydrophobicContact CD2-CG2 4.13Å
336	E	89.5	Confident	91.2	Very high	24 Å²	24	38 Å²	38	11%	0.112	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-39.2	176	-152.1	-175.2	126.5	0	0	111.5	L332 M333 G334 N340 V387 R391	L332-E336 WeakPolarHBondContact O-CB 3.3Å; L332-E336 PolarHBondContact O-N 2.73Å; M333-E336 VanDerWaalsContact O-CB 3.32Å; M333-E336 WeakPolarHBondContact O-CB 3.49Å; M333-E336 PolarHBondContact O-N 3.18Å; G334-E336 VanDerWaalsContact C-N 3.31Å; G334-E336 PolarHBondContact O-N 3.06Å; E336-N340 PolarHBondContact O-N 2.96Å; E336-N340 VanDerWaalsContact O-N 3.08Å; E336-V387 HydrophobicContact CB-CG1 4.34Å; E336-R391 IonicContact OE1-NH2 3.18Å; E336-R391 IonicContact OE2-CZ 3.27Å; E336-R391 IonicContact OE2-NE 3.97Å; E336-R391 PolarHBondContact OE2-NE 2.98Å; E336-R391 IonicContact OE2-NH2 2.73Å; E336-R391 PolarHBondContact OE2-NH2 3.31Å
337	R	90.3	Very high	91.2	Very high	29 Å²	29	41.8 Å²	41.8	11%	0.109	24%	0.237	C	C	.	.	H	α-helix	trans	-68.9	-40.5	175.3	-54.3	-54.5	80.8	174.3	-3.7	112.3	M333 G334 L335 N340 V341 P454 D458 I461	M333-R337 WeakPolarHBondContact O-CG 3.35Å; M333-R337 PolarHBondContact O-N 3.46Å; G334-R337 WeakPolarHBondContact O-CB 3.46Å; G334-R337 PolarHBondContact O-N 3.39Å; G334-R337 VanDerWaalsContact O-N 3.16Å; L335-R337 VanDerWaalsContact C-N 3.28Å; L335-R337 PolarHBondContact O-N 3.4Å; R337-N340 PolarHBondContact NH2-ND2 2.89Å; R337-N340 WeakPolarHBondContact O-CB 3.41Å; R337-N340 PolarHBondContact O-N 3.11Å; R337-V341 PolarHBondContact O-N 3.39Å; R337-P454 VanDerWaalsContact NH1-C 3.26Å; R337-P454 PolarHBondContact NH1-O 2.97Å; R337-D458 WeakPolarHBondContact CD-OD1 3.45Å; R337-D458 IonicContact CZ-OD1 3.59Å; R337-D458 IonicContact CZ-OD2 3.34Å; R337-D458 IonicContact NE-OD1 3.58Å; R337-D458 IonicContact NH1-OD1 3.03Å; R337-D458 PolarHBondContact NH1-OD1 2.74Å; R337-D458 IonicContact NH1-OD2 3.97Å; R337-D458 PolarHBondContact NH1-OD2 2.88Å; R337-D458 IonicContact NH2-OD2 2.73Å; R337-I461 HydrophobicContact CB-CD1 4.21Å
338	A	91	Very high	91.3	Very high	45 Å²	45	40.1 Å²	40.1	37%	0.372	22%	0.224	S	C	.	.	H	α-helix	trans	-63.2	-44.9	176	0	0	0	0	0	111.6	G334 L335 N340 V341 L342	G334-A338 PolarHBondContact O-N 3.2Å; G334-A338 VanDerWaalsContact O-N 3.12Å; L335-A338 PolarHBondContact O-N 3.04Å; A338-N340 VanDerWaalsContact C-N 3.29Å; A338-N340 PolarHBondContact O-N 3.37Å; A338-V341 PolarHBondContact O-N 2.89Å; A338-V341 VanDerWaalsContact O-N 3.15Å; A338-L342 VanDerWaalsContact O-CG 3.29Å; A338-L342 WeakPolarHBondContact O-CG 3.35Å; A338-L342 PolarHBondContact O-N 2.98Å
339	L	90.8	Very high	91.2	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-38.1	175.4	-69.2	170.1	0	0	0	112.4	L335 V341 L342 V343 L373 L376 Q377 V387	L335-L339 HydrophobicContact CD1-CD1 4.48Å; L335-L339 HydrophobicContact CD1-CG 4.35Å; L335-L339 HydrophobicContact CG-CD1 4.08Å; L335-L339 HydrophobicContact CG-CG 4.41Å; L335-L339 VanDerWaalsContact O-CG 3.31Å; L335-L339 WeakPolarHBondContact O-CG 3.31Å; L335-L339 PolarHBondContact O-N 3.4Å; L339-V341 VanDerWaalsContact C-N 3.26Å; L339-V341 PolarHBondContact O-N 2.93Å; L339-L342 PolarHBondContact O-N 2.99Å; L339-V343 WeakPolarHBondContact O-CG2 3.13Å; L339-V343 PolarHBondContact O-N 2.91Å; L339-L373 HydrophobicContact CD2-CD2 3.55Å; L339-L376 HydrophobicContact CD1-CB 3.68Å; L339-L376 HydrophobicContact CD2-CB 4.16Å; L339-L376 HydrophobicContact CD2-CD1 4.16Å; L339-Q377 HydrophobicContact CB-CB 4.37Å; L339-V387 HydrophobicContact CD1-CB 4.41Å; L339-V387 HydrophobicContact CD1-CG2 3.77Å
340	N	88.3	Confident	91.1	Very high	15 Å²	15	40.1 Å²	40.1	8%	0.08	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-33.3	175.2	-83.3	-7.9	0	0	0	113.6	E336 R337 A338 P344 Q377 D458 Q600	E336-N340 PolarHBondContact O-N 2.96Å; E336-N340 VanDerWaalsContact O-N 3.08Å; R337-N340 PolarHBondContact NH2-ND2 2.89Å; R337-N340 WeakPolarHBondContact O-CB 3.41Å; R337-N340 PolarHBondContact O-N 3.11Å; A338-N340 VanDerWaalsContact C-N 3.29Å; A338-N340 PolarHBondContact O-N 3.37Å; N340-P344 VanDerWaalsContact O-CD 3.3Å; N340-P344 WeakPolarHBondContact O-CD 3.43Å; N340-Q377 PolarHBondContact OD1-NE2 3.04Å; N340-D458 PolarHBondContact ND2-OD1 3.17Å; N340-D458 VanDerWaalsContact ND2-OD1 3.12Å; N340-D458 PolarHBondContact ND2-OD2 2.68Å; N340-Q600 PolarHBondContact O-NE2 3.26Å
341	V	90.7	Very high	91.2	Very high	25 Å²	25	37.7 Å²	37.7	15%	0.152	21%	0.213	C	C	.	.	H	α-helix	trans	-82.7	-40.1	175.6	-176.8	0	0	0	0	111.1	R337 A338 L339 P344 I345 I461 Y465	R337-V341 PolarHBondContact O-N 3.39Å; A338-V341 PolarHBondContact O-N 2.89Å; A338-V341 VanDerWaalsContact O-N 3.15Å; L339-V341 VanDerWaalsContact C-N 3.26Å; L339-V341 PolarHBondContact O-N 2.93Å; V341-P344 WeakPolarHBondContact O-CD 3.22Å; V341-I345 HydrophobicContact CG1-CD1 3.86Å; V341-I345 WeakPolarHBondContact O-CD1 3.4Å; V341-I345 WeakPolarHBondContact O-CG1 3.38Å; V341-I461 HydrophobicContact CG2-CG2 3.55Å; V341-Y465 HydrophobicContact CG1-CD2 4.02Å; V341-Y465 HydrophobicContact CG1-CE2 4.2Å
342	L	91.1	Very high	91.1	Very high	71 Å²	71	35.9 Å²	35.9	37%	0.372	19%	0.192	S	C	.	.	H	α-helix	trans	-69.5	-38.7	-174	-70.2	169.6	0	0	0	113.6	A338 L339 I345 F346 L373	A338-L342 VanDerWaalsContact O-CG 3.29Å; A338-L342 WeakPolarHBondContact O-CG 3.35Å; A338-L342 PolarHBondContact O-N 2.98Å; L339-L342 PolarHBondContact O-N 2.99Å; L342-I345 PolarHBondContact O-N 3.24Å; L342-I345 VanDerWaalsContact O-N 3.16Å; L342-F346 WeakPolarHBondContact O-CD2 3.33Å; L342-F346 PolarHBondContact O-N 3.5Å; L342-L373 HydrophobicContact CB-CD1 4.48Å
343	V	91.3	Very high	91	Very high	6 Å²	6	36.2 Å²	36.2	4%	0.036	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-48.4	-175.6	169.6	0	0	0	0	112.8	L339 I345 F346 Y347 Y370 L373 K374 Q377	L339-V343 WeakPolarHBondContact O-CG2 3.13Å; L339-V343 PolarHBondContact O-N 2.91Å; V343-I345 VanDerWaalsContact C-N 3.32Å; V343-I345 PolarHBondContact O-N 2.98Å; V343-F346 PolarHBondContact O-N 3.21Å; V343-Y347 PolarHBondContact O-N 3.33Å; V343-Y347 VanDerWaalsContact O-N 3.08Å; V343-Y370 HydrophobicContact CG1-CD2 4.29Å; V343-Y370 HydrophobicContact CG1-CE2 3.7Å; V343-L373 HydrophobicContact CG2-CB 3.73Å; V343-K374 HydrophobicContact CG1-CG 4.05Å; V343-Q377 HydrophobicContact CG2-CB 4.06Å; V343-Q377 HydrophobicContact CG2-CG 4.47Å
344	P	90.7	Very high	90.9	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-35.7	172.6	-26.2	35.3	0	0	0	114.3	N340 V341 Y347 R348 L593 Y597	N340-P344 VanDerWaalsContact O-CD 3.3Å; N340-P344 WeakPolarHBondContact O-CD 3.43Å; V341-P344 WeakPolarHBondContact O-CD 3.22Å; P344-Y347 PolarHBondContact O-N 3.27Å; P344-R348 PolarHBondContact O-N 3.47Å; P344-L593 HydrophobicContact CB-CG 4.07Å; P344-Y597 HydrophobicContact CG-CD2 4.38Å; P344-Y597 HydrophobicContact CG-CG 4.22Å
345	I	91.6	Very high	90.7	Very high	38 Å²	38	41.5 Å²	41.5	20%	0.195	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-45.8	177.7	-65.4	169.9	0	0	0	111.1	V341 L342 V343 Y347 R348 N349 Y465 L593	V341-I345 HydrophobicContact CG1-CD1 3.86Å; V341-I345 WeakPolarHBondContact O-CD1 3.4Å; V341-I345 WeakPolarHBondContact O-CG1 3.38Å; L342-I345 PolarHBondContact O-N 3.24Å; L342-I345 VanDerWaalsContact O-N 3.16Å; V343-I345 VanDerWaalsContact C-N 3.32Å; V343-I345 PolarHBondContact O-N 2.98Å; I345-Y347 PolarHBondContact O-N 3.48Å; I345-R348 WeakPolarHBondContact O-CB 3.47Å; I345-R348 PolarHBondContact O-N 3.46Å; I345-N349 VanDerWaalsContact O-CG 3.24Å; I345-N349 PolarHBondContact O-N 2.82Å; I345-N349 PolarHBondContact O-OD1 3.4Å; I345-Y465 HydrophobicContact CD1-CE2 3.78Å; I345-Y465 HydrophobicContact CG1-CE2 4.42Å; I345-Y465 WeakPolarHBondContact CG1-OH 3.27Å; I345-L593 HydrophobicContact CG1-CD1 4.05Å
346	F	91.8	Very high	90.4	Very high	55 Å²	55	43.1 Å²	43.1	24%	0.241	22%	0.221	C	C	.	.	H	α-helix	trans	-64.2	-32.3	175.2	-87.4	-95.2	0	0	0	111.9	L342 V343 N349 I350 T366 Y370 L373	L342-F346 WeakPolarHBondContact O-CD2 3.33Å; L342-F346 PolarHBondContact O-N 3.5Å; V343-F346 PolarHBondContact O-N 3.21Å; F346-N349 PolarHBondContact O-N 3.39Å; F346-I350 WeakPolarHBondContact O-CG1 3.34Å; F346-I350 PolarHBondContact O-N 3.02Å; F346-I350 VanDerWaalsContact O-N 3.12Å; F346-T366 HydrophobicContact CD1-CG2 4.02Å; F346-Y370 HydrophobicContact CB-CD2 4.13Å; F346-L373 HydrophobicContact CD1-CD1 4.36Å; F346-L373 HydrophobicContact CD2-CD1 3.45Å; F346-L373 VanDerWaalsContact CD2-CD1 3.45Å; F346-L373 HydrophobicContact CE2-CD1 3.63Å; F346-L373 HydrophobicContact CG-CD1 3.85Å; F346-L373 HydrophobicContact CZ-CD1 4.16Å
347	Y	91	Very high	90.1	Very high	86 Å²	86	51.3 Å²	51.3	34%	0.337	26%	0.256	S	S	.	.	H	α-helix	trans	-68.6	-41.9	174.9	-166.8	-146.3	0	0	0	112.7	V343 P344 I345 N349 I350 V351 Y370 V592 T596	V343-Y347 PolarHBondContact O-N 3.33Å; V343-Y347 VanDerWaalsContact O-N 3.08Å; P344-Y347 PolarHBondContact O-N 3.27Å; I345-Y347 PolarHBondContact O-N 3.48Å; Y347-N349 VanDerWaalsContact C-N 3.31Å; Y347-N349 PolarHBondContact O-N 2.92Å; Y347-I350 PolarHBondContact O-N 2.96Å; Y347-V351 WeakPolarHBondContact O-CG2 3.38Å; Y347-V351 PolarHBondContact O-N 2.92Å; Y347-Y370 HydrophobicContact CD2-CE2 4.43Å; Y347-Y370 HydrophobicContact CG-CE2 4.23Å; Y347-V592 HydrophobicContact CD1-CG1 3.47Å; Y347-V592 VanDerWaalsContact CD1-CG1 3.47Å; Y347-V592 HydrophobicContact CE1-CG1 3.17Å; Y347-V592 HydrophobicContact CG-CG1 4.3Å; Y347-T596 HydrophobicContact CD1-CG2 3.82Å; Y347-T596 HydrophobicContact CE1-CG2 3.72Å
348	R	92.9	Very high	89.6	Confident	58 Å²	58	51 Å²	51	22%	0.219	26%	0.26	C	S	.	.	H	α-helix	trans	-51.9	-50	167.4	162.5	-178.8	169.4	175.1	-0.7	111.4	P344 I345 I350 V351 N352 G589 D590 L593	P344-R348 PolarHBondContact O-N 3.47Å; I345-R348 WeakPolarHBondContact O-CB 3.47Å; I345-R348 PolarHBondContact O-N 3.46Å; R348-I350 VanDerWaalsContact C-N 3.29Å; R348-I350 PolarHBondContact O-N 3.39Å; R348-V351 PolarHBondContact O-N 3.43Å; R348-V351 VanDerWaalsContact O-N 3.12Å; R348-N352 WeakPolarHBondContact CG-ND2 3.25Å; R348-N352 PolarHBondContact NE-ND2 3.32Å; R348-N352 PolarHBondContact O-N 3.05Å; R348-G589 WeakPolarHBondContact CB-O 3.45Å; R348-D590 VanDerWaalsContact CD-OD1 3.25Å; R348-D590 WeakPolarHBondContact CD-OD1 3.48Å; R348-D590 IonicContact CZ-OD1 3.06Å; R348-D590 IonicContact CZ-OD2 3.43Å; R348-D590 IonicContact NE-OD1 3.17Å; R348-D590 PolarHBondContact NE-OD1 3.48Å; R348-D590 VanDerWaalsContact NE-OD1 3.12Å; R348-D590 IonicContact NE-OD2 3.42Å; R348-D590 IonicContact NH1-OD1 2.72Å; R348-D590 PolarHBondContact NH1-OD1 3.4Å; R348-D590 IonicContact NH1-OD2 2.62Å; R348-D590 IonicContact NH2-OD1 2.66Å; R348-D590 IonicContact NH2-OD2 3.64Å; R348-L593 HydrophobicContact CB-CB 4.15Å; R348-L593 HydrophobicContact CB-CD1 3.99Å
349	N	91.3	Very high	89.4	Confident	59 Å²	59	53.3 Å²	53.3	32%	0.316	27%	0.271	S	S	.	.	H	α-helix	trans	-62.1	-38.1	-175.2	-67	-10.9	0	0	0	111.7	I345 F346 Y347 N352 L353 T366	I345-N349 VanDerWaalsContact O-CG 3.24Å; I345-N349 PolarHBondContact O-N 2.82Å; I345-N349 PolarHBondContact O-OD1 3.4Å; F346-N349 PolarHBondContact O-N 3.39Å; Y347-N349 VanDerWaalsContact C-N 3.31Å; Y347-N349 PolarHBondContact O-N 2.92Å; N349-N352 PolarHBondContact O-N 3.48Å; N349-L353 WeakPolarHBondContact O-CB 3.44Å; N349-L353 WeakPolarHBondContact O-CG 3.14Å; N349-L353 PolarHBondContact O-N 2.88Å; N349-T366 HydrophobicContact CB-CG2 4.06Å
350	I	91.3	Very high	88.8	Confident	18 Å²	18	61.1 Å²	61.1	9%	0.092	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-47.1	173.7	-67.3	163.6	0	0	0	111.1	F346 Y347 R348 N352 L354 T366 V367 Y370	F346-I350 WeakPolarHBondContact O-CG1 3.34Å; F346-I350 PolarHBondContact O-N 3.02Å; F346-I350 VanDerWaalsContact O-N 3.12Å; Y347-I350 PolarHBondContact O-N 2.96Å; R348-I350 VanDerWaalsContact C-N 3.29Å; R348-I350 PolarHBondContact O-N 3.39Å; I350-N352 PolarHBondContact O-N 3.46Å; I350-L354 HydrophobicContact CG2-CD1 3.91Å; I350-L354 WeakPolarHBondContact O-CB 3.35Å; I350-L354 WeakPolarHBondContact O-CG 3.42Å; I350-L354 PolarHBondContact O-N 3.13Å; I350-T366 HydrophobicContact CG1-CG2 3.79Å; I350-V367 HydrophobicContact CD1-CG2 3.97Å; I350-V367 HydrophobicContact CG1-CG2 3.97Å; I350-V367 HydrophobicContact CG2-CG2 4.11Å; I350-Y370 HydrophobicContact CD1-CD1 3.97Å; I350-Y370 HydrophobicContact CD1-CD2 4.41Å; I350-Y370 HydrophobicContact CD1-CG 3.73Å
351	V	92.3	Very high	88.5	Confident	26 Å²	26	64.6 Å²	64.6	16%	0.158	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-40.1	-180	176.4	0	0	0	0	111.5	Y347 R348 T355 V588 V592	Y347-V351 WeakPolarHBondContact O-CG2 3.38Å; Y347-V351 PolarHBondContact O-N 2.92Å; R348-V351 PolarHBondContact O-N 3.43Å; R348-V351 VanDerWaalsContact O-N 3.12Å; V351-T355 WeakPolarHBondContact O-CB 3.37Å; V351-T355 PolarHBondContact O-N 3.19Å; V351-T355 PolarHBondContact O-OG1 2.93Å; V351-V588 HydrophobicContact CG1-CB 4.43Å; V351-V588 HydrophobicContact CG1-CG1 4.16Å; V351-V592 HydrophobicContact CG1-CG2 4.35Å; V351-V592 HydrophobicContact CG2-CB 4.41Å; V351-V592 HydrophobicContact CG2-CG1 4.33Å; V351-V592 HydrophobicContact CG2-CG2 4.22Å
352	N	90.8	Very high	88.2	Confident	10 Å²	10	65.7 Å²	65.7	5%	0.053	34%	0.335	C	S	.	.	H	α-helix	trans	-67.8	-47.6	178.1	-68.1	-10.7	0	0	0	111.6	R348 N349 I350 L354 T355 E356 Q587 G589	R348-N352 WeakPolarHBondContact CG-ND2 3.25Å; R348-N352 PolarHBondContact NE-ND2 3.32Å; R348-N352 PolarHBondContact O-N 3.05Å; N349-N352 PolarHBondContact O-N 3.48Å; I350-N352 PolarHBondContact O-N 3.46Å; N352-L354 VanDerWaalsContact C-N 3.29Å; N352-L354 PolarHBondContact O-N 3.48Å; N352-T355 WeakPolarHBondContact O-CB 3.17Å; N352-T355 PolarHBondContact O-N 3.47Å; N352-E356 WeakPolarHBondContact O-CB 3.45Å; N352-E356 WeakPolarHBondContact O-CG 3.34Å; N352-E356 PolarHBondContact O-N 3.01Å; N352-Q587 PolarHBondContact ND2-OE1 3.22Å; N352-Q587 WeakPolarHBondContact OD1-CB 3.31Å; N352-G589 WeakPolarHBondContact OD1-CA 3.2Å; N352-G589 PolarHBondContact OD1-N 2.9Å
353	L	90.4	Very high	88	Confident	31 Å²	31	63.4 Å²	63.4	16%	0.162	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-36.4	176.3	-70.8	169.9	0	0	0	112.9	N349 K357 A358 T366	N349-L353 WeakPolarHBondContact O-CB 3.44Å; N349-L353 WeakPolarHBondContact O-CG 3.14Å; N349-L353 PolarHBondContact O-N 2.88Å; L353-K357 PolarHBondContact O-N 3.13Å; L353-A358 HydrophobicContact CB-CB 3.98Å; L353-A358 HydrophobicContact CD2-CB 3.51Å; L353-A358 HydrophobicContact CG-CB 4.35Å; L353-A358 WeakPolarHBondContact O-CB 3.38Å; L353-A358 PolarHBondContact O-N 3.34Å; L353-T366 HydrophobicContact CD1-CG2 4.28Å
354	L	88.8	Confident	87.7	Confident	105 Å²	105	64.7 Å²	64.7	55%	0.55	33%	0.334	S	S	.	.	H	α-helix	trans	-65	-42.3	172.3	-81.6	166.3	0	0	0	112.2	I350 N352 K357 L363	I350-L354 HydrophobicContact CG2-CD1 3.91Å; I350-L354 WeakPolarHBondContact O-CB 3.35Å; I350-L354 WeakPolarHBondContact O-CG 3.42Å; I350-L354 PolarHBondContact O-N 3.13Å; N352-L354 VanDerWaalsContact C-N 3.29Å; N352-L354 PolarHBondContact O-N 3.48Å; L354-K357 PolarHBondContact O-N 3.33Å; L354-L363 HydrophobicContact CD2-CD1 3.57Å; L354-L363 HydrophobicContact CG-CD1 3.85Å
355	T	86.9	Confident	87.6	Confident	82 Å²	82	73.7 Å²	73.7	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-68.5	-40	-179.9	-54.5	0	0	0	0	111.4	V351 N352 K357 V588	V351-T355 WeakPolarHBondContact O-CB 3.37Å; V351-T355 PolarHBondContact O-N 3.19Å; V351-T355 PolarHBondContact O-OG1 2.93Å; N352-T355 WeakPolarHBondContact O-CB 3.17Å; N352-T355 PolarHBondContact O-N 3.47Å; T355-K357 VanDerWaalsContact C-N 3.26Å; T355-K357 PolarHBondContact O-N 2.91Å; T355-V588 HydrophobicContact CG2-CG2 4.41Å
356	E	85.6	Confident	87.5	Confident	114 Å²	114	72.6 Å²	72.6	53%	0.533	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-3.6	179	-68.5	170.7	-165.9	0	0	113.6	N352 A358 Q587	N352-E356 WeakPolarHBondContact O-CB 3.45Å; N352-E356 WeakPolarHBondContact O-CG 3.34Å; N352-E356 PolarHBondContact O-N 3.01Å; E356-A358 VanDerWaalsContact C-N 3.28Å; E356-A358 PolarHBondContact O-N 3.43Å; E356-Q587 PolarHBondContact OE1-NE2 3Å
357	K	83.3	Confident	87.4	Confident	195 Å²	195	72.4 Å²	72.4	85%	0.848	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	42.3	-175.5	-58.5	178.1	-178.6	176.3	0	112.9	L353 L354 T355	L353-K357 PolarHBondContact O-N 3.13Å; L354-K357 PolarHBondContact O-N 3.33Å; T355-K357 VanDerWaalsContact C-N 3.26Å; T355-K357 PolarHBondContact O-N 2.91Å
358	A	80.9	Confident	87.3	Confident	24 Å²	24	72.8 Å²	72.8	20%	0.198	38%	0.377	C	S	.	.			trans	-61.2	157.1	-178.4	0	0	0	0	0	113.1	L353 E356 W360	L353-A358 HydrophobicContact CB-CB 3.98Å; L353-A358 HydrophobicContact CD2-CB 3.51Å; L353-A358 HydrophobicContact CG-CB 4.35Å; L353-A358 WeakPolarHBondContact O-CB 3.38Å; L353-A358 PolarHBondContact O-N 3.34Å; E356-A358 VanDerWaalsContact C-N 3.28Å; E356-A358 PolarHBondContact O-N 3.43Å; A358-W360 PolarHBondContact O-N 2.89Å
359	P	85	Confident	87.1	Confident	93 Å²	93	71.1 Å²	71.1	60%	0.604	38%	0.375	S	S	*	.			trans	-59.1	138.9	178.4	23.3	-34.5	0	0	0	112.6	S361 S362 L363	P359-S361 PolarHBondContact O-N 2.7Å; P359-S361 VanDerWaalsContact O-N 3.07Å; P359-S362 WeakPolarHBondContact O-CB 3.22Å; P359-S362 PolarHBondContact O-N 3.36Å; P359-L363 PolarHBondContact O-N 3.33Å
360	W	79.9	Confident	87.1	Confident	168 Å²	168	70.9 Å²	70.9	64%	0.636	37%	0.37	S	S	*	.	H	α-helix	trans	-52.1	-34.8	-174.7	178.3	-107	0	0	0	114.3	M80 A358 S362 L363 A364	M80-W360 HydrophobicContact CE-CD2 4.5Å; A358-W360 PolarHBondContact O-N 2.89Å; W360-S362 PolarHBondContact O-N 3.11Å; W360-L363 HydrophobicContact CE3-CD2 4.18Å; W360-L363 HydrophobicContact CZ3-CD2 3.93Å; W360-L363 PolarHBondContact O-N 3.25Å; W360-A364 VanDerWaalsContact O-CB 3.3Å; W360-A364 WeakPolarHBondContact O-CB 3.27Å; W360-A364 PolarHBondContact O-N 3.45Å
361	S	81	Confident	87	Confident	89 Å²	89	74.2 Å²	74.2	62%	0.622	39%	0.391	S	S	*	.	H	α-helix	trans	-60.2	-42.5	177.5	50.3	0	0	0	0	113.2	P359 W365	P359-S361 PolarHBondContact O-N 2.7Å; P359-S361 VanDerWaalsContact O-N 3.07Å; S361-W365 PolarHBondContact O-N 2.92Å; S361-W365 VanDerWaalsContact O-N 3.16Å
362	S	84.4	Confident	86.9	Confident	47 Å²	47	78.8 Å²	78.8	33%	0.329	41%	0.409	S	S	.	.	H	α-helix	trans	-68.4	-43	178.3	-174.9	0	0	0	0	111.6	P359 W360 T366	P359-S362 WeakPolarHBondContact O-CB 3.22Å; P359-S362 PolarHBondContact O-N 3.36Å; W360-S362 PolarHBondContact O-N 3.11Å; S362-T366 WeakPolarHBondContact O-CB 3.47Å; S362-T366 PolarHBondContact O-N 2.95Å; S362-T366 VanDerWaalsContact O-N 3.07Å; S362-T366 PolarHBondContact O-OG1 2.98Å
363	L	86.6	Confident	86.9	Confident	24 Å²	24	79.4 Å²	79.4	13%	0.126	41%	0.412	C	S	.	.	H	α-helix	trans	-63.3	-49.4	177.3	-174	152.9	0	0	0	111.3	L354 P359 W360 W365 T366 V367	L354-L363 HydrophobicContact CD2-CD1 3.57Å; L354-L363 HydrophobicContact CG-CD1 3.85Å; P359-L363 PolarHBondContact O-N 3.33Å; W360-L363 HydrophobicContact CE3-CD2 4.18Å; W360-L363 HydrophobicContact CZ3-CD2 3.93Å; W360-L363 PolarHBondContact O-N 3.25Å; L363-W365 PolarHBondContact O-N 2.98Å; L363-T366 PolarHBondContact O-N 3.29Å; L363-V367 HydrophobicContact CD2-CG2 3.95Å; L363-V367 HydrophobicContact CG-CG2 4.48Å; L363-V367 WeakPolarHBondContact O-CB 3.49Å; L363-V367 WeakPolarHBondContact O-CG2 3.48Å; L363-V367 PolarHBondContact O-N 3.37Å
364	A	85.5	Confident	86.7	Confident	33 Å²	33	80.6 Å²	80.6	27%	0.273	42%	0.416	S	S	.	.	H	α-helix	trans	-58.1	-45.9	179	0	0	0	0	0	111.7	W360 T366 V367 T368	W360-A364 VanDerWaalsContact O-CB 3.3Å; W360-A364 WeakPolarHBondContact O-CB 3.27Å; W360-A364 PolarHBondContact O-N 3.45Å; A364-T366 PolarHBondContact O-N 3.47Å; A364-V367 PolarHBondContact O-N 3.25Å; A364-T368 PolarHBondContact O-N 3.45Å; A364-T368 PolarHBondContact O-OG1 3.21Å
365	W	88.3	Confident	86.7	Confident	192 Å²	192	81.3 Å²	81.3	73%	0.727	42%	0.415	S	S	*	.	H	α-helix	trans	-61.7	-41.8	177.3	-178.2	-105.1	0	0	0	112.9	S361 L363 T368 S369	S361-W365 PolarHBondContact O-N 2.92Å; S361-W365 VanDerWaalsContact O-N 3.16Å; L363-W365 PolarHBondContact O-N 2.98Å; W365-T368 PolarHBondContact O-N 3.16Å; W365-S369 WeakPolarHBondContact O-CB 3.34Å; W365-S369 PolarHBondContact O-N 3.21Å; W365-S369 PolarHBondContact O-OG 3Å
366	T	89.1	Confident	86.8	Confident	16 Å²	16	78.8 Å²	78.8	10%	0.098	40%	0.398	C	S	.	.	H	α-helix	trans	-70.6	-40	-178.8	-53.9	0	0	0	0	111.2	F346 N349 I350 L353 S362 L363 A364 S369 Y370	F346-T366 HydrophobicContact CD1-CG2 4.02Å; N349-T366 HydrophobicContact CB-CG2 4.06Å; I350-T366 HydrophobicContact CG1-CG2 3.79Å; L353-T366 HydrophobicContact CD1-CG2 4.28Å; S362-T366 WeakPolarHBondContact O-CB 3.47Å; S362-T366 PolarHBondContact O-N 2.95Å; S362-T366 VanDerWaalsContact O-N 3.07Å; S362-T366 PolarHBondContact O-OG1 2.98Å; L363-T366 PolarHBondContact O-N 3.29Å; A364-T366 PolarHBondContact O-N 3.47Å; T366-S369 PolarHBondContact O-N 3.2Å; T366-Y370 WeakPolarHBondContact O-CB 3.15Å; T366-Y370 PolarHBondContact O-N 3.29Å
367	V	89.9	Confident	86.8	Confident	51 Å²	51	74.4 Å²	74.4	31%	0.309	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-45.7	173.8	172.1	0	0	0	0	111.3	I350 L363 A364 S369 Y370 V371	I350-V367 HydrophobicContact CD1-CG2 3.97Å; I350-V367 HydrophobicContact CG1-CG2 3.97Å; I350-V367 HydrophobicContact CG2-CG2 4.11Å; L363-V367 HydrophobicContact CD2-CG2 3.95Å; L363-V367 HydrophobicContact CG-CG2 4.48Å; L363-V367 WeakPolarHBondContact O-CB 3.49Å; L363-V367 WeakPolarHBondContact O-CG2 3.48Å; L363-V367 PolarHBondContact O-N 3.37Å; A364-V367 PolarHBondContact O-N 3.25Å; V367-S369 VanDerWaalsContact C-N 3.34Å; V367-S369 PolarHBondContact O-N 3.1Å; V367-Y370 PolarHBondContact O-N 3.2Å; V367-V371 WeakPolarHBondContact O-CG2 3.44Å; V367-V371 PolarHBondContact O-N 3.25Å
368	T	88.8	Confident	86.4	Confident	93 Å²	93	65.7 Å²	65.7	57%	0.571	34%	0.344	S	S	*	.	H	α-helix	trans	-61.5	-43.3	176.2	-56.8	0	0	0	0	111.6	A364 W365 V371 F372	A364-T368 PolarHBondContact O-N 3.45Å; A364-T368 PolarHBondContact O-OG1 3.21Å; W365-T368 PolarHBondContact O-N 3.16Å; T368-V371 PolarHBondContact O-N 3.12Å; T368-F372 PolarHBondContact O-N 2.98Å
369	S	90.4	Very high	85.3	Confident	24 Å²	24	67 Å²	67	17%	0.168	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-44.7	176.7	-59.6	0	0	0	0	111.9	W365 T366 V367 F372 L373	W365-S369 WeakPolarHBondContact O-CB 3.34Å; W365-S369 PolarHBondContact O-N 3.21Å; W365-S369 PolarHBondContact O-OG 3Å; T366-S369 PolarHBondContact O-N 3.2Å; V367-S369 VanDerWaalsContact C-N 3.34Å; V367-S369 PolarHBondContact O-N 3.1Å; S369-F372 PolarHBondContact O-N 3.44Å; S369-L373 VanDerWaalsContact O-CG 3.3Å; S369-L373 WeakPolarHBondContact O-CG 3.45Å; S369-L373 PolarHBondContact O-N 3.12Å
370	Y	90.8	Very high	83.9	Confident	53 Å²	53	65.5 Å²	65.5	21%	0.208	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-50	175	169.4	-103.1	0	0	0	112	V343 F346 Y347 I350 T366 V367 F372 L373 K374	V343-Y370 HydrophobicContact CG1-CD2 4.29Å; V343-Y370 HydrophobicContact CG1-CE2 3.7Å; F346-Y370 HydrophobicContact CB-CD2 4.13Å; Y347-Y370 HydrophobicContact CD2-CE2 4.43Å; Y347-Y370 HydrophobicContact CG-CE2 4.23Å; I350-Y370 HydrophobicContact CD1-CD1 3.97Å; I350-Y370 HydrophobicContact CD1-CD2 4.41Å; I350-Y370 HydrophobicContact CD1-CG 3.73Å; T366-Y370 WeakPolarHBondContact O-CB 3.15Å; T366-Y370 PolarHBondContact O-N 3.29Å; V367-Y370 PolarHBondContact O-N 3.2Å; Y370-F372 VanDerWaalsContact C-N 3.3Å; Y370-F372 PolarHBondContact O-N 3.17Å; Y370-L373 PolarHBondContact O-N 3.49Å; Y370-K374 WeakPolarHBondContact O-CB 3.22Å; Y370-K374 PolarHBondContact O-N 2.92Å
371	V	89.5	Confident	81.9	Confident	89 Å²	89	65.3 Å²	65.3	54%	0.539	38%	0.379	S	S	.	.	H	α-helix	trans	-60.7	-40.4	-179.9	172.6	0	0	0	0	111.3	V367 T368 K374 F375	V367-V371 WeakPolarHBondContact O-CG2 3.44Å; V367-V371 PolarHBondContact O-N 3.25Å; T368-V371 PolarHBondContact O-N 3.12Å; V371-K374 PolarHBondContact O-N 2.81Å; V371-F375 PolarHBondContact O-N 3.22Å
372	F	89.4	Confident	80.4	Confident	121 Å²	121	63.4 Å²	63.4	53%	0.531	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-46	175.3	-179.7	-105.9	0	0	0	112.5	T368 S369 Y370 K374 F375 L376	T368-F372 PolarHBondContact O-N 2.98Å; S369-F372 PolarHBondContact O-N 3.44Å; Y370-F372 VanDerWaalsContact C-N 3.3Å; Y370-F372 PolarHBondContact O-N 3.17Å; F372-K374 VanDerWaalsContact C-N 3.31Å; F372-K374 PolarHBondContact O-N 3.1Å; F372-F375 WeakPolarHBondContact O-CB 3.12Å; F372-F375 PolarHBondContact O-N 3.31Å; F372-L376 HydrophobicContact CD1-CD1 4.15Å; F372-L376 HydrophobicContact CE1-CD1 3.6Å; F372-L376 HydrophobicContact CE1-CG 4.28Å; F372-L376 HydrophobicContact CZ-CD1 3.95Å; F372-L376 HydrophobicContact CZ-CD2 4.41Å; F372-L376 HydrophobicContact CZ-CG 4.29Å; F372-L376 PolarHBondContact O-N 3.28Å
373	L	90.1	Very high	79	Confident	24 Å²	24	67 Å²	67	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-62.6	-37.6	175.3	-67.5	169.7	0	0	0	111.7	L339 L342 V343 F346 S369 Y370 L376 Q377	L339-L373 HydrophobicContact CD2-CD2 3.55Å; L342-L373 HydrophobicContact CB-CD1 4.48Å; V343-L373 HydrophobicContact CG2-CB 3.73Å; F346-L373 HydrophobicContact CD1-CD1 4.36Å; F346-L373 HydrophobicContact CD2-CD1 3.45Å; F346-L373 VanDerWaalsContact CD2-CD1 3.45Å; F346-L373 HydrophobicContact CE2-CD1 3.63Å; F346-L373 HydrophobicContact CG-CD1 3.85Å; F346-L373 HydrophobicContact CZ-CD1 4.16Å; S369-L373 VanDerWaalsContact O-CG 3.3Å; S369-L373 WeakPolarHBondContact O-CG 3.45Å; S369-L373 PolarHBondContact O-N 3.12Å; Y370-L373 PolarHBondContact O-N 3.49Å; L373-L376 PolarHBondContact O-N 3.23Å; L373-Q377 WeakPolarHBondContact O-CB 3.37Å; L373-Q377 PolarHBondContact O-N 3.43Å
374	K	87.3	Confident	78.2	Confident	56 Å²	56	69.1 Å²	69.1	24%	0.243	41%	0.412	C	S	.	.	H	α-helix	trans	-66.8	-34.6	175.1	-132.2	-70.5	173.2	-89.8	0	112.1	V343 Y370 V371 F372 G378	V343-K374 HydrophobicContact CG1-CG 4.05Å; Y370-K374 WeakPolarHBondContact O-CB 3.22Å; Y370-K374 PolarHBondContact O-N 2.92Å; V371-K374 PolarHBondContact O-N 2.81Å; F372-K374 VanDerWaalsContact C-N 3.31Å; F372-K374 PolarHBondContact O-N 3.1Å; K374-G378 WeakPolarHBondContact CE-O 3.3Å; K374-G378 PolarHBondContact NZ-O 2.83Å; K374-G378 WeakPolarHBondContact O-CA 3.23Å; K374-G378 PolarHBondContact O-N 3.45Å
375	F	88.1	Confident	78.1	Confident	120 Å²	120	67.6 Å²	67.6	53%	0.526	40%	0.4	S	S	.	.	H	α-helix	trans	-64.4	-42.6	170.9	167.1	-99.3	0	0	0	112.1	V371 F372 F386	V371-F375 PolarHBondContact O-N 3.22Å; F372-F375 WeakPolarHBondContact O-CB 3.12Å; F372-F375 PolarHBondContact O-N 3.31Å; F375-F386 HydrophobicContact CD1-CB 4.33Å; F375-F386 HydrophobicContact CE1-CB 3.79Å; F375-F386 HydrophobicContact CE1-CD1 4.43Å; F375-F386 HydrophobicContact CE1-CD2 4.15Å; F375-F386 AromaticContact CE1-CG 3.87Å; F375-F386 HydrophobicContact CE1-CG 3.87Å; F375-F386 HydrophobicContact CE2-CB 4.43Å; F375-F386 HydrophobicContact CZ-CB 3.85Å; F375-F386 AromaticContact CZ-CD2 3.78Å; F375-F386 HydrophobicContact CZ-CD2 3.78Å; F375-F386 AromaticContact CZ-CG 3.92Å; F375-F386 HydrophobicContact CZ-CG 3.92Å; F375-F386 PolarHBondContact O-N 3.29Å
376	L	88.8	Confident	78	Confident	29 Å²	29	63.3 Å²	63.3	15%	0.152	39%	0.386	C	S	.	.	H	α-helix	trans	-65.5	-45.8	176.8	-66.6	179.3	0	0	0	112.5	L339 F372 L373 F386 V387	L339-L376 HydrophobicContact CD1-CB 3.68Å; L339-L376 HydrophobicContact CD2-CB 4.16Å; L339-L376 HydrophobicContact CD2-CD1 4.16Å; F372-L376 HydrophobicContact CD1-CD1 4.15Å; F372-L376 HydrophobicContact CE1-CD1 3.6Å; F372-L376 HydrophobicContact CE1-CG 4.28Å; F372-L376 HydrophobicContact CZ-CD1 3.95Å; F372-L376 HydrophobicContact CZ-CD2 4.41Å; F372-L376 HydrophobicContact CZ-CG 4.29Å; F372-L376 PolarHBondContact O-N 3.28Å; L373-L376 PolarHBondContact O-N 3.23Å; L376-F386 HydrophobicContact CD2-CD1 4Å; L376-F386 PolarHBondContact O-N 2.97Å; L376-V387 HydrophobicContact CB-CG2 4.12Å; L376-V387 HydrophobicContact CD2-CG2 4.23Å; L376-V387 PolarHBondContact O-N 3.41Å
377	Q	85.4	Confident	78.1	Confident	21 Å²	21	62.8 Å²	62.8	10%	0.098	38%	0.383	C	S	.	.	H	α-helix	trans	-69.7	-40.9	179	-168.9	-159	27.3	0	0	112.8	L339 N340 V343 L373 G385	L339-Q377 HydrophobicContact CB-CB 4.37Å; N340-Q377 PolarHBondContact OD1-NE2 3.04Å; V343-Q377 HydrophobicContact CG2-CB 4.06Å; V343-Q377 HydrophobicContact CG2-CG 4.47Å; L373-Q377 WeakPolarHBondContact O-CB 3.37Å; L373-Q377 PolarHBondContact O-N 3.43Å; Q377-G385 VanDerWaalsContact C-CA 3.46Å; Q377-G385 VanDerWaalsContact O-CA 3.27Å; Q377-G385 WeakPolarHBondContact O-CA 3.39Å; Q377-G385 PolarHBondContact O-N 3.47Å
378	G	75.8	Confident	77.9	Confident	13 Å²	13	61.1 Å²	61.1	13%	0.134	37%	0.374	C	S	.	.			trans	94.4	155	-171.4	0	0	0	0	0	113.8	K374	K374-G378 WeakPolarHBondContact CE-O 3.3Å; K374-G378 PolarHBondContact NZ-O 2.83Å; K374-G378 WeakPolarHBondContact O-CA 3.23Å; K374-G378 PolarHBondContact O-N 3.45Å
379	G	58	Low	78	Confident	51 Å²	51	60.3 Å²	60.3	53%	0.526	37%	0.366	S	S	.	.			trans	145.8	39.9	177	0	0	0	0	0	114.6
380	G	54.9	Low	78	Confident	62 Å²	62	62.2 Å²	62.2	64%	0.639	37%	0.374	S	S	*	.	S	Bend	trans	-100.4	-157.8	158	0	0	0	0	0	109.7	G382	G380-G382 CarbonylContact O-C 3.57Å; G380-G382 PolarHBondContact O-N 2.99Å
381	T	38.9	Very low	78	Confident	164 Å²	164	60.3 Å²	60.3	100%	1.006	37%	0.366	S	S	*	.	S	Bend	trans	-59.5	-17.9	178.3	-29.7	0	0	0	0	114
382	G	47.7	Very low	78	Confident	49 Å²	49	59.1 Å²	59.1	51%	0.505	36%	0.359	S	S	.	.	S	Bend	trans	-98.2	124.7	164.3	0	0	0	0	0	110.8	G380 T384	G380-G382 CarbonylContact O-C 3.57Å; G380-G382 PolarHBondContact O-N 2.99Å; G382-T384 PolarHBondContact O-N 3.09Å; G382-T384 VanDerWaalsContact O-N 3.15Å
383	S	56.4	Low	78	Confident	121 Å²	121	59.5 Å²	59.5	85%	0.846	36%	0.361	S	S	*	.	S	Bend	trans	-74.1	5.2	-173.6	49.5	0	0	0	0	115.7
384	T	69.7	Low	78.1	Confident	69 Å²	69	60 Å²	60	42%	0.423	36%	0.364	S	S	.	.			trans	-120.5	129.8	-177.3	57.8	0	0	0	0	112.3	G382 N389	G382-T384 PolarHBondContact O-N 3.09Å; G382-T384 VanDerWaalsContact O-N 3.15Å; T384-N389 WeakPolarHBondContact CB-OD1 3.29Å; T384-N389 PolarHBondContact O-ND2 3.19Å; T384-N389 VanDerWaalsContact O-ND2 3.1Å; T384-N389 VanDerWaalsContact OG1-CG 3.3Å; T384-N389 PolarHBondContact OG1-ND2 3.19Å; T384-N389 PolarHBondContact OG1-OD1 3.24Å
385	G	81.9	Confident	78.3	Confident	2 Å²	2	58 Å²	58	2%	0.021	36%	0.355	C	S	.	.			trans	-77	167.3	176.8	0	0	0	0	0	114.6	Q377 V387 S388 N389	Q377-G385 VanDerWaalsContact C-CA 3.46Å; Q377-G385 VanDerWaalsContact O-CA 3.27Å; Q377-G385 WeakPolarHBondContact O-CA 3.39Å; Q377-G385 PolarHBondContact O-N 3.47Å; G385-V387 VanDerWaalsContact C-N 3.27Å; G385-V387 PolarHBondContact O-N 2.87Å; G385-S388 PolarHBondContact O-N 2.93Å; G385-N389 WeakPolarHBondContact O-CB 3.29Å; G385-N389 PolarHBondContact O-N 2.91Å; G385-N389 PolarHBondContact O-ND2 3.49Å
386	F	88.1	Confident	78.4	Confident	101 Å²	101	56.2 Å²	56.2	44%	0.443	35%	0.35	S	S	.	.	H	α-helix	trans	-55.3	-42.6	177.1	179.7	-97.8	0	0	0	112.2	F375 L376 N389 L390	F375-F386 HydrophobicContact CD1-CB 4.33Å; F375-F386 HydrophobicContact CE1-CB 3.79Å; F375-F386 HydrophobicContact CE1-CD1 4.43Å; F375-F386 HydrophobicContact CE1-CD2 4.15Å; F375-F386 AromaticContact CE1-CG 3.87Å; F375-F386 HydrophobicContact CE1-CG 3.87Å; F375-F386 HydrophobicContact CE2-CB 4.43Å; F375-F386 HydrophobicContact CZ-CB 3.85Å; F375-F386 AromaticContact CZ-CD2 3.78Å; F375-F386 HydrophobicContact CZ-CD2 3.78Å; F375-F386 AromaticContact CZ-CG 3.92Å; F375-F386 HydrophobicContact CZ-CG 3.92Å; F375-F386 PolarHBondContact O-N 3.29Å; L376-F386 HydrophobicContact CD2-CD1 4Å; L376-F386 PolarHBondContact O-N 2.97Å; F386-N389 PolarHBondContact O-N 3.4Å; F386-L390 HydrophobicContact CE1-CD2 4.25Å; F386-L390 VanDerWaalsContact O-CB 3.32Å; F386-L390 WeakPolarHBondContact O-CB 3.27Å; F386-L390 PolarHBondContact O-N 3Å
387	V	90	Very high	78.4	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.03	37%	0.373	C	S	.	.	H	α-helix	trans	-64.6	-44	179	174.4	0	0	0	0	111.7	L332 L335 E336 L339 L376 G385 L390 R391	L332-V387 HydrophobicContact CB-CG1 4.2Å; L332-V387 HydrophobicContact CD2-CG1 4.22Å; L332-V387 WeakPolarHBondContact O-CG1 3.43Å; L335-V387 HydrophobicContact CD2-CG1 4.37Å; L335-V387 HydrophobicContact CD2-CG2 4.13Å; E336-V387 HydrophobicContact CB-CG1 4.34Å; L339-V387 HydrophobicContact CD1-CB 4.41Å; L339-V387 HydrophobicContact CD1-CG2 3.77Å; L376-V387 HydrophobicContact CB-CG2 4.12Å; L376-V387 HydrophobicContact CD2-CG2 4.23Å; L376-V387 PolarHBondContact O-N 3.41Å; G385-V387 VanDerWaalsContact C-N 3.27Å; G385-V387 PolarHBondContact O-N 2.87Å; V387-L390 PolarHBondContact O-N 3.49Å; V387-R391 VanDerWaalsContact O-CB 3.31Å; V387-R391 WeakPolarHBondContact O-CB 3.45Å; V387-R391 PolarHBondContact O-N 3.31Å
388	S	87	Confident	78.5	Confident	16 Å²	16	61.9 Å²	61.9	11%	0.112	37%	0.368	C	S	.	.	H	α-helix	trans	-67.5	-39.9	179.4	-173.2	0	0	0	0	112.1	G385 R391 T392	G385-S388 PolarHBondContact O-N 2.93Å; S388-R391 PolarHBondContact OG-NH2 3.42Å; S388-T392 WeakPolarHBondContact O-CB 3.29Å; S388-T392 PolarHBondContact O-N 3.37Å; S388-T392 PolarHBondContact O-OG1 2.87Å
389	N	89.4	Confident	79.1	Confident	76 Å²	76	64.2 Å²	64.2	41%	0.406	38%	0.376	S	S	.	.	H	α-helix	trans	-66.7	-42.3	174.4	-71.9	-45.7	0	0	0	112	T384 G385 F386 T392 F393	T384-N389 WeakPolarHBondContact CB-OD1 3.29Å; T384-N389 PolarHBondContact O-ND2 3.19Å; T384-N389 VanDerWaalsContact O-ND2 3.1Å; T384-N389 VanDerWaalsContact OG1-CG 3.3Å; T384-N389 PolarHBondContact OG1-ND2 3.19Å; T384-N389 PolarHBondContact OG1-OD1 3.24Å; G385-N389 WeakPolarHBondContact O-CB 3.29Å; G385-N389 PolarHBondContact O-N 2.91Å; G385-N389 PolarHBondContact O-ND2 3.49Å; F386-N389 PolarHBondContact O-N 3.4Å; N389-T392 PolarHBondContact O-N 2.93Å; N389-F393 WeakPolarHBondContact O-CB 3.39Å; N389-F393 PolarHBondContact O-N 3.39Å
390	L	90.6	Very high	80.6	Confident	65 Å²	65	67.5 Å²	67.5	34%	0.34	38%	0.377	S	S	.	.	H	α-helix	trans	-63.7	-44.9	175.4	-179.7	61.7	0	0	0	111.7	L332 F386 V387 T392 F393 L394	L332-L390 HydrophobicContact CD1-CD2 4.27Å; L332-L390 HydrophobicContact CD1-CG 4.13Å; L332-L390 HydrophobicContact CD2-CD2 4.48Å; F386-L390 HydrophobicContact CE1-CD2 4.25Å; F386-L390 VanDerWaalsContact O-CB 3.32Å; F386-L390 WeakPolarHBondContact O-CB 3.27Å; F386-L390 PolarHBondContact O-N 3Å; V387-L390 PolarHBondContact O-N 3.49Å; L390-T392 VanDerWaalsContact C-N 3.33Å; L390-T392 PolarHBondContact O-N 3.48Å; L390-F393 PolarHBondContact O-N 3.42Å; L390-L394 HydrophobicContact CD1-CG 4.48Å; L390-L394 HydrophobicContact CG-CD1 4.4Å; L390-L394 WeakPolarHBondContact O-CG 3.47Å; L390-L394 PolarHBondContact O-N 3.45Å
391	R	90.6	Very high	82.2	Confident	12 Å²	12	66.5 Å²	66.5	5%	0.045	36%	0.355	C	S	.	.	H	α-helix	trans	-57.7	-45.3	173.8	-179.6	177.8	57	64.5	-2.3	111.3	C329 L332 E336 V387 S388 L394 W395 F450	C329-R391 HydrophobicContact CB-CG 4.21Å; C329-R391 WeakPolarHBondContact O-CD 3.39Å; L332-R391 HydrophobicContact CB-CB 4.13Å; L332-R391 HydrophobicContact CB-CG 4.4Å; L332-R391 HydrophobicContact CD1-CB 4.09Å; E336-R391 IonicContact OE1-NH2 3.18Å; E336-R391 IonicContact OE2-CZ 3.27Å; E336-R391 IonicContact OE2-NE 3.97Å; E336-R391 PolarHBondContact OE2-NE 2.98Å; E336-R391 IonicContact OE2-NH2 2.73Å; E336-R391 PolarHBondContact OE2-NH2 3.31Å; V387-R391 VanDerWaalsContact O-CB 3.31Å; V387-R391 WeakPolarHBondContact O-CB 3.45Å; V387-R391 PolarHBondContact O-N 3.31Å; S388-R391 PolarHBondContact OG-NH2 3.42Å; R391-L394 PolarHBondContact O-N 3.17Å; R391-W395 WeakPolarHBondContact O-CB 3.41Å; R391-W395 PolarHBondContact O-N 3.22Å; R391-F450 HydrophobicContact CG-CE1 4.45Å
392	T	89.2	Confident	84.5	Confident	64 Å²	64	58.9 Å²	58.9	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-65.2	-44.6	178.5	-56.9	0	0	0	0	111.4	S388 N389 L390 L394 W395 I396	S388-T392 WeakPolarHBondContact O-CB 3.29Å; S388-T392 PolarHBondContact O-N 3.37Å; S388-T392 PolarHBondContact O-OG1 2.87Å; N389-T392 PolarHBondContact O-N 2.93Å; L390-T392 VanDerWaalsContact C-N 3.33Å; L390-T392 PolarHBondContact O-N 3.48Å; T392-L394 PolarHBondContact O-N 3.11Å; T392-W395 WeakPolarHBondContact O-CB 3.42Å; T392-W395 PolarHBondContact O-N 3.11Å; T392-W395 VanDerWaalsContact O-N 3.14Å; T392-I396 WeakPolarHBondContact O-CG1 3.36Å; T392-I396 PolarHBondContact O-N 2.85Å; T392-I396 VanDerWaalsContact O-N 3.09Å
393	F	91.1	Very high	86.4	Confident	130 Å²	130	57.7 Å²	57.7	57%	0.57	29%	0.293	S	S	*	.	H	α-helix	trans	-58.5	-44.7	176.2	175.8	-100	0	0	0	112.6	N389 L390	N389-F393 WeakPolarHBondContact O-CB 3.39Å; N389-F393 PolarHBondContact O-N 3.39Å; L390-F393 PolarHBondContact O-N 3.42Å
394	L	91.4	Very high	88	Confident	35 Å²	35	58.9 Å²	58.9	18%	0.183	28%	0.279	C	S	.	.	H	α-helix	trans	-65.1	-39.2	174.9	-71.2	176.8	0	0	0	112	V325 I328 C329 L332 L390 R391 T392 I396	V325-L394 HydrophobicContact CG1-CB 4.06Å; V325-L394 WeakPolarHBondContact CG1-O 3.26Å; I328-L394 HydrophobicContact CG2-CD1 3.68Å; C329-L394 VanDerWaalsContact SG-CB 3.59Å; L332-L394 HydrophobicContact CD1-CD1 3.87Å; L390-L394 HydrophobicContact CD1-CG 4.48Å; L390-L394 HydrophobicContact CG-CD1 4.4Å; L390-L394 WeakPolarHBondContact O-CG 3.47Å; L390-L394 PolarHBondContact O-N 3.45Å; R391-L394 PolarHBondContact O-N 3.17Å; T392-L394 PolarHBondContact O-N 3.11Å; L394-I396 PolarHBondContact O-N 3.1Å
395	W	90.4	Very high	88.8	Confident	13 Å²	13	63.3 Å²	63.3	5%	0.049	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-34.6	179.4	-175.3	-107.1	0	0	0	114.1	L314 V326 R391 T392 R397 V398 Q399 L445 S446 F450	L314-W395 HydrophobicContact CD2-CH2 4.13Å; V326-W395 HydrophobicContact CG2-CZ3 4.39Å; R391-W395 WeakPolarHBondContact O-CB 3.41Å; R391-W395 PolarHBondContact O-N 3.22Å; T392-W395 WeakPolarHBondContact O-CB 3.42Å; T392-W395 PolarHBondContact O-N 3.11Å; T392-W395 VanDerWaalsContact O-N 3.14Å; W395-R397 PolarHBondContact O-N 3.36Å; W395-R397 VanDerWaalsContact O-N 3.1Å; W395-V398 HydrophobicContact CD2-CB 4.34Å; W395-V398 HydrophobicContact CE3-CB 3.97Å; W395-V398 HydrophobicContact CE3-CG1 4.17Å; W395-V398 HydrophobicContact CE3-CG2 4.26Å; W395-V398 HydrophobicContact CH2-CG1 4.09Å; W395-V398 HydrophobicContact CZ3-CB 4.17Å; W395-V398 HydrophobicContact CZ3-CG1 3.84Å; W395-V398 WeakPolarHBondContact O-CA 3.44Å; W395-V398 WeakPolarHBondContact O-CB 3.46Å; W395-V398 PolarHBondContact O-N 3.17Å; W395-Q399 PolarHBondContact O-N 2.58Å; W395-L445 HydrophobicContact CH2-CD2 3.96Å; W395-L445 HydrophobicContact CH2-CG 4.27Å; W395-L445 HydrophobicContact CZ2-CD2 3.67Å; W395-L445 HydrophobicContact CZ2-CG 3.85Å; W395-S446 PolarHBondContact NE1-OG 3.11Å; W395-F450 HydrophobicContact CB-CE2 4.32Å; W395-F450 HydrophobicContact CB-CZ 4.34Å; W395-F450 AromaticContact CD1-CE2 3.66Å; W395-F450 AromaticContact CD2-CE2 3.51Å; W395-F450 HydrophobicContact CD2-CE2 3.51Å; W395-F450 AromaticContact CD2-CZ 3.49Å; W395-F450 HydrophobicContact CD2-CZ 3.49Å; W395-F450 VanDerWaalsContact CD2-CZ 3.49Å; W395-F450 AromaticContact CE2-CE2 3.55Å; W395-F450 AromaticContact CE2-CZ 3.89Å; W395-F450 HydrophobicContact CE3-CE2 4.13Å; W395-F450 AromaticContact CE3-CZ 3.61Å; W395-F450 HydrophobicContact CE3-CZ 3.61Å; W395-F450 AromaticContact CG-CE2 3.57Å; W395-F450 HydrophobicContact CG-CE2 3.57Å; W395-F450 AromaticContact CG-CZ 3.82Å; W395-F450 HydrophobicContact CG-CZ 3.82Å; W395-F450 HydrophobicContact CH2-CZ 4.41Å; W395-F450 HydrophobicContact CZ2-CE2 4.16Å; W395-F450 HydrophobicContact CZ2-CZ 4.34Å; W395-F450 HydrophobicContact CZ3-CZ 4.07Å; W395-F450 AromaticContact NE1-CE2 3.62Å
396	I	90.8	Very high	89.1	Confident	83 Å²	83	63.5 Å²	63.5	43%	0.426	29%	0.289	S	S	.	.	H	α-helix	trans	-50.4	-41.3	-179.8	-70.6	165	0	0	0	111.5	T392 L394 V398 Q399 Q400	T392-I396 WeakPolarHBondContact O-CG1 3.36Å; T392-I396 PolarHBondContact O-N 2.85Å; T392-I396 VanDerWaalsContact O-N 3.09Å; L394-I396 PolarHBondContact O-N 3.1Å; I396-V398 PolarHBondContact O-N 3.1Å; I396-Q399 PolarHBondContact O-N 3.19Å; I396-Q400 HydrophobicContact CG2-CG 4.22Å; I396-Q400 WeakPolarHBondContact O-CB 3.24Å; I396-Q400 WeakPolarHBondContact O-CG 3.41Å; I396-Q400 PolarHBondContact O-N 3Å
397	R	88.9	Confident	89.2	Confident	169 Å²	169	63.5 Å²	63.5	64%	0.638	29%	0.29	S	S	*	.	H	α-helix	trans	-65.1	-37.7	178.1	-70.3	-174.6	176.5	173.7	-0.8	113.2	L322 W395 F401	L322-R397 HydrophobicContact CD2-CB 4.49Å; W395-R397 PolarHBondContact O-N 3.36Å; W395-R397 VanDerWaalsContact O-N 3.1Å; R397-F401 WeakPolarHBondContact O-CB 3.45Å; R397-F401 PolarHBondContact O-N 3.46Å; R397-F401 VanDerWaalsContact O-N 3.14Å
398	V	88.4	Confident	89.2	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68.5	-46.9	176.3	-176.4	0	0	0	0	109.7	V325 V326 W395 I396 Q400 F401 T402	V325-V398 HydrophobicContact CG1-CG2 3.9Å; V326-V398 HydrophobicContact CG2-CB 4.47Å; V326-V398 HydrophobicContact CG2-CG1 3.79Å; V326-V398 HydrophobicContact CG2-CG2 3.82Å; W395-V398 HydrophobicContact CD2-CB 4.34Å; W395-V398 HydrophobicContact CE3-CB 3.97Å; W395-V398 HydrophobicContact CE3-CG1 4.17Å; W395-V398 HydrophobicContact CE3-CG2 4.26Å; W395-V398 HydrophobicContact CH2-CG1 4.09Å; W395-V398 HydrophobicContact CZ3-CB 4.17Å; W395-V398 HydrophobicContact CZ3-CG1 3.84Å; W395-V398 WeakPolarHBondContact O-CA 3.44Å; W395-V398 WeakPolarHBondContact O-CB 3.46Å; W395-V398 PolarHBondContact O-N 3.17Å; I396-V398 PolarHBondContact O-N 3.1Å; V398-Q400 PolarHBondContact O-N 2.74Å; V398-F401 PolarHBondContact O-N 3.07Å; V398-T402 PolarHBondContact O-N 3.4Å; V398-T402 PolarHBondContact O-OG1 3.49Å
399	Q	87.7	Confident	89.3	Confident	61 Å²	61	74.9 Å²	74.9	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-57.8	-47.7	178.1	-172	177.4	-5.1	0	0	112.1	W395 I396 F401 T402 S403 T442	W395-Q399 PolarHBondContact O-N 2.58Å; I396-Q399 PolarHBondContact O-N 3.19Å; Q399-F401 PolarHBondContact O-N 3.43Å; Q399-T402 PolarHBondContact O-N 3.27Å; Q399-S403 WeakPolarHBondContact O-CB 3.22Å; Q399-S403 PolarHBondContact O-N 3.19Å; Q399-T442 HydrophobicContact CG-CG2 4.13Å
400	Q	89.6	Confident	89.4	Confident	121 Å²	121	71.4 Å²	71.4	57%	0.565	32%	0.319	S	S	*	.	H	α-helix	trans	-64.1	-39.1	178.3	-71	-66.7	-23.4	0	0	112.4	I396 V398 R404	I396-Q400 HydrophobicContact CG2-CG 4.22Å; I396-Q400 WeakPolarHBondContact O-CB 3.24Å; I396-Q400 WeakPolarHBondContact O-CG 3.41Å; I396-Q400 PolarHBondContact O-N 3Å; V398-Q400 PolarHBondContact O-N 2.74Å; Q400-R404 WeakPolarHBondContact O-CB 3.4Å; Q400-R404 PolarHBondContact O-N 3.39Å; Q400-R404 VanDerWaalsContact O-N 3.13Å
401	F	88.4	Confident	89.5	Confident	40 Å²	40	73.9 Å²	73.9	18%	0.175	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-45.6	173.8	177.3	-88.6	0	0	0	112.1	P316 L322 R397 V398 Q399 R405	P316-F401 HydrophobicContact CB-CD1 3.85Å; P316-F401 HydrophobicContact CB-CE1 3.69Å; P316-F401 HydrophobicContact CB-CZ 4.42Å; L322-F401 HydrophobicContact CD1-CB 3.84Å; L322-F401 HydrophobicContact CD1-CD1 4.17Å; L322-F401 HydrophobicContact CD1-CD2 3.56Å; L322-F401 HydrophobicContact CD1-CE2 4.14Å; L322-F401 HydrophobicContact CD1-CG 3.58Å; R397-F401 WeakPolarHBondContact O-CB 3.45Å; R397-F401 PolarHBondContact O-N 3.46Å; R397-F401 VanDerWaalsContact O-N 3.14Å; V398-F401 PolarHBondContact O-N 3.07Å; Q399-F401 PolarHBondContact O-N 3.43Å; F401-R405 WeakPolarHBondContact O-CB 3.46Å; F401-R405 PolarHBondContact O-N 2.98Å
402	T	86.3	Confident	89.5	Confident	5 Å²	5	76.1 Å²	76.1	3%	0.031	35%	0.345	C	S	.	.	H	α-helix	trans	-67.2	-44	179	-64.3	0	0	0	0	111.5	Y313 V398 Q399 R405 V406	Y313-T402 WeakPolarHBondContact O-CG2 3.45Å; Y313-T402 PolarHBondContact O-OG1 3.35Å; Y313-T402 VanDerWaalsContact O-OG1 3.11Å; V398-T402 PolarHBondContact O-N 3.4Å; V398-T402 PolarHBondContact O-OG1 3.49Å; Q399-T402 PolarHBondContact O-N 3.27Å; T402-R405 PolarHBondContact O-N 3.47Å; T402-V406 HydrophobicContact CG2-CG2 4.36Å; T402-V406 WeakPolarHBondContact O-CG2 3.27Å; T402-V406 PolarHBondContact O-N 3.02Å
403	S	88.1	Confident	89.6	Confident	24 Å²	24	74.3 Å²	74.3	17%	0.168	33%	0.331	C	S	.	.	H	α-helix	trans	-54.3	-59.4	176.9	-162	0	0	0	0	110.7	Q399 R405 V406 E407 T438	Q399-S403 WeakPolarHBondContact O-CB 3.22Å; Q399-S403 PolarHBondContact O-N 3.19Å; S403-R405 PolarHBondContact O-N 2.96Å; S403-R405 VanDerWaalsContact O-N 3.12Å; S403-V406 PolarHBondContact O-N 3.26Å; S403-E407 VanDerWaalsContact O-CB 3.3Å; S403-E407 WeakPolarHBondContact O-CB 3.45Å; S403-E407 PolarHBondContact O-N 3.19Å; S403-T438 WeakPolarHBondContact OG-CG2 3.45Å
404	R	89.5	Confident	89.7	Confident	146 Å²	146	69 Å²	69	55%	0.551	31%	0.309	S	S	*	.	H	α-helix	trans	-53.5	-37.9	178.9	-177.9	-178.3	65.3	174.1	1.3	112.8	Q400 L408	Q400-R404 WeakPolarHBondContact O-CB 3.4Å; Q400-R404 PolarHBondContact O-N 3.39Å; Q400-R404 VanDerWaalsContact O-N 3.13Å; R404-L408 HydrophobicContact CG-CD1 3.85Å; R404-L408 HydrophobicContact CG-CG 4.37Å; R404-L408 VanDerWaalsContact O-CB 3.28Å; R404-L408 WeakPolarHBondContact O-CB 3.38Å; R404-L408 WeakPolarHBondContact O-CD1 3.08Å; R404-L408 WeakPolarHBondContact O-CG 3.46Å; R404-L408 PolarHBondContact O-N 3.15Å
405	R	87.4	Confident	89.7	Confident	162 Å²	162	73.9 Å²	73.9	61%	0.611	33%	0.33	S	S	*	.	H	α-helix	trans	-76	-30.8	-178.8	-172.8	168.3	-178.5	79.1	1.7	113.2	F401 T402 S403 R409	F401-R405 WeakPolarHBondContact O-CB 3.46Å; F401-R405 PolarHBondContact O-N 2.98Å; T402-R405 PolarHBondContact O-N 3.47Å; S403-R405 PolarHBondContact O-N 2.96Å; S403-R405 VanDerWaalsContact O-N 3.12Å; R405-R409 WeakPolarHBondContact O-CB 3.31Å; R405-R409 PolarHBondContact O-N 3.08Å
406	V	87.5	Confident	89.6	Confident	6 Å²	6	78.2 Å²	78.2	4%	0.036	35%	0.351	C	S	.	.	H	α-helix	trans	-74.1	-49.5	174	170.7	0	0	0	0	109.7	Y313 T402 S403 R409 I410 T438 V441 M625	Y313-V406 HydrophobicContact CD1-CG2 3.75Å; Y313-V406 HydrophobicContact CE1-CG2 4.11Å; T402-V406 HydrophobicContact CG2-CG2 4.36Å; T402-V406 WeakPolarHBondContact O-CG2 3.27Å; T402-V406 PolarHBondContact O-N 3.02Å; S403-V406 PolarHBondContact O-N 3.26Å; V406-R409 WeakPolarHBondContact O-CB 3.48Å; V406-R409 PolarHBondContact O-N 3.42Å; V406-R409 VanDerWaalsContact O-N 3.1Å; V406-I410 HydrophobicContact CG1-CD1 3.64Å; V406-I410 HydrophobicContact CG1-CG1 4.49Å; V406-I410 WeakPolarHBondContact O-CG1 3.48Å; V406-I410 PolarHBondContact O-N 3.28Å; V406-T438 HydrophobicContact CB-CG2 4.35Å; V406-T438 HydrophobicContact CG1-CG2 4.22Å; V406-V441 HydrophobicContact CG2-CG1 4.48Å; V406-M625 HydrophobicContact CG1-SD 4.13Å
407	E	89.9	Confident	89.6	Confident	101 Å²	101	74.7 Å²	74.7	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-56.3	-54	179.4	-166.7	-179.9	160.3	0	0	112.2	S403 R409 I410 F411 T438	S403-E407 VanDerWaalsContact O-CB 3.3Å; S403-E407 WeakPolarHBondContact O-CB 3.45Å; S403-E407 PolarHBondContact O-N 3.19Å; E407-R409 PolarHBondContact O-N 3.38Å; E407-I410 PolarHBondContact O-N 2.92Å; E407-F411 WeakPolarHBondContact O-CB 3.28Å; E407-F411 PolarHBondContact O-N 3.48Å; E407-T438 HydrophobicContact CB-CG2 4.18Å
408	L	90.9	Very high	89.6	Confident	110 Å²	110	67.4 Å²	67.4	58%	0.576	31%	0.308	S	S	*	.	H	α-helix	trans	-59.7	-32.1	176.2	-72.6	173.2	0	0	0	113.1	R404 S412	R404-L408 HydrophobicContact CG-CD1 3.85Å; R404-L408 HydrophobicContact CG-CG 4.37Å; R404-L408 VanDerWaalsContact O-CB 3.28Å; R404-L408 WeakPolarHBondContact O-CB 3.38Å; R404-L408 WeakPolarHBondContact O-CD1 3.08Å; R404-L408 WeakPolarHBondContact O-CG 3.46Å; R404-L408 PolarHBondContact O-N 3.15Å; L408-S412 VanDerWaalsContact O-CB 3.31Å; L408-S412 WeakPolarHBondContact O-CB 3.34Å; L408-S412 PolarHBondContact O-N 3.41Å
409	R	89.9	Confident	89.5	Confident	150 Å²	150	69.7 Å²	69.7	57%	0.566	32%	0.32	S	S	*	.	H	α-helix	trans	-72.9	-41.9	178.5	-176	177.5	-176.1	175.5	3.9	111.5	Y313 R405 V406 E407 H413	Y313-R409 PolarHBondContact OH-NH1 2.94Å; R405-R409 WeakPolarHBondContact O-CB 3.31Å; R405-R409 PolarHBondContact O-N 3.08Å; V406-R409 WeakPolarHBondContact O-CB 3.48Å; V406-R409 PolarHBondContact O-N 3.42Å; V406-R409 VanDerWaalsContact O-N 3.1Å; E407-R409 PolarHBondContact O-N 3.38Å; R409-H413 WeakPolarHBondContact O-CB 3.18Å; R409-H413 PolarHBondContact O-N 3Å; R409-H413 VanDerWaalsContact O-N 3.1Å
410	I	91.4	Very high	89.4	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.015	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-45.2	175.9	-62.1	158.3	0	0	0	109.6	V406 E407 S412 H413 L414 A434 M625 L628 L629	V406-I410 HydrophobicContact CG1-CD1 3.64Å; V406-I410 HydrophobicContact CG1-CG1 4.49Å; V406-I410 WeakPolarHBondContact O-CG1 3.48Å; V406-I410 PolarHBondContact O-N 3.28Å; E407-I410 PolarHBondContact O-N 2.92Å; I410-S412 PolarHBondContact O-N 2.91Å; I410-H413 PolarHBondContact O-N 2.9Å; I410-L414 HydrophobicContact CG2-CD1 4.06Å; I410-L414 HydrophobicContact CG2-CG 4.27Å; I410-L414 WeakPolarHBondContact O-CG 3.32Å; I410-L414 PolarHBondContact O-N 3.28Å; I410-A434 HydrophobicContact CG2-CB 3.61Å; I410-M625 HydrophobicContact CD1-CG 3.6Å; I410-M625 HydrophobicContact CD1-SD 3.65Å; I410-M625 HydrophobicContact CG1-CG 4.33Å; I410-L628 HydrophobicContact CG2-CD2 4.22Å; I410-L629 HydrophobicContact CG1-CD1 4.03Å; I410-L629 HydrophobicContact CG1-CD2 4.03Å; I410-L629 HydrophobicContact CG1-CG 4.19Å
411	F	91.1	Very high	89.4	Confident	117 Å²	117	67.5 Å²	67.5	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-43.2	179.4	-167.4	-100.3	0	0	0	112.7	E407 L414 H415	E407-F411 WeakPolarHBondContact O-CB 3.28Å; E407-F411 PolarHBondContact O-N 3.48Å; F411-L414 PolarHBondContact O-N 3.15Å; F411-H415 AromaticContact CD1-CD2 3.86Å; F411-H415 AromaticContact CE1-CD2 3.57Å; F411-H415 AromaticContact CE1-NE2 3.25Å; F411-H415 WeakPolarHBondContact CE1-NE2 3.25Å; F411-H415 AromaticContact CZ-CD2 3.95Å; F411-H415 AromaticContact CZ-NE2 3.25Å; F411-H415 WeakPolarHBondContact CZ-NE2 3.37Å; F411-H415 PolarHBondContact O-CD2 3.25Å; F411-H415 VanDerWaalsContact O-CD2 3.31Å; F411-H415 PolarHBondContact O-N 3.43Å
412	S	92.2	Very high	89.4	Confident	59 Å²	59	68.7 Å²	68.7	41%	0.413	31%	0.31	S	S	.	.	H	α-helix	trans	-57.8	-49.2	171.6	-171.2	0	0	0	0	111.3	L408 I410 L414 H415 E416	L408-S412 VanDerWaalsContact O-CB 3.31Å; L408-S412 WeakPolarHBondContact O-CB 3.34Å; L408-S412 PolarHBondContact O-N 3.41Å; I410-S412 PolarHBondContact O-N 2.91Å; S412-L414 PolarHBondContact O-N 3.39Å; S412-H415 WeakPolarHBondContact O-CB 3.25Å; S412-H415 PolarHBondContact O-N 3.27Å; S412-H415 VanDerWaalsContact O-N 3.12Å; S412-E416 WeakPolarHBondContact O-CG 3.49Å; S412-E416 PolarHBondContact O-N 2.76Å; S412-E416 PolarHBondContact OG-OE1 3.47Å
413	H	91.4	Very high	89.3	Confident	25 Å²	25	74.4 Å²	74.4	12%	0.116	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-39.1	-178	-174.1	54.8	0	0	0	112.7	R409 I410 H415 E416 L417 L628 L629 E631	R409-H413 WeakPolarHBondContact O-CB 3.18Å; R409-H413 PolarHBondContact O-N 3Å; R409-H413 VanDerWaalsContact O-N 3.1Å; I410-H413 PolarHBondContact O-N 2.9Å; H413-H415 PolarHBondContact O-N 2.93Å; H413-E416 IonicContact ND1-OE2 3.94Å; H413-E416 PolarHBondContact ND1-OE2 3.35Å; H413-E416 WeakPolarHBondContact O-CA 3.39Å; H413-E416 WeakPolarHBondContact O-CB 3.33Å; H413-E416 PolarHBondContact O-N 3.38Å; H413-L417 PolarHBondContact O-N 3.49Å; H413-L628 PolarHBondContact NE2-O 2.98Å; H413-L629 HydrophobicContact CB-CD2 4.06Å; H413-E631 PolarHBondContact CE1-O 2.95Å; H413-E631 PolarHBondContact NE2-O 3.25Å
414	L	91.7	Very high	89	Confident	18 Å²	18	76.4 Å²	76.4	9%	0.094	37%	0.365	C	S	.	.	H	α-helix	trans	-58.1	-33.7	173.6	-76.1	175.5	0	0	0	112.7	I410 F411 S412 E416 L417 W421 H422 V430 L628	I410-L414 HydrophobicContact CG2-CD1 4.06Å; I410-L414 HydrophobicContact CG2-CG 4.27Å; I410-L414 WeakPolarHBondContact O-CG 3.32Å; I410-L414 PolarHBondContact O-N 3.28Å; F411-L414 PolarHBondContact O-N 3.15Å; S412-L414 PolarHBondContact O-N 3.39Å; L414-E416 VanDerWaalsContact C-N 3.32Å; L414-L417 HydrophobicContact CD2-CD1 4.07Å; L414-W421 HydrophobicContact CD2-CH2 3.85Å; L414-W421 HydrophobicContact CD2-CZ3 4.03Å; L414-H422 PolarHBondContact O-CE1 2.9Å; L414-H422 VanDerWaalsContact O-CE1 3.22Å; L414-H422 PolarHBondContact O-NE2 3.12Å; L414-V430 HydrophobicContact CD1-CG1 4.01Å; L414-V430 HydrophobicContact CD2-CG1 3.49Å; L414-V430 VanDerWaalsContact CD2-CG1 3.49Å; L414-V430 HydrophobicContact CG-CG1 4.42Å; L414-L628 HydrophobicContact CD2-CD1 3.88Å; L414-L628 HydrophobicContact CD2-CD2 4.14Å; L414-L628 HydrophobicContact CD2-CG 4.31Å
415	H	91.1	Very high	88.6	Confident	138 Å²	138	74.8 Å²	74.8	64%	0.639	36%	0.359	S	S	*	.	H	α-helix	trans	-76	-16.1	173.6	-79.2	-61.7	0	0	0	114.3	F411 S412 H413	F411-H415 AromaticContact CD1-CD2 3.86Å; F411-H415 AromaticContact CE1-CD2 3.57Å; F411-H415 AromaticContact CE1-NE2 3.25Å; F411-H415 WeakPolarHBondContact CE1-NE2 3.25Å; F411-H415 AromaticContact CZ-CD2 3.95Å; F411-H415 AromaticContact CZ-NE2 3.25Å; F411-H415 WeakPolarHBondContact CZ-NE2 3.37Å; F411-H415 PolarHBondContact O-CD2 3.25Å; F411-H415 VanDerWaalsContact O-CD2 3.31Å; F411-H415 PolarHBondContact O-N 3.43Å; S412-H415 WeakPolarHBondContact O-CB 3.25Å; S412-H415 PolarHBondContact O-N 3.27Å; S412-H415 VanDerWaalsContact O-N 3.12Å; H413-H415 PolarHBondContact O-N 2.93Å
416	E	90.2	Very high	88.3	Confident	104 Å²	104	73.6 Å²	73.6	49%	0.486	35%	0.354	S	S	.	.	H	α-helix	trans	-87.6	-18.9	175.1	-61.7	156.7	-164.5	0	0	112.4	S412 H413 L414 T633	S412-E416 WeakPolarHBondContact O-CG 3.49Å; S412-E416 PolarHBondContact O-N 2.76Å; S412-E416 PolarHBondContact OG-OE1 3.47Å; H413-E416 IonicContact ND1-OE2 3.94Å; H413-E416 PolarHBondContact ND1-OE2 3.35Å; H413-E416 WeakPolarHBondContact O-CA 3.39Å; H413-E416 WeakPolarHBondContact O-CB 3.33Å; H413-E416 PolarHBondContact O-N 3.38Å; L414-E416 VanDerWaalsContact C-N 3.32Å; E416-T633 HydrophobicContact CB-CG2 3.7Å; E416-T633 WeakPolarHBondContact O-CG2 3.35Å
417	L	91	Very high	87.9	Confident	10 Å²	10	78.6 Å²	78.6	5%	0.052	39%	0.385	C	S	.	.	S	Bend	trans	-70.5	150.9	178	-63.7	179.4	0	0	0	112.4	H413 L414 W421 L628 E631 T633	H413-L417 PolarHBondContact O-N 3.49Å; L414-L417 HydrophobicContact CD2-CD1 4.07Å; L417-W421 HydrophobicContact CB-CD2 4.23Å; L417-W421 HydrophobicContact CB-CE3 4.21Å; L417-W421 HydrophobicContact CB-CG 4.35Å; L417-W421 HydrophobicContact CD1-CD2 3.7Å; L417-W421 HydrophobicContact CD1-CE3 3.84Å; L417-W421 HydrophobicContact CD1-CG 4.35Å; L417-W421 HydrophobicContact CD1-CH2 3.94Å; L417-W421 HydrophobicContact CD1-CZ2 3.77Å; L417-W421 HydrophobicContact CD1-CZ3 3.96Å; L417-L628 HydrophobicContact CD1-CD1 4.3Å; L417-E631 HydrophobicContact CD1-CG 4.48Å; L417-E631 HydrophobicContact CD2-CB 3.98Å; L417-E631 HydrophobicContact CD2-CG 3.84Å; L417-T633 HydrophobicContact CD2-CG2 4.2Å
418	S	87.3	Confident	87.5	Confident	16 Å²	16	76.3 Å²	76.3	11%	0.112	39%	0.389	C	S	.	.			trans	-73	158.1	-170	80.7	0	0	0	0	114	R420 W421 H422 E634	S418-R420 PolarHBondContact O-N 3.45Å; S418-W421 WeakPolarHBondContact O-CB 3.34Å; S418-W421 PolarHBondContact O-N 3.3Å; S418-W421 PolarHBondContact OG-N 3.1Å; S418-H422 PolarHBondContact O-CD2 3.5Å; S418-H422 VanDerWaalsContact O-CD2 3.29Å; S418-H422 PolarHBondContact O-N 2.97Å; S418-E634 WeakPolarHBondContact CB-OE2 3.34Å; S418-E634 PolarHBondContact OG-OE2 3.35Å
419	L	87.4	Confident	86.8	Confident	48 Å²	48	74.6 Å²	74.6	25%	0.251	38%	0.378	S	S	.	.	H	α-helix	trans	-59.8	-31.9	176.8	-177.2	60.1	0	0	0	112	W421 H422 L423 F700 Y701	L419-W421 VanDerWaalsContact C-N 3.35Å; L419-H422 PolarHBondContact O-N 2.92Å; L419-L423 HydrophobicContact CD1-CD1 4.25Å; L419-L423 HydrophobicContact CD1-CG 4.17Å; L419-L423 HydrophobicContact CG-CD1 3.96Å; L419-L423 HydrophobicContact CG-CG 4.34Å; L419-L423 WeakPolarHBondContact O-CB 3.29Å; L419-L423 VanDerWaalsContact O-CG 3.32Å; L419-L423 WeakPolarHBondContact O-CG 3.38Å; L419-L423 PolarHBondContact O-N 2.8Å; L419-F700 HydrophobicContact CB-CD1 4.41Å; L419-F700 HydrophobicContact CD2-CB 4.36Å; L419-F700 HydrophobicContact CD2-CD1 4.47Å; L419-F700 HydrophobicContact CD2-CD2 4.34Å; L419-F700 HydrophobicContact CD2-CG 4.18Å; L419-Y701 HydrophobicContact CB-CE2 4.46Å; L419-Y701 HydrophobicContact CD2-CE2 4.16Å
420	R	85.8	Confident	86.6	Confident	116 Å²	116	68.1 Å²	68.1	44%	0.438	35%	0.354	S	S	.	.	H	α-helix	trans	-58.9	-46.3	173.4	-164.9	177.4	173.9	-176.5	-1.5	111.7	S418 H422 L423 G424 Y660 Y701	S418-R420 PolarHBondContact O-N 3.45Å; R420-H422 VanDerWaalsContact C-N 3.35Å; R420-L423 PolarHBondContact O-N 2.66Å; R420-G424 PolarHBondContact O-N 3Å; R420-G424 VanDerWaalsContact O-N 3.11Å; R420-Y660 PolarHBondContact NE-O 3.22Å; R420-Y660 VanDerWaalsContact NE-O 3.14Å; R420-Y660 PolarHBondContact NH1-O 3.23Å; R420-Y660 PolarHBondContact NH2-O 3.37Å; R420-Y660 VanDerWaalsContact NH2-O 3.14Å; R420-Y701 HydrophobicContact CB-CE1 3.95Å
421	W	87.9	Confident	86.3	Confident	19 Å²	19	72.1 Å²	72.1	7%	0.072	38%	0.375	C	S	.	.	H	α-helix	trans	-63.4	-41.6	-178.2	-174.3	102.9	0	0	0	111.7	L414 L417 S418 L419 R425 V430 L628 E631	L414-W421 HydrophobicContact CD2-CH2 3.85Å; L414-W421 HydrophobicContact CD2-CZ3 4.03Å; L417-W421 HydrophobicContact CB-CD2 4.23Å; L417-W421 HydrophobicContact CB-CE3 4.21Å; L417-W421 HydrophobicContact CB-CG 4.35Å; L417-W421 HydrophobicContact CD1-CD2 3.7Å; L417-W421 HydrophobicContact CD1-CE3 3.84Å; L417-W421 HydrophobicContact CD1-CG 4.35Å; L417-W421 HydrophobicContact CD1-CH2 3.94Å; L417-W421 HydrophobicContact CD1-CZ2 3.77Å; L417-W421 HydrophobicContact CD1-CZ3 3.96Å; S418-W421 WeakPolarHBondContact O-CB 3.34Å; S418-W421 PolarHBondContact O-N 3.3Å; S418-W421 PolarHBondContact OG-N 3.1Å; L419-W421 VanDerWaalsContact C-N 3.35Å; W421-R425 VanDerWaalsContact CE2-CZ 3.43Å; W421-R425 VanDerWaalsContact NE1-CZ 3.26Å; W421-V430 HydrophobicContact CH2-CB 4.28Å; W421-V430 HydrophobicContact CH2-CG1 3.64Å; W421-V430 HydrophobicContact CH2-CG2 3.58Å; W421-V430 HydrophobicContact CZ3-CG1 4.02Å; W421-V430 HydrophobicContact CZ3-CG2 3.95Å; W421-L628 HydrophobicContact CH2-CD1 3.53Å; W421-L628 HydrophobicContact CZ2-CD1 3.31Å; W421-E631 VanDerWaalsContact CD1-CD 3.42Å; W421-E631 VanDerWaalsContact NE1-CG 3.27Å; W421-E631 PolarHBondContact NE1-OE2 3.16Å
422	H	88.5	Confident	85.9	Confident	66 Å²	66	69.2 Å²	69.2	31%	0.306	36%	0.361	S	S	.	.	H	α-helix	trans	-68.8	-44.7	177.1	-75.6	-70.1	0	0	0	112.8	L414 S418 L419 R420 G424 R425	L414-H422 PolarHBondContact O-CE1 2.9Å; L414-H422 VanDerWaalsContact O-CE1 3.22Å; L414-H422 PolarHBondContact O-NE2 3.12Å; S418-H422 PolarHBondContact O-CD2 3.5Å; S418-H422 VanDerWaalsContact O-CD2 3.29Å; S418-H422 PolarHBondContact O-N 2.97Å; L419-H422 PolarHBondContact O-N 2.92Å; R420-H422 VanDerWaalsContact C-N 3.35Å; H422-G424 VanDerWaalsContact C-N 3.25Å; H422-G424 PolarHBondContact O-N 3.19Å; H422-R425 PolarHBondContact O-N 3.03Å
423	L	85.6	Confident	85.5	Confident	124 Å²	124	68.5 Å²	68.5	65%	0.649	35%	0.352	S	S	*	.	H	α-helix	trans	-66.7	-26.2	178.2	-69.8	172.6	0	0	0	113.2	L419 R420 R425	L419-L423 HydrophobicContact CD1-CD1 4.25Å; L419-L423 HydrophobicContact CD1-CG 4.17Å; L419-L423 HydrophobicContact CG-CD1 3.96Å; L419-L423 HydrophobicContact CG-CG 4.34Å; L419-L423 WeakPolarHBondContact O-CB 3.29Å; L419-L423 VanDerWaalsContact O-CG 3.32Å; L419-L423 WeakPolarHBondContact O-CG 3.38Å; L419-L423 PolarHBondContact O-N 2.8Å; R420-L423 PolarHBondContact O-N 2.66Å; L423-R425 VanDerWaalsContact C-N 3.35Å
424	G	81.3	Confident	85.3	Confident	67 Å²	67	67.6 Å²	67.6	69%	0.691	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-6.7	177.7	0	0	0	0	0	115.3	R420 H422	R420-G424 PolarHBondContact O-N 3Å; R420-G424 VanDerWaalsContact O-N 3.11Å; H422-G424 VanDerWaalsContact C-N 3.25Å; H422-G424 PolarHBondContact O-N 3.19Å
425	R	81.3	Confident	85	Confident	112 Å²	112	70.6 Å²	70.6	42%	0.423	37%	0.365	S	S	.	.	S	Bend	trans	-131.7	158.6	-176	-70.8	-174.4	178.3	85.5	-21.7	111.9	W421 H422 L423 V430 E631	W421-R425 VanDerWaalsContact CE2-CZ 3.43Å; W421-R425 VanDerWaalsContact NE1-CZ 3.26Å; H422-R425 PolarHBondContact O-N 3.03Å; L423-R425 VanDerWaalsContact C-N 3.35Å; R425-V430 HydrophobicContact CB-CG2 3.97Å; R425-E631 IonicContact CZ-OE2 2.68Å; R425-E631 IonicContact NH2-OE2 2.72Å; R425-E631 PolarHBondContact NH2-OE2 3.23Å
426	R	81.1	Confident	84.8	Confident	137 Å²	137	69.1 Å²	69.1	52%	0.517	35%	0.354	S	S	.	.			trans	-85.4	121	172.9	-67.2	178.1	179.1	155.3	3.2	109.4	G428 E429 V430	R426-G428 VanDerWaalsContact C-N 3.25Å; R426-G428 PolarHBondContact O-N 2.97Å; R426-G428 VanDerWaalsContact O-N 3.17Å; R426-E429 HydrophobicContact CB-CB 4.25Å; R426-E429 WeakPolarHBondContact O-CB 3.45Å; R426-E429 PolarHBondContact O-N 3.22Å; R426-V430 PolarHBondContact O-N 3.4Å
427	T	79.6	Confident	84.6	Confident	110 Å²	110	64.1 Å²	64.1	68%	0.675	33%	0.331	S	S	*	.	H	α-helix	trans	-53.5	-39.9	-176.8	-42.6	0	0	0	0	113.2	E429 V430 L431	T427-E429 VanDerWaalsContact C-N 3.32Å; T427-E429 PolarHBondContact O-N 3.19Å; T427-V430 PolarHBondContact O-N 3.38Å; T427-L431 WeakPolarHBondContact O-CB 2.99Å; T427-L431 PolarHBondContact O-N 3.26Å
428	G	80	Confident	84.5	Confident	54 Å²	54	64 Å²	64	56%	0.557	33%	0.33	S	S	*	.	H	α-helix	trans	-66.2	-28.1	177	0	0	0	0	0	114.5	R426 R432	R426-G428 VanDerWaalsContact C-N 3.25Å; R426-G428 PolarHBondContact O-N 2.97Å; R426-G428 VanDerWaalsContact O-N 3.17Å; G428-R432 WeakPolarHBondContact O-CB 3.46Å; G428-R432 PolarHBondContact O-N 2.56Å; G428-R432 VanDerWaalsContact O-N 3.12Å
429	E	77.8	Confident	84.4	Confident	74 Å²	74	66.9 Å²	66.9	35%	0.346	35%	0.351	S	S	.	.	H	α-helix	trans	-72.9	-44	173.7	-172.7	-177.5	168.9	0	0	110.6	R426 T427 R432 I433	R426-E429 HydrophobicContact CB-CB 4.25Å; R426-E429 WeakPolarHBondContact O-CB 3.45Å; R426-E429 PolarHBondContact O-N 3.22Å; T427-E429 VanDerWaalsContact C-N 3.32Å; T427-E429 PolarHBondContact O-N 3.19Å; E429-R432 PolarHBondContact O-N 3.1Å; E429-I433 HydrophobicContact CG-CD1 4.37Å; E429-I433 WeakPolarHBondContact O-CG1 3.34Å; E429-I433 PolarHBondContact O-N 3.4Å
430	V	86	Confident	84.4	Confident	13 Å²	13	64.9 Å²	64.9	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-60.6	-48.7	176.4	172.8	0	0	0	0	111.4	L414 W421 R425 R426 T427 R432 I433 A434	L414-V430 HydrophobicContact CD1-CG1 4.01Å; L414-V430 HydrophobicContact CD2-CG1 3.49Å; L414-V430 VanDerWaalsContact CD2-CG1 3.49Å; L414-V430 HydrophobicContact CG-CG1 4.42Å; W421-V430 HydrophobicContact CH2-CB 4.28Å; W421-V430 HydrophobicContact CH2-CG1 3.64Å; W421-V430 HydrophobicContact CH2-CG2 3.58Å; W421-V430 HydrophobicContact CZ3-CG1 4.02Å; W421-V430 HydrophobicContact CZ3-CG2 3.95Å; R425-V430 HydrophobicContact CB-CG2 3.97Å; R426-V430 PolarHBondContact O-N 3.4Å; T427-V430 PolarHBondContact O-N 3.38Å; V430-R432 VanDerWaalsContact C-N 3.34Å; V430-R432 PolarHBondContact O-N 3.46Å; V430-I433 PolarHBondContact O-N 3.48Å; V430-I433 VanDerWaalsContact O-N 3.16Å; V430-A434 PolarHBondContact O-N 3.1Å
431	L	84.7	Confident	84.4	Confident	87 Å²	87	59.5 Å²	59.5	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-61.3	-44	177.9	-174.5	61.8	0	0	0	111	T427 I433 A434 D435	T427-L431 WeakPolarHBondContact O-CB 2.99Å; T427-L431 PolarHBondContact O-N 3.26Å; L431-I433 VanDerWaalsContact C-N 3.29Å; L431-I433 PolarHBondContact O-N 3.32Å; L431-A434 WeakPolarHBondContact O-CA 3.5Å; L431-A434 WeakPolarHBondContact O-CB 3.43Å; L431-A434 PolarHBondContact O-N 3.42Å; L431-D435 VanDerWaalsContact O-CG 3.3Å; L431-D435 PolarHBondContact O-N 3.5Å
432	R	82.5	Confident	84.2	Confident	57 Å²	57	59 Å²	59	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-32.9	174.8	174.6	169.1	157.8	164.9	-10.6	113.4	S289 G428 E429 V430 R436	S289-R432 PolarHBondContact OG-NH2 3.31Å; G428-R432 WeakPolarHBondContact O-CB 3.46Å; G428-R432 PolarHBondContact O-N 2.56Å; G428-R432 VanDerWaalsContact O-N 3.12Å; E429-R432 PolarHBondContact O-N 3.1Å; V430-R432 VanDerWaalsContact C-N 3.34Å; V430-R432 PolarHBondContact O-N 3.46Å; R432-R436 HydrophobicContact CG-CG 4.42Å; R432-R436 WeakPolarHBondContact O-CB 3.5Å; R432-R436 WeakPolarHBondContact O-CG 3.48Å; R432-R436 PolarHBondContact O-N 3.13Å
433	I	84.4	Confident	84.1	Confident	43 Å²	43	56.5 Å²	56.5	22%	0.221	31%	0.312	C	S	.	.	H	α-helix	trans	-68.6	-42.1	172.1	-68.6	163.1	0	0	0	110.5	E429 V430 L431 G437 N624 L628	E429-I433 HydrophobicContact CG-CD1 4.37Å; E429-I433 WeakPolarHBondContact O-CG1 3.34Å; E429-I433 PolarHBondContact O-N 3.4Å; V430-I433 PolarHBondContact O-N 3.48Å; V430-I433 VanDerWaalsContact O-N 3.16Å; L431-I433 VanDerWaalsContact C-N 3.29Å; L431-I433 PolarHBondContact O-N 3.32Å; I433-G437 PolarHBondContact O-N 3.49Å; I433-N624 HydrophobicContact CG2-CB 4.07Å; I433-L628 HydrophobicContact CG2-CD2 4.23Å
434	A	86.7	Confident	84.1	Confident	7 Å²	7	50.6 Å²	50.6	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-63.6	-47	176.7	0	0	0	0	0	112.6	I410 V430 L431 G437 T438	I410-A434 HydrophobicContact CG2-CB 3.61Å; V430-A434 PolarHBondContact O-N 3.1Å; L431-A434 WeakPolarHBondContact O-CA 3.5Å; L431-A434 WeakPolarHBondContact O-CB 3.43Å; L431-A434 PolarHBondContact O-N 3.42Å; A434-G437 PolarHBondContact O-N 3.14Å; A434-T438 WeakPolarHBondContact O-CB 3.24Å; A434-T438 PolarHBondContact O-N 2.89Å; A434-T438 PolarHBondContact O-OG1 3.11Å
435	D	85.8	Confident	84.1	Confident	81 Å²	81	48.1 Å²	48.1	43%	0.433	25%	0.252	S	S	.	.	H	α-helix	trans	-66.2	-47.9	-179.5	-65.1	-22.4	0	0	0	111.5	L431 G437 T438 S439	L431-D435 VanDerWaalsContact O-CG 3.3Å; L431-D435 PolarHBondContact O-N 3.5Å; D435-G437 VanDerWaalsContact C-N 3.34Å; D435-G437 PolarHBondContact O-N 2.93Å; D435-T438 PolarHBondContact O-N 2.86Å; D435-S439 WeakPolarHBondContact O-CB 3.23Å; D435-S439 PolarHBondContact O-N 3.48Å
436	R	86.4	Confident	84.3	Confident	106 Å²	106	43.8 Å²	43.8	40%	0.4	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-39.6	176.2	-72.9	178.8	177	-146.7	-5.9	111.7	R432 S440 D621	R432-R436 HydrophobicContact CG-CG 4.42Å; R432-R436 WeakPolarHBondContact O-CB 3.5Å; R432-R436 WeakPolarHBondContact O-CG 3.48Å; R432-R436 PolarHBondContact O-N 3.13Å; R436-S440 WeakPolarHBondContact O-CA 3.49Å; R436-S440 WeakPolarHBondContact O-CB 3.26Å; R436-S440 PolarHBondContact O-N 3.14Å; R436-S440 PolarHBondContact O-OG 3.34Å; R436-D621 HydrophobicContact CB-CB 4.21Å
437	G	86.4	Confident	84.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.7	-50.1	173.4	0	0	0	0	0	112.2	I433 A434 D435 S440 V441	I433-G437 PolarHBondContact O-N 3.49Å; A434-G437 PolarHBondContact O-N 3.14Å; D435-G437 VanDerWaalsContact C-N 3.34Å; D435-G437 PolarHBondContact O-N 2.93Å; G437-S440 WeakPolarHBondContact O-CB 3.46Å; G437-S440 PolarHBondContact O-N 3.05Å; G437-V441 WeakPolarHBondContact O-CG2 3.28Å; G437-V441 PolarHBondContact O-N 3.17Å
438	T	87.1	Confident	85	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-48.6	-179.9	-57.7	0	0	0	0	111.9	S403 V406 E407 A434 D435 S440 V441 T442	S403-T438 WeakPolarHBondContact OG-CG2 3.45Å; V406-T438 HydrophobicContact CB-CG2 4.35Å; V406-T438 HydrophobicContact CG1-CG2 4.22Å; E407-T438 HydrophobicContact CB-CG2 4.18Å; A434-T438 WeakPolarHBondContact O-CB 3.24Å; A434-T438 PolarHBondContact O-N 2.89Å; A434-T438 PolarHBondContact O-OG1 3.11Å; D435-T438 PolarHBondContact O-N 2.86Å; T438-S440 VanDerWaalsContact C-N 3.31Å; T438-S440 PolarHBondContact O-N 2.85Å; T438-V441 PolarHBondContact O-N 3.22Å; T438-T442 PolarHBondContact O-N 3.05Å
439	S	86.2	Confident	85.2	Confident	78 Å²	78	34.3 Å²	34.3	55%	0.545	18%	0.177	S	C	.	.	H	α-helix	trans	-60.5	-41.1	174.1	-174.8	0	0	0	0	111.5	D435 T442 G443	D435-S439 WeakPolarHBondContact O-CB 3.23Å; D435-S439 PolarHBondContact O-N 3.48Å; S439-T442 PolarHBondContact O-N 3.14Å; S439-T442 PolarHBondContact O-OG1 2.93Å; S439-T442 VanDerWaalsContact O-OG1 3.07Å; S439-G443 PolarHBondContact O-N 3.38Å
440	S	87.3	Confident	85.6	Confident	5 Å²	5	32 Å²	32	4%	0.035	17%	0.166	C	C	.	.	H	α-helix	trans	-65.2	-42.3	178.8	-71.6	0	0	0	0	113.3	R436 G437 T438 T442 G443 L444 N618 D621	R436-S440 WeakPolarHBondContact O-CA 3.49Å; R436-S440 WeakPolarHBondContact O-CB 3.26Å; R436-S440 PolarHBondContact O-N 3.14Å; R436-S440 PolarHBondContact O-OG 3.34Å; G437-S440 WeakPolarHBondContact O-CB 3.46Å; G437-S440 PolarHBondContact O-N 3.05Å; T438-S440 VanDerWaalsContact C-N 3.31Å; T438-S440 PolarHBondContact O-N 2.85Å; S440-T442 PolarHBondContact O-N 3.25Å; S440-G443 PolarHBondContact O-N 2.94Å; S440-L444 WeakPolarHBondContact O-CB 3.42Å; S440-L444 PolarHBondContact O-N 3.14Å; S440-N618 WeakPolarHBondContact CB-O 3.2Å; S440-N618 PolarHBondContact O-ND2 3.29Å; S440-N618 WeakPolarHBondContact OG-CA 3.16Å; S440-D621 VanDerWaalsContact OG-CB 3.31Å; S440-D621 WeakPolarHBondContact OG-CB 3.19Å
441	V	85.5	Confident	85.6	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-58	-48.4	174.7	167.2	0	0	0	0	110.6	L310 V406 G437 T438 L445 M622 M625	L310-V441 HydrophobicContact CD2-CG1 4.01Å; L310-V441 HydrophobicContact CD2-CG2 4.48Å; V406-V441 HydrophobicContact CG2-CG1 4.48Å; G437-V441 WeakPolarHBondContact O-CG2 3.28Å; G437-V441 PolarHBondContact O-N 3.17Å; T438-V441 PolarHBondContact O-N 3.22Å; V441-L445 VanDerWaalsContact O-CB 3.22Å; V441-L445 WeakPolarHBondContact O-CB 3.49Å; V441-L445 PolarHBondContact O-N 3.4Å; V441-M622 HydrophobicContact CG2-CB 4.43Å; V441-M622 HydrophobicContact CG2-CG 3.74Å; V441-M622 HydrophobicContact CG2-SD 4.25Å; V441-M625 HydrophobicContact CG2-CE 4.06Å; V441-M625 HydrophobicContact CG2-SD 4.12Å
442	T	84.4	Confident	85.8	Confident	10 Å²	10	30.1 Å²	30.1	6%	0.061	16%	0.157	C	C	.	.	H	α-helix	trans	-72.4	-37.7	-178.5	65	0	0	0	0	113.1	Q399 T438 S439 S440 S446	Q399-T442 HydrophobicContact CG-CG2 4.13Å; T438-T442 PolarHBondContact O-N 3.05Å; S439-T442 PolarHBondContact O-N 3.14Å; S439-T442 PolarHBondContact O-OG1 2.93Å; S439-T442 VanDerWaalsContact O-OG1 3.07Å; S440-T442 PolarHBondContact O-N 3.25Å; T442-S446 WeakPolarHBondContact O-CB 3.37Å; T442-S446 PolarHBondContact O-N 3.07Å; T442-S446 VanDerWaalsContact O-N 3.11Å; T442-S446 PolarHBondContact O-OG 2.94Å
443	G	85.8	Confident	86.2	Confident	13 Å²	13	31.8 Å²	31.8	13%	0.134	17%	0.169	C	C	.	.	H	α-helix	trans	-68.5	-49.4	177.2	0	0	0	0	0	112.4	S439 S440 L445 S446 Y447	S439-G443 PolarHBondContact O-N 3.38Å; S440-G443 PolarHBondContact O-N 2.94Å; G443-L445 VanDerWaalsContact C-N 3.29Å; G443-L445 PolarHBondContact O-N 3.42Å; G443-S446 PolarHBondContact O-N 3.48Å; G443-S446 VanDerWaalsContact O-N 3.1Å; G443-Y447 WeakPolarHBondContact O-CD2 3.47Å; G443-Y447 VanDerWaalsContact O-CG 3.31Å; G443-Y447 PolarHBondContact O-N 3.45Å
444	L	85.6	Confident	86.4	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-42.4	179.7	-179.3	152.4	0	0	0	110.9	L310 S440 Y447 L448 N618 F619	L310-L444 HydrophobicContact CD1-CD2 3.42Å; L310-L444 VanDerWaalsContact CD1-CD2 3.42Å; S440-L444 WeakPolarHBondContact O-CB 3.42Å; S440-L444 PolarHBondContact O-N 3.14Å; L444-Y447 PolarHBondContact O-N 3.05Å; L444-L448 HydrophobicContact CD2-CD1 3.56Å; L444-L448 HydrophobicContact CD2-CG 4.3Å; L444-L448 HydrophobicContact CG-CD1 4.26Å; L444-L448 WeakPolarHBondContact O-CB 3.41Å; L444-L448 WeakPolarHBondContact O-CG 3.42Å; L444-L448 PolarHBondContact O-N 3.45Å; L444-N618 HydrophobicContact CB-CB 3.8Å; L444-N618 HydrophobicContact CD1-CB 3.96Å; L444-N618 HydrophobicContact CG-CB 4.44Å; L444-N618 PolarHBondContact N-ND2 3.05Å; L444-N618 VanDerWaalsContact N-ND2 3.19Å; L444-F619 HydrophobicContact CD1-CB 4.39Å; L444-F619 HydrophobicContact CD1-CD1 3.68Å; L444-F619 HydrophobicContact CD1-CD2 3.79Å; L444-F619 HydrophobicContact CD1-CE1 3.75Å; L444-F619 HydrophobicContact CD1-CE2 3.87Å; L444-F619 HydrophobicContact CD1-CG 3.68Å; L444-F619 HydrophobicContact CD1-CZ 3.83Å; L444-F619 HydrophobicContact CD2-CE1 4.49Å; L444-F619 HydrophobicContact CD2-CZ 4.36Å
445	L	82.1	Confident	86.5	Confident	15 Å²	15	30.3 Å²	30.3	8%	0.079	16%	0.161	C	C	.	.	H	α-helix	trans	-56.7	-51.1	172.9	172.2	55.4	0	0	0	111.7	L314 W395 V441 G443 Y447 L448 V449	L314-L445 HydrophobicContact CD1-CD1 3.38Å; L314-L445 HydrophobicContact CD2-CD1 3.9Å; L314-L445 HydrophobicContact CD2-CD2 4.34Å; L314-L445 HydrophobicContact CG-CD1 3.35Å; L314-L445 HydrophobicContact CG-CD2 3.85Å; L314-L445 HydrophobicContact CG-CG 4.24Å; W395-L445 HydrophobicContact CH2-CD2 3.96Å; W395-L445 HydrophobicContact CH2-CG 4.27Å; W395-L445 HydrophobicContact CZ2-CD2 3.67Å; W395-L445 HydrophobicContact CZ2-CG 3.85Å; V441-L445 VanDerWaalsContact O-CB 3.22Å; V441-L445 WeakPolarHBondContact O-CB 3.49Å; V441-L445 PolarHBondContact O-N 3.4Å; G443-L445 VanDerWaalsContact C-N 3.29Å; G443-L445 PolarHBondContact O-N 3.42Å; L445-Y447 PolarHBondContact O-N 3.2Å; L445-L448 PolarHBondContact O-N 3.28Å; L445-V449 HydrophobicContact CD1-CG2 3.62Å; L445-V449 WeakPolarHBondContact O-CB 3.14Å; L445-V449 WeakPolarHBondContact O-CG2 3.46Å; L445-V449 PolarHBondContact O-N 3.1Å
446	S	85.4	Confident	86.8	Confident	20 Å²	20	30.2 Å²	30.2	14%	0.14	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-37.8	-177.8	-56	0	0	0	0	112.2	W395 T442 G443 F450	W395-S446 PolarHBondContact NE1-OG 3.11Å; T442-S446 WeakPolarHBondContact O-CB 3.37Å; T442-S446 PolarHBondContact O-N 3.07Å; T442-S446 VanDerWaalsContact O-N 3.11Å; T442-S446 PolarHBondContact O-OG 2.94Å; G443-S446 PolarHBondContact O-N 3.48Å; G443-S446 VanDerWaalsContact O-N 3.1Å; S446-F450 WeakPolarHBondContact O-CB 3.46Å; S446-F450 WeakPolarHBondContact O-CD2 3.4Å; S446-F450 PolarHBondContact O-N 3.22Å; S446-F450 VanDerWaalsContact O-N 3.09Å
447	Y	87.3	Confident	87.1	Confident	67 Å²	67	26.8 Å²	26.8	26%	0.263	16%	0.155	S	C	.	.	H	α-helix	trans	-68.6	-44.3	175.7	-63.6	-47.2	0	0	0	112.5	G443 L444 L445 N451 V452 Y611 M614	G443-Y447 WeakPolarHBondContact O-CD2 3.47Å; G443-Y447 VanDerWaalsContact O-CG 3.31Å; G443-Y447 PolarHBondContact O-N 3.45Å; L444-Y447 PolarHBondContact O-N 3.05Å; L445-Y447 PolarHBondContact O-N 3.2Å; Y447-N451 WeakPolarHBondContact O-CA 3.39Å; Y447-N451 WeakPolarHBondContact O-CB 3.39Å; Y447-N451 PolarHBondContact O-N 2.92Å; Y447-V452 PolarHBondContact O-N 3.12Å; Y447-Y611 AromaticContact CD1-CD1 3.63Å; Y447-Y611 HydrophobicContact CD1-CD1 3.63Å; Y447-Y611 AromaticContact CD1-CE1 3.67Å; Y447-Y611 HydrophobicContact CD1-CE1 3.67Å; Y447-Y611 HydrophobicContact CE1-CD1 4.05Å; Y447-Y611 AromaticContact CE1-CE1 3.87Å; Y447-Y611 HydrophobicContact CE1-CE1 3.87Å; Y447-Y611 HydrophobicContact CG-CD1 4.22Å; Y447-M614 HydrophobicContact CD2-CB 4.11Å; Y447-M614 HydrophobicContact CE1-SD 4.05Å; Y447-M614 HydrophobicContact CE2-CB 3.92Å; Y447-M614 HydrophobicContact CE2-CG 4.34Å; Y447-M614 HydrophobicContact CE2-SD 3.86Å; Y447-M614 VanDerWaalsContact CZ-SD 3.56Å
448	L	86.9	Confident	87.3	Confident	12 Å²	12	27.2 Å²	27.2	6%	0.063	16%	0.157	C	C	.	.	I	π-helix	trans	-66.4	-49.7	178.8	-72.6	-179.7	0	0	0	112	F303 L307 L444 L445 V452 I453 I615	F303-L448 HydrophobicContact CZ-CD1 4.38Å; L307-L448 HydrophobicContact CD1-CD1 3.71Å; L444-L448 HydrophobicContact CD2-CD1 3.56Å; L444-L448 HydrophobicContact CD2-CG 4.3Å; L444-L448 HydrophobicContact CG-CD1 4.26Å; L444-L448 WeakPolarHBondContact O-CB 3.41Å; L444-L448 WeakPolarHBondContact O-CG 3.42Å; L444-L448 PolarHBondContact O-N 3.45Å; L445-L448 PolarHBondContact O-N 3.28Å; L448-V452 HydrophobicContact CD2-CB 4.24Å; L448-V452 HydrophobicContact CD2-CG1 4.48Å; L448-V452 HydrophobicContact CD2-CG2 4.27Å; L448-I453 WeakPolarHBondContact O-CB 3.39Å; L448-I453 WeakPolarHBondContact O-CG1 3.42Å; L448-I453 PolarHBondContact O-N 3.28Å; L448-I615 HydrophobicContact CD2-CD1 3.73Å; L448-I615 HydrophobicContact CD2-CG1 4.32Å; L448-I615 HydrophobicContact CG-CD1 4.46Å
449	V	85.6	Confident	87.5	Confident	24 Å²	24	28 Å²	28	15%	0.145	16%	0.161	C	C	.	.	I	π-helix	trans	-74.3	-35.8	-173.2	177.7	0	0	0	0	112.5	M333 L445 P454	M333-V449 HydrophobicContact SD-CG1 4.44Å; M333-V449 VanDerWaalsContact SD-O 3.36Å; L445-V449 HydrophobicContact CD1-CG2 3.62Å; L445-V449 WeakPolarHBondContact O-CB 3.14Å; L445-V449 WeakPolarHBondContact O-CG2 3.46Å; L445-V449 PolarHBondContact O-N 3.1Å; V449-P454 WeakPolarHBondContact O-CD 3.1Å; V449-P454 WeakPolarHBondContact O-CG 3.33Å
450	F	84.8	Confident	87.9	Confident	24 Å²	24	28 Å²	28	11%	0.105	16%	0.158	C	C	.	.	I	π-helix	trans	-106.4	-13.8	-173.7	-55.2	-48.4	0	0	0	115.9	M333 R391 W395 S446	M333-F450 HydrophobicContact SD-CD1 4.46Å; R391-F450 HydrophobicContact CG-CE1 4.45Å; W395-F450 HydrophobicContact CB-CE2 4.32Å; W395-F450 HydrophobicContact CB-CZ 4.34Å; W395-F450 AromaticContact CD1-CE2 3.66Å; W395-F450 AromaticContact CD2-CE2 3.51Å; W395-F450 HydrophobicContact CD2-CE2 3.51Å; W395-F450 AromaticContact CD2-CZ 3.49Å; W395-F450 HydrophobicContact CD2-CZ 3.49Å; W395-F450 VanDerWaalsContact CD2-CZ 3.49Å; W395-F450 AromaticContact CE2-CE2 3.55Å; W395-F450 AromaticContact CE2-CZ 3.89Å; W395-F450 HydrophobicContact CE3-CE2 4.13Å; W395-F450 AromaticContact CE3-CZ 3.61Å; W395-F450 HydrophobicContact CE3-CZ 3.61Å; W395-F450 AromaticContact CG-CE2 3.57Å; W395-F450 HydrophobicContact CG-CE2 3.57Å; W395-F450 AromaticContact CG-CZ 3.82Å; W395-F450 HydrophobicContact CG-CZ 3.82Å; W395-F450 HydrophobicContact CH2-CZ 4.41Å; W395-F450 HydrophobicContact CZ2-CE2 4.16Å; W395-F450 HydrophobicContact CZ2-CZ 4.34Å; W395-F450 HydrophobicContact CZ3-CZ 4.07Å; W395-F450 AromaticContact NE1-CE2 3.62Å; S446-F450 WeakPolarHBondContact O-CB 3.46Å; S446-F450 WeakPolarHBondContact O-CD2 3.4Å; S446-F450 PolarHBondContact O-N 3.22Å; S446-F450 VanDerWaalsContact O-N 3.09Å
451	N	87.6	Confident	88.2	Confident	43 Å²	43	30.7 Å²	30.7	23%	0.23	17%	0.171	C	C	.	.	I	π-helix	trans	-118.1	-58.4	177.7	-63	-85.3	0	0	0	111.4	Y447 T455 Y611	Y447-N451 WeakPolarHBondContact O-CA 3.39Å; Y447-N451 WeakPolarHBondContact O-CB 3.39Å; Y447-N451 PolarHBondContact O-N 2.92Å; N451-T455 VanDerWaalsContact O-CB 3.3Å; N451-T455 WeakPolarHBondContact O-CB 3.46Å; N451-T455 WeakPolarHBondContact O-CG2 3.34Å; N451-T455 PolarHBondContact O-N 2.96Å; N451-T455 VanDerWaalsContact O-N 3.11Å; N451-T455 PolarHBondContact O-OG1 3.46Å; N451-Y611 HydrophobicContact CB-CD2 3.89Å; N451-Y611 HydrophobicContact CB-CE1 4.45Å; N451-Y611 HydrophobicContact CB-CE2 3.59Å; N451-Y611 HydrophobicContact CB-CG 4.43Å; N451-Y611 VanDerWaalsContact CG-CZ 3.48Å; N451-Y611 VanDerWaalsContact OD1-CZ 3.3Å; N451-Y611 PolarHBondContact OD1-OH 3.22Å
452	V	88.9	Confident	88.5	Confident	18 Å²	18	30.5 Å²	30.5	11%	0.109	17%	0.17	C	C	.	.	I	π-helix	trans	-69.3	-53.9	-173.2	179.3	0	0	0	0	112.9	Y447 L448 T455 L456 F608 I615	Y447-V452 PolarHBondContact O-N 3.12Å; L448-V452 HydrophobicContact CD2-CB 4.24Å; L448-V452 HydrophobicContact CD2-CG1 4.48Å; L448-V452 HydrophobicContact CD2-CG2 4.27Å; V452-T455 PolarHBondContact O-N 3.05Å; V452-T455 PolarHBondContact O-OG1 3.42Å; V452-T455 VanDerWaalsContact O-OG1 3.05Å; V452-L456 HydrophobicContact CG1-CD1 3.94Å; V452-L456 WeakPolarHBondContact O-CG 3.3Å; V452-L456 PolarHBondContact O-N 3.42Å; V452-L456 VanDerWaalsContact O-N 3.08Å; V452-F608 HydrophobicContact CG1-CE2 4.31Å; V452-F608 HydrophobicContact CG2-CE2 4.42Å; V452-I615 HydrophobicContact CG2-CD1 3.59Å
453	I	89.6	Confident	88.9	Confident	93 Å²	93	31.9 Å²	31.9	48%	0.477	18%	0.176	S	C	.	.	H	α-helix	trans	-61.1	-46.4	180	-67.2	168.7	0	0	0	111.4	L448 T455 L456 A457	L448-I453 WeakPolarHBondContact O-CB 3.39Å; L448-I453 WeakPolarHBondContact O-CG1 3.42Å; L448-I453 PolarHBondContact O-N 3.28Å; I453-T455 PolarHBondContact O-N 3.02Å; I453-L456 PolarHBondContact O-N 3.03Å; I453-A457 WeakPolarHBondContact O-CB 3.39Å; I453-A457 PolarHBondContact O-N 2.91Å
454	P	89.2	Confident	89.3	Confident	4 Å²	4	35.4 Å²	35.4	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-70.1	-28.1	-177.7	-23.5	38.2	0	0	0	113.9	M333 R337 V449 D458	M333-P454 HydrophobicContact CG-CG 4.12Å; M333-P454 HydrophobicContact SD-CG 3.72Å; R337-P454 VanDerWaalsContact NH1-C 3.26Å; R337-P454 PolarHBondContact NH1-O 2.97Å; V449-P454 WeakPolarHBondContact O-CD 3.1Å; V449-P454 WeakPolarHBondContact O-CG 3.33Å; P454-D458 PolarHBondContact O-N 3.5Å
455	T	89.3	Confident	89.7	Confident	14 Å²	14	36.2 Å²	36.2	9%	0.086	19%	0.194	C	C	.	.	H	α-helix	trans	-76.9	-40	176.3	51.9	0	0	0	0	112.4	N451 V452 I453 A457 D458 I459 P604	N451-T455 VanDerWaalsContact O-CB 3.3Å; N451-T455 WeakPolarHBondContact O-CB 3.46Å; N451-T455 WeakPolarHBondContact O-CG2 3.34Å; N451-T455 PolarHBondContact O-N 2.96Å; N451-T455 VanDerWaalsContact O-N 3.11Å; N451-T455 PolarHBondContact O-OG1 3.46Å; V452-T455 PolarHBondContact O-N 3.05Å; V452-T455 PolarHBondContact O-OG1 3.42Å; V452-T455 VanDerWaalsContact O-OG1 3.05Å; I453-T455 PolarHBondContact O-N 3.02Å; T455-A457 VanDerWaalsContact C-N 3.26Å; T455-A457 PolarHBondContact O-N 2.81Å; T455-D458 PolarHBondContact O-N 2.87Å; T455-I459 VanDerWaalsContact O-CG1 3.3Å; T455-I459 WeakPolarHBondContact O-CG1 3.43Å; T455-I459 PolarHBondContact O-N 3.34Å; T455-P604 HydrophobicContact CG2-CB 3.26Å; T455-P604 HydrophobicContact CG2-CG 4.05Å
456	L	91.1	Very high	90.2	Very high	79 Å²	79	35.5 Å²	35.5	41%	0.414	19%	0.191	S	C	.	.	H	α-helix	trans	-60.6	-39.5	169.3	-68.1	173.4	0	0	0	111	V452 I453 I459 V460	V452-L456 HydrophobicContact CG1-CD1 3.94Å; V452-L456 WeakPolarHBondContact O-CG 3.3Å; V452-L456 PolarHBondContact O-N 3.42Å; V452-L456 VanDerWaalsContact O-N 3.08Å; I453-L456 PolarHBondContact O-N 3.03Å; L456-I459 PolarHBondContact O-N 2.73Å; L456-V460 WeakPolarHBondContact O-CG2 3.47Å; L456-V460 PolarHBondContact O-N 3.38Å; L456-V460 VanDerWaalsContact O-N 3.07Å
457	A	92.5	Very high	90.5	Very high	35 Å²	35	37.1 Å²	37.1	29%	0.289	20%	0.202	S	C	.	.	H	α-helix	trans	-64.2	-45.3	173.1	0	0	0	0	0	112.7	I453 T455 I459 V460 I461	I453-A457 WeakPolarHBondContact O-CB 3.39Å; I453-A457 PolarHBondContact O-N 2.91Å; T455-A457 VanDerWaalsContact C-N 3.26Å; T455-A457 PolarHBondContact O-N 2.81Å; A457-I459 VanDerWaalsContact C-N 3.31Å; A457-I459 PolarHBondContact O-N 3.02Å; A457-V460 PolarHBondContact O-N 3.04Å; A457-I461 WeakPolarHBondContact O-CB 3.35Å; A457-I461 WeakPolarHBondContact O-CD1 3.38Å; A457-I461 WeakPolarHBondContact O-CG1 3.37Å; A457-I461 PolarHBondContact O-N 3.16Å
458	D	90.9	Very high	90.7	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.043	22%	0.22	C	C	.	.	H	α-helix	trans	-56.6	-43.7	175.2	-79.8	-28	0	0	0	111.5	R337 N340 P454 T455 G462 L601	R337-D458 WeakPolarHBondContact CD-OD1 3.45Å; R337-D458 IonicContact CZ-OD1 3.59Å; R337-D458 IonicContact CZ-OD2 3.34Å; R337-D458 IonicContact NE-OD1 3.58Å; R337-D458 IonicContact NH1-OD1 3.03Å; R337-D458 PolarHBondContact NH1-OD1 2.74Å; R337-D458 IonicContact NH1-OD2 3.97Å; R337-D458 PolarHBondContact NH1-OD2 2.88Å; R337-D458 IonicContact NH2-OD2 2.73Å; N340-D458 PolarHBondContact ND2-OD1 3.17Å; N340-D458 VanDerWaalsContact ND2-OD1 3.12Å; N340-D458 PolarHBondContact ND2-OD2 2.68Å; P454-D458 PolarHBondContact O-N 3.5Å; T455-D458 PolarHBondContact O-N 2.87Å; D458-G462 PolarHBondContact O-N 2.91Å; D458-L601 HydrophobicContact CB-CD2 3.96Å; D458-L601 WeakPolarHBondContact O-CD2 3.34Å
459	I	92	Very high	90.7	Very high	22 Å²	22	45.6 Å²	45.6	11%	0.113	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-48.6	177.8	-66	162.6	0	0	0	110.6	T455 L456 A457 G462 I463 M482 L605	T455-I459 VanDerWaalsContact O-CG1 3.3Å; T455-I459 WeakPolarHBondContact O-CG1 3.43Å; T455-I459 PolarHBondContact O-N 3.34Å; L456-I459 PolarHBondContact O-N 2.73Å; A457-I459 VanDerWaalsContact C-N 3.31Å; A457-I459 PolarHBondContact O-N 3.02Å; I459-G462 PolarHBondContact O-N 3.33Å; I459-I463 HydrophobicContact CG2-CD1 3.72Å; I459-I463 HydrophobicContact CG2-CG1 4.49Å; I459-I463 WeakPolarHBondContact O-CD1 3.47Å; I459-I463 VanDerWaalsContact O-CG1 3.28Å; I459-I463 WeakPolarHBondContact O-CG1 3.4Å; I459-I463 PolarHBondContact O-N 3.21Å; I459-M482 HydrophobicContact CG2-CB 4.24Å; I459-M482 HydrophobicContact CG2-CG 4.47Å; I459-L605 HydrophobicContact CD1-CD1 4.14Å; I459-L605 HydrophobicContact CD1-CD2 4.23Å; I459-L605 HydrophobicContact CG1-CD1 4.43Å
460	V	93.8	Very high	90.7	Very high	80 Å²	80	46 Å²	46	49%	0.485	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-44.8	179.6	170.7	0	0	0	0	111.3	L456 A457 G462 I463 I464	L456-V460 WeakPolarHBondContact O-CG2 3.47Å; L456-V460 PolarHBondContact O-N 3.38Å; L456-V460 VanDerWaalsContact O-N 3.07Å; A457-V460 PolarHBondContact O-N 3.04Å; V460-G462 VanDerWaalsContact C-N 3.34Å; V460-G462 PolarHBondContact O-N 3.04Å; V460-I463 PolarHBondContact O-N 2.82Å; V460-I464 HydrophobicContact CG1-CD1 3.73Å; V460-I464 WeakPolarHBondContact O-CB 3.35Å; V460-I464 VanDerWaalsContact O-CG1 3.29Å; V460-I464 WeakPolarHBondContact O-CG1 3.42Å; V460-I464 PolarHBondContact O-N 3.41Å
461	I	94	Very high	90.9	Very high	60 Å²	60	47.9 Å²	47.9	31%	0.308	26%	0.255	S	S	.	.	H	α-helix	trans	-61	-43.9	176	-68.7	164.8	0	0	0	110.4	R337 V341 A457 I464 Y465	R337-I461 HydrophobicContact CB-CD1 4.21Å; V341-I461 HydrophobicContact CG2-CG2 3.55Å; A457-I461 WeakPolarHBondContact O-CB 3.35Å; A457-I461 WeakPolarHBondContact O-CD1 3.38Å; A457-I461 WeakPolarHBondContact O-CG1 3.37Å; A457-I461 PolarHBondContact O-N 3.16Å; I461-I464 PolarHBondContact O-N 2.97Å; I461-Y465 VanDerWaalsContact O-CB 3.23Å; I461-Y465 WeakPolarHBondContact O-CB 3.18Å; I461-Y465 PolarHBondContact O-N 3.44Å
462	G	91.8	Very high	91	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-45.2	177.7	0	0	0	0	0	113.1	D458 I459 V460 Y465 F466 Y597	D458-G462 PolarHBondContact O-N 2.91Å; I459-G462 PolarHBondContact O-N 3.33Å; V460-G462 VanDerWaalsContact C-N 3.34Å; V460-G462 PolarHBondContact O-N 3.04Å; G462-Y465 PolarHBondContact O-N 3.05Å; G462-F466 VanDerWaalsContact O-CD2 3.23Å; G462-F466 WeakPolarHBondContact O-CD2 3.22Å; G462-F466 PolarHBondContact O-N 3.46Å; G462-Y597 WeakPolarHBondContact CA-OH 3.42Å
463	I	93.1	Very high	91.1	Very high	38 Å²	38	55.7 Å²	55.7	20%	0.195	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-47.1	176.3	-67.7	161.1	0	0	0	110.7	I459 V460 S467 V478 F479	I459-I463 HydrophobicContact CG2-CD1 3.72Å; I459-I463 HydrophobicContact CG2-CG1 4.49Å; I459-I463 WeakPolarHBondContact O-CD1 3.47Å; I459-I463 VanDerWaalsContact O-CG1 3.28Å; I459-I463 WeakPolarHBondContact O-CG1 3.4Å; I459-I463 PolarHBondContact O-N 3.21Å; V460-I463 PolarHBondContact O-N 2.82Å; I463-S467 VanDerWaalsContact O-CB 3.25Å; I463-S467 WeakPolarHBondContact O-CB 3.36Å; I463-S467 PolarHBondContact O-N 3.14Å; I463-V478 HydrophobicContact CG1-CG1 4.09Å; I463-F479 HydrophobicContact CD1-CB 4.01Å; I463-F479 HydrophobicContact CD1-CD2 3.94Å; I463-F479 HydrophobicContact CD1-CG 4.49Å; I463-F479 HydrophobicContact CG1-CB 4.3Å
464	I	93.8	Very high	91.2	Very high	87 Å²	87	51.3 Å²	51.3	45%	0.446	27%	0.269	S	S	.	.	H	α-helix	trans	-60.7	-45.9	177.5	-71.7	169	0	0	0	110.4	V460 I461 S467 M468	V460-I464 HydrophobicContact CG1-CD1 3.73Å; V460-I464 WeakPolarHBondContact O-CB 3.35Å; V460-I464 VanDerWaalsContact O-CG1 3.29Å; V460-I464 WeakPolarHBondContact O-CG1 3.42Å; V460-I464 PolarHBondContact O-N 3.41Å; I461-I464 PolarHBondContact O-N 2.97Å; I464-S467 PolarHBondContact O-N 3.42Å; I464-M468 HydrophobicContact CG2-CE 3.52Å; I464-M468 HydrophobicContact CG2-SD 4.04Å; I464-M468 WeakPolarHBondContact O-CG 3.47Å; I464-M468 PolarHBondContact O-N 2.73Å
465	Y	93.8	Very high	91.3	Very high	17 Å²	17	51.3 Å²	51.3	7%	0.067	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-53.5	178.5	179.3	-91.2	0	0	0	112.2	V341 I345 I461 G462 S467 M468 F469 F470 L593 Y597	V341-Y465 HydrophobicContact CG1-CD2 4.02Å; V341-Y465 HydrophobicContact CG1-CE2 4.2Å; I345-Y465 HydrophobicContact CD1-CE2 3.78Å; I345-Y465 HydrophobicContact CG1-CE2 4.42Å; I345-Y465 WeakPolarHBondContact CG1-OH 3.27Å; I461-Y465 VanDerWaalsContact O-CB 3.23Å; I461-Y465 WeakPolarHBondContact O-CB 3.18Å; I461-Y465 PolarHBondContact O-N 3.44Å; G462-Y465 PolarHBondContact O-N 3.05Å; Y465-S467 VanDerWaalsContact C-N 3.3Å; Y465-S467 PolarHBondContact O-N 3.09Å; Y465-M468 PolarHBondContact O-N 3.16Å; Y465-F469 AromaticContact CD2-CD2 3.4Å; Y465-F469 HydrophobicContact CD2-CD2 3.4Å; Y465-F469 AromaticContact CD2-CE2 3.66Å; Y465-F469 HydrophobicContact CD2-CE2 3.66Å; Y465-F469 HydrophobicContact CD2-CG 4.31Å; Y465-F469 HydrophobicContact CE1-CB 4.5Å; Y465-F469 HydrophobicContact CE2-CB 4.42Å; Y465-F469 AromaticContact CE2-CD2 3.38Å; Y465-F469 HydrophobicContact CE2-CD2 3.38Å; Y465-F469 AromaticContact CE2-CE2 3.68Å; Y465-F469 HydrophobicContact CE2-CE2 3.68Å; Y465-F469 AromaticContact CE2-CG 3.9Å; Y465-F469 HydrophobicContact CE2-CG 3.9Å; Y465-F469 HydrophobicContact CE2-CZ 4.41Å; Y465-F469 HydrophobicContact CG-CD2 4.06Å; Y465-F469 WeakPolarHBondContact O-CB 3.28Å; Y465-F469 WeakPolarHBondContact O-CD2 3.4Å; Y465-F469 PolarHBondContact O-N 3.4Å; Y465-F470 HydrophobicContact CE1-CE2 4.24Å; Y465-L593 HydrophobicContact CE1-CD2 3.93Å; Y465-Y597 HydrophobicContact CD1-CD1 4.3Å; Y465-Y597 AromaticContact CD1-CE1 3.83Å; Y465-Y597 HydrophobicContact CD1-CE1 3.83Å; Y465-Y597 HydrophobicContact CE1-CE1 4.4Å; Y465-Y597 HydrophobicContact CG-CE1 4.29Å
466	F	92.6	Very high	91.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-32.8	-179.8	-78.7	-63.8	0	0	0	113	G462 F470 N471 F474 V478 L593 F594 Y597	G462-F466 VanDerWaalsContact O-CD2 3.23Å; G462-F466 WeakPolarHBondContact O-CD2 3.22Å; G462-F466 PolarHBondContact O-N 3.46Å; F466-F470 AromaticContact CD1-CD2 3.83Å; F466-F470 HydrophobicContact CD1-CD2 3.83Å; F466-F470 HydrophobicContact CD1-CE2 4Å; F466-F470 HydrophobicContact CD1-CG 4.28Å; F466-F470 HydrophobicContact CE1-CD2 4.33Å; F466-F470 HydrophobicContact CE1-CE2 4.02Å; F466-F470 HydrophobicContact CE1-CZ 4.27Å; F466-F470 WeakPolarHBondContact O-CB 3.16Å; F466-F470 PolarHBondContact O-N 3.49Å; F466-N471 PolarHBondContact O-N 2.91Å; F466-F474 HydrophobicContact CB-CB 4.16Å; F466-V478 HydrophobicContact CD2-CG2 3.94Å; F466-V478 HydrophobicContact CE2-CG2 4.34Å; F466-L593 HydrophobicContact CE1-CD2 3.87Å; F466-L593 HydrophobicContact CZ-CD2 4.04Å; F466-F594 HydrophobicContact CD1-CD2 4.34Å; F466-F594 AromaticContact CE1-CD2 3.72Å; F466-F594 HydrophobicContact CE1-CD2 3.72Å; F466-F594 HydrophobicContact CE1-CE2 4.49Å; F466-F594 AromaticContact CZ-CD2 3.96Å; F466-F594 HydrophobicContact CZ-CD2 3.96Å; F466-Y597 AromaticContact CE2-CD1 3.57Å; F466-Y597 HydrophobicContact CE2-CD1 3.57Å; F466-Y597 HydrophobicContact CE2-CE1 4.04Å; F466-Y597 HydrophobicContact CE2-CG 4.16Å; F466-Y597 AromaticContact CZ-CD1 3.6Å; F466-Y597 HydrophobicContact CZ-CD1 3.6Å; F466-Y597 HydrophobicContact CZ-CE1 4.43Å; F466-Y597 HydrophobicContact CZ-CG 4.17Å
467	S	91.9	Very high	91.6	Very high	54 Å²	54	52.8 Å²	52.8	38%	0.378	28%	0.277	S	S	.	.	H	α-helix	trans	-66.5	-42.9	175.4	-166.9	0	0	0	0	112.3	I463 I464 Y465	I463-S467 VanDerWaalsContact O-CB 3.25Å; I463-S467 WeakPolarHBondContact O-CB 3.36Å; I463-S467 PolarHBondContact O-N 3.14Å; I464-S467 PolarHBondContact O-N 3.42Å; Y465-S467 VanDerWaalsContact C-N 3.3Å; Y465-S467 PolarHBondContact O-N 3.09Å
468	M	90.7	Very high	91.6	Very high	131 Å²	131	51.1 Å²	51.1	65%	0.645	26%	0.263	S	S	*	.	H	α-helix	trans	-81	-38.6	-177.2	-65.8	-174.3	-47.9	0	0	114.3	I464 Y465	I464-M468 HydrophobicContact CG2-CE 3.52Å; I464-M468 HydrophobicContact CG2-SD 4.04Å; I464-M468 WeakPolarHBondContact O-CG 3.47Å; I464-M468 PolarHBondContact O-N 2.73Å; Y465-M468 PolarHBondContact O-N 3.16Å
469	F	87.2	Confident	91.7	Very high	127 Å²	127	56.2 Å²	56.2	56%	0.557	29%	0.285	S	S	*	.	H	α-helix	trans	-96	-16.4	-172.1	-74	-82.7	0	0	0	114.8	Y465	Y465-F469 AromaticContact CD2-CD2 3.4Å; Y465-F469 HydrophobicContact CD2-CD2 3.4Å; Y465-F469 AromaticContact CD2-CE2 3.66Å; Y465-F469 HydrophobicContact CD2-CE2 3.66Å; Y465-F469 HydrophobicContact CD2-CG 4.31Å; Y465-F469 HydrophobicContact CE1-CB 4.5Å; Y465-F469 HydrophobicContact CE2-CB 4.42Å; Y465-F469 AromaticContact CE2-CD2 3.38Å; Y465-F469 HydrophobicContact CE2-CD2 3.38Å; Y465-F469 AromaticContact CE2-CE2 3.68Å; Y465-F469 HydrophobicContact CE2-CE2 3.68Å; Y465-F469 AromaticContact CE2-CG 3.9Å; Y465-F469 HydrophobicContact CE2-CG 3.9Å; Y465-F469 HydrophobicContact CE2-CZ 4.41Å; Y465-F469 HydrophobicContact CG-CD2 4.06Å; Y465-F469 WeakPolarHBondContact O-CB 3.28Å; Y465-F469 WeakPolarHBondContact O-CD2 3.4Å; Y465-F469 PolarHBondContact O-N 3.4Å
470	F	86.9	Confident	91.8	Very high	31 Å²	31	60.2 Å²	60.2	14%	0.136	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-79.7	177.8	-72.5	-117.3	0	0	0	110.5	Y465 F466 F474 L586 D590 L593	Y465-F470 HydrophobicContact CE1-CE2 4.24Å; F466-F470 AromaticContact CD1-CD2 3.83Å; F466-F470 HydrophobicContact CD1-CD2 3.83Å; F466-F470 HydrophobicContact CD1-CE2 4Å; F466-F470 HydrophobicContact CD1-CG 4.28Å; F466-F470 HydrophobicContact CE1-CD2 4.33Å; F466-F470 HydrophobicContact CE1-CE2 4.02Å; F466-F470 HydrophobicContact CE1-CZ 4.27Å; F466-F470 WeakPolarHBondContact O-CB 3.16Å; F466-F470 PolarHBondContact O-N 3.49Å; F470-F474 HydrophobicContact CB-CB 4.32Å; F470-F474 HydrophobicContact CB-CD2 3.6Å; F470-F474 HydrophobicContact CB-CE2 4.14Å; F470-F474 HydrophobicContact CB-CG 4.1Å; F470-F474 HydrophobicContact CD1-CD2 4.24Å; F470-F474 HydrophobicContact CD1-CE2 4.17Å; F470-F474 HydrophobicContact CD1-CG 4.49Å; F470-F474 HydrophobicContact CD1-CZ 4.36Å; F470-F474 HydrophobicContact CG-CD2 4.36Å; F470-L586 HydrophobicContact CD1-CD1 3.73Å; F470-L586 HydrophobicContact CD1-CD2 4.06Å; F470-L586 HydrophobicContact CE1-CD1 3.99Å; F470-L586 HydrophobicContact CE1-CD2 4.33Å; F470-D590 HydrophobicContact CE1-CB 3.84Å; F470-D590 HydrophobicContact CZ-CB 3.97Å; F470-L593 HydrophobicContact CE2-CD2 4.14Å; F470-L593 HydrophobicContact CZ-CD2 4.13Å
471	N	88.4	Confident	91.8	Very high	64 Å²	64	57 Å²	57	34%	0.342	29%	0.287	S	S	.	.			trans	-169	150.5	179.9	-164.4	-62.6	0	0	0	108.9	F466 W473 F474 G475	F466-N471 PolarHBondContact O-N 2.91Å; N471-W473 PolarHBondContact O-N 2.93Å; N471-W473 VanDerWaalsContact O-N 3.08Å; N471-W473 PolarHBondContact OD1-N 3.5Å; N471-W473 VanDerWaalsContact OD1-N 3.12Å; N471-F474 HydrophobicContact CB-CD2 3.96Å; N471-F474 HydrophobicContact CB-CE2 4.49Å; N471-F474 PolarHBondContact O-N 3Å; N471-G475 PolarHBondContact O-N 3.28Å
472	A	90.3	Very high	91.7	Very high	58 Å²	58	54.7 Å²	54.7	48%	0.479	28%	0.275	S	S	.	.	H	α-helix	trans	-50.7	-32.7	172	0	0	0	0	0	113.5	F474 G475 L476	A472-F474 PolarHBondContact O-N 3.45Å; A472-G475 PolarHBondContact O-N 3.41Å; A472-L476 WeakPolarHBondContact O-CB 3.46Å; A472-L476 PolarHBondContact O-N 2.96Å
473	W	91.2	Very high	91.7	Very high	167 Å²	167	57.1 Å²	57.1	63%	0.633	29%	0.292	S	S	*	.	H	α-helix	trans	-60.8	-37.8	174.9	-74.9	106.9	0	0	0	113.9	N471 L476 I477 L576	N471-W473 PolarHBondContact O-N 2.93Å; N471-W473 VanDerWaalsContact O-N 3.08Å; N471-W473 PolarHBondContact OD1-N 3.5Å; N471-W473 VanDerWaalsContact OD1-N 3.12Å; W473-L476 HydrophobicContact CE3-CD2 3.98Å; W473-L476 HydrophobicContact CZ3-CD2 3.91Å; W473-L476 PolarHBondContact O-N 3.02Å; W473-I477 WeakPolarHBondContact O-CG1 3.12Å; W473-I477 PolarHBondContact O-N 2.9Å; W473-L576 HydrophobicContact CB-CD2 4.26Å
474	F	91.1	Very high	91.7	Very high	1 Å²	1	59 Å²	59	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-67.7	-44.7	174.2	-73.3	-82.5	0	0	0	110.8	F466 F470 N471 A472 L476 I477 V478 L576 C577 F580 L586 F594	F466-F474 HydrophobicContact CB-CB 4.16Å; F470-F474 HydrophobicContact CB-CB 4.32Å; F470-F474 HydrophobicContact CB-CD2 3.6Å; F470-F474 HydrophobicContact CB-CE2 4.14Å; F470-F474 HydrophobicContact CB-CG 4.1Å; F470-F474 HydrophobicContact CD1-CD2 4.24Å; F470-F474 HydrophobicContact CD1-CE2 4.17Å; F470-F474 HydrophobicContact CD1-CG 4.49Å; F470-F474 HydrophobicContact CD1-CZ 4.36Å; F470-F474 HydrophobicContact CG-CD2 4.36Å; N471-F474 HydrophobicContact CB-CD2 3.96Å; N471-F474 HydrophobicContact CB-CE2 4.49Å; N471-F474 PolarHBondContact O-N 3Å; A472-F474 PolarHBondContact O-N 3.45Å; F474-L476 VanDerWaalsContact C-N 3.27Å; F474-L476 PolarHBondContact O-N 3.32Å; F474-I477 PolarHBondContact O-N 3.43Å; F474-V478 WeakPolarHBondContact O-CG2 3.5Å; F474-V478 PolarHBondContact O-N 2.8Å; F474-L576 HydrophobicContact CD1-CD2 4.27Å; F474-L576 HydrophobicContact CD2-CD2 4.35Å; F474-L576 HydrophobicContact CE1-CB 4.23Å; F474-L576 HydrophobicContact CE1-CD2 3.99Å; F474-L576 HydrophobicContact CE1-CG 4.1Å; F474-L576 HydrophobicContact CE2-CD2 4.1Å; F474-L576 HydrophobicContact CE2-CG 4.28Å; F474-L576 HydrophobicContact CG-CD2 4.44Å; F474-L576 HydrophobicContact CZ-CB 4.3Å; F474-L576 HydrophobicContact CZ-CD2 3.91Å; F474-L576 HydrophobicContact CZ-CG 3.79Å; F474-C577 HydrophobicContact CE1-CB 3.98Å; F474-C577 HydrophobicContact CZ-CB 4.19Å; F474-F580 AromaticContact CE2-CD2 3.73Å; F474-F580 HydrophobicContact CE2-CD2 3.73Å; F474-F580 AromaticContact CE2-CE2 3.89Å; F474-F580 HydrophobicContact CE2-CE2 3.89Å; F474-F580 AromaticContact CZ-CD2 3.81Å; F474-F580 HydrophobicContact CZ-CD2 3.81Å; F474-F580 HydrophobicContact CZ-CE2 4.29Å; F474-L586 HydrophobicContact CE2-CD1 4.43Å; F474-L586 HydrophobicContact CZ-CD1 4.29Å; F474-F594 HydrophobicContact CD1-CD2 4.11Å; F474-F594 HydrophobicContact CD1-CE2 4.02Å
475	G	91.5	Very high	91.6	Very high	5 Å²	5	55.1 Å²	55.1	5%	0.052	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-40.6	173.8	0	0	0	0	0	112.8	N471 A472 V478 F479	N471-G475 PolarHBondContact O-N 3.28Å; A472-G475 PolarHBondContact O-N 3.41Å; G475-V478 PolarHBondContact O-N 2.96Å; G475-F479 WeakPolarHBondContact O-CB 3.34Å; G475-F479 PolarHBondContact O-N 3.31Å
476	L	93.4	Very high	91.5	Very high	84 Å²	84	56.4 Å²	56.4	44%	0.44	29%	0.29	S	S	.	.	H	α-helix	trans	-66.3	-43.4	176.8	-177.8	62.7	0	0	0	112.7	A472 W473 F474 V478 F479 L480	A472-L476 WeakPolarHBondContact O-CB 3.46Å; A472-L476 PolarHBondContact O-N 2.96Å; W473-L476 HydrophobicContact CE3-CD2 3.98Å; W473-L476 HydrophobicContact CZ3-CD2 3.91Å; W473-L476 PolarHBondContact O-N 3.02Å; F474-L476 VanDerWaalsContact C-N 3.27Å; F474-L476 PolarHBondContact O-N 3.32Å; L476-V478 VanDerWaalsContact C-N 3.35Å; L476-F479 PolarHBondContact O-N 3.08Å; L476-L480 VanDerWaalsContact O-CB 3.32Å; L476-L480 WeakPolarHBondContact O-CB 3.39Å; L476-L480 PolarHBondContact O-N 3.33Å
477	I	92.9	Very high	91.4	Very high	39 Å²	39	60 Å²	60	20%	0.2	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-45.4	175.7	-70.1	166.6	0	0	0	110.4	W473 F474 L480 C481 L576	W473-I477 WeakPolarHBondContact O-CG1 3.12Å; W473-I477 PolarHBondContact O-N 2.9Å; F474-I477 PolarHBondContact O-N 3.43Å; I477-L480 PolarHBondContact O-N 2.99Å; I477-C481 VanDerWaalsContact O-CB 3.22Å; I477-C481 WeakPolarHBondContact O-CB 3.33Å; I477-C481 PolarHBondContact O-N 3.42Å; I477-L576 HydrophobicContact CD1-CD2 3.68Å
478	V	92.4	Very high	91.4	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-63.6	-47	177.6	178.4	0	0	0	0	111.2	I463 F466 F474 G475 L476 L480 C481 M482 F594 I598 L601	I463-V478 HydrophobicContact CG1-CG1 4.09Å; F466-V478 HydrophobicContact CD2-CG2 3.94Å; F466-V478 HydrophobicContact CE2-CG2 4.34Å; F474-V478 WeakPolarHBondContact O-CG2 3.5Å; F474-V478 PolarHBondContact O-N 2.8Å; G475-V478 PolarHBondContact O-N 2.96Å; L476-V478 VanDerWaalsContact C-N 3.35Å; V478-L480 PolarHBondContact O-N 3.49Å; V478-C481 PolarHBondContact O-N 2.8Å; V478-M482 HydrophobicContact CG1-CG 4.14Å; V478-M482 WeakPolarHBondContact O-CB 3.37Å; V478-M482 VanDerWaalsContact O-CG 3.23Å; V478-M482 WeakPolarHBondContact O-CG 3.47Å; V478-M482 PolarHBondContact O-N 3.46Å; V478-F594 HydrophobicContact CG2-CE2 4.43Å; V478-I598 HydrophobicContact CG2-CD1 3.55Å; V478-L601 HydrophobicContact CG1-CD1 4.2Å
479	F	93.8	Very high	91.4	Very high	114 Å²	114	54.1 Å²	54.1	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-58.1	-48.9	177.3	172.7	-104	0	0	0	112	I463 G475 L476 M482 S483	I463-F479 HydrophobicContact CD1-CB 4.01Å; I463-F479 HydrophobicContact CD1-CD2 3.94Å; I463-F479 HydrophobicContact CD1-CG 4.49Å; I463-F479 HydrophobicContact CG1-CB 4.3Å; G475-F479 WeakPolarHBondContact O-CB 3.34Å; G475-F479 PolarHBondContact O-N 3.31Å; L476-F479 PolarHBondContact O-N 3.08Å; F479-M482 PolarHBondContact O-N 3.27Å; F479-S483 WeakPolarHBondContact O-CB 3.45Å; F479-S483 PolarHBondContact O-N 3.23Å
480	L	93.9	Very high	91.4	Very high	107 Å²	107	50.2 Å²	50.2	56%	0.56	26%	0.263	S	S	*	.	H	α-helix	trans	-64.6	-45.4	-179.3	-168.3	155.3	0	0	0	111.1	L476 I477 V478 L484	L476-L480 VanDerWaalsContact O-CB 3.32Å; L476-L480 WeakPolarHBondContact O-CB 3.39Å; L476-L480 PolarHBondContact O-N 3.33Å; I477-L480 PolarHBondContact O-N 2.99Å; V478-L480 PolarHBondContact O-N 3.49Å; L480-L484 WeakPolarHBondContact O-CB 3.45Å; L480-L484 PolarHBondContact O-N 3.16Å
481	C	93.1	Very high	91.6	Very high	13 Å²	13	53 Å²	53	9%	0.088	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-48.4	177.3	-175.2	0	0	0	0	112.1	I477 V478 Y485	I477-C481 VanDerWaalsContact O-CB 3.22Å; I477-C481 WeakPolarHBondContact O-CB 3.33Å; I477-C481 PolarHBondContact O-N 3.42Å; V478-C481 PolarHBondContact O-N 2.8Å; C481-Y485 VanDerWaalsContact O-CB 3.25Å; C481-Y485 WeakPolarHBondContact O-CB 3.47Å; C481-Y485 PolarHBondContact O-N 3.24Å
482	M	92	Very high	91.6	Very high	11 Å²	11	51.2 Å²	51.2	5%	0.054	27%	0.274	C	S	.	.	H	α-helix	trans	-71	-38.3	-177.9	-64.6	-63.7	166	0	0	112.1	I459 V478 F479 L486 L601 L605	I459-M482 HydrophobicContact CG2-CB 4.24Å; I459-M482 HydrophobicContact CG2-CG 4.47Å; V478-M482 HydrophobicContact CG1-CG 4.14Å; V478-M482 WeakPolarHBondContact O-CB 3.37Å; V478-M482 VanDerWaalsContact O-CG 3.23Å; V478-M482 WeakPolarHBondContact O-CG 3.47Å; V478-M482 PolarHBondContact O-N 3.46Å; F479-M482 PolarHBondContact O-N 3.27Å; M482-L486 WeakPolarHBondContact O-CB 3.26Å; M482-L486 PolarHBondContact O-N 2.88Å; M482-L601 HydrophobicContact CE-CB 3.65Å; M482-L601 HydrophobicContact CE-CD1 4.34Å; M482-L605 HydrophobicContact SD-CD1 4.38Å; M482-L605 HydrophobicContact SD-CD2 4.29Å
483	S	91.6	Very high	91.4	Very high	51 Å²	51	48.6 Å²	48.6	36%	0.357	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-44.7	175.7	-175.5	0	0	0	0	111.9	F479 L486 T487	F479-S483 WeakPolarHBondContact O-CB 3.45Å; F479-S483 PolarHBondContact O-N 3.23Å; S483-L486 PolarHBondContact O-N 3.46Å; S483-T487 WeakPolarHBondContact O-CB 3.44Å; S483-T487 PolarHBondContact O-N 3.02Å; S483-T487 PolarHBondContact O-OG1 3.21Å
484	L	93.3	Very high	91.2	Very high	78 Å²	78	45.1 Å²	45.1	41%	0.408	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-45.2	175.6	-179.1	61.2	0	0	0	111.3	L480 L486 T487 L488 V565	L480-L484 WeakPolarHBondContact O-CB 3.45Å; L480-L484 PolarHBondContact O-N 3.16Å; L484-L486 PolarHBondContact O-N 2.94Å; L484-T487 PolarHBondContact O-N 3.33Å; L484-L488 HydrophobicContact CD1-CD1 3.74Å; L484-L488 HydrophobicContact CD1-CG 4.07Å; L484-L488 HydrophobicContact CG-CD1 3.85Å; L484-L488 WeakPolarHBondContact O-CB 3.3Å; L484-L488 WeakPolarHBondContact O-CG 3.5Å; L484-L488 PolarHBondContact O-N 2.99Å; L484-V565 HydrophobicContact CB-CG1 4.49Å; L484-V565 HydrophobicContact CD2-CG1 4.21Å; L484-V565 HydrophobicContact CD2-CG2 4.29Å; L484-V565 HydrophobicContact CG-CG1 4.29Å; L484-V565 HydrophobicContact CG-CG2 4.36Å
485	Y	92.3	Very high	91	Very high	5 Å²	5	50.7 Å²	50.7	2%	0.02	26%	0.264	C	S	.	.	H	α-helix	trans	-56.6	-50.9	175.2	-178.8	-75.3	0	0	0	111.5	C481 T489 Q562 I566 Y602 L605 N606	C481-Y485 VanDerWaalsContact O-CB 3.25Å; C481-Y485 WeakPolarHBondContact O-CB 3.47Å; C481-Y485 PolarHBondContact O-N 3.24Å; Y485-T489 VanDerWaalsContact CE1-OG1 3.26Å; Y485-T489 WeakPolarHBondContact CE1-OG1 3.3Å; Y485-T489 VanDerWaalsContact O-CB 3.23Å; Y485-T489 WeakPolarHBondContact O-CB 3.24Å; Y485-T489 PolarHBondContact O-N 3.43Å; Y485-T489 PolarHBondContact O-OG1 3.15Å; Y485-Q562 HydrophobicContact CD2-CB 4.3Å; Y485-Q562 HydrophobicContact CD2-CG 4.22Å; Y485-Q562 HydrophobicContact CE1-CG 4.44Å; Y485-Q562 HydrophobicContact CE2-CB 3.54Å; Y485-Q562 HydrophobicContact CE2-CG 3.5Å; Y485-Q562 VanDerWaalsContact CE2-CG 3.5Å; Y485-Q562 PolarHBondContact OH-NE2 3.43Å; Y485-Q562 PolarHBondContact OH-OE1 3.5Å; Y485-Q562 VanDerWaalsContact OH-OE1 3.14Å; Y485-I566 HydrophobicContact CD2-CD1 4.34Å; Y485-I566 HydrophobicContact CD2-CG1 4.09Å; Y485-I566 HydrophobicContact CE2-CD1 3.94Å; Y485-I566 HydrophobicContact CE2-CG1 4.2Å; Y485-Y602 AromaticContact CE2-CD2 3.9Å; Y485-Y602 HydrophobicContact CE2-CD2 3.9Å; Y485-Y602 AromaticContact CE2-CE2 3.7Å; Y485-Y602 HydrophobicContact CE2-CE2 3.7Å; Y485-Y602 AromaticContact CZ-CE2 3.87Å; Y485-L605 HydrophobicContact CD1-CB 4.01Å; Y485-L605 HydrophobicContact CD1-CD2 3.57Å; Y485-L605 HydrophobicContact CD1-CG 4.43Å; Y485-L605 HydrophobicContact CE1-CB 3.52Å; Y485-L605 HydrophobicContact CE1-CD2 3.98Å; Y485-L605 HydrophobicContact CE1-CG 4.37Å; Y485-L605 HydrophobicContact CG-CD2 4.39Å; Y485-L605 PolarHBondContact OH-O 2.66Å; Y485-N606 WeakPolarHBondContact OH-CA 3.44Å; Y485-N606 PolarHBondContact OH-N 3.04Å
486	L	90.8	Very high	90.8	Very high	43 Å²	43	51.1 Å²	51.1	23%	0.225	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-46.3	-177.1	-176.7	65.1	0	0	0	111.1	M482 S483 L484 T489 I490 F608	M482-L486 WeakPolarHBondContact O-CB 3.26Å; M482-L486 PolarHBondContact O-N 2.88Å; S483-L486 PolarHBondContact O-N 3.46Å; L484-L486 PolarHBondContact O-N 2.94Å; L486-T489 PolarHBondContact O-N 3.24Å; L486-I490 HydrophobicContact CD1-CD1 4.16Å; L486-I490 HydrophobicContact CG-CD1 4.05Å; L486-I490 WeakPolarHBondContact O-CG1 3.46Å; L486-I490 PolarHBondContact O-N 3.43Å; L486-F608 HydrophobicContact CD1-CD1 3.67Å; L486-F608 HydrophobicContact CD1-CD2 4.45Å; L486-F608 HydrophobicContact CD1-CE1 3.42Å; L486-F608 VanDerWaalsContact CD1-CE1 3.42Å; L486-F608 HydrophobicContact CD1-CE2 4.23Å; L486-F608 HydrophobicContact CD1-CG 4.2Å; L486-F608 HydrophobicContact CD1-CZ 3.73Å
487	T	91.1	Very high	90.3	Very high	77 Å²	77	48.2 Å²	48.2	47%	0.472	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-50.7	-180	-55.5	0	0	0	0	111.4	S483 L484 T489 I490 V491	S483-T487 WeakPolarHBondContact O-CB 3.44Å; S483-T487 PolarHBondContact O-N 3.02Å; S483-T487 PolarHBondContact O-OG1 3.21Å; L484-T487 PolarHBondContact O-N 3.33Å; T487-T489 VanDerWaalsContact C-N 3.31Å; T487-T489 PolarHBondContact O-N 3.44Å; T487-I490 PolarHBondContact O-N 3.1Å; T487-V491 WeakPolarHBondContact O-CG2 3.32Å; T487-V491 PolarHBondContact O-N 3.36Å
488	L	90.9	Very high	90	Very high	59 Å²	59	51.4 Å²	51.4	31%	0.309	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-40.1	177.1	-71.9	170.1	0	0	0	111.7	L484 I490 V491 V492 T561 V565	L484-L488 HydrophobicContact CD1-CD1 3.74Å; L484-L488 HydrophobicContact CD1-CG 4.07Å; L484-L488 HydrophobicContact CG-CD1 3.85Å; L484-L488 WeakPolarHBondContact O-CB 3.3Å; L484-L488 WeakPolarHBondContact O-CG 3.5Å; L484-L488 PolarHBondContact O-N 2.99Å; L488-I490 PolarHBondContact O-N 3.35Å; L488-V491 PolarHBondContact O-N 3.37Å; L488-V492 WeakPolarHBondContact O-CB 3.31Å; L488-V492 VanDerWaalsContact O-CG2 3.3Å; L488-V492 WeakPolarHBondContact O-CG2 3.49Å; L488-V492 PolarHBondContact O-N 2.9Å; L488-T561 HydrophobicContact CD1-CG2 4.16Å; L488-V565 HydrophobicContact CD1-CG2 3.69Å
489	T	90.7	Very high	89.8	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-45.3	177.8	-62.5	0	0	0	0	111.6	Y485 L486 T487 T493 Q562	Y485-T489 VanDerWaalsContact CE1-OG1 3.26Å; Y485-T489 WeakPolarHBondContact CE1-OG1 3.3Å; Y485-T489 VanDerWaalsContact O-CB 3.23Å; Y485-T489 WeakPolarHBondContact O-CB 3.24Å; Y485-T489 PolarHBondContact O-N 3.43Å; Y485-T489 PolarHBondContact O-OG1 3.15Å; L486-T489 PolarHBondContact O-N 3.24Å; T487-T489 VanDerWaalsContact C-N 3.31Å; T487-T489 PolarHBondContact O-N 3.44Å; T489-T493 WeakPolarHBondContact O-CB 3.46Å; T489-T493 PolarHBondContact O-N 3.36Å; T489-T493 PolarHBondContact O-OG1 3.11Å; T489-Q562 PolarHBondContact OG1-NE2 3.03Å
490	I	88.1	Confident	89.2	Confident	45 Å²	45	53.3 Å²	53.3	23%	0.231	27%	0.267	C	S	.	.	H	α-helix	trans	-65.1	-53.3	178.3	-67.4	166.2	0	0	0	110.4	L486 T487 L488 V492 T493 E494 F608 Y612	L486-I490 HydrophobicContact CD1-CD1 4.16Å; L486-I490 HydrophobicContact CG-CD1 4.05Å; L486-I490 WeakPolarHBondContact O-CG1 3.46Å; L486-I490 PolarHBondContact O-N 3.43Å; T487-I490 PolarHBondContact O-N 3.1Å; L488-I490 PolarHBondContact O-N 3.35Å; I490-V492 PolarHBondContact O-N 3.39Å; I490-T493 PolarHBondContact O-N 3.47Å; I490-T493 VanDerWaalsContact O-N 3.11Å; I490-E494 PolarHBondContact O-N 3.26Å; I490-F608 HydrophobicContact CD1-CE1 4.46Å; I490-F608 HydrophobicContact CG1-CE1 4.41Å; I490-Y612 HydrophobicContact CG2-CE1 4.42Å; I490-Y612 HydrophobicContact CG2-CE2 4.43Å
491	V	89.8	Confident	88.6	Confident	89 Å²	89	56.3 Å²	56.3	54%	0.539	27%	0.271	S	S	.	.	H	α-helix	trans	-58.3	-47.1	-177.3	172	0	0	0	0	112	T487 L488 E494 W495	T487-V491 WeakPolarHBondContact O-CG2 3.32Å; T487-V491 PolarHBondContact O-N 3.36Å; L488-V491 PolarHBondContact O-N 3.37Å; V491-E494 PolarHBondContact O-N 3.46Å; V491-W495 WeakPolarHBondContact O-CB 3.34Å; V491-W495 PolarHBondContact O-N 3.43Å
492	V	89.6	Confident	88.3	Confident	27 Å²	27	57.6 Å²	57.6	16%	0.164	28%	0.283	C	S	.	.	H	α-helix	trans	-69.6	-33.8	178.6	175.3	0	0	0	0	111.3	L488 I490 R496 L558	L488-V492 WeakPolarHBondContact O-CB 3.31Å; L488-V492 VanDerWaalsContact O-CG2 3.3Å; L488-V492 WeakPolarHBondContact O-CG2 3.49Å; L488-V492 PolarHBondContact O-N 2.9Å; I490-V492 PolarHBondContact O-N 3.39Å; V492-R496 WeakPolarHBondContact O-CB 3.28Å; V492-R496 PolarHBondContact O-N 3.45Å; V492-L558 HydrophobicContact CB-CD1 3.93Å; V492-L558 HydrophobicContact CG1-CB 3.9Å; V492-L558 HydrophobicContact CG1-CD1 3.82Å; V492-L558 HydrophobicContact CG1-CG 4.38Å
493	T	86.9	Confident	88.1	Confident	3 Å²	3	58 Å²	58	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-42	175.9	-66	0	0	0	0	112	T489 I490 R496 T497 Y612 R613	T489-T493 WeakPolarHBondContact O-CB 3.46Å; T489-T493 PolarHBondContact O-N 3.36Å; T489-T493 PolarHBondContact O-OG1 3.11Å; I490-T493 PolarHBondContact O-N 3.47Å; I490-T493 VanDerWaalsContact O-N 3.11Å; T493-R496 PolarHBondContact O-N 3.34Å; T493-T497 PolarHBondContact O-N 2.99Å; T493-T497 PolarHBondContact O-OG1 2.85Å; T493-Y612 HydrophobicContact CG2-CD1 4.21Å; T493-R613 VanDerWaalsContact CG2-CD 3.45Å; T493-R613 HydrophobicContact CG2-CG 3.53Å
494	E	85.3	Confident	87.6	Confident	95 Å²	95	58.8 Å²	58.8	44%	0.444	29%	0.285	S	S	.	.	H	α-helix	trans	-66.4	-46.4	175.6	-69.1	-168.7	161.5	0	0	111.4	I490 V491 R496 T497 Y612	I490-E494 PolarHBondContact O-N 3.26Å; V491-E494 PolarHBondContact O-N 3.46Å; E494-R496 VanDerWaalsContact C-N 3.3Å; E494-R496 PolarHBondContact O-N 3.46Å; E494-T497 WeakPolarHBondContact O-CB 3.48Å; E494-T497 PolarHBondContact O-N 2.89Å; E494-T497 VanDerWaalsContact O-N 3.12Å; E494-Y612 HydrophobicContact CG-CE1 3.98Å; E494-Y612 PolarHBondContact OE1-OH 3.27Å
495	W	87.9	Confident	87.1	Confident	117 Å²	117	59.8 Å²	59.8	44%	0.443	29%	0.294	S	S	.	.	H	α-helix	trans	-58.3	-40.7	173.5	176.1	94.4	0	0	0	112.5	V491 T497 K498 F499	V491-W495 WeakPolarHBondContact O-CB 3.34Å; V491-W495 PolarHBondContact O-N 3.43Å; W495-T497 VanDerWaalsContact C-N 3.32Å; W495-T497 PolarHBondContact O-N 3.14Å; W495-K498 VanDerWaalsContact CD1-NZ 3.34Å; W495-K498 WeakPolarHBondContact O-CD 3.43Å; W495-K498 VanDerWaalsContact O-CE 3.31Å; W495-K498 WeakPolarHBondContact O-CE 3.45Å; W495-K498 VanDerWaalsContact O-CG 3.26Å; W495-K498 WeakPolarHBondContact O-CG 3.5Å; W495-F499 HydrophobicContact CD2-CE2 4.1Å; W495-F499 AromaticContact CE2-CE2 3.96Å; W495-F499 AromaticContact CE3-CE2 3.95Å; W495-F499 HydrophobicContact CE3-CE2 3.95Å; W495-F499 AromaticContact CH2-CE2 3.55Å; W495-F499 HydrophobicContact CH2-CE2 3.55Å; W495-F499 HydrophobicContact CH2-CZ 4.1Å; W495-F499 AromaticContact CZ2-CE2 3.69Å; W495-F499 HydrophobicContact CZ2-CE2 3.69Å; W495-F499 AromaticContact CZ2-CZ 3.96Å; W495-F499 HydrophobicContact CZ2-CZ 3.96Å; W495-F499 HydrophobicContact CZ3-CD2 4.39Å; W495-F499 AromaticContact CZ3-CE2 3.69Å; W495-F499 HydrophobicContact CZ3-CE2 3.69Å
496	R	87.6	Confident	86.9	Confident	14 Å²	14	61.7 Å²	61.7	5%	0.053	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-30.5	177.3	173.9	168.4	-179.2	-116.1	-3.6	112.8	V492 T493 E494 K498 F499 R500 S551 S554	V492-R496 WeakPolarHBondContact O-CB 3.28Å; V492-R496 PolarHBondContact O-N 3.45Å; T493-R496 PolarHBondContact O-N 3.34Å; E494-R496 VanDerWaalsContact C-N 3.3Å; E494-R496 PolarHBondContact O-N 3.46Å; R496-K498 PolarHBondContact O-N 2.83Å; R496-K498 VanDerWaalsContact O-N 3.13Å; R496-F499 PolarHBondContact O-N 3.41Å; R496-R500 PolarHBondContact O-N 3.32Å; R496-S551 VanDerWaalsContact CZ-O 3.23Å; R496-S551 PolarHBondContact NE-O 3.09Å; R496-S551 PolarHBondContact NH2-O 2.9Å; R496-S554 WeakPolarHBondContact CD-OG 3.4Å; R496-S554 WeakPolarHBondContact CG-OG 3.5Å; R496-S554 PolarHBondContact NE-OG 2.89Å
497	T	83.3	Confident	86.9	Confident	23 Å²	23	62 Å²	62	14%	0.141	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-29.6	-174.2	-67.1	0	0	0	0	112.4	T493 E494 W495 F499 R500 R501	T493-T497 PolarHBondContact O-N 2.99Å; T493-T497 PolarHBondContact O-OG1 2.85Å; E494-T497 WeakPolarHBondContact O-CB 3.48Å; E494-T497 PolarHBondContact O-N 2.89Å; E494-T497 VanDerWaalsContact O-N 3.12Å; W495-T497 VanDerWaalsContact C-N 3.32Å; W495-T497 PolarHBondContact O-N 3.14Å; T497-F499 PolarHBondContact O-N 2.94Å; T497-R500 PolarHBondContact O-N 3.39Å; T497-R501 HydrophobicContact CG2-CG 4.34Å; T497-R501 WeakPolarHBondContact O-CG 3.41Å; T497-R501 PolarHBondContact O-N 3.47Å
498	K	86.2	Confident	86.4	Confident	106 Å²	106	61.3 Å²	61.3	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-61.9	-40.3	173.6	78.7	-160.8	173.8	-179.1	0	113.6	W495 R496 R501 A502	W495-K498 VanDerWaalsContact CD1-NZ 3.34Å; W495-K498 WeakPolarHBondContact O-CD 3.43Å; W495-K498 VanDerWaalsContact O-CE 3.31Å; W495-K498 WeakPolarHBondContact O-CE 3.45Å; W495-K498 VanDerWaalsContact O-CG 3.26Å; W495-K498 WeakPolarHBondContact O-CG 3.5Å; R496-K498 PolarHBondContact O-N 2.83Å; R496-K498 VanDerWaalsContact O-N 3.13Å; K498-R501 PolarHBondContact O-N 3.03Å; K498-A502 PolarHBondContact O-N 3.48Å
499	F	87.6	Confident	86.1	Confident	49 Å²	49	60.4 Å²	60.4	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-69.5	-40.2	178.8	-59.8	-65.4	0	0	0	110.9	W495 R496 T497 A502 M503 K550	W495-F499 HydrophobicContact CD2-CE2 4.1Å; W495-F499 AromaticContact CE2-CE2 3.96Å; W495-F499 AromaticContact CE3-CE2 3.95Å; W495-F499 HydrophobicContact CE3-CE2 3.95Å; W495-F499 AromaticContact CH2-CE2 3.55Å; W495-F499 HydrophobicContact CH2-CE2 3.55Å; W495-F499 HydrophobicContact CH2-CZ 4.1Å; W495-F499 AromaticContact CZ2-CE2 3.69Å; W495-F499 HydrophobicContact CZ2-CE2 3.69Å; W495-F499 AromaticContact CZ2-CZ 3.96Å; W495-F499 HydrophobicContact CZ2-CZ 3.96Å; W495-F499 HydrophobicContact CZ3-CD2 4.39Å; W495-F499 AromaticContact CZ3-CE2 3.69Å; W495-F499 HydrophobicContact CZ3-CE2 3.69Å; R496-F499 PolarHBondContact O-N 3.41Å; T497-F499 PolarHBondContact O-N 2.94Å; F499-A502 PolarHBondContact O-N 3.43Å; F499-M503 VanDerWaalsContact O-CB 3.31Å; F499-M503 WeakPolarHBondContact O-CB 3.35Å; F499-M503 PolarHBondContact O-N 3.25Å; F499-K550 HydrophobicContact CD1-CB 4.14Å; F499-K550 HydrophobicContact CD1-CD 4.49Å; F499-K550 HydrophobicContact CG-CB 4.45Å
500	R	80.8	Confident	86	Confident	106 Å²	106	60.7 Å²	60.7	40%	0.4	30%	0.3	S	S	.	.	H	α-helix	trans	-68.1	-35.9	176.5	-169.1	165.7	176.3	149.9	-3.6	112.3	R496 T497 M503 N504	R496-R500 PolarHBondContact O-N 3.32Å; T497-R500 PolarHBondContact O-N 3.39Å; R500-M503 HydrophobicContact CG-CE 4.26Å; R500-N504 WeakPolarHBondContact O-CB 3.47Å; R500-N504 VanDerWaalsContact O-CG 3.25Å; R500-N504 PolarHBondContact O-N 2.92Å; R500-N504 PolarHBondContact O-OD1 3.06Å
501	R	82.6	Confident	85.8	Confident	170 Å²	170	64.2 Å²	64.2	64%	0.642	31%	0.31	S	S	*	.	H	α-helix	trans	-61	-50	170.6	-74.6	177.3	-175.7	-179.5	2.7	111.4	T497 K498 M503 N504 T505	T497-R501 HydrophobicContact CG2-CG 4.34Å; T497-R501 WeakPolarHBondContact O-CG 3.41Å; T497-R501 PolarHBondContact O-N 3.47Å; K498-R501 PolarHBondContact O-N 3.03Å; R501-M503 VanDerWaalsContact C-N 3.35Å; R501-M503 PolarHBondContact O-N 2.71Å; R501-N504 PolarHBondContact O-N 2.86Å; R501-T505 PolarHBondContact O-N 2.89Å; R501-T505 PolarHBondContact O-OG1 2.88Å
502	A	85.4	Confident	85.5	Confident	40 Å²	40	62.8 Å²	62.8	33%	0.331	31%	0.307	S	S	.	.	H	α-helix	trans	-59.1	-44.5	177.4	0	0	0	0	0	112.4	K498 F499 T505 Q506 L547	K498-A502 PolarHBondContact O-N 3.48Å; F499-A502 PolarHBondContact O-N 3.43Å; A502-T505 PolarHBondContact O-N 2.85Å; A502-Q506 PolarHBondContact O-N 3.03Å; A502-L547 HydrophobicContact CB-CD1 4.3Å; A502-L547 HydrophobicContact CB-CD2 4.29Å
503	M	89.1	Confident	85.4	Confident	21 Å²	21	65.9 Å²	65.9	10%	0.103	32%	0.316	C	S	.	.	H	α-helix	trans	-57.5	-52.2	174.6	-175.2	-163	87.9	0	0	111.5	F499 R500 R501 T505 Q506 E507 Y544 L547 E548 S551	F499-M503 VanDerWaalsContact O-CB 3.31Å; F499-M503 WeakPolarHBondContact O-CB 3.35Å; F499-M503 PolarHBondContact O-N 3.25Å; R500-M503 HydrophobicContact CG-CE 4.26Å; R501-M503 VanDerWaalsContact C-N 3.35Å; R501-M503 PolarHBondContact O-N 2.71Å; M503-T505 PolarHBondContact O-N 3.42Å; M503-Q506 PolarHBondContact O-N 3.3Å; M503-E507 WeakPolarHBondContact O-CB 3.43Å; M503-E507 PolarHBondContact O-N 3.04Å; M503-Y544 HydrophobicContact CG-CD2 4.45Å; M503-Y544 HydrophobicContact CG-CE2 3.88Å; M503-L547 HydrophobicContact CB-CB 4.17Å; M503-E548 HydrophobicContact CG-CB 4.32Å; M503-E548 HydrophobicContact SD-CB 4.3Å; M503-E548 HydrophobicContact SD-CG 4.46Å; M503-S551 WeakPolarHBondContact SD-CB 3.39Å; M503-S551 PolarHBondContact SD-OG 2.62Å; M503-S551 VanDerWaalsContact SD-OG 3.39Å
504	N	81.1	Confident	85.5	Confident	66 Å²	66	66.9 Å²	66.9	35%	0.353	33%	0.325	S	S	.	.	H	α-helix	trans	-60	-40.9	178.3	-74.5	27	0	0	0	112.4	R500 R501 E507 N508	R500-N504 WeakPolarHBondContact O-CB 3.47Å; R500-N504 VanDerWaalsContact O-CG 3.25Å; R500-N504 PolarHBondContact O-N 2.92Å; R500-N504 PolarHBondContact O-OD1 3.06Å; R501-N504 PolarHBondContact O-N 2.86Å; N504-E507 PolarHBondContact O-N 3.16Å; N504-N508 PolarHBondContact O-N 2.97Å; N504-N508 PolarHBondContact O-ND2 3.35Å
505	T	82.7	Confident	85.6	Confident	100 Å²	100	63.9 Å²	63.9	61%	0.613	31%	0.313	S	S	*	.	H	α-helix	trans	-64.4	-43.3	177.4	-58.9	0	0	0	0	111.1	R501 A502 M503 N508 A509	R501-T505 PolarHBondContact O-N 2.89Å; R501-T505 PolarHBondContact O-OG1 2.88Å; A502-T505 PolarHBondContact O-N 2.85Å; M503-T505 PolarHBondContact O-N 3.42Å; T505-N508 PolarHBondContact O-N 2.93Å; T505-A509 PolarHBondContact O-N 3.22Å
506	Q	88.3	Confident	85.6	Confident	45 Å²	45	62.4 Å²	62.4	21%	0.21	31%	0.314	C	S	.	.	H	α-helix	trans	-68.4	-36.9	177	-174.1	59	42	0	0	112.1	A502 M503 A509 T510 L547	A502-Q506 PolarHBondContact O-N 3.03Å; M503-Q506 PolarHBondContact O-N 3.3Å; Q506-A509 PolarHBondContact O-N 3.31Å; Q506-T510 PolarHBondContact NE2-OG1 2.99Å; Q506-T510 WeakPolarHBondContact O-CB 3.43Å; Q506-T510 PolarHBondContact O-N 2.74Å; Q506-T510 PolarHBondContact O-OG1 2.04Å; Q506-T510 VanDerWaalsContact O-OG1 3.09Å; Q506-L547 HydrophobicContact CB-CD1 3.67Å; Q506-L547 HydrophobicContact CG-CD1 4.08Å
507	E	89.4	Confident	85.8	Confident	48 Å²	48	63 Å²	63	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-50.1	173.8	-169	-172.6	173.2	0	0	111.3	M503 N504 A509 T510 R511 Y544	M503-E507 WeakPolarHBondContact O-CB 3.43Å; M503-E507 PolarHBondContact O-N 3.04Å; N504-E507 PolarHBondContact O-N 3.16Å; E507-A509 VanDerWaalsContact C-N 3.31Å; E507-A509 PolarHBondContact O-N 3.48Å; E507-T510 PolarHBondContact O-N 3.12Å; E507-R511 WeakPolarHBondContact O-CG 3.38Å; E507-R511 PolarHBondContact O-N 2.71Å; E507-R511 IonicContact OE1-CZ 3Å; E507-R511 VanDerWaalsContact OE1-CZ 3.3Å; E507-R511 IonicContact OE1-NE 3.29Å; E507-R511 PolarHBondContact OE1-NE 3.24Å; E507-R511 VanDerWaalsContact OE1-NE 3.16Å; E507-R511 IonicContact OE1-NH2 3.75Å; E507-R511 PolarHBondContact OE1-NH2 3.06Å; E507-Y544 HydrophobicContact CB-CD2 3.83Å; E507-Y544 HydrophobicContact CB-CE2 3.7Å; E507-Y544 HydrophobicContact CG-CD2 4.29Å; E507-Y544 HydrophobicContact CG-CE2 3.87Å
508	N	80.4	Confident	86.2	Confident	64 Å²	64	67.9 Å²	67.9	34%	0.342	35%	0.345	S	S	.	.	H	α-helix	trans	-58.3	-43.1	175.6	-75.4	-63.8	0	0	0	111.5	S289 N504 T505 A512	S289-N508 WeakPolarHBondContact CB-OD1 3.45Å; S289-N508 PolarHBondContact OG-OD1 3.09Å; N504-N508 PolarHBondContact O-N 2.97Å; N504-N508 PolarHBondContact O-ND2 3.35Å; T505-N508 PolarHBondContact O-N 2.93Å; N508-A512 VanDerWaalsContact O-CB 3.23Å; N508-A512 WeakPolarHBondContact O-CB 3.21Å; N508-A512 PolarHBondContact O-N 3.47Å
509	A	84.6	Confident	86.3	Confident	39 Å²	39	68.4 Å²	68.4	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-66	-36.9	177.9	0	0	0	0	0	112.9	T505 Q506 E507 R513	T505-A509 PolarHBondContact O-N 3.22Å; Q506-A509 PolarHBondContact O-N 3.31Å; E507-A509 VanDerWaalsContact C-N 3.31Å; E507-A509 PolarHBondContact O-N 3.48Å; A509-R513 WeakPolarHBondContact O-CG 3.38Å; A509-R513 PolarHBondContact O-N 2.75Å
510	T	89.9	Confident	86.6	Confident	8 Å²	8	69.4 Å²	69.4	5%	0.049	36%	0.36	C	S	.	.	H	α-helix	trans	-70	-46.4	175.8	-63.8	0	0	0	0	111	Q506 E507 A512 R513 A514 Y537 A540 I541	Q506-T510 PolarHBondContact NE2-OG1 2.99Å; Q506-T510 WeakPolarHBondContact O-CB 3.43Å; Q506-T510 PolarHBondContact O-N 2.74Å; Q506-T510 PolarHBondContact O-OG1 2.04Å; Q506-T510 VanDerWaalsContact O-OG1 3.09Å; E507-T510 PolarHBondContact O-N 3.12Å; T510-A512 PolarHBondContact O-N 3.14Å; T510-R513 PolarHBondContact O-N 2.92Å; T510-A514 PolarHBondContact O-N 2.94Å; T510-Y537 HydrophobicContact CG2-CD2 4.15Å; T510-Y537 HydrophobicContact CG2-CE2 3.55Å; T510-A540 HydrophobicContact CG2-CB 3.96Å; T510-A540 WeakPolarHBondContact OG1-CB 3.41Å; T510-A540 PolarHBondContact OG1-O 3.13Å; T510-A540 VanDerWaalsContact OG1-O 3.04Å; T510-I541 HydrophobicContact CG2-CG1 4.11Å
511	R	83.6	Confident	87.2	Confident	119 Å²	119	69.9 Å²	69.9	45%	0.449	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-43.2	175.5	-70.2	-177.9	-174.6	-139.3	5.5	112.3	V286 E507 R513 A514 V515	V286-R511 HydrophobicContact CG1-CB 4.41Å; E507-R511 WeakPolarHBondContact O-CG 3.38Å; E507-R511 PolarHBondContact O-N 2.71Å; E507-R511 IonicContact OE1-CZ 3Å; E507-R511 VanDerWaalsContact OE1-CZ 3.3Å; E507-R511 IonicContact OE1-NE 3.29Å; E507-R511 PolarHBondContact OE1-NE 3.24Å; E507-R511 VanDerWaalsContact OE1-NE 3.16Å; E507-R511 IonicContact OE1-NH2 3.75Å; E507-R511 PolarHBondContact OE1-NH2 3.06Å; R511-R513 VanDerWaalsContact C-N 3.29Å; R511-R513 PolarHBondContact O-N 2.68Å; R511-A514 WeakPolarHBondContact O-CB 3.44Å; R511-A514 PolarHBondContact O-N 3.4Å; R511-A514 VanDerWaalsContact O-N 3.13Å; R511-V515 PolarHBondContact O-N 3.24Å; R511-V515 VanDerWaalsContact O-N 3.11Å
512	A	83.2	Confident	87.8	Confident	58 Å²	58	67.8 Å²	67.8	48%	0.479	36%	0.362	S	S	.	.	H	α-helix	trans	-60.2	-37.9	179.5	0	0	0	0	0	112.5	N508 T510 V515 D516	N508-A512 VanDerWaalsContact O-CB 3.23Å; N508-A512 WeakPolarHBondContact O-CB 3.21Å; N508-A512 PolarHBondContact O-N 3.47Å; T510-A512 PolarHBondContact O-N 3.14Å; A512-V515 PolarHBondContact O-N 3.07Å; A512-D516 WeakPolarHBondContact O-CB 3.35Å; A512-D516 PolarHBondContact O-N 2.99Å
513	R	87.7	Confident	88.4	Confident	92 Å²	92	69 Å²	69	35%	0.347	37%	0.366	S	S	.	.	H	α-helix	trans	-64.8	-39.5	174.7	-69.8	169.1	-174.7	-152.2	-1.6	112.7	A509 T510 R511 D516 S517	A509-R513 WeakPolarHBondContact O-CG 3.38Å; A509-R513 PolarHBondContact O-N 2.75Å; T510-R513 PolarHBondContact O-N 2.92Å; R511-R513 VanDerWaalsContact C-N 3.29Å; R511-R513 PolarHBondContact O-N 2.68Å; R513-D516 PolarHBondContact O-N 3.5Å; R513-S517 WeakPolarHBondContact O-CB 3.48Å; R513-S517 PolarHBondContact O-N 2.73Å
514	A	89.2	Confident	88.8	Confident	25 Å²	25	69 Å²	69	21%	0.207	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-44.2	177.1	0	0	0	0	0	111.3	T510 R511 S517 L518 Y537	T510-A514 PolarHBondContact O-N 2.94Å; R511-A514 WeakPolarHBondContact O-CB 3.44Å; R511-A514 PolarHBondContact O-N 3.4Å; R511-A514 VanDerWaalsContact O-N 3.13Å; A514-S517 PolarHBondContact O-N 2.82Å; A514-L518 VanDerWaalsContact O-CG 3.31Å; A514-L518 WeakPolarHBondContact O-CG 3.17Å; A514-L518 PolarHBondContact O-N 3.39Å; A514-Y537 HydrophobicContact CB-CD2 4.3Å; A514-Y537 HydrophobicContact CB-CE2 3.76Å
515	V	87.8	Confident	89.5	Confident	31 Å²	31	70.1 Å²	70.1	19%	0.188	37%	0.369	C	S	.	.	H	α-helix	trans	-65.5	-44.7	176.3	172.5	0	0	0	0	111.8	V286 E287 R511 A512 S517 L518 L519	V286-V515 HydrophobicContact CB-CG2 3.92Å; V286-V515 HydrophobicContact CG1-CG2 3.37Å; E287-V515 HydrophobicContact CG-CG1 4.49Å; R511-V515 PolarHBondContact O-N 3.24Å; R511-V515 VanDerWaalsContact O-N 3.11Å; A512-V515 PolarHBondContact O-N 3.07Å; V515-S517 VanDerWaalsContact C-N 3.28Å; V515-S517 PolarHBondContact O-N 2.97Å; V515-L518 PolarHBondContact O-N 3.32Å; V515-L518 VanDerWaalsContact O-N 3.13Å; V515-L519 HydrophobicContact CG1-CD1 3.66Å; V515-L519 HydrophobicContact CG1-CG 3.93Å; V515-L519 WeakPolarHBondContact O-CB 3.35Å; V515-L519 WeakPolarHBondContact O-CG 3.18Å; V515-L519 PolarHBondContact O-N 2.86Å
516	D	87.6	Confident	90.2	Very high	86 Å²	86	73.1 Å²	73.1	46%	0.46	37%	0.37	S	S	.	.	H	α-helix	trans	-59.1	-39.7	177.8	-170.4	47.7	0	0	0	112	A512 R513 N520	A512-D516 WeakPolarHBondContact O-CB 3.35Å; A512-D516 PolarHBondContact O-N 2.99Å; R513-D516 PolarHBondContact O-N 3.5Å; D516-N520 WeakPolarHBondContact O-CB 3.36Å; D516-N520 PolarHBondContact O-N 3.06Å; D516-N520 PolarHBondContact O-ND2 3.11Å; D516-N520 PolarHBondContact OD1-ND2 3.39Å
517	S	90.9	Very high	90.6	Very high	28 Å²	28	79.8 Å²	79.8	20%	0.196	40%	0.395	C	S	.	.	H	α-helix	trans	-66.2	-40.2	174	-171.9	0	0	0	0	112.9	R513 A514 V515 N520 F521	R513-S517 WeakPolarHBondContact O-CB 3.48Å; R513-S517 PolarHBondContact O-N 2.73Å; A514-S517 PolarHBondContact O-N 2.82Å; V515-S517 VanDerWaalsContact C-N 3.28Å; V515-S517 PolarHBondContact O-N 2.97Å; S517-N520 CarbonylContact O-C 3.6Å; S517-F521 PolarHBondContact O-N 3.3Å
518	L	92.4	Very high	91	Very high	125 Å²	125	83.8 Å²	83.8	65%	0.654	42%	0.417	S	S	*	.	H	α-helix	trans	-77.1	-35.2	-179.6	-70.3	172.6	0	0	0	113.6	A514 V515 N520 F521	A514-L518 VanDerWaalsContact O-CG 3.31Å; A514-L518 WeakPolarHBondContact O-CG 3.17Å; A514-L518 PolarHBondContact O-N 3.39Å; V515-L518 PolarHBondContact O-N 3.32Å; V515-L518 VanDerWaalsContact O-N 3.13Å; L518-N520 VanDerWaalsContact C-N 3.3Å; L518-F521 WeakPolarHBondContact O-CB 3.19Å; L518-F521 PolarHBondContact O-N 3.03Å
519	L	88.8	Confident	91.7	Very high	116 Å²	116	81.9 Å²	81.9	61%	0.607	41%	0.41	S	S	*	.	H	α-helix	trans	-64.8	-38	173	-72.4	175.9	0	0	0	110.9	V515 F521	V515-L519 HydrophobicContact CG1-CD1 3.66Å; V515-L519 HydrophobicContact CG1-CG 3.93Å; V515-L519 WeakPolarHBondContact O-CB 3.35Å; V515-L519 WeakPolarHBondContact O-CG 3.18Å; V515-L519 PolarHBondContact O-N 2.86Å; L519-F521 VanDerWaalsContact C-N 3.29Å; L519-F521 PolarHBondContact O-N 3.43Å
520	N	94.1	Very high	92.3	Very high	71 Å²	71	83 Å²	83	38%	0.38	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	31.5	176.9	-60.1	-65.2	0	0	0	112.4	D516 S517 L518 E522 T523 V524	D516-N520 WeakPolarHBondContact O-CB 3.36Å; D516-N520 PolarHBondContact O-N 3.06Å; D516-N520 PolarHBondContact O-ND2 3.11Å; D516-N520 PolarHBondContact OD1-ND2 3.39Å; S517-N520 CarbonylContact O-C 3.6Å; L518-N520 VanDerWaalsContact C-N 3.3Å; N520-E522 VanDerWaalsContact C-N 3.28Å; N520-E522 PolarHBondContact O-N 2.93Å; N520-T523 WeakPolarHBondContact O-CA 3.44Å; N520-T523 WeakPolarHBondContact O-CB 3.3Å; N520-T523 PolarHBondContact O-N 3.31Å; N520-V524 PolarHBondContact O-N 3.47Å
521	F	92.9	Very high	92.6	Very high	115 Å²	115	87.6 Å²	87.6	50%	0.504	44%	0.441	S	S	.	.	H	α-helix	trans	-53	-42.9	-176.8	174.5	-96.8	0	0	0	113.1	S517 L518 L519 T523 V524 K525	S517-F521 PolarHBondContact O-N 3.3Å; L518-F521 WeakPolarHBondContact O-CB 3.19Å; L518-F521 PolarHBondContact O-N 3.03Å; L519-F521 VanDerWaalsContact C-N 3.29Å; L519-F521 PolarHBondContact O-N 3.43Å; F521-T523 PolarHBondContact O-N 2.86Å; F521-V524 PolarHBondContact O-N 2.89Å; F521-K525 HydrophobicContact CD1-CG 4.33Å; F521-K525 HydrophobicContact CE1-CG 3.95Å; F521-K525 HydrophobicContact CE2-CG 4.2Å; F521-K525 HydrophobicContact CZ-CD 4.27Å; F521-K525 HydrophobicContact CZ-CG 3.88Å; F521-K525 WeakPolarHBondContact O-CB 3.27Å; F521-K525 VanDerWaalsContact O-CG 3.32Å; F521-K525 WeakPolarHBondContact O-CG 3.09Å; F521-K525 PolarHBondContact O-N 3.48Å
522	E	95.6	Very high	93.3	Very high	126 Å²	126	89 Å²	89	59%	0.589	45%	0.448	S	S	*	.	H	α-helix	trans	-60	-45.8	175.9	-67.6	-173.7	-177.8	0	0	111.5	N520 V524 K525 Y526	N520-E522 VanDerWaalsContact C-N 3.28Å; N520-E522 PolarHBondContact O-N 2.93Å; E522-V524 PolarHBondContact O-N 3.32Å; E522-K525 CarbonylContact O-C 3.6Å; E522-K525 WeakPolarHBondContact O-CB 3.24Å; E522-K525 PolarHBondContact O-N 3.44Å; E522-K525 VanDerWaalsContact O-N 3.16Å; E522-Y526 HydrophobicContact CB-CD2 4.44Å; E522-Y526 HydrophobicContact CB-CE2 3.81Å; E522-Y526 VanDerWaalsContact O-CD2 3.24Å; E522-Y526 WeakPolarHBondContact O-CD2 3.29Å; E522-Y526 PolarHBondContact O-N 3.14Å; E522-Y526 PolarHBondContact OE2-OH 3.33Å
523	T	96.9	Very high	93.9	Very high	66 Å²	66	87.6 Å²	87.6	41%	0.405	43%	0.431	S	S	.	.	H	α-helix	trans	-60.8	-46.5	176.9	-45.1	0	0	0	0	111.7	N520 F521 K525 Y526 Y527	N520-T523 WeakPolarHBondContact O-CA 3.44Å; N520-T523 WeakPolarHBondContact O-CB 3.3Å; N520-T523 PolarHBondContact O-N 3.31Å; F521-T523 PolarHBondContact O-N 2.86Å; T523-K525 PolarHBondContact O-N 2.85Å; T523-Y526 PolarHBondContact O-N 2.89Å; T523-Y527 HydrophobicContact CG2-CD2 3.92Å; T523-Y527 HydrophobicContact CG2-CE2 3.85Å; T523-Y527 VanDerWaalsContact O-CD2 3.25Å; T523-Y527 WeakPolarHBondContact O-CD2 3.42Å; T523-Y527 PolarHBondContact O-N 3.35Å
524	V	97.6	Very high	94.3	Very high	21 Å²	21	87.8 Å²	87.8	13%	0.127	44%	0.443	C	S	.	.	H	α-helix	trans	-58.8	-38	177	177.2	0	0	0	0	110.7	N520 F521 E522 N528 A529 E530 E533	N520-V524 PolarHBondContact O-N 3.47Å; F521-V524 PolarHBondContact O-N 2.89Å; E522-V524 PolarHBondContact O-N 3.32Å; V524-N528 PolarHBondContact O-N 3.13Å; V524-A529 HydrophobicContact CG1-CB 4.26Å; V524-A529 PolarHBondContact O-N 2.93Å; V524-E530 HydrophobicContact CG1-CG 4.17Å; V524-E533 HydrophobicContact CG2-CG 4.38Å
525	K	96.2	Very high	94.7	Very high	89 Å²	89	90.7 Å²	90.7	39%	0.387	45%	0.452	S	S	.	.	H	α-helix	trans	-72.6	-42.2	176.3	-71.5	-73.4	168.1	-172.4	0	113.6	F521 E522 T523 Y527 N528 E530	F521-K525 HydrophobicContact CD1-CG 4.33Å; F521-K525 HydrophobicContact CE1-CG 3.95Å; F521-K525 HydrophobicContact CE2-CG 4.2Å; F521-K525 HydrophobicContact CZ-CD 4.27Å; F521-K525 HydrophobicContact CZ-CG 3.88Å; F521-K525 WeakPolarHBondContact O-CB 3.27Å; F521-K525 VanDerWaalsContact O-CG 3.32Å; F521-K525 WeakPolarHBondContact O-CG 3.09Å; F521-K525 PolarHBondContact O-N 3.48Å; E522-K525 CarbonylContact O-C 3.6Å; E522-K525 WeakPolarHBondContact O-CB 3.24Å; E522-K525 PolarHBondContact O-N 3.44Å; E522-K525 VanDerWaalsContact O-N 3.16Å; T523-K525 PolarHBondContact O-N 2.85Å; K525-Y527 PolarHBondContact O-N 2.8Å; K525-N528 PolarHBondContact O-N 3.05Å; K525-E530 WeakPolarHBondContact CD-OE1 3.42Å; K525-E530 WeakPolarHBondContact CE-OE1 3.29Å; K525-E530 IonicContact NZ-OE1 3.68Å; K525-E530 PolarHBondContact NZ-OE1 3.22Å
526	Y	97.4	Very high	95	Very high	164 Å²	164	93.5 Å²	93.5	64%	0.643	46%	0.459	S	S	*	.	H	α-helix	trans	-59.9	-30.6	178.3	-63.9	-33.6	0	0	0	112.8	E522 T523	E522-Y526 HydrophobicContact CB-CD2 4.44Å; E522-Y526 HydrophobicContact CB-CE2 3.81Å; E522-Y526 VanDerWaalsContact O-CD2 3.24Å; E522-Y526 WeakPolarHBondContact O-CD2 3.29Å; E522-Y526 PolarHBondContact O-N 3.14Å; E522-Y526 PolarHBondContact OE2-OH 3.33Å; T523-Y526 PolarHBondContact O-N 2.89Å
527	Y	97.4	Very high	95.4	Very high	185 Å²	185	93.9 Å²	93.9	73%	0.725	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	5.9	179.8	-64.3	-69.2	0	0	0	114.7	T523 K525 A529	T523-Y527 HydrophobicContact CG2-CD2 3.92Å; T523-Y527 HydrophobicContact CG2-CE2 3.85Å; T523-Y527 VanDerWaalsContact O-CD2 3.25Å; T523-Y527 WeakPolarHBondContact O-CD2 3.42Å; T523-Y527 PolarHBondContact O-N 3.35Å; K525-Y527 PolarHBondContact O-N 2.8Å; Y527-A529 PolarHBondContact O-N 3.35Å
528	N	96.2	Very high	95.6	Very high	131 Å²	131	99 Å²	99	70%	0.701	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	41.5	-173.6	-62.3	-51.1	0	0	0	113	V524 K525 E530	V524-N528 PolarHBondContact O-N 3.13Å; K525-N528 PolarHBondContact O-N 3.05Å; N528-E530 VanDerWaalsContact CA-OE2 3.25Å; N528-E530 WeakPolarHBondContact CA-OE2 3.47Å
529	A	96.8	Very high	95.8	Very high	24 Å²	24	97.5 Å²	97.5	20%	0.198	46%	0.459	C	S	.	.			trans	-91.1	11	-170.8	0	0	0	0	0	113.8	V524 Y527 S531 Y532 E533	V524-A529 HydrophobicContact CG1-CB 4.26Å; V524-A529 PolarHBondContact O-N 2.93Å; Y527-A529 PolarHBondContact O-N 3.35Å; A529-S531 PolarHBondContact O-N 3.4Å; A529-Y532 WeakPolarHBondContact O-CB 3.19Å; A529-Y532 PolarHBondContact O-N 3.35Å; A529-Y532 VanDerWaalsContact O-N 3.13Å; A529-E533 PolarHBondContact O-N 3.17Å
530	E	96.6	Very high	96.1	Very high	64 Å²	64	92 Å²	92	30%	0.299	43%	0.43	S	S	.	.	H	α-helix	trans	-60.1	-47.4	-172.4	-57.3	96.7	136.3	0	0	112.3	V524 K525 N528 Y532 E533 V534	V524-E530 HydrophobicContact CG1-CG 4.17Å; K525-E530 WeakPolarHBondContact CD-OE1 3.42Å; K525-E530 WeakPolarHBondContact CE-OE1 3.29Å; K525-E530 IonicContact NZ-OE1 3.68Å; K525-E530 PolarHBondContact NZ-OE1 3.22Å; N528-E530 VanDerWaalsContact CA-OE2 3.25Å; N528-E530 WeakPolarHBondContact CA-OE2 3.47Å; E530-Y532 VanDerWaalsContact C-N 3.25Å; E530-Y532 PolarHBondContact O-N 2.79Å; E530-E533 PolarHBondContact O-N 3.2Å; E530-V534 WeakPolarHBondContact O-CB 3.28Å; E530-V534 VanDerWaalsContact O-CG2 3.27Å; E530-V534 WeakPolarHBondContact O-CG2 3.41Å; E530-V534 PolarHBondContact O-N 3.18Å
531	S	97.1	Very high	96.2	Very high	103 Å²	103	91.1 Å²	91.1	72%	0.72	43%	0.425	S	S	*	.	H	α-helix	trans	-63.3	-32.7	178.9	-59.3	0	0	0	0	112.5	A529 E535	A529-S531 PolarHBondContact O-N 3.4Å; S531-E535 PolarHBondContact O-N 3.13Å
532	Y	96.4	Very high	96.4	Very high	149 Å²	149	90 Å²	90	58%	0.584	42%	0.423	S	S	*	.	H	α-helix	trans	-69.8	-48.7	176.9	172.4	-95.1	0	0	0	111.1	A529 E530 V534 E535 R536	A529-Y532 WeakPolarHBondContact O-CB 3.19Å; A529-Y532 PolarHBondContact O-N 3.35Å; A529-Y532 VanDerWaalsContact O-N 3.13Å; E530-Y532 VanDerWaalsContact C-N 3.25Å; E530-Y532 PolarHBondContact O-N 2.79Å; Y532-V534 VanDerWaalsContact C-N 3.33Å; Y532-V534 PolarHBondContact O-N 3.5Å; Y532-E535 PolarHBondContact O-N 2.99Å; Y532-R536 VanDerWaalsContact O-CB 3.25Å; Y532-R536 WeakPolarHBondContact O-CB 3.44Å; Y532-R536 PolarHBondContact O-N 3.08Å
533	E	96.6	Very high	96.3	Very high	28 Å²	28	89.2 Å²	89.2	13%	0.131	42%	0.418	C	S	.	.	H	α-helix	trans	-66.2	-34.5	177.6	-74.7	-57.3	139.4	0	0	112.3	V524 A529 E530 R536 Y537	V524-E533 HydrophobicContact CG2-CG 4.38Å; A529-E533 PolarHBondContact O-N 3.17Å; E530-E533 PolarHBondContact O-N 3.2Å; E533-R536 VanDerWaalsContact CD-NH1 3.34Å; E533-R536 PolarHBondContact O-N 3.46Å; E533-R536 WeakPolarHBondContact OE1-CD 3.24Å; E533-R536 IonicContact OE1-CZ 3.91Å; E533-R536 IonicContact OE1-NE 2.68Å; E533-R536 IonicContact OE1-NH1 3.12Å; E533-R536 PolarHBondContact OE1-NH1 3.47Å; E533-R536 IonicContact OE2-NH1 2.66Å; E533-R536 PolarHBondContact OE2-NH1 2.98Å; E533-R536 VanDerWaalsContact OE2-NH1 3.14Å; E533-Y537 WeakPolarHBondContact O-CB 3.46Å; E533-Y537 PolarHBondContact O-N 3.01Å
534	V	96.3	Very high	96.2	Very high	97 Å²	97	88 Å²	88	59%	0.588	41%	0.406	S	S	*	.	H	α-helix	trans	-61.2	-46.9	172.9	167.6	0	0	0	0	111.9	E530 Y532 Y537 R538	E530-V534 WeakPolarHBondContact O-CB 3.28Å; E530-V534 VanDerWaalsContact O-CG2 3.27Å; E530-V534 WeakPolarHBondContact O-CG2 3.41Å; E530-V534 PolarHBondContact O-N 3.18Å; Y532-V534 VanDerWaalsContact C-N 3.33Å; Y532-V534 PolarHBondContact O-N 3.5Å; V534-Y537 PolarHBondContact O-N 3.06Å; V534-R538 WeakPolarHBondContact O-CB 3.35Å; V534-R538 PolarHBondContact O-N 3.39Å
535	E	97.2	Very high	96.1	Very high	85 Å²	85	91.8 Å²	91.8	40%	0.397	42%	0.423	S	S	.	.	H	α-helix	trans	-71.3	-38	178.7	-168.7	62	-150.8	0	0	111.6	S531 Y532 Y537 R538 E539	S531-E535 PolarHBondContact O-N 3.13Å; Y532-E535 PolarHBondContact O-N 2.99Å; E535-Y537 VanDerWaalsContact C-N 3.28Å; E535-Y537 PolarHBondContact O-N 3.01Å; E535-R538 WeakPolarHBondContact O-CB 3.3Å; E535-R538 PolarHBondContact O-N 3.26Å; E535-R538 IonicContact OE1-CZ 3.75Å; E535-R538 IonicContact OE1-NE 2.73Å; E535-R538 IonicContact OE1-NH1 2.68Å; E535-R538 PolarHBondContact OE1-NH1 3.4Å; E535-R538 VanDerWaalsContact OE2-CD 3.24Å; E535-R538 WeakPolarHBondContact OE2-CD 3.41Å; E535-R538 IonicContact OE2-CZ 2.65Å; E535-R538 IonicContact OE2-NE 3.21Å; E535-R538 IonicContact OE2-NH1 3.12Å; E535-R538 PolarHBondContact OE2-NH1 3.09Å; E535-E539 PolarHBondContact O-N 3.29Å
536	R	94	Very high	96.2	Very high	90 Å²	90	89.2 Å²	89.2	34%	0.34	42%	0.421	S	S	.	.	H	α-helix	trans	-60.5	-35.7	173.4	-174.8	-179.3	179.6	-143	0.1	112.4	Y532 E533 A540	Y532-R536 VanDerWaalsContact O-CB 3.25Å; Y532-R536 WeakPolarHBondContact O-CB 3.44Å; Y532-R536 PolarHBondContact O-N 3.08Å; E533-R536 VanDerWaalsContact CD-NH1 3.34Å; E533-R536 PolarHBondContact O-N 3.46Å; E533-R536 WeakPolarHBondContact OE1-CD 3.24Å; E533-R536 IonicContact OE1-CZ 3.91Å; E533-R536 IonicContact OE1-NE 2.68Å; E533-R536 IonicContact OE1-NH1 3.12Å; E533-R536 PolarHBondContact OE1-NH1 3.47Å; E533-R536 IonicContact OE2-NH1 2.66Å; E533-R536 PolarHBondContact OE2-NH1 2.98Å; E533-R536 VanDerWaalsContact OE2-NH1 3.14Å; R536-A540 PolarHBondContact O-N 3.23Å
537	Y	95.4	Very high	96	Very high	94 Å²	94	83.3 Å²	83.3	37%	0.369	40%	0.401	S	S	.	.	H	α-helix	trans	-74.9	-41.6	173.6	-174.5	-123.8	0	0	0	111.9	T510 A514 E533 V534 E535 E539 A540 I541	T510-Y537 HydrophobicContact CG2-CD2 4.15Å; T510-Y537 HydrophobicContact CG2-CE2 3.55Å; A514-Y537 HydrophobicContact CB-CD2 4.3Å; A514-Y537 HydrophobicContact CB-CE2 3.76Å; E533-Y537 WeakPolarHBondContact O-CB 3.46Å; E533-Y537 PolarHBondContact O-N 3.01Å; V534-Y537 PolarHBondContact O-N 3.06Å; E535-Y537 VanDerWaalsContact C-N 3.28Å; E535-Y537 PolarHBondContact O-N 3.01Å; Y537-E539 PolarHBondContact O-N 3.36Å; Y537-A540 WeakPolarHBondContact O-CA 3.44Å; Y537-A540 WeakPolarHBondContact O-CB 3.45Å; Y537-A540 PolarHBondContact O-N 2.96Å; Y537-I541 HydrophobicContact CD1-CD1 3.76Å; Y537-I541 HydrophobicContact CE1-CD1 3.5Å; Y537-I541 VanDerWaalsContact CE1-CD1 3.5Å; Y537-I541 HydrophobicContact CE1-CG1 4.28Å; Y537-I541 HydrophobicContact CE2-CG1 4.45Å; Y537-I541 HydrophobicContact CG-CD1 4.39Å; Y537-I541 PolarHBondContact O-N 2.99Å
538	R	96.8	Very high	95.9	Very high	135 Å²	135	78 Å²	78	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-57.4	-44.2	174.3	-177	-174.6	171.8	-136.1	-5	112.3	V534 E535 A540 I541 I542	V534-R538 WeakPolarHBondContact O-CB 3.35Å; V534-R538 PolarHBondContact O-N 3.39Å; E535-R538 WeakPolarHBondContact O-CB 3.3Å; E535-R538 PolarHBondContact O-N 3.26Å; E535-R538 IonicContact OE1-CZ 3.75Å; E535-R538 IonicContact OE1-NE 2.73Å; E535-R538 IonicContact OE1-NH1 2.68Å; E535-R538 PolarHBondContact OE1-NH1 3.4Å; E535-R538 VanDerWaalsContact OE2-CD 3.24Å; E535-R538 WeakPolarHBondContact OE2-CD 3.41Å; E535-R538 IonicContact OE2-CZ 2.65Å; E535-R538 IonicContact OE2-NE 3.21Å; E535-R538 IonicContact OE2-NH1 3.12Å; E535-R538 PolarHBondContact OE2-NH1 3.09Å; R538-A540 VanDerWaalsContact C-N 3.29Å; R538-A540 PolarHBondContact O-N 3.5Å; R538-I541 PolarHBondContact O-N 3Å; R538-I542 HydrophobicContact CG-CD1 4.13Å; R538-I542 WeakPolarHBondContact O-CG1 3.38Å; R538-I542 PolarHBondContact O-N 3.21Å
539	E	96.3	Very high	95.9	Very high	94 Å²	94	80.4 Å²	80.4	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-57.3	-42.3	172.2	-83.5	-161.1	-157.9	0	0	112.8	E535 Y537 I541 I542 K543	E535-E539 PolarHBondContact O-N 3.29Å; Y537-E539 PolarHBondContact O-N 3.36Å; E539-I541 VanDerWaalsContact C-N 3.34Å; E539-I542 PolarHBondContact O-N 3.29Å; E539-K543 WeakPolarHBondContact O-CB 3.49Å; E539-K543 WeakPolarHBondContact O-CD 3.32Å; E539-K543 WeakPolarHBondContact O-CG 3.31Å; E539-K543 PolarHBondContact O-N 3.23Å; E539-K543 IonicContact OE2-NZ 2.82Å; E539-K543 PolarHBondContact OE2-NZ 2.94Å
540	A	94.4	Very high	95.8	Very high	0 Å²	0	84 Å²	84	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-67.7	-36	180	0	0	0	0	0	111.5	T510 R536 Y537 R538 Y544	T510-A540 HydrophobicContact CG2-CB 3.96Å; T510-A540 WeakPolarHBondContact OG1-CB 3.41Å; T510-A540 PolarHBondContact OG1-O 3.13Å; T510-A540 VanDerWaalsContact OG1-O 3.04Å; R536-A540 PolarHBondContact O-N 3.23Å; Y537-A540 WeakPolarHBondContact O-CA 3.44Å; Y537-A540 WeakPolarHBondContact O-CB 3.45Å; Y537-A540 PolarHBondContact O-N 2.96Å; R538-A540 VanDerWaalsContact C-N 3.29Å; R538-A540 PolarHBondContact O-N 3.5Å; A540-Y544 WeakPolarHBondContact O-CB 3.25Å; A540-Y544 PolarHBondContact O-N 2.93Å
541	I	96.2	Very high	95.5	Very high	53 Å²	53	81.1 Å²	81.1	27%	0.272	38%	0.38	S	S	.	.	H	α-helix	trans	-63.6	-48.7	171.1	-69.9	168.3	0	0	0	111	T510 Y537 R538 E539 K543 Y544 Q545	T510-I541 HydrophobicContact CG2-CG1 4.11Å; Y537-I541 HydrophobicContact CD1-CD1 3.76Å; Y537-I541 HydrophobicContact CE1-CD1 3.5Å; Y537-I541 VanDerWaalsContact CE1-CD1 3.5Å; Y537-I541 HydrophobicContact CE1-CG1 4.28Å; Y537-I541 HydrophobicContact CE2-CG1 4.45Å; Y537-I541 HydrophobicContact CG-CD1 4.39Å; Y537-I541 PolarHBondContact O-N 2.99Å; R538-I541 PolarHBondContact O-N 3Å; E539-I541 VanDerWaalsContact C-N 3.34Å; I541-K543 VanDerWaalsContact C-N 3.3Å; I541-K543 PolarHBondContact O-N 2.66Å; I541-Y544 CarbonylContact O-C 3.59Å; I541-Y544 WeakPolarHBondContact O-CA 3.39Å; I541-Y544 WeakPolarHBondContact O-CB 3.35Å; I541-Y544 PolarHBondContact O-N 2.91Å; I541-Y544 VanDerWaalsContact O-N 3.09Å; I541-Q545 HydrophobicContact CG2-CG 4.1Å; I541-Q545 WeakPolarHBondContact O-CG 3.39Å; I541-Q545 PolarHBondContact O-N 3.2Å
542	I	96.9	Very high	95.3	Very high	91 Å²	91	79.2 Å²	79.2	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-41.6	-179.4	-67.7	165.1	0	0	0	110.8	R538 E539 Q545 G546	R538-I542 HydrophobicContact CG-CD1 4.13Å; R538-I542 WeakPolarHBondContact O-CG1 3.38Å; R538-I542 PolarHBondContact O-N 3.21Å; E539-I542 PolarHBondContact O-N 3.29Å; I542-Q545 PolarHBondContact O-N 3.33Å; I542-G546 PolarHBondContact O-N 3.48Å; I542-G546 VanDerWaalsContact O-N 3.11Å
543	K	94.7	Very high	95.2	Very high	110 Å²	110	73.8 Å²	73.8	48%	0.478	35%	0.353	S	S	.	.	H	α-helix	trans	-63.3	-39.5	174.8	-72.1	162.1	-177.1	160.9	0	112	E539 I541	E539-K543 WeakPolarHBondContact O-CB 3.49Å; E539-K543 WeakPolarHBondContact O-CD 3.32Å; E539-K543 WeakPolarHBondContact O-CG 3.31Å; E539-K543 PolarHBondContact O-N 3.23Å; E539-K543 IonicContact OE2-NZ 2.82Å; E539-K543 PolarHBondContact OE2-NZ 2.94Å; I541-K543 VanDerWaalsContact C-N 3.3Å; I541-K543 PolarHBondContact O-N 2.66Å
544	Y	94.3	Very high	95.1	Very high	41 Å²	41	72.8 Å²	72.8	16%	0.161	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-50.7	172.5	164.9	-96.2	0	0	0	112.2	M503 E507 A540 I541 G546 L547 E548	M503-Y544 HydrophobicContact CG-CD2 4.45Å; M503-Y544 HydrophobicContact CG-CE2 3.88Å; E507-Y544 HydrophobicContact CB-CD2 3.83Å; E507-Y544 HydrophobicContact CB-CE2 3.7Å; E507-Y544 HydrophobicContact CG-CD2 4.29Å; E507-Y544 HydrophobicContact CG-CE2 3.87Å; A540-Y544 WeakPolarHBondContact O-CB 3.25Å; A540-Y544 PolarHBondContact O-N 2.93Å; I541-Y544 CarbonylContact O-C 3.59Å; I541-Y544 WeakPolarHBondContact O-CA 3.39Å; I541-Y544 WeakPolarHBondContact O-CB 3.35Å; I541-Y544 PolarHBondContact O-N 2.91Å; I541-Y544 VanDerWaalsContact O-N 3.09Å; Y544-G546 VanDerWaalsContact C-N 3.27Å; Y544-G546 PolarHBondContact O-N 3.31Å; Y544-L547 WeakPolarHBondContact O-CA 3.32Å; Y544-L547 WeakPolarHBondContact O-CB 3.39Å; Y544-L547 PolarHBondContact O-N 3Å; Y544-E548 HydrophobicContact CE1-CB 4.1Å; Y544-E548 VanDerWaalsContact CE1-CD 3.49Å; Y544-E548 HydrophobicContact CE1-CG 4.35Å; Y544-E548 WeakPolarHBondContact CE1-OE2 3.48Å; Y544-E548 PolarHBondContact O-N 3.19Å; Y544-E548 VanDerWaalsContact OH-CD 3.25Å; Y544-E548 PolarHBondContact OH-OE1 2.83Å
545	Q	96	Very high	94.8	Very high	100 Å²	100	71.2 Å²	71.2	47%	0.467	34%	0.337	S	S	.	.	H	α-helix	trans	-57.2	-38	-179	-75	174.1	-23.2	0	0	112.3	I541 I542 L547 E548 W549	I541-Q545 HydrophobicContact CG2-CG 4.1Å; I541-Q545 WeakPolarHBondContact O-CG 3.39Å; I541-Q545 PolarHBondContact O-N 3.2Å; I542-Q545 PolarHBondContact O-N 3.33Å; Q545-L547 VanDerWaalsContact C-N 3.26Å; Q545-L547 PolarHBondContact O-N 3.22Å; Q545-E548 PolarHBondContact O-N 2.97Å; Q545-W549 WeakPolarHBondContact O-CB 3.49Å; Q545-W549 PolarHBondContact O-N 3.41Å
546	G	96.6	Very high	94.6	Very high	35 Å²	35	71.3 Å²	71.3	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-64.5	-25	175	0	0	0	0	0	114.6	I542 Y544 K550	I542-G546 PolarHBondContact O-N 3.48Å; I542-G546 VanDerWaalsContact O-N 3.11Å; Y544-G546 VanDerWaalsContact C-N 3.27Å; Y544-G546 PolarHBondContact O-N 3.31Å; G546-K550 WeakPolarHBondContact O-CG 3.44Å
547	L	94.5	Very high	94.5	Very high	40 Å²	40	71.5 Å²	71.5	21%	0.209	35%	0.35	C	S	.	.	H	α-helix	trans	-90.3	-37.2	174.3	-64.9	174.3	0	0	0	111.9	A502 M503 Q506 Y544 Q545 K550 S551	A502-L547 HydrophobicContact CB-CD1 4.3Å; A502-L547 HydrophobicContact CB-CD2 4.29Å; M503-L547 HydrophobicContact CB-CB 4.17Å; Q506-L547 HydrophobicContact CB-CD1 3.67Å; Q506-L547 HydrophobicContact CG-CD1 4.08Å; Y544-L547 WeakPolarHBondContact O-CA 3.32Å; Y544-L547 WeakPolarHBondContact O-CB 3.39Å; Y544-L547 PolarHBondContact O-N 3Å; Q545-L547 VanDerWaalsContact C-N 3.26Å; Q545-L547 PolarHBondContact O-N 3.22Å; L547-K550 PolarHBondContact O-N 2.99Å; L547-S551 WeakPolarHBondContact O-CB 3.5Å; L547-S551 PolarHBondContact O-N 3.14Å
548	E	94.6	Very high	94.3	Very high	74 Å²	74	67.4 Å²	67.4	35%	0.346	34%	0.335	S	S	.	.	H	α-helix	trans	-57.6	-46.8	171.3	-178.7	175.9	-127.1	0	0	111.2	M503 Y544 Q545 K550 S551 S552	M503-E548 HydrophobicContact CG-CB 4.32Å; M503-E548 HydrophobicContact SD-CB 4.3Å; M503-E548 HydrophobicContact SD-CG 4.46Å; Y544-E548 HydrophobicContact CE1-CB 4.1Å; Y544-E548 VanDerWaalsContact CE1-CD 3.49Å; Y544-E548 HydrophobicContact CE1-CG 4.35Å; Y544-E548 WeakPolarHBondContact CE1-OE2 3.48Å; Y544-E548 PolarHBondContact O-N 3.19Å; Y544-E548 VanDerWaalsContact OH-CD 3.25Å; Y544-E548 PolarHBondContact OH-OE1 2.83Å; Q545-E548 PolarHBondContact O-N 2.97Å; E548-K550 VanDerWaalsContact C-N 3.33Å; E548-K550 PolarHBondContact O-N 3.37Å; E548-S551 CarbonylContact O-C 3.54Å; E548-S551 WeakPolarHBondContact O-CA 3.45Å; E548-S551 WeakPolarHBondContact O-CB 3.45Å; E548-S551 PolarHBondContact O-N 3.37Å; E548-S551 VanDerWaalsContact O-N 3.1Å; E548-S552 WeakPolarHBondContact O-CB 3.25Å; E548-S552 PolarHBondContact O-N 3.06Å; E548-S552 PolarHBondContact O-OG 2.81Å
549	W	96.1	Very high	94	Very high	182 Å²	182	63.6 Å²	63.6	69%	0.689	32%	0.324	S	S	*	.	H	α-helix	trans	-56.8	-44.5	174.6	179.8	86.7	0	0	0	112	Q545 S551 S552 A553	Q545-W549 WeakPolarHBondContact O-CB 3.49Å; Q545-W549 PolarHBondContact O-N 3.41Å; W549-S551 PolarHBondContact O-N 2.97Å; W549-S552 PolarHBondContact O-N 2.95Å; W549-A553 HydrophobicContact CZ2-CB 4.35Å; W549-A553 WeakPolarHBondContact O-CB 3.49Å; W549-A553 PolarHBondContact O-N 3.05Å
550	K	94.9	Very high	93.9	Very high	99 Å²	99	64.7 Å²	64.7	43%	0.43	33%	0.33	S	S	.	.	H	α-helix	trans	-64.2	-39.2	175.8	-67	174.1	-173.4	174.1	0	112	F499 G546 L547 E548 S554	F499-K550 HydrophobicContact CD1-CB 4.14Å; F499-K550 HydrophobicContact CD1-CD 4.49Å; F499-K550 HydrophobicContact CG-CB 4.45Å; G546-K550 WeakPolarHBondContact O-CG 3.44Å; L547-K550 PolarHBondContact O-N 2.99Å; E548-K550 VanDerWaalsContact C-N 3.33Å; E548-K550 PolarHBondContact O-N 3.37Å; K550-S554 WeakPolarHBondContact O-CB 3.34Å; K550-S554 PolarHBondContact O-N 2.88Å; K550-S554 VanDerWaalsContact O-N 3.12Å; K550-S554 PolarHBondContact O-OG 3.34Å
551	S	90.9	Very high	93.8	Very high	3 Å²	3	66.8 Å²	66.8	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-66	-35.6	176.5	-175.6	0	0	0	0	112.5	R496 M503 L547 E548 W549 S554	R496-S551 VanDerWaalsContact CZ-O 3.23Å; R496-S551 PolarHBondContact NE-O 3.09Å; R496-S551 PolarHBondContact NH2-O 2.9Å; M503-S551 WeakPolarHBondContact SD-CB 3.39Å; M503-S551 PolarHBondContact SD-OG 2.62Å; M503-S551 VanDerWaalsContact SD-OG 3.39Å; L547-S551 WeakPolarHBondContact O-CB 3.5Å; L547-S551 PolarHBondContact O-N 3.14Å; E548-S551 CarbonylContact O-C 3.54Å; E548-S551 WeakPolarHBondContact O-CA 3.45Å; E548-S551 WeakPolarHBondContact O-CB 3.45Å; E548-S551 PolarHBondContact O-N 3.37Å; E548-S551 VanDerWaalsContact O-N 3.1Å; W549-S551 PolarHBondContact O-N 2.97Å; S551-S554 PolarHBondContact O-OG 2.92Å; S551-S554 VanDerWaalsContact O-OG 3.04Å
552	S	92.4	Very high	93.6	Very high	63 Å²	63	64.5 Å²	64.5	44%	0.441	33%	0.331	S	S	.	.	H	α-helix	trans	-81.5	-45	178.2	-67.5	0	0	0	0	112.5	E548 W549 S554 L555 V556	E548-S552 WeakPolarHBondContact O-CB 3.25Å; E548-S552 PolarHBondContact O-N 3.06Å; E548-S552 PolarHBondContact O-OG 2.81Å; W549-S552 PolarHBondContact O-N 2.95Å; S552-S554 VanDerWaalsContact C-N 3.28Å; S552-S554 PolarHBondContact O-N 3.38Å; S552-L555 WeakPolarHBondContact O-CA 3.45Å; S552-L555 WeakPolarHBondContact O-CB 3.22Å; S552-L555 PolarHBondContact O-N 3.22Å; S552-V556 PolarHBondContact O-N 3.35Å
553	A	94.7	Very high	93.3	Very high	36 Å²	36	63.7 Å²	63.7	30%	0.298	33%	0.327	S	S	.	.	H	α-helix	trans	-58.9	-39	175.5	0	0	0	0	0	112.1	W549 L555 V556 L557	W549-A553 HydrophobicContact CZ2-CB 4.35Å; W549-A553 WeakPolarHBondContact O-CB 3.49Å; W549-A553 PolarHBondContact O-N 3.05Å; A553-L555 VanDerWaalsContact C-N 3.29Å; A553-L555 PolarHBondContact O-N 2.77Å; A553-V556 PolarHBondContact O-N 3.49Å; A553-L557 PolarHBondContact O-N 3.21Å
554	S	93.4	Very high	93.3	Very high	6 Å²	6	63.7 Å²	63.7	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-68.6	-22.2	174.2	52.8	0	0	0	0	114.2	R496 K550 S551 S552 L558	R496-S554 WeakPolarHBondContact CD-OG 3.4Å; R496-S554 WeakPolarHBondContact CG-OG 3.5Å; R496-S554 PolarHBondContact NE-OG 2.89Å; K550-S554 WeakPolarHBondContact O-CB 3.34Å; K550-S554 PolarHBondContact O-N 2.88Å; K550-S554 VanDerWaalsContact O-N 3.12Å; K550-S554 PolarHBondContact O-OG 3.34Å; S551-S554 PolarHBondContact O-OG 2.92Å; S551-S554 VanDerWaalsContact O-OG 3.04Å; S552-S554 VanDerWaalsContact C-N 3.28Å; S552-S554 PolarHBondContact O-N 3.38Å; S554-L558 PolarHBondContact O-N 3.42Å
555	L	90.4	Very high	93.3	Very high	64 Å²	64	62.4 Å²	62.4	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-75.6	-43	169.4	-178.5	56.4	0	0	0	111.3	S552 A553 L557 L558 N559	S552-L555 WeakPolarHBondContact O-CA 3.45Å; S552-L555 WeakPolarHBondContact O-CB 3.22Å; S552-L555 PolarHBondContact O-N 3.22Å; A553-L555 VanDerWaalsContact C-N 3.29Å; A553-L555 PolarHBondContact O-N 2.77Å; L555-L557 VanDerWaalsContact C-N 3.3Å; L555-L557 PolarHBondContact O-N 2.83Å; L555-L558 HydrophobicContact CD1-CD2 4.36Å; L555-L558 WeakPolarHBondContact O-CB 3.24Å; L555-L558 PolarHBondContact O-N 3.48Å; L555-N559 VanDerWaalsContact O-CG 3.29Å; L555-N559 PolarHBondContact O-N 3.11Å; L555-N559 PolarHBondContact O-OD1 3.48Å
556	V	92.6	Very high	93	Very high	88 Å²	88	58.6 Å²	58.6	53%	0.533	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-43.9	175.6	177.6	0	0	0	0	110.1	S552 A553 L558 N559 Q560	S552-V556 PolarHBondContact O-N 3.35Å; A553-V556 PolarHBondContact O-N 3.49Å; V556-L558 PolarHBondContact O-N 3.29Å; V556-N559 PolarHBondContact O-N 2.82Å; V556-Q560 HydrophobicContact CG1-CG 4.34Å; V556-Q560 VanDerWaalsContact O-CG 3.31Å; V556-Q560 WeakPolarHBondContact O-CG 3.48Å; V556-Q560 PolarHBondContact O-N 3.11Å
557	L	93	Very high	92.8	Very high	93 Å²	93	58.8 Å²	58.8	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-48	175.1	-177.5	62.6	0	0	0	112.1	A553 L555 N559 Q560 T561	A553-L557 PolarHBondContact O-N 3.21Å; L555-L557 VanDerWaalsContact C-N 3.3Å; L555-L557 PolarHBondContact O-N 2.83Å; L557-N559 PolarHBondContact O-N 3.22Å; L557-Q560 PolarHBondContact O-N 3.33Å; L557-T561 PolarHBondContact O-N 3.47Å; L557-T561 PolarHBondContact O-OG1 2.87Å
558	L	90.2	Very high	92.8	Very high	9 Å²	9	61.7 Å²	61.7	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-54.9	-51.4	175.2	172.4	63.3	0	0	0	111.3	V492 S554 L555 V556 Q560 T561 Q562	V492-L558 HydrophobicContact CB-CD1 3.93Å; V492-L558 HydrophobicContact CG1-CB 3.9Å; V492-L558 HydrophobicContact CG1-CD1 3.82Å; V492-L558 HydrophobicContact CG1-CG 4.38Å; S554-L558 PolarHBondContact O-N 3.42Å; L555-L558 HydrophobicContact CD1-CD2 4.36Å; L555-L558 WeakPolarHBondContact O-CB 3.24Å; L555-L558 PolarHBondContact O-N 3.48Å; V556-L558 PolarHBondContact O-N 3.29Å; L558-Q560 VanDerWaalsContact C-N 3.29Å; L558-Q560 PolarHBondContact O-N 2.9Å; L558-T561 PolarHBondContact O-N 2.75Å; L558-Q562 HydrophobicContact CD1-CG 4.09Å; L558-Q562 HydrophobicContact CG-CG 4.49Å; L558-Q562 WeakPolarHBondContact O-CB 3.32Å; L558-Q562 VanDerWaalsContact O-CG 3.27Å; L558-Q562 WeakPolarHBondContact O-CG 3.36Å; L558-Q562 PolarHBondContact O-N 3.07Å
559	N	90.9	Very high	92.6	Very high	54 Å²	54	58.6 Å²	58.6	29%	0.289	32%	0.316	S	S	.	.	H	α-helix	trans	-61	-37.7	-178.9	-67.1	0.4	0	0	0	111.7	L555 V556 L557 Q562 N563	L555-N559 VanDerWaalsContact O-CG 3.29Å; L555-N559 PolarHBondContact O-N 3.11Å; L555-N559 PolarHBondContact O-OD1 3.48Å; V556-N559 PolarHBondContact O-N 2.82Å; L557-N559 PolarHBondContact O-N 3.22Å; N559-Q562 WeakPolarHBondContact O-CB 3.31Å; N559-Q562 PolarHBondContact O-N 2.7Å; N559-N563 WeakPolarHBondContact O-CB 3.43Å; N559-N563 PolarHBondContact O-N 3.18Å; N559-N563 PolarHBondContact O-ND2 2.92Å
560	Q	94.1	Very high	92.4	Very high	117 Å²	117	52.3 Å²	52.3	55%	0.547	30%	0.296	S	S	.	.	H	α-helix	trans	-73.5	-38.8	178.3	-63.7	-65.2	56.1	0	0	112.9	V556 L557 L558 Q562 N563 L564	V556-Q560 HydrophobicContact CG1-CG 4.34Å; V556-Q560 VanDerWaalsContact O-CG 3.31Å; V556-Q560 WeakPolarHBondContact O-CG 3.48Å; V556-Q560 PolarHBondContact O-N 3.11Å; L557-Q560 PolarHBondContact O-N 3.33Å; L558-Q560 VanDerWaalsContact C-N 3.29Å; L558-Q560 PolarHBondContact O-N 2.9Å; Q560-Q562 VanDerWaalsContact C-N 3.31Å; Q560-Q562 PolarHBondContact O-N 2.8Å; Q560-N563 PolarHBondContact O-N 3.18Å; Q560-N563 PolarHBondContact OE1-ND2 3.28Å; Q560-N563 VanDerWaalsContact OE1-ND2 3.1Å; Q560-L564 WeakPolarHBondContact O-CB 3.37Å; Q560-L564 PolarHBondContact O-N 3.49Å
561	T	92.1	Very high	92.4	Very high	44 Å²	44	52.2 Å²	52.2	27%	0.27	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-41.9	171	-58.2	0	0	0	0	111.2	L488 L557 L558 L564 V565	L488-T561 HydrophobicContact CD1-CG2 4.16Å; L557-T561 PolarHBondContact O-N 3.47Å; L557-T561 PolarHBondContact O-OG1 2.87Å; L558-T561 PolarHBondContact O-N 2.75Å; T561-L564 PolarHBondContact O-N 2.91Å; T561-V565 WeakPolarHBondContact O-CG2 3.47Å; T561-V565 PolarHBondContact O-N 3.02Å; T561-V565 VanDerWaalsContact O-N 3.13Å
562	Q	91.6	Very high	92.5	Very high	5 Å²	5	54.3 Å²	54.3	2%	0.023	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-50.2	175.1	-78	178.1	-12.2	0	0	112.1	Y485 T489 L558 N559 Q560 L564 V565 I566	Y485-Q562 HydrophobicContact CD2-CB 4.3Å; Y485-Q562 HydrophobicContact CD2-CG 4.22Å; Y485-Q562 HydrophobicContact CE1-CG 4.44Å; Y485-Q562 HydrophobicContact CE2-CB 3.54Å; Y485-Q562 HydrophobicContact CE2-CG 3.5Å; Y485-Q562 VanDerWaalsContact CE2-CG 3.5Å; Y485-Q562 PolarHBondContact OH-NE2 3.43Å; Y485-Q562 PolarHBondContact OH-OE1 3.5Å; Y485-Q562 VanDerWaalsContact OH-OE1 3.14Å; T489-Q562 PolarHBondContact OG1-NE2 3.03Å; L558-Q562 HydrophobicContact CD1-CG 4.09Å; L558-Q562 HydrophobicContact CG-CG 4.49Å; L558-Q562 WeakPolarHBondContact O-CB 3.32Å; L558-Q562 VanDerWaalsContact O-CG 3.27Å; L558-Q562 WeakPolarHBondContact O-CG 3.36Å; L558-Q562 PolarHBondContact O-N 3.07Å; N559-Q562 WeakPolarHBondContact O-CB 3.31Å; N559-Q562 PolarHBondContact O-N 2.7Å; Q560-Q562 VanDerWaalsContact C-N 3.31Å; Q560-Q562 PolarHBondContact O-N 2.8Å; Q562-L564 VanDerWaalsContact C-N 3.28Å; Q562-L564 PolarHBondContact O-N 3.1Å; Q562-V565 PolarHBondContact O-N 3.02Å; Q562-I566 VanDerWaalsContact O-CD1 3.24Å; Q562-I566 WeakPolarHBondContact O-CD1 3.04Å; Q562-I566 VanDerWaalsContact O-CG1 3.29Å; Q562-I566 WeakPolarHBondContact O-CG1 3.37Å; Q562-I566 PolarHBondContact O-N 2.8Å; Q562-I566 VanDerWaalsContact O-N 3.08Å
563	N	91.8	Very high	92.5	Very high	74 Å²	74	51.3 Å²	51.3	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-56.8	-40.3	175.9	-74	-23.5	0	0	0	112.2	N559 Q560 I566 G567	N559-N563 WeakPolarHBondContact O-CB 3.43Å; N559-N563 PolarHBondContact O-N 3.18Å; N559-N563 PolarHBondContact O-ND2 2.92Å; Q560-N563 PolarHBondContact O-N 3.18Å; Q560-N563 PolarHBondContact OE1-ND2 3.28Å; Q560-N563 VanDerWaalsContact OE1-ND2 3.1Å; N563-I566 PolarHBondContact O-N 3.2Å; N563-G567 PolarHBondContact O-N 3.41Å
564	L	94.5	Very high	92.3	Very high	111 Å²	111	50.3 Å²	50.3	58%	0.581	29%	0.287	S	S	*	.	H	α-helix	trans	-63	-45.8	176.6	-178.5	64.1	0	0	0	112.1	Q560 T561 Q562 I566 G567 L568	Q560-L564 WeakPolarHBondContact O-CB 3.37Å; Q560-L564 PolarHBondContact O-N 3.49Å; T561-L564 PolarHBondContact O-N 2.91Å; Q562-L564 VanDerWaalsContact C-N 3.28Å; Q562-L564 PolarHBondContact O-N 3.1Å; L564-I566 PolarHBondContact O-N 3.2Å; L564-G567 PolarHBondContact O-N 2.96Å; L564-L568 HydrophobicContact CD1-CD1 4.3Å; L564-L568 HydrophobicContact CD1-CG 4.4Å; L564-L568 HydrophobicContact CG-CD1 4.18Å; L564-L568 VanDerWaalsContact O-CG 3.32Å; L564-L568 WeakPolarHBondContact O-CG 3.06Å; L564-L568 PolarHBondContact O-N 3.32Å
565	V	93.3	Very high	92.4	Very high	14 Å²	14	55.3 Å²	55.3	9%	0.085	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-44.6	177.9	172.5	0	0	0	0	111.3	L484 L488 T561 Q562 L568 G569	L484-V565 HydrophobicContact CB-CG1 4.49Å; L484-V565 HydrophobicContact CD2-CG1 4.21Å; L484-V565 HydrophobicContact CD2-CG2 4.29Å; L484-V565 HydrophobicContact CG-CG1 4.29Å; L484-V565 HydrophobicContact CG-CG2 4.36Å; L488-V565 HydrophobicContact CD1-CG2 3.69Å; T561-V565 WeakPolarHBondContact O-CG2 3.47Å; T561-V565 PolarHBondContact O-N 3.02Å; T561-V565 VanDerWaalsContact O-N 3.13Å; Q562-V565 PolarHBondContact O-N 3.02Å; V565-L568 PolarHBondContact O-N 3.14Å; V565-G569 PolarHBondContact O-N 3.39Å
566	I	90.6	Very high	92.5	Very high	19 Å²	19	54.4 Å²	54.4	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-43.3	178.2	-57.5	149.6	0	0	0	110.6	Y485 Q562 N563 L564 L568 G569 L570 Y602	Y485-I566 HydrophobicContact CD2-CD1 4.34Å; Y485-I566 HydrophobicContact CD2-CG1 4.09Å; Y485-I566 HydrophobicContact CE2-CD1 3.94Å; Y485-I566 HydrophobicContact CE2-CG1 4.2Å; Q562-I566 VanDerWaalsContact O-CD1 3.24Å; Q562-I566 WeakPolarHBondContact O-CD1 3.04Å; Q562-I566 VanDerWaalsContact O-CG1 3.29Å; Q562-I566 WeakPolarHBondContact O-CG1 3.37Å; Q562-I566 PolarHBondContact O-N 2.8Å; Q562-I566 VanDerWaalsContact O-N 3.08Å; N563-I566 PolarHBondContact O-N 3.2Å; L564-I566 PolarHBondContact O-N 3.2Å; I566-L568 VanDerWaalsContact C-N 3.32Å; I566-L568 PolarHBondContact O-N 3.27Å; I566-G569 PolarHBondContact O-N 2.8Å; I566-L570 VanDerWaalsContact O-CB 3.22Å; I566-L570 WeakPolarHBondContact O-CB 3.35Å; I566-L570 PolarHBondContact O-N 3.13Å; I566-Y602 HydrophobicContact CD1-CD1 3.78Å; I566-Y602 HydrophobicContact CD1-CD2 3.38Å; I566-Y602 HydrophobicContact CD1-CE1 3.58Å; I566-Y602 HydrophobicContact CD1-CE2 3.24Å; I566-Y602 HydrophobicContact CD1-CG 3.67Å; I566-Y602 HydrophobicContact CG1-CD2 3.97Å; I566-Y602 HydrophobicContact CG1-CE2 4.28Å; I566-Y602 HydrophobicContact CG1-CG 4.12Å
567	G	92.4	Very high	92.4	Very high	39 Å²	39	50.2 Å²	50.2	40%	0.402	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-43.4	177.4	0	0	0	0	0	112	N563 L564 L571	N563-G567 PolarHBondContact O-N 3.41Å; L564-G567 PolarHBondContact O-N 2.96Å; G567-L571 WeakPolarHBondContact O-CB 3.47Å; G567-L571 PolarHBondContact O-N 2.94Å
568	L	93.9	Very high	92.4	Very high	101 Å²	101	48 Å²	48	53%	0.529	28%	0.277	S	S	.	.	H	α-helix	trans	-67.6	-43.3	175.6	-69.5	172	0	0	0	112.6	L564 V565 I566 L571 A572	L564-L568 HydrophobicContact CD1-CD1 4.3Å; L564-L568 HydrophobicContact CD1-CG 4.4Å; L564-L568 HydrophobicContact CG-CD1 4.18Å; L564-L568 VanDerWaalsContact O-CG 3.32Å; L564-L568 WeakPolarHBondContact O-CG 3.06Å; L564-L568 PolarHBondContact O-N 3.32Å; V565-L568 PolarHBondContact O-N 3.14Å; I566-L568 VanDerWaalsContact C-N 3.32Å; I566-L568 PolarHBondContact O-N 3.27Å; L568-L571 PolarHBondContact O-N 3.31Å; L568-A572 WeakPolarHBondContact O-CB 3.01Å; L568-A572 PolarHBondContact O-N 3.48Å
569	G	91.9	Very high	92.6	Very high	10 Å²	10	53.6 Å²	53.6	10%	0.103	30%	0.299	C	S	.	.	H	α-helix	trans	-65	-43.1	177.2	0	0	0	0	0	112.8	V565 I566 G573	V565-G569 PolarHBondContact O-N 3.39Å; I566-G569 PolarHBondContact O-N 2.8Å; G569-G573 PolarHBondContact O-N 3.35Å
570	L	91.9	Very high	92.6	Very high	49 Å²	49	52.8 Å²	52.8	26%	0.257	29%	0.293	S	S	.	.	H	α-helix	trans	-64.8	-43.7	174.4	-176.9	64.1	0	0	0	110.8	I566 S574 F594 I598	I566-L570 VanDerWaalsContact O-CB 3.22Å; I566-L570 WeakPolarHBondContact O-CB 3.35Å; I566-L570 PolarHBondContact O-N 3.13Å; L570-S574 WeakPolarHBondContact O-CB 3.48Å; L570-S574 PolarHBondContact O-N 3.27Å; L570-S574 PolarHBondContact O-OG 3.11Å; L570-F594 HydrophobicContact CD1-CE1 4.37Å; L570-I598 HydrophobicContact CD1-CG2 4.45Å
571	L	93.6	Very high	92.5	Very high	98 Å²	98	49 Å²	49	51%	0.513	28%	0.277	S	S	.	.	H	α-helix	trans	-58.9	-53.1	175.9	176.5	64.8	0	0	0	111.4	G567 L568 G573 S574 L575	G567-L571 WeakPolarHBondContact O-CB 3.47Å; G567-L571 PolarHBondContact O-N 2.94Å; L568-L571 PolarHBondContact O-N 3.31Å; L571-G573 PolarHBondContact O-N 3.44Å; L571-S574 PolarHBondContact O-N 3.45Å; L571-L575 HydrophobicContact CD1-CD1 3.8Å; L571-L575 HydrophobicContact CD1-CG 4.11Å; L571-L575 HydrophobicContact CG-CD1 3.98Å; L571-L575 WeakPolarHBondContact O-CB 3.47Å; L571-L575 VanDerWaalsContact O-CG 3.29Å; L571-L575 WeakPolarHBondContact O-CG 3.31Å; L571-L575 PolarHBondContact O-N 3.02Å
572	A	93.4	Very high	92.5	Very high	46 Å²	46	51.1 Å²	51.1	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-61.1	-47.4	-177.8	0	0	0	0	0	112.2	L568 L576	L568-A572 WeakPolarHBondContact O-CB 3.01Å; L568-A572 PolarHBondContact O-N 3.48Å; A572-L576 WeakPolarHBondContact O-CB 3.07Å; A572-L576 PolarHBondContact O-N 2.92Å; A572-L576 VanDerWaalsContact O-N 3.07Å
573	G	91.8	Very high	92.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-70.9	-34.6	178.7	0	0	0	0	0	113.8	G569 L571 L576 C577 F594	G569-G573 PolarHBondContact O-N 3.35Å; L571-G573 PolarHBondContact O-N 3.44Å; G573-L576 PolarHBondContact O-N 3.15Å; G573-C577 VanDerWaalsContact O-CB 3.3Å; G573-C577 WeakPolarHBondContact O-CB 3.32Å; G573-C577 PolarHBondContact O-N 3.5Å; G573-F594 VanDerWaalsContact C-CE1 3.43Å
574	S	92	Very high	92.2	Very high	16 Å²	16	59.4 Å²	59.4	11%	0.112	33%	0.33	C	S	.	.	H	α-helix	trans	-70	-38.9	176.3	-58.9	0	0	0	0	111.7	L570 L571 C577 A578	L570-S574 WeakPolarHBondContact O-CB 3.48Å; L570-S574 PolarHBondContact O-N 3.27Å; L570-S574 PolarHBondContact O-OG 3.11Å; L571-S574 PolarHBondContact O-N 3.45Å; S574-C577 PolarHBondContact O-N 2.87Å; S574-A578 VanDerWaalsContact O-CB 3.23Å; S574-A578 WeakPolarHBondContact O-CB 3.23Å; S574-A578 PolarHBondContact O-N 3.34Å
575	L	94	Very high	91.9	Very high	111 Å²	111	60.4 Å²	60.4	58%	0.581	33%	0.33	S	S	*	.	H	α-helix	trans	-63.1	-45.5	172.8	-74.9	171	0	0	0	111.4	L571 C577 A578 Y579	L571-L575 HydrophobicContact CD1-CD1 3.8Å; L571-L575 HydrophobicContact CD1-CG 4.11Å; L571-L575 HydrophobicContact CG-CD1 3.98Å; L571-L575 WeakPolarHBondContact O-CB 3.47Å; L571-L575 VanDerWaalsContact O-CG 3.29Å; L571-L575 WeakPolarHBondContact O-CG 3.31Å; L571-L575 PolarHBondContact O-N 3.02Å; L575-C577 PolarHBondContact O-N 3.4Å; L575-A578 PolarHBondContact O-N 3.13Å; L575-Y579 WeakPolarHBondContact O-CB 3.4Å; L575-Y579 PolarHBondContact O-N 3.24Å
576	L	92.6	Very high	91.7	Very high	45 Å²	45	61.2 Å²	61.2	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-42.3	176.4	-173.2	64.6	0	0	0	111.7	W473 F474 I477 A572 G573 Y579 F580	W473-L576 HydrophobicContact CB-CD2 4.26Å; F474-L576 HydrophobicContact CD1-CD2 4.27Å; F474-L576 HydrophobicContact CD2-CD2 4.35Å; F474-L576 HydrophobicContact CE1-CB 4.23Å; F474-L576 HydrophobicContact CE1-CD2 3.99Å; F474-L576 HydrophobicContact CE1-CG 4.1Å; F474-L576 HydrophobicContact CE2-CD2 4.1Å; F474-L576 HydrophobicContact CE2-CG 4.28Å; F474-L576 HydrophobicContact CG-CD2 4.44Å; F474-L576 HydrophobicContact CZ-CB 4.3Å; F474-L576 HydrophobicContact CZ-CD2 3.91Å; F474-L576 HydrophobicContact CZ-CG 3.79Å; I477-L576 HydrophobicContact CD1-CD2 3.68Å; A572-L576 WeakPolarHBondContact O-CB 3.07Å; A572-L576 PolarHBondContact O-N 2.92Å; A572-L576 VanDerWaalsContact O-N 3.07Å; G573-L576 PolarHBondContact O-N 3.15Å; L576-Y579 PolarHBondContact O-N 3.01Å; L576-F580 HydrophobicContact CD1-CD2 4.08Å; L576-F580 HydrophobicContact CD1-CE2 3.62Å; L576-F580 HydrophobicContact CD2-CE2 4.36Å; L576-F580 HydrophobicContact CG-CD2 3.98Å; L576-F580 HydrophobicContact CG-CE2 3.8Å; L576-F580 VanDerWaalsContact O-CD2 3.24Å; L576-F580 WeakPolarHBondContact O-CD2 3.42Å; L576-F580 PolarHBondContact O-N 2.98Å; L576-F580 VanDerWaalsContact O-N 3.09Å
577	C	91.6	Very high	91.8	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-66	-43	176.4	-164.2	0	0	0	0	111.9	F474 G573 S574 L575 Y579 F580 V581 Y591	F474-C577 HydrophobicContact CE1-CB 3.98Å; F474-C577 HydrophobicContact CZ-CB 4.19Å; G573-C577 VanDerWaalsContact O-CB 3.3Å; G573-C577 WeakPolarHBondContact O-CB 3.32Å; G573-C577 PolarHBondContact O-N 3.5Å; S574-C577 PolarHBondContact O-N 2.87Å; L575-C577 PolarHBondContact O-N 3.4Å; C577-Y579 VanDerWaalsContact C-N 3.32Å; C577-Y579 PolarHBondContact O-N 3.01Å; C577-F580 PolarHBondContact O-N 3.48Å; C577-V581 VanDerWaalsContact O-CG2 3.3Å; C577-V581 WeakPolarHBondContact O-CG2 3.48Å; C577-V581 PolarHBondContact O-N 3.1Å; C577-Y591 HydrophobicContact CB-CD2 4.15Å; C577-Y591 VanDerWaalsContact SG-CA 3.56Å
578	A	92.3	Very high	91.7	Very high	45 Å²	45	65.6 Å²	65.6	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-39.1	176.9	0	0	0	0	0	111.9	S574 L575 V581 S582 Y591	S574-A578 VanDerWaalsContact O-CB 3.23Å; S574-A578 WeakPolarHBondContact O-CB 3.23Å; S574-A578 PolarHBondContact O-N 3.34Å; L575-A578 PolarHBondContact O-N 3.13Å; A578-V581 PolarHBondContact O-N 3.5Å; A578-S582 WeakPolarHBondContact O-CB 3.46Å; A578-S582 PolarHBondContact O-N 2.89Å; A578-Y591 HydrophobicContact CB-CE2 4.5Å
579	Y	93.4	Very high	91.5	Very high	128 Å²	128	60.8 Å²	60.8	50%	0.502	32%	0.323	S	S	.	.	H	α-helix	trans	-59.1	-52.5	172.1	178.7	-98.6	0	0	0	111.4	L575 L576 C577 V581 S582 E583	L575-Y579 WeakPolarHBondContact O-CB 3.4Å; L575-Y579 PolarHBondContact O-N 3.24Å; L576-Y579 PolarHBondContact O-N 3.01Å; C577-Y579 VanDerWaalsContact C-N 3.32Å; C577-Y579 PolarHBondContact O-N 3.01Å; Y579-V581 VanDerWaalsContact C-N 3.31Å; Y579-V581 PolarHBondContact O-N 2.83Å; Y579-S582 WeakPolarHBondContact O-CA 3.3Å; Y579-S582 WeakPolarHBondContact O-CB 3.37Å; Y579-S582 PolarHBondContact O-N 3.3Å; Y579-S582 PolarHBondContact O-OG 3.3Å; Y579-E583 HydrophobicContact CD1-CG 4.46Å; Y579-E583 VanDerWaalsContact CE1-CD 3.41Å; Y579-E583 HydrophobicContact CE1-CG 4.03Å; Y579-E583 VanDerWaalsContact CE1-OE2 3.26Å; Y579-E583 WeakPolarHBondContact CE1-OE2 3.33Å; Y579-E583 HydrophobicContact CE2-CG 4.44Å; Y579-E583 PolarHBondContact O-N 3.42Å; Y579-E583 PolarHBondContact OH-OE1 3.26Å
580	F	92.1	Very high	91.5	Very high	37 Å²	37	60.4 Å²	60.4	16%	0.162	32%	0.319	C	S	.	.	H	α-helix	trans	-65.1	-29.5	179	-79.9	-60	0	0	0	114.1	F474 L576 C577 Q584 K585 L586	F474-F580 AromaticContact CE2-CD2 3.73Å; F474-F580 HydrophobicContact CE2-CD2 3.73Å; F474-F580 AromaticContact CE2-CE2 3.89Å; F474-F580 HydrophobicContact CE2-CE2 3.89Å; F474-F580 AromaticContact CZ-CD2 3.81Å; F474-F580 HydrophobicContact CZ-CD2 3.81Å; F474-F580 HydrophobicContact CZ-CE2 4.29Å; L576-F580 HydrophobicContact CD1-CD2 4.08Å; L576-F580 HydrophobicContact CD1-CE2 3.62Å; L576-F580 HydrophobicContact CD2-CE2 4.36Å; L576-F580 HydrophobicContact CG-CD2 3.98Å; L576-F580 HydrophobicContact CG-CE2 3.8Å; L576-F580 VanDerWaalsContact O-CD2 3.24Å; L576-F580 WeakPolarHBondContact O-CD2 3.42Å; L576-F580 PolarHBondContact O-N 2.98Å; L576-F580 VanDerWaalsContact O-N 3.09Å; C577-F580 PolarHBondContact O-N 3.48Å; F580-Q584 PolarHBondContact O-N 3.24Å; F580-K585 HydrophobicContact CD1-CB 4.09Å; F580-K585 HydrophobicContact CD1-CD 3.74Å; F580-K585 HydrophobicContact CE1-CD 4.03Å; F580-K585 PolarHBondContact O-N 2.94Å; F580-L586 HydrophobicContact CB-CB 4.42Å; F580-L586 HydrophobicContact CB-CD1 3.66Å; F580-L586 HydrophobicContact CB-CG 3.97Å; F580-L586 HydrophobicContact CG-CD1 4.42Å; F580-L586 PolarHBondContact O-N 2.72Å
581	V	92.1	Very high	91.5	Very high	37 Å²	37	63.3 Å²	63.3	22%	0.224	33%	0.327	C	S	.	.	H	α-helix	trans	-69.5	-39.7	170.1	172.3	0	0	0	0	110.9	C577 A578 Y579 E583 Q584 L586 V588	C577-V581 VanDerWaalsContact O-CG2 3.3Å; C577-V581 WeakPolarHBondContact O-CG2 3.48Å; C577-V581 PolarHBondContact O-N 3.1Å; A578-V581 PolarHBondContact O-N 3.5Å; Y579-V581 VanDerWaalsContact C-N 3.31Å; Y579-V581 PolarHBondContact O-N 2.83Å; V581-E583 VanDerWaalsContact C-N 3.33Å; V581-E583 PolarHBondContact O-N 2.96Å; V581-Q584 PolarHBondContact O-N 3.32Å; V581-L586 HydrophobicContact CG2-CB 3.86Å; V581-V588 HydrophobicContact CG1-CG2 4.44Å
582	S	91.4	Very high	91.4	Very high	89 Å²	89	60.3 Å²	60.3	62%	0.622	31%	0.312	S	S	*	.	H	α-helix	trans	-66.6	-32.2	175.6	76.7	0	0	0	0	113.2	A578 Y579 Q584	A578-S582 WeakPolarHBondContact O-CB 3.46Å; A578-S582 PolarHBondContact O-N 2.89Å; Y579-S582 WeakPolarHBondContact O-CA 3.3Å; Y579-S582 WeakPolarHBondContact O-CB 3.37Å; Y579-S582 PolarHBondContact O-N 3.3Å; Y579-S582 PolarHBondContact O-OG 3.3Å; S582-Q584 PolarHBondContact O-N 3.38Å
583	E	91.9	Very high	91.4	Very high	72 Å²	72	58.1 Å²	58.1	34%	0.336	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	3.8	170.7	-69	-163.8	117.9	0	0	113.7	Y579 V581 K585	Y579-E583 HydrophobicContact CD1-CG 4.46Å; Y579-E583 VanDerWaalsContact CE1-CD 3.41Å; Y579-E583 HydrophobicContact CE1-CG 4.03Å; Y579-E583 VanDerWaalsContact CE1-OE2 3.26Å; Y579-E583 WeakPolarHBondContact CE1-OE2 3.33Å; Y579-E583 HydrophobicContact CE2-CG 4.44Å; Y579-E583 PolarHBondContact O-N 3.42Å; Y579-E583 PolarHBondContact OH-OE1 3.26Å; V581-E583 VanDerWaalsContact C-N 3.33Å; V581-E583 PolarHBondContact O-N 2.96Å; E583-K585 HydrophobicContact CB-CD 4.12Å; E583-K585 HydrophobicContact CB-CG 4.33Å; E583-K585 PolarHBondContact O-N 3.22Å; E583-K585 VanDerWaalsContact O-N 3.15Å; E583-K585 IonicContact OE1-NZ 3.86Å; E583-K585 PolarHBondContact OE1-NZ 3.44Å; E583-K585 VanDerWaalsContact OE1-NZ 3.17Å; E583-K585 WeakPolarHBondContact OE2-CD 3.4Å; E583-K585 WeakPolarHBondContact OE2-CE 3.45Å; E583-K585 IonicContact OE2-NZ 2.93Å; E583-K585 PolarHBondContact OE2-NZ 2.98Å
584	Q	86.2	Confident	91.4	Very high	180 Å²	180	58.1 Å²	58.1	84%	0.841	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	21	-176.4	-55	-171.1	-4.7	0	0	115.4	F580 V581 S582	F580-Q584 PolarHBondContact O-N 3.24Å; V581-Q584 PolarHBondContact O-N 3.32Å; S582-Q584 PolarHBondContact O-N 3.38Å
585	K	87.7	Confident	91.3	Very high	132 Å²	132	58.1 Å²	58.1	57%	0.574	30%	0.297	S	S	*	.	S	Bend	trans	-84	-17.8	174.9	-70.3	166.4	-175.8	162.7	0	112.8	F580 E583	F580-K585 HydrophobicContact CD1-CB 4.09Å; F580-K585 HydrophobicContact CD1-CD 3.74Å; F580-K585 HydrophobicContact CE1-CD 4.03Å; F580-K585 PolarHBondContact O-N 2.94Å; E583-K585 HydrophobicContact CB-CD 4.12Å; E583-K585 HydrophobicContact CB-CG 4.33Å; E583-K585 PolarHBondContact O-N 3.22Å; E583-K585 VanDerWaalsContact O-N 3.15Å; E583-K585 IonicContact OE1-NZ 3.86Å; E583-K585 PolarHBondContact OE1-NZ 3.44Å; E583-K585 VanDerWaalsContact OE1-NZ 3.17Å; E583-K585 WeakPolarHBondContact OE2-CD 3.4Å; E583-K585 WeakPolarHBondContact OE2-CE 3.45Å; E583-K585 IonicContact OE2-NZ 2.93Å; E583-K585 PolarHBondContact OE2-NZ 2.98Å
586	L	89.8	Confident	91.1	Very high	31 Å²	31	55.1 Å²	55.1	16%	0.162	28%	0.283	C	S	.	.	S	Bend	trans	-133.8	156.5	175.6	-67.7	177.3	0	0	0	110.5	F470 F474 F580 V581 D590	F470-L586 HydrophobicContact CD1-CD1 3.73Å; F470-L586 HydrophobicContact CD1-CD2 4.06Å; F470-L586 HydrophobicContact CE1-CD1 3.99Å; F470-L586 HydrophobicContact CE1-CD2 4.33Å; F474-L586 HydrophobicContact CE2-CD1 4.43Å; F474-L586 HydrophobicContact CZ-CD1 4.29Å; F580-L586 HydrophobicContact CB-CB 4.42Å; F580-L586 HydrophobicContact CB-CD1 3.66Å; F580-L586 HydrophobicContact CB-CG 3.97Å; F580-L586 HydrophobicContact CG-CD1 4.42Å; F580-L586 PolarHBondContact O-N 2.72Å; V581-L586 HydrophobicContact CG2-CB 3.86Å; L586-D590 HydrophobicContact CB-CB 4.12Å; L586-D590 HydrophobicContact CD2-CB 4.44Å
587	Q	91.1	Very high	91	Very high	77 Å²	77	53 Å²	53	36%	0.36	27%	0.272	S	S	.	.			trans	-92	164.4	178.4	-59.8	-173	-64.4	0	0	111.7	N352 E356 G589 D590	N352-Q587 PolarHBondContact ND2-OE1 3.22Å; N352-Q587 WeakPolarHBondContact OD1-CB 3.31Å; E356-Q587 PolarHBondContact OE1-NE2 3Å; Q587-G589 PolarHBondContact O-N 3.31Å; Q587-D590 PolarHBondContact N-OD2 3.2Å; Q587-D590 VanDerWaalsContact O-CB 3.3Å; Q587-D590 WeakPolarHBondContact O-CB 3.49Å; Q587-D590 PolarHBondContact O-N 3.26Å
588	V	90.6	Very high	90.9	Very high	73 Å²	73	53.5 Å²	53.5	44%	0.442	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-33.4	-179	-176.7	0	0	0	0	112.3	V351 T355 V581 D590 Y591	V351-V588 HydrophobicContact CG1-CB 4.43Å; V351-V588 HydrophobicContact CG1-CG1 4.16Å; T355-V588 HydrophobicContact CG2-CG2 4.41Å; V581-V588 HydrophobicContact CG1-CG2 4.44Å; V588-D590 VanDerWaalsContact C-N 3.29Å; V588-D590 PolarHBondContact O-N 2.99Å; V588-Y591 PolarHBondContact O-N 3.46Å
589	G	89.9	Confident	90.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69	-20.8	175	0	0	0	0	0	114.7	R348 N352 Q587 V592 L593	R348-G589 WeakPolarHBondContact CB-O 3.45Å; N352-G589 WeakPolarHBondContact OD1-CA 3.2Å; N352-G589 PolarHBondContact OD1-N 2.9Å; Q587-G589 PolarHBondContact O-N 3.31Å; G589-V592 PolarHBondContact O-N 2.84Å; G589-L593 PolarHBondContact O-N 2.93Å
590	D	91.6	Very high	90.5	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-68.6	-35.9	175.8	-73.5	-60.5	0	0	0	112.1	R348 F470 L586 Q587 V588 V592 L593 F594	R348-D590 VanDerWaalsContact CD-OD1 3.25Å; R348-D590 WeakPolarHBondContact CD-OD1 3.48Å; R348-D590 IonicContact CZ-OD1 3.06Å; R348-D590 IonicContact CZ-OD2 3.43Å; R348-D590 IonicContact NE-OD1 3.17Å; R348-D590 PolarHBondContact NE-OD1 3.48Å; R348-D590 VanDerWaalsContact NE-OD1 3.12Å; R348-D590 IonicContact NE-OD2 3.42Å; R348-D590 IonicContact NH1-OD1 2.72Å; R348-D590 PolarHBondContact NH1-OD1 3.4Å; R348-D590 IonicContact NH1-OD2 2.62Å; R348-D590 IonicContact NH2-OD1 2.66Å; R348-D590 IonicContact NH2-OD2 3.64Å; F470-D590 HydrophobicContact CE1-CB 3.84Å; F470-D590 HydrophobicContact CZ-CB 3.97Å; L586-D590 HydrophobicContact CB-CB 4.12Å; L586-D590 HydrophobicContact CD2-CB 4.44Å; Q587-D590 PolarHBondContact N-OD2 3.2Å; Q587-D590 VanDerWaalsContact O-CB 3.3Å; Q587-D590 WeakPolarHBondContact O-CB 3.49Å; Q587-D590 PolarHBondContact O-N 3.26Å; V588-D590 VanDerWaalsContact C-N 3.29Å; V588-D590 PolarHBondContact O-N 2.99Å; D590-V592 VanDerWaalsContact C-N 3.32Å; D590-V592 PolarHBondContact O-N 3.09Å; D590-L593 WeakPolarHBondContact O-CB 3.25Å; D590-L593 PolarHBondContact O-N 3.43Å; D590-F594 PolarHBondContact O-N 2.94Å
591	Y	92.1	Very high	90.3	Very high	110 Å²	110	49.3 Å²	49.3	43%	0.431	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-42.8	171.7	179.3	-92	0	0	0	111.6	C577 A578 V588 F594 G595	C577-Y591 HydrophobicContact CB-CD2 4.15Å; C577-Y591 VanDerWaalsContact SG-CA 3.56Å; A578-Y591 HydrophobicContact CB-CE2 4.5Å; V588-Y591 PolarHBondContact O-N 3.46Å; Y591-F594 PolarHBondContact O-N 3.1Å; Y591-G595 PolarHBondContact O-N 3.37Å
592	V	92.2	Very high	90	Very high	34 Å²	34	49.2 Å²	49.2	21%	0.206	25%	0.25	C	S	.	.	H	α-helix	trans	-68.4	-37.9	178.4	-178.6	0	0	0	0	111.4	Y347 V351 G589 D590 T596	Y347-V592 HydrophobicContact CD1-CG1 3.47Å; Y347-V592 VanDerWaalsContact CD1-CG1 3.47Å; Y347-V592 HydrophobicContact CE1-CG1 3.17Å; Y347-V592 HydrophobicContact CG-CG1 4.3Å; V351-V592 HydrophobicContact CG1-CG2 4.35Å; V351-V592 HydrophobicContact CG2-CB 4.41Å; V351-V592 HydrophobicContact CG2-CG1 4.33Å; V351-V592 HydrophobicContact CG2-CG2 4.22Å; G589-V592 PolarHBondContact O-N 2.84Å; D590-V592 VanDerWaalsContact C-N 3.32Å; D590-V592 PolarHBondContact O-N 3.09Å; V592-T596 HydrophobicContact CG1-CG2 4.46Å; V592-T596 WeakPolarHBondContact O-CB 3.43Å; V592-T596 WeakPolarHBondContact O-CG2 3.43Å; V592-T596 PolarHBondContact O-N 2.92Å; V592-T596 PolarHBondContact O-OG1 2.94Å
593	L	92.4	Very high	89.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-50.9	171.9	-169.3	155	0	0	0	111	P344 I345 R348 Y465 F466 F470 G589 D590 G595 T596 Y597	P344-L593 HydrophobicContact CB-CG 4.07Å; I345-L593 HydrophobicContact CG1-CD1 4.05Å; R348-L593 HydrophobicContact CB-CB 4.15Å; R348-L593 HydrophobicContact CB-CD1 3.99Å; Y465-L593 HydrophobicContact CE1-CD2 3.93Å; F466-L593 HydrophobicContact CE1-CD2 3.87Å; F466-L593 HydrophobicContact CZ-CD2 4.04Å; F470-L593 HydrophobicContact CE2-CD2 4.14Å; F470-L593 HydrophobicContact CZ-CD2 4.13Å; G589-L593 PolarHBondContact O-N 2.93Å; D590-L593 WeakPolarHBondContact O-CB 3.25Å; D590-L593 PolarHBondContact O-N 3.43Å; L593-G595 PolarHBondContact O-N 3.19Å; L593-T596 PolarHBondContact O-N 3.38Å; L593-T596 PolarHBondContact O-OG1 3.07Å; L593-Y597 HydrophobicContact CD2-CD1 4.2Å; L593-Y597 WeakPolarHBondContact O-CB 3.35Å; L593-Y597 PolarHBondContact O-N 3.01Å
594	F	92.1	Very high	89.3	Confident	1 Å²	1	48.9 Å²	48.9	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-56.5	-54.8	179.8	-178.5	-95.6	0	0	0	110.8	F466 F474 V478 L570 G573 D590 Y591 T596 Y597 I598	F466-F594 HydrophobicContact CD1-CD2 4.34Å; F466-F594 AromaticContact CE1-CD2 3.72Å; F466-F594 HydrophobicContact CE1-CD2 3.72Å; F466-F594 HydrophobicContact CE1-CE2 4.49Å; F466-F594 AromaticContact CZ-CD2 3.96Å; F466-F594 HydrophobicContact CZ-CD2 3.96Å; F474-F594 HydrophobicContact CD1-CD2 4.11Å; F474-F594 HydrophobicContact CD1-CE2 4.02Å; V478-F594 HydrophobicContact CG2-CE2 4.43Å; L570-F594 HydrophobicContact CD1-CE1 4.37Å; G573-F594 VanDerWaalsContact C-CE1 3.43Å; D590-F594 PolarHBondContact O-N 2.94Å; Y591-F594 PolarHBondContact O-N 3.1Å; F594-T596 PolarHBondContact O-N 3.28Å; F594-Y597 PolarHBondContact O-N 3.39Å; F594-I598 HydrophobicContact CD1-CG1 4.28Å; F594-I598 HydrophobicContact CD2-CG1 4.2Å; F594-I598 HydrophobicContact CE1-CG1 3.87Å; F594-I598 HydrophobicContact CE2-CD1 3.83Å; F594-I598 HydrophobicContact CE2-CG1 3.79Å; F594-I598 HydrophobicContact CG-CG1 4.41Å; F594-I598 HydrophobicContact CZ-CD1 3.82Å; F594-I598 HydrophobicContact CZ-CG1 3.59Å; F594-I598 WeakPolarHBondContact O-CB 3.34Å; F594-I598 WeakPolarHBondContact O-CG1 3.41Å; F594-I598 PolarHBondContact O-N 3.04Å
595	G	90.1	Very high	89.3	Confident	16 Å²	16	40.5 Å²	40.5	17%	0.165	21%	0.205	C	C	.	.	H	α-helix	trans	-58.6	-46.1	-179.3	0	0	0	0	0	113.5	Y591 L593 I599	Y591-G595 PolarHBondContact O-N 3.37Å; L593-G595 PolarHBondContact O-N 3.19Å; G595-I599 WeakPolarHBondContact O-CD1 3.44Å; G595-I599 WeakPolarHBondContact O-CG1 3.27Å; G595-I599 PolarHBondContact O-N 2.95Å
596	T	90.1	Very high	89.2	Confident	47 Å²	47	37 Å²	37	29%	0.288	19%	0.193	S	C	.	.	H	α-helix	trans	-70.7	-40.2	-178.9	52.1	0	0	0	0	113.3	Y347 V592 L593 F594 I599 Q600	Y347-T596 HydrophobicContact CD1-CG2 3.82Å; Y347-T596 HydrophobicContact CE1-CG2 3.72Å; V592-T596 HydrophobicContact CG1-CG2 4.46Å; V592-T596 WeakPolarHBondContact O-CB 3.43Å; V592-T596 WeakPolarHBondContact O-CG2 3.43Å; V592-T596 PolarHBondContact O-N 2.92Å; V592-T596 PolarHBondContact O-OG1 2.94Å; L593-T596 PolarHBondContact O-N 3.38Å; L593-T596 PolarHBondContact O-OG1 3.07Å; F594-T596 PolarHBondContact O-N 3.28Å; T596-I599 PolarHBondContact O-N 3.34Å; T596-Q600 WeakPolarHBondContact O-CB 3.46Å; T596-Q600 PolarHBondContact O-N 3.42Å
597	Y	91.1	Very high	88.9	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-71.9	-35.6	-178.4	-164.8	-172.7	0	0	0	111.6	P344 G462 Y465 F466 L593 F594 Q600 L601	P344-Y597 HydrophobicContact CG-CD2 4.38Å; P344-Y597 HydrophobicContact CG-CG 4.22Å; G462-Y597 WeakPolarHBondContact CA-OH 3.42Å; Y465-Y597 HydrophobicContact CD1-CD1 4.3Å; Y465-Y597 AromaticContact CD1-CE1 3.83Å; Y465-Y597 HydrophobicContact CD1-CE1 3.83Å; Y465-Y597 HydrophobicContact CE1-CE1 4.4Å; Y465-Y597 HydrophobicContact CG-CE1 4.29Å; F466-Y597 AromaticContact CE2-CD1 3.57Å; F466-Y597 HydrophobicContact CE2-CD1 3.57Å; F466-Y597 HydrophobicContact CE2-CE1 4.04Å; F466-Y597 HydrophobicContact CE2-CG 4.16Å; F466-Y597 AromaticContact CZ-CD1 3.6Å; F466-Y597 HydrophobicContact CZ-CD1 3.6Å; F466-Y597 HydrophobicContact CZ-CE1 4.43Å; F466-Y597 HydrophobicContact CZ-CG 4.17Å; L593-Y597 HydrophobicContact CD2-CD1 4.2Å; L593-Y597 WeakPolarHBondContact O-CB 3.35Å; L593-Y597 PolarHBondContact O-N 3.01Å; F594-Y597 PolarHBondContact O-N 3.39Å; Y597-Q600 PolarHBondContact O-N 3.06Å; Y597-L601 HydrophobicContact CD2-CD1 4.35Å; Y597-L601 HydrophobicContact CD2-CD2 4.44Å; Y597-L601 HydrophobicContact CD2-CG 3.95Å; Y597-L601 HydrophobicContact CE2-CD1 4.29Å; Y597-L601 HydrophobicContact CE2-CD2 3.88Å; Y597-L601 HydrophobicContact CE2-CG 3.88Å; Y597-L601 WeakPolarHBondContact O-CG 3.44Å; Y597-L601 PolarHBondContact O-N 3.25Å
598	I	89.6	Confident	88.6	Confident	10 Å²	10	40.3 Å²	40.3	5%	0.051	20%	0.2	C	C	.	.	H	α-helix	trans	-61.2	-45.7	172.9	-66.6	-68.6	0	0	0	111.7	V478 L570 F594 Q600 L601 Y602	V478-I598 HydrophobicContact CG2-CD1 3.55Å; L570-I598 HydrophobicContact CD1-CG2 4.45Å; F594-I598 HydrophobicContact CD1-CG1 4.28Å; F594-I598 HydrophobicContact CD2-CG1 4.2Å; F594-I598 HydrophobicContact CE1-CG1 3.87Å; F594-I598 HydrophobicContact CE2-CD1 3.83Å; F594-I598 HydrophobicContact CE2-CG1 3.79Å; F594-I598 HydrophobicContact CG-CG1 4.41Å; F594-I598 HydrophobicContact CZ-CD1 3.82Å; F594-I598 HydrophobicContact CZ-CG1 3.59Å; F594-I598 WeakPolarHBondContact O-CB 3.34Å; F594-I598 WeakPolarHBondContact O-CG1 3.41Å; F594-I598 PolarHBondContact O-N 3.04Å; I598-Q600 VanDerWaalsContact C-N 3.31Å; I598-Q600 PolarHBondContact O-N 3.2Å; I598-L601 PolarHBondContact O-N 3.26Å; I598-Y602 PolarHBondContact O-N 2.94Å
599	I	87.9	Confident	88.2	Confident	86 Å²	86	37.1 Å²	37.1	44%	0.441	18%	0.182	S	C	.	.	H	α-helix	trans	-62.5	-40.6	176.8	-67.4	167.8	0	0	0	110.7	G595 T596 Y602 M603	G595-I599 WeakPolarHBondContact O-CD1 3.44Å; G595-I599 WeakPolarHBondContact O-CG1 3.27Å; G595-I599 PolarHBondContact O-N 2.95Å; T596-I599 PolarHBondContact O-N 3.34Å; I599-Y602 PolarHBondContact O-N 3.29Å; I599-M603 PolarHBondContact O-N 2.98Å
600	Q	87.9	Confident	87.8	Confident	29 Å²	29	39 Å²	39	14%	0.136	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-42.3	177.7	-170.7	-171.6	-69.8	0	0	112.5	N340 T596 Y597 I598 Y602 P604	N340-Q600 PolarHBondContact O-NE2 3.26Å; T596-Q600 WeakPolarHBondContact O-CB 3.46Å; T596-Q600 PolarHBondContact O-N 3.42Å; Y597-Q600 PolarHBondContact O-N 3.06Å; I598-Q600 VanDerWaalsContact C-N 3.31Å; I598-Q600 PolarHBondContact O-N 3.2Å; Q600-Y602 VanDerWaalsContact C-N 3.3Å; Q600-Y602 PolarHBondContact O-N 2.89Å; Q600-P604 VanDerWaalsContact O-CD 3.27Å; Q600-P604 WeakPolarHBondContact O-CD 3.2Å
601	L	88.4	Confident	87.5	Confident	7 Å²	7	40.9 Å²	40.9	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-40.3	173.5	-72.4	175	0	0	0	110.9	D458 V478 M482 Y597 I598 L605	D458-L601 HydrophobicContact CB-CD2 3.96Å; D458-L601 WeakPolarHBondContact O-CD2 3.34Å; V478-L601 HydrophobicContact CG1-CD1 4.2Å; M482-L601 HydrophobicContact CE-CB 3.65Å; M482-L601 HydrophobicContact CE-CD1 4.34Å; Y597-L601 HydrophobicContact CD2-CD1 4.35Å; Y597-L601 HydrophobicContact CD2-CD2 4.44Å; Y597-L601 HydrophobicContact CD2-CG 3.95Å; Y597-L601 HydrophobicContact CE2-CD1 4.29Å; Y597-L601 HydrophobicContact CE2-CD2 3.88Å; Y597-L601 HydrophobicContact CE2-CG 3.88Å; Y597-L601 WeakPolarHBondContact O-CG 3.44Å; Y597-L601 PolarHBondContact O-N 3.25Å; I598-L601 PolarHBondContact O-N 3.26Å; L601-L605 WeakPolarHBondContact O-CD1 3.46Å
602	Y	85.9	Confident	87.1	Confident	34 Å²	34	36.5 Å²	36.5	13%	0.133	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-43.7	179.2	160.5	-122.2	0	0	0	114.1	Y485 I566 I598 I599 Q600 P604 L605 N606	Y485-Y602 AromaticContact CE2-CD2 3.9Å; Y485-Y602 HydrophobicContact CE2-CD2 3.9Å; Y485-Y602 AromaticContact CE2-CE2 3.7Å; Y485-Y602 HydrophobicContact CE2-CE2 3.7Å; Y485-Y602 AromaticContact CZ-CE2 3.87Å; I566-Y602 HydrophobicContact CD1-CD1 3.78Å; I566-Y602 HydrophobicContact CD1-CD2 3.38Å; I566-Y602 HydrophobicContact CD1-CE1 3.58Å; I566-Y602 HydrophobicContact CD1-CE2 3.24Å; I566-Y602 HydrophobicContact CD1-CG 3.67Å; I566-Y602 HydrophobicContact CG1-CD2 3.97Å; I566-Y602 HydrophobicContact CG1-CE2 4.28Å; I566-Y602 HydrophobicContact CG1-CG 4.12Å; I598-Y602 PolarHBondContact O-N 2.94Å; I599-Y602 PolarHBondContact O-N 3.29Å; Q600-Y602 VanDerWaalsContact C-N 3.3Å; Q600-Y602 PolarHBondContact O-N 2.89Å; Y602-P604 VanDerWaalsContact O-N 3.11Å; Y602-L605 WeakPolarHBondContact O-CA 3.12Å; Y602-L605 WeakPolarHBondContact O-CB 3.43Å; Y602-L605 PolarHBondContact O-N 2.9Å; Y602-N606 HydrophobicContact CE2-CB 3.94Å; Y602-N606 PolarHBondContact O-N 3.03Å; Y602-N606 PolarHBondContact OH-ND2 3.4Å
603	M	85.6	Confident	86.4	Confident	113 Å²	113	36.7 Å²	36.7	56%	0.557	18%	0.181	S	C	*	.	H	α-helix	trans	-47.9	-45.9	-168.9	-88.7	-165.6	-68.4	0	0	115.2	I599 L605	I599-M603 PolarHBondContact O-N 2.98Å; M603-L605 PolarHBondContact O-N 2.86Å
604	P	84.3	Confident	85.9	Confident	41 Å²	41	39.9 Å²	39.9	27%	0.266	20%	0.196	S	C	.	.	H	α-helix	trans	-67.4	-29.7	175.8	-22.8	35.3	0	0	0	114.7	T455 Q600 Y602 N606 W607	T455-P604 HydrophobicContact CG2-CB 3.26Å; T455-P604 HydrophobicContact CG2-CG 4.05Å; Q600-P604 VanDerWaalsContact O-CD 3.27Å; Q600-P604 WeakPolarHBondContact O-CD 3.2Å; Y602-P604 VanDerWaalsContact O-N 3.11Å; P604-N606 VanDerWaalsContact C-N 3.31Å; P604-N606 PolarHBondContact O-N 2.86Å; P604-W607 PolarHBondContact O-N 2.97Å
605	L	85.6	Confident	85.6	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-26.4	-178.4	-79.7	92.1	0	0	0	113.1	I459 M482 Y485 L601 Y602 M603 W607 F608	I459-L605 HydrophobicContact CD1-CD1 4.14Å; I459-L605 HydrophobicContact CD1-CD2 4.23Å; I459-L605 HydrophobicContact CG1-CD1 4.43Å; M482-L605 HydrophobicContact SD-CD1 4.38Å; M482-L605 HydrophobicContact SD-CD2 4.29Å; Y485-L605 HydrophobicContact CD1-CB 4.01Å; Y485-L605 HydrophobicContact CD1-CD2 3.57Å; Y485-L605 HydrophobicContact CD1-CG 4.43Å; Y485-L605 HydrophobicContact CE1-CB 3.52Å; Y485-L605 HydrophobicContact CE1-CD2 3.98Å; Y485-L605 HydrophobicContact CE1-CG 4.37Å; Y485-L605 HydrophobicContact CG-CD2 4.39Å; Y485-L605 PolarHBondContact OH-O 2.66Å; L601-L605 WeakPolarHBondContact O-CD1 3.46Å; Y602-L605 WeakPolarHBondContact O-CA 3.12Å; Y602-L605 WeakPolarHBondContact O-CB 3.43Å; Y602-L605 PolarHBondContact O-N 2.9Å; M603-L605 PolarHBondContact O-N 2.86Å; L605-W607 PolarHBondContact O-N 3.15Å; L605-F608 WeakPolarHBondContact O-CB 3.35Å; L605-F608 PolarHBondContact O-N 2.89Å
606	N	84.9	Confident	85	Confident	60 Å²	60	40.7 Å²	40.7	32%	0.321	20%	0.196	S	C	.	.	H	α-helix	trans	-54.6	-42.3	172.5	-170.8	-41.6	0	0	0	111.3	Y485 Y602 P604 F608	Y485-N606 WeakPolarHBondContact OH-CA 3.44Å; Y485-N606 PolarHBondContact OH-N 3.04Å; Y602-N606 HydrophobicContact CE2-CB 3.94Å; Y602-N606 PolarHBondContact O-N 3.03Å; Y602-N606 PolarHBondContact OH-ND2 3.4Å; P604-N606 VanDerWaalsContact C-N 3.31Å; P604-N606 PolarHBondContact O-N 2.86Å; N606-F608 VanDerWaalsContact C-N 3.31Å; N606-F608 PolarHBondContact O-N 3.43Å
607	W	84.4	Confident	84.4	Confident	153 Å²	153	42 Å²	42	58%	0.58	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-11.4	177.6	-62.7	92.9	0	0	0	113.8	P604 L605 G609 T610 Y611	P604-W607 PolarHBondContact O-N 2.97Å; L605-W607 PolarHBondContact O-N 3.15Å; W607-G609 PolarHBondContact O-N 2.8Å; W607-T610 WeakPolarHBondContact O-CA 3.17Å; W607-T610 WeakPolarHBondContact O-CB 3.47Å; W607-T610 PolarHBondContact O-N 2.88Å; W607-Y611 HydrophobicContact CB-CD2 4.14Å; W607-Y611 HydrophobicContact CB-CE2 3.59Å; W607-Y611 WeakPolarHBondContact O-CD2 3.23Å; W607-Y611 PolarHBondContact O-N 3.03Å
608	F	84.2	Confident	84.1	Confident	24 Å²	24	43 Å²	43	11%	0.105	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-40.2	-176.6	-167.5	-83.2	0	0	0	113	V452 L486 I490 L605 N606 T610 Y611 Y612	V452-F608 HydrophobicContact CG1-CE2 4.31Å; V452-F608 HydrophobicContact CG2-CE2 4.42Å; L486-F608 HydrophobicContact CD1-CD1 3.67Å; L486-F608 HydrophobicContact CD1-CD2 4.45Å; L486-F608 HydrophobicContact CD1-CE1 3.42Å; L486-F608 VanDerWaalsContact CD1-CE1 3.42Å; L486-F608 HydrophobicContact CD1-CE2 4.23Å; L486-F608 HydrophobicContact CD1-CG 4.2Å; L486-F608 HydrophobicContact CD1-CZ 3.73Å; I490-F608 HydrophobicContact CD1-CE1 4.46Å; I490-F608 HydrophobicContact CG1-CE1 4.41Å; L605-F608 WeakPolarHBondContact O-CB 3.35Å; L605-F608 PolarHBondContact O-N 2.89Å; N606-F608 VanDerWaalsContact C-N 3.31Å; N606-F608 PolarHBondContact O-N 3.43Å; F608-T610 PolarHBondContact O-N 2.99Å; F608-Y611 PolarHBondContact O-N 3.06Å; F608-Y612 WeakPolarHBondContact O-CB 3.43Å; F608-Y612 PolarHBondContact O-N 3.45Å
609	G	81.1	Confident	83.8	Confident	5 Å²	5	42.6 Å²	42.6	5%	0.052	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-16.6	175.1	0	0	0	0	0	114.1	W607 R613	W607-G609 PolarHBondContact O-N 2.8Å; G609-R613 PolarHBondContact O-NE 2.69Å
610	T	83.4	Confident	83.4	Confident	40 Å²	40	42 Å²	42	25%	0.245	20%	0.204	C	C	.	.	H	α-helix	trans	-88.5	-45.2	169.7	-67.9	0	0	0	0	110.9	W607 F608 Y612 R613 M614	W607-T610 WeakPolarHBondContact O-CA 3.17Å; W607-T610 WeakPolarHBondContact O-CB 3.47Å; W607-T610 PolarHBondContact O-N 2.88Å; F608-T610 PolarHBondContact O-N 2.99Å; T610-Y612 PolarHBondContact O-N 3.16Å; T610-R613 PolarHBondContact O-N 2.91Å; T610-R613 PolarHBondContact OG1-NH2 3.29Å; T610-M614 HydrophobicContact CG2-CE 3.68Å; T610-M614 HydrophobicContact CG2-CG 4.39Å; T610-M614 HydrophobicContact CG2-SD 3.82Å; T610-M614 WeakPolarHBondContact O-CG 3.03Å; T610-M614 PolarHBondContact O-N 3.47Å
611	Y	84.9	Confident	83.1	Confident	42 Å²	42	42.1 Å²	42.1	17%	0.165	21%	0.206	C	C	.	.	H	α-helix	trans	-59.4	-41.7	174.7	-62.8	-42.5	0	0	0	112.9	Y447 N451 W607 F608 R613 M614 I615	Y447-Y611 AromaticContact CD1-CD1 3.63Å; Y447-Y611 HydrophobicContact CD1-CD1 3.63Å; Y447-Y611 AromaticContact CD1-CE1 3.67Å; Y447-Y611 HydrophobicContact CD1-CE1 3.67Å; Y447-Y611 HydrophobicContact CE1-CD1 4.05Å; Y447-Y611 AromaticContact CE1-CE1 3.87Å; Y447-Y611 HydrophobicContact CE1-CE1 3.87Å; Y447-Y611 HydrophobicContact CG-CD1 4.22Å; N451-Y611 HydrophobicContact CB-CD2 3.89Å; N451-Y611 HydrophobicContact CB-CE1 4.45Å; N451-Y611 HydrophobicContact CB-CE2 3.59Å; N451-Y611 HydrophobicContact CB-CG 4.43Å; N451-Y611 VanDerWaalsContact CG-CZ 3.48Å; N451-Y611 VanDerWaalsContact OD1-CZ 3.3Å; N451-Y611 PolarHBondContact OD1-OH 3.22Å; W607-Y611 HydrophobicContact CB-CD2 4.14Å; W607-Y611 HydrophobicContact CB-CE2 3.59Å; W607-Y611 WeakPolarHBondContact O-CD2 3.23Å; W607-Y611 PolarHBondContact O-N 3.03Å; F608-Y611 PolarHBondContact O-N 3.06Å; Y611-R613 VanDerWaalsContact C-N 3.31Å; Y611-R613 PolarHBondContact O-N 3.28Å; Y611-M614 HydrophobicContact CD1-SD 4.3Å; Y611-M614 PolarHBondContact O-N 3.4Å; Y611-I615 WeakPolarHBondContact O-CB 3.49Å; Y611-I615 WeakPolarHBondContact O-CD1 3.23Å; Y611-I615 WeakPolarHBondContact O-CG1 3.27Å; Y611-I615 PolarHBondContact O-N 3.2Å
612	Y	82.6	Confident	82.9	Confident	18 Å²	18	41.8 Å²	41.8	7%	0.071	20%	0.204	C	C	.	.	H	α-helix	trans	-53.2	-47.6	175.6	-176.8	-103	0	0	0	111.9	W300 I490 T493 E494 F608 T610 I615 Q616	W300-Y612 AromaticContact CE2-CE2 3.95Å; W300-Y612 HydrophobicContact CZ2-CD2 4.02Å; W300-Y612 AromaticContact CZ2-CE2 3.51Å; W300-Y612 HydrophobicContact CZ2-CE2 3.51Å; W300-Y612 AromaticContact NE1-CE2 3.8Å; W300-Y612 AromaticContact NE1-CZ 3.84Å; W300-Y612 PolarHBondContact NE1-OH 3.15Å; I490-Y612 HydrophobicContact CG2-CE1 4.42Å; I490-Y612 HydrophobicContact CG2-CE2 4.43Å; T493-Y612 HydrophobicContact CG2-CD1 4.21Å; E494-Y612 HydrophobicContact CG-CE1 3.98Å; E494-Y612 PolarHBondContact OE1-OH 3.27Å; F608-Y612 WeakPolarHBondContact O-CB 3.43Å; F608-Y612 PolarHBondContact O-N 3.45Å; T610-Y612 PolarHBondContact O-N 3.16Å; Y612-I615 PolarHBondContact O-N 3.38Å; Y612-Q616 HydrophobicContact CE1-CG 4.48Å; Y612-Q616 VanDerWaalsContact CE1-NE2 3.29Å; Y612-Q616 WeakPolarHBondContact O-CG 3.49Å; Y612-Q616 PolarHBondContact O-N 3.24Å; Y612-Q616 PolarHBondContact OH-NE2 3.47Å
613	R	78.9	Confident	82.8	Confident	39 Å²	39	43.3 Å²	43.3	15%	0.147	21%	0.212	C	C	.	.	H	α-helix	trans	-72.6	-39.4	179.1	-69.3	-179.6	-66.8	125	6.5	112.6	T493 G609 T610 Y611 I615 Q616 T617	T493-R613 VanDerWaalsContact CG2-CD 3.45Å; T493-R613 HydrophobicContact CG2-CG 3.53Å; G609-R613 PolarHBondContact O-NE 2.69Å; T610-R613 PolarHBondContact O-N 2.91Å; T610-R613 PolarHBondContact OG1-NH2 3.29Å; Y611-R613 VanDerWaalsContact C-N 3.31Å; Y611-R613 PolarHBondContact O-N 3.28Å; R613-I615 VanDerWaalsContact C-N 3.31Å; R613-I615 PolarHBondContact O-N 3.17Å; R613-Q616 PolarHBondContact O-N 2.98Å; R613-T617 PolarHBondContact O-N 3.49Å; R613-T617 PolarHBondContact O-OG1 3.35Å
614	M	81.7	Confident	82.7	Confident	67 Å²	67	40.8 Å²	40.8	33%	0.33	20%	0.201	S	C	.	.	H	α-helix	trans	-60.7	-42.3	173.8	-73.2	172	164.9	0	0	111.1	Y447 T610 Y611 T617 N618	Y447-M614 HydrophobicContact CD2-CB 4.11Å; Y447-M614 HydrophobicContact CE1-SD 4.05Å; Y447-M614 HydrophobicContact CE2-CB 3.92Å; Y447-M614 HydrophobicContact CE2-CG 4.34Å; Y447-M614 HydrophobicContact CE2-SD 3.86Å; Y447-M614 VanDerWaalsContact CZ-SD 3.56Å; T610-M614 HydrophobicContact CG2-CE 3.68Å; T610-M614 HydrophobicContact CG2-CG 4.39Å; T610-M614 HydrophobicContact CG2-SD 3.82Å; T610-M614 WeakPolarHBondContact O-CG 3.03Å; T610-M614 PolarHBondContact O-N 3.47Å; Y611-M614 HydrophobicContact CD1-SD 4.3Å; Y611-M614 PolarHBondContact O-N 3.4Å; M614-T617 PolarHBondContact O-N 2.86Å; M614-N618 VanDerWaalsContact O-CB 3.23Å; M614-N618 WeakPolarHBondContact O-CB 2.99Å; M614-N618 PolarHBondContact O-N 3.35Å; M614-N618 PolarHBondContact O-OD1 3.36Å
615	I	84.2	Confident	82.8	Confident	5 Å²	5	39 Å²	39	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-45.2	174.9	-71	161.4	0	0	0	110.5	W300 L448 V452 Y611 Y612 R613 F619	W300-I615 HydrophobicContact CH2-CG2 4.38Å; L448-I615 HydrophobicContact CD2-CD1 3.73Å; L448-I615 HydrophobicContact CD2-CG1 4.32Å; L448-I615 HydrophobicContact CG-CD1 4.46Å; V452-I615 HydrophobicContact CG2-CD1 3.59Å; Y611-I615 WeakPolarHBondContact O-CB 3.49Å; Y611-I615 WeakPolarHBondContact O-CD1 3.23Å; Y611-I615 WeakPolarHBondContact O-CG1 3.27Å; Y611-I615 PolarHBondContact O-N 3.2Å; Y612-I615 PolarHBondContact O-N 3.38Å; R613-I615 VanDerWaalsContact C-N 3.31Å; R613-I615 PolarHBondContact O-N 3.17Å; I615-F619 HydrophobicContact CG2-CD2 3.6Å; I615-F619 HydrophobicContact CG2-CE2 3.44Å; I615-F619 VanDerWaalsContact CG2-CE2 3.44Å; I615-F619 WeakPolarHBondContact O-CB 3.43Å; I615-F619 WeakPolarHBondContact O-CD2 3.46Å; I615-F619 PolarHBondContact O-N 3.22Å
616	Q	77.7	Confident	82.8	Confident	29 Å²	29	40 Å²	40	14%	0.136	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-48.5	175.5	-75.8	-179.2	-28.9	0	0	112.9	T299 Y612 R613 F619 I620	T299-Q616 HydrophobicContact CG2-CB 4.29Å; T299-Q616 HydrophobicContact CG2-CG 4.27Å; Y612-Q616 HydrophobicContact CE1-CG 4.48Å; Y612-Q616 VanDerWaalsContact CE1-NE2 3.29Å; Y612-Q616 WeakPolarHBondContact O-CG 3.49Å; Y612-Q616 PolarHBondContact O-N 3.24Å; Y612-Q616 PolarHBondContact OH-NE2 3.47Å; R613-Q616 PolarHBondContact O-N 2.98Å; Q616-F619 PolarHBondContact O-N 2.87Å; Q616-I620 WeakPolarHBondContact O-CG1 3.4Å; Q616-I620 PolarHBondContact O-N 2.96Å
617	T	79	Confident	82.9	Confident	74 Å²	74	40.8 Å²	40.8	45%	0.454	20%	0.198	S	C	.	.	H	α-helix	trans	-62.2	-49.1	178	-65.4	0	0	0	0	111.1	R613 M614 F619 I620 D621	R613-T617 PolarHBondContact O-N 3.49Å; R613-T617 PolarHBondContact O-OG1 3.35Å; M614-T617 PolarHBondContact O-N 2.86Å; T617-F619 VanDerWaalsContact C-N 3.25Å; T617-F619 PolarHBondContact O-N 3.36Å; T617-I620 PolarHBondContact O-N 2.74Å; T617-D621 PolarHBondContact O-N 3.49Å
618	N	84.6	Confident	83	Confident	22 Å²	22	34.4 Å²	34.4	12%	0.118	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-30.2	-179.4	-67.9	22.4	0	0	0	112.3	S440 L444 M614 M622	S440-N618 WeakPolarHBondContact CB-O 3.2Å; S440-N618 PolarHBondContact O-ND2 3.29Å; S440-N618 WeakPolarHBondContact OG-CA 3.16Å; L444-N618 HydrophobicContact CB-CB 3.8Å; L444-N618 HydrophobicContact CD1-CB 3.96Å; L444-N618 HydrophobicContact CG-CB 4.44Å; L444-N618 PolarHBondContact N-ND2 3.05Å; L444-N618 VanDerWaalsContact N-ND2 3.19Å; M614-N618 VanDerWaalsContact O-CB 3.23Å; M614-N618 WeakPolarHBondContact O-CB 2.99Å; M614-N618 PolarHBondContact O-N 3.35Å; M614-N618 PolarHBondContact O-OD1 3.36Å; N618-M622 WeakPolarHBondContact O-CB 3.23Å; N618-M622 PolarHBondContact O-N 3.09Å
619	F	82.4	Confident	83.1	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.179	C	C	.	.	H	α-helix	trans	-64.8	-41.2	171.8	-92.1	-56.1	0	0	0	112.4	T299 F303 K306 L444 I615 Q616 T617 M622 E623	T299-F619 HydrophobicContact CG2-CB 3.8Å; T299-F619 HydrophobicContact CG2-CD2 4.49Å; T299-F619 HydrophobicContact CG2-CG 4.48Å; F303-F619 HydrophobicContact CD2-CE1 4.44Å; F303-F619 AromaticContact CD2-CE2 3.68Å; F303-F619 HydrophobicContact CD2-CE2 3.68Å; F303-F619 AromaticContact CD2-CZ 3.45Å; F303-F619 HydrophobicContact CD2-CZ 3.45Å; F303-F619 VanDerWaalsContact CD2-CZ 3.45Å; F303-F619 AromaticContact CE2-CE2 3.58Å; F303-F619 HydrophobicContact CE2-CE2 3.58Å; F303-F619 AromaticContact CE2-CZ 3.41Å; F303-F619 HydrophobicContact CE2-CZ 3.41Å; F303-F619 VanDerWaalsContact CE2-CZ 3.41Å; K306-F619 HydrophobicContact CB-CD1 4.42Å; K306-F619 HydrophobicContact CB-CE1 3.82Å; K306-F619 HydrophobicContact CD-CD1 3.91Å; K306-F619 HydrophobicContact CD-CE1 4.09Å; L444-F619 HydrophobicContact CD1-CB 4.39Å; L444-F619 HydrophobicContact CD1-CD1 3.68Å; L444-F619 HydrophobicContact CD1-CD2 3.79Å; L444-F619 HydrophobicContact CD1-CE1 3.75Å; L444-F619 HydrophobicContact CD1-CE2 3.87Å; L444-F619 HydrophobicContact CD1-CG 3.68Å; L444-F619 HydrophobicContact CD1-CZ 3.83Å; L444-F619 HydrophobicContact CD2-CE1 4.49Å; L444-F619 HydrophobicContact CD2-CZ 4.36Å; I615-F619 HydrophobicContact CG2-CD2 3.6Å; I615-F619 HydrophobicContact CG2-CE2 3.44Å; I615-F619 VanDerWaalsContact CG2-CE2 3.44Å; I615-F619 WeakPolarHBondContact O-CB 3.43Å; I615-F619 WeakPolarHBondContact O-CD2 3.46Å; I615-F619 PolarHBondContact O-N 3.22Å; Q616-F619 PolarHBondContact O-N 2.87Å; T617-F619 VanDerWaalsContact C-N 3.25Å; T617-F619 PolarHBondContact O-N 3.36Å; F619-M622 HydrophobicContact CD1-CE 3.66Å; F619-M622 HydrophobicContact CE1-CE 4.02Å; F619-E623 VanDerWaalsContact O-CB 3.23Å; F619-E623 WeakPolarHBondContact O-CB 3.48Å; F619-E623 PolarHBondContact O-N 3.41Å
620	I	79.4	Confident	83.5	Confident	75 Å²	75	41.5 Å²	41.5	39%	0.385	21%	0.206	S	C	.	.	H	α-helix	trans	-69.2	-48.5	179.6	-65.1	163.1	0	0	0	110.5	T299 Q616 T617 M622 E623 N624	T299-I620 HydrophobicContact CG2-CG1 4.45Å; Q616-I620 WeakPolarHBondContact O-CG1 3.4Å; Q616-I620 PolarHBondContact O-N 2.96Å; T617-I620 PolarHBondContact O-N 2.74Å; I620-M622 VanDerWaalsContact C-N 3.3Å; I620-M622 PolarHBondContact O-N 3.39Å; I620-E623 WeakPolarHBondContact O-CB 3.48Å; I620-E623 PolarHBondContact O-N 2.85Å; I620-E623 VanDerWaalsContact O-N 3.07Å; I620-N624 PolarHBondContact O-N 3.33Å; I620-N624 PolarHBondContact O-ND2 3.14Å
621	D	82.6	Confident	83.8	Confident	30 Å²	30	43.1 Å²	43.1	16%	0.16	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-37.2	179.4	-74.3	-17.3	0	0	0	111.5	R436 S440 T617 M625	R436-D621 HydrophobicContact CB-CB 4.21Å; S440-D621 VanDerWaalsContact OG-CB 3.31Å; S440-D621 WeakPolarHBondContact OG-CB 3.19Å; T617-D621 PolarHBondContact O-N 3.49Å; D621-M625 WeakPolarHBondContact O-CB 3.25Å; D621-M625 PolarHBondContact O-N 3.06Å; D621-M625 VanDerWaalsContact O-N 3.11Å
622	M	84.3	Confident	83.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-67.9	-34.2	171.6	-178.9	-165.4	78.4	0	0	112.9	K306 L310 V441 N618 F619 I620 M625 F626	K306-M622 HydrophobicContact CB-CE 4.24Å; K306-M622 HydrophobicContact CD-CE 4.47Å; K306-M622 HydrophobicContact CG-CE 4.48Å; L310-M622 HydrophobicContact CD1-SD 4.01Å; L310-M622 HydrophobicContact CD2-SD 3.75Å; L310-M622 HydrophobicContact CG-SD 4.01Å; V441-M622 HydrophobicContact CG2-CB 4.43Å; V441-M622 HydrophobicContact CG2-CG 3.74Å; V441-M622 HydrophobicContact CG2-SD 4.25Å; N618-M622 WeakPolarHBondContact O-CB 3.23Å; N618-M622 PolarHBondContact O-N 3.09Å; F619-M622 HydrophobicContact CD1-CE 3.66Å; F619-M622 HydrophobicContact CE1-CE 4.02Å; I620-M622 VanDerWaalsContact C-N 3.3Å; I620-M622 PolarHBondContact O-N 3.39Å; M622-M625 HydrophobicContact CG-CE 4.3Å; M622-M625 PolarHBondContact O-N 2.88Å; M622-F626 HydrophobicContact CE-CD2 4.23Å; M622-F626 HydrophobicContact CE-CE2 4.04Å; M622-F626 HydrophobicContact CG-CD2 3.68Å; M622-F626 HydrophobicContact CG-CE2 3.5Å; M622-F626 VanDerWaalsContact CG-CE2 3.5Å; M622-F626 WeakPolarHBondContact O-CB 3.42Å; M622-F626 VanDerWaalsContact O-CD2 3.24Å; M622-F626 WeakPolarHBondContact O-CD2 3.45Å; M622-F626 PolarHBondContact O-N 3.46Å; M622-F626 HydrophobicContact SD-CD2 4.35Å; M622-F626 HydrophobicContact SD-CE2 3.77Å
623	E	83	Confident	84	Confident	65 Å²	65	48.2 Å²	48.2	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-68.9	-46.7	177.8	-172.3	148.2	-130.5	0	0	110.8	K306 F619 I620 M625 F626 D627	K306-E623 WeakPolarHBondContact CE-OE1 3.46Å; K306-E623 IonicContact NZ-OE1 3.92Å; K306-E623 PolarHBondContact NZ-OE1 3.36Å; K306-E623 IonicContact NZ-OE2 3.44Å; K306-E623 PolarHBondContact NZ-OE2 3.38Å; F619-E623 VanDerWaalsContact O-CB 3.23Å; F619-E623 WeakPolarHBondContact O-CB 3.48Å; F619-E623 PolarHBondContact O-N 3.41Å; I620-E623 WeakPolarHBondContact O-CB 3.48Å; I620-E623 PolarHBondContact O-N 2.85Å; I620-E623 VanDerWaalsContact O-N 3.07Å; E623-M625 VanDerWaalsContact C-N 3.29Å; E623-M625 PolarHBondContact O-N 3.19Å; E623-F626 CarbonylContact O-C 3.48Å; E623-F626 PolarHBondContact O-N 2.91Å; E623-D627 PolarHBondContact O-N 3.46Å
624	N	82.9	Confident	84.3	Confident	61 Å²	61	50.3 Å²	50.3	33%	0.326	25%	0.25	S	C	.	.	H	α-helix	trans	-55.9	-42.8	171.6	-64.7	-28.9	0	0	0	112.1	I433 I620 D627 L628	I433-N624 HydrophobicContact CG2-CB 4.07Å; I620-N624 PolarHBondContact O-N 3.33Å; I620-N624 PolarHBondContact O-ND2 3.14Å; N624-D627 PolarHBondContact O-N 3.35Å; N624-L628 WeakPolarHBondContact O-CB 3.34Å; N624-L628 PolarHBondContact O-N 2.99Å
625	M	87.1	Confident	84.6	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-35.7	175.5	-179.6	-143.1	74.4	0	0	112.7	V406 I410 V441 D621 M622 E623 L629	V406-M625 HydrophobicContact CG1-SD 4.13Å; I410-M625 HydrophobicContact CD1-CG 3.6Å; I410-M625 HydrophobicContact CD1-SD 3.65Å; I410-M625 HydrophobicContact CG1-CG 4.33Å; V441-M625 HydrophobicContact CG2-CE 4.06Å; V441-M625 HydrophobicContact CG2-SD 4.12Å; D621-M625 WeakPolarHBondContact O-CB 3.25Å; D621-M625 PolarHBondContact O-N 3.06Å; D621-M625 VanDerWaalsContact O-N 3.11Å; M622-M625 HydrophobicContact CG-CE 4.3Å; M622-M625 PolarHBondContact O-N 2.88Å; E623-M625 VanDerWaalsContact C-N 3.29Å; E623-M625 PolarHBondContact O-N 3.19Å; M625-L629 HydrophobicContact CE-CD1 4.19Å; M625-L629 WeakPolarHBondContact O-CG 3.42Å; M625-L629 PolarHBondContact O-N 2.92Å; M625-L629 VanDerWaalsContact O-N 3.1Å
626	F	85.2	Confident	84.8	Confident	27 Å²	27	52 Å²	52	12%	0.118	26%	0.256	C	S	.	.	H	α-helix	trans	-74.8	-30	173.9	-83.5	-50.9	0	0	0	113	Y313 M622 E623 L629 K630	Y313-F626 HydrophobicContact CE2-CE1 4.22Å; Y313-F626 HydrophobicContact CE2-CZ 4.01Å; M622-F626 HydrophobicContact CE-CD2 4.23Å; M622-F626 HydrophobicContact CE-CE2 4.04Å; M622-F626 HydrophobicContact CG-CD2 3.68Å; M622-F626 HydrophobicContact CG-CE2 3.5Å; M622-F626 VanDerWaalsContact CG-CE2 3.5Å; M622-F626 WeakPolarHBondContact O-CB 3.42Å; M622-F626 VanDerWaalsContact O-CD2 3.24Å; M622-F626 WeakPolarHBondContact O-CD2 3.45Å; M622-F626 PolarHBondContact O-N 3.46Å; M622-F626 HydrophobicContact SD-CD2 4.35Å; M622-F626 HydrophobicContact SD-CE2 3.77Å; E623-F626 CarbonylContact O-C 3.48Å; E623-F626 PolarHBondContact O-N 2.91Å; F626-L629 HydrophobicContact CD1-CD1 4.12Å; F626-L629 HydrophobicContact CE1-CD1 4.43Å; F626-L629 CarbonylContact O-C 3.55Å; F626-L629 PolarHBondContact O-N 3.44Å; F626-K630 VanDerWaalsContact O-CG 3.25Å; F626-K630 WeakPolarHBondContact O-CG 3.22Å; F626-K630 PolarHBondContact O-N 3.1Å; F626-K630 VanDerWaalsContact O-N 3.15Å
627	D	86.1	Confident	85.5	Confident	76 Å²	76	53.7 Å²	53.7	41%	0.406	27%	0.266	S	S	.	.	H	α-helix	trans	-70	-39.4	172.8	-69.4	-21.7	0	0	0	110.7	E623 N624 L629 K630 E631	E623-D627 PolarHBondContact O-N 3.46Å; N624-D627 PolarHBondContact O-N 3.35Å; D627-L629 VanDerWaalsContact C-N 3.3Å; D627-L629 PolarHBondContact O-N 2.87Å; D627-K630 WeakPolarHBondContact O-CB 3.46Å; D627-K630 PolarHBondContact O-N 3.4Å; D627-K630 IonicContact OD1-NZ 3.44Å; D627-K630 PolarHBondContact OD1-NZ 3.18Å; D627-E631 PolarHBondContact O-N 3.12Å
628	L	87.3	Confident	86	Confident	18 Å²	18	53.9 Å²	53.9	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-57.3	-39.8	168	178.5	63	0	0	0	112.6	I410 H413 L414 L417 W421 I433 N624 K630 E631	I410-L628 HydrophobicContact CG2-CD2 4.22Å; H413-L628 PolarHBondContact NE2-O 2.98Å; L414-L628 HydrophobicContact CD2-CD1 3.88Å; L414-L628 HydrophobicContact CD2-CD2 4.14Å; L414-L628 HydrophobicContact CD2-CG 4.31Å; L417-L628 HydrophobicContact CD1-CD1 4.3Å; W421-L628 HydrophobicContact CH2-CD1 3.53Å; W421-L628 HydrophobicContact CZ2-CD1 3.31Å; I433-L628 HydrophobicContact CG2-CD2 4.23Å; N624-L628 WeakPolarHBondContact O-CB 3.34Å; N624-L628 PolarHBondContact O-N 2.99Å; L628-K630 VanDerWaalsContact C-N 3.27Å; L628-K630 PolarHBondContact O-N 3.12Å; L628-E631 PolarHBondContact O-N 3.36Å
629	L	87.4	Confident	86.2	Confident	40 Å²	40	59.1 Å²	59.1	21%	0.209	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-2.7	175	-74.2	171.9	0	0	0	114.8	I410 H413 M625 F626 D627	I410-L629 HydrophobicContact CG1-CD1 4.03Å; I410-L629 HydrophobicContact CG1-CD2 4.03Å; I410-L629 HydrophobicContact CG1-CG 4.19Å; H413-L629 HydrophobicContact CB-CD2 4.06Å; M625-L629 HydrophobicContact CE-CD1 4.19Å; M625-L629 WeakPolarHBondContact O-CG 3.42Å; M625-L629 PolarHBondContact O-N 2.92Å; M625-L629 VanDerWaalsContact O-N 3.1Å; F626-L629 HydrophobicContact CD1-CD1 4.12Å; F626-L629 HydrophobicContact CE1-CD1 4.43Å; F626-L629 CarbonylContact O-C 3.55Å; F626-L629 PolarHBondContact O-N 3.44Å; D627-L629 VanDerWaalsContact C-N 3.3Å; D627-L629 PolarHBondContact O-N 2.87Å
630	K	88.6	Confident	86.4	Confident	139 Å²	139	62.9 Å²	62.9	60%	0.604	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-11.1	172.7	-71.9	166.7	-153.4	161.1	0	112.4	F626 D627 L628 E632	F626-K630 VanDerWaalsContact O-CG 3.25Å; F626-K630 WeakPolarHBondContact O-CG 3.22Å; F626-K630 PolarHBondContact O-N 3.1Å; F626-K630 VanDerWaalsContact O-N 3.15Å; D627-K630 WeakPolarHBondContact O-CB 3.46Å; D627-K630 PolarHBondContact O-N 3.4Å; D627-K630 IonicContact OD1-NZ 3.44Å; D627-K630 PolarHBondContact OD1-NZ 3.18Å; L628-K630 VanDerWaalsContact C-N 3.27Å; L628-K630 PolarHBondContact O-N 3.12Å; K630-E632 PolarHBondContact O-N 2.92Å
631	E	89.6	Confident	87	Confident	73 Å²	73	60.4 Å²	60.4	34%	0.341	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-58.7	131	178.5	-171.1	88.9	-120.2	0	0	109.2	H413 L417 W421 R425 D627 L628	H413-E631 PolarHBondContact CE1-O 2.95Å; H413-E631 PolarHBondContact NE2-O 3.25Å; L417-E631 HydrophobicContact CD1-CG 4.48Å; L417-E631 HydrophobicContact CD2-CB 3.98Å; L417-E631 HydrophobicContact CD2-CG 3.84Å; W421-E631 VanDerWaalsContact CD1-CD 3.42Å; W421-E631 VanDerWaalsContact NE1-CG 3.27Å; W421-E631 PolarHBondContact NE1-OE2 3.16Å; R425-E631 IonicContact CZ-OE2 2.68Å; R425-E631 IonicContact NH2-OE2 2.72Å; R425-E631 PolarHBondContact NH2-OE2 3.23Å; D627-E631 PolarHBondContact O-N 3.12Å; L628-E631 PolarHBondContact O-N 3.36Å
632	E	85.9	Confident	87.5	Confident	142 Å²	142	60.5 Å²	60.5	66%	0.664	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-81.7	135	-176.9	-68.6	-148.6	-145.9	0	0	111.3	K630 E634 K636	K630-E632 PolarHBondContact O-N 2.92Å; E632-E634 PolarHBondContact O-N 2.93Å; E632-K636 IonicContact OE2-NZ 3.1Å; E632-K636 PolarHBondContact OE2-NZ 2.95Å
633	T	86.1	Confident	88	Confident	25 Å²	25	64.9 Å²	64.9	15%	0.153	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-70.4	119.7	172.1	54.9	0	0	0	0	109.1	E416 L417 K636	E416-T633 HydrophobicContact CB-CG2 3.7Å; E416-T633 WeakPolarHBondContact O-CG2 3.35Å; L417-T633 HydrophobicContact CD2-CG2 4.2Å; T633-K636 WeakPolarHBondContact O-CE 3.31Å; T633-K636 PolarHBondContact O-NZ 3.49Å; T633-K636 WeakPolarHBondContact OG1-CE 3.25Å; T633-K636 VanDerWaalsContact OG1-CG 3.22Å; T633-K636 WeakPolarHBondContact OG1-CG 3.42Å
634	E	85.4	Confident	88.6	Confident	83 Å²	83	62.2 Å²	62.2	39%	0.388	35%	0.354	S	S	.	.	S	Bend	trans	-63.8	-44.8	-176	-166.6	173.5	173.3	0	0	111.3	S418 E632	S418-E634 WeakPolarHBondContact CB-OE2 3.34Å; S418-E634 PolarHBondContact OG-OE2 3.35Å; E632-E634 PolarHBondContact O-N 2.93Å
635	V	87.6	Confident	89.1	Confident	12 Å²	12	68.5 Å²	68.5	7%	0.073	37%	0.373	C	S	.	.	S	Bend	trans	-104.9	105.6	179.9	-177	0	0	0	0	109.6	R699 Q720	V635-R699 HydrophobicContact CG1-CG 3.93Å; V635-Q720 HydrophobicContact CG1-CG 4.35Å; V635-Q720 PolarHBondContact O-NE2 3.34Å
636	K	88.5	Confident	89.3	Confident	97 Å²	97	71 Å²	71	42%	0.422	38%	0.384	S	S	.	.			trans	-107.8	142.5	178.6	-72.3	162.2	-178.9	148.5	0	110.9	E632 T633 R699	E632-K636 IonicContact OE2-NZ 3.1Å; E632-K636 PolarHBondContact OE2-NZ 2.95Å; T633-K636 WeakPolarHBondContact O-CE 3.31Å; T633-K636 PolarHBondContact O-NZ 3.49Å; T633-K636 WeakPolarHBondContact OG1-CE 3.25Å; T633-K636 VanDerWaalsContact OG1-CG 3.22Å; T633-K636 WeakPolarHBondContact OG1-CG 3.42Å; K636-R699 PolarHBondContact O-NH2 2.69Å
637	D	91.3	Very high	89.5	Confident	64 Å²	64	76.6 Å²	76.6	34%	0.342	41%	0.41	S	S	.	.			trans	-72.1	130.3	165.8	-75	9	0	0	0	108.4	T719 Q720	D637-T719 WeakPolarHBondContact OD2-CA 3.39Å; D637-T719 WeakPolarHBondContact OD2-CB 3.37Å; D637-Q720 WeakPolarHBondContact OD1-CB 3.46Å; D637-Q720 WeakPolarHBondContact OD1-CG 3.3Å; D637-Q720 PolarHBondContact OD1-N 3.29Å; D637-Q720 VanDerWaalsContact OD1-N 3.13Å; D637-Q720 PolarHBondContact OD1-NE2 3.12Å; D637-Q720 PolarHBondContact OD2-N 3.34Å; D637-Q720 VanDerWaalsContact OD2-N 3.09Å
638	L	90.6	Very high	89.6	Confident	77 Å²	77	79.8 Å²	79.8	40%	0.403	42%	0.42	S	S	.	.			trans	-65.6	146.8	179.7	-74.4	169.7	0	0	0	111.1	G640 A641 Q717	L638-G640 PolarHBondContact O-N 2.78Å; L638-A641 VanDerWaalsContact O-CB 3.25Å; L638-A641 WeakPolarHBondContact O-CB 3.5Å; L638-A641 PolarHBondContact O-N 2.95Å; L638-Q717 VanDerWaalsContact CD1-NE2 3.35Å; L638-Q717 VanDerWaalsContact CD1-OE1 3.31Å
639	P	88.8	Confident	89.7	Confident	132 Å²	132	79 Å²	79	86%	0.857	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	110.7	179.4	25.9	-33.8	0	0	0	110.4
640	G	87.4	Confident	90.1	Very high	82 Å²	82	82 Å²	82	85%	0.845	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.8	7.1	-174.8	0	0	0	0	0	115.2	L638 G642	L638-G640 PolarHBondContact O-N 2.78Å; G640-G642 PolarHBondContact O-N 3.36Å
641	A	91.7	Very high	90.5	Very high	22 Å²	22	75.4 Å²	75.4	18%	0.182	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-53.5	131.5	173.8	0	0	0	0	0	111.8	L638 Q717 T719	L638-A641 VanDerWaalsContact O-CB 3.25Å; L638-A641 WeakPolarHBondContact O-CB 3.5Å; L638-A641 PolarHBondContact O-N 2.95Å; A641-Q717 WeakPolarHBondContact CA-O 3.41Å; A641-Q717 WeakPolarHBondContact CB-O 3.44Å; A641-T719 HydrophobicContact CB-CG2 4.07Å; A641-T719 WeakPolarHBondContact O-CG2 3.33Å
642	G	92.4	Very high	90.9	Very high	32 Å²	32	72.8 Å²	72.8	33%	0.33	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-87.5	171.1	179.7	0	0	0	0	0	113.2	G640 V718 T719	G640-G642 PolarHBondContact O-N 3.36Å; G642-V718 CarbonylContact O-C 3.6Å; G642-V718 WeakPolarHBondContact O-CA 3.35Å; G642-T719 PolarHBondContact O-N 3.38Å; G642-T719 PolarHBondContact O-OG1 3.16Å
643	P	95.5	Very high	91.4	Very high	94 Å²	94	66.2 Å²	66.2	61%	0.61	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-68.6	141.5	162.9	30.6	-33.5	0	0	0	110.3	R645 S722	P643-R645 PolarHBondContact O-N 3.08Å; P643-S722 WeakPolarHBondContact CA-OG 3.48Å
644	L	94.1	Very high	91.9	Very high	9 Å²	9	68.5 Å²	68.5	5%	0.047	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-58	124.8	172.9	179.2	65.6	0	0	0	110.4	F646 I710 Q713 V718 S722 L723	L644-F646 PolarHBondContact O-N 2.62Å; L644-I710 HydrophobicContact CD1-CB 4.34Å; L644-I710 HydrophobicContact CD2-CD1 4.39Å; L644-I710 HydrophobicContact CD2-CG2 4.32Å; L644-Q713 HydrophobicContact CD1-CB 4.12Å; L644-V718 HydrophobicContact CB-CB 4.3Å; L644-V718 HydrophobicContact CB-CG1 4.29Å; L644-V718 HydrophobicContact CB-CG2 4.31Å; L644-V718 HydrophobicContact CD1-CG1 4.14Å; L644-V718 HydrophobicContact CD1-CG2 4.44Å; L644-S722 PolarHBondContact N-OG 2.97Å; L644-L723 HydrophobicContact CD2-CD1 4.02Å
645	R	93.6	Very high	92.3	Very high	192 Å²	192	69 Å²	69	73%	0.725	37%	0.367	S	S	*	.			trans	-89.8	85	175.6	-58.2	-179.5	-179	-177	0.7	109.8	P643 Q713	P643-R645 PolarHBondContact O-N 3.08Å; R645-Q713 VanDerWaalsContact CB-OE1 3.31Å; R645-Q713 PolarHBondContact O-NE2 3.31Å
646	F	91.7	Very high	92.7	Very high	55 Å²	55	68.4 Å²	68.4	24%	0.241	36%	0.364	C	S	.	.			trans	-64.5	134.7	175.2	-166.9	-92	0	0	0	111	L644 G649 H726 D807 I808	L644-F646 PolarHBondContact O-N 2.62Å; F646-G649 VanDerWaalsContact CZ-N 3.3Å; F646-H726 HydrophobicContact CD2-CB 4.47Å; F646-D807 HydrophobicContact CD1-CB 4.24Å; F646-D807 HydrophobicContact CD2-CB 4.4Å; F646-D807 HydrophobicContact CE1-CB 3.55Å; F646-D807 HydrophobicContact CE2-CB 3.73Å; F646-D807 HydrophobicContact CZ-CB 3.26Å; F646-I808 HydrophobicContact CE2-CD1 4.08Å; F646-I808 HydrophobicContact CE2-CG1 4.03Å
647	Q	90.8	Very high	92.9	Very high	144 Å²	144	66 Å²	66	67%	0.673	35%	0.354	S	S	*	.	S	Bend	trans	-128.5	-48.3	177.5	-62.8	-175.5	26.3	0	0	112.5	D711	Q647-D711 PolarHBondContact N-OD2 3.2Å
648	K	88.1	Confident	93	Very high	144 Å²	144	63.1 Å²	63.1	63%	0.626	34%	0.338	S	S	*	.	S	Bend	trans	-143.9	-15.8	-173.9	-59	-171.7	-179.5	-177.9	0	113.4	P676 D711	K648-P676 HydrophobicContact CB-CB 3.97Å; K648-P676 HydrophobicContact CB-CG 3.51Å; K648-P676 HydrophobicContact CD-CG 4.41Å; K648-P676 WeakPolarHBondContact O-CB 3.21Å; K648-D711 PolarHBondContact N-OD2 3.42Å
649	G	89.6	Confident	92.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.329	C	S	.	.			trans	73	38.9	-178.8	0	0	0	0	0	113.8	F646 D711 T838	F646-G649 VanDerWaalsContact CZ-N 3.3Å; G649-D711 VanDerWaalsContact N-CG 3.33Å; G649-D711 PolarHBondContact N-OD1 3.08Å; G649-D711 PolarHBondContact N-OD2 3.05Å; G649-T838 WeakPolarHBondContact O-CB 3.32Å; G649-T838 WeakPolarHBondContact O-CG2 3.37Å; G649-T838 PolarHBondContact O-OG1 2.66Å
650	R	95.7	Very high	92.7	Very high	104 Å²	104	57.3 Å²	57.3	39%	0.392	30%	0.299	S	S	.	.			trans	-73.3	128.5	164.4	176.9	177	170.1	161	-2.7	108.7	E652 T673 V674 P676 I710 D711	R650-E652 HydrophobicContact CG-CG 4.39Å; R650-E652 IonicContact CZ-OE1 3.72Å; R650-E652 IonicContact NE-OE1 3.14Å; R650-E652 PolarHBondContact NE-OE1 3.07Å; R650-E652 IonicContact NH2-OE1 2.74Å; R650-E652 PolarHBondContact NH2-OE1 2.98Å; R650-T673 HydrophobicContact CG-CG2 4.2Å; R650-V674 WeakPolarHBondContact CA-O 3.45Å; R650-P676 HydrophobicContact CB-CG 4.25Å; R650-I710 CarbonylContact O-C 3.48Å; R650-I710 WeakPolarHBondContact O-CA 3.38Å; R650-D711 PolarHBondContact N-OD1 2.86Å; R650-D711 PolarHBondContact O-N 3.43Å
651	I	96.9	Very high	92.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.3	-179	-55.3	166.8	0	0	0	108.8	F653 T673 V674 L697 I808 T838 I840	I651-F653 HydrophobicContact CG2-CD2 4.24Å; I651-F653 HydrophobicContact CG2-CE2 3.99Å; I651-T673 CarbonylContact O-C 3.54Å; I651-T673 WeakPolarHBondContact O-CA 3.42Å; I651-V674 HydrophobicContact CB-CB 4.21Å; I651-V674 HydrophobicContact CB-CG2 4.41Å; I651-V674 PolarHBondContact N-O 3.11Å; I651-V674 PolarHBondContact O-N 2.94Å; I651-L697 HydrophobicContact CD1-CD2 4.08Å; I651-L697 HydrophobicContact CG2-CD1 3.79Å; I651-L697 HydrophobicContact CG2-CD2 4.35Å; I651-I808 HydrophobicContact CD1-CD1 4.07Å; I651-I808 HydrophobicContact CD1-CG1 4.38Å; I651-I808 HydrophobicContact CD1-CG2 3.9Å; I651-I808 HydrophobicContact CG1-CD1 4.24Å; I651-T838 HydrophobicContact CD1-CG2 3.73Å; I651-T838 HydrophobicContact CG1-CG2 4.33Å; I651-I840 HydrophobicContact CD1-CD1 3.96Å
652	E	97	Very high	91.5	Very high	19 Å²	19	62.3 Å²	62.3	9%	0.089	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.6	-178	-66	176.1	149.9	0	0	110.5	R650 T673 I708 R709	R650-E652 HydrophobicContact CG-CG 4.39Å; R650-E652 IonicContact CZ-OE1 3.72Å; R650-E652 IonicContact NE-OE1 3.14Å; R650-E652 PolarHBondContact NE-OE1 3.07Å; R650-E652 IonicContact NH2-OE1 2.74Å; R650-E652 PolarHBondContact NH2-OE1 2.98Å; E652-T673 HydrophobicContact CG-CG2 3.91Å; E652-I708 CarbonylContact O-C 3.57Å; E652-I708 VanDerWaalsContact O-CA 3.31Å; E652-I708 WeakPolarHBondContact O-CA 3.48Å; E652-R709 HydrophobicContact CB-CB 4.29Å; E652-R709 PolarHBondContact N-O 2.87Å; E652-R709 PolarHBondContact O-N 3.26Å
653	F	97.1	Very high	90.3	Very high	4 Å²	4	65.1 Å²	65.1	2%	0.018	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.4	165.2	-79.5	-117.6	0	0	0	106.4	I651 V656 S671 F672 I693 L697 I708	I651-F653 HydrophobicContact CG2-CD2 4.24Å; I651-F653 HydrophobicContact CG2-CE2 3.99Å; F653-V656 HydrophobicContact CB-CG2 4.08Å; F653-V656 HydrophobicContact CD1-CB 4.16Å; F653-V656 HydrophobicContact CD1-CG1 4.38Å; F653-V656 HydrophobicContact CD1-CG2 3.76Å; F653-V656 HydrophobicContact CG-CG2 4.29Å; F653-S671 VanDerWaalsContact O-CA 3.3Å; F653-S671 WeakPolarHBondContact O-CA 3.35Å; F653-F672 HydrophobicContact CB-CD1 3.86Å; F653-F672 HydrophobicContact CB-CE1 3.76Å; F653-F672 HydrophobicContact CB-CG 4.46Å; F653-F672 HydrophobicContact CB-CZ 4.27Å; F653-F672 AromaticContact CD1-CE1 3.88Å; F653-F672 HydrophobicContact CD1-CE1 3.88Å; F653-F672 HydrophobicContact CD1-CZ 4.21Å; F653-F672 AromaticContact CD2-CE1 3.77Å; F653-F672 HydrophobicContact CD2-CE1 3.77Å; F653-F672 AromaticContact CD2-CE2 3.9Å; F653-F672 HydrophobicContact CD2-CE2 3.9Å; F653-F672 AromaticContact CD2-CZ 3.4Å; F653-F672 HydrophobicContact CD2-CZ 3.4Å; F653-F672 VanDerWaalsContact CD2-CZ 3.4Å; F653-F672 HydrophobicContact CE1-CE1 4.46Å; F653-F672 HydrophobicContact CE1-CZ 4.47Å; F653-F672 HydrophobicContact CE2-CE1 4.36Å; F653-F672 HydrophobicContact CE2-CE2 4.33Å; F653-F672 AromaticContact CE2-CZ 3.72Å; F653-F672 HydrophobicContact CE2-CZ 3.72Å; F653-F672 HydrophobicContact CG-CD1 4.16Å; F653-F672 AromaticContact CG-CE1 3.52Å; F653-F672 HydrophobicContact CG-CE1 3.52Å; F653-F672 HydrophobicContact CG-CE2 4.46Å; F653-F672 AromaticContact CG-CZ 3.7Å; F653-F672 HydrophobicContact CG-CZ 3.7Å; F653-F672 HydrophobicContact CZ-CZ 4.26Å; F653-F672 PolarHBondContact N-O 2.87Å; F653-F672 PolarHBondContact O-N 3.24Å; F653-I693 HydrophobicContact CE1-CG2 3.96Å; F653-I693 HydrophobicContact CE2-CG2 4.38Å; F653-I693 HydrophobicContact CZ-CG2 3.74Å; F653-L697 HydrophobicContact CE2-CD1 4.37Å; F653-L697 HydrophobicContact CZ-CB 4.22Å; F653-I708 HydrophobicContact CD1-CD1 4.05Å; F653-I708 HydrophobicContact CD1-CG1 3.85Å; F653-I708 HydrophobicContact CD2-CG2 4.15Å; F653-I708 HydrophobicContact CE1-CD1 3.49Å; F653-I708 VanDerWaalsContact CE1-CD1 3.49Å; F653-I708 HydrophobicContact CE1-CG1 3.78Å; F653-I708 HydrophobicContact CE2-CG1 4.47Å; F653-I708 HydrophobicContact CE2-CG2 3.81Å; F653-I708 HydrophobicContact CG-CG1 4.21Å; F653-I708 HydrophobicContact CZ-CD1 3.8Å; F653-I708 HydrophobicContact CZ-CG1 4.1Å; F653-I708 HydrophobicContact CZ-CG2 4.01Å
654	E	95.9	Very high	89.6	Confident	72 Å²	72	70.3 Å²	70.3	34%	0.336	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	111.9	176.8	-67	-176.9	178.7	0	0	109.5	V656 G706 C707 R709	E654-V656 VanDerWaalsContact C-N 3.31Å; E654-V656 PolarHBondContact O-N 2.99Å; E654-G706 CarbonylContact O-C 3.45Å; E654-G706 WeakPolarHBondContact O-CA 3.43Å; E654-C707 PolarHBondContact N-O 3.36Å; E654-C707 PolarHBondContact O-N 3.38Å; E654-C707 PolarHBondContact OE2-SG 3.31Å; E654-R709 IonicContact OE1-CZ 2.73Å; E654-R709 IonicContact OE1-NH1 2.75Å; E654-R709 PolarHBondContact OE1-NH1 2.85Å; E654-R709 IonicContact OE1-NH2 3.83Å; E654-R709 IonicContact OE2-CZ 3.71Å; E654-R709 IonicContact OE2-NH1 2.64Å; E654-R709 PolarHBondContact OE2-NH1 3.39Å; E654-R709 VanDerWaalsContact OE2-NH1 3.1Å; E654-R709 IonicContact OE2-NH2 3.68Å; E654-R709 PolarHBondContact OE2-NH2 3.27Å
655	N	94.7	Very high	89.1	Confident	93 Å²	93	74.1 Å²	74.1	50%	0.497	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.7	48	175.1	-57	9.1	0	0	0	112.9	H657 D669 S671 G706	N655-H657 PolarHBondContact O-CD2 3.41Å; N655-H657 PolarHBondContact O-N 2.89Å; N655-D669 WeakPolarHBondContact CA-OD1 3.34Å; N655-D669 WeakPolarHBondContact CB-OD1 3.3Å; N655-D669 PolarHBondContact OD1-OD1 3.43Å; N655-S671 WeakPolarHBondContact CA-OG 3.38Å; N655-S671 PolarHBondContact N-OG 3.42Å; N655-S671 PolarHBondContact OD1-OG 2.94Å; N655-G706 WeakPolarHBondContact O-CA 3.39Å
656	V	95.2	Very high	89	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.7	-172	176.5	0	0	0	0	110.9	F653 E654 V670 L696 I703 C707 I708	F653-V656 HydrophobicContact CB-CG2 4.08Å; F653-V656 HydrophobicContact CD1-CB 4.16Å; F653-V656 HydrophobicContact CD1-CG1 4.38Å; F653-V656 HydrophobicContact CD1-CG2 3.76Å; F653-V656 HydrophobicContact CG-CG2 4.29Å; E654-V656 VanDerWaalsContact C-N 3.31Å; E654-V656 PolarHBondContact O-N 2.99Å; V656-V670 PolarHBondContact N-O 3.18Å; V656-V670 VanDerWaalsContact N-O 3.15Å; V656-V670 PolarHBondContact O-N 3.34Å; V656-V670 VanDerWaalsContact O-N 3.11Å; V656-L696 HydrophobicContact CG1-CD1 4.32Å; V656-I703 HydrophobicContact CG1-CB 4.42Å; V656-I703 HydrophobicContact CG1-CG2 3.73Å; V656-C707 WeakPolarHBondContact CG2-O 3.36Å; V656-I708 HydrophobicContact CG2-CD1 4.5Å; V656-I708 HydrophobicContact CG2-CG1 3.8Å
657	H	93.5	Very high	89	Confident	46 Å²	46	63.7 Å²	63.7	21%	0.213	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.1	166.6	-65.1	-108.1	0	0	0	110.6	N655 E665 L667 D669 S704 S705	N655-H657 PolarHBondContact O-CD2 3.41Å; N655-H657 PolarHBondContact O-N 2.89Å; H657-E665 IonicContact ND1-OE1 3.75Å; H657-E665 IonicContact ND1-OE2 2.71Å; H657-E665 PolarHBondContact ND1-OE2 3.46Å; H657-E665 VanDerWaalsContact ND1-OE2 3.12Å; H657-L667 WeakPolarHBondContact CA-O 3.45Å; H657-D669 PolarHBondContact CE1-N 3.33Å; H657-D669 PolarHBondContact NE2-N 2.82Å; H657-S704 WeakPolarHBondContact O-CB 3.36Å; H657-S704 PolarHBondContact O-N 2.68Å; H657-S705 WeakPolarHBondContact CB-OG 3.35Å; H657-S705 PolarHBondContact CD2-OG 3.15Å; H657-S705 VanDerWaalsContact CD2-OG 3.25Å; H657-S705 PolarHBondContact N-O 3Å; H657-S705 PolarHBondContact O-N 3.48Å
658	F	93	Very high	89.1	Confident	5 Å²	5	60.6 Å²	60.6	2%	0.022	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	139	177	176.6	-99.4	0	0	0	113	Y660 T666 L667 T692 L696 Y701	F658-Y660 AromaticContact CE1-CD1 3.75Å; F658-Y660 HydrophobicContact CE1-CD1 3.75Å; F658-Y660 AromaticContact CE1-CD2 3.92Å; F658-Y660 HydrophobicContact CE1-CD2 3.92Å; F658-Y660 AromaticContact CE1-CE1 3.83Å; F658-Y660 HydrophobicContact CE1-CE1 3.83Å; F658-Y660 AromaticContact CE1-CE2 3.99Å; F658-Y660 HydrophobicContact CE1-CE2 3.99Å; F658-Y660 AromaticContact CE1-CG 3.81Å; F658-Y660 HydrophobicContact CE1-CG 3.81Å; F658-Y660 AromaticContact CE1-CZ 3.95Å; F658-Y660 AromaticContact CZ-CD1 3.84Å; F658-Y660 HydrophobicContact CZ-CD1 3.84Å; F658-Y660 HydrophobicContact CZ-CE1 4.07Å; F658-Y660 HydrophobicContact CZ-CG 4.21Å; F658-T666 PolarHBondContact O-N 3.05Å; F658-L667 HydrophobicContact CB-CB 4.4Å; F658-L667 PolarHBondContact N-O 3.42Å; F658-L667 VanDerWaalsContact N-O 3.1Å; F658-L667 PolarHBondContact O-N 3.38Å; F658-T692 HydrophobicContact CD1-CG2 3.42Å; F658-T692 VanDerWaalsContact CD1-CG2 3.42Å; F658-T692 HydrophobicContact CE1-CG2 3.53Å; F658-T692 HydrophobicContact CG-CG2 4.47Å; F658-L696 HydrophobicContact CB-CD1 3.92Å; F658-L696 HydrophobicContact CD1-CD1 4.33Å; F658-L696 HydrophobicContact CD2-CD1 4.49Å; F658-L696 HydrophobicContact CD2-CD2 3.77Å; F658-L696 HydrophobicContact CE2-CD2 4.03Å; F658-L696 HydrophobicContact CG-CD1 3.98Å; F658-L696 HydrophobicContact CG-CD2 4.07Å; F658-L696 HydrophobicContact CG-CG 4.49Å; F658-Y701 HydrophobicContact CE2-CD1 4.35Å; F658-Y701 HydrophobicContact CE2-CG 4.13Å; F658-Y701 AromaticContact CZ-CD1 3.87Å; F658-Y701 HydrophobicContact CZ-CD1 3.87Å; F658-Y701 HydrophobicContact CZ-CD2 4.42Å; F658-Y701 AromaticContact CZ-CG 3.78Å; F658-Y701 HydrophobicContact CZ-CG 3.78Å
659	S	89	Confident	89.3	Confident	28 Å²	28	58.2 Å²	58.2	20%	0.196	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.7	173.5	56.8	0	0	0	0	110.9	A661 R664	S659-A661 VanDerWaalsContact C-N 3.26Å; S659-A661 PolarHBondContact O-N 3Å; S659-R664 WeakPolarHBondContact CB-O 3.13Å
660	Y	84.4	Confident	89.5	Confident	58 Å²	58	58.2 Å²	58.2	23%	0.227	31%	0.305	C	S	.	.	S	Bend	trans	-73.4	-19.7	172.7	-75.2	-74.6	0	0	0	113	R420 F658 T666 T692 R695 Y701	R420-Y660 PolarHBondContact NE-O 3.22Å; R420-Y660 VanDerWaalsContact NE-O 3.14Å; R420-Y660 PolarHBondContact NH1-O 3.23Å; R420-Y660 PolarHBondContact NH2-O 3.37Å; R420-Y660 VanDerWaalsContact NH2-O 3.14Å; F658-Y660 AromaticContact CE1-CD1 3.75Å; F658-Y660 HydrophobicContact CE1-CD1 3.75Å; F658-Y660 AromaticContact CE1-CD2 3.92Å; F658-Y660 HydrophobicContact CE1-CD2 3.92Å; F658-Y660 AromaticContact CE1-CE1 3.83Å; F658-Y660 HydrophobicContact CE1-CE1 3.83Å; F658-Y660 AromaticContact CE1-CE2 3.99Å; F658-Y660 HydrophobicContact CE1-CE2 3.99Å; F658-Y660 AromaticContact CE1-CG 3.81Å; F658-Y660 HydrophobicContact CE1-CG 3.81Å; F658-Y660 AromaticContact CE1-CZ 3.95Å; F658-Y660 AromaticContact CZ-CD1 3.84Å; F658-Y660 HydrophobicContact CZ-CD1 3.84Å; F658-Y660 HydrophobicContact CZ-CE1 4.07Å; F658-Y660 HydrophobicContact CZ-CG 4.21Å; Y660-T666 HydrophobicContact CD2-CG2 4.21Å; Y660-T666 HydrophobicContact CE2-CG2 4Å; Y660-T692 HydrophobicContact CE2-CG2 3.93Å; Y660-T692 WeakPolarHBondContact CE2-OG1 3.36Å; Y660-T692 PolarHBondContact OH-OG1 3.02Å; Y660-R695 WeakPolarHBondContact OH-CD 3.44Å; Y660-R695 PolarHBondContact OH-NH1 3.38Å; Y660-R695 VanDerWaalsContact OH-NH1 3.09Å; Y660-Y701 HydrophobicContact CD1-CD1 4.43Å; Y660-Y701 AromaticContact CD1-CE1 3.87Å; Y660-Y701 HydrophobicContact CD1-CE1 3.87Å; Y660-Y701 HydrophobicContact CE1-CD1 4.47Å; Y660-Y701 HydrophobicContact CE1-CD2 4.42Å; Y660-Y701 AromaticContact CE1-CE1 3.87Å; Y660-Y701 HydrophobicContact CE1-CE1 3.87Å; Y660-Y701 AromaticContact CE1-CE2 3.87Å; Y660-Y701 HydrophobicContact CE1-CE2 3.87Å; Y660-Y701 AromaticContact CE1-CZ 3.57Å
661	A	78.6	Confident	89.5	Confident	49 Å²	49	55.6 Å²	55.6	41%	0.405	30%	0.303	S	S	.	.	S	Bend	trans	-157.4	153.2	177.2	0	0	0	0	0	109.5	S659 G663 R664	S659-A661 VanDerWaalsContact C-N 3.26Å; S659-A661 PolarHBondContact O-N 3Å; A661-G663 PolarHBondContact O-N 2.83Å; A661-R664 PolarHBondContact O-N 2.77Å
662	D	73.8	Confident	89.4	Confident	161 Å²	161	55.9 Å²	55.9	86%	0.861	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	132.7	-179.4	-55.3	-49.8	0	0	0	111.2
663	G	69	Low	89.4	Confident	90 Å²	90	57 Å²	57	93%	0.928	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-5.7	177.2	0	0	0	0	0	116.7	A661	A661-G663 PolarHBondContact O-N 2.83Å
664	R	79.3	Confident	89.3	Confident	204 Å²	204	56.8 Å²	56.8	77%	0.77	31%	0.312	S	S	*	.			trans	-139.4	101.7	169.4	-169.3	176.3	-178.2	179.3	1.3	112.8	S659 A661 T666	S659-R664 WeakPolarHBondContact CB-O 3.13Å; A661-R664 PolarHBondContact O-N 2.77Å; R664-T666 PolarHBondContact O-N 2.8Å
665	E	84.4	Confident	89.3	Confident	89 Å²	89	58 Å²	58	42%	0.416	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	130.9	169	-60.5	-161.5	165.5	0	0	110.4	H657 Q668	H657-E665 IonicContact ND1-OE1 3.75Å; H657-E665 IonicContact ND1-OE2 2.71Å; H657-E665 PolarHBondContact ND1-OE2 3.46Å; H657-E665 VanDerWaalsContact ND1-OE2 3.12Å; E665-Q668 HydrophobicContact CB-CG 3.76Å
666	T	90.6	Very high	89.2	Confident	28 Å²	28	56.2 Å²	56.2	17%	0.172	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-28	178.6	-56.4	0	0	0	0	111.6	F658 Y660 R664 T692 G861	F658-T666 PolarHBondContact O-N 3.05Å; Y660-T666 HydrophobicContact CD2-CG2 4.21Å; Y660-T666 HydrophobicContact CE2-CG2 4Å; R664-T666 PolarHBondContact O-N 2.8Å; T666-T692 HydrophobicContact CG2-CG2 4.41Å; T666-G861 WeakPolarHBondContact O-CA 3.3Å
667	L	92.7	Very high	89	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.1	170.3	-60.7	176.3	0	0	0	107.6	H657 F658 V670 T692 I693 L696 G861	H657-L667 WeakPolarHBondContact CA-O 3.45Å; F658-L667 HydrophobicContact CB-CB 4.4Å; F658-L667 PolarHBondContact N-O 3.42Å; F658-L667 VanDerWaalsContact N-O 3.1Å; F658-L667 PolarHBondContact O-N 3.38Å; L667-V670 HydrophobicContact CB-CG2 3.88Å; L667-V670 HydrophobicContact CD2-CG2 4.19Å; L667-T692 HydrophobicContact CD1-CG2 4.05Å; L667-T692 HydrophobicContact CG-CG2 4.39Å; L667-I693 HydrophobicContact CD1-CG1 3.78Å; L667-I693 HydrophobicContact CD2-CD1 4.33Å; L667-I693 HydrophobicContact CD2-CG1 4.05Å; L667-L696 HydrophobicContact CD1-CD1 3.55Å; L667-G861 WeakPolarHBondContact CA-O 3.3Å
668	Q	92.5	Very high	89	Confident	78 Å²	78	57.2 Å²	57.2	36%	0.364	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	119.4	-175.4	-54	179.6	20.5	0	0	108.3	E665 V670 G861	E665-Q668 HydrophobicContact CB-CG 3.76Å; Q668-V670 VanDerWaalsContact C-N 3.3Å; Q668-V670 PolarHBondContact O-N 3.24Å; Q668-G861 PolarHBondContact N-O 2.9Å
669	D	91.6	Very high	89.1	Confident	94 Å²	94	58.8 Å²	58.8	50%	0.503	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	43.7	49	-179.6	-163.9	19.5	0	0	0	114.5	N655 H657 S671	N655-D669 WeakPolarHBondContact CA-OD1 3.34Å; N655-D669 WeakPolarHBondContact CB-OD1 3.3Å; N655-D669 PolarHBondContact OD1-OD1 3.43Å; H657-D669 PolarHBondContact CE1-N 3.33Å; H657-D669 PolarHBondContact NE2-N 2.82Å; D669-S671 PolarHBondContact O-N 2.94Å
670	V	94.2	Very high	89.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	110.3	-176.2	177.4	0	0	0	0	110.4	V656 L667 Q668 F672 I693 G861 I863	V656-V670 PolarHBondContact N-O 3.18Å; V656-V670 VanDerWaalsContact N-O 3.15Å; V656-V670 PolarHBondContact O-N 3.34Å; V656-V670 VanDerWaalsContact O-N 3.11Å; L667-V670 HydrophobicContact CB-CG2 3.88Å; L667-V670 HydrophobicContact CD2-CG2 4.19Å; Q668-V670 VanDerWaalsContact C-N 3.3Å; Q668-V670 PolarHBondContact O-N 3.24Å; V670-F672 HydrophobicContact CG1-CD1 3.89Å; V670-F672 HydrophobicContact CG1-CE1 3.83Å; V670-I693 HydrophobicContact CG1-CD1 4.32Å; V670-G861 WeakPolarHBondContact CG2-O 3.47Å; V670-I863 HydrophobicContact CG1-CD1 4.01Å; V670-I863 HydrophobicContact CG1-CG1 4.34Å
671	S	95.4	Very high	89.9	Confident	50 Å²	50	54.7 Å²	54.7	35%	0.35	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	118.2	-177.6	-76.5	0	0	0	0	112.9	F653 N655 D669	F653-S671 VanDerWaalsContact O-CA 3.3Å; F653-S671 WeakPolarHBondContact O-CA 3.35Å; N655-S671 WeakPolarHBondContact CA-OG 3.38Å; N655-S671 PolarHBondContact N-OG 3.42Å; N655-S671 PolarHBondContact OD1-OG 2.94Å; D669-S671 PolarHBondContact O-N 2.94Å
672	F	95.9	Very high	90.7	Very high	5 Å²	5	52.4 Å²	52.4	2%	0.022	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	164.1	174.3	66.7	-85.7	0	0	0	113.1	F653 V670 V674 L680 I693 L856 I863	F653-F672 HydrophobicContact CB-CD1 3.86Å; F653-F672 HydrophobicContact CB-CE1 3.76Å; F653-F672 HydrophobicContact CB-CG 4.46Å; F653-F672 HydrophobicContact CB-CZ 4.27Å; F653-F672 AromaticContact CD1-CE1 3.88Å; F653-F672 HydrophobicContact CD1-CE1 3.88Å; F653-F672 HydrophobicContact CD1-CZ 4.21Å; F653-F672 AromaticContact CD2-CE1 3.77Å; F653-F672 HydrophobicContact CD2-CE1 3.77Å; F653-F672 AromaticContact CD2-CE2 3.9Å; F653-F672 HydrophobicContact CD2-CE2 3.9Å; F653-F672 AromaticContact CD2-CZ 3.4Å; F653-F672 HydrophobicContact CD2-CZ 3.4Å; F653-F672 VanDerWaalsContact CD2-CZ 3.4Å; F653-F672 HydrophobicContact CE1-CE1 4.46Å; F653-F672 HydrophobicContact CE1-CZ 4.47Å; F653-F672 HydrophobicContact CE2-CE1 4.36Å; F653-F672 HydrophobicContact CE2-CE2 4.33Å; F653-F672 AromaticContact CE2-CZ 3.72Å; F653-F672 HydrophobicContact CE2-CZ 3.72Å; F653-F672 HydrophobicContact CG-CD1 4.16Å; F653-F672 AromaticContact CG-CE1 3.52Å; F653-F672 HydrophobicContact CG-CE1 3.52Å; F653-F672 HydrophobicContact CG-CE2 4.46Å; F653-F672 AromaticContact CG-CZ 3.7Å; F653-F672 HydrophobicContact CG-CZ 3.7Å; F653-F672 HydrophobicContact CZ-CZ 4.26Å; F653-F672 PolarHBondContact N-O 2.87Å; F653-F672 PolarHBondContact O-N 3.24Å; V670-F672 HydrophobicContact CG1-CD1 3.89Å; V670-F672 HydrophobicContact CG1-CE1 3.83Å; F672-V674 HydrophobicContact CD2-CG2 4.03Å; F672-V674 HydrophobicContact CE2-CG2 3.9Å; F672-L680 HydrophobicContact CD2-CD2 3.79Å; F672-L680 HydrophobicContact CE2-CD2 3.5Å; F672-L680 VanDerWaalsContact CE2-CD2 3.5Å; F672-L680 HydrophobicContact CZ-CD2 4.34Å; F672-I693 HydrophobicContact CE1-CD1 4.35Å; F672-I693 HydrophobicContact CE1-CG2 4.33Å; F672-I693 HydrophobicContact CZ-CG2 3.88Å; F672-L856 HydrophobicContact CB-CD1 3.86Å; F672-L856 HydrophobicContact CD1-CD1 4.09Å; F672-L856 HydrophobicContact CD2-CD1 3.99Å; F672-L856 HydrophobicContact CG-CD1 3.71Å; F672-I863 HydrophobicContact CB-CD1 4.2Å; F672-I863 HydrophobicContact CD1-CD1 3.93Å; F672-I863 HydrophobicContact CG-CD1 4.47Å
673	T	96.1	Very high	91.6	Very high	43 Å²	43	44.7 Å²	44.7	26%	0.264	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.3	175.6	-49.5	0	0	0	0	109.9	R650 I651 E652 M675	R650-T673 HydrophobicContact CG-CG2 4.2Å; I651-T673 CarbonylContact O-C 3.54Å; I651-T673 WeakPolarHBondContact O-CA 3.42Å; E652-T673 HydrophobicContact CG-CG2 3.91Å; T673-M675 HydrophobicContact CG2-SD 4.37Å
674	V	96.1	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126.2	169.3	-166.7	0	0	0	0	108.4	R650 I651 F672 Q678 L680 T838 I840	R650-V674 WeakPolarHBondContact CA-O 3.45Å; I651-V674 HydrophobicContact CB-CB 4.21Å; I651-V674 HydrophobicContact CB-CG2 4.41Å; I651-V674 PolarHBondContact N-O 3.11Å; I651-V674 PolarHBondContact O-N 2.94Å; F672-V674 HydrophobicContact CD2-CG2 4.03Å; F672-V674 HydrophobicContact CE2-CG2 3.9Å; V674-Q678 HydrophobicContact CG1-CB 4.08Å; V674-L680 HydrophobicContact CG1-CB 4.12Å; V674-L680 HydrophobicContact CG2-CB 4Å; V674-L680 HydrophobicContact CG2-CD2 3.58Å; V674-L680 HydrophobicContact CG2-CG 4.24Å; V674-T838 HydrophobicContact CB-CG2 4.3Å; V674-T838 HydrophobicContact CG1-CG2 3.62Å; V674-I840 HydrophobicContact CG2-CD1 4.28Å
675	M	95.1	Very high	92.9	Very high	98 Å²	98	34 Å²	34	48%	0.483	20%	0.199	S	C	.	.			trans	-80.7	154.8	179.2	-63.7	-61.6	-72.8	0	0	111.4	T673 G677 Q678	T673-M675 HydrophobicContact CG2-SD 4.37Å; M675-G677 PolarHBondContact O-N 3.42Å; M675-Q678 HydrophobicContact CB-CB 4.17Å; M675-Q678 WeakPolarHBondContact O-CB 3.35Å; M675-Q678 PolarHBondContact O-N 2.9Å
676	P	93.8	Very high	92.8	Very high	54 Å²	54	34.4 Å²	34.4	35%	0.351	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	125.2	172.7	-34	40.6	0	0	0	113.4	K648 R650 Q678	K648-P676 HydrophobicContact CB-CB 3.97Å; K648-P676 HydrophobicContact CB-CG 3.51Å; K648-P676 HydrophobicContact CD-CG 4.41Å; K648-P676 WeakPolarHBondContact O-CB 3.21Å; R650-P676 HydrophobicContact CB-CG 4.25Å; P676-Q678 PolarHBondContact O-N 3.26Å
677	G	90.1	Very high	92.4	Very high	38 Å²	38	36.8 Å²	36.8	39%	0.392	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	2.4	178.4	0	0	0	0	0	115.5	M675 T838	M675-G677 PolarHBondContact O-N 3.42Å; G677-T838 PolarHBondContact N-OG1 3.03Å; G677-T838 VanDerWaalsContact N-OG1 3.08Å
678	Q	93.6	Very high	92	Very high	29 Å²	29	37 Å²	37	14%	0.136	24%	0.244	C	C	.	.			trans	-77.1	144.6	177.9	-169.6	-176.7	3.5	0	0	111	V674 M675 P676 T839 D853	V674-Q678 HydrophobicContact CG1-CB 4.08Å; M675-Q678 HydrophobicContact CB-CB 4.17Å; M675-Q678 WeakPolarHBondContact O-CB 3.35Å; M675-Q678 PolarHBondContact O-N 2.9Å; P676-Q678 PolarHBondContact O-N 3.26Å; Q678-T839 PolarHBondContact O-N 3.02Å; Q678-D853 HydrophobicContact CG-CB 3.49Å; Q678-D853 VanDerWaalsContact CG-CB 3.49Å
679	T	94.5	Very high	91.8	Very high	39 Å²	39	33.6 Å²	33.6	24%	0.239	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	111.2	167.1	-58.1	0	0	0	0	110.9	T839 V841 A852 D853 Q854	T679-T839 WeakPolarHBondContact CA-O 3.17Å; T679-T839 HydrophobicContact CG2-CG2 4.35Å; T679-V841 HydrophobicContact CG2-CG2 4.12Å; T679-A852 HydrophobicContact CG2-CB 4.27Å; T679-D853 PolarHBondContact N-OD2 3.47Å; T679-D853 PolarHBondContact O-N 3.27Å; T679-D853 VanDerWaalsContact O-N 3.08Å; T679-Q854 PolarHBondContact O-N 3.16Å
680	L	95.8	Very high	91.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.9	171.4	-175.5	76.1	0	0	0	110.4	F672 V674 L682 T839 I840 V841 Q854 L856	F672-L680 HydrophobicContact CD2-CD2 3.79Å; F672-L680 HydrophobicContact CE2-CD2 3.5Å; F672-L680 VanDerWaalsContact CE2-CD2 3.5Å; F672-L680 HydrophobicContact CZ-CD2 4.34Å; V674-L680 HydrophobicContact CG1-CB 4.12Å; V674-L680 HydrophobicContact CG2-CB 4Å; V674-L680 HydrophobicContact CG2-CD2 3.58Å; V674-L680 HydrophobicContact CG2-CG 4.24Å; L680-L682 HydrophobicContact CD2-CD2 3.82Å; L680-L682 HydrophobicContact CG-CD2 4.29Å; L680-T839 PolarHBondContact N-O 3.08Å; L680-I840 HydrophobicContact CB-CG1 4.38Å; L680-I840 HydrophobicContact CD2-CG2 4.28Å; L680-I840 CarbonylContact O-C 2.94Å; L680-I840 WeakPolarHBondContact O-CA 3.3Å; L680-V841 PolarHBondContact O-N 3.49Å; L680-Q854 WeakPolarHBondContact CA-O 3.42Å; L680-Q854 HydrophobicContact CD1-CB 4.04Å; L680-Q854 HydrophobicContact CD1-CG 3.95Å; L680-Q854 VanDerWaalsContact CD1-NE2 3.26Å; L680-L856 HydrophobicContact CD1-CD1 3.93Å; L680-L856 HydrophobicContact CD1-CG 3.93Å; L680-L856 HydrophobicContact CD2-CD1 4.03Å; L680-L856 HydrophobicContact CG-CD1 4.45Å
681	A	94.9	Very high	91.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	137.2	170	0	0	0	0	0	111.9	V841 V849 A852 Q854 I855 L856	A681-V841 CarbonylContact C-O 3.59Å; A681-V841 WeakPolarHBondContact CA-O 3.42Å; A681-V849 HydrophobicContact CB-CB 3.57Å; A681-V849 HydrophobicContact CB-CG1 3.47Å; A681-V849 VanDerWaalsContact CB-CG1 3.47Å; A681-V849 HydrophobicContact CB-CG2 4.35Å; A681-A852 HydrophobicContact CB-CB 3.62Å; A681-Q854 PolarHBondContact N-O 3.21Å; A681-I855 HydrophobicContact CB-CB 4.37Å; A681-I855 HydrophobicContact CB-CG1 3.85Å; A681-I855 HydrophobicContact CB-CG2 4.47Å; A681-I855 CarbonylContact O-C 3.57Å; A681-I855 WeakPolarHBondContact O-CA 3.36Å; A681-L856 PolarHBondContact O-N 3.41Å
682	L	94.8	Very high	91.4	Very high	0 Å²	0	29 Å²	29	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.7	173.8	-57.7	-177.6	0	0	0	108.8	L680 I693 I840 V841 V842 A843 L856 I858	L680-L682 HydrophobicContact CD2-CD2 3.82Å; L680-L682 HydrophobicContact CG-CD2 4.29Å; L682-I693 HydrophobicContact CD1-CB 4.14Å; L682-I693 HydrophobicContact CD1-CD1 4.14Å; L682-I693 HydrophobicContact CD1-CG2 3.98Å; L682-I840 HydrophobicContact CD1-CG2 3.84Å; L682-I840 HydrophobicContact CG-CG2 4.03Å; L682-V841 PolarHBondContact N-O 3.48Å; L682-V842 HydrophobicContact CB-CG2 4.05Å; L682-V842 HydrophobicContact CD1-CG2 3.95Å; L682-V842 HydrophobicContact CG-CG2 4.49Å; L682-A843 PolarHBondContact O-N 3.49Å; L682-A843 VanDerWaalsContact O-N 3.15Å; L682-L856 HydrophobicContact CD2-CB 4Å; L682-L856 HydrophobicContact CD2-CD1 3.97Å; L682-L856 HydrophobicContact CD2-CG 4.44Å; L682-I858 HydrophobicContact CB-CD1 4.44Å; L682-I858 HydrophobicContact CD2-CD1 4.15Å
683	V	93.4	Very high	91.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	166.5	-178.1	-58.2	0	0	0	0	111	A843 L846 V849 I855 L856 V857 I858 Y879 M882	V683-A843 HydrophobicContact CG1-CB 4.45Å; V683-L846 HydrophobicContact CB-CD2 3.88Å; V683-L846 HydrophobicContact CG1-CD2 3.66Å; V683-L846 HydrophobicContact CG2-CD2 4.34Å; V683-V849 HydrophobicContact CG1-CG2 3.85Å; V683-I855 HydrophobicContact CG1-CG2 4.3Å; V683-I855 HydrophobicContact CG2-CG2 3.55Å; V683-L856 PolarHBondContact N-O 3.25Å; V683-V857 HydrophobicContact CG2-CB 4.34Å; V683-V857 HydrophobicContact CG2-CG2 3.83Å; V683-V857 WeakPolarHBondContact O-CA 3.21Å; V683-I858 PolarHBondContact O-N 3.44Å; V683-Y879 HydrophobicContact CG2-CD2 4Å; V683-Y879 HydrophobicContact CG2-CE2 4.18Å; V683-M882 HydrophobicContact CG2-CE 4.27Å
684	G	90.6	Very high	91.3	Very high	11 Å²	11	27 Å²	27	11%	0.113	19%	0.191	C	C	.	.			trans	138.8	173.2	-177	0	0	0	0	0	112.3	K690 I858	G684-K690 PolarHBondContact O-NZ 3.43Å; G684-I858 WeakPolarHBondContact CA-O 3.34Å
685	P	85.4	Confident	91.1	Very high	59 Å²	59	31.1 Å²	31.1	38%	0.383	21%	0.206	S	C	.	.	S	Bend	trans	-60.9	162.7	-176.2	22.2	-31.5	0	0	0	113.6	G687 A688 K690 K859	P685-G687 PolarHBondContact O-N 3.31Å; P685-A688 HydrophobicContact CG-CB 4.2Å; P685-A688 VanDerWaalsContact O-CB 3.23Å; P685-A688 WeakPolarHBondContact O-CB 3.3Å; P685-A688 PolarHBondContact O-N 3.34Å; P685-K690 PolarHBondContact O-NZ 2.82Å; P685-K690 VanDerWaalsContact O-NZ 3.11Å; P685-K859 HydrophobicContact CG-CG 4.45Å
686	S	82.9	Confident	91.1	Very high	96 Å²	96	26.5 Å²	26.5	67%	0.671	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	135.4	172.9	-63.9	0	0	0	0	110.6	A688	S686-A688 VanDerWaalsContact C-N 3.35Å
687	G	81.4	Confident	91.2	Very high	78 Å²	78	23.9 Å²	23.9	80%	0.804	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	-3.9	-175.8	0	0	0	0	0	116	P685 G689	P685-G687 PolarHBondContact O-N 3.31Å; G687-G689 PolarHBondContact O-N 2.76Å
688	A	84.8	Confident	91.4	Very high	6 Å²	6	23.4 Å²	23.4	5%	0.05	15%	0.154	C	C	.	.	S	Bend	trans	-67.8	2.3	-178.7	0	0	0	0	0	116.2	P685 S686 I858	P685-A688 HydrophobicContact CG-CB 4.2Å; P685-A688 VanDerWaalsContact O-CB 3.23Å; P685-A688 WeakPolarHBondContact O-CB 3.3Å; P685-A688 PolarHBondContact O-N 3.34Å; S686-A688 VanDerWaalsContact C-N 3.35Å; A688-I858 HydrophobicContact CB-CG2 4.37Å; A688-I858 WeakPolarHBondContact CB-O 3.39Å; A688-I858 WeakPolarHBondContact O-CG2 3.47Å
689	G	87	Confident	91.4	Very high	6 Å²	6	22.2 Å²	22.2	6%	0.062	15%	0.148	C	C	.	.	S	Bend	trans	93.9	2.6	177.9	0	0	0	0	0	116.4	G687 S691 T692 I693	G687-G689 PolarHBondContact O-N 2.76Å; G689-S691 PolarHBondContact O-N 2.99Å; G689-T692 WeakPolarHBondContact O-CA 3.39Å; G689-T692 WeakPolarHBondContact O-CB 3.41Å; G689-T692 PolarHBondContact O-N 3.24Å; G689-I693 PolarHBondContact O-N 3.41Å
690	K	91.2	Very high	91.3	Very high	9 Å²	9	24 Å²	24	4%	0.039	15%	0.153	C	C	.	.	H	α-helix	trans	-49.2	-58.9	-176.1	-51.1	-171.8	-63.2	-87.2	0	114	G684 P685 T692 I693 V842	G684-K690 PolarHBondContact O-NZ 3.43Å; P685-K690 PolarHBondContact O-NZ 2.82Å; P685-K690 VanDerWaalsContact O-NZ 3.11Å; K690-T692 PolarHBondContact O-N 3.15Å; K690-I693 WeakPolarHBondContact O-CB 3.36Å; K690-I693 PolarHBondContact O-N 2.77Å; K690-V842 HydrophobicContact CB-CG1 3.63Å; K690-V842 HydrophobicContact CB-CG2 4.07Å; K690-V842 HydrophobicContact CD-CG1 4.13Å
691	S	90.4	Very high	91.1	Very high	28 Å²	28	24.2 Å²	24.2	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-70.1	-15.8	179.6	-44.3	0	0	0	0	113.4	G689 L694 R695 D812	G689-S691 PolarHBondContact O-N 2.99Å; S691-L694 PolarHBondContact O-N 3.21Å; S691-R695 WeakPolarHBondContact O-CD 3.41Å; S691-R695 VanDerWaalsContact O-CG 3.27Å; S691-R695 WeakPolarHBondContact O-CG 3.44Å; S691-R695 PolarHBondContact O-N 3.38Å; S691-R695 VanDerWaalsContact O-N 3.09Å; S691-D812 WeakPolarHBondContact CB-OD1 3.47Å; S691-D812 PolarHBondContact OG-OD1 3.37Å
692	T	92.2	Very high	90.8	Very high	9 Å²	9	27 Å²	27	6%	0.055	17%	0.168	C	C	.	.	H	α-helix	trans	-66.6	-37.5	171.3	-52.2	0	0	0	0	111.1	F658 Y660 T666 L667 G689 K690 L694 R695 L696	F658-T692 HydrophobicContact CD1-CG2 3.42Å; F658-T692 VanDerWaalsContact CD1-CG2 3.42Å; F658-T692 HydrophobicContact CE1-CG2 3.53Å; F658-T692 HydrophobicContact CG-CG2 4.47Å; Y660-T692 HydrophobicContact CE2-CG2 3.93Å; Y660-T692 WeakPolarHBondContact CE2-OG1 3.36Å; Y660-T692 PolarHBondContact OH-OG1 3.02Å; T666-T692 HydrophobicContact CG2-CG2 4.41Å; L667-T692 HydrophobicContact CD1-CG2 4.05Å; L667-T692 HydrophobicContact CG-CG2 4.39Å; G689-T692 WeakPolarHBondContact O-CA 3.39Å; G689-T692 WeakPolarHBondContact O-CB 3.41Å; G689-T692 PolarHBondContact O-N 3.24Å; K690-T692 PolarHBondContact O-N 3.15Å; T692-L694 VanDerWaalsContact C-N 3.33Å; T692-L694 PolarHBondContact O-N 3.23Å; T692-R695 PolarHBondContact O-N 2.68Å; T692-L696 HydrophobicContact CG2-CD1 4.23Å; T692-L696 HydrophobicContact CG2-CG 4.41Å; T692-L696 WeakPolarHBondContact O-CG 3.08Å; T692-L696 PolarHBondContact O-N 3.09Å
693	I	94.3	Very high	90.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-43.6	174.9	-67.4	172.9	0	0	0	110.8	F653 L667 V670 F672 L682 G689 K690 R695 L696 L697 I858	F653-I693 HydrophobicContact CE1-CG2 3.96Å; F653-I693 HydrophobicContact CE2-CG2 4.38Å; F653-I693 HydrophobicContact CZ-CG2 3.74Å; L667-I693 HydrophobicContact CD1-CG1 3.78Å; L667-I693 HydrophobicContact CD2-CD1 4.33Å; L667-I693 HydrophobicContact CD2-CG1 4.05Å; V670-I693 HydrophobicContact CG1-CD1 4.32Å; F672-I693 HydrophobicContact CE1-CD1 4.35Å; F672-I693 HydrophobicContact CE1-CG2 4.33Å; F672-I693 HydrophobicContact CZ-CG2 3.88Å; L682-I693 HydrophobicContact CD1-CB 4.14Å; L682-I693 HydrophobicContact CD1-CD1 4.14Å; L682-I693 HydrophobicContact CD1-CG2 3.98Å; G689-I693 PolarHBondContact O-N 3.41Å; K690-I693 WeakPolarHBondContact O-CB 3.36Å; K690-I693 PolarHBondContact O-N 2.77Å; I693-R695 VanDerWaalsContact C-N 3.35Å; I693-R695 PolarHBondContact O-N 3.39Å; I693-L696 PolarHBondContact O-N 2.98Å; I693-L697 WeakPolarHBondContact O-CB 3.4Å; I693-L697 PolarHBondContact O-N 3.04Å; I693-I858 HydrophobicContact CD1-CD1 3.39Å
694	L	94.3	Very high	90.5	Very high	7 Å²	7	32.9 Å²	32.9	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-41.9	175.8	-57.7	-172.6	0	0	0	111.8	S691 T692 L697 F698 L810 D812 I840 V842	S691-L694 PolarHBondContact O-N 3.21Å; T692-L694 VanDerWaalsContact C-N 3.33Å; T692-L694 PolarHBondContact O-N 3.23Å; L694-L697 PolarHBondContact O-N 3.42Å; L694-F698 WeakPolarHBondContact O-CB 3.16Å; L694-F698 PolarHBondContact O-N 3.35Å; L694-L810 HydrophobicContact CB-CD1 4.33Å; L694-L810 HydrophobicContact CD1-CB 4.5Å; L694-L810 HydrophobicContact CD2-CB 4.13Å; L694-L810 HydrophobicContact CD2-CD1 4.3Å; L694-L810 HydrophobicContact CD2-CD2 4.08Å; L694-L810 HydrophobicContact CD2-CG 4.38Å; L694-D812 HydrophobicContact CD1-CB 3.64Å; L694-I840 HydrophobicContact CD2-CB 4.24Å; L694-I840 HydrophobicContact CD2-CG2 3.77Å; L694-V842 HydrophobicContact CD1-CB 4.24Å; L694-V842 HydrophobicContact CD1-CG2 3.57Å; L694-V842 HydrophobicContact CD2-CG2 4.19Å; L694-V842 HydrophobicContact CG-CG2 3.76Å
695	R	93.2	Very high	90.5	Very high	86 Å²	86	35.1 Å²	35.1	33%	0.325	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-36.9	178.2	-69.8	165.2	-174.6	-174.8	-0.4	112.8	Y660 S691 T692 I693 R699 F700 Y701	Y660-R695 WeakPolarHBondContact OH-CD 3.44Å; Y660-R695 PolarHBondContact OH-NH1 3.38Å; Y660-R695 VanDerWaalsContact OH-NH1 3.09Å; S691-R695 WeakPolarHBondContact O-CD 3.41Å; S691-R695 VanDerWaalsContact O-CG 3.27Å; S691-R695 WeakPolarHBondContact O-CG 3.44Å; S691-R695 PolarHBondContact O-N 3.38Å; S691-R695 VanDerWaalsContact O-N 3.09Å; T692-R695 PolarHBondContact O-N 2.68Å; I693-R695 VanDerWaalsContact C-N 3.35Å; I693-R695 PolarHBondContact O-N 3.39Å; R695-R699 PolarHBondContact O-N 3.42Å; R695-F700 HydrophobicContact CB-CB 4.44Å; R695-F700 HydrophobicContact CB-CD2 4.39Å; R695-F700 HydrophobicContact CG-CD2 4.35Å; R695-F700 PolarHBondContact O-N 2.9Å; R695-Y701 HydrophobicContact CB-CD2 4.13Å; R695-Y701 HydrophobicContact CB-CE2 4.12Å
696	L	94.6	Very high	90.9	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-70.4	-41.8	174.5	-71.4	172.9	0	0	0	112	V656 F658 L667 T692 I693 F698 R699 I703 I708 I715	V656-L696 HydrophobicContact CG1-CD1 4.32Å; F658-L696 HydrophobicContact CB-CD1 3.92Å; F658-L696 HydrophobicContact CD1-CD1 4.33Å; F658-L696 HydrophobicContact CD2-CD1 4.49Å; F658-L696 HydrophobicContact CD2-CD2 3.77Å; F658-L696 HydrophobicContact CE2-CD2 4.03Å; F658-L696 HydrophobicContact CG-CD1 3.98Å; F658-L696 HydrophobicContact CG-CD2 4.07Å; F658-L696 HydrophobicContact CG-CG 4.49Å; L667-L696 HydrophobicContact CD1-CD1 3.55Å; T692-L696 HydrophobicContact CG2-CD1 4.23Å; T692-L696 HydrophobicContact CG2-CG 4.41Å; T692-L696 WeakPolarHBondContact O-CG 3.08Å; T692-L696 PolarHBondContact O-N 3.09Å; I693-L696 PolarHBondContact O-N 2.98Å; L696-F698 VanDerWaalsContact C-N 3.32Å; L696-F698 PolarHBondContact O-N 2.91Å; L696-R699 VanDerWaalsContact O-CA 3.27Å; L696-R699 WeakPolarHBondContact O-CA 3.41Å; L696-R699 PolarHBondContact O-N 3.03Å; L696-I703 HydrophobicContact CD1-CG2 4.27Å; L696-I703 HydrophobicContact CD2-CG2 3.9Å; L696-I708 HydrophobicContact CB-CD1 3.87Å; L696-I715 WeakPolarHBondContact O-CD1 3.29Å
697	L	95.3	Very high	91.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-35.3	176.3	-177	59.1	0	0	0	112.6	I651 F653 I693 L694 R699 I708 I710 L810 I840	I651-L697 HydrophobicContact CD1-CD2 4.08Å; I651-L697 HydrophobicContact CG2-CD1 3.79Å; I651-L697 HydrophobicContact CG2-CD2 4.35Å; F653-L697 HydrophobicContact CE2-CD1 4.37Å; F653-L697 HydrophobicContact CZ-CB 4.22Å; I693-L697 WeakPolarHBondContact O-CB 3.4Å; I693-L697 PolarHBondContact O-N 3.04Å; L694-L697 PolarHBondContact O-N 3.42Å; L697-R699 PolarHBondContact O-N 3.46Å; L697-I708 HydrophobicContact CD1-CG2 4.22Å; L697-I710 HydrophobicContact CD1-CD1 4.02Å; L697-I710 HydrophobicContact CD1-CG1 4.35Å; L697-L810 HydrophobicContact CD2-CD1 4.27Å; L697-L810 HydrophobicContact CD2-CD2 3.64Å; L697-I840 HydrophobicContact CD2-CD1 3.61Å
698	F	94.6	Very high	92.2	Very high	28 Å²	28	26.7 Å²	26.7	12%	0.123	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-0.7	170.8	-156.3	-100.4	0	0	0	113.5	L694 L696 F700 R724 I727 V729	L694-F698 WeakPolarHBondContact O-CB 3.16Å; L694-F698 PolarHBondContact O-N 3.35Å; L696-F698 VanDerWaalsContact C-N 3.32Å; L696-F698 PolarHBondContact O-N 2.91Å; F698-F700 HydrophobicContact CB-CD2 4.17Å; F698-F700 HydrophobicContact CB-CE2 4.3Å; F698-F700 HydrophobicContact CD1-CD1 4.39Å; F698-F700 AromaticContact CD1-CD2 3.77Å; F698-F700 HydrophobicContact CD1-CD2 3.77Å; F698-F700 AromaticContact CD1-CE1 4Å; F698-F700 HydrophobicContact CD1-CE1 4Å; F698-F700 AromaticContact CD1-CE2 3.32Å; F698-F700 HydrophobicContact CD1-CE2 3.32Å; F698-F700 HydrophobicContact CD1-CG 4.29Å; F698-F700 AromaticContact CD1-CZ 3.45Å; F698-F700 HydrophobicContact CD1-CZ 3.45Å; F698-F700 VanDerWaalsContact CD1-CZ 3.45Å; F698-F700 HydrophobicContact CE1-CE1 4.14Å; F698-F700 AromaticContact CE1-CE2 3.93Å; F698-F700 HydrophobicContact CE1-CE2 3.93Å; F698-F700 AromaticContact CE1-CZ 3.6Å; F698-F700 HydrophobicContact CE1-CZ 3.6Å; F698-F700 HydrophobicContact CG-CD2 4.39Å; F698-F700 HydrophobicContact CG-CE2 4.09Å; F698-F700 PolarHBondContact O-N 3.25Å; F698-R724 HydrophobicContact CD1-CG 4.01Å; F698-R724 HydrophobicContact CD2-CG 4.3Å; F698-R724 HydrophobicContact CE1-CB 4.29Å; F698-R724 VanDerWaalsContact CE1-CD 3.46Å; F698-R724 HydrophobicContact CE1-CG 3.66Å; F698-R724 HydrophobicContact CE2-CB 4.05Å; F698-R724 HydrophobicContact CE2-CG 3.96Å; F698-R724 HydrophobicContact CG-CG 4.33Å; F698-R724 HydrophobicContact CZ-CB 3.78Å; F698-R724 HydrophobicContact CZ-CG 3.63Å; F698-R724 PolarHBondContact O-NE 3.12Å; F698-R724 VanDerWaalsContact O-NE 3.09Å; F698-I727 HydrophobicContact CD2-CB 4Å; F698-I727 HydrophobicContact CD2-CD1 4.4Å; F698-I727 HydrophobicContact CD2-CG2 3.74Å; F698-I727 HydrophobicContact CE2-CB 4.1Å; F698-I727 HydrophobicContact CE2-CG2 4.14Å; F698-V729 HydrophobicContact CD2-CG2 3.81Å; F698-V729 HydrophobicContact CE2-CG2 3.89Å
699	R	94.1	Very high	92.8	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.015	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	50	-177.6	-156.8	180	168.7	-149.4	-18.3	112.8	V635 K636 R695 L696 L697 Y701 D702 I715 S716 V718 L723 R724	V635-R699 HydrophobicContact CG1-CG 3.93Å; K636-R699 PolarHBondContact O-NH2 2.69Å; R695-R699 PolarHBondContact O-N 3.42Å; L696-R699 VanDerWaalsContact O-CA 3.27Å; L696-R699 WeakPolarHBondContact O-CA 3.41Å; L696-R699 PolarHBondContact O-N 3.03Å; L697-R699 PolarHBondContact O-N 3.46Å; R699-Y701 VanDerWaalsContact C-N 3.29Å; R699-D702 IonicContact CZ-OD1 3.42Å; R699-D702 IonicContact NE-OD1 3.92Å; R699-D702 PolarHBondContact NE-OD1 3.19Å; R699-D702 IonicContact NE-OD2 3.85Å; R699-D702 IonicContact NH2-OD1 3.47Å; R699-D702 PolarHBondContact NH2-OD1 2.87Å; R699-D702 IonicContact NH2-OD2 2.73Å; R699-D702 PolarHBondContact NH2-OD2 3.39Å; R699-I715 HydrophobicContact CB-CD1 4.35Å; R699-I715 WeakPolarHBondContact CD-O 3.19Å; R699-I715 HydrophobicContact CG-CD1 4.48Å; R699-I715 PolarHBondContact NH1-O 3.22Å; R699-I715 VanDerWaalsContact NH1-O 3.16Å; R699-S716 PolarHBondContact NH1-O 3.44Å; R699-V718 PolarHBondContact NH1-O 2.96Å; R699-L723 HydrophobicContact CB-CD2 3.69Å; R699-R724 PolarHBondContact O-NH2 3.08Å
700	F	92	Very high	93.2	Very high	75 Å²	75	29.5 Å²	29.5	33%	0.329	16%	0.163	S	C	.	.	S	Bend	trans	-77	-19.6	166.6	-80.4	-56.4	0	0	0	112.8	L419 R695 F698	L419-F700 HydrophobicContact CB-CD1 4.41Å; L419-F700 HydrophobicContact CD2-CB 4.36Å; L419-F700 HydrophobicContact CD2-CD1 4.47Å; L419-F700 HydrophobicContact CD2-CD2 4.34Å; L419-F700 HydrophobicContact CD2-CG 4.18Å; R695-F700 HydrophobicContact CB-CB 4.44Å; R695-F700 HydrophobicContact CB-CD2 4.39Å; R695-F700 HydrophobicContact CG-CD2 4.35Å; R695-F700 PolarHBondContact O-N 2.9Å; F698-F700 HydrophobicContact CB-CD2 4.17Å; F698-F700 HydrophobicContact CB-CE2 4.3Å; F698-F700 HydrophobicContact CD1-CD1 4.39Å; F698-F700 AromaticContact CD1-CD2 3.77Å; F698-F700 HydrophobicContact CD1-CD2 3.77Å; F698-F700 AromaticContact CD1-CE1 4Å; F698-F700 HydrophobicContact CD1-CE1 4Å; F698-F700 AromaticContact CD1-CE2 3.32Å; F698-F700 HydrophobicContact CD1-CE2 3.32Å; F698-F700 HydrophobicContact CD1-CG 4.29Å; F698-F700 AromaticContact CD1-CZ 3.45Å; F698-F700 HydrophobicContact CD1-CZ 3.45Å; F698-F700 VanDerWaalsContact CD1-CZ 3.45Å; F698-F700 HydrophobicContact CE1-CE1 4.14Å; F698-F700 AromaticContact CE1-CE2 3.93Å; F698-F700 HydrophobicContact CE1-CE2 3.93Å; F698-F700 AromaticContact CE1-CZ 3.6Å; F698-F700 HydrophobicContact CE1-CZ 3.6Å; F698-F700 HydrophobicContact CG-CD2 4.39Å; F698-F700 HydrophobicContact CG-CE2 4.09Å; F698-F700 PolarHBondContact O-N 3.25Å
701	Y	91.7	Very high	93.4	Very high	6 Å²	6	30.4 Å²	30.4	2%	0.024	17%	0.169	C	C	.	.	S	Bend	trans	-138.5	150.1	174.6	-52.2	-98.8	0	0	0	107.1	L419 R420 F658 Y660 R695 R699	L419-Y701 HydrophobicContact CB-CE2 4.46Å; L419-Y701 HydrophobicContact CD2-CE2 4.16Å; R420-Y701 HydrophobicContact CB-CE1 3.95Å; F658-Y701 HydrophobicContact CE2-CD1 4.35Å; F658-Y701 HydrophobicContact CE2-CG 4.13Å; F658-Y701 AromaticContact CZ-CD1 3.87Å; F658-Y701 HydrophobicContact CZ-CD1 3.87Å; F658-Y701 HydrophobicContact CZ-CD2 4.42Å; F658-Y701 AromaticContact CZ-CG 3.78Å; F658-Y701 HydrophobicContact CZ-CG 3.78Å; Y660-Y701 HydrophobicContact CD1-CD1 4.43Å; Y660-Y701 AromaticContact CD1-CE1 3.87Å; Y660-Y701 HydrophobicContact CD1-CE1 3.87Å; Y660-Y701 HydrophobicContact CE1-CD1 4.47Å; Y660-Y701 HydrophobicContact CE1-CD2 4.42Å; Y660-Y701 AromaticContact CE1-CE1 3.87Å; Y660-Y701 HydrophobicContact CE1-CE1 3.87Å; Y660-Y701 AromaticContact CE1-CE2 3.87Å; Y660-Y701 HydrophobicContact CE1-CE2 3.87Å; Y660-Y701 AromaticContact CE1-CZ 3.57Å; R695-Y701 HydrophobicContact CB-CD2 4.13Å; R695-Y701 HydrophobicContact CB-CE2 4.12Å; R699-Y701 VanDerWaalsContact C-N 3.29Å
702	D	89.8	Confident	93.5	Very high	57 Å²	57	31.5 Å²	31.5	31%	0.305	18%	0.184	S	C	.	.			trans	-89.1	156.9	166.1	-76.7	-34.7	0	0	0	109.7	R699	R699-D702 IonicContact CZ-OD1 3.42Å; R699-D702 IonicContact NE-OD1 3.92Å; R699-D702 PolarHBondContact NE-OD1 3.19Å; R699-D702 IonicContact NE-OD2 3.85Å; R699-D702 IonicContact NH2-OD1 3.47Å; R699-D702 PolarHBondContact NH2-OD1 2.87Å; R699-D702 IonicContact NH2-OD2 2.73Å; R699-D702 PolarHBondContact NH2-OD2 3.39Å
703	I	92	Very high	93.6	Very high	51 Å²	51	33.1 Å²	33.1	26%	0.262	19%	0.191	S	C	.	.			trans	-83	154.9	-176	56.4	178.2	0	0	0	112.1	V656 L696 G706 I708	V656-I703 HydrophobicContact CG1-CB 4.42Å; V656-I703 HydrophobicContact CG1-CG2 3.73Å; L696-I703 HydrophobicContact CD1-CG2 4.27Å; L696-I703 HydrophobicContact CD2-CG2 3.9Å; I703-G706 VanDerWaalsContact CD1-O 3.31Å; I703-G706 WeakPolarHBondContact CD1-O 3.49Å; I703-I708 HydrophobicContact CG2-CD1 3.77Å; I703-I708 HydrophobicContact CG2-CG1 4.44Å
704	S	89	Confident	93.7	Very high	73 Å²	73	35.2 Å²	35.2	51%	0.51	20%	0.202	S	C	.	.	S	Bend	trans	-79.6	-39.5	177	-51.1	0	0	0	0	111.9	H657	H657-S704 WeakPolarHBondContact O-CB 3.36Å; H657-S704 PolarHBondContact O-N 2.68Å
705	S	91.1	Very high	93.7	Very high	58 Å²	58	35.3 Å²	35.3	41%	0.406	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	170.5	171.3	68.9	0	0	0	0	110.6	H657	H657-S705 WeakPolarHBondContact CB-OG 3.35Å; H657-S705 PolarHBondContact CD2-OG 3.15Å; H657-S705 VanDerWaalsContact CD2-OG 3.25Å; H657-S705 PolarHBondContact N-O 3Å; H657-S705 PolarHBondContact O-N 3.48Å
706	G	93	Very high	93.7	Very high	42 Å²	42	32.6 Å²	32.6	43%	0.433	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	91.2	-162	-171.3	0	0	0	0	0	112.5	E654 N655 I703	E654-G706 CarbonylContact O-C 3.45Å; E654-G706 WeakPolarHBondContact O-CA 3.43Å; N655-G706 WeakPolarHBondContact O-CA 3.39Å; I703-G706 VanDerWaalsContact CD1-O 3.31Å; I703-G706 WeakPolarHBondContact CD1-O 3.49Å
707	C	94.9	Very high	93.6	Very high	13 Å²	13	37.7 Å²	37.7	9%	0.088	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	156.6	166.5	73.4	0	0	0	0	112.3	E654 V656 R709	E654-C707 PolarHBondContact N-O 3.36Å; E654-C707 PolarHBondContact O-N 3.38Å; E654-C707 PolarHBondContact OE2-SG 3.31Å; V656-C707 WeakPolarHBondContact CG2-O 3.36Å; C707-R709 VanDerWaalsContact SG-CZ 3.52Å; C707-R709 PolarHBondContact SG-NH2 2.97Å
708	I	96.8	Very high	93.6	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124	172.9	-59.5	168.4	0	0	0	107.5	E652 F653 V656 L696 L697 I703 D714 I715	E652-I708 CarbonylContact O-C 3.57Å; E652-I708 VanDerWaalsContact O-CA 3.31Å; E652-I708 WeakPolarHBondContact O-CA 3.48Å; F653-I708 HydrophobicContact CD1-CD1 4.05Å; F653-I708 HydrophobicContact CD1-CG1 3.85Å; F653-I708 HydrophobicContact CD2-CG2 4.15Å; F653-I708 HydrophobicContact CE1-CD1 3.49Å; F653-I708 VanDerWaalsContact CE1-CD1 3.49Å; F653-I708 HydrophobicContact CE1-CG1 3.78Å; F653-I708 HydrophobicContact CE2-CG1 4.47Å; F653-I708 HydrophobicContact CE2-CG2 3.81Å; F653-I708 HydrophobicContact CG-CG1 4.21Å; F653-I708 HydrophobicContact CZ-CD1 3.8Å; F653-I708 HydrophobicContact CZ-CG1 4.1Å; F653-I708 HydrophobicContact CZ-CG2 4.01Å; V656-I708 HydrophobicContact CG2-CD1 4.5Å; V656-I708 HydrophobicContact CG2-CG1 3.8Å; L696-I708 HydrophobicContact CB-CD1 3.87Å; L697-I708 HydrophobicContact CD1-CG2 4.22Å; I703-I708 HydrophobicContact CG2-CD1 3.77Å; I703-I708 HydrophobicContact CG2-CG1 4.44Å; I708-D714 WeakPolarHBondContact O-CA 3.43Å; I708-I715 HydrophobicContact CB-CD1 3.78Å; I708-I715 HydrophobicContact CB-CG1 4.01Å; I708-I715 HydrophobicContact CD1-CD1 4.15Å; I708-I715 HydrophobicContact CG2-CD1 3.74Å; I708-I715 HydrophobicContact CG2-CG1 4.25Å; I708-I715 HydrophobicContact CG2-CG2 4.33Å; I708-I715 PolarHBondContact O-N 3.07Å
709	R	96.8	Very high	93.7	Very high	70 Å²	70	38.5 Å²	38.5	26%	0.264	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.1	-178.8	-51.4	-169.7	-167.9	114.7	12.1	112.7	E652 E654 C707 Q713	E652-R709 HydrophobicContact CB-CB 4.29Å; E652-R709 PolarHBondContact N-O 2.87Å; E652-R709 PolarHBondContact O-N 3.26Å; E654-R709 IonicContact OE1-CZ 2.73Å; E654-R709 IonicContact OE1-NH1 2.75Å; E654-R709 PolarHBondContact OE1-NH1 2.85Å; E654-R709 IonicContact OE1-NH2 3.83Å; E654-R709 IonicContact OE2-CZ 3.71Å; E654-R709 IonicContact OE2-NH1 2.64Å; E654-R709 PolarHBondContact OE2-NH1 3.39Å; E654-R709 VanDerWaalsContact OE2-NH1 3.1Å; E654-R709 IonicContact OE2-NH2 3.68Å; E654-R709 PolarHBondContact OE2-NH2 3.27Å; C707-R709 VanDerWaalsContact SG-CZ 3.52Å; C707-R709 PolarHBondContact SG-NH2 2.97Å; R709-Q713 CarbonylContact C-O 3.58Å; R709-Q713 WeakPolarHBondContact CA-O 3.37Å
710	I	96.4	Very high	93.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122.9	168.3	-58.4	178.4	0	0	0	108.2	L644 R650 L697 G712 Q713 I715 L723 I808	L644-I710 HydrophobicContact CD1-CB 4.34Å; L644-I710 HydrophobicContact CD2-CD1 4.39Å; L644-I710 HydrophobicContact CD2-CG2 4.32Å; R650-I710 CarbonylContact O-C 3.48Å; R650-I710 WeakPolarHBondContact O-CA 3.38Å; L697-I710 HydrophobicContact CD1-CD1 4.02Å; L697-I710 HydrophobicContact CD1-CG1 4.35Å; I710-G712 PolarHBondContact O-N 3.43Å; I710-G712 VanDerWaalsContact O-N 3.16Å; I710-Q713 PolarHBondContact N-O 2.95Å; I710-Q713 WeakPolarHBondContact O-CB 3.38Å; I710-Q713 PolarHBondContact O-N 2.94Å; I710-I715 HydrophobicContact CD1-CG2 3.92Å; I710-I715 HydrophobicContact CG1-CG2 3.88Å; I710-L723 HydrophobicContact CD1-CD1 3.52Å; I710-I808 HydrophobicContact CD1-CD1 4.03Å; I710-I808 HydrophobicContact CG2-CD1 4.1Å
711	D	94.3	Very high	93.8	Very high	29 Å²	29	40 Å²	40	16%	0.155	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	47	41.1	-172.6	-68.5	-33.2	0	0	0	112.8	Q647 K648 G649 R650 Q713	Q647-D711 PolarHBondContact N-OD2 3.2Å; K648-D711 PolarHBondContact N-OD2 3.42Å; G649-D711 VanDerWaalsContact N-CG 3.33Å; G649-D711 PolarHBondContact N-OD1 3.08Å; G649-D711 PolarHBondContact N-OD2 3.05Å; R650-D711 PolarHBondContact N-OD1 2.86Å; R650-D711 PolarHBondContact O-N 3.43Å; D711-Q713 VanDerWaalsContact C-N 3.29Å; D711-Q713 PolarHBondContact O-N 3.49Å
712	G	93.4	Very high	93.9	Very high	50 Å²	50	40.4 Å²	40.4	52%	0.515	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-0	-179.3	0	0	0	0	0	115.9	I710	I710-G712 PolarHBondContact O-N 3.43Å; I710-G712 VanDerWaalsContact O-N 3.16Å
713	Q	95.1	Very high	94.2	Very high	44 Å²	44	37.7 Å²	37.7	21%	0.206	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128	175.5	-67.5	153.5	101.2	0	0	110.5	L644 R645 R709 I710 D711	L644-Q713 HydrophobicContact CD1-CB 4.12Å; R645-Q713 VanDerWaalsContact CB-OE1 3.31Å; R645-Q713 PolarHBondContact O-NE2 3.31Å; R709-Q713 CarbonylContact C-O 3.58Å; R709-Q713 WeakPolarHBondContact CA-O 3.37Å; I710-Q713 PolarHBondContact N-O 2.95Å; I710-Q713 WeakPolarHBondContact O-CB 3.38Å; I710-Q713 PolarHBondContact O-N 2.94Å; D711-Q713 VanDerWaalsContact C-N 3.29Å; D711-Q713 PolarHBondContact O-N 3.49Å
714	D	95	Very high	94.4	Very high	44 Å²	44	38.2 Å²	38.2	24%	0.235	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	128.8	174.4	-171.3	-40.1	0	0	0	111.1	I708 S716 Q717	I708-D714 WeakPolarHBondContact O-CA 3.43Å; D714-S716 PolarHBondContact O-N 3.46Å; D714-S716 VanDerWaalsContact OD1-CB 3.26Å; D714-S716 WeakPolarHBondContact OD1-CB 3.24Å; D714-S716 PolarHBondContact OD1-N 3.16Å; D714-S716 PolarHBondContact OD1-OG 2.84Å; D714-Q717 HydrophobicContact CB-CG 4.01Å; D714-Q717 PolarHBondContact O-N 3.01Å; D714-Q717 VanDerWaalsContact O-N 3.1Å
715	I	95.2	Very high	94.6	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.041	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.9	-177.5	68.2	172.2	0	0	0	113.5	L696 R699 I708 I710 Q717 L723	L696-I715 WeakPolarHBondContact O-CD1 3.29Å; R699-I715 HydrophobicContact CB-CD1 4.35Å; R699-I715 WeakPolarHBondContact CD-O 3.19Å; R699-I715 HydrophobicContact CG-CD1 4.48Å; R699-I715 PolarHBondContact NH1-O 3.22Å; R699-I715 VanDerWaalsContact NH1-O 3.16Å; I708-I715 HydrophobicContact CB-CD1 3.78Å; I708-I715 HydrophobicContact CB-CG1 4.01Å; I708-I715 HydrophobicContact CD1-CD1 4.15Å; I708-I715 HydrophobicContact CG2-CD1 3.74Å; I708-I715 HydrophobicContact CG2-CG1 4.25Å; I708-I715 HydrophobicContact CG2-CG2 4.33Å; I708-I715 PolarHBondContact O-N 3.07Å; I710-I715 HydrophobicContact CD1-CG2 3.92Å; I710-I715 HydrophobicContact CG1-CG2 3.88Å; I715-Q717 VanDerWaalsContact C-N 3.34Å; I715-L723 HydrophobicContact CB-CD1 4.36Å; I715-L723 HydrophobicContact CB-CD2 3.99Å; I715-L723 HydrophobicContact CG2-CD1 3.93Å; I715-L723 HydrophobicContact CG2-CD2 4.42Å
716	S	92.6	Very high	94.8	Very high	29 Å²	29	37 Å²	37	20%	0.203	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.8	173.6	66.8	0	0	0	0	113.1	R699 D714	R699-S716 PolarHBondContact NH1-O 3.44Å; D714-S716 PolarHBondContact O-N 3.46Å; D714-S716 VanDerWaalsContact OD1-CB 3.26Å; D714-S716 WeakPolarHBondContact OD1-CB 3.24Å; D714-S716 PolarHBondContact OD1-N 3.16Å; D714-S716 PolarHBondContact OD1-OG 2.84Å
717	Q	93.1	Very high	94.9	Very high	108 Å²	108	35 Å²	35	51%	0.505	20%	0.203	S	C	.	.	S	Bend	trans	-92	-5.3	-173.2	-58.2	-63.4	-32.8	0	0	113.9	L638 A641 D714 I715	L638-Q717 VanDerWaalsContact CD1-NE2 3.35Å; L638-Q717 VanDerWaalsContact CD1-OE1 3.31Å; A641-Q717 WeakPolarHBondContact CA-O 3.41Å; A641-Q717 WeakPolarHBondContact CB-O 3.44Å; D714-Q717 HydrophobicContact CB-CG 4.01Å; D714-Q717 PolarHBondContact O-N 3.01Å; D714-Q717 VanDerWaalsContact O-N 3.1Å; I715-Q717 VanDerWaalsContact C-N 3.34Å
718	V	95.1	Very high	94.9	Very high	9 Å²	9	34.4 Å²	34.4	6%	0.055	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-109.8	158.3	179.4	-59.7	0	0	0	0	111.4	G642 L644 R699 L723	G642-V718 CarbonylContact O-C 3.6Å; G642-V718 WeakPolarHBondContact O-CA 3.35Å; L644-V718 HydrophobicContact CB-CB 4.3Å; L644-V718 HydrophobicContact CB-CG1 4.29Å; L644-V718 HydrophobicContact CB-CG2 4.31Å; L644-V718 HydrophobicContact CD1-CG1 4.14Å; L644-V718 HydrophobicContact CD1-CG2 4.44Å; R699-V718 PolarHBondContact NH1-O 2.96Å; V718-L723 HydrophobicContact CG2-CB 4.28Å
719	T	95.6	Very high	94.7	Very high	36 Å²	36	36.8 Å²	36.8	22%	0.221	21%	0.214	C	C	.	.			trans	-68.8	133	178	55.9	0	0	0	0	111.8	D637 A641 G642 A721 S722 L723	D637-T719 WeakPolarHBondContact OD2-CA 3.39Å; D637-T719 WeakPolarHBondContact OD2-CB 3.37Å; A641-T719 HydrophobicContact CB-CG2 4.07Å; A641-T719 WeakPolarHBondContact O-CG2 3.33Å; G642-T719 PolarHBondContact O-N 3.38Å; G642-T719 PolarHBondContact O-OG1 3.16Å; T719-A721 PolarHBondContact O-N 3.21Å; T719-A721 VanDerWaalsContact O-N 3.17Å; T719-S722 PolarHBondContact O-N 3.07Å; T719-S722 VanDerWaalsContact O-N 3.08Å; T719-S722 PolarHBondContact O-OG 3.5Å; T719-S722 WeakPolarHBondContact OG1-CB 3.49Å; T719-S722 PolarHBondContact OG1-OG 3.06Å; T719-L723 PolarHBondContact O-N 3.41Å; T719-L723 VanDerWaalsContact O-N 3.12Å
720	Q	94.3	Very high	94.5	Very high	32 Å²	32	33.6 Å²	33.6	15%	0.15	20%	0.202	C	C	.	.	H	α-helix	trans	-54.2	-37.1	179.5	-83.5	168.6	79.6	0	0	112.9	V635 D637 R724	V635-Q720 HydrophobicContact CG1-CG 4.35Å; V635-Q720 PolarHBondContact O-NE2 3.34Å; D637-Q720 WeakPolarHBondContact OD1-CB 3.46Å; D637-Q720 WeakPolarHBondContact OD1-CG 3.3Å; D637-Q720 PolarHBondContact OD1-N 3.29Å; D637-Q720 VanDerWaalsContact OD1-N 3.13Å; D637-Q720 PolarHBondContact OD1-NE2 3.12Å; D637-Q720 PolarHBondContact OD2-N 3.34Å; D637-Q720 VanDerWaalsContact OD2-N 3.09Å; Q720-R724 VanDerWaalsContact O-CB 3.31Å; Q720-R724 WeakPolarHBondContact O-CB 3.42Å; Q720-R724 VanDerWaalsContact O-CG 3.29Å; Q720-R724 WeakPolarHBondContact O-CG 3.5Å; Q720-R724 PolarHBondContact O-N 2.79Å; Q720-R724 VanDerWaalsContact OE1-CZ 3.25Å
721	A	93.8	Very high	94.2	Very high	78 Å²	78	35.7 Å²	35.7	65%	0.645	22%	0.215	S	C	*	.	H	α-helix	trans	-62.9	-42.1	179.4	0	0	0	0	0	112.5	T719 S725	T719-A721 PolarHBondContact O-N 3.21Å; T719-A721 VanDerWaalsContact O-N 3.17Å; A721-S725 PolarHBondContact O-N 3.25Å; A721-S725 VanDerWaalsContact O-N 3.11Å
722	S	95.2	Very high	93.8	Very high	15 Å²	15	37.9 Å²	37.9	11%	0.105	23%	0.225	C	C	.	.	H	α-helix	trans	-71.7	-43.2	177.6	69.1	0	0	0	0	112.2	P643 L644 T719 R724 S725 H726	P643-S722 WeakPolarHBondContact CA-OG 3.48Å; L644-S722 PolarHBondContact N-OG 2.97Å; T719-S722 PolarHBondContact O-N 3.07Å; T719-S722 VanDerWaalsContact O-N 3.08Å; T719-S722 PolarHBondContact O-OG 3.5Å; T719-S722 WeakPolarHBondContact OG1-CB 3.49Å; T719-S722 PolarHBondContact OG1-OG 3.06Å; S722-R724 PolarHBondContact O-N 2.86Å; S722-S725 PolarHBondContact O-N 3.38Å; S722-S725 PolarHBondContact O-OG 3.49Å; S722-H726 PolarHBondContact O-CD2 2.95Å; S722-H726 VanDerWaalsContact O-CD2 3.24Å
723	L	95.6	Very high	93.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.3	-51.7	175.2	175	64.8	0	0	0	111.1	L644 R699 I710 I715 V718 T719 S725 H726 I727	L644-L723 HydrophobicContact CD2-CD1 4.02Å; R699-L723 HydrophobicContact CB-CD2 3.69Å; I710-L723 HydrophobicContact CD1-CD1 3.52Å; I715-L723 HydrophobicContact CB-CD1 4.36Å; I715-L723 HydrophobicContact CB-CD2 3.99Å; I715-L723 HydrophobicContact CG2-CD1 3.93Å; I715-L723 HydrophobicContact CG2-CD2 4.42Å; V718-L723 HydrophobicContact CG2-CB 4.28Å; T719-L723 PolarHBondContact O-N 3.41Å; T719-L723 VanDerWaalsContact O-N 3.12Å; L723-S725 VanDerWaalsContact C-N 3.3Å; L723-S725 PolarHBondContact O-N 3.49Å; L723-H726 PolarHBondContact O-N 3.42Å; L723-I727 HydrophobicContact CD1-CD1 3.86Å; L723-I727 HydrophobicContact CG-CD1 4.11Å; L723-I727 WeakPolarHBondContact O-CG1 3.3Å
724	R	95.5	Very high	92.9	Very high	62 Å²	62	40.3 Å²	40.3	23%	0.234	23%	0.228	C	C	.	.	H	α-helix	trans	-73.9	-15.2	-177	-65.7	176	-176.9	144.9	7.4	113.4	F698 R699 Q720 S722 K804	F698-R724 HydrophobicContact CD1-CG 4.01Å; F698-R724 HydrophobicContact CD2-CG 4.3Å; F698-R724 HydrophobicContact CE1-CB 4.29Å; F698-R724 VanDerWaalsContact CE1-CD 3.46Å; F698-R724 HydrophobicContact CE1-CG 3.66Å; F698-R724 HydrophobicContact CE2-CB 4.05Å; F698-R724 HydrophobicContact CE2-CG 3.96Å; F698-R724 HydrophobicContact CG-CG 4.33Å; F698-R724 HydrophobicContact CZ-CB 3.78Å; F698-R724 HydrophobicContact CZ-CG 3.63Å; F698-R724 PolarHBondContact O-NE 3.12Å; F698-R724 VanDerWaalsContact O-NE 3.09Å; R699-R724 PolarHBondContact O-NH2 3.08Å; Q720-R724 VanDerWaalsContact O-CB 3.31Å; Q720-R724 WeakPolarHBondContact O-CB 3.42Å; Q720-R724 VanDerWaalsContact O-CG 3.29Å; Q720-R724 WeakPolarHBondContact O-CG 3.5Å; Q720-R724 PolarHBondContact O-N 2.79Å; Q720-R724 VanDerWaalsContact OE1-CZ 3.25Å; S722-R724 PolarHBondContact O-N 2.86Å; R724-K804 WeakPolarHBondContact O-CE 3.32Å; R724-K804 PolarHBondContact O-NZ 2.9Å
725	S	93.7	Very high	92.6	Very high	62 Å²	62	43.5 Å²	43.5	43%	0.434	25%	0.249	S	C	.	.	H	α-helix	trans	-71.3	-38.2	172.9	62.8	0	0	0	0	111.9	A721 S722 L723 I727 K804	A721-S725 PolarHBondContact O-N 3.25Å; A721-S725 VanDerWaalsContact O-N 3.11Å; S722-S725 PolarHBondContact O-N 3.38Å; S722-S725 PolarHBondContact O-OG 3.49Å; L723-S725 VanDerWaalsContact C-N 3.3Å; L723-S725 PolarHBondContact O-N 3.49Å; S725-I727 VanDerWaalsContact C-N 3.32Å; S725-I727 PolarHBondContact O-N 2.81Å; S725-K804 WeakPolarHBondContact O-CE 3.5Å
726	H	94.8	Very high	92.4	Very high	44 Å²	44	44 Å²	44	20%	0.204	25%	0.252	C	S	.	.	S	Bend	trans	-76.9	-10.9	179.4	-69.1	-71.7	0	0	0	114.6	F646 S722 L723 P806 D807 I808	F646-H726 HydrophobicContact CD2-CB 4.47Å; S722-H726 PolarHBondContact O-CD2 2.95Å; S722-H726 VanDerWaalsContact O-CD2 3.24Å; L723-H726 PolarHBondContact O-N 3.42Å; H726-P806 WeakPolarHBondContact O-CB 3.39Å; H726-D807 IonicContact CE1-OD2 3.81Å; H726-D807 IonicContact CG-OD2 3.96Å; H726-D807 IonicContact ND1-OD2 2.7Å; H726-D807 PolarHBondContact ND1-OD2 3.42Å; H726-D807 PolarHBondContact O-N 3.29Å; H726-D807 VanDerWaalsContact O-N 3.09Å; H726-I808 PolarHBondContact O-N 3.27Å
727	I	95.6	Very high	92.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.4	-175	-55.9	168.3	0	0	0	111.8	F698 L723 S725 V729 K804 I808 L810	F698-I727 HydrophobicContact CD2-CB 4Å; F698-I727 HydrophobicContact CD2-CD1 4.4Å; F698-I727 HydrophobicContact CD2-CG2 3.74Å; F698-I727 HydrophobicContact CE2-CB 4.1Å; F698-I727 HydrophobicContact CE2-CG2 4.14Å; L723-I727 HydrophobicContact CD1-CD1 3.86Å; L723-I727 HydrophobicContact CG-CD1 4.11Å; L723-I727 WeakPolarHBondContact O-CG1 3.3Å; S725-I727 VanDerWaalsContact C-N 3.32Å; S725-I727 PolarHBondContact O-N 2.81Å; I727-V729 HydrophobicContact CG2-CG2 4.35Å; I727-K804 PolarHBondContact O-NZ 3.3Å; I727-I808 CarbonylContact C-O 3.54Å; I727-I808 WeakPolarHBondContact CA-O 3.36Å; I727-I808 HydrophobicContact CG1-CB 4.21Å; I727-I808 HydrophobicContact CG1-CD1 4.36Å; I727-I808 HydrophobicContact CG1-CG2 4.43Å; I727-I808 HydrophobicContact CG2-CG2 4.44Å; I727-L810 HydrophobicContact CG2-CD1 3.63Å; I727-L810 HydrophobicContact CG2-CG 3.71Å
728	G	94.6	Very high	92.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	145.3	167.5	0	0	0	0	0	111.7	P806 I808 L810	G728-P806 VanDerWaalsContact CA-CG 3.43Å; G728-I808 PolarHBondContact N-O 3.35Å; G728-L810 PolarHBondContact O-N 3.43Å
729	V	93.5	Very high	92.4	Very high	53 Å²	53	49.1 Å²	49.1	32%	0.321	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.6	174.2	-170.8	0	0	0	0	109	F698 I727 P731 L810	F698-V729 HydrophobicContact CD2-CG2 3.81Å; F698-V729 HydrophobicContact CE2-CG2 3.89Å; I727-V729 HydrophobicContact CG2-CG2 4.35Å; V729-P731 WeakPolarHBondContact O-CD 3.27Å; V729-L810 CarbonylContact C-O 3.56Å; V729-L810 WeakPolarHBondContact CA-O 3.43Å; V729-L810 HydrophobicContact CG1-CB 4.47Å; V729-L810 HydrophobicContact CG2-CB 4.29Å; V729-L810 HydrophobicContact CG2-CD1 4.23Å
730	V	92.5	Very high	92.4	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	103.4	164.1	-176.3	0	0	0	0	106.8	A797 I798 T801 L810 L811 D812 A814 L830	V730-A797 HydrophobicContact CG1-CB 4.3Å; V730-I798 HydrophobicContact CG1-CG1 4.19Å; V730-I798 HydrophobicContact CG2-CG1 4.36Å; V730-T801 HydrophobicContact CG2-CG2 4.28Å; V730-L810 PolarHBondContact N-O 3.41Å; V730-L811 HydrophobicContact CB-CD2 3.7Å; V730-L811 HydrophobicContact CG2-CD2 3.64Å; V730-D812 PolarHBondContact O-N 2.95Å; V730-A814 HydrophobicContact CB-CB 4.37Å; V730-A814 HydrophobicContact CG1-CB 3.8Å; V730-L830 HydrophobicContact CG2-CD2 4.34Å
731	P	90.1	Very high	92.5	Very high	44 Å²	44	46.7 Å²	46.7	29%	0.286	26%	0.263	S	S	.	.			trans	-76.8	162.4	-178.8	33.3	-36.3	0	0	0	111.8	V729 Q794 D812	V729-P731 WeakPolarHBondContact O-CD 3.27Å; P731-Q794 PolarHBondContact O-NE2 3.35Å; P731-D812 CarbonylContact C-O 3.57Å
732	Q	85.4	Confident	92.6	Very high	76 Å²	76	43.5 Å²	43.5	36%	0.355	24%	0.236	S	C	.	.	S	Bend	trans	-59.4	-61.7	172.1	-170.7	-178.3	25.5	0	0	110.1	Q794 D812 E813	Q732-Q794 PolarHBondContact O-NE2 2.96Å; Q732-D812 VanDerWaalsContact CA-O 3.22Å; Q732-D812 WeakPolarHBondContact CA-O 3.11Å; Q732-D812 WeakPolarHBondContact CB-O 3.18Å; Q732-D812 PolarHBondContact N-O 2.8Å; Q732-E813 HydrophobicContact CB-CB 4.3Å; Q732-E813 HydrophobicContact CG-CB 3.96Å; Q732-E813 PolarHBondContact NE2-OE2 2.83Å
733	D	82.8	Confident	92.6	Very high	129 Å²	129	45.5 Å²	45.5	69%	0.69	25%	0.246	S	C	*	.	S	Bend	trans	-91.2	109.9	175.9	-71.2	-42.2	0	0	0	111.2	V735	D733-V735 PolarHBondContact O-N 3.18Å
734	T	86.8	Confident	92.7	Very high	15 Å²	15	45.6 Å²	45.6	9%	0.092	25%	0.246	C	C	.	.			trans	-87.5	111	174.5	-61.1	0	0	0	0	111.5	L736 K793 A797	T734-L736 HydrophobicContact CG2-CD2 4.43Å; T734-K793 HydrophobicContact CG2-CB 4.41Å; T734-K793 WeakPolarHBondContact CG2-O 3.43Å; T734-A797 HydrophobicContact CG2-CB 3.74Å; T734-A797 VanDerWaalsContact OG1-CB 3.27Å; T734-A797 WeakPolarHBondContact OG1-CB 3.26Å
735	V	88.6	Confident	92.7	Very high	111 Å²	111	42.6 Å²	42.6	67%	0.673	24%	0.235	S	C	*	.			trans	-82.1	138.9	170.2	-173.6	0	0	0	0	110.5	D733 R800	D733-V735 PolarHBondContact O-N 3.18Å; V735-R800 PolarHBondContact O-NH1 3.32Å; V735-R800 PolarHBondContact O-NH2 3.04Å
736	L	92.1	Very high	92.9	Very high	20 Å²	20	41.8 Å²	41.8	11%	0.105	22%	0.222	C	C	.	.			trans	-107.6	138.1	171.1	-58.7	179.1	0	0	0	109	T734 N744 V781 L788 K793 V796	T734-L736 HydrophobicContact CG2-CD2 4.43Å; L736-N744 WeakPolarHBondContact CA-OD1 3.38Å; L736-V781 HydrophobicContact CB-CG2 4.46Å; L736-V781 HydrophobicContact CD1-CB 3.98Å; L736-V781 HydrophobicContact CD1-CG2 4.05Å; L736-L788 HydrophobicContact CD1-CB 4.39Å; L736-L788 HydrophobicContact CD1-CD1 3.87Å; L736-L788 HydrophobicContact CD1-CG 4.18Å; L736-K793 HydrophobicContact CD1-CG 4.09Å; L736-K793 HydrophobicContact CG-CG 4.41Å; L736-V796 HydrophobicContact CD2-CB 4.26Å; L736-V796 HydrophobicContact CD2-CG1 3.85Å
737	F	93.4	Very high	92.9	Very high	96 Å²	96	46.3 Å²	46.3	42%	0.421	24%	0.239	S	C	.	.			trans	-72.4	151.2	168.3	-64.5	-78.5	0	0	0	109.6	D739 N744 Y747 V781	F737-D739 PolarHBondContact O-N 2.73Å; F737-N744 PolarHBondContact N-OD1 3.39Å; F737-N744 PolarHBondContact O-ND2 2.97Å; F737-Y747 HydrophobicContact CD2-CD2 4Å; F737-Y747 HydrophobicContact CD2-CE2 4.19Å; F737-Y747 HydrophobicContact CD2-CG 4.33Å; F737-Y747 HydrophobicContact CE1-CE2 4.49Å; F737-Y747 AromaticContact CE2-CD1 3.88Å; F737-Y747 HydrophobicContact CE2-CD1 3.88Å; F737-Y747 AromaticContact CE2-CD2 3.54Å; F737-Y747 HydrophobicContact CE2-CD2 3.54Å; F737-Y747 AromaticContact CE2-CE1 3.76Å; F737-Y747 HydrophobicContact CE2-CE1 3.76Å; F737-Y747 AromaticContact CE2-CE2 3.42Å; F737-Y747 HydrophobicContact CE2-CE2 3.42Å; F737-Y747 VanDerWaalsContact CE2-CE2 3.42Å; F737-Y747 AromaticContact CE2-CG 3.77Å; F737-Y747 HydrophobicContact CE2-CG 3.77Å; F737-Y747 AromaticContact CE2-CZ 3.54Å; F737-Y747 HydrophobicContact CZ-CD2 4.21Å; F737-Y747 HydrophobicContact CZ-CE1 4.01Å; F737-Y747 AromaticContact CZ-CE2 3.6Å; F737-Y747 HydrophobicContact CZ-CE2 3.6Å; F737-Y747 AromaticContact CZ-CZ 3.49Å; F737-Y747 VanDerWaalsContact CZ-CZ 3.49Å; F737-V781 VanDerWaalsContact O-O 3.12Å
738	N	92.9	Very high	92.8	Very high	91 Å²	91	47.1 Å²	47.1	49%	0.487	25%	0.247	S	C	.	.	S	Bend	trans	-71	75.2	172.5	-70.4	-50.1	0	0	0	109.7	V781 G782 E783 R784	N738-V781 WeakPolarHBondContact CA-O 3.37Å; N738-G782 WeakPolarHBondContact OD1-CA 3.39Å; N738-E783 PolarHBondContact OD1-N 3.18Å; N738-R784 PolarHBondContact OD1-N 2.93Å
739	D	94.2	Very high	92.8	Very high	66 Å²	66	51.9 Å²	51.9	35%	0.353	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	-177.1	-173.1	-154.5	-13.9	0	0	0	110.1	F737 N744 V781	F737-D739 PolarHBondContact O-N 2.73Å; D739-N744 PolarHBondContact O-ND2 3.3Å; D739-V781 PolarHBondContact N-O 3.36Å; D739-V781 VanDerWaalsContact O-CG2 3.31Å; D739-V781 WeakPolarHBondContact O-CG2 3.37Å; D739-V781 PolarHBondContact O-N 3.48Å
740	T	95.1	Very high	92.8	Very high	16 Å²	16	54.7 Å²	54.7	10%	0.098	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	158.5	178.1	81.2	0	0	0	0	112.9	A742 D743 N744 R778 T779	T740-A742 VanDerWaalsContact C-N 3.3Å; T740-A742 PolarHBondContact O-N 3.38Å; T740-A742 PolarHBondContact OG1-N 2.77Å; T740-D743 PolarHBondContact O-N 2.93Å; T740-D743 PolarHBondContact OG1-N 3.33Å; T740-D743 PolarHBondContact OG1-OD2 3.37Å; T740-N744 WeakPolarHBondContact O-CB 3.36Å; T740-N744 PolarHBondContact O-N 3.03Å; T740-N744 PolarHBondContact O-ND2 3.29Å; T740-R778 WeakPolarHBondContact CG2-O 3.44Å; T740-T779 WeakPolarHBondContact CA-O 3.39Å
741	I	95.7	Very high	92.9	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-39.7	170.5	-62.8	173.9	0	0	0	111	D743 N744 I745 I770 F773 Y777 T779 V781 L788	I741-D743 PolarHBondContact O-N 2.89Å; I741-N744 PolarHBondContact O-N 3.43Å; I741-I745 HydrophobicContact CG2-CD1 3.93Å; I741-I745 HydrophobicContact CG2-CG1 4.42Å; I741-I745 WeakPolarHBondContact O-CG1 3.31Å; I741-I745 PolarHBondContact O-N 3.1Å; I741-I770 HydrophobicContact CD1-CG1 4.29Å; I741-I770 HydrophobicContact CG2-CD1 3.65Å; I741-I770 HydrophobicContact CG2-CG1 3.98Å; I741-F773 HydrophobicContact CD1-CD2 3.74Å; I741-F773 HydrophobicContact CD1-CE2 3.72Å; I741-Y777 PolarHBondContact N-O 3.44Å; I741-T779 HydrophobicContact CD1-CG2 4.32Å; I741-T779 PolarHBondContact N-O 2.9Å; I741-T779 VanDerWaalsContact N-O 3.07Å; I741-V781 HydrophobicContact CD1-CG1 3.93Å; I741-V781 HydrophobicContact CG1-CB 4.41Å; I741-V781 HydrophobicContact CG1-CG1 3.52Å; I741-V781 HydrophobicContact CG1-CG2 3.97Å; I741-L788 HydrophobicContact CD1-CD2 4.49Å
742	A	96.3	Very high	93.1	Very high	11 Å²	11	58.6 Å²	58.6	9%	0.091	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-48.6	177.3	0	0	0	0	0	112.1	T740 I745 R746 Y777	T740-A742 VanDerWaalsContact C-N 3.3Å; T740-A742 PolarHBondContact O-N 3.38Å; T740-A742 PolarHBondContact OG1-N 2.77Å; A742-I745 PolarHBondContact O-N 3.44Å; A742-R746 VanDerWaalsContact O-CB 3.26Å; A742-R746 WeakPolarHBondContact O-CB 3.47Å; A742-R746 PolarHBondContact O-N 2.87Å; A742-Y777 HydrophobicContact CB-CD1 4.35Å; A742-Y777 WeakPolarHBondContact CB-O 3.32Å; A742-Y777 PolarHBondContact N-O 3.33Å
743	D	96.4	Very high	93.6	Very high	56 Å²	56	56.8 Å²	56.8	30%	0.299	31%	0.307	S	S	.	.	H	α-helix	trans	-72.1	-34	-178.4	-65.4	-58.3	0	0	0	111.7	T740 I741 I745 R746 Y747	T740-D743 PolarHBondContact O-N 2.93Å; T740-D743 PolarHBondContact OG1-N 3.33Å; T740-D743 PolarHBondContact OG1-OD2 3.37Å; I741-D743 PolarHBondContact O-N 2.89Å; D743-I745 VanDerWaalsContact C-N 3.34Å; D743-I745 PolarHBondContact O-N 3.36Å; D743-R746 PolarHBondContact O-N 3.38Å; D743-R746 IonicContact OD1-CZ 2.72Å; D743-R746 IonicContact OD1-NH1 3.04Å; D743-R746 PolarHBondContact OD1-NH1 3.32Å; D743-Y747 PolarHBondContact O-N 2.92Å
744	N	96.1	Very high	94.2	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.011	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-38.3	169.1	-91.3	-82.6	0	0	0	113.1	L736 F737 D739 T740 I741 Y747 V781 V796 R800	L736-N744 WeakPolarHBondContact CA-OD1 3.38Å; F737-N744 PolarHBondContact N-OD1 3.39Å; F737-N744 PolarHBondContact O-ND2 2.97Å; D739-N744 PolarHBondContact O-ND2 3.3Å; T740-N744 WeakPolarHBondContact O-CB 3.36Å; T740-N744 PolarHBondContact O-N 3.03Å; T740-N744 PolarHBondContact O-ND2 3.29Å; I741-N744 PolarHBondContact O-N 3.43Å; N744-Y747 WeakPolarHBondContact O-CB 3.38Å; N744-V781 WeakPolarHBondContact ND2-CG2 3.39Å; N744-V796 HydrophobicContact CB-CG1 4.41Å; N744-R800 VanDerWaalsContact O-CG 3.29Å; N744-R800 WeakPolarHBondContact O-CG 3.34Å; N744-R800 PolarHBondContact O-NE 3.25Å; N744-R800 PolarHBondContact OD1-NH2 2.83Å
745	I	96.5	Very high	94.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-75.2	-45.2	174.8	-65.3	171.2	0	0	0	110.5	I741 A742 D743 Y747 G748 V757 A761 I770 Y777 V796 A799 L803	I741-I745 HydrophobicContact CG2-CD1 3.93Å; I741-I745 HydrophobicContact CG2-CG1 4.42Å; I741-I745 WeakPolarHBondContact O-CG1 3.31Å; I741-I745 PolarHBondContact O-N 3.1Å; A742-I745 PolarHBondContact O-N 3.44Å; D743-I745 VanDerWaalsContact C-N 3.34Å; D743-I745 PolarHBondContact O-N 3.36Å; I745-Y747 PolarHBondContact O-N 3.23Å; I745-Y747 VanDerWaalsContact O-N 3.09Å; I745-G748 PolarHBondContact O-N 2.91Å; I745-V757 HydrophobicContact CB-CG1 3.97Å; I745-V757 HydrophobicContact CG2-CB 4.48Å; I745-V757 HydrophobicContact CG2-CG1 3.89Å; I745-V757 HydrophobicContact CG2-CG2 4.5Å; I745-A761 HydrophobicContact CD1-CB 4.04Å; I745-I770 HydrophobicContact CD1-CD1 4.04Å; I745-Y777 HydrophobicContact CD1-CE1 4.44Å; I745-V796 HydrophobicContact CG1-CG1 4.04Å; I745-A799 HydrophobicContact CD1-CB 4.25Å; I745-A799 HydrophobicContact CG1-CB 4.15Å; I745-A799 HydrophobicContact CG2-CB 3.91Å; I745-L803 HydrophobicContact CG2-CD2 4.3Å; I745-L803 WeakPolarHBondContact O-CD2 3.41Å
746	R	96.9	Very high	95	Very high	45 Å²	45	59.3 Å²	59.3	17%	0.17	31%	0.314	C	S	.	.	H	α-helix	trans	-54.5	-26.3	175.5	-179	175.3	-72.3	120.1	7.2	113	A742 D743 G748 R749 V750 A752 N754 V757	A742-R746 VanDerWaalsContact O-CB 3.26Å; A742-R746 WeakPolarHBondContact O-CB 3.47Å; A742-R746 PolarHBondContact O-N 2.87Å; D743-R746 PolarHBondContact O-N 3.38Å; D743-R746 IonicContact OD1-CZ 2.72Å; D743-R746 IonicContact OD1-NH1 3.04Å; D743-R746 PolarHBondContact OD1-NH1 3.32Å; R746-G748 PolarHBondContact O-N 2.89Å; R746-R749 CarbonylContact O-C 3.57Å; R746-R749 WeakPolarHBondContact O-CA 3.45Å; R746-R749 PolarHBondContact O-N 3.25Å; R746-R749 VanDerWaalsContact O-O 3.07Å; R746-V750 PolarHBondContact O-N 2.81Å; R746-A752 PolarHBondContact NE-O 3.09Å; R746-N754 PolarHBondContact NH2-OD1 2.95Å; R746-V757 HydrophobicContact CB-CG2 3.99Å
747	Y	95.9	Very high	95.2	Very high	138 Å²	138	58.4 Å²	58.4	54%	0.541	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-25.4	173.3	-158.9	-91.4	0	0	0	113.9	F737 D743 N744 I745 R749	F737-Y747 HydrophobicContact CD2-CD2 4Å; F737-Y747 HydrophobicContact CD2-CE2 4.19Å; F737-Y747 HydrophobicContact CD2-CG 4.33Å; F737-Y747 HydrophobicContact CE1-CE2 4.49Å; F737-Y747 AromaticContact CE2-CD1 3.88Å; F737-Y747 HydrophobicContact CE2-CD1 3.88Å; F737-Y747 AromaticContact CE2-CD2 3.54Å; F737-Y747 HydrophobicContact CE2-CD2 3.54Å; F737-Y747 AromaticContact CE2-CE1 3.76Å; F737-Y747 HydrophobicContact CE2-CE1 3.76Å; F737-Y747 AromaticContact CE2-CE2 3.42Å; F737-Y747 HydrophobicContact CE2-CE2 3.42Å; F737-Y747 VanDerWaalsContact CE2-CE2 3.42Å; F737-Y747 AromaticContact CE2-CG 3.77Å; F737-Y747 HydrophobicContact CE2-CG 3.77Å; F737-Y747 AromaticContact CE2-CZ 3.54Å; F737-Y747 HydrophobicContact CZ-CD2 4.21Å; F737-Y747 HydrophobicContact CZ-CE1 4.01Å; F737-Y747 AromaticContact CZ-CE2 3.6Å; F737-Y747 HydrophobicContact CZ-CE2 3.6Å; F737-Y747 AromaticContact CZ-CZ 3.49Å; F737-Y747 VanDerWaalsContact CZ-CZ 3.49Å; D743-Y747 PolarHBondContact O-N 2.92Å; N744-Y747 WeakPolarHBondContact O-CB 3.38Å; I745-Y747 PolarHBondContact O-N 3.23Å; I745-Y747 VanDerWaalsContact O-N 3.09Å; Y747-R749 VanDerWaalsContact C-N 3.3Å; Y747-R749 PolarHBondContact O-N 3.11Å
748	G	93	Very high	95.3	Very high	17 Å²	17	57.4 Å²	57.4	18%	0.175	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-33.9	172	0	0	0	0	0	114	I745 R746 R800 K804	I745-G748 PolarHBondContact O-N 2.91Å; R746-G748 PolarHBondContact O-N 2.89Å; G748-R800 WeakPolarHBondContact CA-O 3.47Å; G748-K804 WeakPolarHBondContact O-CB 3.45Å
749	R	94.8	Very high	95.4	Very high	101 Å²	101	55.6 Å²	55.6	38%	0.381	30%	0.304	S	S	.	.	S	Bend	trans	-155.5	96.9	173.4	-173.1	173.5	71.3	165.2	3.1	109.8	R746 Y747 T751 A752 E756 L803	R746-R749 CarbonylContact O-C 3.57Å; R746-R749 WeakPolarHBondContact O-CA 3.45Å; R746-R749 PolarHBondContact O-N 3.25Å; R746-R749 VanDerWaalsContact O-O 3.07Å; Y747-R749 VanDerWaalsContact C-N 3.3Å; Y747-R749 PolarHBondContact O-N 3.11Å; R749-T751 PolarHBondContact O-N 3.4Å; R749-A752 WeakPolarHBondContact O-CB 3.47Å; R749-A752 PolarHBondContact O-N 3.01Å; R749-E756 IonicContact CZ-OE1 2.69Å; R749-E756 IonicContact CZ-OE2 2.99Å; R749-E756 IonicContact NH2-OE1 3.16Å; R749-E756 PolarHBondContact NH2-OE1 3.4Å; R749-E756 IonicContact NH2-OE2 3.3Å; R749-E756 PolarHBondContact NH2-OE2 3.48Å; R749-L803 HydrophobicContact CB-CG 4.29Å
750	V	93.9	Very high	95.4	Very high	112 Å²	112	52.7 Å²	52.7	68%	0.679	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.5	-169.9	-62.6	0	0	0	0	115.7	R746 A752	R746-V750 PolarHBondContact O-N 2.81Å; V750-A752 VanDerWaalsContact C-N 3.31Å
751	T	94.4	Very high	95.4	Very high	121 Å²	121	51.9 Å²	51.9	74%	0.742	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	0.6	176	53.7	0	0	0	0	114.1	R749	R749-T751 PolarHBondContact O-N 3.4Å
752	A	95.1	Very high	95.3	Very high	6 Å²	6	57.1 Å²	57.1	5%	0.05	31%	0.308	C	S	.	.			trans	-75.1	137.7	-175.3	0	0	0	0	0	114.1	R746 R749 V750 E756 V757 L803	R746-A752 PolarHBondContact NE-O 3.09Å; R749-A752 WeakPolarHBondContact O-CB 3.47Å; R749-A752 PolarHBondContact O-N 3.01Å; V750-A752 VanDerWaalsContact C-N 3.31Å; A752-E756 WeakPolarHBondContact CA-OE2 3.48Å; A752-E756 HydrophobicContact CB-CB 4.35Å; A752-E756 VanDerWaalsContact CB-OE2 3.23Å; A752-E756 WeakPolarHBondContact CB-OE2 3.49Å; A752-V757 HydrophobicContact CB-CG2 4.5Å; A752-L803 HydrophobicContact CB-CD1 3.87Å; A752-L803 HydrophobicContact CB-CD2 3.85Å; A752-L803 HydrophobicContact CB-CG 4.09Å
753	G	95.3	Very high	95	Very high	38 Å²	38	58.6 Å²	58.6	39%	0.392	32%	0.32	S	S	.	.			trans	-69.4	171.7	173.5	0	0	0	0	0	113.1	E756 V757	G753-E756 PolarHBondContact N-OE2 3.31Å; G753-V757 WeakPolarHBondContact O-CG2 3.5Å; G753-V757 PolarHBondContact O-N 3.04Å
754	N	94.6	Very high	94.7	Very high	96 Å²	96	55.9 Å²	55.9	51%	0.513	31%	0.306	S	S	.	.	H	α-helix	trans	-62.7	-44.9	175.3	-69	-27.9	0	0	0	111.2	R746 E756 V757 E758	R746-N754 PolarHBondContact NH2-OD1 2.95Å; N754-E756 VanDerWaalsContact C-N 3.26Å; N754-E756 PolarHBondContact O-N 2.72Å; N754-V757 CarbonylContact O-C 3.58Å; N754-V757 WeakPolarHBondContact O-CA 3.49Å; N754-V757 WeakPolarHBondContact O-CB 3.48Å; N754-V757 PolarHBondContact O-N 2.85Å; N754-E758 PolarHBondContact O-N 3.38Å
755	D	96.2	Very high	94.4	Very high	131 Å²	131	57.3 Å²	57.3	70%	0.701	32%	0.321	S	S	*	.	H	α-helix	trans	-58.5	-37.8	-177.4	-43.8	-2.4	0	0	0	112	A759	D755-A759 WeakPolarHBondContact O-CB 3.44Å; D755-A759 PolarHBondContact O-N 3.38Å
756	E	95.7	Very high	94.2	Very high	82 Å²	82	57.5 Å²	57.5	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-71	-37.1	175.5	-60.1	-173.4	136.6	0	0	112.3	R749 A752 G753 N754 A760 L803	R749-E756 IonicContact CZ-OE1 2.69Å; R749-E756 IonicContact CZ-OE2 2.99Å; R749-E756 IonicContact NH2-OE1 3.16Å; R749-E756 PolarHBondContact NH2-OE1 3.4Å; R749-E756 IonicContact NH2-OE2 3.3Å; R749-E756 PolarHBondContact NH2-OE2 3.48Å; A752-E756 WeakPolarHBondContact CA-OE2 3.48Å; A752-E756 HydrophobicContact CB-CB 4.35Å; A752-E756 VanDerWaalsContact CB-OE2 3.23Å; A752-E756 WeakPolarHBondContact CB-OE2 3.49Å; G753-E756 PolarHBondContact N-OE2 3.31Å; N754-E756 VanDerWaalsContact C-N 3.26Å; N754-E756 PolarHBondContact O-N 2.72Å; E756-A760 VanDerWaalsContact O-CB 3.32Å; E756-A760 WeakPolarHBondContact O-CB 3.4Å; E756-A760 PolarHBondContact O-N 3.01Å; E756-L803 HydrophobicContact CB-CD1 3.79Å; E756-L803 WeakPolarHBondContact O-CD1 3.34Å
757	V	96.8	Very high	94	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-65.6	-40.3	174.5	165.9	0	0	0	0	110.8	I745 R746 A752 G753 N754 A761 Y777 L803	I745-V757 HydrophobicContact CB-CG1 3.97Å; I745-V757 HydrophobicContact CG2-CB 4.48Å; I745-V757 HydrophobicContact CG2-CG1 3.89Å; I745-V757 HydrophobicContact CG2-CG2 4.5Å; R746-V757 HydrophobicContact CB-CG2 3.99Å; A752-V757 HydrophobicContact CB-CG2 4.5Å; G753-V757 WeakPolarHBondContact O-CG2 3.5Å; G753-V757 PolarHBondContact O-N 3.04Å; N754-V757 CarbonylContact O-C 3.58Å; N754-V757 WeakPolarHBondContact O-CA 3.49Å; N754-V757 WeakPolarHBondContact O-CB 3.48Å; N754-V757 PolarHBondContact O-N 2.85Å; V757-A761 WeakPolarHBondContact O-CB 3.44Å; V757-A761 PolarHBondContact O-N 2.94Å; V757-Y777 HydrophobicContact CG1-CD1 4.36Å; V757-Y777 HydrophobicContact CG1-CE1 4.24Å; V757-L803 HydrophobicContact CG2-CD2 3.92Å
758	E	96.1	Very high	93.9	Very high	75 Å²	75	56.4 Å²	56.4	35%	0.35	33%	0.327	S	S	.	.	H	α-helix	trans	-66	-47.3	174.6	-70.5	-178.5	-159.1	0	0	111.4	N754 A760 A761 Q762 Y777	N754-E758 PolarHBondContact O-N 3.38Å; E758-A760 VanDerWaalsContact C-N 3.34Å; E758-A760 PolarHBondContact O-N 3Å; E758-A761 WeakPolarHBondContact O-CB 3.32Å; E758-A761 PolarHBondContact O-N 3.46Å; E758-Q762 WeakPolarHBondContact O-CG 3.29Å; E758-Q762 PolarHBondContact O-N 3.07Å; E758-Y777 HydrophobicContact CG-CD2 4.41Å; E758-Y777 HydrophobicContact CG-CE1 4.29Å; E758-Y777 HydrophobicContact CG-CE2 3.87Å
759	A	94.4	Very high	93.8	Very high	53 Å²	53	57.2 Å²	57.2	44%	0.438	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-41.1	175.6	0	0	0	0	0	112.6	D755 Q762 A763	D755-A759 WeakPolarHBondContact O-CB 3.44Å; D755-A759 PolarHBondContact O-N 3.38Å; A759-Q762 PolarHBondContact O-N 3.43Å; A759-A763 WeakPolarHBondContact O-CB 3.36Å; A759-A763 PolarHBondContact O-N 3.3Å
760	A	94.3	Very high	93.7	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.033	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-38.5	175.4	0	0	0	0	0	112.4	E756 E758 A763 A764 I802 L803	E756-A760 VanDerWaalsContact O-CB 3.32Å; E756-A760 WeakPolarHBondContact O-CB 3.4Å; E756-A760 PolarHBondContact O-N 3.01Å; E758-A760 VanDerWaalsContact C-N 3.34Å; E758-A760 PolarHBondContact O-N 3Å; A760-A763 PolarHBondContact O-N 3.37Å; A760-A764 WeakPolarHBondContact O-CB 3.46Å; A760-A764 PolarHBondContact O-N 2.94Å; A760-I802 HydrophobicContact CB-CB 4.41Å; A760-I802 HydrophobicContact CB-CG2 4.06Å; A760-L803 HydrophobicContact CB-CB 3.97Å; A760-L803 HydrophobicContact CB-CD1 4.14Å
761	A	95	Very high	93.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-69	-35.5	175.3	0	0	0	0	0	113.1	I745 V757 E758 G765 I766 H767 I770 Y777	I745-A761 HydrophobicContact CD1-CB 4.04Å; V757-A761 WeakPolarHBondContact O-CB 3.44Å; V757-A761 PolarHBondContact O-N 2.94Å; E758-A761 WeakPolarHBondContact O-CB 3.32Å; E758-A761 PolarHBondContact O-N 3.46Å; A761-G765 PolarHBondContact O-N 3.34Å; A761-G765 VanDerWaalsContact O-N 3.13Å; A761-I766 HydrophobicContact CB-CG2 4.03Å; A761-I766 WeakPolarHBondContact O-CG2 3.42Å; A761-I766 PolarHBondContact O-N 3.41Å; A761-H767 HydrophobicContact CB-CB 4.46Å; A761-H767 PolarHBondContact O-N 3.27Å; A761-I770 HydrophobicContact CB-CD1 4.23Å; A761-Y777 HydrophobicContact CB-CE1 4.05Å; A761-Y777 WeakPolarHBondContact CB-OH 3.41Å
762	Q	93.3	Very high	93.8	Very high	110 Å²	110	50.7 Å²	50.7	51%	0.514	31%	0.306	S	S	.	.	H	α-helix	trans	-66.8	-45.5	172	-72.9	174.9	-1.6	0	0	110.9	E758 A759 A764 G765 H767	E758-Q762 WeakPolarHBondContact O-CG 3.29Å; E758-Q762 PolarHBondContact O-N 3.07Å; A759-Q762 PolarHBondContact O-N 3.43Å; Q762-A764 VanDerWaalsContact C-N 3.31Å; Q762-A764 PolarHBondContact O-N 3.4Å; Q762-G765 PolarHBondContact O-N 3.02Å; Q762-H767 HydrophobicContact CB-CB 4.34Å; Q762-H767 HydrophobicContact CG-CB 3.55Å
763	A	89.8	Confident	93.7	Very high	42 Å²	42	52.4 Å²	52.4	35%	0.347	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-33.1	177.7	0	0	0	0	0	113.3	A759 A760 G765 I802	A759-A763 WeakPolarHBondContact O-CB 3.36Å; A759-A763 PolarHBondContact O-N 3.3Å; A760-A763 PolarHBondContact O-N 3.37Å; A763-G765 VanDerWaalsContact C-N 3.32Å; A763-I802 HydrophobicContact CB-CD1 3.8Å; A763-I802 HydrophobicContact CB-CG2 4.26Å
764	A	90.3	Very high	93.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-6.4	171	0	0	0	0	0	114.4	A760 Q762 I766 I798 A799 I802	A760-A764 WeakPolarHBondContact O-CB 3.46Å; A760-A764 PolarHBondContact O-N 2.94Å; Q762-A764 VanDerWaalsContact C-N 3.31Å; Q762-A764 PolarHBondContact O-N 3.4Å; A764-I766 HydrophobicContact CB-CG2 4.28Å; A764-I798 HydrophobicContact CB-CB 4.28Å; A764-I798 HydrophobicContact CB-CG2 3.93Å; A764-A799 HydrophobicContact CB-CB 3.8Å; A764-I802 HydrophobicContact CB-CD1 4.05Å
765	G	89.6	Confident	93.5	Very high	31 Å²	31	58.5 Å²	58.5	32%	0.32	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	39.5	-179.2	0	0	0	0	0	114.2	A761 Q762 A763 R795	A761-G765 PolarHBondContact O-N 3.34Å; A761-G765 VanDerWaalsContact O-N 3.13Å; Q762-G765 PolarHBondContact O-N 3.02Å; A763-G765 VanDerWaalsContact C-N 3.32Å; G765-R795 WeakPolarHBondContact O-CD 3.43Å; G765-R795 PolarHBondContact O-NH1 2.95Å
766	I	91.9	Very high	93.4	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	31%	0.312	C	S	.	.			trans	-119.3	-10.1	175.5	-172.4	158.2	0	0	0	113.6	A761 A764 D768 A769 I770 E792 R795 V796	A761-I766 HydrophobicContact CB-CG2 4.03Å; A761-I766 WeakPolarHBondContact O-CG2 3.42Å; A761-I766 PolarHBondContact O-N 3.41Å; A764-I766 HydrophobicContact CB-CG2 4.28Å; I766-D768 PolarHBondContact O-N 3.02Å; I766-A769 HydrophobicContact CG1-CB 4.43Å; I766-A769 PolarHBondContact O-N 3.23Å; I766-I770 HydrophobicContact CG1-CD1 4Å; I766-I770 HydrophobicContact CG1-CG1 3.99Å; I766-I770 HydrophobicContact CG2-CD1 4.04Å; I766-I770 WeakPolarHBondContact O-CG1 3.37Å; I766-I770 PolarHBondContact O-N 3.35Å; I766-E792 HydrophobicContact CD1-CB 4.05Å; I766-E792 HydrophobicContact CD1-CG 4.48Å; I766-E792 WeakPolarHBondContact CD1-O 3.23Å; I766-R795 HydrophobicContact CB-CB 3.86Å; I766-R795 HydrophobicContact CD1-CB 3.83Å; I766-R795 HydrophobicContact CG1-CB 4.38Å; I766-R795 HydrophobicContact CG2-CB 4.28Å; I766-V796 HydrophobicContact CD1-CG2 3.73Å
767	H	94.6	Very high	93.4	Very high	33 Å²	33	50 Å²	50	15%	0.153	30%	0.298	C	S	.	.	H	α-helix	trans	-48.9	-50.3	178.5	178.7	77.1	0	0	0	113.5	A761 Q762 A769 I770 M771 Y777	A761-H767 HydrophobicContact CB-CB 4.46Å; A761-H767 PolarHBondContact O-N 3.27Å; Q762-H767 HydrophobicContact CB-CB 4.34Å; Q762-H767 HydrophobicContact CG-CB 3.55Å; H767-A769 VanDerWaalsContact C-N 3.34Å; H767-A769 PolarHBondContact O-N 2.59Å; H767-I770 WeakPolarHBondContact O-CB 3.48Å; H767-I770 PolarHBondContact O-N 3.28Å; H767-I770 VanDerWaalsContact O-N 3.15Å; H767-M771 WeakPolarHBondContact O-CG 3.21Å; H767-M771 PolarHBondContact O-N 3.28Å; H767-Y777 AromaticContact ND1-CE2 3.71Å; H767-Y777 AromaticContact ND1-CZ 3.73Å; H767-Y777 PolarHBondContact ND1-OH 3.32Å
768	D	92.4	Very high	93.3	Very high	127 Å²	127	59.4 Å²	59.4	68%	0.679	33%	0.334	S	S	*	.	H	α-helix	trans	-66	-36	-175.8	-49.6	-50.1	0	0	0	112.5	I766 M771 A772	I766-D768 PolarHBondContact O-N 3.02Å; D768-M771 PolarHBondContact O-N 2.74Å; D768-A772 PolarHBondContact O-N 3.12Å
769	A	90.4	Very high	93.2	Very high	35 Å²	35	56.3 Å²	56.3	29%	0.289	32%	0.32	S	S	.	.	H	α-helix	trans	-67.7	-39.3	174.4	0	0	0	0	0	111.6	I766 H767 A772	I766-A769 HydrophobicContact CG1-CB 4.43Å; I766-A769 PolarHBondContact O-N 3.23Å; H767-A769 VanDerWaalsContact C-N 3.34Å; H767-A769 PolarHBondContact O-N 2.59Å; A769-A772 WeakPolarHBondContact O-CB 3.28Å; A769-A772 PolarHBondContact O-N 3.5Å
770	I	94.7	Very high	93.2	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-45.4	174.1	-66	165.5	0	0	0	110.3	I741 I745 A761 I766 H767 A772 F773 G776 Y777	I741-I770 HydrophobicContact CD1-CG1 4.29Å; I741-I770 HydrophobicContact CG2-CD1 3.65Å; I741-I770 HydrophobicContact CG2-CG1 3.98Å; I745-I770 HydrophobicContact CD1-CD1 4.04Å; A761-I770 HydrophobicContact CB-CD1 4.23Å; I766-I770 HydrophobicContact CG1-CD1 4Å; I766-I770 HydrophobicContact CG1-CG1 3.99Å; I766-I770 HydrophobicContact CG2-CD1 4.04Å; I766-I770 WeakPolarHBondContact O-CG1 3.37Å; I766-I770 PolarHBondContact O-N 3.35Å; H767-I770 WeakPolarHBondContact O-CB 3.48Å; H767-I770 PolarHBondContact O-N 3.28Å; H767-I770 VanDerWaalsContact O-N 3.15Å; I770-A772 PolarHBondContact O-N 3.32Å; I770-F773 WeakPolarHBondContact O-CB 3.39Å; I770-F773 PolarHBondContact O-N 2.92Å; I770-F773 VanDerWaalsContact O-N 3.08Å; I770-G776 VanDerWaalsContact CG2-C 3.47Å; I770-G776 WeakPolarHBondContact O-CA 3.4Å; I770-Y777 HydrophobicContact CD1-CD1 4.41Å; I770-Y777 HydrophobicContact CD1-CE1 3.83Å; I770-Y777 HydrophobicContact CG2-CD1 3.94Å; I770-Y777 HydrophobicContact CG2-CD2 3.74Å; I770-Y777 HydrophobicContact CG2-CE1 4.11Å; I770-Y777 HydrophobicContact CG2-CE2 3.89Å; I770-Y777 HydrophobicContact CG2-CG 3.75Å
771	M	95.3	Very high	93.2	Very high	113 Å²	113	58.1 Å²	58.1	56%	0.557	32%	0.319	S	S	*	.	H	α-helix	trans	-68.9	-17.4	179.7	-67.7	-59.1	-66	0	0	113.6	H767 D768 F773 Y777	H767-M771 WeakPolarHBondContact O-CG 3.21Å; H767-M771 PolarHBondContact O-N 3.28Å; D768-M771 PolarHBondContact O-N 2.74Å; M771-F773 VanDerWaalsContact C-N 3.34Å; M771-Y777 HydrophobicContact SD-CD2 4.14Å; M771-Y777 HydrophobicContact SD-CE2 4.06Å
772	A	93.9	Very high	92.9	Very high	82 Å²	82	58.9 Å²	58.9	68%	0.678	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-16.8	171.1	0	0	0	0	0	113.4	D768 A769 I770	D768-A772 PolarHBondContact O-N 3.12Å; A769-A772 WeakPolarHBondContact O-CB 3.28Å; A769-A772 PolarHBondContact O-N 3.5Å; I770-A772 PolarHBondContact O-N 3.32Å
773	F	93.9	Very high	92.1	Very high	43 Å²	43	61.4 Å²	61.4	19%	0.189	34%	0.339	C	S	.	.	S	Bend	trans	-78.4	144.8	175.5	-56.8	-42.2	0	0	0	111.7	I741 I770 M771 E775 G776 T779 L786 L788	I741-F773 HydrophobicContact CD1-CD2 3.74Å; I741-F773 HydrophobicContact CD1-CE2 3.72Å; I770-F773 WeakPolarHBondContact O-CB 3.39Å; I770-F773 PolarHBondContact O-N 2.92Å; I770-F773 VanDerWaalsContact O-N 3.08Å; M771-F773 VanDerWaalsContact C-N 3.34Å; F773-E775 PolarHBondContact O-N 3.27Å; F773-E775 VanDerWaalsContact O-N 3.09Å; F773-G776 PolarHBondContact O-N 3.02Å; F773-T779 HydrophobicContact CB-CG2 4.28Å; F773-T779 WeakPolarHBondContact CB-OG1 3.22Å; F773-T779 HydrophobicContact CD2-CG2 4.28Å; F773-T779 HydrophobicContact CG-CG2 4.38Å; F773-L786 HydrophobicContact CD1-CD2 3.75Å; F773-L786 HydrophobicContact CD2-CD2 4.24Å; F773-L786 HydrophobicContact CE1-CD2 3.66Å; F773-L786 HydrophobicContact CE2-CD2 4.16Å; F773-L786 HydrophobicContact CG-CD2 4.07Å; F773-L786 HydrophobicContact CZ-CD2 3.88Å; F773-L788 HydrophobicContact CE2-CD2 3.74Å; F773-L788 HydrophobicContact CZ-CD2 3.63Å
774	P	90.8	Very high	91.2	Very high	138 Å²	138	68.5 Å²	68.5	90%	0.896	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.1	-175.7	-27.6	35.4	0	0	0	115.7
775	E	93.3	Very high	90.5	Very high	123 Å²	123	69.8 Å²	69.8	58%	0.575	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	5.3	178.5	-60.8	-171	153.6	0	0	112.9	F773 Y777 R778	F773-E775 PolarHBondContact O-N 3.27Å; F773-E775 VanDerWaalsContact O-N 3.09Å; E775-Y777 PolarHBondContact O-N 3.45Å; E775-R778 HydrophobicContact CB-CB 4.33Å; E775-R778 WeakPolarHBondContact O-CB 3.48Å; E775-R778 PolarHBondContact O-N 2.86Å
776	G	94.8	Very high	90.1	Very high	12 Å²	12	71.9 Å²	71.9	12%	0.124	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	53.4	-129.5	-177.9	0	0	0	0	0	112.2	I770 F773 R778 T779	I770-G776 VanDerWaalsContact CG2-C 3.47Å; I770-G776 WeakPolarHBondContact O-CA 3.4Å; F773-G776 PolarHBondContact O-N 3.02Å; G776-R778 PolarHBondContact O-N 3.43Å; G776-T779 VanDerWaalsContact O-CB 3.27Å; G776-T779 WeakPolarHBondContact O-CB 3.36Å; G776-T779 PolarHBondContact O-N 2.89Å; G776-T779 VanDerWaalsContact O-N 3.15Å; G776-T779 PolarHBondContact O-OG1 3.06Å
777	Y	95	Very high	89.7	Confident	24 Å²	24	79.9 Å²	79.9	9%	0.094	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-60.3	-20	175.4	-82.3	-84.4	0	0	0	115.5	I741 A742 I745 V757 E758 A761 H767 I770 M771 E775	I741-Y777 PolarHBondContact N-O 3.44Å; A742-Y777 HydrophobicContact CB-CD1 4.35Å; A742-Y777 WeakPolarHBondContact CB-O 3.32Å; A742-Y777 PolarHBondContact N-O 3.33Å; I745-Y777 HydrophobicContact CD1-CE1 4.44Å; V757-Y777 HydrophobicContact CG1-CD1 4.36Å; V757-Y777 HydrophobicContact CG1-CE1 4.24Å; E758-Y777 HydrophobicContact CG-CD2 4.41Å; E758-Y777 HydrophobicContact CG-CE1 4.29Å; E758-Y777 HydrophobicContact CG-CE2 3.87Å; A761-Y777 HydrophobicContact CB-CE1 4.05Å; A761-Y777 WeakPolarHBondContact CB-OH 3.41Å; H767-Y777 AromaticContact ND1-CE2 3.71Å; H767-Y777 AromaticContact ND1-CZ 3.73Å; H767-Y777 PolarHBondContact ND1-OH 3.32Å; I770-Y777 HydrophobicContact CD1-CD1 4.41Å; I770-Y777 HydrophobicContact CD1-CE1 3.83Å; I770-Y777 HydrophobicContact CG2-CD1 3.94Å; I770-Y777 HydrophobicContact CG2-CD2 3.74Å; I770-Y777 HydrophobicContact CG2-CE1 4.11Å; I770-Y777 HydrophobicContact CG2-CE2 3.89Å; I770-Y777 HydrophobicContact CG2-CG 3.75Å; M771-Y777 HydrophobicContact SD-CD2 4.14Å; M771-Y777 HydrophobicContact SD-CE2 4.06Å; E775-Y777 PolarHBondContact O-N 3.45Å
778	R	95.3	Very high	89.3	Confident	197 Å²	197	78.8 Å²	78.8	74%	0.743	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-85.4	-8.7	178.6	-63.8	-176.9	179.4	175.7	1.2	113.6	T740 E775 G776 Q780	T740-R778 WeakPolarHBondContact CG2-O 3.44Å; E775-R778 HydrophobicContact CB-CB 4.33Å; E775-R778 WeakPolarHBondContact O-CB 3.48Å; E775-R778 PolarHBondContact O-N 2.86Å; G776-R778 PolarHBondContact O-N 3.43Å; R778-Q780 PolarHBondContact O-N 3.3Å
779	T	94.8	Very high	89.1	Confident	11 Å²	11	75.5 Å²	75.5	7%	0.067	39%	0.389	C	S	.	.			trans	-49.7	123.4	178.3	-57.7	0	0	0	0	110.6	T740 I741 F773 G776 L786	T740-T779 WeakPolarHBondContact CA-O 3.39Å; I741-T779 HydrophobicContact CD1-CG2 4.32Å; I741-T779 PolarHBondContact N-O 2.9Å; I741-T779 VanDerWaalsContact N-O 3.07Å; F773-T779 HydrophobicContact CB-CG2 4.28Å; F773-T779 WeakPolarHBondContact CB-OG1 3.22Å; F773-T779 HydrophobicContact CD2-CG2 4.28Å; F773-T779 HydrophobicContact CG-CG2 4.38Å; G776-T779 VanDerWaalsContact O-CB 3.27Å; G776-T779 WeakPolarHBondContact O-CB 3.36Å; G776-T779 PolarHBondContact O-N 2.89Å; G776-T779 VanDerWaalsContact O-N 3.15Å; G776-T779 PolarHBondContact O-OG1 3.06Å; T779-L786 HydrophobicContact CG2-CB 4.12Å; T779-L786 HydrophobicContact CG2-CD2 3.78Å
780	Q	93.6	Very high	88.8	Confident	93 Å²	93	75.9 Å²	75.9	44%	0.435	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126.5	177.2	-70.4	-70.5	-23.6	0	0	110.7	R778 L786	R778-Q780 PolarHBondContact O-N 3.3Å; Q780-L786 PolarHBondContact O-N 2.99Å
781	V	93.6	Very high	88.3	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.012	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	169.9	178	-67.9	0	0	0	0	110.9	L736 F737 N738 D739 I741 N744 L786 L788	L736-V781 HydrophobicContact CB-CG2 4.46Å; L736-V781 HydrophobicContact CD1-CB 3.98Å; L736-V781 HydrophobicContact CD1-CG2 4.05Å; F737-V781 VanDerWaalsContact O-O 3.12Å; N738-V781 WeakPolarHBondContact CA-O 3.37Å; D739-V781 PolarHBondContact N-O 3.36Å; D739-V781 VanDerWaalsContact O-CG2 3.31Å; D739-V781 WeakPolarHBondContact O-CG2 3.37Å; D739-V781 PolarHBondContact O-N 3.48Å; I741-V781 HydrophobicContact CD1-CG1 3.93Å; I741-V781 HydrophobicContact CG1-CB 4.41Å; I741-V781 HydrophobicContact CG1-CG1 3.52Å; I741-V781 HydrophobicContact CG1-CG2 3.97Å; N744-V781 WeakPolarHBondContact ND2-CG2 3.39Å; V781-L786 HydrophobicContact CG1-CB 4.36Å; V781-L788 HydrophobicContact CG1-CD1 4.27Å; V781-L788 HydrophobicContact CG1-CD2 4.28Å; V781-L788 HydrophobicContact CG1-CG 4.01Å
782	G	89	Confident	88	Confident	16 Å²	16	73 Å²	73	17%	0.165	38%	0.384	C	S	.	.	S	Bend	trans	129.3	-151.6	-179.2	0	0	0	0	0	112.2	N738	N738-G782 WeakPolarHBondContact OD1-CA 3.39Å
783	E	76.9	Confident	87.9	Confident	163 Å²	163	72.9 Å²	72.9	76%	0.762	37%	0.368	S	S	*	.	S	Bend	trans	-74.7	-35.5	176	-64.4	-178.6	150.9	0	0	112.2	N738	N738-E783 PolarHBondContact OD1-N 3.18Å
784	R	70.2	Confident	87.6	Confident	191 Å²	191	71 Å²	71	72%	0.721	36%	0.36	S	S	*	.	S	Bend	trans	-101.5	-8	-179.1	-65.8	-178.2	176	168.2	-0.3	114.1	Q284 N738	Q284-R784 VanDerWaalsContact NE2-NH2 3.16Å; N738-R784 PolarHBondContact OD1-N 2.93Å
785	G	75.8	Confident	87.6	Confident	26 Å²	26	66.4 Å²	66.4	27%	0.268	33%	0.325	S	S	.	.	S	Bend	trans	-95.6	-163	-179.5	0	0	0	0	0	113.7	K787	G785-K787 PolarHBondContact O-N 3.47Å
786	L	81.4	Confident	87.6	Confident	75 Å²	75	60.6 Å²	60.6	39%	0.393	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-60.8	128	171.5	-175.5	72.4	0	0	0	110	F773 T779 Q780 V781 L788	F773-L786 HydrophobicContact CD1-CD2 3.75Å; F773-L786 HydrophobicContact CD2-CD2 4.24Å; F773-L786 HydrophobicContact CE1-CD2 3.66Å; F773-L786 HydrophobicContact CE2-CD2 4.16Å; F773-L786 HydrophobicContact CG-CD2 4.07Å; F773-L786 HydrophobicContact CZ-CD2 3.88Å; T779-L786 HydrophobicContact CG2-CB 4.12Å; T779-L786 HydrophobicContact CG2-CD2 3.78Å; Q780-L786 PolarHBondContact O-N 2.99Å; V781-L786 HydrophobicContact CG1-CB 4.36Å; L786-L788 HydrophobicContact CD2-CD2 4.29Å; L786-L788 PolarHBondContact O-N 3.35Å
787	K	83.4	Confident	87.5	Confident	173 Å²	173	60.1 Å²	60.1	75%	0.752	29%	0.293	S	S	*	.			trans	-82.2	98.9	175.6	-69.1	-175.4	178.7	-179.8	0	110	G785	G785-K787 PolarHBondContact O-N 3.47Å
788	L	86.9	Confident	87.4	Confident	10 Å²	10	59 Å²	59	5%	0.052	29%	0.289	C	S	.	.			trans	-61.9	145.4	166.2	-61.9	-170.3	0	0	0	110.9	L736 I741 F773 V781 L786 E792 K793 V796	L736-L788 HydrophobicContact CD1-CB 4.39Å; L736-L788 HydrophobicContact CD1-CD1 3.87Å; L736-L788 HydrophobicContact CD1-CG 4.18Å; I741-L788 HydrophobicContact CD1-CD2 4.49Å; F773-L788 HydrophobicContact CE2-CD2 3.74Å; F773-L788 HydrophobicContact CZ-CD2 3.63Å; V781-L788 HydrophobicContact CG1-CD1 4.27Å; V781-L788 HydrophobicContact CG1-CD2 4.28Å; V781-L788 HydrophobicContact CG1-CG 4.01Å; L786-L788 HydrophobicContact CD2-CD2 4.29Å; L786-L788 PolarHBondContact O-N 3.35Å; L788-E792 HydrophobicContact CB-CB 3.97Å; L788-E792 HydrophobicContact CD1-CB 4.34Å; L788-K793 HydrophobicContact CB-CG 3.92Å; L788-K793 VanDerWaalsContact O-CE 3.25Å; L788-K793 WeakPolarHBondContact O-CE 3.34Å; L788-V796 HydrophobicContact CD1-CG2 4.01Å
789	S	87.9	Confident	87.4	Confident	57 Å²	57	49.7 Å²	49.7	40%	0.399	25%	0.253	S	S	.	.			trans	-63.7	165.3	171.1	66.8	0	0	0	0	112.1	G791 E792 K793	S789-G791 VanDerWaalsContact C-N 3.33Å; S789-G791 PolarHBondContact O-N 3.29Å; S789-E792 VanDerWaalsContact CB-OE2 3.22Å; S789-E792 WeakPolarHBondContact CB-OE2 2.93Å; S789-E792 PolarHBondContact N-OE2 2.97Å; S789-E792 PolarHBondContact O-N 2.88Å; S789-E792 WeakPolarHBondContact OG-CB 3.5Å; S789-E792 VanDerWaalsContact OG-CD 3.24Å; S789-E792 VanDerWaalsContact OG-CG 3.27Å; S789-E792 WeakPolarHBondContact OG-CG 3.43Å; S789-E792 PolarHBondContact OG-N 3.48Å; S789-E792 PolarHBondContact OG-OE2 2.63Å; S789-K793 WeakPolarHBondContact O-CG 3.43Å; S789-K793 PolarHBondContact O-N 2.99Å
790	G	83.9	Confident	87.4	Confident	44 Å²	44	50.9 Å²	50.9	45%	0.454	26%	0.257	S	S	.	.	H	α-helix	trans	-55.8	-45.7	177.3	0	0	0	0	0	112.7	K793 Q794	G790-K793 PolarHBondContact O-N 3.38Å; G790-Q794 WeakPolarHBondContact O-CB 3.47Å; G790-Q794 PolarHBondContact O-N 2.91Å
791	G	84.8	Confident	87.4	Confident	7 Å²	7	46.8 Å²	46.8	7%	0.072	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-40.1	177.4	0	0	0	0	0	113.9	S789 Q794 R795 L818	S789-G791 VanDerWaalsContact C-N 3.33Å; S789-G791 PolarHBondContact O-N 3.29Å; G791-Q794 PolarHBondContact O-N 2.71Å; G791-R795 WeakPolarHBondContact O-CG 3.23Å; G791-R795 PolarHBondContact O-N 3.4Å; G791-L818 VanDerWaalsContact CA-CD2 3.44Å
792	E	89.6	Confident	87.4	Confident	47 Å²	47	48.4 Å²	48.4	22%	0.22	25%	0.246	C	C	.	.	H	α-helix	trans	-66.9	-44.5	176	-71.6	163.2	134.2	0	0	111.5	I766 L788 S789 Q794 R795 V796	I766-E792 HydrophobicContact CD1-CB 4.05Å; I766-E792 HydrophobicContact CD1-CG 4.48Å; I766-E792 WeakPolarHBondContact CD1-O 3.23Å; L788-E792 HydrophobicContact CB-CB 3.97Å; L788-E792 HydrophobicContact CD1-CB 4.34Å; S789-E792 VanDerWaalsContact CB-OE2 3.22Å; S789-E792 WeakPolarHBondContact CB-OE2 2.93Å; S789-E792 PolarHBondContact N-OE2 2.97Å; S789-E792 PolarHBondContact O-N 2.88Å; S789-E792 WeakPolarHBondContact OG-CB 3.5Å; S789-E792 VanDerWaalsContact OG-CD 3.24Å; S789-E792 VanDerWaalsContact OG-CG 3.27Å; S789-E792 WeakPolarHBondContact OG-CG 3.43Å; S789-E792 PolarHBondContact OG-N 3.48Å; S789-E792 PolarHBondContact OG-OE2 2.63Å; E792-Q794 VanDerWaalsContact C-N 3.3Å; E792-Q794 PolarHBondContact O-N 3.32Å; E792-R795 PolarHBondContact O-N 2.84Å; E792-R795 VanDerWaalsContact O-N 3.17Å; E792-V796 WeakPolarHBondContact O-CG2 3.44Å; E792-V796 PolarHBondContact O-N 3.47Å
793	K	90.1	Very high	87.6	Confident	78 Å²	78	48.1 Å²	48.1	34%	0.339	24%	0.241	S	C	.	.	H	α-helix	trans	-55	-46.6	173	-71.9	176.1	177.2	176.3	0	111.2	T734 L736 L788 S789 G790 R795 V796 A797	T734-K793 HydrophobicContact CG2-CB 4.41Å; T734-K793 WeakPolarHBondContact CG2-O 3.43Å; L736-K793 HydrophobicContact CD1-CG 4.09Å; L736-K793 HydrophobicContact CG-CG 4.41Å; L788-K793 HydrophobicContact CB-CG 3.92Å; L788-K793 VanDerWaalsContact O-CE 3.25Å; L788-K793 WeakPolarHBondContact O-CE 3.34Å; S789-K793 WeakPolarHBondContact O-CG 3.43Å; S789-K793 PolarHBondContact O-N 2.99Å; G790-K793 PolarHBondContact O-N 3.38Å; K793-R795 VanDerWaalsContact C-N 3.35Å; K793-R795 PolarHBondContact O-N 3.35Å; K793-V796 WeakPolarHBondContact O-CB 3.17Å; K793-V796 PolarHBondContact O-N 3Å; K793-V796 VanDerWaalsContact O-N 3.1Å; K793-A797 PolarHBondContact O-N 3.47Å
794	Q	88.9	Confident	88.5	Confident	5 Å²	5	43.4 Å²	43.4	2%	0.023	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-39.5	179.2	-156.6	129.7	54.8	0	0	112	P731 Q732 G790 G791 E792 V796 A797 I798 A814 I826	P731-Q794 PolarHBondContact O-NE2 3.35Å; Q732-Q794 PolarHBondContact O-NE2 2.96Å; G790-Q794 WeakPolarHBondContact O-CB 3.47Å; G790-Q794 PolarHBondContact O-N 2.91Å; G791-Q794 PolarHBondContact O-N 2.71Å; E792-Q794 VanDerWaalsContact C-N 3.3Å; E792-Q794 PolarHBondContact O-N 3.32Å; Q794-V796 VanDerWaalsContact C-N 3.35Å; Q794-V796 PolarHBondContact O-N 3.11Å; Q794-A797 WeakPolarHBondContact O-CB 3.26Å; Q794-A797 PolarHBondContact O-N 3.39Å; Q794-A797 VanDerWaalsContact O-N 3.16Å; Q794-I798 WeakPolarHBondContact O-CG1 3.08Å; Q794-I798 PolarHBondContact O-N 3.12Å; Q794-A814 PolarHBondContact NE2-O 3.14Å; Q794-A814 PolarHBondContact OE1-O 3.05Å; Q794-I826 HydrophobicContact CB-CD1 4.47Å
795	R	90.9	Very high	89.5	Confident	40 Å²	40	37.1 Å²	37.1	15%	0.151	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-32.7	172.5	-67.2	177.1	-162.4	-128.7	2	113	G765 I766 G791 E792 K793 I798 A799 I826	G765-R795 WeakPolarHBondContact O-CD 3.43Å; G765-R795 PolarHBondContact O-NH1 2.95Å; I766-R795 HydrophobicContact CB-CB 3.86Å; I766-R795 HydrophobicContact CD1-CB 3.83Å; I766-R795 HydrophobicContact CG1-CB 4.38Å; I766-R795 HydrophobicContact CG2-CB 4.28Å; G791-R795 WeakPolarHBondContact O-CG 3.23Å; G791-R795 PolarHBondContact O-N 3.4Å; E792-R795 PolarHBondContact O-N 2.84Å; E792-R795 VanDerWaalsContact O-N 3.17Å; K793-R795 VanDerWaalsContact C-N 3.35Å; K793-R795 PolarHBondContact O-N 3.35Å; R795-I798 PolarHBondContact O-N 3.03Å; R795-A799 WeakPolarHBondContact O-CB 3.33Å; R795-A799 PolarHBondContact O-N 3.31Å; R795-I826 HydrophobicContact CG-CD1 4.09Å; R795-I826 HydrophobicContact CG-CG1 3.88Å
796	V	93.5	Very high	90.3	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-41.4	169.6	175.6	0	0	0	0	111	L736 N744 I745 I766 L788 E792 K793 Q794 A799 R800	L736-V796 HydrophobicContact CD2-CB 4.26Å; L736-V796 HydrophobicContact CD2-CG1 3.85Å; N744-V796 HydrophobicContact CB-CG1 4.41Å; I745-V796 HydrophobicContact CG1-CG1 4.04Å; I766-V796 HydrophobicContact CD1-CG2 3.73Å; L788-V796 HydrophobicContact CD1-CG2 4.01Å; E792-V796 WeakPolarHBondContact O-CG2 3.44Å; E792-V796 PolarHBondContact O-N 3.47Å; K793-V796 WeakPolarHBondContact O-CB 3.17Å; K793-V796 PolarHBondContact O-N 3Å; K793-V796 VanDerWaalsContact O-N 3.1Å; Q794-V796 VanDerWaalsContact C-N 3.35Å; Q794-V796 PolarHBondContact O-N 3.11Å; V796-A799 PolarHBondContact O-N 3.13Å; V796-R800 WeakPolarHBondContact O-CG 3.31Å; V796-R800 PolarHBondContact O-N 2.98Å
797	A	92.6	Very high	90.9	Very high	3 Å²	3	35.3 Å²	35.3	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-64.7	-37.5	173.9	0	0	0	0	0	113.3	V730 T734 K793 Q794 R800 T801	V730-A797 HydrophobicContact CG1-CB 4.3Å; T734-A797 HydrophobicContact CG2-CB 3.74Å; T734-A797 VanDerWaalsContact OG1-CB 3.27Å; T734-A797 WeakPolarHBondContact OG1-CB 3.26Å; K793-A797 PolarHBondContact O-N 3.47Å; Q794-A797 WeakPolarHBondContact O-CB 3.26Å; Q794-A797 PolarHBondContact O-N 3.39Å; Q794-A797 VanDerWaalsContact O-N 3.16Å; A797-R800 PolarHBondContact O-N 3.4Å; A797-T801 PolarHBondContact O-N 2.69Å; A797-T801 PolarHBondContact O-OG1 2.99Å
798	I	92.4	Very high	91.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-64.3	-45.6	173.2	-66.2	166.4	0	0	0	109.9	V730 A764 Q794 R795 R800 T801 I802 I826 L830 V833	V730-I798 HydrophobicContact CG1-CG1 4.19Å; V730-I798 HydrophobicContact CG2-CG1 4.36Å; A764-I798 HydrophobicContact CB-CB 4.28Å; A764-I798 HydrophobicContact CB-CG2 3.93Å; Q794-I798 WeakPolarHBondContact O-CG1 3.08Å; Q794-I798 PolarHBondContact O-N 3.12Å; R795-I798 PolarHBondContact O-N 3.03Å; I798-R800 PolarHBondContact O-N 2.97Å; I798-T801 CarbonylContact O-C 3.5Å; I798-T801 WeakPolarHBondContact O-CB 3.49Å; I798-T801 PolarHBondContact O-N 2.88Å; I798-I802 HydrophobicContact CG2-CD1 3.89Å; I798-I802 HydrophobicContact CG2-CG1 4.37Å; I798-I802 WeakPolarHBondContact O-CG1 3.37Å; I798-I802 PolarHBondContact O-N 3.06Å; I798-I826 HydrophobicContact CD1-CG2 3.87Å; I798-L830 HydrophobicContact CD1-CD2 3.8Å; I798-L830 HydrophobicContact CD1-CG 3.87Å; I798-L830 HydrophobicContact CG1-CD2 3.81Å; I798-L830 HydrophobicContact CG1-CG 4.43Å; I798-V833 HydrophobicContact CG2-CG2 3.9Å
799	A	94.5	Very high	91.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-43.6	176	0	0	0	0	0	112.5	I745 A764 R795 V796 T801 I802 L803	I745-A799 HydrophobicContact CD1-CB 4.25Å; I745-A799 HydrophobicContact CG1-CB 4.15Å; I745-A799 HydrophobicContact CG2-CB 3.91Å; A764-A799 HydrophobicContact CB-CB 3.8Å; R795-A799 WeakPolarHBondContact O-CB 3.33Å; R795-A799 PolarHBondContact O-N 3.31Å; V796-A799 PolarHBondContact O-N 3.13Å; A799-T801 VanDerWaalsContact C-N 3.27Å; A799-T801 PolarHBondContact O-N 3.27Å; A799-I802 PolarHBondContact O-N 3.46Å; A799-L803 WeakPolarHBondContact O-CB 3.39Å; A799-L803 PolarHBondContact O-N 3.28Å
800	R	95.1	Very high	92.3	Very high	36 Å²	36	24 Å²	24	14%	0.136	13%	0.134	C	C	.	.	H	α-helix	trans	-55.3	-43	171.3	-72	171	-180	164.8	-2.1	111.6	V735 N744 G748 V796 A797 I798 K804	V735-R800 PolarHBondContact O-NH1 3.32Å; V735-R800 PolarHBondContact O-NH2 3.04Å; N744-R800 VanDerWaalsContact O-CG 3.29Å; N744-R800 WeakPolarHBondContact O-CG 3.34Å; N744-R800 PolarHBondContact O-NE 3.25Å; N744-R800 PolarHBondContact OD1-NH2 2.83Å; G748-R800 WeakPolarHBondContact CA-O 3.47Å; V796-R800 WeakPolarHBondContact O-CG 3.31Å; V796-R800 PolarHBondContact O-N 2.98Å; A797-R800 PolarHBondContact O-N 3.4Å; I798-R800 PolarHBondContact O-N 2.97Å; R800-K804 WeakPolarHBondContact O-CB 3.34Å; R800-K804 PolarHBondContact O-N 3.33Å
801	T	93.4	Very high	92.7	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.043	12%	0.115	C	C	.	.	H	α-helix	trans	-72	-38.3	-178.5	-55.5	0	0	0	0	112.2	V730 A797 I798 A799 K804 A805 P806 V833	V730-T801 HydrophobicContact CG2-CG2 4.28Å; A797-T801 PolarHBondContact O-N 2.69Å; A797-T801 PolarHBondContact O-OG1 2.99Å; I798-T801 CarbonylContact O-C 3.5Å; I798-T801 WeakPolarHBondContact O-CB 3.49Å; I798-T801 PolarHBondContact O-N 2.88Å; A799-T801 VanDerWaalsContact C-N 3.27Å; A799-T801 PolarHBondContact O-N 3.27Å; T801-K804 PolarHBondContact O-N 3.12Å; T801-A805 PolarHBondContact O-N 3.47Å; T801-P806 HydrophobicContact CG2-CG 4.16Å; T801-P806 WeakPolarHBondContact O-CD 3.23Å; T801-V833 HydrophobicContact CG2-CG1 4.41Å
802	I	93.3	Very high	93	Very high	36 Å²	36	23.1 Å²	23.1	19%	0.185	12%	0.118	C	C	.	.	H	α-helix	trans	-61.2	-49.6	172.2	-68.8	169.9	0	0	0	110.1	A760 A763 A764 I798 A799 K804 A805 V833	A760-I802 HydrophobicContact CB-CB 4.41Å; A760-I802 HydrophobicContact CB-CG2 4.06Å; A763-I802 HydrophobicContact CB-CD1 3.8Å; A763-I802 HydrophobicContact CB-CG2 4.26Å; A764-I802 HydrophobicContact CB-CD1 4.05Å; I798-I802 HydrophobicContact CG2-CD1 3.89Å; I798-I802 HydrophobicContact CG2-CG1 4.37Å; I798-I802 WeakPolarHBondContact O-CG1 3.37Å; I798-I802 PolarHBondContact O-N 3.06Å; A799-I802 PolarHBondContact O-N 3.46Å; I802-K804 VanDerWaalsContact C-N 3.29Å; I802-K804 PolarHBondContact O-N 2.79Å; I802-A805 WeakPolarHBondContact O-CA 3.48Å; I802-A805 PolarHBondContact O-N 2.93Å; I802-V833 HydrophobicContact CD1-CG2 3.65Å; I802-V833 HydrophobicContact CG1-CB 4.38Å; I802-V833 HydrophobicContact CG1-CG1 4Å; I802-V833 HydrophobicContact CG1-CG2 3.45Å; I802-V833 VanDerWaalsContact CG1-CG2 3.45Å
803	L	94.7	Very high	92.7	Very high	11 Å²	11	22 Å²	22	6%	0.058	11%	0.113	C	C	.	.	H	α-helix	trans	-64.4	-32.8	-178.4	-169.6	69.1	0	0	0	113	I745 R749 A752 E756 V757 A760 A799 A805	I745-L803 HydrophobicContact CG2-CD2 4.3Å; I745-L803 WeakPolarHBondContact O-CD2 3.41Å; R749-L803 HydrophobicContact CB-CG 4.29Å; A752-L803 HydrophobicContact CB-CD1 3.87Å; A752-L803 HydrophobicContact CB-CD2 3.85Å; A752-L803 HydrophobicContact CB-CG 4.09Å; E756-L803 HydrophobicContact CB-CD1 3.79Å; E756-L803 WeakPolarHBondContact O-CD1 3.34Å; V757-L803 HydrophobicContact CG2-CD2 3.92Å; A760-L803 HydrophobicContact CB-CB 3.97Å; A760-L803 HydrophobicContact CB-CD1 4.14Å; A799-L803 WeakPolarHBondContact O-CB 3.39Å; A799-L803 PolarHBondContact O-N 3.28Å; L803-A805 VanDerWaalsContact C-N 3.25Å; L803-A805 PolarHBondContact O-N 3.04Å
804	K	94.3	Very high	92	Very high	64 Å²	64	18.7 Å²	18.7	28%	0.278	10%	0.099	S	C	.	.	H	α-helix	trans	-66.5	-26.7	172.4	-174.7	174.7	-178.8	-177	0	112.8	R724 S725 I727 G748 R800 T801 I802	R724-K804 WeakPolarHBondContact O-CE 3.32Å; R724-K804 PolarHBondContact O-NZ 2.9Å; S725-K804 WeakPolarHBondContact O-CE 3.5Å; I727-K804 PolarHBondContact O-NZ 3.3Å; G748-K804 WeakPolarHBondContact O-CB 3.45Å; R800-K804 WeakPolarHBondContact O-CB 3.34Å; R800-K804 PolarHBondContact O-N 3.33Å; T801-K804 PolarHBondContact O-N 3.12Å; I802-K804 VanDerWaalsContact C-N 3.29Å; I802-K804 PolarHBondContact O-N 2.79Å
805	A	92	Very high	91.5	Very high	58 Å²	58	19 Å²	19	48%	0.479	10%	0.101	S	C	.	.			trans	47	52.1	-176.4	0	0	0	0	0	115.8	T801 I802 L803	T801-A805 PolarHBondContact O-N 3.47Å; I802-A805 WeakPolarHBondContact O-CA 3.48Å; I802-A805 PolarHBondContact O-N 2.93Å; L803-A805 VanDerWaalsContact C-N 3.25Å; L803-A805 PolarHBondContact O-N 3.04Å
806	P	93.8	Very high	90.4	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.006	11%	0.105	C	C	.	.			trans	-79.8	150.7	-177	33.2	-34.8	0	0	0	113.2	H726 G728 T801 I809 R837	H726-P806 WeakPolarHBondContact O-CB 3.39Å; G728-P806 VanDerWaalsContact CA-CG 3.43Å; T801-P806 HydrophobicContact CG2-CG 4.16Å; T801-P806 WeakPolarHBondContact O-CD 3.23Å; P806-I809 HydrophobicContact CG-CG1 4.4Å; P806-R837 WeakPolarHBondContact O-CD 3.33Å; P806-R837 PolarHBondContact O-NH1 2.95Å
807	D	93.6	Very high	88.9	Confident	62 Å²	62	22 Å²	22	33%	0.332	13%	0.133	S	C	.	.	S	Bend	trans	-80	-28.8	-179.4	-49.1	-82.5	0	0	0	114	F646 H726 R837 T838	F646-D807 HydrophobicContact CD1-CB 4.24Å; F646-D807 HydrophobicContact CD2-CB 4.4Å; F646-D807 HydrophobicContact CE1-CB 3.55Å; F646-D807 HydrophobicContact CE2-CB 3.73Å; F646-D807 HydrophobicContact CZ-CB 3.26Å; H726-D807 IonicContact CE1-OD2 3.81Å; H726-D807 IonicContact CG-OD2 3.96Å; H726-D807 IonicContact ND1-OD2 2.7Å; H726-D807 PolarHBondContact ND1-OD2 3.42Å; H726-D807 PolarHBondContact O-N 3.29Å; H726-D807 VanDerWaalsContact O-N 3.09Å; D807-R837 WeakPolarHBondContact O-CB 3.41Å; D807-T838 PolarHBondContact O-N 3.5Å
808	I	95.4	Very high	87.8	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.6	174.8	-61.8	169.2	0	0	0	108.5	F646 I651 I710 H726 I727 G728 L810 T838	F646-I808 HydrophobicContact CE2-CD1 4.08Å; F646-I808 HydrophobicContact CE2-CG1 4.03Å; I651-I808 HydrophobicContact CD1-CD1 4.07Å; I651-I808 HydrophobicContact CD1-CG1 4.38Å; I651-I808 HydrophobicContact CD1-CG2 3.9Å; I651-I808 HydrophobicContact CG1-CD1 4.24Å; I710-I808 HydrophobicContact CD1-CD1 4.03Å; I710-I808 HydrophobicContact CG2-CD1 4.1Å; H726-I808 PolarHBondContact O-N 3.27Å; I727-I808 CarbonylContact C-O 3.54Å; I727-I808 WeakPolarHBondContact CA-O 3.36Å; I727-I808 HydrophobicContact CG1-CB 4.21Å; I727-I808 HydrophobicContact CG1-CD1 4.36Å; I727-I808 HydrophobicContact CG1-CG2 4.43Å; I727-I808 HydrophobicContact CG2-CG2 4.44Å; G728-I808 PolarHBondContact N-O 3.35Å; I808-L810 HydrophobicContact CG2-CD2 4.02Å; I808-T838 WeakPolarHBondContact CA-O 3.46Å
809	I	95.4	Very high	86.8	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.1	178.8	-67.5	162.5	0	0	0	110.6	P806 L811 V833 R837 T838 T839 I840	P806-I809 HydrophobicContact CG-CG1 4.4Å; I809-L811 HydrophobicContact CG2-CD2 3.61Å; I809-L811 HydrophobicContact CG2-CG 4.07Å; I809-V833 HydrophobicContact CD1-CG1 3.82Å; I809-V833 WeakPolarHBondContact CD1-O 3.46Å; I809-R837 HydrophobicContact CD1-CB 4.08Å; I809-R837 VanDerWaalsContact CD1-CD 3.45Å; I809-R837 HydrophobicContact CD1-CG 4.43Å; I809-T838 PolarHBondContact N-O 2.83Å; I809-T839 HydrophobicContact CB-CG2 4.45Å; I809-T839 HydrophobicContact CG2-CG2 4.39Å; I809-T839 CarbonylContact O-C 3.53Å; I809-T839 WeakPolarHBondContact O-CA 3.34Å; I809-I840 PolarHBondContact O-N 3.34Å
810	L	95.3	Very high	85.7	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	123.3	173.5	-49.8	-174.1	0	0	0	109.1	L694 L697 I727 G728 V729 V730 I808 I840	L694-L810 HydrophobicContact CB-CD1 4.33Å; L694-L810 HydrophobicContact CD1-CB 4.5Å; L694-L810 HydrophobicContact CD2-CB 4.13Å; L694-L810 HydrophobicContact CD2-CD1 4.3Å; L694-L810 HydrophobicContact CD2-CD2 4.08Å; L694-L810 HydrophobicContact CD2-CG 4.38Å; L697-L810 HydrophobicContact CD2-CD1 4.27Å; L697-L810 HydrophobicContact CD2-CD2 3.64Å; I727-L810 HydrophobicContact CG2-CD1 3.63Å; I727-L810 HydrophobicContact CG2-CG 3.71Å; G728-L810 PolarHBondContact O-N 3.43Å; V729-L810 CarbonylContact C-O 3.56Å; V729-L810 WeakPolarHBondContact CA-O 3.43Å; V729-L810 HydrophobicContact CG1-CB 4.47Å; V729-L810 HydrophobicContact CG2-CB 4.29Å; V729-L810 HydrophobicContact CG2-CD1 4.23Å; V730-L810 PolarHBondContact N-O 3.41Å; I808-L810 HydrophobicContact CG2-CD2 4.02Å; L810-I840 WeakPolarHBondContact CA-O 3.32Å; L810-I840 HydrophobicContact CD2-CB 3.91Å; L810-I840 HydrophobicContact CD2-CD1 4.21Å; L810-I840 HydrophobicContact CD2-CG1 4.2Å
811	L	92.9	Very high	84.4	Confident	10 Å²	10	35 Å²	35	5%	0.052	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.4	173.9	-52.6	-175.3	0	0	0	108.3	V730 I809 A814 L830 I840 V841 V842	V730-L811 HydrophobicContact CB-CD2 3.7Å; V730-L811 HydrophobicContact CG2-CD2 3.64Å; I809-L811 HydrophobicContact CG2-CD2 3.61Å; I809-L811 HydrophobicContact CG2-CG 4.07Å; L811-A814 HydrophobicContact CB-CB 4.32Å; L811-L830 HydrophobicContact CD1-CD1 4.35Å; L811-L830 HydrophobicContact CD1-CD2 4.07Å; L811-L830 HydrophobicContact CD2-CD2 3.75Å; L811-I840 PolarHBondContact N-O 3.49Å; L811-V841 HydrophobicContact CB-CG1 4.21Å; L811-V841 HydrophobicContact CB-CG2 4.38Å; L811-V841 HydrophobicContact CD1-CG1 4.46Å; L811-V841 HydrophobicContact CD1-CG2 3.95Å; L811-V841 HydrophobicContact CG-CG2 4.33Å; L811-V842 PolarHBondContact O-N 2.65Å
812	D	91.3	Very high	83.4	Confident	23 Å²	23	37.3 Å²	37.3	12%	0.123	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	95.5	178.7	-159	18.1	0	0	0	108.6	S691 L694 V730 P731 Q732 A814	S691-D812 WeakPolarHBondContact CB-OD1 3.47Å; S691-D812 PolarHBondContact OG-OD1 3.37Å; L694-D812 HydrophobicContact CD1-CB 3.64Å; V730-D812 PolarHBondContact O-N 2.95Å; P731-D812 CarbonylContact C-O 3.57Å; Q732-D812 VanDerWaalsContact CA-O 3.22Å; Q732-D812 WeakPolarHBondContact CA-O 3.11Å; Q732-D812 WeakPolarHBondContact CB-O 3.18Å; Q732-D812 PolarHBondContact N-O 2.8Å; D812-A814 PolarHBondContact O-N 3.44Å; D812-A814 VanDerWaalsContact O-N 3.11Å
813	E	84.3	Confident	82.5	Confident	25 Å²	25	36.1 Å²	36.1	12%	0.117	22%	0.222	C	C	.	.	S	Bend	trans	50.4	36.2	-180	-59	-165.2	179.3	0	0	115.5	Q732 T815 S816 V842 H844	Q732-E813 HydrophobicContact CB-CB 4.3Å; Q732-E813 HydrophobicContact CG-CB 3.96Å; Q732-E813 PolarHBondContact NE2-OE2 2.83Å; E813-T815 PolarHBondContact O-N 2.92Å; E813-S816 PolarHBondContact O-N 2.78Å; E813-S816 PolarHBondContact O-OG 2.77Å; E813-V842 WeakPolarHBondContact CA-O 3.25Å; E813-V842 HydrophobicContact CG-CG1 4.06Å; E813-V842 PolarHBondContact N-O 2.99Å; E813-H844 HydrophobicContact CG-CB 4.48Å
814	A	74.8	Confident	81.7	Confident	7 Å²	7	44.9 Å²	44.9	6%	0.058	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	13.2	-169.6	0	0	0	0	0	117.5	V730 Q794 L811 D812 L830	V730-A814 HydrophobicContact CB-CB 4.37Å; V730-A814 HydrophobicContact CG1-CB 3.8Å; Q794-A814 PolarHBondContact NE2-O 3.14Å; Q794-A814 PolarHBondContact OE1-O 3.05Å; L811-A814 HydrophobicContact CB-CB 4.32Å; D812-A814 PolarHBondContact O-N 3.44Å; D812-A814 VanDerWaalsContact O-N 3.11Å; A814-L830 HydrophobicContact CB-CD1 4.23Å
815	T	77.6	Confident	80.9	Confident	11 Å²	11	43.7 Å²	43.7	7%	0.067	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	2.4	170.6	70.3	0	0	0	0	114.7	E813 A817 L818 E823 I826 Q827 L830 T848	E813-T815 PolarHBondContact O-N 2.92Å; T815-A817 VanDerWaalsContact C-N 3.34Å; T815-A817 PolarHBondContact O-N 3.4Å; T815-L818 HydrophobicContact CG2-CD1 4.41Å; T815-L818 PolarHBondContact O-N 3.12Å; T815-E823 VanDerWaalsContact CB-OE1 3.23Å; T815-E823 WeakPolarHBondContact CB-OE1 3.48Å; T815-E823 HydrophobicContact CG2-CG 4.13Å; T815-E823 PolarHBondContact OG1-OE1 3.39Å; T815-I826 HydrophobicContact CG2-CG2 4.33Å; T815-Q827 HydrophobicContact CG2-CG 4.14Å; T815-L830 HydrophobicContact CG2-CD1 4.44Å; T815-T848 WeakPolarHBondContact OG1-CG2 3.24Å
816	S	69	Low	80.4	Confident	33 Å²	33	40.9 Å²	40.9	23%	0.231	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-37.3	-170.2	60.5	0	0	0	0	113.6	E813 L818 R845	E813-S816 PolarHBondContact O-N 2.78Å; E813-S816 PolarHBondContact O-OG 2.77Å; S816-L818 VanDerWaalsContact C-N 3.34Å; S816-L818 PolarHBondContact O-N 2.93Å; S816-R845 PolarHBondContact O-NH2 2.97Å
817	A	62.3	Low	79.8	Confident	72 Å²	72	44 Å²	44	60%	0.595	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	20.6	-176	0	0	0	0	0	114.9	T815	T815-A817 VanDerWaalsContact C-N 3.34Å; T815-A817 PolarHBondContact O-N 3.4Å
818	L	69.6	Low	79.3	Confident	8 Å²	8	43.6 Å²	43.6	4%	0.042	25%	0.253	C	S	.	.	S	Bend	trans	-117.3	143.8	-170.9	-56.3	178.7	0	0	0	114.2	G791 T815 S816 E823 I826 R845	G791-L818 VanDerWaalsContact CA-CD2 3.44Å; T815-L818 HydrophobicContact CG2-CD1 4.41Å; T815-L818 PolarHBondContact O-N 3.12Å; S816-L818 VanDerWaalsContact C-N 3.34Å; S816-L818 PolarHBondContact O-N 2.93Å; L818-E823 HydrophobicContact CB-CB 4.43Å; L818-I826 HydrophobicContact CD1-CB 4.15Å; L818-I826 HydrophobicContact CD1-CD1 3.5Å; L818-I826 VanDerWaalsContact CD1-CD1 3.5Å; L818-I826 HydrophobicContact CD1-CG1 4.4Å; L818-I826 HydrophobicContact CD1-CG2 4.03Å; L818-I826 HydrophobicContact CD2-CD1 4.16Å; L818-I826 HydrophobicContact CG-CD1 4.49Å; L818-R845 PolarHBondContact O-NH1 3.35Å; L818-R845 PolarHBondContact O-NH2 3.49Å
819	D	70.8	Confident	78.7	Confident	111 Å²	111	44.1 Å²	44.1	59%	0.594	26%	0.257	S	S	*	.			trans	-63.3	148.9	165.1	-48.7	-51.3	0	0	0	111.3	S821 N822 E823	D819-S821 VanDerWaalsContact C-N 3.26Å; D819-S821 PolarHBondContact O-N 2.92Å; D819-S821 VanDerWaalsContact O-N 3.14Å; D819-N822 PolarHBondContact O-N 3.48Å; D819-E823 PolarHBondContact O-N 3.43Å
820	T	70.6	Confident	78.2	Confident	101 Å²	101	44.7 Å²	44.7	62%	0.62	26%	0.26	S	S	*	.	H	α-helix	trans	-60.1	-30.1	-171	-20.9	0	0	0	0	114.2
821	S	68.1	Low	77.6	Confident	92 Å²	92	47.7 Å²	47.7	64%	0.643	29%	0.285	S	S	*	.	H	α-helix	trans	-74.3	-41.5	175.6	53.9	0	0	0	0	112.3	D819	D819-S821 VanDerWaalsContact C-N 3.26Å; D819-S821 PolarHBondContact O-N 2.92Å; D819-S821 VanDerWaalsContact O-N 3.14Å
822	N	71.7	Confident	77.1	Confident	56 Å²	56	54.6 Å²	54.6	30%	0.299	31%	0.314	S	S	.	.	H	α-helix	trans	-69.4	-36.3	176.3	-82.4	-45.6	0	0	0	112.1	D819 R824 A825 I826	D819-N822 PolarHBondContact O-N 3.48Å; N822-R824 PolarHBondContact O-N 2.96Å; N822-A825 PolarHBondContact O-N 2.88Å; N822-I826 PolarHBondContact O-N 2.95Å
823	E	75.6	Confident	76.7	Confident	12 Å²	12	54 Å²	54	6%	0.056	31%	0.312	C	S	.	.	H	α-helix	trans	-56.3	-49.7	178.4	174.9	164.6	-142	0	0	112.2	T815 L818 D819 A825 I826 Q827 R845 T848	T815-E823 VanDerWaalsContact CB-OE1 3.23Å; T815-E823 WeakPolarHBondContact CB-OE1 3.48Å; T815-E823 HydrophobicContact CG2-CG 4.13Å; T815-E823 PolarHBondContact OG1-OE1 3.39Å; L818-E823 HydrophobicContact CB-CB 4.43Å; D819-E823 PolarHBondContact O-N 3.43Å; E823-A825 VanDerWaalsContact C-N 3.33Å; E823-A825 PolarHBondContact O-N 3.48Å; E823-I826 PolarHBondContact O-N 3.48Å; E823-I826 VanDerWaalsContact O-N 3.17Å; E823-Q827 HydrophobicContact CG-CG 4.18Å; E823-Q827 WeakPolarHBondContact O-CG 3.34Å; E823-Q827 PolarHBondContact O-N 3.01Å; E823-Q827 PolarHBondContact OE1-NE2 3.39Å; E823-R845 WeakPolarHBondContact OE1-CD 3.23Å; E823-R845 IonicContact OE1-NH1 4Å; E823-R845 IonicContact OE2-CZ 3.53Å; E823-R845 IonicContact OE2-NH1 2.69Å; E823-R845 PolarHBondContact OE2-NH1 2.76Å; E823-T848 WeakPolarHBondContact OE1-CG2 3.29Å
824	R	77.3	Confident	76.9	Confident	194 Å²	194	53.7 Å²	53.7	73%	0.732	31%	0.312	S	S	*	.	H	α-helix	trans	-60	-40.9	-178.9	-69	-177.7	-177.6	160.4	2.3	112.9	N822 A828	N822-R824 PolarHBondContact O-N 2.96Å; R824-A828 WeakPolarHBondContact O-CB 3.12Å; R824-A828 PolarHBondContact O-N 3.4Å
825	A	77	Confident	77.4	Confident	39 Å²	39	56 Å²	56	32%	0.322	33%	0.33	S	S	.	.	H	α-helix	trans	-68.7	-35.5	178.4	0	0	0	0	0	112.4	N822 E823 S829	N822-A825 PolarHBondContact O-N 2.88Å; E823-A825 VanDerWaalsContact C-N 3.33Å; E823-A825 PolarHBondContact O-N 3.48Å; A825-S829 PolarHBondContact O-N 3.24Å; A825-S829 VanDerWaalsContact O-N 3.16Å; A825-S829 PolarHBondContact O-OG 3.02Å
826	I	82.5	Confident	77.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-73.5	-40.5	176	-78.7	165.1	0	0	0	111.1	Q794 R795 I798 T815 L818 N822 E823 A828 S829 L830	Q794-I826 HydrophobicContact CB-CD1 4.47Å; R795-I826 HydrophobicContact CG-CD1 4.09Å; R795-I826 HydrophobicContact CG-CG1 3.88Å; I798-I826 HydrophobicContact CD1-CG2 3.87Å; T815-I826 HydrophobicContact CG2-CG2 4.33Å; L818-I826 HydrophobicContact CD1-CB 4.15Å; L818-I826 HydrophobicContact CD1-CD1 3.5Å; L818-I826 VanDerWaalsContact CD1-CD1 3.5Å; L818-I826 HydrophobicContact CD1-CG1 4.4Å; L818-I826 HydrophobicContact CD1-CG2 4.03Å; L818-I826 HydrophobicContact CD2-CD1 4.16Å; L818-I826 HydrophobicContact CG-CD1 4.49Å; N822-I826 PolarHBondContact O-N 2.95Å; E823-I826 PolarHBondContact O-N 3.48Å; E823-I826 VanDerWaalsContact O-N 3.17Å; I826-A828 VanDerWaalsContact C-N 3.34Å; I826-A828 PolarHBondContact O-N 3.39Å; I826-S829 WeakPolarHBondContact O-CB 3.48Å; I826-S829 PolarHBondContact O-N 2.87Å; I826-S829 VanDerWaalsContact O-N 3.15Å; I826-L830 HydrophobicContact CG2-CD1 3.95Å; I826-L830 HydrophobicContact CG2-CG 4.4Å; I826-L830 WeakPolarHBondContact O-CB 3.38Å; I826-L830 WeakPolarHBondContact O-CG 3.32Å; I826-L830 PolarHBondContact O-N 3.29Å
827	Q	81.9	Confident	78.8	Confident	66 Å²	66	65 Å²	65	31%	0.308	37%	0.37	S	S	.	.	H	α-helix	trans	-58.2	-43.4	170.5	-73.5	-178	5.1	0	0	112	T815 E823 S829 L830 A831	T815-Q827 HydrophobicContact CG2-CG 4.14Å; E823-Q827 HydrophobicContact CG-CG 4.18Å; E823-Q827 WeakPolarHBondContact O-CG 3.34Å; E823-Q827 PolarHBondContact O-N 3.01Å; E823-Q827 PolarHBondContact OE1-NE2 3.39Å; Q827-S829 VanDerWaalsContact C-N 3.28Å; Q827-S829 PolarHBondContact O-N 2.74Å; Q827-L830 PolarHBondContact O-N 2.92Å; Q827-A831 WeakPolarHBondContact O-CB 3.46Å; Q827-A831 PolarHBondContact O-N 3.02Å
828	A	81.7	Confident	80.4	Confident	54 Å²	54	61.6 Å²	61.6	45%	0.446	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-33.2	176.4	0	0	0	0	0	112.9	R824 I826 K832	R824-A828 WeakPolarHBondContact O-CB 3.12Å; R824-A828 PolarHBondContact O-N 3.4Å; I826-A828 VanDerWaalsContact C-N 3.34Å; I826-A828 PolarHBondContact O-N 3.39Å; A828-K832 WeakPolarHBondContact O-CG 3.17Å
829	S	83.1	Confident	81.6	Confident	10 Å²	10	61.3 Å²	61.3	7%	0.07	34%	0.341	C	S	.	.	H	α-helix	trans	-71.4	-49.1	173.1	-56.8	0	0	0	0	110.8	A825 I826 Q827 A831 K832 V833	A825-S829 PolarHBondContact O-N 3.24Å; A825-S829 VanDerWaalsContact O-N 3.16Å; A825-S829 PolarHBondContact O-OG 3.02Å; I826-S829 WeakPolarHBondContact O-CB 3.48Å; I826-S829 PolarHBondContact O-N 2.87Å; I826-S829 VanDerWaalsContact O-N 3.15Å; Q827-S829 VanDerWaalsContact C-N 3.28Å; Q827-S829 PolarHBondContact O-N 2.74Å; S829-A831 VanDerWaalsContact C-N 3.33Å; S829-A831 PolarHBondContact O-N 3.05Å; S829-K832 WeakPolarHBondContact O-CB 3.44Å; S829-K832 PolarHBondContact O-N 3.39Å; S829-K832 VanDerWaalsContact O-N 3.09Å; S829-V833 WeakPolarHBondContact O-CG2 3.46Å; S829-V833 PolarHBondContact O-N 3.02Å
830	L	84.3	Confident	82.7	Confident	14 Å²	14	56 Å²	56	7%	0.073	31%	0.313	C	S	.	.	H	α-helix	trans	-56.1	-43.9	177	-73.4	169.3	0	0	0	112.3	V730 I798 L811 A814 T815 I826 Q827 K832 V833 C834	V730-L830 HydrophobicContact CG2-CD2 4.34Å; I798-L830 HydrophobicContact CD1-CD2 3.8Å; I798-L830 HydrophobicContact CD1-CG 3.87Å; I798-L830 HydrophobicContact CG1-CD2 3.81Å; I798-L830 HydrophobicContact CG1-CG 4.43Å; L811-L830 HydrophobicContact CD1-CD1 4.35Å; L811-L830 HydrophobicContact CD1-CD2 4.07Å; L811-L830 HydrophobicContact CD2-CD2 3.75Å; A814-L830 HydrophobicContact CB-CD1 4.23Å; T815-L830 HydrophobicContact CG2-CD1 4.44Å; I826-L830 HydrophobicContact CG2-CD1 3.95Å; I826-L830 HydrophobicContact CG2-CG 4.4Å; I826-L830 WeakPolarHBondContact O-CB 3.38Å; I826-L830 WeakPolarHBondContact O-CG 3.32Å; I826-L830 PolarHBondContact O-N 3.29Å; Q827-L830 PolarHBondContact O-N 2.92Å; L830-K832 VanDerWaalsContact C-N 3.27Å; L830-K832 PolarHBondContact O-N 3.5Å; L830-V833 PolarHBondContact O-N 3.39Å; L830-C834 PolarHBondContact O-N 3.04Å; L830-C834 PolarHBondContact O-SG 3.43Å
831	A	84.1	Confident	83.8	Confident	64 Å²	64	52.2 Å²	52.2	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-58.2	-36.4	177	0	0	0	0	0	112.9	Q827 S829 A835	Q827-A831 WeakPolarHBondContact O-CB 3.46Å; Q827-A831 PolarHBondContact O-N 3.02Å; S829-A831 VanDerWaalsContact C-N 3.33Å; S829-A831 PolarHBondContact O-N 3.05Å; A831-A835 PolarHBondContact O-N 2.94Å
832	K	81.3	Confident	85	Confident	155 Å²	155	47.9 Å²	47.9	67%	0.674	26%	0.259	S	S	*	.	H	α-helix	trans	-68.2	-37	173.3	-66.1	171.8	-177.4	177.3	0	112.3	A828 S829 L830	A828-K832 WeakPolarHBondContact O-CG 3.17Å; S829-K832 WeakPolarHBondContact O-CB 3.44Å; S829-K832 PolarHBondContact O-N 3.39Å; S829-K832 VanDerWaalsContact O-N 3.09Å; L830-K832 VanDerWaalsContact C-N 3.27Å; L830-K832 PolarHBondContact O-N 3.5Å
833	V	84.2	Confident	85.7	Confident	11 Å²	11	45.4 Å²	45.4	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-70.7	-39.5	178.6	-166.5	0	0	0	0	111.1	I798 T801 I802 I809 S829 L830 A835 R837	I798-V833 HydrophobicContact CG2-CG2 3.9Å; T801-V833 HydrophobicContact CG2-CG1 4.41Å; I802-V833 HydrophobicContact CD1-CG2 3.65Å; I802-V833 HydrophobicContact CG1-CB 4.38Å; I802-V833 HydrophobicContact CG1-CG1 4Å; I802-V833 HydrophobicContact CG1-CG2 3.45Å; I802-V833 VanDerWaalsContact CG1-CG2 3.45Å; I809-V833 HydrophobicContact CD1-CG1 3.82Å; I809-V833 WeakPolarHBondContact CD1-O 3.46Å; S829-V833 WeakPolarHBondContact O-CG2 3.46Å; S829-V833 PolarHBondContact O-N 3.02Å; L830-V833 PolarHBondContact O-N 3.39Å; V833-A835 VanDerWaalsContact C-N 3.33Å; V833-A835 PolarHBondContact O-N 3.5Å; V833-R837 WeakPolarHBondContact O-CD 3.25Å
834	C	87	Confident	85.9	Confident	18 Å²	18	49.1 Å²	49.1	12%	0.122	26%	0.264	C	S	.	.	H	α-helix	trans	-78.3	-11.6	-178.3	-59.1	0	0	0	0	114.3	L830 N836 R837 T839	L830-C834 PolarHBondContact O-N 3.04Å; L830-C834 PolarHBondContact O-SG 3.43Å; C834-N836 PolarHBondContact O-N 2.98Å; C834-R837 PolarHBondContact O-N 3.42Å; C834-R837 VanDerWaalsContact O-N 3.17Å; C834-T839 HydrophobicContact CB-CG2 4.08Å; C834-T839 WeakPolarHBondContact CB-OG1 3.39Å
835	A	85.6	Confident	86.1	Confident	54 Å²	54	42.7 Å²	42.7	45%	0.446	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	128.1	-179.4	0	0	0	0	0	112	A831 V833 R837	A831-A835 PolarHBondContact O-N 2.94Å; V833-A835 VanDerWaalsContact C-N 3.33Å; V833-A835 PolarHBondContact O-N 3.5Å; A835-R837 VanDerWaalsContact C-N 3.26Å; A835-R837 PolarHBondContact O-N 2.92Å
836	N	85.3	Confident	86.5	Confident	166 Å²	166	41 Å²	41	89%	0.888	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	25.6	-177.5	-55.9	-35.7	0	0	0	115.3	C834	C834-N836 PolarHBondContact O-N 2.98Å
837	R	91.3	Very high	86.4	Confident	67 Å²	67	43.4 Å²	43.4	25%	0.253	24%	0.242	S	C	.	.	S	Bend	trans	-130	145	-179.1	-66.1	177.8	-167.3	-166.3	15.2	111.8	P806 D807 I809 V833 C834 A835 T839	P806-R837 WeakPolarHBondContact O-CD 3.33Å; P806-R837 PolarHBondContact O-NH1 2.95Å; D807-R837 WeakPolarHBondContact O-CB 3.41Å; I809-R837 HydrophobicContact CD1-CB 4.08Å; I809-R837 VanDerWaalsContact CD1-CD 3.45Å; I809-R837 HydrophobicContact CD1-CG 4.43Å; V833-R837 WeakPolarHBondContact O-CD 3.25Å; C834-R837 PolarHBondContact O-N 3.42Å; C834-R837 VanDerWaalsContact O-N 3.17Å; A835-R837 VanDerWaalsContact C-N 3.26Å; A835-R837 PolarHBondContact O-N 2.92Å; R837-T839 PolarHBondContact O-N 3.3Å; R837-T839 PolarHBondContact O-OG1 3.19Å
838	T	95	Very high	86.4	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	118.1	175.8	-57.9	0	0	0	0	108.7	G649 I651 V674 G677 D807 I808 I809	G649-T838 WeakPolarHBondContact O-CB 3.32Å; G649-T838 WeakPolarHBondContact O-CG2 3.37Å; G649-T838 PolarHBondContact O-OG1 2.66Å; I651-T838 HydrophobicContact CD1-CG2 3.73Å; I651-T838 HydrophobicContact CG1-CG2 4.33Å; V674-T838 HydrophobicContact CB-CG2 4.3Å; V674-T838 HydrophobicContact CG1-CG2 3.62Å; G677-T838 PolarHBondContact N-OG1 3.03Å; G677-T838 VanDerWaalsContact N-OG1 3.08Å; D807-T838 PolarHBondContact O-N 3.5Å; I808-T838 WeakPolarHBondContact CA-O 3.46Å; I809-T838 PolarHBondContact N-O 2.83Å
839	T	94.9	Very high	86.6	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.2	-169	-58.5	0	0	0	0	110.5	Q678 T679 L680 I809 C834 R837 V841	Q678-T839 PolarHBondContact O-N 3.02Å; T679-T839 WeakPolarHBondContact CA-O 3.17Å; T679-T839 HydrophobicContact CG2-CG2 4.35Å; L680-T839 PolarHBondContact N-O 3.08Å; I809-T839 HydrophobicContact CB-CG2 4.45Å; I809-T839 HydrophobicContact CG2-CG2 4.39Å; I809-T839 CarbonylContact O-C 3.53Å; I809-T839 WeakPolarHBondContact O-CA 3.34Å; C834-T839 HydrophobicContact CB-CG2 4.08Å; C834-T839 WeakPolarHBondContact CB-OG1 3.39Å; R837-T839 PolarHBondContact O-N 3.3Å; R837-T839 PolarHBondContact O-OG1 3.19Å; T839-V841 HydrophobicContact CG2-CG2 3.79Å
840	I	95.3	Very high	86.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.2	171.5	-53.1	-176.3	0	0	0	108.9	I651 V674 L680 L682 L694 L697 I809 L810 L811	I651-I840 HydrophobicContact CD1-CD1 3.96Å; V674-I840 HydrophobicContact CG2-CD1 4.28Å; L680-I840 HydrophobicContact CB-CG1 4.38Å; L680-I840 HydrophobicContact CD2-CG2 4.28Å; L680-I840 CarbonylContact O-C 2.94Å; L680-I840 WeakPolarHBondContact O-CA 3.3Å; L682-I840 HydrophobicContact CD1-CG2 3.84Å; L682-I840 HydrophobicContact CG-CG2 4.03Å; L694-I840 HydrophobicContact CD2-CB 4.24Å; L694-I840 HydrophobicContact CD2-CG2 3.77Å; L697-I840 HydrophobicContact CD2-CD1 3.61Å; I809-I840 PolarHBondContact O-N 3.34Å; L810-I840 WeakPolarHBondContact CA-O 3.32Å; L810-I840 HydrophobicContact CD2-CB 3.91Å; L810-I840 HydrophobicContact CD2-CD1 4.21Å; L810-I840 HydrophobicContact CD2-CG1 4.2Å; L811-I840 PolarHBondContact N-O 3.49Å
841	V	93.9	Very high	87	Confident	21 Å²	21	48.3 Å²	48.3	13%	0.127	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	114.9	-176.1	-173.1	0	0	0	0	109.6	T679 L680 A681 L682 L811 T839 A843 V849	T679-V841 HydrophobicContact CG2-CG2 4.12Å; L680-V841 PolarHBondContact O-N 3.49Å; A681-V841 CarbonylContact C-O 3.59Å; A681-V841 WeakPolarHBondContact CA-O 3.42Å; L682-V841 PolarHBondContact N-O 3.48Å; L811-V841 HydrophobicContact CB-CG1 4.21Å; L811-V841 HydrophobicContact CB-CG2 4.38Å; L811-V841 HydrophobicContact CD1-CG1 4.46Å; L811-V841 HydrophobicContact CD1-CG2 3.95Å; L811-V841 HydrophobicContact CG-CG2 4.33Å; T839-V841 HydrophobicContact CG2-CG2 3.79Å; V841-A843 HydrophobicContact CG1-CB 4.47Å; V841-V849 HydrophobicContact CB-CG1 4.47Å; V841-V849 HydrophobicContact CG1-CG1 4.1Å
842	V	93.1	Very high	87.3	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	121.1	162.8	174.5	0	0	0	0	107.7	L682 K690 L694 L811 E813	L682-V842 HydrophobicContact CB-CG2 4.05Å; L682-V842 HydrophobicContact CD1-CG2 3.95Å; L682-V842 HydrophobicContact CG-CG2 4.49Å; K690-V842 HydrophobicContact CB-CG1 3.63Å; K690-V842 HydrophobicContact CB-CG2 4.07Å; K690-V842 HydrophobicContact CD-CG1 4.13Å; L694-V842 HydrophobicContact CD1-CB 4.24Å; L694-V842 HydrophobicContact CD1-CG2 3.57Å; L694-V842 HydrophobicContact CD2-CG2 4.19Å; L694-V842 HydrophobicContact CG-CG2 3.76Å; L811-V842 PolarHBondContact O-N 2.65Å; E813-V842 WeakPolarHBondContact CA-O 3.25Å; E813-V842 HydrophobicContact CG-CG1 4.06Å; E813-V842 PolarHBondContact N-O 2.99Å
843	A	85.2	Confident	87.9	Confident	5 Å²	5	41.1 Å²	41.1	4%	0.041	23%	0.226	C	C	.	.			trans	-123.9	134	-177.3	0	0	0	0	0	112.3	L682 V683 V841 T848 V849	L682-A843 PolarHBondContact O-N 3.49Å; L682-A843 VanDerWaalsContact O-N 3.15Å; V683-A843 HydrophobicContact CG1-CB 4.45Å; V841-A843 HydrophobicContact CG1-CB 4.47Å; A843-T848 VanDerWaalsContact CB-OG1 3.26Å; A843-T848 WeakPolarHBondContact CB-OG1 3.27Å; A843-V849 HydrophobicContact CB-CG1 3.42Å; A843-V849 VanDerWaalsContact CB-CG1 3.42Å; A843-V849 HydrophobicContact CB-CG2 4.32Å
844	H	80.6	Confident	88.4	Confident	90 Å²	90	41.6 Å²	41.6	42%	0.417	23%	0.228	S	C	.	.	S	Bend	trans	-88	-44.2	163.3	-164.9	-76.4	0	0	0	111.2	E813 Q886	E813-H844 HydrophobicContact CG-CB 4.48Å; H844-Q886 PolarHBondContact O-NE2 3.33Å
845	R	81	Confident	88.8	Confident	58 Å²	58	40.7 Å²	40.7	22%	0.219	22%	0.222	C	C	.	.	S	Bend	trans	-83.2	112.6	176.2	-63	-178.3	-171.9	-171.5	7	109.7	S816 L818 E823 S847 T848	S816-R845 PolarHBondContact O-NH2 2.97Å; L818-R845 PolarHBondContact O-NH1 3.35Å; L818-R845 PolarHBondContact O-NH2 3.49Å; E823-R845 WeakPolarHBondContact OE1-CD 3.23Å; E823-R845 IonicContact OE1-NH1 4Å; E823-R845 IonicContact OE2-CZ 3.53Å; E823-R845 IonicContact OE2-NH1 2.69Å; E823-R845 PolarHBondContact OE2-NH1 2.76Å; R845-S847 PolarHBondContact O-N 2.92Å; R845-T848 HydrophobicContact CB-CG2 4.01Å; R845-T848 WeakPolarHBondContact O-CB 3.36Å; R845-T848 PolarHBondContact O-N 3.23Å; R845-T848 VanDerWaalsContact O-N 3.13Å; R845-T848 PolarHBondContact O-OG1 2.87Å
846	L	84.8	Confident	89.3	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.016	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-66	-24.8	-175.4	-65	174.2	0	0	0	113.2	V683 T848 V849 V850 Y879 M882 W883	V683-L846 HydrophobicContact CB-CD2 3.88Å; V683-L846 HydrophobicContact CG1-CD2 3.66Å; V683-L846 HydrophobicContact CG2-CD2 4.34Å; L846-T848 PolarHBondContact O-N 3.42Å; L846-V849 HydrophobicContact CD2-CG2 4.44Å; L846-V849 WeakPolarHBondContact O-CG2 3.5Å; L846-V849 PolarHBondContact O-N 3.3Å; L846-V849 VanDerWaalsContact O-N 3.09Å; L846-V850 PolarHBondContact O-N 2.94Å; L846-Y879 HydrophobicContact CD2-CE2 3.88Å; L846-M882 HydrophobicContact CD1-CB 3.79Å; L846-W883 HydrophobicContact CB-CE3 3.55Å; L846-W883 HydrophobicContact CB-CZ3 3.72Å; L846-W883 HydrophobicContact CD1-CB 4.1Å; L846-W883 HydrophobicContact CD1-CE3 4.1Å; L846-W883 HydrophobicContact CG-CE3 4.49Å
847	S	81.3	Confident	89.7	Confident	51 Å²	51	30.3 Å²	30.3	36%	0.357	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-54.9	-30.1	172.2	55.3	0	0	0	0	113.4	R845 V849	R845-S847 PolarHBondContact O-N 2.92Å; S847-V849 VanDerWaalsContact C-N 3.28Å; S847-V849 PolarHBondContact O-N 3.1Å
848	T	81.1	Confident	89.8	Confident	41 Å²	41	27.1 Å²	27.1	25%	0.252	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-71.7	-19.5	179.5	64.7	0	0	0	0	113.6	T815 E823 A843 R845 L846	T815-T848 WeakPolarHBondContact OG1-CG2 3.24Å; E823-T848 WeakPolarHBondContact OE1-CG2 3.29Å; A843-T848 VanDerWaalsContact CB-OG1 3.26Å; A843-T848 WeakPolarHBondContact CB-OG1 3.27Å; R845-T848 HydrophobicContact CB-CG2 4.01Å; R845-T848 WeakPolarHBondContact O-CB 3.36Å; R845-T848 PolarHBondContact O-N 3.23Å; R845-T848 VanDerWaalsContact O-N 3.13Å; R845-T848 PolarHBondContact O-OG1 2.87Å; L846-T848 PolarHBondContact O-N 3.42Å
849	V	87.3	Confident	89.7	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.018	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-116.7	7	-172	-66.8	0	0	0	0	114.2	A681 V683 V841 A843 L846 S847 N851 A852	A681-V849 HydrophobicContact CB-CB 3.57Å; A681-V849 HydrophobicContact CB-CG1 3.47Å; A681-V849 VanDerWaalsContact CB-CG1 3.47Å; A681-V849 HydrophobicContact CB-CG2 4.35Å; V683-V849 HydrophobicContact CG1-CG2 3.85Å; V841-V849 HydrophobicContact CB-CG1 4.47Å; V841-V849 HydrophobicContact CG1-CG1 4.1Å; A843-V849 HydrophobicContact CB-CG1 3.42Å; A843-V849 VanDerWaalsContact CB-CG1 3.42Å; A843-V849 HydrophobicContact CB-CG2 4.32Å; L846-V849 HydrophobicContact CD2-CG2 4.44Å; L846-V849 WeakPolarHBondContact O-CG2 3.5Å; L846-V849 PolarHBondContact O-N 3.3Å; L846-V849 VanDerWaalsContact O-N 3.09Å; S847-V849 VanDerWaalsContact C-N 3.28Å; S847-V849 PolarHBondContact O-N 3.1Å; V849-N851 PolarHBondContact O-N 3.34Å; V849-A852 HydrophobicContact CB-CB 4.44Å; V849-A852 VanDerWaalsContact O-CB 3.29Å; V849-A852 WeakPolarHBondContact O-CB 3.36Å; V849-A852 PolarHBondContact O-N 2.95Å
850	V	87.9	Confident	89.4	Confident	48 Å²	48	36.9 Å²	36.9	29%	0.291	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-40.2	174.7	174.2	0	0	0	0	111.6	L846 A852 W883	L846-V850 PolarHBondContact O-N 2.94Å; V850-A852 VanDerWaalsContact C-N 3.34Å; V850-A852 PolarHBondContact O-N 3.25Å; V850-W883 HydrophobicContact CG2-CH2 3.74Å; V850-W883 HydrophobicContact CG2-CZ3 3.83Å
851	N	86.4	Confident	89.1	Confident	156 Å²	156	37 Å²	37	83%	0.834	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	8.4	-177.9	-62.1	-27.9	0	0	0	114.2	V849	V849-N851 PolarHBondContact O-N 3.34Å
852	A	91.4	Very high	89	Confident	7 Å²	7	38.1 Å²	38.1	6%	0.058	20%	0.204	C	C	.	.			trans	-73.4	137.5	179	0	0	0	0	0	111.4	T679 A681 V849 V850 Q854 I855	T679-A852 HydrophobicContact CG2-CB 4.27Å; A681-A852 HydrophobicContact CB-CB 3.62Å; V849-A852 HydrophobicContact CB-CB 4.44Å; V849-A852 VanDerWaalsContact O-CB 3.29Å; V849-A852 WeakPolarHBondContact O-CB 3.36Å; V849-A852 PolarHBondContact O-N 2.95Å; V850-A852 VanDerWaalsContact C-N 3.34Å; V850-A852 PolarHBondContact O-N 3.25Å; A852-Q854 PolarHBondContact O-N 2.91Å; A852-I855 HydrophobicContact CB-CG1 4.19Å
853	D	93.1	Very high	89.1	Confident	61 Å²	61	40.5 Å²	40.5	33%	0.326	22%	0.216	S	C	.	.	S	Bend	trans	-59.9	-32.4	178.4	-71.4	-64.9	0	0	0	113	Q678 T679 R868	Q678-D853 HydrophobicContact CG-CB 3.49Å; Q678-D853 VanDerWaalsContact CG-CB 3.49Å; T679-D853 PolarHBondContact N-OD2 3.47Å; T679-D853 PolarHBondContact O-N 3.27Å; T679-D853 VanDerWaalsContact O-N 3.08Å; D853-R868 WeakPolarHBondContact O-CG 3.47Å; D853-R868 PolarHBondContact O-NE 3.46Å; D853-R868 IonicContact OD1-NH2 3.37Å; D853-R868 PolarHBondContact OD1-NH2 2.89Å
854	Q	94.7	Very high	89.5	Confident	20 Å²	20	43.6 Å²	43.6	9%	0.093	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	133.2	177.6	-177.4	-177.6	-67.8	0	0	109.7	T679 L680 A681 A852 R866	T679-Q854 PolarHBondContact O-N 3.16Å; L680-Q854 WeakPolarHBondContact CA-O 3.42Å; L680-Q854 HydrophobicContact CD1-CB 4.04Å; L680-Q854 HydrophobicContact CD1-CG 3.95Å; L680-Q854 VanDerWaalsContact CD1-NE2 3.26Å; A681-Q854 PolarHBondContact N-O 3.21Å; A852-Q854 PolarHBondContact O-N 2.91Å; Q854-R866 VanDerWaalsContact CD-NE 3.27Å; Q854-R866 HydrophobicContact CG-CG 4.24Å; Q854-R866 VanDerWaalsContact OE1-NE 3.1Å
855	I	96	Very high	90.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.3	170.9	-61.5	158.9	0	0	0	108.3	A681 V683 A852 R866 G867 H869 L872 Y879	A681-I855 HydrophobicContact CB-CB 4.37Å; A681-I855 HydrophobicContact CB-CG1 3.85Å; A681-I855 HydrophobicContact CB-CG2 4.47Å; A681-I855 CarbonylContact O-C 3.57Å; A681-I855 WeakPolarHBondContact O-CA 3.36Å; V683-I855 HydrophobicContact CG1-CG2 4.3Å; V683-I855 HydrophobicContact CG2-CG2 3.55Å; A852-I855 HydrophobicContact CB-CG1 4.19Å; I855-R866 WeakPolarHBondContact O-CA 3.31Å; I855-G867 PolarHBondContact N-O 3.26Å; I855-G867 PolarHBondContact O-N 3.03Å; I855-H869 HydrophobicContact CD1-CB 4Å; I855-L872 HydrophobicContact CB-CD1 3.8Å; I855-L872 HydrophobicContact CD1-CD1 4.41Å; I855-L872 HydrophobicContact CG2-CD1 3.84Å; I855-Y879 HydrophobicContact CD1-CE2 3.96Å; I855-Y879 HydrophobicContact CG2-CD2 4.17Å; I855-Y879 HydrophobicContact CG2-CE2 3.94Å
856	L	95.4	Very high	90.8	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.1	167	-62.2	176.8	0	0	0	109	F672 L680 A681 L682 V683 I863 E865 R866	F672-L856 HydrophobicContact CB-CD1 3.86Å; F672-L856 HydrophobicContact CD1-CD1 4.09Å; F672-L856 HydrophobicContact CD2-CD1 3.99Å; F672-L856 HydrophobicContact CG-CD1 3.71Å; L680-L856 HydrophobicContact CD1-CD1 3.93Å; L680-L856 HydrophobicContact CD1-CG 3.93Å; L680-L856 HydrophobicContact CD2-CD1 4.03Å; L680-L856 HydrophobicContact CG-CD1 4.45Å; A681-L856 PolarHBondContact O-N 3.41Å; L682-L856 HydrophobicContact CD2-CB 4Å; L682-L856 HydrophobicContact CD2-CD1 3.97Å; L682-L856 HydrophobicContact CD2-CG 4.44Å; V683-L856 PolarHBondContact N-O 3.25Å; L856-I863 HydrophobicContact CD1-CD1 4.09Å; L856-I863 HydrophobicContact CD2-CG2 4.03Å; L856-E865 WeakPolarHBondContact CA-O 3.22Å; L856-R866 HydrophobicContact CD2-CB 3.77Å; L856-R866 HydrophobicContact CD2-CG 3.62Å
857	V	94.7	Very high	91.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119.1	170.5	-172.3	0	0	0	0	107.9	V683 V864 E865 L872 V878 Y879 M882	V683-V857 HydrophobicContact CG2-CB 4.34Å; V683-V857 HydrophobicContact CG2-CG2 3.83Å; V683-V857 WeakPolarHBondContact O-CA 3.21Å; V857-V864 HydrophobicContact CB-CG2 3.97Å; V857-V864 HydrophobicContact CG1-CG2 3.73Å; V857-V864 WeakPolarHBondContact O-CG2 3.25Å; V857-V864 PolarHBondContact O-N 3.42Å; V857-E865 HydrophobicContact CB-CB 3.91Å; V857-E865 HydrophobicContact CG2-CB 3.78Å; V857-E865 PolarHBondContact N-O 2.91Å; V857-E865 PolarHBondContact O-N 2.96Å; V857-L872 HydrophobicContact CG2-CD1 4.35Å; V857-V878 HydrophobicContact CG1-CB 4.33Å; V857-V878 HydrophobicContact CG1-CG1 4.09Å; V857-Y879 HydrophobicContact CG2-CD2 4.07Å; V857-Y879 HydrophobicContact CG2-CG 4.49Å; V857-M882 HydrophobicContact CG1-CE 3.86Å
858	I	93.6	Very high	91.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.9	177.9	-53.5	173.1	0	0	0	108.4	L682 V683 G684 A688 I693 C862	L682-I858 HydrophobicContact CB-CD1 4.44Å; L682-I858 HydrophobicContact CD2-CD1 4.15Å; V683-I858 PolarHBondContact O-N 3.44Å; G684-I858 WeakPolarHBondContact CA-O 3.34Å; A688-I858 HydrophobicContact CB-CG2 4.37Å; A688-I858 WeakPolarHBondContact CB-O 3.39Å; A688-I858 WeakPolarHBondContact O-CG2 3.47Å; I693-I858 HydrophobicContact CD1-CD1 3.39Å; I858-C862 CarbonylContact C-O 3.51Å; I858-C862 VanDerWaalsContact CA-O 3.31Å; I858-C862 WeakPolarHBondContact CA-O 3.44Å; I858-C862 WeakPolarHBondContact CG2-O 3.32Å
859	K	91.7	Very high	92.4	Very high	87 Å²	87	48.3 Å²	48.3	38%	0.378	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	134.6	175.9	-177.4	179.6	173.8	-177.9	0	108.8	P685 G861 C862 V864	P685-K859 HydrophobicContact CG-CG 4.45Å; K859-G861 PolarHBondContact O-N 3.08Å; K859-C862 PolarHBondContact N-O 2.88Å; K859-C862 PolarHBondContact O-N 3.34Å; K859-V864 HydrophobicContact CB-CG1 3.94Å; K859-V864 HydrophobicContact CB-CG2 3.92Å
860	D	88.7	Confident	92.7	Very high	121 Å²	121	55.9 Å²	55.9	65%	0.647	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	27.4	178.6	-55.4	-43.8	0	0	0	115
861	G	88.6	Confident	92.9	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.021	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-3.9	-179.5	0	0	0	0	0	115.3	T666 L667 Q668 V670 K859	T666-G861 WeakPolarHBondContact O-CA 3.3Å; L667-G861 WeakPolarHBondContact CA-O 3.3Å; Q668-G861 PolarHBondContact N-O 2.9Å; V670-G861 WeakPolarHBondContact CG2-O 3.47Å; K859-G861 PolarHBondContact O-N 3.08Å
862	C	92.4	Very high	93.2	Very high	45 Å²	45	48 Å²	48	30%	0.304	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	153.5	-179.8	-59.2	0	0	0	0	111.8	I858 K859 V864	I858-C862 CarbonylContact C-O 3.51Å; I858-C862 VanDerWaalsContact CA-O 3.31Å; I858-C862 WeakPolarHBondContact CA-O 3.44Å; I858-C862 WeakPolarHBondContact CG2-O 3.32Å; K859-C862 PolarHBondContact N-O 2.88Å; K859-C862 PolarHBondContact O-N 3.34Å; C862-V864 PolarHBondContact O-N 3.47Å
863	I	94.3	Very high	93.2	Very high	50 Å²	50	50.4 Å²	50.4	26%	0.256	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	114	167.5	-61.8	169.9	0	0	0	108.2	V670 F672 L856	V670-I863 HydrophobicContact CG1-CD1 4.01Å; V670-I863 HydrophobicContact CG1-CG1 4.34Å; F672-I863 HydrophobicContact CB-CD1 4.2Å; F672-I863 HydrophobicContact CD1-CD1 3.93Å; F672-I863 HydrophobicContact CG-CD1 4.47Å; L856-I863 HydrophobicContact CD1-CD1 4.09Å; L856-I863 HydrophobicContact CD2-CG2 4.03Å
864	V	94	Very high	93.1	Very high	70 Å²	70	52.2 Å²	52.2	42%	0.424	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-31.4	179.7	-66.4	0	0	0	0	113	V857 K859 C862	V857-V864 HydrophobicContact CB-CG2 3.97Å; V857-V864 HydrophobicContact CG1-CG2 3.73Å; V857-V864 WeakPolarHBondContact O-CG2 3.25Å; V857-V864 PolarHBondContact O-N 3.42Å; K859-V864 HydrophobicContact CB-CG1 3.94Å; K859-V864 HydrophobicContact CB-CG2 3.92Å; C862-V864 PolarHBondContact O-N 3.47Å
865	E	94.1	Very high	93	Very high	31 Å²	31	58.9 Å²	58.9	15%	0.145	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	148.4	179.1	-59.2	174.8	-176.1	0	0	112.2	L856 V857 L872 G877 V878 Y879	L856-E865 WeakPolarHBondContact CA-O 3.22Å; V857-E865 HydrophobicContact CB-CB 3.91Å; V857-E865 HydrophobicContact CG2-CB 3.78Å; V857-E865 PolarHBondContact N-O 2.91Å; V857-E865 PolarHBondContact O-N 2.96Å; E865-L872 HydrophobicContact CB-CD2 3.91Å; E865-G877 VanDerWaalsContact OE1-CA 3.27Å; E865-G877 WeakPolarHBondContact OE1-CA 3.16Å; E865-V878 PolarHBondContact OE1-N 2.88Å; E865-Y879 WeakPolarHBondContact OE2-CB 3.36Å; E865-Y879 PolarHBondContact OE2-N 3.44Å
866	R	94.9	Very high	92.6	Very high	120 Å²	120	61.5 Å²	61.5	45%	0.453	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	130	176.9	178.6	173.9	-177.3	179.8	3.6	110.3	Q854 I855 L856 R875	Q854-R866 VanDerWaalsContact CD-NE 3.27Å; Q854-R866 HydrophobicContact CG-CG 4.24Å; Q854-R866 VanDerWaalsContact OE1-NE 3.1Å; I855-R866 WeakPolarHBondContact O-CA 3.31Å; L856-R866 HydrophobicContact CD2-CB 3.77Å; L856-R866 HydrophobicContact CD2-CG 3.62Å; R866-R875 PolarHBondContact O-NH1 3.03Å
867	G	93.6	Very high	92.4	Very high	17 Å²	17	62.3 Å²	62.3	18%	0.175	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.8	-174.7	178.5	0	0	0	0	0	113.3	I855	I855-G867 PolarHBondContact N-O 3.26Å; I855-G867 PolarHBondContact O-N 3.03Å
868	R	94.6	Very high	92.2	Very high	148 Å²	148	64.2 Å²	64.2	56%	0.558	34%	0.34	S	S	*	.			trans	-89.1	164.2	163.9	-77.8	-179.8	169.8	-170.4	-9.7	110.1	D853 E870 A871 L872	D853-R868 WeakPolarHBondContact O-CG 3.47Å; D853-R868 PolarHBondContact O-NE 3.46Å; D853-R868 IonicContact OD1-NH2 3.37Å; D853-R868 PolarHBondContact OD1-NH2 2.89Å; R868-E870 PolarHBondContact O-N 3.39Å; R868-A871 PolarHBondContact O-N 3.49Å; R868-A871 VanDerWaalsContact O-N 3.07Å; R868-L872 WeakPolarHBondContact O-CG 3.3Å; R868-L872 PolarHBondContact O-N 3.24Å
869	H	92.9	Very high	92.2	Very high	27 Å²	27	64.1 Å²	64.1	13%	0.125	34%	0.34	C	S	.	.	H	α-helix	trans	-47.7	-55.7	-178.1	173.7	74.5	0	0	0	112.7	I855 A871 L872 L873 Y879 W883	I855-H869 HydrophobicContact CD1-CB 4Å; H869-A871 VanDerWaalsContact C-N 3.34Å; H869-A871 PolarHBondContact O-N 2.92Å; H869-L872 PolarHBondContact O-N 3.43Å; H869-L873 VanDerWaalsContact CE1-CD1 3.43Å; H869-L873 WeakPolarHBondContact CE1-CD1 3.06Å; H869-L873 VanDerWaalsContact NE2-CD1 3.33Å; H869-L873 WeakPolarHBondContact NE2-CD1 3.22Å; H869-L873 PolarHBondContact O-N 3.39Å; H869-Y879 AromaticContact ND1-CE1 3.56Å; H869-Y879 AromaticContact ND1-CZ 3.65Å; H869-Y879 PolarHBondContact ND1-OH 3.32Å; H869-W883 AromaticContact CE1-CE3 3.75Å; H869-W883 AromaticContact CE1-CH2 3.65Å; H869-W883 AromaticContact CE1-CZ2 3.91Å; H869-W883 AromaticContact CE1-CZ3 3.56Å
870	E	93.1	Very high	92.2	Very high	162 Å²	162	60.2 Å²	60.2	76%	0.757	32%	0.324	S	S	*	.	H	α-helix	trans	-56.9	-44.1	178.4	-61.7	170.8	178.2	0	0	112.7	R868 L873 S874	R868-E870 PolarHBondContact O-N 3.39Å; E870-L873 PolarHBondContact O-N 2.96Å; E870-S874 WeakPolarHBondContact O-CB 3.15Å; E870-S874 PolarHBondContact O-N 3.21Å; E870-S874 PolarHBondContact O-OG 2.93Å
871	A	92.5	Very high	92.2	Very high	37 Å²	37	58.7 Å²	58.7	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-72.7	-27.8	-177.7	0	0	0	0	0	113.3	R868 H869 S874 R875	R868-A871 PolarHBondContact O-N 3.49Å; R868-A871 VanDerWaalsContact O-N 3.07Å; H869-A871 VanDerWaalsContact C-N 3.34Å; H869-A871 PolarHBondContact O-N 2.92Å; A871-S874 PolarHBondContact O-OG 2.63Å; A871-S874 VanDerWaalsContact O-OG 3.13Å; A871-R875 WeakPolarHBondContact O-CD 3.4Å; A871-R875 VanDerWaalsContact O-CG 3.26Å; A871-R875 WeakPolarHBondContact O-CG 3.32Å
872	L	92.6	Very high	92.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-79.5	-39.7	174.6	-69.2	179.3	0	0	0	111.2	I855 V857 E865 R868 H869 R875 Y879	I855-L872 HydrophobicContact CB-CD1 3.8Å; I855-L872 HydrophobicContact CD1-CD1 4.41Å; I855-L872 HydrophobicContact CG2-CD1 3.84Å; V857-L872 HydrophobicContact CG2-CD1 4.35Å; E865-L872 HydrophobicContact CB-CD2 3.91Å; R868-L872 WeakPolarHBondContact O-CG 3.3Å; R868-L872 PolarHBondContact O-N 3.24Å; H869-L872 PolarHBondContact O-N 3.43Å; L872-R875 PolarHBondContact O-N 2.84Å; L872-Y879 HydrophobicContact CB-CD1 3.51Å; L872-Y879 HydrophobicContact CB-CE1 4.24Å; L872-Y879 HydrophobicContact CB-CG 3.7Å; L872-Y879 HydrophobicContact CD1-CD1 4.32Å; L872-Y879 HydrophobicContact CD1-CD2 3.91Å; L872-Y879 HydrophobicContact CD1-CE2 4.42Å; L872-Y879 HydrophobicContact CD1-CG 3.86Å; L872-Y879 HydrophobicContact CG-CG 4.41Å
873	L	91.9	Very high	92.1	Very high	58 Å²	58	60.1 Å²	60.1	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-47.4	170.9	-81.4	169.5	0	0	0	112	H869 E870 R875 G876 Y879 A880 W883	H869-L873 VanDerWaalsContact CE1-CD1 3.43Å; H869-L873 WeakPolarHBondContact CE1-CD1 3.06Å; H869-L873 VanDerWaalsContact NE2-CD1 3.33Å; H869-L873 WeakPolarHBondContact NE2-CD1 3.22Å; H869-L873 PolarHBondContact O-N 3.39Å; E870-L873 PolarHBondContact O-N 2.96Å; L873-R875 PolarHBondContact O-N 2.81Å; L873-R875 VanDerWaalsContact O-N 3.12Å; L873-G876 PolarHBondContact O-N 3.3Å; L873-G876 VanDerWaalsContact O-N 3.07Å; L873-Y879 HydrophobicContact CG-CD1 4.41Å; L873-Y879 HydrophobicContact CG-CE1 4.24Å; L873-A880 HydrophobicContact CD2-CB 4.26Å; L873-W883 HydrophobicContact CD2-CB 4.17Å; L873-W883 HydrophobicContact CD2-CG 3.94Å
874	S	91.1	Very high	91.7	Very high	99 Å²	99	63 Å²	63	69%	0.692	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.5	-179.6	70.9	0	0	0	0	114	E870 A871	E870-S874 WeakPolarHBondContact O-CB 3.15Å; E870-S874 PolarHBondContact O-N 3.21Å; E870-S874 PolarHBondContact O-OG 2.93Å; A871-S874 PolarHBondContact O-OG 2.63Å; A871-S874 VanDerWaalsContact O-OG 3.13Å
875	R	91.6	Very high	91.3	Very high	161 Å²	161	65.3 Å²	65.3	61%	0.608	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-16.7	176.4	-77.9	172	-179.8	169.9	2.7	113.5	R866 A871 L872 L873 G877	R866-R875 PolarHBondContact O-NH1 3.03Å; A871-R875 WeakPolarHBondContact O-CD 3.4Å; A871-R875 VanDerWaalsContact O-CG 3.26Å; A871-R875 WeakPolarHBondContact O-CG 3.32Å; L872-R875 PolarHBondContact O-N 2.84Å; L873-R875 PolarHBondContact O-N 2.81Å; L873-R875 VanDerWaalsContact O-N 3.12Å; R875-G877 VanDerWaalsContact C-N 3.27Å; R875-G877 PolarHBondContact O-N 2.94Å
876	G	87.9	Confident	90.8	Very high	55 Å²	55	66.4 Å²	66.4	57%	0.567	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	35.4	-178.1	0	0	0	0	0	113.7	L873	L873-G876 PolarHBondContact O-N 3.3Å; L873-G876 VanDerWaalsContact O-N 3.07Å
877	G	92.1	Very high	90.1	Very high	17 Å²	17	64.9 Å²	64.9	18%	0.175	34%	0.341	C	S	.	.	S	Bend	trans	-95.4	-164.1	-179.1	0	0	0	0	0	114	E865 R875 Y879 A880 D881	E865-G877 VanDerWaalsContact OE1-CA 3.27Å; E865-G877 WeakPolarHBondContact OE1-CA 3.16Å; R875-G877 VanDerWaalsContact C-N 3.27Å; R875-G877 PolarHBondContact O-N 2.94Å; G877-Y879 PolarHBondContact O-N 3.43Å; G877-Y879 VanDerWaalsContact O-N 3.12Å; G877-A880 WeakPolarHBondContact O-CA 3.24Å; G877-A880 WeakPolarHBondContact O-CB 3.48Å; G877-A880 PolarHBondContact O-N 2.87Å; G877-D881 PolarHBondContact O-N 3.13Å; G877-D881 VanDerWaalsContact O-N 3.08Å
878	V	90.5	Very high	89.1	Confident	40 Å²	40	69.1 Å²	69.1	24%	0.242	36%	0.356	C	S	.	.	H	α-helix	trans	-54.7	-34	-179.8	-175.2	0	0	0	0	111.7	V857 E865 M882	V857-V878 HydrophobicContact CG1-CB 4.33Å; V857-V878 HydrophobicContact CG1-CG1 4.09Å; E865-V878 PolarHBondContact OE1-N 2.88Å; V878-M882 HydrophobicContact CG1-CE 4.34Å; V878-M882 WeakPolarHBondContact O-CG 3.43Å; V878-M882 PolarHBondContact O-N 3.4Å; V878-M882 VanDerWaalsContact O-N 3.16Å
879	Y	92.8	Very high	87.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62.6	-43	172.8	-173.7	-96.3	0	0	0	113.2	V683 L846 I855 V857 E865 H869 L872 L873 G877 W883	V683-Y879 HydrophobicContact CG2-CD2 4Å; V683-Y879 HydrophobicContact CG2-CE2 4.18Å; L846-Y879 HydrophobicContact CD2-CE2 3.88Å; I855-Y879 HydrophobicContact CD1-CE2 3.96Å; I855-Y879 HydrophobicContact CG2-CD2 4.17Å; I855-Y879 HydrophobicContact CG2-CE2 3.94Å; V857-Y879 HydrophobicContact CG2-CD2 4.07Å; V857-Y879 HydrophobicContact CG2-CG 4.49Å; E865-Y879 WeakPolarHBondContact OE2-CB 3.36Å; E865-Y879 PolarHBondContact OE2-N 3.44Å; H869-Y879 AromaticContact ND1-CE1 3.56Å; H869-Y879 AromaticContact ND1-CZ 3.65Å; H869-Y879 PolarHBondContact ND1-OH 3.32Å; L872-Y879 HydrophobicContact CB-CD1 3.51Å; L872-Y879 HydrophobicContact CB-CE1 4.24Å; L872-Y879 HydrophobicContact CB-CG 3.7Å; L872-Y879 HydrophobicContact CD1-CD1 4.32Å; L872-Y879 HydrophobicContact CD1-CD2 3.91Å; L872-Y879 HydrophobicContact CD1-CE2 4.42Å; L872-Y879 HydrophobicContact CD1-CG 3.86Å; L872-Y879 HydrophobicContact CG-CG 4.41Å; L873-Y879 HydrophobicContact CG-CD1 4.41Å; L873-Y879 HydrophobicContact CG-CE1 4.24Å; G877-Y879 PolarHBondContact O-N 3.43Å; G877-Y879 VanDerWaalsContact O-N 3.12Å; Y879-W883 WeakPolarHBondContact O-CB 3.23Å; Y879-W883 PolarHBondContact O-N 2.95Å
880	A	91.5	Very high	86.1	Confident	5 Å²	5	68 Å²	68	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-69.9	-39.9	-178.5	0	0	0	0	0	111.2	L873 G877 W883 Q884	L873-A880 HydrophobicContact CD2-CB 4.26Å; G877-A880 WeakPolarHBondContact O-CA 3.24Å; G877-A880 WeakPolarHBondContact O-CB 3.48Å; G877-A880 PolarHBondContact O-N 2.87Å; A880-W883 WeakPolarHBondContact O-CB 3.46Å; A880-W883 PolarHBondContact O-N 3.47Å; A880-W883 VanDerWaalsContact O-N 3.17Å; A880-Q884 WeakPolarHBondContact O-CG 3.3Å; A880-Q884 PolarHBondContact O-N 3.47Å
881	D	89.7	Confident	84.3	Confident	89 Å²	89	66 Å²	66	48%	0.476	36%	0.356	S	S	.	.	H	α-helix	trans	-58.5	-49.8	174	-61.7	-21.4	0	0	0	111.2	G877 W883 Q884 L885	G877-D881 PolarHBondContact O-N 3.13Å; G877-D881 VanDerWaalsContact O-N 3.08Å; D881-W883 VanDerWaalsContact C-N 3.26Å; D881-W883 PolarHBondContact O-N 2.97Å; D881-Q884 PolarHBondContact O-N 3.04Å; D881-L885 WeakPolarHBondContact O-CG 3.47Å; D881-L885 PolarHBondContact O-N 3.15Å
882	M	88.4	Confident	82.2	Confident	33 Å²	33	70.9 Å²	70.9	16%	0.163	37%	0.373	C	S	.	.	H	α-helix	trans	-63	-32.4	176.7	-69.1	-173.5	-60.6	0	0	112.4	V683 L846 V857 V878 Q886	V683-M882 HydrophobicContact CG2-CE 4.27Å; L846-M882 HydrophobicContact CD1-CB 3.79Å; V857-M882 HydrophobicContact CG1-CE 3.86Å; V878-M882 HydrophobicContact CG1-CE 4.34Å; V878-M882 WeakPolarHBondContact O-CG 3.43Å; V878-M882 PolarHBondContact O-N 3.4Å; V878-M882 VanDerWaalsContact O-N 3.16Å; M882-Q886 WeakPolarHBondContact O-CG 3.38Å; M882-Q886 PolarHBondContact O-N 2.91Å
883	W	89.6	Confident	80.2	Confident	44 Å²	44	75.6 Å²	75.6	17%	0.167	40%	0.402	C	S	.	.	H	α-helix	trans	-68.8	-46.9	176.8	-177.5	-90.2	0	0	0	112	L846 V850 H869 L873 Y879 A880 D881 Q886 Q887	L846-W883 HydrophobicContact CB-CE3 3.55Å; L846-W883 HydrophobicContact CB-CZ3 3.72Å; L846-W883 HydrophobicContact CD1-CB 4.1Å; L846-W883 HydrophobicContact CD1-CE3 4.1Å; L846-W883 HydrophobicContact CG-CE3 4.49Å; V850-W883 HydrophobicContact CG2-CH2 3.74Å; V850-W883 HydrophobicContact CG2-CZ3 3.83Å; H869-W883 AromaticContact CE1-CE3 3.75Å; H869-W883 AromaticContact CE1-CH2 3.65Å; H869-W883 AromaticContact CE1-CZ2 3.91Å; H869-W883 AromaticContact CE1-CZ3 3.56Å; L873-W883 HydrophobicContact CD2-CB 4.17Å; L873-W883 HydrophobicContact CD2-CG 3.94Å; Y879-W883 WeakPolarHBondContact O-CB 3.23Å; Y879-W883 PolarHBondContact O-N 2.95Å; A880-W883 WeakPolarHBondContact O-CB 3.46Å; A880-W883 PolarHBondContact O-N 3.47Å; A880-W883 VanDerWaalsContact O-N 3.17Å; D881-W883 VanDerWaalsContact C-N 3.26Å; D881-W883 PolarHBondContact O-N 2.97Å; W883-Q886 PolarHBondContact O-N 3.04Å; W883-Q887 PolarHBondContact O-N 3.12Å
884	Q	87.2	Confident	78.3	Confident	111 Å²	111	76.1 Å²	76.1	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-61.9	-44.7	177.1	-71.1	178.7	-0.4	0	0	111.7	A880 D881 Q886 Q887 Q888	A880-Q884 WeakPolarHBondContact O-CG 3.3Å; A880-Q884 PolarHBondContact O-N 3.47Å; D881-Q884 PolarHBondContact O-N 3.04Å; Q884-Q886 VanDerWaalsContact C-N 3.26Å; Q884-Q886 PolarHBondContact O-N 3.47Å; Q884-Q887 PolarHBondContact O-N 3.41Å; Q884-Q887 VanDerWaalsContact O-N 3.13Å; Q884-Q888 WeakPolarHBondContact O-CG 3.38Å; Q884-Q888 PolarHBondContact O-N 3.28Å
885	L	84.9	Confident	76.2	Confident	117 Å²	117	78.7 Å²	78.7	61%	0.613	41%	0.411	S	S	*	.	H	α-helix	trans	-58.1	-36.6	175.4	-75.6	164.5	0	0	0	112.7	D881 G889	D881-L885 WeakPolarHBondContact O-CG 3.47Å; D881-L885 PolarHBondContact O-N 3.15Å; L885-G889 PolarHBondContact O-N 3.45Å
886	Q	82.5	Confident	74.2	Confident	55 Å²	55	78.5 Å²	78.5	26%	0.257	42%	0.422	S	S	.	.	H	α-helix	trans	-76.9	-28.3	176.8	-74.3	-170.4	6.7	0	0	113.8	H844 M882 W883 Q884 Q890	H844-Q886 PolarHBondContact O-NE2 3.33Å; M882-Q886 WeakPolarHBondContact O-CG 3.38Å; M882-Q886 PolarHBondContact O-N 2.91Å; W883-Q886 PolarHBondContact O-N 3.04Å; Q884-Q886 VanDerWaalsContact C-N 3.26Å; Q884-Q886 PolarHBondContact O-N 3.47Å; Q886-Q890 WeakPolarHBondContact O-CG 3.26Å; Q886-Q890 PolarHBondContact O-N 3.27Å
887	Q	80.8	Confident	72.1	Confident	88 Å²	88	81 Å²	81	41%	0.411	43%	0.427	S	S	.	.	H	α-helix	trans	-69.9	-48.6	172	-73.2	-169.9	-29.4	0	0	111.1	W883 Q884 G889 Q890 E891	W883-Q887 PolarHBondContact O-N 3.12Å; Q884-Q887 PolarHBondContact O-N 3.41Å; Q884-Q887 VanDerWaalsContact O-N 3.13Å; Q887-G889 PolarHBondContact O-N 2.9Å; Q887-Q890 WeakPolarHBondContact O-CA 3.29Å; Q887-Q890 WeakPolarHBondContact O-CB 3.42Å; Q887-Q890 PolarHBondContact O-N 3.36Å; Q887-E891 PolarHBondContact O-N 3.09Å
888	Q	73.9	Confident	69.6	Low	106 Å²	106	87.4 Å²	87.4	50%	0.495	45%	0.454	S	S	.	.	H	α-helix	trans	-56.2	-47.2	179.3	-71.7	170.9	-12.1	0	0	112	Q884 Q890 E891 E892	Q884-Q888 WeakPolarHBondContact O-CG 3.38Å; Q884-Q888 PolarHBondContact O-N 3.28Å; Q888-Q890 VanDerWaalsContact C-N 3.27Å; Q888-Q890 PolarHBondContact O-N 2.9Å; Q888-E891 PolarHBondContact O-N 3.37Å; Q888-E892 PolarHBondContact O-N 3.5Å
889	G	63.2	Low	67.3	Low	32 Å²	32	90.7 Å²	90.7	33%	0.33	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-24.9	176.3	0	0	0	0	0	114.5	L885 Q887 T893	L885-G889 PolarHBondContact O-N 3.45Å; Q887-G889 PolarHBondContact O-N 2.9Å; G889-T893 PolarHBondContact O-OG1 2.87Å
890	Q	60	Low	64.8	Low	119 Å²	119	99.8 Å²	99.8	56%	0.556	52%	0.519	S	S	*	.	H	α-helix	trans	-78.7	-36.2	172.6	-76.8	-178.1	-2	0	0	112.2	Q886 Q887 Q888 S894	Q886-Q890 WeakPolarHBondContact O-CG 3.26Å; Q886-Q890 PolarHBondContact O-N 3.27Å; Q887-Q890 WeakPolarHBondContact O-CA 3.29Å; Q887-Q890 WeakPolarHBondContact O-CB 3.42Å; Q887-Q890 PolarHBondContact O-N 3.36Å; Q888-Q890 VanDerWaalsContact C-N 3.27Å; Q888-Q890 PolarHBondContact O-N 2.9Å; Q890-S894 WeakPolarHBondContact O-CB 3.39Å; Q890-S894 PolarHBondContact O-N 3.45Å; Q890-S894 PolarHBondContact O-OG 2.94Å
891	E	55.2	Low	62.4	Low	120 Å²	120	105.6 Å²	105.6	56%	0.561	55%	0.554	S	S	*	*	H	α-helix	trans	-67.6	-49.8	177.4	-72.5	176.6	161.3	0	0	111.1	Q887 Q888 T893 S894 E895	Q887-E891 PolarHBondContact O-N 3.09Å; Q888-E891 PolarHBondContact O-N 3.37Å; E891-T893 VanDerWaalsContact C-N 3.31Å; E891-T893 PolarHBondContact O-N 2.83Å; E891-S894 WeakPolarHBondContact O-CA 3.49Å; E891-S894 PolarHBondContact O-N 3.47Å; E891-S894 PolarHBondContact O-OG 3.49Å; E891-E895 PolarHBondContact O-N 2.93Å
892	E	49.2	Very low	60.2	Low	140 Å²	140	110.2 Å²	110.2	65%	0.654	58%	0.575	S	S	*	*	H	α-helix	trans	-55.2	-43.9	175.6	-71.9	-179.3	165.7	0	0	112.2	Q888 S894 E895 D896	Q888-E892 PolarHBondContact O-N 3.5Å; E892-S894 PolarHBondContact O-N 3.07Å; E892-E895 PolarHBondContact O-N 3.41Å; E892-D896 PolarHBondContact O-N 3.44Å
893	T	51.3	Low	57.8	Low	98 Å²	98	117.6 Å²	117.6	60%	0.601	61%	0.609	S	S	*	*	H	α-helix	trans	-65.7	-26.3	177.6	-49.4	0	0	0	0	112.3	G889 E891 T897	G889-T893 PolarHBondContact O-OG1 2.87Å; E891-T893 VanDerWaalsContact C-N 3.31Å; E891-T893 PolarHBondContact O-N 2.83Å; T893-T897 PolarHBondContact O-OG1 3.17Å
894	S	52	Low	55.5	Low	70 Å²	70	130.8 Å²	130.8	49%	0.49	66%	0.659	S	S	.	*	H	α-helix	trans	-84.9	-31.7	-179	71.8	0	0	0	0	113.7	Q890 E891 E892 T897	Q890-S894 WeakPolarHBondContact O-CB 3.39Å; Q890-S894 PolarHBondContact O-N 3.45Å; Q890-S894 PolarHBondContact O-OG 2.94Å; E891-S894 WeakPolarHBondContact O-CA 3.49Å; E891-S894 PolarHBondContact O-N 3.47Å; E891-S894 PolarHBondContact O-OG 3.49Å; E892-S894 PolarHBondContact O-N 3.07Å; S894-T897 PolarHBondContact O-N 2.91Å
895	E	46.5	Very low	53.9	Low	152 Å²	152	131.8 Å²	131.8	71%	0.71	67%	0.666	S	S	*	*	H	α-helix	trans	-67.9	-41.4	175.8	-69.5	-165.4	141.7	0	0	111.9	E891 E892 T897 M898	E891-E895 PolarHBondContact O-N 2.93Å; E892-E895 PolarHBondContact O-N 3.41Å; E895-T897 PolarHBondContact O-N 2.68Å; E895-M898 PolarHBondContact O-N 3.39Å; E895-M898 VanDerWaalsContact O-N 3.12Å
896	D	48.3	Very low	52.2	Low	157 Å²	157	132.5 Å²	132.5	84%	0.84	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-12.6	175.3	-101.1	-7.6	0	0	0	113.8	E892	E892-D896 PolarHBondContact O-N 3.44Å
897	T	44.4	Very low	50.6	Low	109 Å²	109	136.8 Å²	136.8	67%	0.669	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-3.4	179.5	-43.9	0	0	0	0	113.1	T893 S894 E895 P899	T893-T897 PolarHBondContact O-OG1 3.17Å; S894-T897 PolarHBondContact O-N 2.91Å; E895-T897 PolarHBondContact O-N 2.68Å; T897-P899 WeakPolarHBondContact O-CD 3.49Å
898	M	38.9	Very low	48.8	Very low	151 Å²	151	139.7 Å²	139.7	74%	0.744	71%	0.708	S	S	*	*	S	Bend	trans	-73.4	120.5	170.9	-71.5	-159.8	72.2	0	0	110.2	E895 Q900	E895-M898 PolarHBondContact O-N 3.39Å; E895-M898 VanDerWaalsContact O-N 3.12Å; M898-Q900 PolarHBondContact O-N 2.94Å; M898-Q900 VanDerWaalsContact O-N 3.13Å
899	P	42.3	Very low	47.2	Very low	109 Å²	109	141.8 Å²	141.8	71%	0.708	72%	0.721	S	S	*	*			trans	-64.9	120.4	175.5	26.9	-32.6	0	0	0	108.7	T897 T901	T897-P899 WeakPolarHBondContact O-CD 3.49Å; P899-T901 PolarHBondContact O-N 3.26Å
900	Q	40.9	Very low	46.1	Very low	190 Å²	190	149.1 Å²	149.1	89%	0.888	75%	0.747	S	S	*	*			trans	-58.7	100.6	168.8	-71.1	-176.2	-3.4	0	0	108.5	M898 M902	M898-Q900 PolarHBondContact O-N 2.94Å; M898-Q900 VanDerWaalsContact O-N 3.13Å; Q900-M902 PolarHBondContact O-N 3.04Å
901	T	41.5	Very low	45.2	Very low	128 Å²	128	151.3 Å²	151.3	79%	0.785	76%	0.761	S	S	*	*			trans	-62.3	101.9	167.4	28.9	0	0	0	0	107.9	P899 E903	P899-T901 PolarHBondContact O-N 3.26Å; T901-E903 VanDerWaalsContact C-N 3.32Å; T901-E903 PolarHBondContact O-N 2.68Å
902	M	42.8	Very low	44.4	Very low	186 Å²	186	153.7 Å²	153.7	92%	0.916	78%	0.776	S	S	*	*			trans	-61	95.3	164.5	-76.9	-177.7	162.8	0	0	108.8	Q900	Q900-M902 PolarHBondContact O-N 3.04Å
903	E	39	Very low	44	Very low	187 Å²	187	154.8 Å²	154.8	87%	0.874	79%	0.786	S	S	*	*			trans	-67.4	150.1	151.8	-68.7	-163.5	129	0	0	109.2	T901	T901-E903 VanDerWaalsContact C-N 3.32Å; T901-E903 PolarHBondContact O-N 2.68Å
904	R	40	Very low	43.3	Very low	321 Å²	321	160 Å²	160	100%	1.211	80%	0.803	S	S	*	*			trans	-78.5	0	-163.5	-79	177.7	166.4	176.2	-4.4	114.9

Retrieved 904 of 904 residues in 1251.7 ms (Link to these results)

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