A0A077YY14_TRITR Loading...

Cyclic nucleotide gated cation channel

AlphaFold DB , UniProt , Accession A0A077YY14, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 682 aa.

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(Predicted Aligned Error values between residue pairs)

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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	36	Very low	38.8	Very low	231 Å²	231	143.4 Å²	143.4	100%	1.138	83%	0.826	S	S	*	*				0	75.5	0	-71	169.7	150.7	0	0	105.9
2	T	37.5	Very low	38.7	Very low	144 Å²	144	143.8 Å²	143.8	88%	0.883	82%	0.823	S	S	*	*				64.1	122.8	102	46.7	0	0	0	0	111.3
3	A	36.9	Very low	38.7	Very low	93 Å²	93	139.7 Å²	139.7	77%	0.769	82%	0.817	S	S	*	*			cis	-165.7	141.8	10.8	0	0	0	0	0	106.7
4	A	38	Very low	38.7	Very low	89 Å²	89	139.1 Å²	139.1	74%	0.736	81%	0.809	S	S	*	*				73.7	136.9	91.7	0	0	0	0	0	118
5	S	38.9	Very low	38.6	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	80%	0.8	S	S	*	*			trans	60.3	143.5	150.3	53.9	0	0	0	0	120
6	E	38.7	Very low	38.4	Very low	180 Å²	180	140.7 Å²	140.7	84%	0.841	80%	0.803	S	S	*	*			cis	-170	156.4	13.3	-121.1	168.3	-170.8	0	0	109.3
7	P	38	Very low	38.1	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	80%	0.804	S	S	*	*			trans	-104.7	162.1	176.2	37.8	-28.5	0	0	0	114.2
8	V	46	Very low	38	Very low	152 Å²	152	140.3 Å²	140.3	92%	0.921	81%	0.809	S	S	*	*			trans	-123.2	133.5	174.1	176.8	0	0	0	0	109.9
9	E	34.8	Very low	37.8	Very low	179 Å²	179	137.9 Å²	137.9	84%	0.836	80%	0.802	S	S	*	*			trans	-123.1	-170.6	-170.2	-145.7	-149.2	179.6	0	0	109.9
10	P	45.6	Very low	37.7	Very low	93 Å²	93	136.8 Å²	136.8	60%	0.604	80%	0.802	S	S	*	*				-126.2	-163.5	-106.5	44	-25.1	0	0	0	113.4
11	K	36.2	Very low	37.5	Very low	187 Å²	187	141.1 Å²	141.1	81%	0.813	81%	0.805	S	S	*	*			trans	165	131.3	150.1	-92.8	163.1	-174.8	-175.8	0	109.3
12	D	37.4	Very low	37.3	Very low	148 Å²	148	137.6 Å²	137.6	79%	0.791	79%	0.79	S	S	*	*				-162.5	128.9	74.2	-74.6	-44.3	0	0	0	110
13	A	38.6	Very low	37.1	Very low	91 Å²	91	137 Å²	137	75%	0.752	79%	0.786	S	S	*	*				64.9	126.2	96	0	0	0	0	0	114
14	D	38.6	Very low	36.9	Very low	131 Å²	131	136.8 Å²	136.8	70%	0.701	79%	0.792	S	S	*	*			cis	-168.9	144.8	49.9	-123.5	-18.5	0	0	0	113.6
15	Q	38.1	Very low	36.6	Very low	145 Å²	145	141 Å²	141	68%	0.678	80%	0.797	S	S	*	*			trans	58.8	106.3	138.4	-73.6	167.5	44.6	0	0	124.2
16	N	34.9	Very low	36.2	Very low	159 Å²	159	142 Å²	142	85%	0.85	80%	0.799	S	S	*	*				153.9	128.2	100	-87.8	-28.7	0	0	0	113.5
17	G	34.2	Very low	36	Very low	79 Å²	79	139.6 Å²	139.6	81%	0.814	80%	0.799	S	S	*	*			trans	129.9	92.1	153.8	0	0	0	0	0	118.5
18	H	35.9	Very low	35.7	Very low	195 Å²	195	139.1 Å²	139.1	90%	0.903	80%	0.798	S	S	*	*			trans	-32.9	161.4	156.1	-77.1	-38.6	0	0	0	116.5
19	S	33.4	Very low	35.1	Very low	96 Å²	96	137.3 Å²	137.3	67%	0.671	79%	0.793	S	S	*	*			cis	177	150.9	-3.9	173.4	0	0	0	0	105.8
20	S	35.4	Very low	35.1	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	79%	0.792	S	S	*	*			trans	71.3	147.8	159.8	72.6	0	0	0	0	119.3
21	R	34.8	Very low	34.5	Very low	227 Å²	227	137.4 Å²	137.4	86%	0.857	80%	0.802	S	S	*	*			cis	-174.5	122.4	-25.3	-154.3	178.8	-159.4	173	4.6	105.3
22	L	31.3	Very low	34.4	Very low	158 Å²	158	136.2 Å²	136.2	83%	0.827	80%	0.802	S	S	*	*			trans	46.5	98.1	153.4	-64.3	165.4	0	0	0	120.9
23	V	34	Very low	34.2	Very low	132 Å²	132	137.4 Å²	137.4	80%	0.8	80%	0.803	S	S	*	*			trans	-154	121.2	131.8	176.5	0	0	0	0	107	Q25	V23-Q25 PolarHBondContact O-N 2.9Å; V23-Q25 VanDerWaalsContact O-N 3.15Å
24	G	31.3	Very low	34	Very low	87 Å²	87	138.7 Å²	138.7	90%	0.897	81%	0.807	S	S	*	*			trans	-70.2	106	-179.4	0	0	0	0	0	111.7
25	Q	32.8	Very low	33.7	Very low	177 Å²	177	139.5 Å²	139.5	83%	0.827	81%	0.81	S	S	*	*			trans	-106.3	143.7	171.4	-80.3	-177.9	-18.7	0	0	111	V23	V23-Q25 PolarHBondContact O-N 2.9Å; V23-Q25 VanDerWaalsContact O-N 3.15Å
26	T	30.6	Very low	33.7	Very low	128 Å²	128	138.2 Å²	138.2	79%	0.785	82%	0.815	S	S	*	*			trans	-42	143.2	175.9	43.9	0	0	0	0	115.8
27	P	34.1	Very low	33.5	Very low	130 Å²	130	138.7 Å²	138.7	84%	0.844	82%	0.816	S	S	*	*			trans	-73.9	137.2	171	31.7	-31.2	0	0	0	110.7
28	S	32.3	Very low	33.6	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	81%	0.814	S	S	*	*			trans	-66.8	142.2	-172.7	43	0	0	0	0	114.7	E30	S28-E30 PolarHBondContact O-N 3.45Å
29	S	32	Very low	33.5	Very low	114 Å²	114	140.5 Å²	140.5	80%	0.797	81%	0.814	S	S	*	*	S	Bend	trans	-69.9	103.9	163.1	167.6	0	0	0	0	109.7
30	E	35.1	Very low	33.5	Very low	175 Å²	175	140.5 Å²	140.5	82%	0.818	82%	0.82	S	S	*	*			trans	-175.4	24.8	161.1	-108.5	163.2	-160.5	0	0	115.7	S28	S28-E30 PolarHBondContact O-N 3.45Å
31	A	34	Very low	33.4	Very low	99 Å²	99	144.2 Å²	144.2	82%	0.818	82%	0.824	S	S	*	*	S	Bend	trans	-127.8	19.4	177.6	0	0	0	0	0	115.2
32	I	34.5	Very low	33.5	Very low	161 Å²	161	144.6 Å²	144.6	83%	0.826	83%	0.826	S	S	*	*	S	Bend	trans	-131.1	42.3	175.5	-47.5	-179.9	0	0	0	109.8
33	E	32.9	Very low	33.8	Very low	174 Å²	174	148.3 Å²	148.3	81%	0.813	83%	0.829	S	S	*	*			trans	-129.2	68.7	179.7	-96	-176.8	165	0	0	111.5
34	S	33.6	Very low	34.1	Very low	117 Å²	117	146.2 Å²	146.2	82%	0.818	82%	0.818	S	S	*	*			trans	-162.4	62.6	154.5	67.2	0	0	0	0	109.9
35	L	33.5	Very low	35.2	Very low	148 Å²	148	144 Å²	144	78%	0.775	79%	0.788	S	S	*	*	S	Bend	trans	-129.6	128.3	166.1	-87.5	161.2	0	0	0	107.5	L37	L35-L37 PolarHBondContact O-N 2.68Å; L35-L37 VanDerWaalsContact O-N 3.14Å
36	P	36.7	Very low	35.6	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	78%	0.781	S	S	*	*			trans	-62.2	119.7	-171.8	24.8	-32.1	0	0	0	110.4	D38	P36-D38 VanDerWaalsContact C-N 3.29Å; P36-D38 PolarHBondContact O-N 3.01Å
37	L	32.3	Very low	36.3	Very low	168 Å²	168	137.9 Å²	137.9	88%	0.88	77%	0.771	S	S	*	*	S	Bend	trans	-66.4	83.8	170	-81	154.1	0	0	0	109.1	L35	L35-L37 PolarHBondContact O-N 2.68Å; L35-L37 VanDerWaalsContact O-N 3.14Å
38	D	35.1	Very low	36.8	Very low	144 Å²	144	136.3 Å²	136.3	77%	0.77	75%	0.748	S	S	*	*	S	Bend	trans	-151.1	20.6	168.9	-131.1	1.5	0	0	0	115.2	P36	P36-D38 VanDerWaalsContact C-N 3.29Å; P36-D38 PolarHBondContact O-N 3.01Å
39	N	34.5	Very low	37.3	Very low	168 Å²	168	133.5 Å²	133.5	90%	0.898	73%	0.727	S	S	*	*			trans	-149.2	27.8	179.7	-92.2	-38.7	0	0	0	116.2
40	A	32.3	Very low	37.8	Very low	96 Å²	96	130.7 Å²	130.7	79%	0.793	71%	0.71	S	S	*	*			trans	-90.7	10.9	-170.4	0	0	0	0	0	117.1
41	E	34.3	Very low	38	Very low	194 Å²	194	129 Å²	129	91%	0.907	70%	0.7	S	S	*	*	S	Bend	trans	-105.1	20.4	-172	-84.3	-169.8	156.4	0	0	117.4
42	R	37.2	Very low	38.5	Very low	234 Å²	234	127.3 Å²	127.3	88%	0.883	68%	0.68	S	S	*	*			trans	-137.6	28.5	-172.5	-85.1	-169	-171.4	-177.3	4.7	120.4
43	R	36.3	Very low	38.9	Very low	236 Å²	236	124.9 Å²	124.9	89%	0.891	67%	0.668	S	S	*	*			trans	-132.4	90	178.7	-66.2	-168	-179.1	-165.4	1.5	117.3
44	P	41.4	Very low	39.4	Very low	89 Å²	89	121.7 Å²	121.7	58%	0.578	66%	0.655	S	S	*	*			trans	-92.9	14.2	167.2	7.2	11.3	0	0	0	114.5	R48	P44-R48 PolarHBondContact O-NE 3.44Å
45	S	54	Low	40	Very low	39 Å²	39	120.2 Å²	120.2	27%	0.273	64%	0.644	S	S	.	*			trans	-96.1	-30.3	-158.1	54.8	0	0	0	0	117.2	V47 R48 V49	S45-V47 PolarHBondContact O-N 3.23Å; S45-R48 WeakPolarHBondContact O-CB 3.43Å; S45-R48 PolarHBondContact O-N 3.27Å; S45-R48 VanDerWaalsContact O-N 3.11Å; S45-V49 PolarHBondContact O-N 2.75Å
46	A	41.9	Very low	40.5	Very low	81 Å²	81	117 Å²	117	67%	0.669	63%	0.627	S	S	*	*	H	α-helix	trans	-67.8	-37.6	-176.8	0	0	0	0	0	113.4	R48 V49 A50	A46-R48 PolarHBondContact O-N 3.11Å; A46-V49 PolarHBondContact O-N 3.03Å; A46-A50 PolarHBondContact O-N 3.12Å
47	V	43.8	Very low	40.8	Very low	96 Å²	96	117.8 Å²	117.8	58%	0.582	62%	0.62	S	S	*	*	H	α-helix	trans	-63.2	-28.3	173.8	177.8	0	0	0	0	111.5	S45 K51	S45-V47 PolarHBondContact O-N 3.23Å; V47-K51 HydrophobicContact CG1-CD 4.33Å; V47-K51 WeakPolarHBondContact O-CG 3.06Å; V47-K51 PolarHBondContact O-N 2.66Å
48	R	44.4	Very low	41	Very low	97 Å²	97	114.3 Å²	114.3	37%	0.366	60%	0.602	S	S	.	*	H	α-helix	trans	-70.2	-41.4	178.3	-73.5	-177.7	-95.4	172.7	-2.5	111.8	P44 S45 A46 K51 T52 H229	P44-R48 PolarHBondContact O-NE 3.44Å; S45-R48 WeakPolarHBondContact O-CB 3.43Å; S45-R48 PolarHBondContact O-N 3.27Å; S45-R48 VanDerWaalsContact O-N 3.11Å; A46-R48 PolarHBondContact O-N 3.11Å; R48-K51 PolarHBondContact O-N 3.32Å; R48-T52 PolarHBondContact O-N 3.14Å; R48-T52 PolarHBondContact O-OG1 3.23Å; R48-H229 WeakPolarHBondContact CD-NE2 3.31Å
49	V	44.5	Very low	41.4	Very low	55 Å²	55	112.2 Å²	112.2	33%	0.333	58%	0.584	S	S	.	*	H	α-helix	trans	-67.1	-42.5	179.2	-178.3	0	0	0	0	112	S45 A46 K51 T52 L53	S45-V49 PolarHBondContact O-N 2.75Å; A46-V49 PolarHBondContact O-N 3.03Å; V49-K51 VanDerWaalsContact C-N 3.34Å; V49-K51 PolarHBondContact O-N 3.37Å; V49-T52 WeakPolarHBondContact O-CB 2.98Å; V49-T52 PolarHBondContact O-N 3.46Å; V49-L53 PolarHBondContact O-N 3.07Å
50	A	41.8	Very low	41.8	Very low	54 Å²	54	108.4 Å²	108.4	45%	0.446	56%	0.563	S	S	.	*	H	α-helix	trans	-63.9	-37.8	178.2	0	0	0	0	0	112.7	A46 T52 L53 I54	A46-A50 PolarHBondContact O-N 3.12Å; A50-T52 VanDerWaalsContact C-N 3.33Å; A50-T52 PolarHBondContact O-N 3.14Å; A50-L53 PolarHBondContact O-N 3.05Å; A50-I54 WeakPolarHBondContact O-CG1 3.35Å; A50-I54 PolarHBondContact O-N 3.05Å
51	K	39.1	Very low	42.2	Very low	141 Å²	141	107.7 Å²	107.7	61%	0.613	55%	0.546	S	S	*	.	H	α-helix	trans	-64.5	-37	174.5	-77.4	178.9	178.2	179.9	0	112.1	V47 R48 V49 I54 C55	V47-K51 HydrophobicContact CG1-CD 4.33Å; V47-K51 WeakPolarHBondContact O-CG 3.06Å; V47-K51 PolarHBondContact O-N 2.66Å; R48-K51 PolarHBondContact O-N 3.32Å; V49-K51 VanDerWaalsContact C-N 3.34Å; V49-K51 PolarHBondContact O-N 3.37Å; K51-I54 PolarHBondContact O-N 3.25Å; K51-C55 PolarHBondContact O-N 3Å; K51-C55 VanDerWaalsContact O-N 3.1Å
52	T	43.7	Very low	42.5	Very low	63 Å²	63	104.5 Å²	104.5	39%	0.387	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-44	176.8	-52.7	0	0	0	0	112	R48 V49 A50 C55 I56	R48-T52 PolarHBondContact O-N 3.14Å; R48-T52 PolarHBondContact O-OG1 3.23Å; V49-T52 WeakPolarHBondContact O-CB 2.98Å; V49-T52 PolarHBondContact O-N 3.46Å; A50-T52 VanDerWaalsContact C-N 3.33Å; A50-T52 PolarHBondContact O-N 3.14Å; T52-C55 PolarHBondContact O-N 3.11Å; T52-I56 HydrophobicContact CG2-CD1 4.26Å; T52-I56 WeakPolarHBondContact O-CG1 3.44Å; T52-I56 PolarHBondContact O-N 3.37Å
53	L	43.2	Very low	42.8	Very low	109 Å²	109	96.4 Å²	96.4	57%	0.571	50%	0.502	S	S	*	.	H	α-helix	trans	-64.4	-42.3	179.2	-74.1	167.6	0	0	0	112.8	V49 A50 C55 I56 Q57	V49-L53 PolarHBondContact O-N 3.07Å; A50-L53 PolarHBondContact O-N 3.05Å; L53-C55 VanDerWaalsContact C-N 3.31Å; L53-C55 PolarHBondContact O-N 2.85Å; L53-I56 PolarHBondContact O-N 3.33Å; L53-Q57 PolarHBondContact O-N 2.95Å
54	I	44.5	Very low	43.5	Very low	108 Å²	108	90.7 Å²	90.7	55%	0.554	49%	0.485	S	S	*	.	H	α-helix	trans	-65.3	-36.5	177.3	-64.7	170.2	0	0	0	111.1	A50 K51 Q57 N58	A50-I54 WeakPolarHBondContact O-CG1 3.35Å; A50-I54 PolarHBondContact O-N 3.05Å; K51-I54 PolarHBondContact O-N 3.25Å; I54-Q57 PolarHBondContact O-N 3.25Å; I54-N58 PolarHBondContact O-N 2.89Å
55	C	45.3	Very low	43.5	Very low	86 Å²	86	94.6 Å²	94.6	58%	0.581	49%	0.488	S	S	*	.	H	α-helix	trans	-65.8	-40.3	174.7	-82.2	0	0	0	0	112.8	K51 T52 L53 Q57 N58 W59	K51-C55 PolarHBondContact O-N 3Å; K51-C55 VanDerWaalsContact O-N 3.1Å; T52-C55 PolarHBondContact O-N 3.11Å; L53-C55 VanDerWaalsContact C-N 3.31Å; L53-C55 PolarHBondContact O-N 2.85Å; C55-Q57 VanDerWaalsContact C-N 3.33Å; C55-Q57 PolarHBondContact O-N 2.78Å; C55-N58 PolarHBondContact O-N 3.23Å; C55-W59 VanDerWaalsContact O-CB 3.31Å; C55-W59 WeakPolarHBondContact O-CB 3.47Å; C55-W59 PolarHBondContact O-N 3.42Å
56	I	43.5	Very low	43	Very low	80 Å²	80	96.2 Å²	96.2	41%	0.41	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-43.4	176.3	-69.3	164.8	0	0	0	110.9	T52 L53 W59 L60	T52-I56 HydrophobicContact CG2-CD1 4.26Å; T52-I56 WeakPolarHBondContact O-CG1 3.44Å; T52-I56 PolarHBondContact O-N 3.37Å; L53-I56 PolarHBondContact O-N 3.33Å; I56-W59 WeakPolarHBondContact O-CB 3.37Å; I56-W59 PolarHBondContact O-N 3.1Å; I56-L60 HydrophobicContact CG2-CD1 4.2Å; I56-L60 PolarHBondContact O-N 3.42Å
57	Q	42.9	Very low	43	Very low	135 Å²	135	101 Å²	101	63%	0.631	49%	0.489	S	S	*	.	H	α-helix	trans	-69.3	-39.3	-178.8	-169	147.8	-8.3	0	0	112.7	L53 I54 C55 W59 N61	L53-Q57 PolarHBondContact O-N 2.95Å; I54-Q57 PolarHBondContact O-N 3.25Å; C55-Q57 VanDerWaalsContact C-N 3.33Å; C55-Q57 PolarHBondContact O-N 2.78Å; Q57-W59 VanDerWaalsContact C-N 3.31Å; Q57-W59 PolarHBondContact O-N 2.95Å; Q57-N61 PolarHBondContact O-N 3.06Å; Q57-N61 PolarHBondContact O-ND2 2.88Å
58	N	38.5	Very low	42.7	Very low	96 Å²	96	100.2 Å²	100.2	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-69.6	-28.6	174.6	-79.6	-31.8	0	0	0	113.1	I54 C55	I54-N58 PolarHBondContact O-N 2.89Å; C55-N58 PolarHBondContact O-N 3.23Å
59	W	42.4	Very low	42.4	Very low	100 Å²	100	100.5 Å²	100.5	38%	0.379	50%	0.501	S	S	.	.	H	α-helix	trans	-70.2	-46.6	173.9	174.7	89.3	0	0	0	112.1	C55 I56 Q57 N61 R62 V63 G232 V236	C55-W59 VanDerWaalsContact O-CB 3.31Å; C55-W59 WeakPolarHBondContact O-CB 3.47Å; C55-W59 PolarHBondContact O-N 3.42Å; I56-W59 WeakPolarHBondContact O-CB 3.37Å; I56-W59 PolarHBondContact O-N 3.1Å; Q57-W59 VanDerWaalsContact C-N 3.31Å; Q57-W59 PolarHBondContact O-N 2.95Å; W59-N61 VanDerWaalsContact C-N 3.3Å; W59-N61 PolarHBondContact O-N 3.19Å; W59-R62 PolarHBondContact O-N 3.19Å; W59-V63 HydrophobicContact CD2-CG2 4.08Å; W59-V63 HydrophobicContact CH2-CG2 4.42Å; W59-V63 HydrophobicContact CZ2-CG2 3.92Å; W59-V63 PolarHBondContact O-N 3.37Å; W59-G232 PolarHBondContact NE1-O 3.07Å; W59-V236 HydrophobicContact CZ2-CG2 4.41Å
60	L	43.1	Very low	42.3	Very low	87 Å²	87	102.7 Å²	102.7	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-52.4	-47.9	174.9	-88.2	156.9	0	0	0	111.7	I56 R62 V63 E64	I56-L60 HydrophobicContact CG2-CD1 4.2Å; I56-L60 PolarHBondContact O-N 3.42Å; L60-R62 PolarHBondContact O-N 3.5Å; L60-R62 VanDerWaalsContact O-N 3.13Å; L60-V63 PolarHBondContact O-N 2.88Å; L60-E64 PolarHBondContact O-N 2.95Å
61	N	40.5	Very low	42	Very low	82 Å²	82	103 Å²	103	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-66.4	-12.4	178.6	-72.8	-22.1	0	0	0	114.7	Q57 W59 R65	Q57-N61 PolarHBondContact O-N 3.06Å; Q57-N61 PolarHBondContact O-ND2 2.88Å; W59-N61 VanDerWaalsContact C-N 3.3Å; W59-N61 PolarHBondContact O-N 3.19Å; N61-R65 PolarHBondContact O-NE 2.91Å
62	R	41.6	Very low	42	Very low	127 Å²	127	103.7 Å²	103.7	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-102.1	-35.4	-177.9	-167.2	177.9	-68.5	-153.5	-0.5	112.3	W59 L60 E64 R65 R66	W59-R62 PolarHBondContact O-N 3.19Å; L60-R62 PolarHBondContact O-N 3.5Å; L60-R62 VanDerWaalsContact O-N 3.13Å; R62-E64 PolarHBondContact O-N 3.03Å; R62-R65 PolarHBondContact O-N 3.47Å; R62-R66 PolarHBondContact O-N 3.28Å
63	V	42.3	Very low	41.7	Very low	63 Å²	63	111 Å²	111	38%	0.382	55%	0.545	S	S	.	.	H	α-helix	trans	-59.7	-38.8	172.2	172.2	0	0	0	0	110.7	W59 L60 R65	W59-V63 HydrophobicContact CD2-CG2 4.08Å; W59-V63 HydrophobicContact CH2-CG2 4.42Å; W59-V63 HydrophobicContact CZ2-CG2 3.92Å; W59-V63 PolarHBondContact O-N 3.37Å; L60-V63 PolarHBondContact O-N 2.88Å; V63-R65 VanDerWaalsContact C-N 3.33Å; V63-R65 PolarHBondContact O-N 3.49Å
64	E	50.8	Low	41.7	Very low	117 Å²	117	113.1 Å²	113.1	55%	0.547	55%	0.546	S	S	.	.	H	α-helix	trans	-68.2	-31.8	179.6	-156.9	151.2	-144.2	0	0	112.7	L60 R62	L60-E64 PolarHBondContact O-N 2.95Å; R62-E64 PolarHBondContact O-N 3.03Å
65	R	42.7	Very low	41.6	Very low	170 Å²	170	114.4 Å²	114.4	64%	0.642	55%	0.554	S	S	*	*	H	α-helix	trans	-72.6	-41.3	178	-94.8	-177.4	-78.1	179	-8.7	113.9	N61 R62 V63 R67 S68 T69	N61-R65 PolarHBondContact O-NE 2.91Å; R62-R65 PolarHBondContact O-N 3.47Å; V63-R65 VanDerWaalsContact C-N 3.33Å; V63-R65 PolarHBondContact O-N 3.49Å; R65-R67 VanDerWaalsContact C-N 3.26Å; R65-R67 PolarHBondContact O-N 3.18Å; R65-S68 PolarHBondContact O-N 3.04Å; R65-S68 VanDerWaalsContact O-N 3.16Å; R65-S68 PolarHBondContact O-OG 3.36Å; R65-T69 PolarHBondContact O-OG1 2.94Å
66	R	42.3	Very low	41.5	Very low	73 Å²	73	117 Å²	117	28%	0.275	56%	0.562	S	S	.	*	H	α-helix	trans	-64.9	-30.6	178.5	-76.9	-163.1	-171.8	177.3	4.2	112.9	R62 S68 T69 E70	R62-R66 PolarHBondContact O-N 3.28Å; R66-S68 PolarHBondContact O-N 2.98Å; R66-T69 PolarHBondContact O-N 2.99Å; R66-E70 PolarHBondContact O-N 2.88Å
67	R	42.1	Very low	41.5	Very low	181 Å²	181	117 Å²	117	68%	0.683	56%	0.562	S	S	*	*	H	α-helix	trans	-57.9	-28.9	174.3	-133.4	179	-161.6	162.6	6.4	113.2	R65	R65-R67 VanDerWaalsContact C-N 3.26Å; R65-R67 PolarHBondContact O-N 3.18Å
68	S	38.2	Very low	41.8	Very low	80 Å²	80	115.6 Å²	115.6	56%	0.559	56%	0.556	S	S	*	*	H	α-helix	trans	-85.6	-25.2	-179	81.1	0	0	0	0	114.4	R65 R66	R65-S68 PolarHBondContact O-N 3.04Å; R65-S68 VanDerWaalsContact O-N 3.16Å; R65-S68 PolarHBondContact O-OG 3.36Å; R66-S68 PolarHBondContact O-N 2.98Å
69	T	38.4	Very low	42.1	Very low	104 Å²	104	114.5 Å²	114.5	64%	0.638	55%	0.55	S	S	*	.	H	α-helix	trans	-102.6	-19.4	-170.8	32.3	0	0	0	0	114.9	R65 R66	R65-T69 PolarHBondContact O-OG1 2.94Å; R66-T69 PolarHBondContact O-N 2.99Å
70	E	41	Very low	42.4	Very low	100 Å²	100	114.4 Å²	114.4	47%	0.467	56%	0.56	S	S	.	*	H	α-helix	trans	-111.6	-26	-175	-73.4	167.9	176.6	0	0	113.5	R66 I72 Y74	R66-E70 PolarHBondContact O-N 2.88Å; E70-I72 VanDerWaalsContact C-N 3.33Å; E70-I72 PolarHBondContact O-N 2.83Å; E70-Y74 HydrophobicContact CB-CE2 4.45Å; E70-Y74 WeakPolarHBondContact O-CD2 3.27Å
71	G	36.3	Very low	42.6	Very low	60 Å²	60	113 Å²	113	62%	0.619	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-3.3	-172.5	0	0	0	0	0	117.8
72	I	37.9	Very low	42.8	Very low	156 Å²	156	111.6 Å²	111.6	80%	0.8	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-8.3	-173.8	-61	172.1	0	0	0	112.1	E70	E70-I72 VanDerWaalsContact C-N 3.33Å; E70-I72 PolarHBondContact O-N 2.83Å
73	R	37.5	Very low	42.8	Very low	218 Å²	218	106.9 Å²	106.9	82%	0.823	53%	0.533	S	S	*	.	S	Bend	trans	-108.7	-8.9	-169.1	-143.4	170.6	-173.1	170	1.4	115.8
74	Y	42.9	Very low	42.8	Very low	153 Å²	153	108 Å²	108	60%	0.6	54%	0.544	S	S	*	.	S	Bend	trans	-95.7	-26.3	-171.3	-74.5	-83.9	0	0	0	115.7	E70 L76	E70-Y74 HydrophobicContact CB-CE2 4.45Å; E70-Y74 WeakPolarHBondContact O-CD2 3.27Å; Y74-L76 VanDerWaalsContact C-N 3.34Å; Y74-L76 PolarHBondContact O-N 2.73Å
75	D	44.4	Very low	42.4	Very low	135 Å²	135	110 Å²	110	72%	0.722	55%	0.551	S	S	*	*	H	α-helix	trans	-75.1	-17.1	-175.3	-88	-24.6	0	0	0	114.6
76	L	41.5	Very low	42.2	Very low	141 Å²	141	107.6 Å²	107.6	74%	0.738	55%	0.551	S	S	*	*	H	α-helix	trans	-86.6	-30	-171.5	-139.3	78	0	0	0	114	Y74	Y74-L76 VanDerWaalsContact C-N 3.34Å; Y74-L76 PolarHBondContact O-N 2.73Å
77	D	44.3	Very low	42	Very low	78 Å²	78	108.7 Å²	108.7	42%	0.417	57%	0.569	S	S	.	*	H	α-helix	trans	-92.6	-22	-172.7	-81	-12.4	0	0	0	113.5	V80 K81	D77-V80 PolarHBondContact O-N 3.22Å; D77-K81 PolarHBondContact O-N 2.97Å
78	E	49.4	Very low	41.7	Very low	107 Å²	107	107.3 Å²	107.3	50%	0.5	58%	0.575	S	S	.	*	H	α-helix	trans	-74.6	-30.4	-179.5	-160.3	164	-144.5	0	0	112.4	V80 S82 K132	E78-V80 VanDerWaalsContact C-N 3.33Å; E78-S82 PolarHBondContact O-N 3.28Å; E78-S82 PolarHBondContact O-OG 2.89Å; E78-K132 VanDerWaalsContact OE1-CE 3.24Å; E78-K132 WeakPolarHBondContact OE1-CE 3.26Å; E78-K132 IonicContact OE1-NZ 3.07Å; E78-K132 PolarHBondContact OE1-NZ 3.01Å
79	L	44.3	Very low	41.6	Very low	72 Å²	72	111.9 Å²	111.9	38%	0.377	59%	0.587	S	S	.	*	H	α-helix	trans	-69.7	-26.2	171.6	-77.1	161.9	0	0	0	113.3	S82 P458 L461	L79-S82 PolarHBondContact O-OG 2.94Å; L79-P458 HydrophobicContact CB-CG 4.21Å; L79-P458 HydrophobicContact CD1-CG 4.11Å; L79-P458 HydrophobicContact CD2-CG 4.23Å; L79-P458 HydrophobicContact CG-CG 4.43Å; L79-L461 HydrophobicContact CD2-CD1 3.4Å
80	V	48.7	Very low	41.2	Very low	98 Å²	98	112.2 Å²	112.2	59%	0.594	59%	0.593	S	S	*	*	H	α-helix	trans	-81.3	-29.9	179.3	177.1	0	0	0	0	111.3	D77 E78	D77-V80 PolarHBondContact O-N 3.22Å; E78-V80 VanDerWaalsContact C-N 3.33Å
81	K	47.3	Very low	40.6	Very low	59 Å²	59	118.5 Å²	118.5	26%	0.257	61%	0.613	S	S	.	*	H	α-helix	trans	-88.2	-30.2	-176.6	-81.1	171.8	155.9	-131	0	115.2	D77 S83 S84 K85 G198 M199	D77-K81 PolarHBondContact O-N 2.97Å; K81-S83 VanDerWaalsContact C-N 3.3Å; K81-S84 PolarHBondContact O-N 3.46Å; K81-K85 PolarHBondContact O-N 3.25Å; K81-G198 WeakPolarHBondContact CD-O 3.3Å; K81-G198 VanDerWaalsContact CE-C 3.44Å; K81-G198 WeakPolarHBondContact CE-O 3.48Å; K81-G198 VanDerWaalsContact NZ-C 3.3Å; K81-G198 PolarHBondContact NZ-O 2.82Å; K81-M199 WeakPolarHBondContact CE-SD 3.32Å; K81-M199 VanDerWaalsContact NZ-CA 3.29Å; K81-M199 PolarHBondContact NZ-SD 2.87Å
82	S	45.4	Very low	40.4	Very low	51 Å²	51	124.8 Å²	124.8	36%	0.357	62%	0.623	S	S	.	*	H	α-helix	trans	-64.2	-39.8	169.9	58.6	0	0	0	0	110.7	E78 L79 S84 K85	E78-S82 PolarHBondContact O-N 3.28Å; E78-S82 PolarHBondContact O-OG 2.89Å; L79-S82 PolarHBondContact O-OG 2.94Å; S82-S84 VanDerWaalsContact C-N 3.26Å; S82-S84 PolarHBondContact O-N 3.47Å; S82-K85 PolarHBondContact O-N 2.61Å
83	S	40.8	Very low	40	Very low	28 Å²	28	124.9 Å²	124.9	20%	0.196	63%	0.625	C	S	.	*	H	α-helix	trans	-66.3	-18.8	178.7	-173.1	0	0	0	0	115.1	K81	K81-S83 VanDerWaalsContact C-N 3.3Å
84	S	42.5	Very low	39.7	Very low	88 Å²	88	119.2 Å²	119.2	62%	0.615	62%	0.619	S	S	*	*	H	α-helix	trans	-103.8	-13.4	-176.8	-168.9	0	0	0	0	114.2	K81 S82	K81-S84 PolarHBondContact O-N 3.46Å; S82-S84 VanDerWaalsContact C-N 3.26Å; S82-S84 PolarHBondContact O-N 3.47Å
85	K	42.9	Very low	39	Very low	159 Å²	159	119.4 Å²	119.4	69%	0.691	63%	0.63	S	S	*	*	H	α-helix	trans	-95.4	-19.3	178.7	-80.2	-174.5	173.5	-175	0	113.5	K81 S82 S87	K81-K85 PolarHBondContact O-N 3.25Å; S82-K85 PolarHBondContact O-N 2.61Å; K85-S87 VanDerWaalsContact C-N 3.28Å; K85-S87 PolarHBondContact O-N 3.48Å
86	D	39.1	Very low	38.2	Very low	119 Å²	119	117.4 Å²	117.4	64%	0.636	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-5.5	-177.7	-67	-17.7	0	0	0	114
87	S	37.2	Very low	37.7	Very low	95 Å²	95	116.3 Å²	116.3	66%	0.664	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-2.4	176.2	61.2	0	0	0	0	115	K85	K85-S87 VanDerWaalsContact C-N 3.28Å; K85-S87 PolarHBondContact O-N 3.48Å
88	L	35.4	Very low	37.2	Very low	153 Å²	153	118.4 Å²	118.4	80%	0.801	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	-2.7	-177.6	-127	87.6	0	0	0	115.9
89	H	36.4	Very low	36.4	Very low	176 Å²	176	118.7 Å²	118.7	82%	0.815	66%	0.661	S	S	*	*			trans	-115.1	61.3	173.7	-85.8	-43	0	0	0	112.2
90	S	29.4	Very low	35.8	Very low	110 Å²	110	122.9 Å²	122.9	77%	0.769	68%	0.683	S	S	*	*			trans	-119.4	60.4	164.9	173	0	0	0	0	109.8
91	R	30	Very low	34.9	Very low	232 Å²	232	125.3 Å²	125.3	88%	0.875	69%	0.692	S	S	*	*	S	Bend	trans	-179.6	125.4	163.3	-114.1	166.7	171.1	170.4	-2.8	109.7
92	K	30.6	Very low	34.3	Very low	192 Å²	192	130.9 Å²	130.9	84%	0.835	72%	0.723	S	S	*	*			trans	83	95.5	178.4	-57.8	178.3	174.3	-179.9	0	114.4
93	D	30.9	Very low	33.6	Very low	159 Å²	159	131.4 Å²	131.4	85%	0.85	74%	0.736	S	S	*	*				-178.6	87.4	109.3	-81.2	-16.5	0	0	0	109.7
94	S	29.6	Very low	33.3	Very low	98 Å²	98	138 Å²	138	69%	0.685	76%	0.764	S	S	*	*			trans	-64.2	137.5	153.1	46.1	0	0	0	0	109.5
95	N	28.5	Very low	33	Very low	158 Å²	158	140.6 Å²	140.6	85%	0.845	78%	0.779	S	S	*	*			trans	80.6	87.8	162.8	-47.4	-22.4	0	0	0	116.8
96	A	28.7	Very low	32.8	Very low	93 Å²	93	137.3 Å²	137.3	77%	0.769	77%	0.772	S	S	*	*			trans	-176.3	64.5	143	0	0	0	0	0	112.6	V98	A96-V98 PolarHBondContact O-N 2.96Å
97	S	30.8	Very low	33.1	Very low	117 Å²	117	138.4 Å²	138.4	82%	0.818	78%	0.783	S	S	*	*			trans	-86.3	90.6	154.7	58.3	0	0	0	0	107.7	V99	S97-V99 PolarHBondContact O-N 2.85Å; S97-V99 VanDerWaalsContact O-N 3.1Å
98	V	32.8	Very low	33.6	Very low	122 Å²	122	137.3 Å²	137.3	74%	0.739	78%	0.775	S	S	*	*			trans	-65.7	105.3	173.7	173.3	0	0	0	0	108.2	A96 L100	A96-V98 PolarHBondContact O-N 2.96Å; V98-L100 PolarHBondContact O-N 2.74Å
99	V	32.5	Very low	34.4	Very low	113 Å²	113	131.8 Å²	131.8	69%	0.685	76%	0.755	S	S	*	*			trans	-68.5	114.3	166	175.5	0	0	0	0	107.3	S97 N101	S97-V99 PolarHBondContact O-N 2.85Å; S97-V99 VanDerWaalsContact O-N 3.1Å; V99-N101 PolarHBondContact O-N 2.68Å
100	L	33.1	Very low	35	Very low	161 Å²	161	129.3 Å²	129.3	84%	0.843	75%	0.747	S	S	*	*			trans	-73.8	83.4	165.7	-77.5	168.4	0	0	0	108.2	V98 I102	V98-L100 PolarHBondContact O-N 2.74Å; L100-I102 PolarHBondContact O-N 3.26Å
101	N	29.9	Very low	36.4	Very low	148 Å²	148	127 Å²	127	79%	0.791	73%	0.731	S	S	*	*			trans	-70.5	107.1	163.7	-111	-7.1	0	0	0	107.4	V99 G103	V99-N101 PolarHBondContact O-N 2.68Å; N101-G103 PolarHBondContact O-N 2.74Å
102	I	34	Very low	37.9	Very low	177 Å²	177	118.9 Å²	118.9	91%	0.908	71%	0.71	S	S	*	*			trans	-75.7	82.5	171	-56.4	174.3	0	0	0	106.4	L100	L100-I102 PolarHBondContact O-N 3.26Å
103	G	30.6	Very low	39.3	Very low	61 Å²	61	115.1 Å²	115.1	63%	0.629	70%	0.698	S	S	*	*			trans	-128.5	124.7	172.8	0	0	0	0	0	109.2	N101	N101-G103 PolarHBondContact O-N 2.74Å
104	E	33.5	Very low	41.2	Very low	166 Å²	166	114 Å²	114	78%	0.776	69%	0.686	S	S	*	*			trans	33.8	118.7	167.9	-64.6	-179.2	174.1	0	0	118.8	T106	E104-T106 PolarHBondContact O-N 2.92Å
105	P	36.6	Very low	43.1	Very low	143 Å²	143	116.4 Å²	116.4	93%	0.929	68%	0.684	S	S	*	*			trans	-75.2	75.4	-180	34.4	-33.4	0	0	0	110.1
106	T	38.3	Very low	45	Very low	91 Å²	91	112.8 Å²	112.8	56%	0.558	66%	0.664	S	S	*	*			trans	-81.1	140.4	167.1	59	0	0	0	0	108.4	E104 S108 G109	E104-T106 PolarHBondContact O-N 2.92Å; T106-S108 PolarHBondContact O-N 2.79Å; T106-S108 PolarHBondContact O-OG 2.86Å; T106-S108 VanDerWaalsContact O-OG 3.06Å; T106-G109 PolarHBondContact O-N 3.33Å
107	V	47.1	Very low	46.9	Very low	142 Å²	142	111 Å²	111	86%	0.861	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-28.9	-12.1	-174.8	-176	0	0	0	0	118.9	G109	V107-G109 VanDerWaalsContact C-N 3.32Å; V107-G109 PolarHBondContact O-N 2.78Å
108	S	47.5	Very low	48.7	Very low	71 Å²	71	110.4 Å²	110.4	50%	0.497	64%	0.637	S	S	.	*	H	α-helix	trans	-63.5	-21.2	170.3	71.8	0	0	0	0	116.3	T106 L110 S111 S112	T106-S108 PolarHBondContact O-N 2.79Å; T106-S108 PolarHBondContact O-OG 2.86Å; T106-S108 VanDerWaalsContact O-OG 3.06Å; S108-L110 PolarHBondContact O-N 3.39Å; S108-S111 PolarHBondContact O-N 3.48Å; S108-S111 PolarHBondContact O-OG 2.82Å; S108-S112 PolarHBondContact O-N 2.91Å; S108-S112 PolarHBondContact O-OG 3.5Å
109	G	51.1	Low	50.4	Low	37 Å²	37	110.6 Å²	110.6	38%	0.381	63%	0.63	S	S	.	*	H	α-helix	trans	-64.5	-36.7	-178.5	0	0	0	0	0	113.8	T106 V107 S112 L113	T106-G109 PolarHBondContact O-N 3.33Å; V107-G109 VanDerWaalsContact C-N 3.32Å; V107-G109 PolarHBondContact O-N 2.78Å; G109-S112 PolarHBondContact O-N 3.14Å; G109-L113 WeakPolarHBondContact O-CB 3.38Å; G109-L113 WeakPolarHBondContact O-CG 3.32Å; G109-L113 PolarHBondContact O-N 3.34Å
110	L	49.6	Very low	52.1	Low	124 Å²	124	112.4 Å²	112.4	65%	0.649	62%	0.624	S	S	*	*	H	α-helix	trans	-72.2	-33.4	-177.9	-148.3	81.4	0	0	0	112.3	S108 K114	S108-L110 PolarHBondContact O-N 3.39Å; L110-K114 WeakPolarHBondContact O-CB 3.49Å; L110-K114 WeakPolarHBondContact O-CG 3.43Å; L110-K114 PolarHBondContact O-N 3.37Å
111	S	59.5	Low	53.7	Low	62 Å²	62	106.6 Å²	106.6	43%	0.434	60%	0.6	S	S	.	*	H	α-helix	trans	-74.1	-34.7	175.7	69.2	0	0	0	0	111.6	S108 K114 K115	S108-S111 PolarHBondContact O-N 3.48Å; S108-S111 PolarHBondContact O-OG 2.82Å; S111-K114 PolarHBondContact O-N 3.05Å; S111-K115 WeakPolarHBondContact O-CG 3.42Å; S111-K115 PolarHBondContact O-N 3.19Å
112	S	61.3	Low	55.4	Low	61 Å²	61	103.9 Å²	103.9	43%	0.427	59%	0.585	S	S	.	*	H	α-helix	trans	-66.5	-43.1	173.4	-58	0	0	0	0	111.6	S108 G109 K115 L116	S108-S112 PolarHBondContact O-N 2.91Å; S108-S112 PolarHBondContact O-OG 3.5Å; G109-S112 PolarHBondContact O-N 3.14Å; S112-K115 PolarHBondContact O-N 3.02Å; S112-L116 WeakPolarHBondContact O-CG 3.43Å; S112-L116 PolarHBondContact O-N 3.4Å
113	L	60.2	Low	57.1	Low	113 Å²	113	98.3 Å²	98.3	59%	0.592	56%	0.555	S	S	*	*	H	α-helix	trans	-64.2	-41.2	173.3	-75.2	172	0	0	0	112.2	G109 L116 A117	G109-L113 WeakPolarHBondContact O-CB 3.38Å; G109-L113 WeakPolarHBondContact O-CG 3.32Å; G109-L113 PolarHBondContact O-N 3.34Å; L113-L116 PolarHBondContact O-N 2.86Å; L113-A117 VanDerWaalsContact O-CB 3.23Å; L113-A117 WeakPolarHBondContact O-CB 3.1Å; L113-A117 PolarHBondContact O-N 2.9Å
114	K	69.8	Low	58.9	Low	135 Å²	135	96.9 Å²	96.9	59%	0.587	53%	0.532	S	S	*	.	H	α-helix	trans	-62.7	-40.7	173.6	-79.4	-177.5	179.1	-175.4	0	112.3	L110 S111 A117 N118	L110-K114 WeakPolarHBondContact O-CB 3.49Å; L110-K114 WeakPolarHBondContact O-CG 3.43Å; L110-K114 PolarHBondContact O-N 3.37Å; S111-K114 PolarHBondContact O-N 3.05Å; K114-A117 PolarHBondContact O-N 2.88Å; K114-N118 WeakPolarHBondContact O-CB 3.26Å; K114-N118 VanDerWaalsContact O-CG 3.29Å; K114-N118 PolarHBondContact O-N 2.99Å
115	K	69.1	Low	60.6	Low	149 Å²	149	92.7 Å²	92.7	65%	0.648	52%	0.515	S	S	*	.	H	α-helix	trans	-63.2	-45.9	175.4	-78.6	-179.9	-179.7	-179.5	0	111.6	S111 S112 N118 Q119	S111-K115 WeakPolarHBondContact O-CG 3.42Å; S111-K115 PolarHBondContact O-N 3.19Å; S112-K115 PolarHBondContact O-N 3.02Å; K115-N118 PolarHBondContact O-N 3.31Å; K115-Q119 WeakPolarHBondContact O-CB 3.4Å; K115-Q119 WeakPolarHBondContact O-CG 3.09Å; K115-Q119 PolarHBondContact O-N 2.63Å
116	L	69.4	Low	61.9	Low	83 Å²	83	93.8 Å²	93.8	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-49.4	174.8	-73.7	168	0	0	0	110.6	S112 L113 N118 Q119 W120	S112-L116 WeakPolarHBondContact O-CG 3.43Å; S112-L116 PolarHBondContact O-N 3.4Å; L113-L116 PolarHBondContact O-N 2.86Å; L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 3.28Å; L116-Q119 PolarHBondContact O-N 2.83Å; L116-Q119 VanDerWaalsContact O-N 3.1Å; L116-W120 WeakPolarHBondContact O-CB 3.35Å; L116-W120 PolarHBondContact O-N 2.82Å
117	A	68	Low	63.6	Low	55 Å²	55	94.6 Å²	94.6	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-57	-41.4	177.2	0	0	0	0	0	112.2	L113 K114 W120 A121	L113-A117 VanDerWaalsContact O-CB 3.23Å; L113-A117 WeakPolarHBondContact O-CB 3.1Å; L113-A117 PolarHBondContact O-N 2.9Å; K114-A117 PolarHBondContact O-N 2.88Å; A117-W120 PolarHBondContact O-N 3.08Å; A117-A121 WeakPolarHBondContact O-CB 3.35Å; A117-A121 PolarHBondContact O-N 2.93Å
118	N	68.5	Low	65.1	Low	104 Å²	104	89 Å²	89	56%	0.556	47%	0.465	S	S	*	.	H	α-helix	trans	-68.8	-39.1	176	-76.6	-8.5	0	0	0	112.7	K114 K115 L116 W120 N122	K114-N118 WeakPolarHBondContact O-CB 3.26Å; K114-N118 VanDerWaalsContact O-CG 3.29Å; K114-N118 PolarHBondContact O-N 2.99Å; K115-N118 PolarHBondContact O-N 3.31Å; L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 3.28Å; N118-W120 VanDerWaalsContact C-N 3.34Å; N118-N122 VanDerWaalsContact O-CB 3.31Å; N118-N122 WeakPolarHBondContact O-CB 3.05Å; N118-N122 VanDerWaalsContact O-CG 3.24Å; N118-N122 PolarHBondContact O-N 2.92Å; N118-N122 PolarHBondContact O-ND2 3.46Å
119	Q	69.9	Low	66.6	Low	126 Å²	126	85.6 Å²	85.6	59%	0.589	44%	0.441	S	S	*	.	H	α-helix	trans	-62.9	-43.4	173.5	-78.6	178.7	-13.6	0	0	111.4	K115 L116 N122 K123	K115-Q119 WeakPolarHBondContact O-CB 3.4Å; K115-Q119 WeakPolarHBondContact O-CG 3.09Å; K115-Q119 PolarHBondContact O-N 2.63Å; L116-Q119 PolarHBondContact O-N 2.83Å; L116-Q119 VanDerWaalsContact O-N 3.1Å; Q119-N122 PolarHBondContact O-N 2.84Å; Q119-K123 WeakPolarHBondContact O-CB 3.28Å; Q119-K123 PolarHBondContact O-N 3.44Å
120	W	67	Low	67.9	Low	151 Å²	151	85.5 Å²	85.5	57%	0.572	43%	0.432	S	S	*	.	H	α-helix	trans	-66.8	-44.6	178	-76.1	53	0	0	0	111.2	L116 A117 N118 N122 K123 L124 W135	L116-W120 WeakPolarHBondContact O-CB 3.35Å; L116-W120 PolarHBondContact O-N 2.82Å; A117-W120 PolarHBondContact O-N 3.08Å; N118-W120 VanDerWaalsContact C-N 3.34Å; W120-N122 VanDerWaalsContact C-N 3.34Å; W120-N122 PolarHBondContact O-N 2.95Å; W120-K123 PolarHBondContact O-N 3.02Å; W120-L124 WeakPolarHBondContact O-CB 3.39Å; W120-L124 PolarHBondContact O-N 3.43Å; W120-W135 HydrophobicContact CH2-CB 4.23Å
121	A	66.2	Low	69.1	Low	39 Å²	39	83.1 Å²	83.1	32%	0.322	42%	0.416	S	S	.	.	H	α-helix	trans	-60.5	-45.1	175.6	0	0	0	0	0	110.8	A117 K123 L124 L125	A117-A121 WeakPolarHBondContact O-CB 3.35Å; A117-A121 PolarHBondContact O-N 2.93Å; A121-K123 PolarHBondContact O-N 3.23Å; A121-L124 PolarHBondContact O-N 3.13Å; A121-L125 HydrophobicContact CB-CD1 4.41Å; A121-L125 WeakPolarHBondContact O-CB 3.35Å; A121-L125 WeakPolarHBondContact O-CD1 3.45Å; A121-L125 WeakPolarHBondContact O-CG 3.43Å; A121-L125 PolarHBondContact O-N 3.06Å
122	N	66.7	Low	69.6	Low	91 Å²	91	84.1 Å²	84.1	49%	0.487	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-43.3	177.8	-76.1	-15.9	0	0	0	111.7	N118 Q119 W120 L125 Y126	N118-N122 VanDerWaalsContact O-CB 3.31Å; N118-N122 WeakPolarHBondContact O-CB 3.05Å; N118-N122 VanDerWaalsContact O-CG 3.24Å; N118-N122 PolarHBondContact O-N 2.92Å; N118-N122 PolarHBondContact O-ND2 3.46Å; Q119-N122 PolarHBondContact O-N 2.84Å; W120-N122 VanDerWaalsContact C-N 3.34Å; W120-N122 PolarHBondContact O-N 2.95Å; N122-L125 PolarHBondContact O-N 3.44Å; N122-Y126 HydrophobicContact CB-CD2 4.28Å; N122-Y126 WeakPolarHBondContact O-CB 3.18Å; N122-Y126 WeakPolarHBondContact O-CD2 3.23Å; N122-Y126 PolarHBondContact O-N 3.45Å
123	K	68.5	Low	70.1	Confident	61 Å²	61	83.7 Å²	83.7	27%	0.265	40%	0.404	S	S	.	.	H	α-helix	trans	-62.2	-46.3	176.6	-169.3	164.1	-156.7	-173.6	0	112	Q119 W120 A121 L125 E127 E133	Q119-K123 WeakPolarHBondContact O-CB 3.28Å; Q119-K123 PolarHBondContact O-N 3.44Å; W120-K123 PolarHBondContact O-N 3.02Å; A121-K123 PolarHBondContact O-N 3.23Å; K123-L125 PolarHBondContact O-N 3.46Å; K123-E127 WeakPolarHBondContact CE-OE2 3.03Å; K123-E127 HydrophobicContact CG-CB 4.31Å; K123-E127 WeakPolarHBondContact CG-OE2 3.47Å; K123-E127 WeakPolarHBondContact O-CA 3.4Å; K123-E127 WeakPolarHBondContact O-CB 3.35Å; K123-E127 PolarHBondContact O-N 3.29Å; K123-E133 WeakPolarHBondContact CE-OE1 3.31Å; K123-E133 WeakPolarHBondContact CE-OE2 3.39Å; K123-E133 IonicContact NZ-OE1 3.95Å; K123-E133 PolarHBondContact NZ-OE1 3.18Å; K123-E133 IonicContact NZ-OE2 3.68Å; K123-E133 PolarHBondContact NZ-OE2 2.83Å
124	L	69.4	Low	70.9	Confident	31 Å²	31	83 Å²	83	16%	0.162	41%	0.405	C	S	.	.	H	α-helix	trans	-71.1	-30.1	-178.3	-158	99.9	0	0	0	113	W120 A121 W135 F184 Y187 V188 R191	W120-L124 WeakPolarHBondContact O-CB 3.39Å; W120-L124 PolarHBondContact O-N 3.43Å; A121-L124 PolarHBondContact O-N 3.13Å; L124-W135 HydrophobicContact CD1-CH2 4.07Å; L124-W135 HydrophobicContact CD1-CZ3 4.43Å; L124-F184 HydrophobicContact CD1-CE1 4.15Å; L124-F184 HydrophobicContact CD1-CE2 4.48Å; L124-F184 HydrophobicContact CD1-CZ 3.58Å; L124-F184 HydrophobicContact CD2-CE2 3.55Å; L124-F184 HydrophobicContact CD2-CZ 3.48Å; L124-F184 VanDerWaalsContact CD2-CZ 3.48Å; L124-F184 HydrophobicContact CG-CZ 4.16Å; L124-Y187 HydrophobicContact CD2-CD1 4.24Å; L124-Y187 HydrophobicContact CD2-CE1 3.65Å; L124-Y187 HydrophobicContact CG-CE1 3.93Å; L124-Y187 PolarHBondContact O-OH 3.39Å; L124-V188 HydrophobicContact CD1-CG2 4.5Å; L124-R191 WeakPolarHBondContact O-CD 3.38Å; L124-R191 PolarHBondContact O-NE 2.95Å; L124-R191 PolarHBondContact O-NH1 3.29Å
125	L	68	Low	71.3	Confident	78 Å²	78	78.2 Å²	78.2	41%	0.408	38%	0.383	S	S	.	.	H	α-helix	trans	-89.8	-37.1	-177.9	-69.8	169.3	0	0	0	112.7	A121 N122 K123 R191 R204	A121-L125 HydrophobicContact CB-CD1 4.41Å; A121-L125 WeakPolarHBondContact O-CB 3.35Å; A121-L125 WeakPolarHBondContact O-CD1 3.45Å; A121-L125 WeakPolarHBondContact O-CG 3.43Å; A121-L125 PolarHBondContact O-N 3.06Å; N122-L125 PolarHBondContact O-N 3.44Å; K123-L125 PolarHBondContact O-N 3.46Å; L125-R191 VanDerWaalsContact C-NH1 3.34Å; L125-R191 VanDerWaalsContact O-CZ 3.23Å; L125-R191 PolarHBondContact O-NH1 3.07Å; L125-R191 PolarHBondContact O-NH2 2.99Å; L125-R204 PolarHBondContact O-NH1 2.82Å
126	Y	63.9	Low	71.7	Confident	165 Å²	165	72 Å²	72	65%	0.647	36%	0.356	S	S	*	.	H	α-helix	trans	-110.8	-29	-170.4	-59.8	-74.1	0	0	0	114.2	N122	N122-Y126 HydrophobicContact CB-CD2 4.28Å; N122-Y126 WeakPolarHBondContact O-CB 3.18Å; N122-Y126 WeakPolarHBondContact O-CD2 3.23Å; N122-Y126 PolarHBondContact O-N 3.45Å
127	E	74.1	Confident	71.8	Confident	109 Å²	109	70 Å²	70	51%	0.509	34%	0.343	S	S	.	.	S	Bend	trans	-97.1	157.5	-177.2	-60.5	-177.1	177	0	0	112.4	K123 R191	K123-E127 WeakPolarHBondContact CE-OE2 3.03Å; K123-E127 HydrophobicContact CG-CB 4.31Å; K123-E127 WeakPolarHBondContact CG-OE2 3.47Å; K123-E127 WeakPolarHBondContact O-CA 3.4Å; K123-E127 WeakPolarHBondContact O-CB 3.35Å; K123-E127 PolarHBondContact O-N 3.29Å; E127-R191 PolarHBondContact O-NH1 2.75Å
128	T	79	Confident	72.4	Confident	23 Å²	23	72.4 Å²	72.4	14%	0.141	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-84.7	149.8	166.8	53.8	0	0	0	0	109.9	V193 T202 R204 V207	T128-V193 VanDerWaalsContact CB-CG2 3.48Å; T128-V193 HydrophobicContact CG2-CG2 4.45Å; T128-V193 WeakPolarHBondContact OG1-CG2 3.38Å; T128-T202 WeakPolarHBondContact CG2-O 3.42Å; T128-R204 HydrophobicContact CG2-CB 4.32Å; T128-V207 HydrophobicContact CG2-CG2 4.25Å
129	I	79.1	Confident	73.1	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.005	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-102.8	122.1	-169.4	-58.1	172.3	0	0	0	109.3	W135 Y136 V188 R191 L192 V193	I129-W135 HydrophobicContact CB-CZ2 4Å; I129-W135 HydrophobicContact CD1-CH2 3.62Å; I129-W135 HydrophobicContact CD1-CZ2 3.6Å; I129-W135 HydrophobicContact CG1-CH2 4.22Å; I129-W135 HydrophobicContact CG1-CZ2 3.66Å; I129-W135 HydrophobicContact CG2-CH2 3.91Å; I129-W135 HydrophobicContact CG2-CZ2 3.24Å; I129-Y136 HydrophobicContact CG2-CD2 3.98Å; I129-Y136 HydrophobicContact CG2-CG 4.27Å; I129-V188 HydrophobicContact CD1-CB 4.45Å; I129-V188 HydrophobicContact CD1-CG1 3.97Å; I129-V188 HydrophobicContact CD1-CG2 4.46Å; I129-R191 HydrophobicContact CD1-CB 3.8Å; I129-R191 HydrophobicContact CG1-CB 4.06Å; I129-R191 PolarHBondContact N-O 3.37Å; I129-L192 HydrophobicContact CG2-CD1 4.31Å; I129-L192 CarbonylContact O-C 3.57Å; I129-L192 WeakPolarHBondContact O-CA 3.47Å; I129-V193 WeakPolarHBondContact O-CG2 3.36Å; I129-V193 PolarHBondContact O-N 2.81Å
130	D	78.1	Confident	73.5	Confident	34 Å²	34	63.8 Å²	63.8	18%	0.182	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-92.6	137.5	173.2	-167	-7.6	0	0	0	110.1	K132 E133 Y195	D130-K132 PolarHBondContact O-N 3.31Å; D130-K132 VanDerWaalsContact O-N 3.1Å; D130-K132 PolarHBondContact OD1-N 3.29Å; D130-E133 HydrophobicContact CB-CG 4.11Å; D130-E133 WeakPolarHBondContact O-CG 3.46Å; D130-E133 PolarHBondContact O-N 2.97Å; D130-E133 VanDerWaalsContact O-N 3.12Å; D130-Y195 PolarHBondContact OD1-OH 2.89Å; D130-Y195 PolarHBondContact OD2-OH 3.22Å; D130-Y195 VanDerWaalsContact OD2-OH 3.08Å
131	F	75.3	Confident	74	Confident	74 Å²	74	57.5 Å²	57.5	33%	0.325	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.6	179.3	65.7	-101.7	0	0	0	112.5	E133 Y136 L192 Y195	F131-E133 VanDerWaalsContact C-N 3.28Å; F131-E133 PolarHBondContact O-N 2.88Å; F131-Y136 HydrophobicContact CB-CD1 4.21Å; F131-Y136 HydrophobicContact CB-CE1 4.08Å; F131-L192 HydrophobicContact CB-CD1 4.28Å; F131-Y195 AromaticContact CD1-CE2 3.83Å; F131-Y195 HydrophobicContact CD1-CE2 3.83Å; F131-Y195 AromaticContact CE1-CD2 3.88Å; F131-Y195 HydrophobicContact CE1-CD2 3.88Å; F131-Y195 AromaticContact CE1-CE2 3.18Å; F131-Y195 HydrophobicContact CE1-CE2 3.18Å; F131-Y195 AromaticContact CE1-CZ 3.64Å; F131-Y195 HydrophobicContact CZ-CE2 4.08Å
132	K	69	Low	74.9	Confident	84 Å²	84	58.6 Å²	58.6	37%	0.365	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-18.1	178.7	-63.3	-175.6	175.2	-165.5	0	113.6	E78 D130 K137 Y195	E78-K132 VanDerWaalsContact OE1-CE 3.24Å; E78-K132 WeakPolarHBondContact OE1-CE 3.26Å; E78-K132 IonicContact OE1-NZ 3.07Å; E78-K132 PolarHBondContact OE1-NZ 3.01Å; D130-K132 PolarHBondContact O-N 3.31Å; D130-K132 VanDerWaalsContact O-N 3.1Å; D130-K132 PolarHBondContact OD1-N 3.29Å; K132-K137 WeakPolarHBondContact O-CE 3.37Å; K132-Y195 WeakPolarHBondContact CE-OH 3.44Å
133	E	73.8	Confident	75.5	Confident	51 Å²	51	54.3 Å²	54.3	24%	0.238	26%	0.264	C	S	.	.	S	Bend	trans	-73.6	134.8	-173.8	-59.6	-166.1	146.2	0	0	111.9	K123 D130 F131 W135 Y136 K137	K123-E133 WeakPolarHBondContact CE-OE1 3.31Å; K123-E133 WeakPolarHBondContact CE-OE2 3.39Å; K123-E133 IonicContact NZ-OE1 3.95Å; K123-E133 PolarHBondContact NZ-OE1 3.18Å; K123-E133 IonicContact NZ-OE2 3.68Å; K123-E133 PolarHBondContact NZ-OE2 2.83Å; D130-E133 HydrophobicContact CB-CG 4.11Å; D130-E133 WeakPolarHBondContact O-CG 3.46Å; D130-E133 PolarHBondContact O-N 2.97Å; D130-E133 VanDerWaalsContact O-N 3.12Å; F131-E133 VanDerWaalsContact C-N 3.28Å; F131-E133 PolarHBondContact O-N 2.88Å; E133-W135 PolarHBondContact O-N 3.43Å; E133-W135 VanDerWaalsContact O-N 3.14Å; E133-W135 PolarHBondContact OE2-NE1 3.38Å; E133-Y136 PolarHBondContact O-N 3.41Å; E133-K137 WeakPolarHBondContact O-CG 3.43Å; E133-K137 PolarHBondContact O-N 2.93Å
134	T	75.7	Confident	75.8	Confident	99 Å²	99	52.3 Å²	52.3	61%	0.607	26%	0.257	S	S	*	.	H	α-helix	trans	-54.7	-36.9	-177.8	-49.9	0	0	0	0	113.2	Y136 K137 I138	T134-Y136 PolarHBondContact O-N 2.91Å; T134-K137 WeakPolarHBondContact O-CB 3.34Å; T134-K137 PolarHBondContact O-N 3.1Å; T134-I138 HydrophobicContact CG2-CD1 4.19Å; T134-I138 WeakPolarHBondContact O-CG1 3.47Å; T134-I138 PolarHBondContact O-N 3.04Å; T134-I138 VanDerWaalsContact O-N 3.08Å
135	W	78.5	Confident	76.5	Confident	34 Å²	34	56.7 Å²	56.7	13%	0.129	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-38.3	-179.7	82.4	-93.9	0	0	0	111.9	W120 L124 I129 E133 K137 I138 W139 V188	W120-W135 HydrophobicContact CH2-CB 4.23Å; L124-W135 HydrophobicContact CD1-CH2 4.07Å; L124-W135 HydrophobicContact CD1-CZ3 4.43Å; I129-W135 HydrophobicContact CB-CZ2 4Å; I129-W135 HydrophobicContact CD1-CH2 3.62Å; I129-W135 HydrophobicContact CD1-CZ2 3.6Å; I129-W135 HydrophobicContact CG1-CH2 4.22Å; I129-W135 HydrophobicContact CG1-CZ2 3.66Å; I129-W135 HydrophobicContact CG2-CH2 3.91Å; I129-W135 HydrophobicContact CG2-CZ2 3.24Å; E133-W135 PolarHBondContact O-N 3.43Å; E133-W135 VanDerWaalsContact O-N 3.14Å; E133-W135 PolarHBondContact OE2-NE1 3.38Å; W135-K137 VanDerWaalsContact C-N 3.32Å; W135-I138 PolarHBondContact O-N 3.19Å; W135-W139 HydrophobicContact CE3-CB 4.18Å; W135-W139 HydrophobicContact CZ3-CB 4.04Å; W135-W139 HydrophobicContact CZ3-CG 4.31Å; W135-W139 WeakPolarHBondContact O-CB 3.29Å; W135-W139 PolarHBondContact O-N 3.05Å; W135-V188 HydrophobicContact CH2-CG1 4.17Å; W135-V188 HydrophobicContact CH2-CG2 4.31Å
136	Y	77.9	Confident	77.2	Confident	19 Å²	19	53.9 Å²	53.9	8%	0.075	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-38.8	178.5	177.4	-102.3	0	0	0	110.4	I129 F131 E133 T134 I138 W139 L140 V188 L192	I129-Y136 HydrophobicContact CG2-CD2 3.98Å; I129-Y136 HydrophobicContact CG2-CG 4.27Å; F131-Y136 HydrophobicContact CB-CD1 4.21Å; F131-Y136 HydrophobicContact CB-CE1 4.08Å; E133-Y136 PolarHBondContact O-N 3.41Å; T134-Y136 PolarHBondContact O-N 2.91Å; Y136-I138 VanDerWaalsContact C-N 3.32Å; Y136-I138 PolarHBondContact O-N 3.48Å; Y136-W139 WeakPolarHBondContact O-CB 3.39Å; Y136-W139 PolarHBondContact O-N 3.29Å; Y136-L140 WeakPolarHBondContact O-CB 3.45Å; Y136-L140 PolarHBondContact O-N 3.05Å; Y136-V188 HydrophobicContact CD2-CG1 3.78Å; Y136-V188 HydrophobicContact CE2-CG1 3.6Å; Y136-L192 HydrophobicContact CD2-CD1 4.4Å; Y136-L192 HydrophobicContact CE1-CD1 4.11Å; Y136-L192 HydrophobicContact CE2-CD1 3.94Å
137	K	71	Confident	77.8	Confident	40 Å²	40	48.2 Å²	48.2	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-58.5	-43.5	172.7	-54.7	175.6	-179.2	-164	0	111.6	K132 E133 T134 W135 G141 F241 E245	K132-K137 WeakPolarHBondContact O-CE 3.37Å; E133-K137 WeakPolarHBondContact O-CG 3.43Å; E133-K137 PolarHBondContact O-N 2.93Å; T134-K137 WeakPolarHBondContact O-CB 3.34Å; T134-K137 PolarHBondContact O-N 3.1Å; W135-K137 VanDerWaalsContact C-N 3.32Å; K137-G141 PolarHBondContact O-N 3.32Å; K137-F241 HydrophobicContact CB-CD1 4.33Å; K137-F241 HydrophobicContact CB-CE1 3.72Å; K137-F241 HydrophobicContact CB-CZ 4.34Å; K137-F241 HydrophobicContact CD-CE1 3.31Å; K137-F241 HydrophobicContact CD-CE2 4.29Å; K137-F241 HydrophobicContact CD-CZ 3.19Å; K137-F241 HydrophobicContact CG-CD1 4.15Å; K137-F241 HydrophobicContact CG-CE1 3.29Å; K137-F241 HydrophobicContact CG-CE2 4.25Å; K137-F241 HydrophobicContact CG-CZ 3.4Å; K137-E245 IonicContact NZ-OE1 3.39Å; K137-E245 PolarHBondContact NZ-OE1 3.15Å; K137-E245 IonicContact NZ-OE2 3.19Å; K137-E245 PolarHBondContact NZ-OE2 2.78Å
138	I	80.3	Confident	78.2	Confident	106 Å²	106	45.9 Å²	45.9	54%	0.544	24%	0.235	S	C	.	.	H	α-helix	trans	-65.7	-46.2	176.3	-66.5	165.3	0	0	0	110.6	T134 W135 Y136 L140 G141 V142	T134-I138 HydrophobicContact CG2-CD1 4.19Å; T134-I138 WeakPolarHBondContact O-CG1 3.47Å; T134-I138 PolarHBondContact O-N 3.04Å; T134-I138 VanDerWaalsContact O-N 3.08Å; W135-I138 PolarHBondContact O-N 3.19Å; Y136-I138 VanDerWaalsContact C-N 3.32Å; Y136-I138 PolarHBondContact O-N 3.48Å; I138-L140 VanDerWaalsContact C-N 3.32Å; I138-L140 PolarHBondContact O-N 3.13Å; I138-G141 WeakPolarHBondContact O-CA 3.46Å; I138-G141 PolarHBondContact O-N 3.47Å; I138-V142 PolarHBondContact O-N 3.16Å; I138-V142 VanDerWaalsContact O-N 3.11Å
139	W	83.5	Confident	78.5	Confident	44 Å²	44	47.4 Å²	47.4	17%	0.167	24%	0.238	C	C	.	.	H	α-helix	trans	-56.3	-46.2	177.4	175.2	-101.4	0	0	0	111.8	W135 Y136 G141 V142 V143 V181 F184 D185	W135-W139 HydrophobicContact CE3-CB 4.18Å; W135-W139 HydrophobicContact CZ3-CB 4.04Å; W135-W139 HydrophobicContact CZ3-CG 4.31Å; W135-W139 WeakPolarHBondContact O-CB 3.29Å; W135-W139 PolarHBondContact O-N 3.05Å; Y136-W139 WeakPolarHBondContact O-CB 3.39Å; Y136-W139 PolarHBondContact O-N 3.29Å; W139-G141 PolarHBondContact O-N 2.84Å; W139-V142 WeakPolarHBondContact O-CA 3.48Å; W139-V142 WeakPolarHBondContact O-CB 3.37Å; W139-V142 PolarHBondContact O-N 3.43Å; W139-V143 HydrophobicContact CD2-CG2 4.41Å; W139-V143 HydrophobicContact CZ2-CG2 3.82Å; W139-V143 WeakPolarHBondContact O-CG2 3.38Å; W139-V143 PolarHBondContact O-N 2.86Å; W139-V181 HydrophobicContact CH2-CG1 4.1Å; W139-V181 HydrophobicContact CZ2-CG1 4.08Å; W139-F184 HydrophobicContact CD2-CD1 4.19Å; W139-F184 HydrophobicContact CD2-CE1 4.18Å; W139-F184 AromaticContact CE2-CD1 3.68Å; W139-F184 HydrophobicContact CE3-CD1 4.2Å; W139-F184 HydrophobicContact CE3-CE1 4.07Å; W139-F184 HydrophobicContact CH2-CB 3.97Å; W139-F184 AromaticContact CH2-CD1 3.24Å; W139-F184 HydrophobicContact CH2-CD1 3.24Å; W139-F184 AromaticContact CH2-CE1 3.9Å; W139-F184 HydrophobicContact CH2-CE1 3.9Å; W139-F184 AromaticContact CH2-CG 3.88Å; W139-F184 HydrophobicContact CH2-CG 3.88Å; W139-F184 HydrophobicContact CZ2-CB 4.03Å; W139-F184 AromaticContact CZ2-CD1 3.23Å; W139-F184 HydrophobicContact CZ2-CD1 3.23Å; W139-F184 HydrophobicContact CZ2-CE1 4.04Å; W139-F184 HydrophobicContact CZ2-CG 4.05Å; W139-F184 AromaticContact CZ3-CD1 3.74Å; W139-F184 HydrophobicContact CZ3-CD1 3.74Å; W139-F184 AromaticContact CZ3-CE1 3.9Å; W139-F184 HydrophobicContact CZ3-CE1 3.9Å; W139-D185 HydrophobicContact CZ2-CB 4.24Å; W139-D185 PolarHBondContact NE1-OD1 3.47Å
140	L	78.6	Confident	78.6	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-30.5	177.4	-171.2	62.7	0	0	0	112.4	Y136 I138 T144 F238 F241	Y136-L140 WeakPolarHBondContact O-CB 3.45Å; Y136-L140 PolarHBondContact O-N 3.05Å; I138-L140 VanDerWaalsContact C-N 3.32Å; I138-L140 PolarHBondContact O-N 3.13Å; L140-T144 WeakPolarHBondContact O-CB 3.25Å; L140-T144 PolarHBondContact O-N 3.28Å; L140-T144 PolarHBondContact O-OG1 3Å; L140-F238 VanDerWaalsContact C-CD2 3.46Å; L140-F238 HydrophobicContact CB-CD2 3.99Å; L140-F238 HydrophobicContact CD1-CB 4.31Å; L140-F238 HydrophobicContact CD2-CB 4.01Å; L140-F238 HydrophobicContact CD2-CD2 4.06Å; L140-F238 HydrophobicContact CG-CB 3.71Å; L140-F238 HydrophobicContact CG-CD2 3.7Å; L140-F238 HydrophobicContact CG-CG 4.15Å; L140-F241 HydrophobicContact CD2-CB 4.44Å
141	G	77.7	Confident	78.7	Confident	19 Å²	19	48.7 Å²	48.7	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-40.5	170.6	0	0	0	0	0	113.4	K137 I138 W139 T144 L145 F238	K137-G141 PolarHBondContact O-N 3.32Å; I138-G141 WeakPolarHBondContact O-CA 3.46Å; I138-G141 PolarHBondContact O-N 3.47Å; W139-G141 PolarHBondContact O-N 2.84Å; G141-T144 PolarHBondContact O-N 3.36Å; G141-L145 PolarHBondContact O-N 3.34Å; G141-F238 VanDerWaalsContact CA-CZ 3.49Å; G141-F238 VanDerWaalsContact N-CE2 3.32Å
142	V	84.6	Confident	79.2	Confident	63 Å²	63	46.5 Å²	46.5	38%	0.382	24%	0.238	S	C	.	.	H	α-helix	trans	-61.1	-48.7	173.4	177.9	0	0	0	0	110.3	I138 W139 T144 L145 T146	I138-V142 PolarHBondContact O-N 3.16Å; I138-V142 VanDerWaalsContact O-N 3.11Å; W139-V142 WeakPolarHBondContact O-CA 3.48Å; W139-V142 WeakPolarHBondContact O-CB 3.37Å; W139-V142 PolarHBondContact O-N 3.43Å; V142-T144 VanDerWaalsContact C-N 3.27Å; V142-T144 PolarHBondContact O-N 2.87Å; V142-L145 PolarHBondContact O-N 3.41Å; V142-T146 PolarHBondContact O-N 3.14Å; V142-T146 PolarHBondContact O-OG1 3Å; V142-T146 VanDerWaalsContact O-OG1 3.08Å
143	V	78.4	Confident	79.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-40	178	174.8	0	0	0	0	111.7	W139 T146 Y147 V181 Y182 D185 L234	W139-V143 HydrophobicContact CD2-CG2 4.41Å; W139-V143 HydrophobicContact CZ2-CG2 3.82Å; W139-V143 WeakPolarHBondContact O-CG2 3.38Å; W139-V143 PolarHBondContact O-N 2.86Å; V143-T146 PolarHBondContact O-N 3.46Å; V143-Y147 PolarHBondContact O-N 3.33Å; V143-V181 HydrophobicContact CG2-CG1 3.98Å; V143-Y182 HydrophobicContact CG1-CE1 4.38Å; V143-D185 HydrophobicContact CG2-CB 4.06Å; V143-L234 HydrophobicContact CG1-CB 3.98Å; V143-L234 HydrophobicContact CG1-CD1 3.68Å; V143-L234 HydrophobicContact CG1-CG 4.29Å
144	T	76.6	Confident	80.1	Confident	19 Å²	19	45.9 Å²	45.9	12%	0.117	24%	0.24	C	C	.	.	H	α-helix	trans	-69.2	-39.2	178.6	-58.7	0	0	0	0	112.7	L140 G141 V142 T146 Y147 L148 F238	L140-T144 WeakPolarHBondContact O-CB 3.25Å; L140-T144 PolarHBondContact O-N 3.28Å; L140-T144 PolarHBondContact O-OG1 3Å; G141-T144 PolarHBondContact O-N 3.36Å; V142-T144 VanDerWaalsContact C-N 3.27Å; V142-T144 PolarHBondContact O-N 2.87Å; T144-T146 VanDerWaalsContact C-N 3.32Å; T144-Y147 PolarHBondContact O-N 3.17Å; T144-L148 PolarHBondContact O-N 3.41Å; T144-F238 HydrophobicContact CG2-CB 4.37Å; T144-F238 HydrophobicContact CG2-CD1 3.61Å; T144-F238 HydrophobicContact CG2-CE1 4.23Å; T144-F238 HydrophobicContact CG2-CG 4.25Å; T144-F238 WeakPolarHBondContact OG1-CB 3.3Å; T144-F238 WeakPolarHBondContact OG1-CD1 3.4Å; T144-F238 WeakPolarHBondContact OG1-CG 3.32Å
145	L	84.1	Confident	80.5	Confident	123 Å²	123	41.9 Å²	41.9	64%	0.644	21%	0.214	S	C	*	.	H	α-helix	trans	-62.5	-42.8	175.2	-176	63.7	0	0	0	110.9	G141 V142 Y147 L148 Y149	G141-L145 PolarHBondContact O-N 3.34Å; V142-L145 PolarHBondContact O-N 3.41Å; L145-Y147 VanDerWaalsContact C-N 3.33Å; L145-Y147 PolarHBondContact O-N 2.89Å; L145-L148 PolarHBondContact O-N 3.1Å; L145-Y149 PolarHBondContact O-N 2.9Å
146	T	81.6	Confident	80.9	Confident	20 Å²	20	40.7 Å²	40.7	12%	0.123	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-40.7	174.4	-54.3	0	0	0	0	111.8	V142 V143 T144 Y149 N150 S178 V181 Y182	V142-T146 PolarHBondContact O-N 3.14Å; V142-T146 PolarHBondContact O-OG1 3Å; V142-T146 VanDerWaalsContact O-OG1 3.08Å; V143-T146 PolarHBondContact O-N 3.46Å; T144-T146 VanDerWaalsContact C-N 3.32Å; T146-Y149 WeakPolarHBondContact O-CB 3.43Å; T146-Y149 PolarHBondContact O-N 2.93Å; T146-N150 PolarHBondContact O-N 2.61Å; T146-N150 VanDerWaalsContact O-N 3.11Å; T146-N150 PolarHBondContact O-ND2 3.45Å; T146-S178 VanDerWaalsContact CG2-OG 3.22Å; T146-S178 WeakPolarHBondContact CG2-OG 3.48Å; T146-V181 HydrophobicContact CG2-CB 4.39Å; T146-V181 HydrophobicContact CG2-CG1 4.45Å; T146-Y182 HydrophobicContact CG2-CE1 4.19Å; T146-Y182 HydrophobicContact CG2-CE2 4.42Å; T146-Y182 PolarHBondContact O-OH 2.86Å
147	Y	77.6	Confident	81.1	Confident	45 Å²	45	41.1 Å²	41.1	18%	0.176	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-45.8	173.6	-178.4	-80.9	0	0	0	112.7	V143 T144 L145 Y149 N150 L151 Y182 L231 V235	V143-Y147 PolarHBondContact O-N 3.33Å; T144-Y147 PolarHBondContact O-N 3.17Å; L145-Y147 VanDerWaalsContact C-N 3.33Å; L145-Y147 PolarHBondContact O-N 2.89Å; Y147-Y149 VanDerWaalsContact C-N 3.28Å; Y147-Y149 PolarHBondContact O-N 3.36Å; Y147-N150 PolarHBondContact O-N 3.38Å; Y147-L151 HydrophobicContact CD1-CB 4.47Å; Y147-L151 HydrophobicContact CE1-CB 4.24Å; Y147-L151 HydrophobicContact CE1-CD2 3.97Å; Y147-L151 WeakPolarHBondContact O-CB 3.42Å; Y147-L151 PolarHBondContact O-N 2.9Å; Y147-Y182 VanDerWaalsContact CA-OH 3.23Å; Y147-Y182 WeakPolarHBondContact CA-OH 3.48Å; Y147-Y182 PolarHBondContact N-OH 3.22Å; Y147-L231 HydrophobicContact CD2-CD2 3.44Å; Y147-L231 VanDerWaalsContact CD2-CD2 3.44Å; Y147-L231 HydrophobicContact CD2-CG 3.77Å; Y147-L231 HydrophobicContact CE2-CD2 3.92Å; Y147-L231 HydrophobicContact CE2-CG 3.81Å; Y147-V235 HydrophobicContact CD1-CB 4.38Å; Y147-V235 HydrophobicContact CD1-CG2 2.95Å; Y147-V235 HydrophobicContact CD2-CG2 3.73Å; Y147-V235 HydrophobicContact CE1-CB 4.38Å; Y147-V235 HydrophobicContact CE1-CG2 3.21Å; Y147-V235 HydrophobicContact CE2-CG2 3.99Å; Y147-V235 HydrophobicContact CG-CG2 3.21Å
148	L	81.7	Confident	81.6	Confident	60 Å²	60	44 Å²	44	31%	0.314	23%	0.226	S	C	.	.	H	α-helix	trans	-62	-39.8	179.7	-178.3	63.2	0	0	0	111.2	T144 L145 L151 V152 V259 L263	T144-L148 PolarHBondContact O-N 3.41Å; L145-L148 PolarHBondContact O-N 3.1Å; L148-L151 PolarHBondContact O-N 2.67Å; L148-V152 WeakPolarHBondContact O-CG2 3.4Å; L148-V152 PolarHBondContact O-N 3.11Å; L148-V259 HydrophobicContact CD1-CG1 3.92Å; L148-L263 HydrophobicContact CD1-CD1 4.03Å; L148-L263 HydrophobicContact CD1-CD2 4.11Å; L148-L263 HydrophobicContact CD1-CG 4.45Å
149	Y	84.8	Confident	81.9	Confident	56 Å²	56	39.1 Å²	39.1	22%	0.22	20%	0.201	C	C	.	.	H	α-helix	trans	-53.5	-56.6	171.3	163.5	-96.8	0	0	0	110.9	L145 T146 Y147 L151 V152 T153 W171 L174	L145-Y149 PolarHBondContact O-N 2.9Å; T146-Y149 WeakPolarHBondContact O-CB 3.43Å; T146-Y149 PolarHBondContact O-N 2.93Å; Y147-Y149 VanDerWaalsContact C-N 3.28Å; Y147-Y149 PolarHBondContact O-N 3.36Å; Y149-L151 VanDerWaalsContact C-N 3.31Å; Y149-L151 PolarHBondContact O-N 3.47Å; Y149-V152 PolarHBondContact O-N 2.94Å; Y149-T153 HydrophobicContact CD2-CG2 3.74Å; Y149-T153 HydrophobicContact CE2-CG2 3.56Å; Y149-T153 HydrophobicContact CG-CG2 4.47Å; Y149-T153 WeakPolarHBondContact O-CG2 3.26Å; Y149-T153 PolarHBondContact O-N 2.97Å; Y149-T153 PolarHBondContact O-OG1 3.49Å; Y149-W171 AromaticContact CE2-CZ3 3.97Å; Y149-W171 HydrophobicContact CE2-CZ3 3.97Å; Y149-W171 WeakPolarHBondContact OH-CZ3 3.25Å; Y149-L174 HydrophobicContact CE1-CB 4.38Å; Y149-L174 HydrophobicContact CE2-CB 4.49Å; Y149-L174 HydrophobicContact CE2-CD1 4.03Å; Y149-L174 WeakPolarHBondContact OH-CB 3.5Å
150	N	81.8	Confident	82	Confident	17 Å²	17	37.3 Å²	37.3	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-37.6	-178.5	-73.6	-31.7	0	0	0	113.1	T146 Y147 V152 I154 S178 Y182	T146-N150 PolarHBondContact O-N 2.61Å; T146-N150 VanDerWaalsContact O-N 3.11Å; T146-N150 PolarHBondContact O-ND2 3.45Å; Y147-N150 PolarHBondContact O-N 3.38Å; N150-V152 VanDerWaalsContact C-N 3.26Å; N150-V152 PolarHBondContact O-N 2.92Å; N150-I154 HydrophobicContact CB-CD1 3.85Å; N150-I154 HydrophobicContact CB-CG1 4.47Å; N150-I154 VanDerWaalsContact O-CB 3.29Å; N150-I154 WeakPolarHBondContact O-CB 3.39Å; N150-I154 WeakPolarHBondContact O-CD1 3.24Å; N150-I154 WeakPolarHBondContact O-CG1 3.33Å; N150-I154 PolarHBondContact O-N 3.2Å; N150-I154 VanDerWaalsContact O-N 3.16Å; N150-S178 PolarHBondContact ND2-OG 2.98Å; N150-Y182 WeakPolarHBondContact ND2-CE2 3.29Å; N150-Y182 PolarHBondContact ND2-OH 2.82Å
151	L	80.1	Confident	82.2	Confident	44 Å²	44	43.3 Å²	43.3	23%	0.23	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-29.5	-178.9	-171.6	66.4	0	0	0	113.1	Y147 L148 Y149 L263 W267	Y147-L151 HydrophobicContact CD1-CB 4.47Å; Y147-L151 HydrophobicContact CE1-CB 4.24Å; Y147-L151 HydrophobicContact CE1-CD2 3.97Å; Y147-L151 WeakPolarHBondContact O-CB 3.42Å; Y147-L151 PolarHBondContact O-N 2.9Å; L148-L151 PolarHBondContact O-N 2.67Å; Y149-L151 VanDerWaalsContact C-N 3.31Å; Y149-L151 PolarHBondContact O-N 3.47Å; L151-L263 HydrophobicContact CD2-CD1 3.48Å; L151-L263 VanDerWaalsContact CD2-CD1 3.48Å; L151-L263 HydrophobicContact CD2-CD2 3.73Å; L151-L263 HydrophobicContact CD2-CG 4.12Å; L151-L263 HydrophobicContact CG-CD2 3.99Å; L151-W267 HydrophobicContact CD1-CZ2 3.93Å; L151-W267 PolarHBondContact O-NE1 3.27Å; L151-W267 VanDerWaalsContact O-NE1 3.09Å
152	V	86	Confident	82.4	Confident	29 Å²	29	43.9 Å²	43.9	18%	0.176	22%	0.215	C	C	.	.	H	α-helix	trans	-87.4	-49.9	176.6	176.5	0	0	0	0	110.5	L148 Y149 N150 A156 Y262 L263 H266	L148-V152 WeakPolarHBondContact O-CG2 3.4Å; L148-V152 PolarHBondContact O-N 3.11Å; Y149-V152 PolarHBondContact O-N 2.94Å; N150-V152 VanDerWaalsContact C-N 3.26Å; N150-V152 PolarHBondContact O-N 2.92Å; V152-A156 WeakPolarHBondContact O-CB 3.35Å; V152-A156 PolarHBondContact O-N 2.8Å; V152-Y262 HydrophobicContact CG2-CE1 4.07Å; V152-L263 HydrophobicContact CG2-CD2 3.58Å; V152-H266 PolarHBondContact O-NE2 3.18Å
153	T	82.2	Confident	82.3	Confident	16 Å²	16	42.7 Å²	42.7	10%	0.098	21%	0.207	C	C	.	.	H	α-helix	trans	-76.3	-33.6	-167.4	58.3	0	0	0	0	113.7	Y149 A156 R157 W171	Y149-T153 HydrophobicContact CD2-CG2 3.74Å; Y149-T153 HydrophobicContact CE2-CG2 3.56Å; Y149-T153 HydrophobicContact CG-CG2 4.47Å; Y149-T153 WeakPolarHBondContact O-CG2 3.26Å; Y149-T153 PolarHBondContact O-N 2.97Å; Y149-T153 PolarHBondContact O-OG1 3.49Å; T153-A156 PolarHBondContact O-N 2.8Å; T153-R157 WeakPolarHBondContact O-CB 3.18Å; T153-R157 VanDerWaalsContact O-CG 3.25Å; T153-R157 WeakPolarHBondContact O-CG 3.3Å; T153-R157 PolarHBondContact O-N 3.28Å; T153-W171 HydrophobicContact CG2-CH2 4.19Å; T153-W171 HydrophobicContact CG2-CZ3 3.85Å
154	I	79.4	Confident	82.2	Confident	106 Å²	106	46 Å²	46	54%	0.544	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-49.4	-177.1	-67.6	172.1	0	0	0	110.9	N150 F158	N150-I154 HydrophobicContact CB-CD1 3.85Å; N150-I154 HydrophobicContact CB-CG1 4.47Å; N150-I154 VanDerWaalsContact O-CB 3.29Å; N150-I154 WeakPolarHBondContact O-CB 3.39Å; N150-I154 WeakPolarHBondContact O-CD1 3.24Å; N150-I154 WeakPolarHBondContact O-CG1 3.33Å; N150-I154 PolarHBondContact O-N 3.2Å; N150-I154 VanDerWaalsContact O-N 3.16Å; I154-F158 WeakPolarHBondContact O-CB 3.31Å; I154-F158 PolarHBondContact O-N 2.86Å; I154-F158 VanDerWaalsContact O-N 3.08Å
155	I	84.1	Confident	82.3	Confident	14 Å²	14	52 Å²	52	7%	0.072	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-34.1	-178.6	-168.2	60.1	0	0	0	111.9	F158 S159 H266 W267 C270	I155-F158 PolarHBondContact O-N 3.25Å; I155-S159 WeakPolarHBondContact O-CB 3.33Å; I155-S159 PolarHBondContact O-N 2.68Å; I155-S159 VanDerWaalsContact O-N 3.08Å; I155-S159 PolarHBondContact O-OG 2.61Å; I155-H266 WeakPolarHBondContact CG2-NE2 3.2Å; I155-W267 HydrophobicContact CB-CD2 4.43Å; I155-W267 HydrophobicContact CB-CZ2 4.25Å; I155-W267 HydrophobicContact CD1-CE3 4.47Å; I155-W267 HydrophobicContact CD1-CZ3 4.4Å; I155-W267 HydrophobicContact CG1-CD2 4.19Å; I155-W267 HydrophobicContact CG1-CE3 4.26Å; I155-W267 HydrophobicContact CG2-CD2 4.32Å; I155-W267 HydrophobicContact CG2-CG 4.34Å; I155-W267 HydrophobicContact CG2-CZ2 4.46Å; I155-C270 HydrophobicContact CD1-CB 4.49Å; I155-C270 HydrophobicContact CG1-CB 3.65Å
156	A	86	Confident	82	Confident	10 Å²	10	52.8 Å²	52.8	8%	0.083	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-49.1	175	0	0	0	0	0	111.5	V152 T153 F158 S159 F160 L163	V152-A156 WeakPolarHBondContact O-CB 3.35Å; V152-A156 PolarHBondContact O-N 2.8Å; T153-A156 PolarHBondContact O-N 2.8Å; A156-F158 VanDerWaalsContact C-N 3.3Å; A156-F158 PolarHBondContact O-N 3.41Å; A156-S159 PolarHBondContact O-N 3.35Å; A156-F160 WeakPolarHBondContact O-CD2 3.49Å; A156-F160 PolarHBondContact O-N 2.81Å; A156-L163 HydrophobicContact CB-CD2 4.31Å
157	R	82.6	Confident	82	Confident	27 Å²	27	56 Å²	56	10%	0.102	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-37.5	177.5	-72.9	170.9	62.1	-178.6	2.7	112.3	T153 S159 L163 E164 N175	T153-R157 WeakPolarHBondContact O-CB 3.18Å; T153-R157 VanDerWaalsContact O-CG 3.25Å; T153-R157 WeakPolarHBondContact O-CG 3.3Å; T153-R157 PolarHBondContact O-N 3.28Å; R157-S159 VanDerWaalsContact C-N 3.32Å; R157-S159 PolarHBondContact O-N 2.95Å; R157-L163 HydrophobicContact CG-CD2 3.95Å; R157-L163 HydrophobicContact CG-CG 4.48Å; R157-E164 IonicContact CZ-OE1 3.75Å; R157-E164 IonicContact NE-OE1 3.82Å; R157-E164 IonicContact NH2-OE1 2.74Å; R157-E164 PolarHBondContact NH2-OE1 3Å; R157-N175 PolarHBondContact NH1-ND2 3.29Å; R157-N175 VanDerWaalsContact NH1-ND2 3.11Å; R157-N175 PolarHBondContact NH1-OD1 2.74Å
158	F	82.7	Confident	82	Confident	101 Å²	101	60 Å²	60	44%	0.443	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-35.8	177.3	-176.4	-103.3	0	0	0	113	I154 I155 A156 L274	I154-F158 WeakPolarHBondContact O-CB 3.31Å; I154-F158 PolarHBondContact O-N 2.86Å; I154-F158 VanDerWaalsContact O-N 3.08Å; I155-F158 PolarHBondContact O-N 3.25Å; A156-F158 VanDerWaalsContact C-N 3.3Å; A156-F158 PolarHBondContact O-N 3.41Å; F158-L274 HydrophobicContact CD1-CD1 4.29Å; F158-L274 HydrophobicContact CD1-CD2 4.26Å; F158-L274 HydrophobicContact CE1-CD1 3.78Å; F158-L274 HydrophobicContact CE1-CD2 3.63Å; F158-L274 HydrophobicContact CE1-CG 4.35Å; F158-L274 HydrophobicContact CZ-CD1 4.49Å
159	S	85	Confident	82	Confident	4 Å²	4	61.6 Å²	61.6	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-87.9	-43	-175.8	-48.2	0	0	0	0	111.5	I155 A156 R157 C270 F273	I155-S159 WeakPolarHBondContact O-CB 3.33Å; I155-S159 PolarHBondContact O-N 2.68Å; I155-S159 VanDerWaalsContact O-N 3.08Å; I155-S159 PolarHBondContact O-OG 2.61Å; A156-S159 PolarHBondContact O-N 3.35Å; R157-S159 VanDerWaalsContact C-N 3.32Å; R157-S159 PolarHBondContact O-N 2.95Å; S159-C270 VanDerWaalsContact OG-CB 3.25Å; S159-C270 WeakPolarHBondContact OG-CB 3.38Å; S159-C270 PolarHBondContact OG-O 3.06Å; S159-F273 WeakPolarHBondContact O-CD1 3.25Å; S159-F273 VanDerWaalsContact O-CE1 3.24Å; S159-F273 WeakPolarHBondContact O-CE1 3.09Å
160	F	87.2	Confident	82.1	Confident	5 Å²	5	62.7 Å²	62.7	2%	0.022	31%	0.309	C	S	.	.			trans	-107.7	81.3	-179.5	-53.6	-77.5	0	0	0	109.5	A156 E162 L163 T269 F273 L325 H328 Y329	A156-F160 WeakPolarHBondContact O-CD2 3.49Å; A156-F160 PolarHBondContact O-N 2.81Å; F160-E162 PolarHBondContact O-N 3.3Å; F160-E162 VanDerWaalsContact O-N 3.15Å; F160-L163 VanDerWaalsContact O-CB 3.26Å; F160-L163 WeakPolarHBondContact O-CB 3.44Å; F160-L163 PolarHBondContact O-N 2.95Å; F160-T269 HydrophobicContact CZ-CG2 4.45Å; F160-F273 AromaticContact CD1-CD1 3.51Å; F160-F273 HydrophobicContact CD1-CD1 3.51Å; F160-F273 HydrophobicContact CD1-CD2 4.43Å; F160-F273 AromaticContact CD1-CE1 3.52Å; F160-F273 HydrophobicContact CD1-CE1 3.52Å; F160-F273 HydrophobicContact CD1-CE2 4.45Å; F160-F273 AromaticContact CD1-CG 3.98Å; F160-F273 HydrophobicContact CD1-CG 3.98Å; F160-F273 HydrophobicContact CD1-CZ 4.01Å; F160-F273 HydrophobicContact CE1-CB 3.86Å; F160-F273 AromaticContact CE1-CD1 3.42Å; F160-F273 HydrophobicContact CE1-CD1 3.42Å; F160-F273 VanDerWaalsContact CE1-CD1 3.42Å; F160-F273 AromaticContact CE1-CD2 3.77Å; F160-F273 HydrophobicContact CE1-CD2 3.77Å; F160-F273 AromaticContact CE1-CE1 3.82Å; F160-F273 HydrophobicContact CE1-CE1 3.82Å; F160-F273 HydrophobicContact CE1-CE2 4.15Å; F160-F273 AromaticContact CE1-CG 3.38Å; F160-F273 HydrophobicContact CE1-CG 3.38Å; F160-F273 HydrophobicContact CE1-CZ 4.16Å; F160-F273 HydrophobicContact CG-CD1 4.32Å; F160-F273 HydrophobicContact CG-CE1 4.42Å; F160-F273 HydrophobicContact CZ-CB 3.93Å; F160-F273 HydrophobicContact CZ-CD1 4.17Å; F160-F273 AromaticContact CZ-CG 3.98Å; F160-F273 HydrophobicContact CZ-CG 3.98Å; F160-L325 HydrophobicContact CB-CD1 3.62Å; F160-L325 HydrophobicContact CD1-CD1 4.12Å; F160-L325 HydrophobicContact CG-CD1 3.97Å; F160-H328 HydrophobicContact CD1-CB 3.98Å; F160-H328 HydrophobicContact CE1-CB 3.76Å; F160-Y329 AromaticContact CE2-CD2 3.71Å; F160-Y329 HydrophobicContact CE2-CD2 3.71Å; F160-Y329 HydrophobicContact CE2-CE2 4.43Å; F160-Y329 AromaticContact CZ-CD2 3.93Å; F160-Y329 HydrophobicContact CZ-CD2 3.93Å
161	Y	82.4	Confident	82.1	Confident	131 Å²	131	63.4 Å²	63.4	51%	0.514	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.2	-175.7	66.3	-90	0	0	0	113.3	L163 E164 E165	Y161-L163 PolarHBondContact O-N 3.43Å; Y161-L163 VanDerWaalsContact O-N 3.13Å; Y161-E164 WeakPolarHBondContact O-CB 3.44Å; Y161-E164 PolarHBondContact O-N 3.47Å; Y161-E165 PolarHBondContact O-N 2.97Å
162	E	81.9	Confident	82	Confident	31 Å²	31	64.3 Å²	64.3	15%	0.145	32%	0.315	C	S	.	.	H	α-helix	trans	-53.7	-31.5	173.6	-60.2	171.4	164.8	0	0	112.9	F160 E164 E165 Q166 H328	F160-E162 PolarHBondContact O-N 3.3Å; F160-E162 VanDerWaalsContact O-N 3.15Å; E162-E164 VanDerWaalsContact C-N 3.3Å; E162-E164 PolarHBondContact O-N 3.48Å; E162-E165 PolarHBondContact O-N 3.37Å; E162-Q166 WeakPolarHBondContact O-CG 3.35Å; E162-Q166 PolarHBondContact O-N 3.27Å; E162-H328 IonicContact OE1-CE1 2.85Å; E162-H328 PolarHBondContact OE1-CE1 3.29Å; E162-H328 IonicContact OE1-ND1 2.75Å; E162-H328 IonicContact OE2-CE1 3.26Å; E162-H328 IonicContact OE2-ND1 3.39Å; E162-H328 PolarHBondContact OE2-ND1 2.94Å
163	L	81.7	Confident	82	Confident	39 Å²	39	65.8 Å²	65.8	20%	0.204	33%	0.331	C	S	.	.	H	α-helix	trans	-67.2	-33.1	179.3	-172.3	69.2	0	0	0	111.9	A156 R157 F160 Y161 W171 L325	A156-L163 HydrophobicContact CB-CD2 4.31Å; R157-L163 HydrophobicContact CG-CD2 3.95Å; R157-L163 HydrophobicContact CG-CG 4.48Å; F160-L163 VanDerWaalsContact O-CB 3.26Å; F160-L163 WeakPolarHBondContact O-CB 3.44Å; F160-L163 PolarHBondContact O-N 2.95Å; Y161-L163 PolarHBondContact O-N 3.43Å; Y161-L163 VanDerWaalsContact O-N 3.13Å; L163-W171 HydrophobicContact CD1-CZ2 4.05Å; L163-W171 HydrophobicContact CD2-CZ2 4.04Å; L163-W171 HydrophobicContact CG-CZ2 3.89Å; L163-W171 PolarHBondContact O-NE1 3.38Å; L163-L325 HydrophobicContact CD1-CD2 3.91Å
164	E	76.3	Confident	82	Confident	70 Å²	70	67.9 Å²	67.9	33%	0.327	34%	0.341	S	S	.	.	H	α-helix	trans	-76.8	-40.1	177.9	179.6	155.4	-136.5	0	0	111.4	R157 Y161 E162 Y168	R157-E164 IonicContact CZ-OE1 3.75Å; R157-E164 IonicContact NE-OE1 3.82Å; R157-E164 IonicContact NH2-OE1 2.74Å; R157-E164 PolarHBondContact NH2-OE1 3Å; Y161-E164 WeakPolarHBondContact O-CB 3.44Å; Y161-E164 PolarHBondContact O-N 3.47Å; E162-E164 VanDerWaalsContact C-N 3.3Å; E162-E164 PolarHBondContact O-N 3.48Å; E164-Y168 HydrophobicContact CG-CD2 4Å; E164-Y168 VanDerWaalsContact O-CA 3.28Å; E164-Y168 WeakPolarHBondContact O-CA 3.31Å; E164-Y168 WeakPolarHBondContact O-CB 3.47Å; E164-Y168 PolarHBondContact O-N 3.46Å
165	E	78.6	Confident	82	Confident	144 Å²	144	65 Å²	65	67%	0.673	33%	0.327	S	S	*	.	H	α-helix	trans	-65.7	-39.9	-178.4	-69	-177	173.7	0	0	112.9	Y161 E162 L167	Y161-E165 PolarHBondContact O-N 2.97Å; E162-E165 PolarHBondContact O-N 3.37Å; E165-L167 PolarHBondContact O-N 2.82Å
166	Q	77.8	Confident	81.8	Confident	139 Å²	139	71.7 Å²	71.7	65%	0.65	35%	0.352	S	S	*	.	H	α-helix	trans	-70.5	-30.5	-176.2	-71	-177.5	0.2	0	0	114	E162	E162-Q166 WeakPolarHBondContact O-CG 3.35Å; E162-Q166 PolarHBondContact O-N 3.27Å
167	L	82	Confident	81.8	Confident	88 Å²	88	76.4 Å²	76.4	46%	0.461	38%	0.376	S	S	.	.	S	Bend	trans	-137.3	31.6	-169.3	-68	174.8	0	0	0	113.3	E165 S169 V170 W171	E165-L167 PolarHBondContact O-N 2.82Å; L167-S169 VanDerWaalsContact C-N 3.31Å; L167-S169 PolarHBondContact O-N 2.8Å; L167-S169 VanDerWaalsContact O-N 3.16Å; L167-V170 HydrophobicContact CB-CB 4.43Å; L167-V170 HydrophobicContact CD2-CG2 4.4Å; L167-V170 PolarHBondContact O-N 3.11Å; L167-W171 PolarHBondContact O-N 3Å; L167-W171 VanDerWaalsContact O-N 3.08Å
168	Y	78.3	Confident	81.6	Confident	129 Å²	129	75.3 Å²	75.3	51%	0.506	37%	0.372	S	S	.	.	H	α-helix	trans	-47.5	-48.4	-174.2	-177.3	-102	0	0	0	113.8	E164 V170 W171 L172	E164-Y168 HydrophobicContact CG-CD2 4Å; E164-Y168 VanDerWaalsContact O-CA 3.28Å; E164-Y168 WeakPolarHBondContact O-CA 3.31Å; E164-Y168 WeakPolarHBondContact O-CB 3.47Å; E164-Y168 PolarHBondContact O-N 3.46Å; Y168-V170 VanDerWaalsContact C-N 3.33Å; Y168-V170 PolarHBondContact O-N 3.01Å; Y168-W171 PolarHBondContact O-N 3.34Å; Y168-L172 HydrophobicContact CE1-CD2 4.4Å; Y168-L172 WeakPolarHBondContact O-CB 3.16Å; Y168-L172 PolarHBondContact O-N 3.03Å
169	S	81.1	Confident	81.5	Confident	94 Å²	94	72.5 Å²	72.5	66%	0.657	36%	0.361	S	S	*	.	H	α-helix	trans	-62.5	-37.2	-178.8	-51.2	0	0	0	0	113.3	L167 A173	L167-S169 VanDerWaalsContact C-N 3.31Å; L167-S169 PolarHBondContact O-N 2.8Å; L167-S169 VanDerWaalsContact O-N 3.16Å; S169-A173 PolarHBondContact O-N 3.42Å; S169-A173 VanDerWaalsContact O-N 3.17Å
170	V	87.3	Confident	81.5	Confident	78 Å²	78	74.8 Å²	74.8	47%	0.473	38%	0.38	S	S	.	.	H	α-helix	trans	-71.6	-44.1	179.5	179.9	0	0	0	0	109.9	L167 Y168 L172 A173 L174	L167-V170 HydrophobicContact CB-CB 4.43Å; L167-V170 HydrophobicContact CD2-CG2 4.4Å; L167-V170 PolarHBondContact O-N 3.11Å; Y168-V170 VanDerWaalsContact C-N 3.33Å; Y168-V170 PolarHBondContact O-N 3.01Å; V170-L172 VanDerWaalsContact C-N 3.32Å; V170-L172 PolarHBondContact O-N 3.08Å; V170-A173 PolarHBondContact O-N 3.26Å; V170-L174 HydrophobicContact CG1-CD1 4.2Å; V170-L174 WeakPolarHBondContact O-CG 3.26Å; V170-L174 PolarHBondContact O-N 3.43Å
171	W	80.8	Confident	81.3	Confident	33 Å²	33	75.3 Å²	75.3	13%	0.125	38%	0.384	C	S	.	.	H	α-helix	trans	-61.8	-40.8	176.7	-69.3	124.4	0	0	0	112.3	Y149 T153 L163 L167 Y168 L174 N175	Y149-W171 AromaticContact CE2-CZ3 3.97Å; Y149-W171 HydrophobicContact CE2-CZ3 3.97Å; Y149-W171 WeakPolarHBondContact OH-CZ3 3.25Å; T153-W171 HydrophobicContact CG2-CH2 4.19Å; T153-W171 HydrophobicContact CG2-CZ3 3.85Å; L163-W171 HydrophobicContact CD1-CZ2 4.05Å; L163-W171 HydrophobicContact CD2-CZ2 4.04Å; L163-W171 HydrophobicContact CG-CZ2 3.89Å; L163-W171 PolarHBondContact O-NE1 3.38Å; L167-W171 PolarHBondContact O-N 3Å; L167-W171 VanDerWaalsContact O-N 3.08Å; Y168-W171 PolarHBondContact O-N 3.34Å; W171-L174 HydrophobicContact CE3-CD1 4.15Å; W171-L174 HydrophobicContact CZ3-CD1 4.24Å; W171-L174 PolarHBondContact O-N 3.27Å; W171-N175 WeakPolarHBondContact O-CB 3.49Å; W171-N175 VanDerWaalsContact O-CG 3.26Å; W171-N175 PolarHBondContact O-N 2.95Å; W171-N175 PolarHBondContact O-OD1 3.03Å
172	L	78.7	Confident	81.2	Confident	62 Å²	62	69.5 Å²	69.5	33%	0.325	36%	0.362	S	S	.	.	H	α-helix	trans	-61.3	-45.4	175.9	-173.7	66.3	0	0	0	111.6	Y168 V170 L174 N175 Y176	Y168-L172 HydrophobicContact CE1-CD2 4.4Å; Y168-L172 WeakPolarHBondContact O-CB 3.16Å; Y168-L172 PolarHBondContact O-N 3.03Å; V170-L172 VanDerWaalsContact C-N 3.32Å; V170-L172 PolarHBondContact O-N 3.08Å; L172-L174 PolarHBondContact O-N 3.44Å; L172-N175 PolarHBondContact O-N 3.47Å; L172-Y176 HydrophobicContact CD1-CD2 4.15Å; L172-Y176 HydrophobicContact CD1-CE2 3.52Å; L172-Y176 HydrophobicContact CD2-CE2 4.19Å; L172-Y176 HydrophobicContact CG-CD2 3.97Å; L172-Y176 HydrophobicContact CG-CE2 3.59Å; L172-Y176 WeakPolarHBondContact O-CD2 3.39Å; L172-Y176 PolarHBondContact O-N 3.42Å; L172-Y176 VanDerWaalsContact O-N 3.08Å
173	A	85.6	Confident	81.2	Confident	60 Å²	60	72.4 Å²	72.4	50%	0.496	38%	0.378	S	S	.	.	H	α-helix	trans	-61.8	-41.9	176.1	0	0	0	0	0	112.8	S169 V170 Y176 L177	S169-A173 PolarHBondContact O-N 3.42Å; S169-A173 VanDerWaalsContact O-N 3.17Å; V170-A173 PolarHBondContact O-N 3.26Å; A173-Y176 PolarHBondContact O-N 2.7Å; A173-L177 WeakPolarHBondContact O-CB 3.12Å; A173-L177 PolarHBondContact O-N 3.19Å
174	L	83.5	Confident	81.4	Confident	61 Å²	61	74 Å²	74	32%	0.319	38%	0.383	S	S	.	.	H	α-helix	trans	-67.6	-36.8	177.6	-69.3	172.8	0	0	0	112.5	Y149 V170 W171 L172 L177 S178	Y149-L174 HydrophobicContact CE1-CB 4.38Å; Y149-L174 HydrophobicContact CE2-CB 4.49Å; Y149-L174 HydrophobicContact CE2-CD1 4.03Å; Y149-L174 WeakPolarHBondContact OH-CB 3.5Å; V170-L174 HydrophobicContact CG1-CD1 4.2Å; V170-L174 WeakPolarHBondContact O-CG 3.26Å; V170-L174 PolarHBondContact O-N 3.43Å; W171-L174 HydrophobicContact CE3-CD1 4.15Å; W171-L174 HydrophobicContact CZ3-CD1 4.24Å; W171-L174 PolarHBondContact O-N 3.27Å; L172-L174 PolarHBondContact O-N 3.44Å; L174-L177 PolarHBondContact O-N 3.46Å; L174-S178 WeakPolarHBondContact O-CB 3.39Å; L174-S178 PolarHBondContact O-N 3.02Å
175	N	77.9	Confident	81.8	Confident	45 Å²	45	71 Å²	71	24%	0.241	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-50.2	173.8	-75.3	0.6	0	0	0	110.9	R157 W171 L172 L177 S178 D179	R157-N175 PolarHBondContact NH1-ND2 3.29Å; R157-N175 VanDerWaalsContact NH1-ND2 3.11Å; R157-N175 PolarHBondContact NH1-OD1 2.74Å; W171-N175 WeakPolarHBondContact O-CB 3.49Å; W171-N175 VanDerWaalsContact O-CG 3.26Å; W171-N175 PolarHBondContact O-N 2.95Å; W171-N175 PolarHBondContact O-OD1 3.03Å; L172-N175 PolarHBondContact O-N 3.47Å; N175-L177 VanDerWaalsContact C-N 3.29Å; N175-L177 PolarHBondContact O-N 2.88Å; N175-S178 WeakPolarHBondContact O-CB 3.24Å; N175-S178 PolarHBondContact O-N 3.35Å; N175-S178 VanDerWaalsContact O-N 3.11Å; N175-D179 PolarHBondContact O-N 3.4Å
176	Y	80.6	Confident	81.8	Confident	155 Å²	155	64.7 Å²	64.7	61%	0.608	34%	0.341	S	S	*	.	H	α-helix	trans	-62.9	-35	177.1	-75.9	-59.4	0	0	0	113.2	L172 A173 D179 A180	L172-Y176 HydrophobicContact CD1-CD2 4.15Å; L172-Y176 HydrophobicContact CD1-CE2 3.52Å; L172-Y176 HydrophobicContact CD2-CE2 4.19Å; L172-Y176 HydrophobicContact CG-CD2 3.97Å; L172-Y176 HydrophobicContact CG-CE2 3.59Å; L172-Y176 WeakPolarHBondContact O-CD2 3.39Å; L172-Y176 PolarHBondContact O-N 3.42Å; L172-Y176 VanDerWaalsContact O-N 3.08Å; A173-Y176 PolarHBondContact O-N 2.7Å; Y176-D179 PolarHBondContact O-N 2.93Å; Y176-A180 WeakPolarHBondContact O-CB 3.44Å; Y176-A180 PolarHBondContact O-N 2.98Å
177	L	86.7	Confident	82.2	Confident	109 Å²	109	61.4 Å²	61.4	57%	0.571	32%	0.323	S	S	*	.	H	α-helix	trans	-64.3	-42.6	173.9	179.9	62.5	0	0	0	111.3	A173 L174 N175 A180 V181	A173-L177 WeakPolarHBondContact O-CB 3.12Å; A173-L177 PolarHBondContact O-N 3.19Å; L174-L177 PolarHBondContact O-N 3.46Å; N175-L177 VanDerWaalsContact C-N 3.29Å; N175-L177 PolarHBondContact O-N 2.88Å; L177-A180 PolarHBondContact O-N 3.43Å; L177-V181 WeakPolarHBondContact O-CG2 3.44Å; L177-V181 PolarHBondContact O-N 2.88Å; L177-V181 VanDerWaalsContact O-N 3.07Å
178	S	78.7	Confident	82.2	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-46.9	175	168.9	0	0	0	0	111.8	T146 N150 L174 N175 A180 V181 Y182	T146-S178 VanDerWaalsContact CG2-OG 3.22Å; T146-S178 WeakPolarHBondContact CG2-OG 3.48Å; N150-S178 PolarHBondContact ND2-OG 2.98Å; L174-S178 WeakPolarHBondContact O-CB 3.39Å; L174-S178 PolarHBondContact O-N 3.02Å; N175-S178 WeakPolarHBondContact O-CB 3.24Å; N175-S178 PolarHBondContact O-N 3.35Å; N175-S178 VanDerWaalsContact O-N 3.11Å; S178-A180 VanDerWaalsContact C-N 3.31Å; S178-A180 PolarHBondContact O-N 2.88Å; S178-V181 WeakPolarHBondContact O-CB 3.5Å; S178-V181 PolarHBondContact O-N 3.32Å; S178-V181 VanDerWaalsContact O-N 3.11Å; S178-Y182 WeakPolarHBondContact O-CD2 3.35Å; S178-Y182 PolarHBondContact O-N 3.43Å; S178-Y182 VanDerWaalsContact OG-CE2 3.23Å; S178-Y182 WeakPolarHBondContact OG-CE2 3.38Å
179	D	79.3	Confident	82.3	Confident	42 Å²	42	52.2 Å²	52.2	23%	0.225	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-39.5	178.8	-66.5	-15.8	0	0	0	111.5	N175 Y176 V181 Y182 L183	N175-D179 PolarHBondContact O-N 3.4Å; Y176-D179 PolarHBondContact O-N 2.93Å; D179-V181 VanDerWaalsContact C-N 3.32Å; D179-V181 PolarHBondContact O-N 3.41Å; D179-Y182 PolarHBondContact O-N 2.88Å; D179-L183 WeakPolarHBondContact O-CB 3.3Å; D179-L183 WeakPolarHBondContact O-CG 3.44Å; D179-L183 PolarHBondContact O-N 3.41Å
180	A	84.5	Confident	82.5	Confident	52 Å²	52	49.4 Å²	49.4	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-39.5	173.9	0	0	0	0	0	112.3	Y176 L177 S178 F184	Y176-A180 WeakPolarHBondContact O-CB 3.44Å; Y176-A180 PolarHBondContact O-N 2.98Å; L177-A180 PolarHBondContact O-N 3.43Å; S178-A180 VanDerWaalsContact C-N 3.31Å; S178-A180 PolarHBondContact O-N 2.88Å; A180-F184 WeakPolarHBondContact O-CB 3.4Å; A180-F184 PolarHBondContact O-N 3.48Å
181	V	84.5	Confident	82.3	Confident	17 Å²	17	46.4 Å²	46.4	10%	0.103	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-43.5	174.5	171.1	0	0	0	0	110.8	W139 V143 T146 L177 S178 D179 F184 D185	W139-V181 HydrophobicContact CH2-CG1 4.1Å; W139-V181 HydrophobicContact CZ2-CG1 4.08Å; V143-V181 HydrophobicContact CG2-CG1 3.98Å; T146-V181 HydrophobicContact CG2-CB 4.39Å; T146-V181 HydrophobicContact CG2-CG1 4.45Å; L177-V181 WeakPolarHBondContact O-CG2 3.44Å; L177-V181 PolarHBondContact O-N 2.88Å; L177-V181 VanDerWaalsContact O-N 3.07Å; S178-V181 WeakPolarHBondContact O-CB 3.5Å; S178-V181 PolarHBondContact O-N 3.32Å; S178-V181 VanDerWaalsContact O-N 3.11Å; D179-V181 VanDerWaalsContact C-N 3.32Å; D179-V181 PolarHBondContact O-N 3.41Å; V181-F184 PolarHBondContact O-N 2.89Å; V181-D185 WeakPolarHBondContact O-CB 3.49Å; V181-D185 PolarHBondContact O-N 3.28Å
182	Y	79.6	Confident	82.4	Confident	9 Å²	9	46.4 Å²	46.4	4%	0.035	24%	0.242	C	C	.	.	H	α-helix	trans	-70.3	-36.9	179	-63.5	-37.4	0	0	0	113.7	V143 T146 Y147 N150 S178 D179 F184 D185 C186 L231 L234	V143-Y182 HydrophobicContact CG1-CE1 4.38Å; T146-Y182 HydrophobicContact CG2-CE1 4.19Å; T146-Y182 HydrophobicContact CG2-CE2 4.42Å; T146-Y182 PolarHBondContact O-OH 2.86Å; Y147-Y182 VanDerWaalsContact CA-OH 3.23Å; Y147-Y182 WeakPolarHBondContact CA-OH 3.48Å; Y147-Y182 PolarHBondContact N-OH 3.22Å; N150-Y182 WeakPolarHBondContact ND2-CE2 3.29Å; N150-Y182 PolarHBondContact ND2-OH 2.82Å; S178-Y182 WeakPolarHBondContact O-CD2 3.35Å; S178-Y182 PolarHBondContact O-N 3.43Å; S178-Y182 VanDerWaalsContact OG-CE2 3.23Å; S178-Y182 WeakPolarHBondContact OG-CE2 3.38Å; D179-Y182 PolarHBondContact O-N 2.88Å; Y182-F184 VanDerWaalsContact C-N 3.35Å; Y182-D185 PolarHBondContact O-N 3.43Å; Y182-C186 PolarHBondContact O-N 3.38Å; Y182-C186 PolarHBondContact O-SG 3.21Å; Y182-L231 HydrophobicContact CD2-CD2 4.37Å; Y182-L231 HydrophobicContact CE1-CD2 3.91Å; Y182-L231 HydrophobicContact CE2-CD2 3.52Å; Y182-L231 WeakPolarHBondContact OH-CD2 3.41Å; Y182-L234 HydrophobicContact CD1-CD1 3.85Å; Y182-L234 HydrophobicContact CE1-CD1 4.06Å
183	L	81.5	Confident	82.6	Confident	92 Å²	92	43.9 Å²	43.9	48%	0.482	23%	0.229	S	C	.	.	H	α-helix	trans	-63.5	-42.8	172.8	-74.5	167.7	0	0	0	111.3	D179 D185 C186 Y187	D179-L183 WeakPolarHBondContact O-CB 3.3Å; D179-L183 WeakPolarHBondContact O-CG 3.44Å; D179-L183 PolarHBondContact O-N 3.41Å; L183-D185 VanDerWaalsContact C-N 3.34Å; L183-C186 WeakPolarHBondContact O-CB 3.33Å; L183-C186 PolarHBondContact O-N 3.38Å; L183-Y187 PolarHBondContact O-N 3.43Å; L183-Y187 VanDerWaalsContact O-N 3.17Å
184	F	86.4	Confident	82.4	Confident	71 Å²	71	43 Å²	43	31%	0.311	21%	0.214	S	C	.	.	H	α-helix	trans	-66.7	-37.9	175.6	-169.9	-89.4	0	0	0	111.8	L124 W139 A180 V181 Y182 C186 Y187 V188	L124-F184 HydrophobicContact CD1-CE1 4.15Å; L124-F184 HydrophobicContact CD1-CE2 4.48Å; L124-F184 HydrophobicContact CD1-CZ 3.58Å; L124-F184 HydrophobicContact CD2-CE2 3.55Å; L124-F184 HydrophobicContact CD2-CZ 3.48Å; L124-F184 VanDerWaalsContact CD2-CZ 3.48Å; L124-F184 HydrophobicContact CG-CZ 4.16Å; W139-F184 HydrophobicContact CD2-CD1 4.19Å; W139-F184 HydrophobicContact CD2-CE1 4.18Å; W139-F184 AromaticContact CE2-CD1 3.68Å; W139-F184 HydrophobicContact CE3-CD1 4.2Å; W139-F184 HydrophobicContact CE3-CE1 4.07Å; W139-F184 HydrophobicContact CH2-CB 3.97Å; W139-F184 AromaticContact CH2-CD1 3.24Å; W139-F184 HydrophobicContact CH2-CD1 3.24Å; W139-F184 AromaticContact CH2-CE1 3.9Å; W139-F184 HydrophobicContact CH2-CE1 3.9Å; W139-F184 AromaticContact CH2-CG 3.88Å; W139-F184 HydrophobicContact CH2-CG 3.88Å; W139-F184 HydrophobicContact CZ2-CB 4.03Å; W139-F184 AromaticContact CZ2-CD1 3.23Å; W139-F184 HydrophobicContact CZ2-CD1 3.23Å; W139-F184 HydrophobicContact CZ2-CE1 4.04Å; W139-F184 HydrophobicContact CZ2-CG 4.05Å; W139-F184 AromaticContact CZ3-CD1 3.74Å; W139-F184 HydrophobicContact CZ3-CD1 3.74Å; W139-F184 AromaticContact CZ3-CE1 3.9Å; W139-F184 HydrophobicContact CZ3-CE1 3.9Å; A180-F184 WeakPolarHBondContact O-CB 3.4Å; A180-F184 PolarHBondContact O-N 3.48Å; V181-F184 PolarHBondContact O-N 2.89Å; Y182-F184 VanDerWaalsContact C-N 3.35Å; F184-C186 VanDerWaalsContact C-N 3.33Å; F184-C186 PolarHBondContact O-N 3.04Å; F184-Y187 WeakPolarHBondContact O-CA 3.48Å; F184-Y187 WeakPolarHBondContact O-CB 3.38Å; F184-Y187 PolarHBondContact O-N 3.14Å; F184-Y187 VanDerWaalsContact O-N 3.09Å; F184-V188 HydrophobicContact CD1-CG2 3.72Å; F184-V188 HydrophobicContact CE1-CG2 3.52Å; F184-V188 HydrophobicContact CZ-CG2 4.34Å; F184-V188 WeakPolarHBondContact O-CG2 3.31Å; F184-V188 PolarHBondContact O-N 3.22Å
185	D	84.4	Confident	82.2	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-40.7	175.7	-167	56.8	0	0	0	111.9	W139 V143 V181 Y182 L183 Y187 V188 E189 L234	W139-D185 HydrophobicContact CZ2-CB 4.24Å; W139-D185 PolarHBondContact NE1-OD1 3.47Å; V143-D185 HydrophobicContact CG2-CB 4.06Å; V181-D185 WeakPolarHBondContact O-CB 3.49Å; V181-D185 PolarHBondContact O-N 3.28Å; Y182-D185 PolarHBondContact O-N 3.43Å; L183-D185 VanDerWaalsContact C-N 3.34Å; D185-Y187 VanDerWaalsContact C-N 3.28Å; D185-Y187 PolarHBondContact O-N 2.83Å; D185-V188 PolarHBondContact O-N 2.72Å; D185-V188 VanDerWaalsContact O-N 3.15Å; D185-E189 WeakPolarHBondContact O-CB 3.46Å; D185-E189 PolarHBondContact O-N 3.17Å; D185-L234 WeakPolarHBondContact OD2-CD2 3.46Å
186	C	79.7	Confident	82.2	Confident	12 Å²	12	44 Å²	44	8%	0.081	21%	0.214	C	C	.	.	H	α-helix	trans	-58.8	-39.9	171.6	-68.7	0	0	0	0	112.2	Y182 L183 F184 E189 L190 F217 S220 S224	Y182-C186 PolarHBondContact O-N 3.38Å; Y182-C186 PolarHBondContact O-SG 3.21Å; L183-C186 WeakPolarHBondContact O-CB 3.33Å; L183-C186 PolarHBondContact O-N 3.38Å; F184-C186 VanDerWaalsContact C-N 3.33Å; F184-C186 PolarHBondContact O-N 3.04Å; C186-E189 PolarHBondContact O-N 2.98Å; C186-L190 WeakPolarHBondContact O-CG 3.44Å; C186-L190 PolarHBondContact O-N 3.17Å; C186-L190 VanDerWaalsContact O-N 3.13Å; C186-F217 HydrophobicContact CB-CE2 4.44Å; C186-S220 PolarHBondContact SG-O 3.19Å; C186-S224 VanDerWaalsContact SG-CB 3.6Å
187	Y	85	Confident	82.1	Confident	71 Å²	71	45.3 Å²	45.3	28%	0.278	23%	0.225	S	C	.	.	H	α-helix	trans	-66.6	-39.4	176	175	-96.4	0	0	0	112.5	L124 L183 F184 D185 L190 R191	L124-Y187 HydrophobicContact CD2-CD1 4.24Å; L124-Y187 HydrophobicContact CD2-CE1 3.65Å; L124-Y187 HydrophobicContact CG-CE1 3.93Å; L124-Y187 PolarHBondContact O-OH 3.39Å; L183-Y187 PolarHBondContact O-N 3.43Å; L183-Y187 VanDerWaalsContact O-N 3.17Å; F184-Y187 WeakPolarHBondContact O-CA 3.48Å; F184-Y187 WeakPolarHBondContact O-CB 3.38Å; F184-Y187 PolarHBondContact O-N 3.14Å; F184-Y187 VanDerWaalsContact O-N 3.09Å; D185-Y187 VanDerWaalsContact C-N 3.28Å; D185-Y187 PolarHBondContact O-N 2.83Å; Y187-L190 PolarHBondContact O-N 2.97Å; Y187-R191 PolarHBondContact OH-NE 3.45Å; Y187-R191 PolarHBondContact OH-NH2 3.35Å
188	V	83.3	Confident	81.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.5	-43.3	174.1	170.2	0	0	0	0	110.7	L124 I129 W135 Y136 F184 D185 L190 R191 L192	L124-V188 HydrophobicContact CD1-CG2 4.5Å; I129-V188 HydrophobicContact CD1-CB 4.45Å; I129-V188 HydrophobicContact CD1-CG1 3.97Å; I129-V188 HydrophobicContact CD1-CG2 4.46Å; W135-V188 HydrophobicContact CH2-CG1 4.17Å; W135-V188 HydrophobicContact CH2-CG2 4.31Å; Y136-V188 HydrophobicContact CD2-CG1 3.78Å; Y136-V188 HydrophobicContact CE2-CG1 3.6Å; F184-V188 HydrophobicContact CD1-CG2 3.72Å; F184-V188 HydrophobicContact CE1-CG2 3.52Å; F184-V188 HydrophobicContact CZ-CG2 4.34Å; F184-V188 WeakPolarHBondContact O-CG2 3.31Å; F184-V188 PolarHBondContact O-N 3.22Å; D185-V188 PolarHBondContact O-N 2.72Å; D185-V188 VanDerWaalsContact O-N 3.15Å; V188-L190 VanDerWaalsContact C-N 3.3Å; V188-L190 PolarHBondContact O-N 3.39Å; V188-R191 CarbonylContact O-C 3.54Å; V188-R191 PolarHBondContact O-N 3.5Å; V188-L192 PolarHBondContact O-N 3.02Å; V188-L192 VanDerWaalsContact O-N 3.12Å
189	E	79.9	Confident	81.1	Confident	23 Å²	23	46 Å²	46	11%	0.107	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-35.5	179	-166.9	176.5	-178.8	0	0	112	D185 C186 R191 L192 N211 P216 F217 S220	D185-E189 WeakPolarHBondContact O-CB 3.46Å; D185-E189 PolarHBondContact O-N 3.17Å; C186-E189 PolarHBondContact O-N 2.98Å; E189-R191 PolarHBondContact O-N 2.94Å; E189-R191 VanDerWaalsContact O-N 3.16Å; E189-L192 WeakPolarHBondContact O-CB 3.47Å; E189-L192 PolarHBondContact O-N 2.87Å; E189-N211 PolarHBondContact O-ND2 3.18Å; E189-P216 VanDerWaalsContact OE1-CB 3.31Å; E189-P216 WeakPolarHBondContact OE1-CB 3.37Å; E189-F217 HydrophobicContact CG-CD2 4.48Å; E189-F217 PolarHBondContact OE1-N 3.18Å; E189-S220 WeakPolarHBondContact OE2-CB 3.38Å; E189-S220 PolarHBondContact OE2-OG 3.45Å
190	L	84.4	Confident	81.2	Confident	36 Å²	36	46.1 Å²	46.1	19%	0.188	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.2	173.3	-75.2	173.4	0	0	0	114.2	C186 Y187 V188 M208 L212 F217	C186-L190 WeakPolarHBondContact O-CG 3.44Å; C186-L190 PolarHBondContact O-N 3.17Å; C186-L190 VanDerWaalsContact O-N 3.13Å; Y187-L190 PolarHBondContact O-N 2.97Å; V188-L190 VanDerWaalsContact C-N 3.3Å; V188-L190 PolarHBondContact O-N 3.39Å; L190-M208 HydrophobicContact CD2-CG 4.39Å; L190-M208 WeakPolarHBondContact O-CA 3.44Å; L190-L212 HydrophobicContact CD2-CD2 3.6Å; L190-L212 HydrophobicContact CD2-CG 3.68Å; L190-F217 HydrophobicContact CD1-CE2 3.95Å; L190-F217 HydrophobicContact CD1-CZ 4Å; L190-F217 HydrophobicContact CD2-CD1 4.38Å; L190-F217 HydrophobicContact CD2-CD2 3.79Å; L190-F217 HydrophobicContact CD2-CE1 4.01Å; L190-F217 HydrophobicContact CD2-CE2 3.37Å; L190-F217 HydrophobicContact CD2-CG 4.29Å; L190-F217 HydrophobicContact CD2-CZ 3.48Å; L190-F217 VanDerWaalsContact CD2-CZ 3.48Å; L190-F217 HydrophobicContact CG-CD2 4.02Å; L190-F217 HydrophobicContact CG-CE2 3.36Å; L190-F217 HydrophobicContact CG-CZ 3.79Å
191	R	83.9	Confident	81.1	Confident	14 Å²	14	44.4 Å²	44.4	5%	0.053	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-1.7	-177.9	-69.5	-179.4	174.5	-105.7	8.6	113.5	L124 L125 E127 I129 Y187 V188 E189 V193 R204	L124-R191 WeakPolarHBondContact O-CD 3.38Å; L124-R191 PolarHBondContact O-NE 2.95Å; L124-R191 PolarHBondContact O-NH1 3.29Å; L125-R191 VanDerWaalsContact C-NH1 3.34Å; L125-R191 VanDerWaalsContact O-CZ 3.23Å; L125-R191 PolarHBondContact O-NH1 3.07Å; L125-R191 PolarHBondContact O-NH2 2.99Å; E127-R191 PolarHBondContact O-NH1 2.75Å; I129-R191 HydrophobicContact CD1-CB 3.8Å; I129-R191 HydrophobicContact CG1-CB 4.06Å; I129-R191 PolarHBondContact N-O 3.37Å; Y187-R191 PolarHBondContact OH-NE 3.45Å; Y187-R191 PolarHBondContact OH-NH2 3.35Å; V188-R191 CarbonylContact O-C 3.54Å; V188-R191 PolarHBondContact O-N 3.5Å; E189-R191 PolarHBondContact O-N 2.94Å; E189-R191 VanDerWaalsContact O-N 3.16Å; R191-V193 PolarHBondContact O-N 2.85Å; R191-R204 VanDerWaalsContact NH2-NH2 3.18Å
192	L	82	Confident	80.9	Confident	34 Å²	34	48.5 Å²	48.5	18%	0.178	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-68.4	123.3	-179.8	-168.8	70.6	0	0	0	110.6	I129 F131 Y136 V188 E189 V207 N211	I129-L192 HydrophobicContact CG2-CD1 4.31Å; I129-L192 CarbonylContact O-C 3.57Å; I129-L192 WeakPolarHBondContact O-CA 3.47Å; F131-L192 HydrophobicContact CB-CD1 4.28Å; Y136-L192 HydrophobicContact CD2-CD1 4.4Å; Y136-L192 HydrophobicContact CE1-CD1 4.11Å; Y136-L192 HydrophobicContact CE2-CD1 3.94Å; V188-L192 PolarHBondContact O-N 3.02Å; V188-L192 VanDerWaalsContact O-N 3.12Å; E189-L192 WeakPolarHBondContact O-CB 3.47Å; E189-L192 PolarHBondContact O-N 2.87Å; L192-V207 WeakPolarHBondContact O-CG1 3.45Å; L192-N211 PolarHBondContact O-ND2 2.81Å
193	V	83.3	Confident	81.1	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.055	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-67.9	133.9	-177.4	175.4	0	0	0	0	110.8	T128 I129 R191 Y195 P200 V201	T128-V193 VanDerWaalsContact CB-CG2 3.48Å; T128-V193 HydrophobicContact CG2-CG2 4.45Å; T128-V193 WeakPolarHBondContact OG1-CG2 3.38Å; I129-V193 WeakPolarHBondContact O-CG2 3.36Å; I129-V193 PolarHBondContact O-N 2.81Å; R191-V193 PolarHBondContact O-N 2.85Å; V193-Y195 HydrophobicContact CG1-CE2 4.41Å; V193-P200 HydrophobicContact CG1-CB 3.52Å; V193-V201 WeakPolarHBondContact CG1-O 3.34Å
194	F	81.7	Confident	81	Confident	40 Å²	40	53.7 Å²	53.7	18%	0.175	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-101.1	155.5	167.1	72.3	-79.7	0	0	0	110.1	E196 V201 R206 V207	F194-E196 HydrophobicContact CD2-CG 4.05Å; F194-E196 HydrophobicContact CE2-CG 3.57Å; F194-E196 VanDerWaalsContact CE2-OE1 3.31Å; F194-E196 WeakPolarHBondContact CE2-OE1 3.45Å; F194-V201 HydrophobicContact CD1-CB 4.45Å; F194-V201 HydrophobicContact CD2-CG2 4.47Å; F194-V201 HydrophobicContact CE1-CB 3.99Å; F194-V201 HydrophobicContact CE1-CG1 4.02Å; F194-V201 HydrophobicContact CE1-CG2 4.34Å; F194-V201 HydrophobicContact CE2-CG2 4.02Å; F194-V201 HydrophobicContact CZ-CB 4.05Å; F194-V201 HydrophobicContact CZ-CG1 4.05Å; F194-V201 HydrophobicContact CZ-CG2 3.92Å; F194-V201 PolarHBondContact O-N 3.25Å; F194-V201 VanDerWaalsContact O-N 3.12Å; F194-R206 HydrophobicContact CE1-CG 4.47Å; F194-R206 HydrophobicContact CZ-CG 4.18Å; F194-V207 HydrophobicContact CD1-CG2 4.09Å; F194-V207 HydrophobicContact CE1-CB 4.46Å; F194-V207 HydrophobicContact CE1-CG2 4Å
195	Y	79.7	Confident	81	Confident	64 Å²	64	56 Å²	56	25%	0.251	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123	-174	-76.8	-114.8	0	0	0	110	D130 F131 K132 V193 G198 M199 P200	D130-Y195 PolarHBondContact OD1-OH 2.89Å; D130-Y195 PolarHBondContact OD2-OH 3.22Å; D130-Y195 VanDerWaalsContact OD2-OH 3.08Å; F131-Y195 AromaticContact CD1-CE2 3.83Å; F131-Y195 HydrophobicContact CD1-CE2 3.83Å; F131-Y195 AromaticContact CE1-CD2 3.88Å; F131-Y195 HydrophobicContact CE1-CD2 3.88Å; F131-Y195 AromaticContact CE1-CE2 3.18Å; F131-Y195 HydrophobicContact CE1-CE2 3.18Å; F131-Y195 AromaticContact CE1-CZ 3.64Å; F131-Y195 HydrophobicContact CZ-CE2 4.08Å; K132-Y195 WeakPolarHBondContact CE-OH 3.44Å; V193-Y195 HydrophobicContact CG1-CE2 4.41Å; Y195-G198 WeakPolarHBondContact CD1-O 3.4Å; Y195-M199 WeakPolarHBondContact CA-O 3.18Å; Y195-P200 HydrophobicContact CE1-CB 4.23Å; Y195-P200 HydrophobicContact CE2-CB 4.38Å
196	E	76.9	Confident	81.1	Confident	64 Å²	64	61.1 Å²	61.1	30%	0.299	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.7	169.8	-79	-177.2	-179.7	0	0	109.1	F194 G198 M199 V201 R206	F194-E196 HydrophobicContact CD2-CG 4.05Å; F194-E196 HydrophobicContact CE2-CG 3.57Å; F194-E196 VanDerWaalsContact CE2-OE1 3.31Å; F194-E196 WeakPolarHBondContact CE2-OE1 3.45Å; E196-G198 PolarHBondContact O-N 3.46Å; E196-M199 PolarHBondContact N-O 3.48Å; E196-M199 PolarHBondContact O-N 2.95Å; E196-V201 HydrophobicContact CB-CG2 4.05Å; E196-V201 HydrophobicContact CG-CG2 4.2Å; E196-R206 IonicContact OE1-CZ 2.72Å; E196-R206 IonicContact OE1-NE 2.69Å; E196-R206 IonicContact OE1-NH2 2.59Å; E196-R206 PolarHBondContact OE1-NH2 2.93Å; E196-R206 IonicContact OE2-CZ 3.79Å; E196-R206 IonicContact OE2-NH1 2.83Å; E196-R206 PolarHBondContact OE2-NH1 2.87Å; E196-R206 IonicContact OE2-NH2 2.7Å; E196-R206 PolarHBondContact OE2-NH2 3.12Å
197	H	78.8	Confident	81.3	Confident	182 Å²	182	60.5 Å²	60.5	84%	0.843	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	39.8	-177.4	-53.7	-70.7	0	0	0	112.8	M199	H197-M199 PolarHBondContact O-N 3.42Å
198	G	69.7	Low	81.3	Confident	12 Å²	12	60.5 Å²	60.5	12%	0.124	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	-9.1	-174.9	0	0	0	0	0	114.7	K81 Y195 E196	K81-G198 WeakPolarHBondContact CD-O 3.3Å; K81-G198 VanDerWaalsContact CE-C 3.44Å; K81-G198 WeakPolarHBondContact CE-O 3.48Å; K81-G198 VanDerWaalsContact NZ-C 3.3Å; K81-G198 PolarHBondContact NZ-O 2.82Å; Y195-G198 WeakPolarHBondContact CD1-O 3.4Å; E196-G198 PolarHBondContact O-N 3.46Å
199	M	75.7	Confident	81.5	Confident	114 Å²	114	66.1 Å²	66.1	56%	0.562	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.4	-177.1	-62	-69.9	-65.1	0	0	112.7	K81 Y195 E196 H197 V201	K81-M199 WeakPolarHBondContact CE-SD 3.32Å; K81-M199 VanDerWaalsContact NZ-CA 3.29Å; K81-M199 PolarHBondContact NZ-SD 2.87Å; Y195-M199 WeakPolarHBondContact CA-O 3.18Å; E196-M199 PolarHBondContact N-O 3.48Å; E196-M199 PolarHBondContact O-N 2.95Å; H197-M199 PolarHBondContact O-N 3.42Å; M199-V201 PolarHBondContact O-N 3.42Å
200	P	81.3	Confident	81.7	Confident	45 Å²	45	66.9 Å²	66.9	29%	0.292	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	123	171.8	27.4	-31.6	0	0	0	109	V193 Y195 T202	V193-P200 HydrophobicContact CG1-CB 3.52Å; Y195-P200 HydrophobicContact CE1-CB 4.23Å; Y195-P200 HydrophobicContact CE2-CB 4.38Å; P200-T202 PolarHBondContact O-N 3.27Å
201	V	81.8	Confident	81.7	Confident	17 Å²	17	65.9 Å²	65.9	10%	0.103	32%	0.319	C	S	.	.			trans	-78.2	107.7	173.7	179.2	0	0	0	0	108.4	V193 F194 E196 M199 D203 R206 V207	V193-V201 WeakPolarHBondContact CG1-O 3.34Å; F194-V201 HydrophobicContact CD1-CB 4.45Å; F194-V201 HydrophobicContact CD2-CG2 4.47Å; F194-V201 HydrophobicContact CE1-CB 3.99Å; F194-V201 HydrophobicContact CE1-CG1 4.02Å; F194-V201 HydrophobicContact CE1-CG2 4.34Å; F194-V201 HydrophobicContact CE2-CG2 4.02Å; F194-V201 HydrophobicContact CZ-CB 4.05Å; F194-V201 HydrophobicContact CZ-CG1 4.05Å; F194-V201 HydrophobicContact CZ-CG2 3.92Å; F194-V201 PolarHBondContact O-N 3.25Å; F194-V201 VanDerWaalsContact O-N 3.12Å; E196-V201 HydrophobicContact CB-CG2 4.05Å; E196-V201 HydrophobicContact CG-CG2 4.2Å; M199-V201 PolarHBondContact O-N 3.42Å; V201-D203 HydrophobicContact CG1-CB 4.44Å; V201-R206 HydrophobicContact CG1-CB 4.3Å; V201-R206 HydrophobicContact CG1-CG 4.2Å; V201-V207 HydrophobicContact CG1-CG2 4.31Å; V201-V207 WeakPolarHBondContact O-CG2 3.31Å
202	T	80.1	Confident	81.7	Confident	103 Å²	103	69.2 Å²	69.2	63%	0.632	34%	0.337	S	S	*	.			trans	-89.3	-5.1	-177.7	53.9	0	0	0	0	113.9	T128 P200 R204	T128-T202 WeakPolarHBondContact CG2-O 3.42Å; P200-T202 PolarHBondContact O-N 3.27Å; T202-R204 PolarHBondContact O-N 3Å; T202-R204 VanDerWaalsContact O-N 3.15Å
203	D	82.9	Confident	81.7	Confident	88 Å²	88	75.5 Å²	75.5	47%	0.471	36%	0.363	S	S	.	.			trans	-72.2	108.5	177.5	177.8	6.6	0	0	0	110.7	V201 H205 R206 V207	V201-D203 HydrophobicContact CG1-CB 4.44Å; D203-H205 VanDerWaalsContact C-N 3.29Å; D203-H205 PolarHBondContact O-N 3.07Å; D203-H205 PolarHBondContact OD1-N 3.36Å; D203-H205 VanDerWaalsContact OD1-N 3.12Å; D203-R206 HydrophobicContact CB-CB 4.01Å; D203-R206 PolarHBondContact O-N 2.94Å; D203-R206 VanDerWaalsContact O-N 3.15Å; D203-V207 WeakPolarHBondContact O-CG2 3.4Å; D203-V207 PolarHBondContact O-N 3.31Å
204	R	81.1	Confident	81.4	Confident	121 Å²	121	77.2 Å²	77.2	46%	0.457	37%	0.374	S	S	.	.	H	α-helix	trans	-51.9	-44.2	-179.1	178	-179.3	170.6	-173.3	-4.2	112.9	L125 T128 R191 T202 R206 V207 M208	L125-R204 PolarHBondContact O-NH1 2.82Å; T128-R204 HydrophobicContact CG2-CB 4.32Å; R191-R204 VanDerWaalsContact NH2-NH2 3.18Å; T202-R204 PolarHBondContact O-N 3Å; T202-R204 VanDerWaalsContact O-N 3.15Å; R204-R206 VanDerWaalsContact C-N 3.31Å; R204-R206 PolarHBondContact O-N 3.05Å; R204-V207 PolarHBondContact O-N 2.93Å; R204-M208 WeakPolarHBondContact O-CB 3.43Å; R204-M208 PolarHBondContact O-N 3.12Å
205	H	84.7	Confident	80.9	Confident	120 Å²	120	82.5 Å²	82.5	56%	0.556	40%	0.396	S	S	*	.	H	α-helix	trans	-68	-39.7	-175.3	-179.4	-94.7	0	0	0	110.5	D203 K209	D203-H205 VanDerWaalsContact C-N 3.29Å; D203-H205 PolarHBondContact O-N 3.07Å; D203-H205 PolarHBondContact OD1-N 3.36Å; D203-H205 VanDerWaalsContact OD1-N 3.12Å; H205-K209 VanDerWaalsContact O-CB 3.27Å; H205-K209 WeakPolarHBondContact O-CB 3.48Å; H205-K209 PolarHBondContact O-N 3.18Å
206	R	86.6	Confident	80.3	Confident	114 Å²	114	80.7 Å²	80.7	43%	0.43	39%	0.393	S	S	.	.	H	α-helix	trans	-68.5	-43.2	177	-168.7	172.2	-178.8	-167.6	0.1	112.3	F194 E196 V201 D203 R204 S210	F194-R206 HydrophobicContact CE1-CG 4.47Å; F194-R206 HydrophobicContact CZ-CG 4.18Å; E196-R206 IonicContact OE1-CZ 2.72Å; E196-R206 IonicContact OE1-NE 2.69Å; E196-R206 IonicContact OE1-NH2 2.59Å; E196-R206 PolarHBondContact OE1-NH2 2.93Å; E196-R206 IonicContact OE2-CZ 3.79Å; E196-R206 IonicContact OE2-NH1 2.83Å; E196-R206 PolarHBondContact OE2-NH1 2.87Å; E196-R206 IonicContact OE2-NH2 2.7Å; E196-R206 PolarHBondContact OE2-NH2 3.12Å; V201-R206 HydrophobicContact CG1-CB 4.3Å; V201-R206 HydrophobicContact CG1-CG 4.2Å; D203-R206 HydrophobicContact CB-CB 4.01Å; D203-R206 PolarHBondContact O-N 2.94Å; D203-R206 VanDerWaalsContact O-N 3.15Å; R204-R206 VanDerWaalsContact C-N 3.31Å; R204-R206 PolarHBondContact O-N 3.05Å; R206-S210 VanDerWaalsContact O-CB 3.29Å; R206-S210 WeakPolarHBondContact O-CB 3.37Å; R206-S210 PolarHBondContact O-N 3.4Å
207	V	84.5	Confident	80.1	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-58.8	-52.9	174.8	173	0	0	0	0	110.9	T128 L192 F194 V201 D203 R204 K209 S210 N211	T128-V207 HydrophobicContact CG2-CG2 4.25Å; L192-V207 WeakPolarHBondContact O-CG1 3.45Å; F194-V207 HydrophobicContact CD1-CG2 4.09Å; F194-V207 HydrophobicContact CE1-CB 4.46Å; F194-V207 HydrophobicContact CE1-CG2 4Å; V201-V207 HydrophobicContact CG1-CG2 4.31Å; V201-V207 WeakPolarHBondContact O-CG2 3.31Å; D203-V207 WeakPolarHBondContact O-CG2 3.4Å; D203-V207 PolarHBondContact O-N 3.31Å; R204-V207 PolarHBondContact O-N 2.93Å; V207-K209 PolarHBondContact O-N 3.05Å; V207-S210 WeakPolarHBondContact O-CB 3.39Å; V207-S210 PolarHBondContact O-N 3.49Å; V207-S210 VanDerWaalsContact O-N 3.16Å; V207-N211 WeakPolarHBondContact CG1-ND2 3.36Å; V207-N211 WeakPolarHBondContact O-CB 3.45Å; V207-N211 PolarHBondContact O-N 3.02Å
208	M	85.1	Confident	79.8	Confident	70 Å²	70	72.6 Å²	72.6	35%	0.345	36%	0.363	S	S	.	.	H	α-helix	trans	-59.9	-47.1	-179.7	-172.7	-177.5	75.9	0	0	111.8	L190 R204 S210 N211 L212	L190-M208 HydrophobicContact CD2-CG 4.39Å; L190-M208 WeakPolarHBondContact O-CA 3.44Å; R204-M208 WeakPolarHBondContact O-CB 3.43Å; R204-M208 PolarHBondContact O-N 3.12Å; M208-S210 VanDerWaalsContact C-N 3.27Å; M208-S210 PolarHBondContact O-N 2.93Å; M208-N211 PolarHBondContact O-N 3.05Å; M208-L212 HydrophobicContact CG-CD1 3.94Å; M208-L212 HydrophobicContact CG-CG 4.4Å; M208-L212 VanDerWaalsContact O-CB 3.32Å; M208-L212 WeakPolarHBondContact O-CB 3.43Å; M208-L212 WeakPolarHBondContact O-CD1 3.32Å; M208-L212 WeakPolarHBondContact O-CG 3.24Å; M208-L212 PolarHBondContact O-N 3.47Å
209	K	87.6	Confident	79.8	Confident	118 Å²	118	74.6 Å²	74.6	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-33.5	178.7	-174.3	176.5	-178.4	177.3	0	112.6	H205 V207 K213	H205-K209 VanDerWaalsContact O-CB 3.27Å; H205-K209 WeakPolarHBondContact O-CB 3.48Å; H205-K209 PolarHBondContact O-N 3.18Å; V207-K209 PolarHBondContact O-N 3.05Å; K209-K213 WeakPolarHBondContact O-CG 3.5Å
210	S	84.8	Confident	79.4	Confident	40 Å²	40	69.4 Å²	69.4	28%	0.28	35%	0.346	S	S	.	.	H	α-helix	trans	-68.9	-56.7	174.6	-169.6	0	0	0	0	110.1	R206 V207 M208 L212 K213 T214	R206-S210 VanDerWaalsContact O-CB 3.29Å; R206-S210 WeakPolarHBondContact O-CB 3.37Å; R206-S210 PolarHBondContact O-N 3.4Å; V207-S210 WeakPolarHBondContact O-CB 3.39Å; V207-S210 PolarHBondContact O-N 3.49Å; V207-S210 VanDerWaalsContact O-N 3.16Å; M208-S210 VanDerWaalsContact C-N 3.27Å; M208-S210 PolarHBondContact O-N 2.93Å; S210-L212 VanDerWaalsContact C-N 3.34Å; S210-L212 PolarHBondContact O-N 3.3Å; S210-K213 WeakPolarHBondContact O-CB 3.36Å; S210-K213 PolarHBondContact O-N 3.04Å; S210-T214 WeakPolarHBondContact O-CG2 3.33Å; S210-T214 PolarHBondContact O-N 3.45Å
211	N	82.4	Confident	78.9	Confident	14 Å²	14	68.7 Å²	68.7	8%	0.075	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-38.7	-174.7	-67.1	-5.6	0	0	0	112.2	E189 L192 V207 M208 K213 T214 F217	E189-N211 PolarHBondContact O-ND2 3.18Å; L192-N211 PolarHBondContact O-ND2 2.81Å; V207-N211 WeakPolarHBondContact CG1-ND2 3.36Å; V207-N211 WeakPolarHBondContact O-CB 3.45Å; V207-N211 PolarHBondContact O-N 3.02Å; M208-N211 PolarHBondContact O-N 3.05Å; N211-K213 PolarHBondContact O-N 3.44Å; N211-K213 VanDerWaalsContact O-N 3.13Å; N211-T214 WeakPolarHBondContact O-CB 3.39Å; N211-T214 PolarHBondContact O-N 3.25Å; N211-T214 PolarHBondContact O-OG1 3.41Å; N211-F217 WeakPolarHBondContact O-CB 3.35Å
212	L	85.3	Confident	78.2	Confident	85 Å²	85	70.6 Å²	70.6	45%	0.445	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.5	173.8	-78.7	167.7	0	0	0	113.8	L190 M208 S210 F217	L190-L212 HydrophobicContact CD2-CD2 3.6Å; L190-L212 HydrophobicContact CD2-CG 3.68Å; M208-L212 HydrophobicContact CG-CD1 3.94Å; M208-L212 HydrophobicContact CG-CG 4.4Å; M208-L212 VanDerWaalsContact O-CB 3.32Å; M208-L212 WeakPolarHBondContact O-CB 3.43Å; M208-L212 WeakPolarHBondContact O-CD1 3.32Å; M208-L212 WeakPolarHBondContact O-CG 3.24Å; M208-L212 PolarHBondContact O-N 3.47Å; S210-L212 VanDerWaalsContact C-N 3.34Å; S210-L212 PolarHBondContact O-N 3.3Å; L212-F217 HydrophobicContact CD2-CD1 4.16Å; L212-F217 HydrophobicContact CD2-CE1 3.54Å; L212-F217 HydrophobicContact CD2-CZ 4.04Å
213	K	82.6	Confident	77.4	Confident	165 Å²	165	66.4 Å²	66.4	72%	0.717	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.2	178.9	-65.6	179.5	178.5	-169.6	0	113.1	K209 S210 N211	K209-K213 WeakPolarHBondContact O-CG 3.5Å; S210-K213 WeakPolarHBondContact O-CB 3.36Å; S210-K213 PolarHBondContact O-N 3.04Å; N211-K213 PolarHBondContact O-N 3.44Å; N211-K213 VanDerWaalsContact O-N 3.13Å
214	T	76.8	Confident	76.6	Confident	45 Å²	45	62.7 Å²	62.7	28%	0.276	31%	0.312	S	S	.	.	S	Bend	trans	-79.1	139.8	-176.3	71	0	0	0	0	110.7	S210 N211 F217 A218	S210-T214 WeakPolarHBondContact O-CG2 3.33Å; S210-T214 PolarHBondContact O-N 3.45Å; N211-T214 WeakPolarHBondContact O-CB 3.39Å; N211-T214 PolarHBondContact O-N 3.25Å; N211-T214 PolarHBondContact O-OG1 3.41Å; T214-F217 PolarHBondContact O-N 2.97Å; T214-A218 PolarHBondContact O-N 3.2Å
215	K	71.1	Confident	75.5	Confident	151 Å²	151	61.5 Å²	61.5	66%	0.657	32%	0.315	S	S	*	.	H	α-helix	trans	-58.8	-35.9	175.4	-67.4	-178.5	179.9	175	0	114.7	L219	K215-L219 WeakPolarHBondContact O-CG 3.44Å; K215-L219 PolarHBondContact O-N 3.04Å
216	P	66.1	Low	74.2	Confident	26 Å²	26	60.4 Å²	60.4	17%	0.169	32%	0.318	C	S	.	.	H	α-helix	trans	-54	-54.2	171.8	-21.7	31.5	0	0	0	112.1	E189 A218 L219 S220 L233	E189-P216 VanDerWaalsContact OE1-CB 3.31Å; E189-P216 WeakPolarHBondContact OE1-CB 3.37Å; P216-A218 VanDerWaalsContact C-N 3.31Å; P216-A218 PolarHBondContact O-N 2.89Å; P216-L219 WeakPolarHBondContact O-CA 3.46Å; P216-L219 WeakPolarHBondContact O-CB 3.3Å; P216-L219 PolarHBondContact O-N 3.38Å; P216-S220 PolarHBondContact O-N 2.94Å; P216-S220 PolarHBondContact O-OG 3.09Å; P216-L233 HydrophobicContact CB-CD2 4.35Å
217	F	73.1	Confident	72.3	Confident	25 Å²	25	59 Å²	59	11%	0.11	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-42.6	-179.4	178.8	-99.6	0	0	0	112.6	C186 E189 L190 N211 L212 T214 L219 S220 A221	C186-F217 HydrophobicContact CB-CE2 4.44Å; E189-F217 HydrophobicContact CG-CD2 4.48Å; E189-F217 PolarHBondContact OE1-N 3.18Å; L190-F217 HydrophobicContact CD1-CE2 3.95Å; L190-F217 HydrophobicContact CD1-CZ 4Å; L190-F217 HydrophobicContact CD2-CD1 4.38Å; L190-F217 HydrophobicContact CD2-CD2 3.79Å; L190-F217 HydrophobicContact CD2-CE1 4.01Å; L190-F217 HydrophobicContact CD2-CE2 3.37Å; L190-F217 HydrophobicContact CD2-CG 4.29Å; L190-F217 HydrophobicContact CD2-CZ 3.48Å; L190-F217 VanDerWaalsContact CD2-CZ 3.48Å; L190-F217 HydrophobicContact CG-CD2 4.02Å; L190-F217 HydrophobicContact CG-CE2 3.36Å; L190-F217 HydrophobicContact CG-CZ 3.79Å; N211-F217 WeakPolarHBondContact O-CB 3.35Å; L212-F217 HydrophobicContact CD2-CD1 4.16Å; L212-F217 HydrophobicContact CD2-CE1 3.54Å; L212-F217 HydrophobicContact CD2-CZ 4.04Å; T214-F217 PolarHBondContact O-N 2.97Å; F217-L219 VanDerWaalsContact C-N 3.25Å; F217-L219 PolarHBondContact O-N 3.11Å; F217-S220 PolarHBondContact O-N 2.94Å; F217-A221 HydrophobicContact CE1-CB 4.26Å; F217-A221 HydrophobicContact CZ-CB 4.26Å; F217-A221 VanDerWaalsContact O-CB 3.29Å; F217-A221 WeakPolarHBondContact O-CB 3.49Å; F217-A221 PolarHBondContact O-N 2.86Å
218	A	73	Confident	70.4	Confident	51 Å²	51	65.8 Å²	65.8	42%	0.421	36%	0.359	S	S	.	.	H	α-helix	trans	-60.1	-35.3	176.1	0	0	0	0	0	112.7	T214 P216 V222	T214-A218 PolarHBondContact O-N 3.2Å; P216-A218 VanDerWaalsContact C-N 3.31Å; P216-A218 PolarHBondContact O-N 2.89Å; A218-V222 WeakPolarHBondContact O-CB 3.45Å; A218-V222 WeakPolarHBondContact O-CG2 3.34Å; A218-V222 PolarHBondContact O-N 3.31Å; A218-V222 VanDerWaalsContact O-N 3.15Å
219	L	68.2	Low	68.5	Low	55 Å²	55	67 Å²	67	29%	0.288	36%	0.363	S	S	.	.	H	α-helix	trans	-75.3	-39.5	177.3	-69.6	164.3	0	0	0	111.7	K215 P216 F217 A223 L233	K215-L219 WeakPolarHBondContact O-CG 3.44Å; K215-L219 PolarHBondContact O-N 3.04Å; P216-L219 WeakPolarHBondContact O-CA 3.46Å; P216-L219 WeakPolarHBondContact O-CB 3.3Å; P216-L219 PolarHBondContact O-N 3.38Å; F217-L219 VanDerWaalsContact C-N 3.25Å; F217-L219 PolarHBondContact O-N 3.11Å; L219-A223 VanDerWaalsContact O-CB 3.31Å; L219-A223 WeakPolarHBondContact O-CB 3.47Å; L219-A223 PolarHBondContact O-N 3.47Å; L219-L233 HydrophobicContact CB-CD1 4.46Å; L219-L233 HydrophobicContact CB-CD2 4.32Å; L219-L233 HydrophobicContact CD1-CD1 3.61Å; L219-L233 HydrophobicContact CD1-CD2 3.86Å; L219-L233 HydrophobicContact CD1-CG 4.37Å
220	S	67.4	Low	66.5	Low	5 Å²	5	66 Å²	66	4%	0.035	36%	0.363	C	S	.	.	H	α-helix	trans	-63.3	-45.5	174.2	-52.2	0	0	0	0	111.2	C186 E189 P216 F217 V222 A223 S224	C186-S220 PolarHBondContact SG-O 3.19Å; E189-S220 WeakPolarHBondContact OE2-CB 3.38Å; E189-S220 PolarHBondContact OE2-OG 3.45Å; P216-S220 PolarHBondContact O-N 2.94Å; P216-S220 PolarHBondContact O-OG 3.09Å; F217-S220 PolarHBondContact O-N 2.94Å; S220-V222 PolarHBondContact O-N 2.69Å; S220-A223 CarbonylContact O-C 3.57Å; S220-A223 WeakPolarHBondContact O-CA 3.36Å; S220-A223 WeakPolarHBondContact O-CB 3.5Å; S220-A223 PolarHBondContact O-N 3.48Å; S220-A223 VanDerWaalsContact O-N 3.07Å; S220-S224 PolarHBondContact O-N 2.97Å
221	A	70.8	Confident	64.8	Low	30 Å²	30	66.8 Å²	66.8	25%	0.248	36%	0.363	C	S	.	.	H	α-helix	trans	-60.9	-44.7	177.9	0	0	0	0	0	111.9	F217 A223 S224 L225	F217-A221 HydrophobicContact CE1-CB 4.26Å; F217-A221 HydrophobicContact CZ-CB 4.26Å; F217-A221 VanDerWaalsContact O-CB 3.29Å; F217-A221 WeakPolarHBondContact O-CB 3.49Å; F217-A221 PolarHBondContact O-N 2.86Å; A221-A223 VanDerWaalsContact C-N 3.27Å; A221-A223 PolarHBondContact O-N 3.43Å; A221-S224 PolarHBondContact O-N 2.96Å; A221-S224 PolarHBondContact O-OG 3.25Å; A221-L225 PolarHBondContact O-N 2.87Å
222	V	67.8	Low	63	Low	57 Å²	57	67.4 Å²	67.4	35%	0.345	37%	0.372	S	S	.	.	H	α-helix	trans	-63.4	-36.1	174.9	171.9	0	0	0	0	111.4	A218 S220 S224 L225 I230	A218-V222 WeakPolarHBondContact O-CB 3.45Å; A218-V222 WeakPolarHBondContact O-CG2 3.34Å; A218-V222 PolarHBondContact O-N 3.31Å; A218-V222 VanDerWaalsContact O-N 3.15Å; S220-V222 PolarHBondContact O-N 2.69Å; V222-S224 VanDerWaalsContact C-N 3.32Å; V222-L225 PolarHBondContact O-N 2.88Å; V222-I230 HydrophobicContact CG1-CB 4.04Å; V222-I230 HydrophobicContact CG1-CD1 3.35Å; V222-I230 HydrophobicContact CG1-CG1 4.23Å; V222-I230 HydrophobicContact CG1-CG2 3.77Å
223	A	64	Low	61.1	Low	14 Å²	14	65.6 Å²	65.6	12%	0.116	36%	0.363	C	S	.	.	H	α-helix	trans	-74	-21.7	177.8	0	0	0	0	0	114.7	L219 S220 A221 L225 I230 L231	L219-A223 VanDerWaalsContact O-CB 3.31Å; L219-A223 WeakPolarHBondContact O-CB 3.47Å; L219-A223 PolarHBondContact O-N 3.47Å; S220-A223 CarbonylContact O-C 3.57Å; S220-A223 WeakPolarHBondContact O-CA 3.36Å; S220-A223 WeakPolarHBondContact O-CB 3.5Å; S220-A223 PolarHBondContact O-N 3.48Å; S220-A223 VanDerWaalsContact O-N 3.07Å; A221-A223 VanDerWaalsContact C-N 3.27Å; A221-A223 PolarHBondContact O-N 3.43Å; A223-L225 VanDerWaalsContact C-N 3.34Å; A223-I230 WeakPolarHBondContact CA-O 3.34Å; A223-I230 WeakPolarHBondContact CB-O 3.35Å; A223-L231 HydrophobicContact CB-CB 4.36Å; A223-L231 HydrophobicContact CB-CD1 3.49Å; A223-L231 VanDerWaalsContact CB-CD1 3.49Å
224	S	64.8	Low	59.4	Low	11 Å²	11	58.1 Å²	58.1	8%	0.077	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-10.5	175.7	72.5	0	0	0	0	113.8	C186 S220 A221 V222	C186-S224 VanDerWaalsContact SG-CB 3.6Å; S220-S224 PolarHBondContact O-N 2.97Å; A221-S224 PolarHBondContact O-N 2.96Å; A221-S224 PolarHBondContact O-OG 3.25Å; V222-S224 VanDerWaalsContact C-N 3.32Å
225	L	59.7	Low	58	Low	96 Å²	96	57.8 Å²	57.8	50%	0.503	33%	0.329	S	S	.	.	S	Bend	trans	-69.1	133.7	174.2	-71.4	170.1	0	0	0	108.5	A221 V222 A223 T227	A221-L225 PolarHBondContact O-N 2.87Å; V222-L225 PolarHBondContact O-N 2.88Å; A223-L225 VanDerWaalsContact C-N 3.34Å; L225-T227 PolarHBondContact O-N 3.49Å; L225-T227 PolarHBondContact O-OG1 2.87Å
226	P	55.8	Low	56.7	Low	97 Å²	97	53.4 Å²	53.4	63%	0.63	31%	0.314	S	S	*	.	S	Bend	trans	-62.7	18.9	175.8	-20.7	31.6	0	0	0	115
227	T	48.4	Very low	55.8	Low	84 Å²	84	56.6 Å²	56.6	52%	0.515	33%	0.327	S	S	.	.	S	Bend	trans	-78.7	122.3	168.4	46.7	0	0	0	0	108.1	L225 H229	L225-T227 PolarHBondContact O-N 3.49Å; L225-T227 PolarHBondContact O-OG1 2.87Å; T227-H229 PolarHBondContact O-N 3.41Å
228	D	44.1	Very low	54.6	Low	143 Å²	143	57.6 Å²	57.6	77%	0.765	33%	0.332	S	S	*	.	S	Bend	trans	-56.9	15.7	-177.3	-53.4	-36.1	0	0	0	116.3
229	H	44.4	Very low	53.6	Low	95 Å²	95	56.2 Å²	56.2	44%	0.44	32%	0.318	S	S	.	.			trans	-144.9	112.2	-176.6	-59.1	-45.5	0	0	0	108.8	R48 T227	R48-H229 WeakPolarHBondContact CD-NE2 3.31Å; T227-H229 PolarHBondContact O-N 3.41Å
230	I	46.6	Very low	52.6	Low	98 Å²	98	57.6 Å²	57.6	50%	0.503	33%	0.325	S	S	.	.			trans	142.8	101.1	147	-70.4	150.9	0	0	0	109.3	V222 A223	V222-I230 HydrophobicContact CG1-CB 4.04Å; V222-I230 HydrophobicContact CG1-CD1 3.35Å; V222-I230 HydrophobicContact CG1-CG1 4.23Å; V222-I230 HydrophobicContact CG1-CG2 3.77Å; A223-I230 WeakPolarHBondContact CA-O 3.34Å; A223-I230 WeakPolarHBondContact CB-O 3.35Å
231	L	47.6	Very low	51.8	Low	56 Å²	56	59.4 Å²	59.4	29%	0.293	33%	0.333	S	S	.	.			trans	-155.1	127.5	163.1	-172.5	66.9	0	0	0	111.3	Y147 Y182 A223 L234	Y147-L231 HydrophobicContact CD2-CD2 3.44Å; Y147-L231 VanDerWaalsContact CD2-CD2 3.44Å; Y147-L231 HydrophobicContact CD2-CG 3.77Å; Y147-L231 HydrophobicContact CE2-CD2 3.92Å; Y147-L231 HydrophobicContact CE2-CG 3.81Å; Y182-L231 HydrophobicContact CD2-CD2 4.37Å; Y182-L231 HydrophobicContact CE1-CD2 3.91Å; Y182-L231 HydrophobicContact CE2-CD2 3.52Å; Y182-L231 WeakPolarHBondContact OH-CD2 3.41Å; A223-L231 HydrophobicContact CB-CB 4.36Å; A223-L231 HydrophobicContact CB-CD1 3.49Å; A223-L231 VanDerWaalsContact CB-CD1 3.49Å; L231-L234 HydrophobicContact CD1-CD1 3.97Å; L231-L234 HydrophobicContact CD1-CG 4.44Å
232	G	46.1	Very low	50.9	Low	26 Å²	26	58.6 Å²	58.6	27%	0.268	33%	0.326	S	S	.	.			trans	-172.4	16.3	178.6	0	0	0	0	0	117	W59	W59-G232 PolarHBondContact NE1-O 3.07Å
233	L	44.4	Very low	50.2	Low	47 Å²	47	58.1 Å²	58.1	25%	0.246	32%	0.32	C	S	.	.	S	Bend	trans	-106.9	-26.1	179.2	-117.8	83.9	0	0	0	115.4	P216 L219	P216-L233 HydrophobicContact CB-CD2 4.35Å; L219-L233 HydrophobicContact CB-CD1 4.46Å; L219-L233 HydrophobicContact CB-CD2 4.32Å; L219-L233 HydrophobicContact CD1-CD1 3.61Å; L219-L233 HydrophobicContact CD1-CD2 3.86Å; L219-L233 HydrophobicContact CD1-CG 4.37Å
234	L	46.4	Very low	49.7	Very low	9 Å²	9	62.7 Å²	62.7	5%	0.047	35%	0.347	C	S	.	.	H	α-helix	trans	-76.7	-29.8	-164.9	-63.7	173	0	0	0	114.5	V143 Y182 D185 L231 V236	V143-L234 HydrophobicContact CG1-CB 3.98Å; V143-L234 HydrophobicContact CG1-CD1 3.68Å; V143-L234 HydrophobicContact CG1-CG 4.29Å; Y182-L234 HydrophobicContact CD1-CD1 3.85Å; Y182-L234 HydrophobicContact CE1-CD1 4.06Å; D185-L234 WeakPolarHBondContact OD2-CD2 3.46Å; L231-L234 HydrophobicContact CD1-CD1 3.97Å; L231-L234 HydrophobicContact CD1-CG 4.44Å; L234-V236 PolarHBondContact O-N 2.95Å
235	V	48.7	Very low	49.3	Very low	38 Å²	38	67.7 Å²	67.7	23%	0.23	37%	0.369	C	S	.	.	H	α-helix	trans	-66.9	-34.9	-175.2	178.7	0	0	0	0	113.9	Y147 Q237 F238 V239	Y147-V235 HydrophobicContact CD1-CB 4.38Å; Y147-V235 HydrophobicContact CD1-CG2 2.95Å; Y147-V235 HydrophobicContact CD2-CG2 3.73Å; Y147-V235 HydrophobicContact CE1-CB 4.38Å; Y147-V235 HydrophobicContact CE1-CG2 3.21Å; Y147-V235 HydrophobicContact CE2-CG2 3.99Å; Y147-V235 HydrophobicContact CG-CG2 3.21Å; V235-Q237 VanDerWaalsContact C-N 3.3Å; V235-Q237 PolarHBondContact O-N 3.2Å; V235-F238 PolarHBondContact O-N 3.34Å; V235-V239 HydrophobicContact CG1-CG2 3.82Å; V235-V239 WeakPolarHBondContact O-CB 3.34Å; V235-V239 VanDerWaalsContact O-CG2 3.26Å; V235-V239 WeakPolarHBondContact O-CG2 3.5Å; V235-V239 PolarHBondContact O-N 2.85Å; V235-V239 VanDerWaalsContact O-N 3.14Å
236	V	44.3	Very low	49.3	Very low	58 Å²	58	65.4 Å²	65.4	35%	0.352	36%	0.359	S	S	.	.	H	α-helix	trans	-68.2	-33.9	-171.4	179.3	0	0	0	0	111.3	W59 L234 N240	W59-V236 HydrophobicContact CZ2-CG2 4.41Å; L234-V236 PolarHBondContact O-N 2.95Å; V236-N240 VanDerWaalsContact O-CG 3.29Å; V236-N240 PolarHBondContact O-N 3.23Å; V236-N240 PolarHBondContact O-ND2 2.92Å; V236-N240 VanDerWaalsContact O-ND2 3.16Å
237	Q	45.4	Very low	49.4	Very low	93 Å²	93	66.3 Å²	66.3	44%	0.435	37%	0.368	S	S	.	.	H	α-helix	trans	-69.9	-44.6	179.9	-76.7	-179	-22.2	0	0	111.9	V235 F241	V235-Q237 VanDerWaalsContact C-N 3.3Å; V235-Q237 PolarHBondContact O-N 3.2Å; Q237-F241 VanDerWaalsContact O-CB 3.26Å; Q237-F241 WeakPolarHBondContact O-CB 3.09Å; Q237-F241 PolarHBondContact O-N 3.49Å
238	F	49.5	Very low	50	Low	47 Å²	47	68 Å²	68	21%	0.206	37%	0.371	C	S	.	.	H	α-helix	trans	-63.3	-44.8	176.9	-176.1	-109.6	0	0	0	112.6	L140 G141 T144 V235 N240 F241 A242	L140-F238 VanDerWaalsContact C-CD2 3.46Å; L140-F238 HydrophobicContact CB-CD2 3.99Å; L140-F238 HydrophobicContact CD1-CB 4.31Å; L140-F238 HydrophobicContact CD2-CB 4.01Å; L140-F238 HydrophobicContact CD2-CD2 4.06Å; L140-F238 HydrophobicContact CG-CB 3.71Å; L140-F238 HydrophobicContact CG-CD2 3.7Å; L140-F238 HydrophobicContact CG-CG 4.15Å; G141-F238 VanDerWaalsContact CA-CZ 3.49Å; G141-F238 VanDerWaalsContact N-CE2 3.32Å; T144-F238 HydrophobicContact CG2-CB 4.37Å; T144-F238 HydrophobicContact CG2-CD1 3.61Å; T144-F238 HydrophobicContact CG2-CE1 4.23Å; T144-F238 HydrophobicContact CG2-CG 4.25Å; T144-F238 WeakPolarHBondContact OG1-CB 3.3Å; T144-F238 WeakPolarHBondContact OG1-CD1 3.4Å; T144-F238 WeakPolarHBondContact OG1-CG 3.32Å; V235-F238 PolarHBondContact O-N 3.34Å; F238-N240 VanDerWaalsContact C-N 3.34Å; F238-N240 PolarHBondContact O-N 3.16Å; F238-F241 PolarHBondContact O-N 3.13Å; F238-A242 HydrophobicContact CE1-CB 4.33Å; F238-A242 HydrophobicContact CZ-CB 4.36Å; F238-A242 VanDerWaalsContact O-CB 3.27Å; F238-A242 WeakPolarHBondContact O-CB 3.29Å; F238-A242 PolarHBondContact O-N 3.48Å
239	V	51.4	Low	50.9	Low	21 Å²	21	63.2 Å²	63.2	13%	0.127	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-44.7	-176.9	167.7	0	0	0	0	110.9	V235 E243 F252 Q256	V235-V239 HydrophobicContact CG1-CG2 3.82Å; V235-V239 WeakPolarHBondContact O-CB 3.34Å; V235-V239 VanDerWaalsContact O-CG2 3.26Å; V235-V239 WeakPolarHBondContact O-CG2 3.5Å; V235-V239 PolarHBondContact O-N 2.85Å; V235-V239 VanDerWaalsContact O-N 3.14Å; V239-E243 WeakPolarHBondContact O-CB 3.41Å; V239-E243 PolarHBondContact O-N 3.43Å; V239-F252 HydrophobicContact CG1-CE1 4.43Å; V239-Q256 VanDerWaalsContact CG1-CD 3.48Å; V239-Q256 HydrophobicContact CG1-CG 4.45Å; V239-Q256 VanDerWaalsContact CG1-NE2 3.26Å
240	N	46.1	Very low	51.7	Low	84 Å²	84	59.7 Å²	59.7	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-41.1	177.4	-69.3	-26.1	0	0	0	111.5	V236 F238 E243 T244	V236-N240 VanDerWaalsContact O-CG 3.29Å; V236-N240 PolarHBondContact O-N 3.23Å; V236-N240 PolarHBondContact O-ND2 2.92Å; V236-N240 VanDerWaalsContact O-ND2 3.16Å; F238-N240 VanDerWaalsContact C-N 3.34Å; F238-N240 PolarHBondContact O-N 3.16Å; N240-E243 PolarHBondContact O-N 3.5Å; N240-T244 PolarHBondContact O-N 3.36Å; N240-T244 PolarHBondContact O-OG1 2.93Å
241	F	51.8	Low	52.7	Low	44 Å²	44	59.9 Å²	59.9	19%	0.193	33%	0.334	C	S	.	.	H	α-helix	trans	-66.1	-44.7	-179.5	-174.9	-86.9	0	0	0	112.1	K137 L140 Q237 F238 E243 T244 E245	K137-F241 HydrophobicContact CB-CD1 4.33Å; K137-F241 HydrophobicContact CB-CE1 3.72Å; K137-F241 HydrophobicContact CB-CZ 4.34Å; K137-F241 HydrophobicContact CD-CE1 3.31Å; K137-F241 HydrophobicContact CD-CE2 4.29Å; K137-F241 HydrophobicContact CD-CZ 3.19Å; K137-F241 HydrophobicContact CG-CD1 4.15Å; K137-F241 HydrophobicContact CG-CE1 3.29Å; K137-F241 HydrophobicContact CG-CE2 4.25Å; K137-F241 HydrophobicContact CG-CZ 3.4Å; L140-F241 HydrophobicContact CD2-CB 4.44Å; Q237-F241 VanDerWaalsContact O-CB 3.26Å; Q237-F241 WeakPolarHBondContact O-CB 3.09Å; Q237-F241 PolarHBondContact O-N 3.49Å; F238-F241 PolarHBondContact O-N 3.13Å; F241-E243 VanDerWaalsContact C-N 3.31Å; F241-E243 PolarHBondContact O-N 3.36Å; F241-T244 PolarHBondContact O-N 3Å; F241-T244 PolarHBondContact O-OG1 3.16Å; F241-E245 HydrophobicContact CE1-CB 4.33Å; F241-E245 HydrophobicContact CE1-CG 3.72Å; F241-E245 HydrophobicContact CE2-CG 4.16Å; F241-E245 HydrophobicContact CZ-CB 4.48Å; F241-E245 HydrophobicContact CZ-CG 3.42Å; F241-E245 VanDerWaalsContact CZ-CG 3.42Å; F241-E245 PolarHBondContact O-N 2.95Å
242	A	52.5	Low	53.6	Low	13 Å²	13	59.6 Å²	59.6	11%	0.107	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-35.4	174.6	0	0	0	0	0	111.6	F238 T244 T246 F252	F238-A242 HydrophobicContact CE1-CB 4.33Å; F238-A242 HydrophobicContact CZ-CB 4.36Å; F238-A242 VanDerWaalsContact O-CB 3.27Å; F238-A242 WeakPolarHBondContact O-CB 3.29Å; F238-A242 PolarHBondContact O-N 3.48Å; A242-T244 VanDerWaalsContact C-N 3.34Å; A242-T244 PolarHBondContact O-N 2.73Å; A242-T246 WeakPolarHBondContact O-CB 3.49Å; A242-T246 WeakPolarHBondContact O-CG2 3.36Å; A242-T246 PolarHBondContact O-N 3.29Å; A242-T246 VanDerWaalsContact O-N 3.11Å; A242-T246 PolarHBondContact O-OG1 3.22Å; A242-T246 VanDerWaalsContact O-OG1 3.04Å; A242-F252 HydrophobicContact CB-CE1 3.86Å; A242-F252 HydrophobicContact CB-CE2 3.8Å; A242-F252 HydrophobicContact CB-CZ 3.36Å
243	E	52.4	Low	54.5	Low	46 Å²	46	62.1 Å²	62.1	22%	0.215	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-38.3	175.5	-169.3	-179	164.5	0	0	112.3	V239 N240 F241 T246 F252 R253	V239-E243 WeakPolarHBondContact O-CB 3.41Å; V239-E243 PolarHBondContact O-N 3.43Å; N240-E243 PolarHBondContact O-N 3.5Å; F241-E243 VanDerWaalsContact C-N 3.31Å; F241-E243 PolarHBondContact O-N 3.36Å; E243-T246 PolarHBondContact O-OG1 2.98Å; E243-F252 HydrophobicContact CB-CD1 4.17Å; E243-F252 HydrophobicContact CB-CE1 4.38Å; E243-R253 IonicContact OE1-CZ 3.38Å; E243-R253 IonicContact OE1-NE 2.72Å; E243-R253 PolarHBondContact OE1-NE 3.34Å; E243-R253 IonicContact OE1-NH2 3.28Å; E243-R253 PolarHBondContact OE1-NH2 2.76Å
244	T	53.1	Low	55.6	Low	111 Å²	111	62.1 Å²	62.1	68%	0.681	33%	0.334	S	S	*	.	H	α-helix	trans	-76.8	-28	-178.8	47.7	0	0	0	0	114.4	N240 F241 A242	N240-T244 PolarHBondContact O-N 3.36Å; N240-T244 PolarHBondContact O-OG1 2.93Å; F241-T244 PolarHBondContact O-N 3Å; F241-T244 PolarHBondContact O-OG1 3.16Å; A242-T244 VanDerWaalsContact C-N 3.34Å; A242-T244 PolarHBondContact O-N 2.73Å
245	E	57.3	Low	57	Low	115 Å²	115	65.1 Å²	65.1	54%	0.537	35%	0.352	S	S	.	.	H	α-helix	trans	-100.9	-13.5	-173.7	-66.6	-107.4	167.8	0	0	113.4	K137 F241 S247	K137-E245 IonicContact NZ-OE1 3.39Å; K137-E245 PolarHBondContact NZ-OE1 3.15Å; K137-E245 IonicContact NZ-OE2 3.19Å; K137-E245 PolarHBondContact NZ-OE2 2.78Å; F241-E245 HydrophobicContact CE1-CB 4.33Å; F241-E245 HydrophobicContact CE1-CG 3.72Å; F241-E245 HydrophobicContact CE2-CG 4.16Å; F241-E245 HydrophobicContact CZ-CB 4.48Å; F241-E245 HydrophobicContact CZ-CG 3.42Å; F241-E245 VanDerWaalsContact CZ-CG 3.42Å; F241-E245 PolarHBondContact O-N 2.95Å; E245-S247 PolarHBondContact O-N 2.86Å
246	T	58.9	Low	58.1	Low	49 Å²	49	66.1 Å²	66.1	30%	0.301	35%	0.354	S	S	.	.			trans	-71.1	131	174.5	53.6	0	0	0	0	110.5	A242 E243 M248 F252	A242-T246 WeakPolarHBondContact O-CB 3.49Å; A242-T246 WeakPolarHBondContact O-CG2 3.36Å; A242-T246 PolarHBondContact O-N 3.29Å; A242-T246 VanDerWaalsContact O-N 3.11Å; A242-T246 PolarHBondContact O-OG1 3.22Å; A242-T246 VanDerWaalsContact O-OG1 3.04Å; E243-T246 PolarHBondContact O-OG1 2.98Å; T246-M248 PolarHBondContact O-N 3.21Å; T246-M248 VanDerWaalsContact O-N 3.1Å; T246-F252 HydrophobicContact CG2-CB 4.48Å; T246-F252 HydrophobicContact CG2-CD2 4.22Å; T246-F252 HydrophobicContact CG2-CG 4.41Å
247	S	58	Low	59.6	Low	116 Å²	116	65.9 Å²	65.9	81%	0.811	35%	0.351	S	S	*	.	S	Bend	trans	-62.8	-13.2	170.3	56.8	0	0	0	0	113.1	E245	E245-S247 PolarHBondContact O-N 2.86Å
248	M	61.6	Low	61.3	Low	118 Å²	118	67.6 Å²	67.6	58%	0.581	36%	0.361	S	S	*	.			trans	-129.3	69.7	179.5	-57.4	-162.5	-162.7	0	0	111.5	T246 N250 L251 F252	T246-M248 PolarHBondContact O-N 3.21Å; T246-M248 VanDerWaalsContact O-N 3.1Å; M248-N250 PolarHBondContact O-N 3.46Å; M248-N250 VanDerWaalsContact O-N 3.12Å; M248-L251 HydrophobicContact CB-CB 4Å; M248-L251 PolarHBondContact O-N 2.98Å; M248-L251 VanDerWaalsContact O-N 3.14Å; M248-L251 HydrophobicContact SD-CD2 4.21Å; M248-F252 PolarHBondContact O-N 3.09Å
249	P	62.3	Low	62.9	Low	43 Å²	43	67.9 Å²	67.9	28%	0.279	37%	0.366	S	S	.	.	H	α-helix	trans	-60.7	-30.6	-175.4	24.5	-35.1	0	0	0	112.4	R253	P249-R253 VanDerWaalsContact O-CG 3.24Å; P249-R253 WeakPolarHBondContact O-CG 3.26Å; P249-R253 PolarHBondContact O-N 3.38Å
250	N	60.9	Low	64.3	Low	21 Å²	21	70.2 Å²	70.2	11%	0.112	38%	0.377	C	S	.	.	H	α-helix	trans	-72.6	-36.4	-179.9	-74.1	-26.1	0	0	0	113.7	M248 R253 T254 V399 M403	M248-N250 PolarHBondContact O-N 3.46Å; M248-N250 VanDerWaalsContact O-N 3.12Å; N250-R253 PolarHBondContact OD1-NH1 3.31Å; N250-T254 PolarHBondContact O-N 2.84Å; N250-T254 PolarHBondContact O-OG1 3.13Å; N250-V399 HydrophobicContact CB-CB 4.01Å; N250-V399 HydrophobicContact CB-CG1 3.63Å; N250-V399 HydrophobicContact CB-CG2 3.81Å; N250-V399 PolarHBondContact ND2-O 2.95Å; N250-V399 WeakPolarHBondContact O-CG2 3.37Å; N250-M403 HydrophobicContact CB-SD 4.41Å; N250-M403 WeakPolarHBondContact ND2-CG 3.42Å
251	L	68	Low	66.1	Low	103 Å²	103	68.1 Å²	68.1	54%	0.539	37%	0.367	S	S	.	.	H	α-helix	trans	-66.4	-45.3	173.8	178.3	62	0	0	0	109.6	M248 R253 T254 V255	M248-L251 HydrophobicContact CB-CB 4Å; M248-L251 PolarHBondContact O-N 2.98Å; M248-L251 VanDerWaalsContact O-N 3.14Å; M248-L251 HydrophobicContact SD-CD2 4.21Å; L251-R253 PolarHBondContact O-N 2.88Å; L251-T254 WeakPolarHBondContact O-CB 3.17Å; L251-T254 PolarHBondContact O-N 2.92Å; L251-V255 HydrophobicContact CD1-CG2 4.49Å; L251-V255 PolarHBondContact O-N 2.84Å
252	F	66.5	Low	67.9	Low	50 Å²	50	71.4 Å²	71.4	22%	0.219	38%	0.379	C	S	.	.	H	α-helix	trans	-58.3	-46.5	177.8	-170.9	-99.8	0	0	0	112.3	V239 A242 E243 T246 M248 T254 V255 Q256	V239-F252 HydrophobicContact CG1-CE1 4.43Å; A242-F252 HydrophobicContact CB-CE1 3.86Å; A242-F252 HydrophobicContact CB-CE2 3.8Å; A242-F252 HydrophobicContact CB-CZ 3.36Å; E243-F252 HydrophobicContact CB-CD1 4.17Å; E243-F252 HydrophobicContact CB-CE1 4.38Å; T246-F252 HydrophobicContact CG2-CB 4.48Å; T246-F252 HydrophobicContact CG2-CD2 4.22Å; T246-F252 HydrophobicContact CG2-CG 4.41Å; M248-F252 PolarHBondContact O-N 3.09Å; F252-T254 VanDerWaalsContact C-N 3.25Å; F252-T254 PolarHBondContact O-N 3.18Å; F252-V255 PolarHBondContact O-N 3.42Å; F252-Q256 WeakPolarHBondContact O-CB 3.47Å; F252-Q256 PolarHBondContact O-N 3.03Å
253	R	66.2	Low	69.6	Low	78 Å²	78	71.8 Å²	71.8	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-56.6	-37.2	173.3	-73.6	170.2	-173.9	142.8	8	113.1	E243 P249 N250 L251 L257	E243-R253 IonicContact OE1-CZ 3.38Å; E243-R253 IonicContact OE1-NE 2.72Å; E243-R253 PolarHBondContact OE1-NE 3.34Å; E243-R253 IonicContact OE1-NH2 3.28Å; E243-R253 PolarHBondContact OE1-NH2 2.76Å; P249-R253 VanDerWaalsContact O-CG 3.24Å; P249-R253 WeakPolarHBondContact O-CG 3.26Å; P249-R253 PolarHBondContact O-N 3.38Å; N250-R253 PolarHBondContact OD1-NH1 3.31Å; L251-R253 PolarHBondContact O-N 2.88Å; R253-L257 WeakPolarHBondContact O-CB 3.38Å; R253-L257 PolarHBondContact O-N 3.42Å
254	T	66.8	Low	71.3	Confident	47 Å²	47	71.9 Å²	71.9	29%	0.288	38%	0.381	S	S	.	.	H	α-helix	trans	-71	-45.2	179.8	-55.1	0	0	0	0	111.1	N250 L251 F252 Q256 L257 M258	N250-T254 PolarHBondContact O-N 2.84Å; N250-T254 PolarHBondContact O-OG1 3.13Å; L251-T254 WeakPolarHBondContact O-CB 3.17Å; L251-T254 PolarHBondContact O-N 2.92Å; F252-T254 VanDerWaalsContact C-N 3.25Å; F252-T254 PolarHBondContact O-N 3.18Å; T254-Q256 VanDerWaalsContact C-N 3.33Å; T254-Q256 PolarHBondContact O-N 3.49Å; T254-L257 WeakPolarHBondContact O-CB 3.47Å; T254-L257 PolarHBondContact O-N 3.03Å; T254-M258 HydrophobicContact CG2-CE 4.07Å; T254-M258 WeakPolarHBondContact O-CG 3.33Å; T254-M258 PolarHBondContact O-N 3.17Å
255	V	74.8	Confident	73.2	Confident	73 Å²	73	68.6 Å²	68.6	44%	0.442	36%	0.357	S	S	.	.	H	α-helix	trans	-61.8	-43.9	175.8	174.2	0	0	0	0	110.6	L251 F252 L257 M258 V259	L251-V255 HydrophobicContact CD1-CG2 4.49Å; L251-V255 PolarHBondContact O-N 2.84Å; F252-V255 PolarHBondContact O-N 3.42Å; V255-L257 VanDerWaalsContact C-N 3.29Å; V255-L257 PolarHBondContact O-N 3.31Å; V255-M258 WeakPolarHBondContact O-CB 3.08Å; V255-M258 PolarHBondContact O-N 3.37Å; V255-M258 VanDerWaalsContact O-N 3.15Å; V255-V259 WeakPolarHBondContact O-CG2 3.39Å; V255-V259 PolarHBondContact O-N 3.27Å
256	Q	72.8	Confident	74.9	Confident	58 Å²	58	63.3 Å²	63.3	27%	0.271	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-42.7	175.3	-174.5	-168.2	-8.3	0	0	111.8	V239 F252 T254 V259 I260	V239-Q256 VanDerWaalsContact CG1-CD 3.48Å; V239-Q256 HydrophobicContact CG1-CG 4.45Å; V239-Q256 VanDerWaalsContact CG1-NE2 3.26Å; F252-Q256 WeakPolarHBondContact O-CB 3.47Å; F252-Q256 PolarHBondContact O-N 3.03Å; T254-Q256 VanDerWaalsContact C-N 3.33Å; T254-Q256 PolarHBondContact O-N 3.49Å; Q256-V259 PolarHBondContact O-N 3Å; Q256-I260 HydrophobicContact CG-CD1 4.09Å; Q256-I260 VanDerWaalsContact O-CG1 3.32Å; Q256-I260 WeakPolarHBondContact O-CG1 3.41Å; Q256-I260 PolarHBondContact O-N 3.33Å
257	L	76.2	Confident	76.4	Confident	53 Å²	53	64.7 Å²	64.7	28%	0.277	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-44.9	176.1	-167.1	71	0	0	0	111.5	R253 T254 V255 V259 I260 V261 L372	R253-L257 WeakPolarHBondContact O-CB 3.38Å; R253-L257 PolarHBondContact O-N 3.42Å; T254-L257 WeakPolarHBondContact O-CB 3.47Å; T254-L257 PolarHBondContact O-N 3.03Å; V255-L257 VanDerWaalsContact C-N 3.29Å; V255-L257 PolarHBondContact O-N 3.31Å; L257-V259 PolarHBondContact O-N 2.98Å; L257-I260 PolarHBondContact O-N 2.98Å; L257-V261 WeakPolarHBondContact O-CG2 3.4Å; L257-V261 PolarHBondContact O-N 3.26Å; L257-L372 HydrophobicContact CD1-CD2 3.27Å; L257-L372 HydrophobicContact CG-CD2 4.15Å
258	M	80.6	Confident	78	Confident	130 Å²	130	59.6 Å²	59.6	64%	0.64	30%	0.297	S	S	*	.	H	α-helix	trans	-60.7	-43.3	177.5	-70.2	174.6	172.2	0	0	111.8	T254 V255 V261 Y262	T254-M258 HydrophobicContact CG2-CE 4.07Å; T254-M258 WeakPolarHBondContact O-CG 3.33Å; T254-M258 PolarHBondContact O-N 3.17Å; V255-M258 WeakPolarHBondContact O-CB 3.08Å; V255-M258 PolarHBondContact O-N 3.37Å; V255-M258 VanDerWaalsContact O-N 3.15Å; M258-V261 PolarHBondContact O-N 2.87Å; M258-Y262 WeakPolarHBondContact O-CB 3.46Å; M258-Y262 PolarHBondContact O-N 3.37Å
259	V	82.4	Confident	79.5	Confident	52 Å²	52	54 Å²	54	32%	0.315	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-43.7	176.3	174	0	0	0	0	111	L148 V255 Q256 L257 Y262 L263	L148-V259 HydrophobicContact CD1-CG1 3.92Å; V255-V259 WeakPolarHBondContact O-CG2 3.39Å; V255-V259 PolarHBondContact O-N 3.27Å; Q256-V259 PolarHBondContact O-N 3Å; L257-V259 PolarHBondContact O-N 2.98Å; V259-Y262 PolarHBondContact O-N 3.42Å; V259-L263 HydrophobicContact CG1-CD1 3.9Å; V259-L263 HydrophobicContact CG1-CG 4.44Å; V259-L263 VanDerWaalsContact O-CG 3.23Å; V259-L263 WeakPolarHBondContact O-CG 3.49Å; V259-L263 PolarHBondContact O-N 2.95Å
260	I	81.1	Confident	80.9	Confident	70 Å²	70	51.9 Å²	51.9	36%	0.359	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-44.9	176.9	-68.8	166.4	0	0	0	111.3	Q256 L257 L263 I264	Q256-I260 HydrophobicContact CG-CD1 4.09Å; Q256-I260 VanDerWaalsContact O-CG1 3.32Å; Q256-I260 WeakPolarHBondContact O-CG1 3.41Å; Q256-I260 PolarHBondContact O-N 3.33Å; L257-I260 PolarHBondContact O-N 2.98Å; I260-L263 PolarHBondContact O-N 2.9Å; I260-I264 HydrophobicContact CG2-CD1 3.91Å; I260-I264 VanDerWaalsContact O-CG1 3.31Å; I260-I264 WeakPolarHBondContact O-CG1 3.22Å; I260-I264 PolarHBondContact O-N 3.42Å; I260-I264 VanDerWaalsContact O-N 3.07Å
261	V	84.9	Confident	82.3	Confident	41 Å²	41	53.9 Å²	53.9	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-45.1	178.3	171.8	0	0	0	0	111	L257 M258 L263 I264 F265 L372	L257-V261 WeakPolarHBondContact O-CG2 3.4Å; L257-V261 PolarHBondContact O-N 3.26Å; M258-V261 PolarHBondContact O-N 2.87Å; V261-L263 PolarHBondContact O-N 3.34Å; V261-I264 PolarHBondContact O-N 3.48Å; V261-F265 HydrophobicContact CG1-CE1 4.25Å; V261-F265 HydrophobicContact CG1-CE2 4.48Å; V261-F265 HydrophobicContact CG1-CZ 4.22Å; V261-F265 PolarHBondContact O-N 2.95Å; V261-L372 HydrophobicContact CG2-CD1 3.6Å; V261-L372 HydrophobicContact CG2-CD2 4.17Å
262	Y	89.6	Confident	83.5	Confident	112 Å²	112	49 Å²	49	44%	0.439	24%	0.238	S	C	.	.	H	α-helix	trans	-57.1	-47.1	175.1	166.1	-99.2	0	0	0	111.8	V152 M258 V259 I264 F265 H266	V152-Y262 HydrophobicContact CG2-CE1 4.07Å; M258-Y262 WeakPolarHBondContact O-CB 3.46Å; M258-Y262 PolarHBondContact O-N 3.37Å; V259-Y262 PolarHBondContact O-N 3.42Å; Y262-I264 VanDerWaalsContact C-N 3.32Å; Y262-I264 PolarHBondContact O-N 3.08Å; Y262-F265 PolarHBondContact O-N 2.79Å; Y262-H266 VanDerWaalsContact O-CB 3.31Å; Y262-H266 WeakPolarHBondContact O-CB 3.38Å; Y262-H266 PolarHBondContact O-N 2.93Å
263	L	87.8	Confident	84.7	Confident	22 Å²	22	46.9 Å²	46.9	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-38.4	179.8	-71.9	165.7	0	0	0	112.5	L148 L151 V152 V259 I260 V261 H266 W267	L148-L263 HydrophobicContact CD1-CD1 4.03Å; L148-L263 HydrophobicContact CD1-CD2 4.11Å; L148-L263 HydrophobicContact CD1-CG 4.45Å; L151-L263 HydrophobicContact CD2-CD1 3.48Å; L151-L263 VanDerWaalsContact CD2-CD1 3.48Å; L151-L263 HydrophobicContact CD2-CD2 3.73Å; L151-L263 HydrophobicContact CD2-CG 4.12Å; L151-L263 HydrophobicContact CG-CD2 3.99Å; V152-L263 HydrophobicContact CG2-CD2 3.58Å; V259-L263 HydrophobicContact CG1-CD1 3.9Å; V259-L263 HydrophobicContact CG1-CG 4.44Å; V259-L263 VanDerWaalsContact O-CG 3.23Å; V259-L263 WeakPolarHBondContact O-CG 3.49Å; V259-L263 PolarHBondContact O-N 2.95Å; I260-L263 PolarHBondContact O-N 2.9Å; V261-L263 PolarHBondContact O-N 3.34Å; L263-H266 PolarHBondContact O-N 2.95Å; L263-W267 WeakPolarHBondContact O-CB 3.45Å; L263-W267 VanDerWaalsContact O-CD1 3.23Å; L263-W267 PolarHBondContact O-N 2.97Å
264	I	88.2	Confident	85.8	Confident	47 Å²	47	45.5 Å²	45.5	24%	0.241	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-46.9	175.8	-67.9	165.1	0	0	0	110.4	I260 V261 Y262 H266 W267 A268 L340 I368	I260-I264 HydrophobicContact CG2-CD1 3.91Å; I260-I264 VanDerWaalsContact O-CG1 3.31Å; I260-I264 WeakPolarHBondContact O-CG1 3.22Å; I260-I264 PolarHBondContact O-N 3.42Å; I260-I264 VanDerWaalsContact O-N 3.07Å; V261-I264 PolarHBondContact O-N 3.48Å; Y262-I264 VanDerWaalsContact C-N 3.32Å; Y262-I264 PolarHBondContact O-N 3.08Å; I264-H266 VanDerWaalsContact C-N 3.32Å; I264-H266 PolarHBondContact O-N 2.93Å; I264-W267 PolarHBondContact O-N 3.41Å; I264-A268 WeakPolarHBondContact O-CB 3.32Å; I264-A268 PolarHBondContact O-N 3.44Å; I264-L340 HydrophobicContact CG2-CD1 3.98Å; I264-I368 HydrophobicContact CD1-CD1 4.32Å; I264-I368 HydrophobicContact CD1-CG2 3.89Å; I264-I368 HydrophobicContact CG2-CD1 3.87Å
265	F	92	Very high	86.9	Confident	42 Å²	42	44.7 Å²	44.7	18%	0.184	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-41.3	178.4	-76.9	14.6	0	0	0	111.1	V261 Y262 A268 T269 L333 A337 L340 I341	V261-F265 HydrophobicContact CG1-CE1 4.25Å; V261-F265 HydrophobicContact CG1-CE2 4.48Å; V261-F265 HydrophobicContact CG1-CZ 4.22Å; V261-F265 PolarHBondContact O-N 2.95Å; Y262-F265 PolarHBondContact O-N 2.79Å; F265-A268 PolarHBondContact O-N 2.93Å; F265-T269 WeakPolarHBondContact O-CB 3.29Å; F265-T269 PolarHBondContact O-N 2.92Å; F265-T269 PolarHBondContact O-OG1 3.08Å; F265-L333 HydrophobicContact CB-CD1 4.07Å; F265-A337 HydrophobicContact CD2-CB 4.42Å; F265-A337 HydrophobicContact CE2-CB 4.21Å; F265-L340 HydrophobicContact CD1-CB 4.24Å; F265-L340 HydrophobicContact CD1-CD1 3.45Å; F265-L340 VanDerWaalsContact CD1-CD1 3.45Å; F265-L340 HydrophobicContact CE1-CB 3.73Å; F265-L340 HydrophobicContact CE1-CD1 3.82Å; F265-L340 HydrophobicContact CE1-CG 4.47Å; F265-L340 HydrophobicContact CG-CD1 4.41Å; F265-L340 HydrophobicContact CZ-CB 4.5Å; F265-I341 HydrophobicContact CE2-CD1 3.98Å; F265-I341 HydrophobicContact CE2-CG1 4.29Å; F265-I341 HydrophobicContact CZ-CD1 3.84Å; F265-I341 HydrophobicContact CZ-CG1 3.64Å
266	H	92.6	Very high	87.6	Confident	5 Å²	5	41.2 Å²	41.2	2%	0.023	20%	0.201	C	C	.	.	H	α-helix	trans	-61.3	-48.7	176.9	-179.3	69.6	0	0	0	112	V152 I155 Y262 L263 I264 A268 T269 C270 Y329	V152-H266 PolarHBondContact O-NE2 3.18Å; I155-H266 WeakPolarHBondContact CG2-NE2 3.2Å; Y262-H266 VanDerWaalsContact O-CB 3.31Å; Y262-H266 WeakPolarHBondContact O-CB 3.38Å; Y262-H266 PolarHBondContact O-N 2.93Å; L263-H266 PolarHBondContact O-N 2.95Å; I264-H266 VanDerWaalsContact C-N 3.32Å; I264-H266 PolarHBondContact O-N 2.93Å; H266-A268 PolarHBondContact O-N 2.89Å; H266-T269 VanDerWaalsContact O-CB 3.3Å; H266-T269 WeakPolarHBondContact O-CB 3.49Å; H266-T269 PolarHBondContact O-N 3.34Å; H266-C270 PolarHBondContact O-N 3.1Å; H266-C270 PolarHBondContact O-SG 3.19Å; H266-C270 VanDerWaalsContact O-SG 3.38Å; H266-Y329 AromaticContact CE1-CE2 3.88Å; H266-Y329 AromaticContact ND1-CE2 3.58Å; H266-Y329 AromaticContact ND1-CZ 3.73Å; H266-Y329 PolarHBondContact ND1-OH 3.27Å
267	W	90.9	Very high	88.4	Confident	78 Å²	78	40.9 Å²	40.9	30%	0.295	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-41.5	177.1	-86.2	63.8	0	0	0	112.2	L151 I155 L263 I264 C270 F271	L151-W267 HydrophobicContact CD1-CZ2 3.93Å; L151-W267 PolarHBondContact O-NE1 3.27Å; L151-W267 VanDerWaalsContact O-NE1 3.09Å; I155-W267 HydrophobicContact CB-CD2 4.43Å; I155-W267 HydrophobicContact CB-CZ2 4.25Å; I155-W267 HydrophobicContact CD1-CE3 4.47Å; I155-W267 HydrophobicContact CD1-CZ3 4.4Å; I155-W267 HydrophobicContact CG1-CD2 4.19Å; I155-W267 HydrophobicContact CG1-CE3 4.26Å; I155-W267 HydrophobicContact CG2-CD2 4.32Å; I155-W267 HydrophobicContact CG2-CG 4.34Å; I155-W267 HydrophobicContact CG2-CZ2 4.46Å; L263-W267 WeakPolarHBondContact O-CB 3.45Å; L263-W267 VanDerWaalsContact O-CD1 3.23Å; L263-W267 PolarHBondContact O-N 2.97Å; I264-W267 PolarHBondContact O-N 3.41Å; W267-C270 PolarHBondContact O-N 2.91Å; W267-F271 AromaticContact CE3-CE2 3.63Å; W267-F271 HydrophobicContact CE3-CE2 3.63Å; W267-F271 HydrophobicContact CE3-CZ 4.01Å; W267-F271 HydrophobicContact CZ3-CE2 4.21Å; W267-F271 HydrophobicContact CZ3-CZ 4.14Å; W267-F271 WeakPolarHBondContact O-CD2 3.49Å; W267-F271 PolarHBondContact O-N 3.43Å
268	A	91.9	Very high	89	Confident	8 Å²	8	42.4 Å²	42.4	7%	0.066	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-38.2	175.7	0	0	0	0	0	112.7	I264 F265 H266 F271 Y272 A336 L340	I264-A268 WeakPolarHBondContact O-CB 3.32Å; I264-A268 PolarHBondContact O-N 3.44Å; F265-A268 PolarHBondContact O-N 2.93Å; H266-A268 PolarHBondContact O-N 2.89Å; A268-F271 PolarHBondContact O-N 3.38Å; A268-Y272 WeakPolarHBondContact O-CB 3.4Å; A268-Y272 PolarHBondContact O-N 3.38Å; A268-A336 HydrophobicContact CB-CB 3.9Å; A268-L340 HydrophobicContact CB-CD1 3.65Å; A268-L340 HydrophobicContact CB-CG 4.49Å
269	T	93.2	Very high	89.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-51.3	173.6	-60	0	0	0	0	110.8	F160 F265 H266 Y272 F273 Y329 C332 L333	F160-T269 HydrophobicContact CZ-CG2 4.45Å; F265-T269 WeakPolarHBondContact O-CB 3.29Å; F265-T269 PolarHBondContact O-N 2.92Å; F265-T269 PolarHBondContact O-OG1 3.08Å; H266-T269 VanDerWaalsContact O-CB 3.3Å; H266-T269 WeakPolarHBondContact O-CB 3.49Å; H266-T269 PolarHBondContact O-N 3.34Å; T269-Y272 PolarHBondContact O-N 3.45Å; T269-F273 PolarHBondContact O-N 3.15Å; T269-F273 VanDerWaalsContact O-N 3.14Å; T269-Y329 HydrophobicContact CG2-CD2 3.83Å; T269-Y329 HydrophobicContact CG2-CE2 3.77Å; T269-C332 HydrophobicContact CG2-CB 3.6Å; T269-L333 HydrophobicContact CG2-CB 4Å; T269-L333 VanDerWaalsContact OG1-CA 3.26Å; T269-L333 WeakPolarHBondContact OG1-CA 3.49Å; T269-L333 VanDerWaalsContact OG1-CD1 3.23Å; T269-L333 WeakPolarHBondContact OG1-CD1 3.45Å
270	C	91.4	Very high	89.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.7	-45.4	178.8	-74.5	0	0	0	0	112.2	I155 S159 H266 W267 Y272 F273 L274	I155-C270 HydrophobicContact CD1-CB 4.49Å; I155-C270 HydrophobicContact CG1-CB 3.65Å; S159-C270 VanDerWaalsContact OG-CB 3.25Å; S159-C270 WeakPolarHBondContact OG-CB 3.38Å; S159-C270 PolarHBondContact OG-O 3.06Å; H266-C270 PolarHBondContact O-N 3.1Å; H266-C270 PolarHBondContact O-SG 3.19Å; H266-C270 VanDerWaalsContact O-SG 3.38Å; W267-C270 PolarHBondContact O-N 2.91Å; C270-Y272 PolarHBondContact O-N 3.11Å; C270-F273 PolarHBondContact O-N 3.21Å; C270-L274 WeakPolarHBondContact O-CB 3.48Å; C270-L274 PolarHBondContact O-N 3.48Å
271	F	90.8	Very high	89.5	Confident	62 Å²	62	39.8 Å²	39.8	27%	0.272	21%	0.211	S	C	.	.	H	α-helix	trans	-63.8	-40.6	177	-80.8	-56	0	0	0	113.1	W267 A268 F273 L274 V275 F357	W267-F271 AromaticContact CE3-CE2 3.63Å; W267-F271 HydrophobicContact CE3-CE2 3.63Å; W267-F271 HydrophobicContact CE3-CZ 4.01Å; W267-F271 HydrophobicContact CZ3-CE2 4.21Å; W267-F271 HydrophobicContact CZ3-CZ 4.14Å; W267-F271 WeakPolarHBondContact O-CD2 3.49Å; W267-F271 PolarHBondContact O-N 3.43Å; A268-F271 PolarHBondContact O-N 3.38Å; F271-F273 VanDerWaalsContact C-N 3.34Å; F271-F273 PolarHBondContact O-N 3.18Å; F271-L274 HydrophobicContact CD1-CD2 4.44Å; F271-L274 PolarHBondContact O-N 3.48Å; F271-V275 VanDerWaalsContact O-CG2 3.31Å; F271-V275 WeakPolarHBondContact O-CG2 3.46Å; F271-V275 PolarHBondContact O-N 3.37Å; F271-F357 HydrophobicContact CB-CZ 4.42Å
272	Y	92.8	Very high	89.2	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-42.1	177.9	172.3	-104	0	0	0	111.9	A268 T269 C270 V275 S276 W286 C332 W335 F357	A268-Y272 WeakPolarHBondContact O-CB 3.4Å; A268-Y272 PolarHBondContact O-N 3.38Å; T269-Y272 PolarHBondContact O-N 3.45Å; C270-Y272 PolarHBondContact O-N 3.11Å; Y272-V275 PolarHBondContact O-N 3.22Å; Y272-S276 VanDerWaalsContact O-CB 3.32Å; Y272-S276 WeakPolarHBondContact O-CB 3.42Å; Y272-S276 PolarHBondContact O-N 3.06Å; Y272-S276 PolarHBondContact O-OG 2.96Å; Y272-W286 AromaticContact CD2-CH2 3.96Å; Y272-W286 HydrophobicContact CD2-CH2 3.96Å; Y272-W286 AromaticContact CD2-CZ2 3.99Å; Y272-W286 HydrophobicContact CD2-CZ2 3.99Å; Y272-W286 HydrophobicContact CE2-CD2 4.46Å; Y272-W286 AromaticContact CE2-CH2 3.85Å; Y272-W286 HydrophobicContact CE2-CH2 3.85Å; Y272-W286 AromaticContact CE2-CZ2 3.73Å; Y272-W286 HydrophobicContact CE2-CZ2 3.73Å; Y272-W286 HydrophobicContact CE2-CZ3 4.26Å; Y272-W286 PolarHBondContact OH-O 2.96Å; Y272-C332 HydrophobicContact CD1-CB 3.76Å; Y272-C332 VanDerWaalsContact CD1-SG 3.56Å; Y272-C332 HydrophobicContact CE1-CB 4.33Å; Y272-W335 HydrophobicContact CD1-CB 4.25Å; Y272-W335 HydrophobicContact CD1-CD2 4.21Å; Y272-W335 HydrophobicContact CD1-CE3 4.17Å; Y272-W335 HydrophobicContact CD1-CG 4.24Å; Y272-W335 AromaticContact CD2-CD2 3.43Å; Y272-W335 HydrophobicContact CD2-CD2 3.43Å; Y272-W335 VanDerWaalsContact CD2-CD2 3.43Å; Y272-W335 AromaticContact CD2-CE2 3.6Å; Y272-W335 AromaticContact CD2-CE3 3.39Å; Y272-W335 HydrophobicContact CD2-CE3 3.39Å; Y272-W335 HydrophobicContact CD2-CG 4.12Å; Y272-W335 AromaticContact CD2-CH2 3.8Å; Y272-W335 HydrophobicContact CD2-CH2 3.8Å; Y272-W335 AromaticContact CD2-CZ2 3.8Å; Y272-W335 HydrophobicContact CD2-CZ2 3.8Å; Y272-W335 AromaticContact CD2-CZ3 3.59Å; Y272-W335 HydrophobicContact CD2-CZ3 3.59Å; Y272-W335 HydrophobicContact CE1-CB 3.97Å; Y272-W335 HydrophobicContact CE1-CD2 4.23Å; Y272-W335 AromaticContact CE1-CG 3.91Å; Y272-W335 HydrophobicContact CE1-CG 3.91Å; Y272-W335 AromaticContact CE2-CD1 3.77Å; Y272-W335 AromaticContact CE2-CD2 3.44Å; Y272-W335 HydrophobicContact CE2-CD2 3.44Å; Y272-W335 VanDerWaalsContact CE2-CD2 3.44Å; Y272-W335 AromaticContact CE2-CE2 3.35Å; Y272-W335 AromaticContact CE2-CE3 3.94Å; Y272-W335 HydrophobicContact CE2-CE3 3.94Å; Y272-W335 AromaticContact CE2-CG 3.76Å; Y272-W335 HydrophobicContact CE2-CG 3.76Å; Y272-W335 HydrophobicContact CE2-CH2 4.32Å; Y272-W335 AromaticContact CE2-CZ2 3.84Å; Y272-W335 HydrophobicContact CE2-CZ2 3.84Å; Y272-W335 HydrophobicContact CE2-CZ3 4.36Å; Y272-W335 AromaticContact CE2-NE1 3.51Å; Y272-W335 AromaticContact CG-CD2 3.81Å; Y272-W335 HydrophobicContact CG-CD2 3.81Å; Y272-W335 AromaticContact CG-CE3 3.5Å; Y272-W335 HydrophobicContact CG-CE3 3.5Å; Y272-W335 VanDerWaalsContact CG-CE3 3.5Å; Y272-W335 HydrophobicContact CG-CG 4.32Å; Y272-W335 AromaticContact CG-CZ3 3.94Å; Y272-W335 HydrophobicContact CG-CZ3 3.94Å; Y272-W335 AromaticContact CZ-CD1 3.62Å; Y272-W335 AromaticContact CZ-CD2 3.84Å; Y272-W335 AromaticContact CZ-CG 3.62Å; Y272-W335 AromaticContact CZ-NE1 3.85Å; Y272-F357 HydrophobicContact CD2-CE1 4.19Å
273	F	91.7	Very high	88.9	Confident	5 Å²	5	40.7 Å²	40.7	2%	0.022	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-41.5	174.5	-170.9	-105.8	0	0	0	112.2	S159 F160 T269 C270 F271 V275 S276 T277 L281 Y288 H328	S159-F273 WeakPolarHBondContact O-CD1 3.25Å; S159-F273 VanDerWaalsContact O-CE1 3.24Å; S159-F273 WeakPolarHBondContact O-CE1 3.09Å; F160-F273 AromaticContact CD1-CD1 3.51Å; F160-F273 HydrophobicContact CD1-CD1 3.51Å; F160-F273 HydrophobicContact CD1-CD2 4.43Å; F160-F273 AromaticContact CD1-CE1 3.52Å; F160-F273 HydrophobicContact CD1-CE1 3.52Å; F160-F273 HydrophobicContact CD1-CE2 4.45Å; F160-F273 AromaticContact CD1-CG 3.98Å; F160-F273 HydrophobicContact CD1-CG 3.98Å; F160-F273 HydrophobicContact CD1-CZ 4.01Å; F160-F273 HydrophobicContact CE1-CB 3.86Å; F160-F273 AromaticContact CE1-CD1 3.42Å; F160-F273 HydrophobicContact CE1-CD1 3.42Å; F160-F273 VanDerWaalsContact CE1-CD1 3.42Å; F160-F273 AromaticContact CE1-CD2 3.77Å; F160-F273 HydrophobicContact CE1-CD2 3.77Å; F160-F273 AromaticContact CE1-CE1 3.82Å; F160-F273 HydrophobicContact CE1-CE1 3.82Å; F160-F273 HydrophobicContact CE1-CE2 4.15Å; F160-F273 AromaticContact CE1-CG 3.38Å; F160-F273 HydrophobicContact CE1-CG 3.38Å; F160-F273 HydrophobicContact CE1-CZ 4.16Å; F160-F273 HydrophobicContact CG-CD1 4.32Å; F160-F273 HydrophobicContact CG-CE1 4.42Å; F160-F273 HydrophobicContact CZ-CB 3.93Å; F160-F273 HydrophobicContact CZ-CD1 4.17Å; F160-F273 AromaticContact CZ-CG 3.98Å; F160-F273 HydrophobicContact CZ-CG 3.98Å; T269-F273 PolarHBondContact O-N 3.15Å; T269-F273 VanDerWaalsContact O-N 3.14Å; C270-F273 PolarHBondContact O-N 3.21Å; F271-F273 VanDerWaalsContact C-N 3.34Å; F271-F273 PolarHBondContact O-N 3.18Å; F273-V275 VanDerWaalsContact C-N 3.34Å; F273-V275 PolarHBondContact O-N 3.32Å; F273-S276 WeakPolarHBondContact O-CB 3.28Å; F273-S276 PolarHBondContact O-N 3.39Å; F273-T277 HydrophobicContact CD1-CG2 4.18Å; F273-T277 HydrophobicContact CE1-CG2 3.8Å; F273-T277 HydrophobicContact CE2-CG2 4.45Å; F273-T277 HydrophobicContact CZ-CG2 3.96Å; F273-T277 WeakPolarHBondContact O-CG2 3.42Å; F273-T277 PolarHBondContact O-N 3.48Å; F273-T277 PolarHBondContact O-OG1 3.39Å; F273-L281 HydrophobicContact CE2-CD2 4.4Å; F273-Y288 HydrophobicContact CD2-CG 4.48Å; F273-Y288 HydrophobicContact CE2-CG 4.35Å; F273-H328 HydrophobicContact CD2-CB 4.48Å; F273-H328 HydrophobicContact CE2-CB 3.93Å; F273-H328 AromaticContact CE2-CD2 3.58Å; F273-H328 AromaticContact CE2-CG 3.82Å; F273-H328 HydrophobicContact CZ-CB 4.26Å; F273-H328 AromaticContact CZ-CD2 3.95Å; F273-H328 AromaticContact CZ-CG 3.96Å
274	L	89.5	Confident	88.8	Confident	48 Å²	48	41.1 Å²	41.1	25%	0.251	23%	0.227	S	C	.	.	H	α-helix	trans	-62.3	-39.8	176	-175.8	72.6	0	0	0	112.5	F158 C270 F271 T277 A278	F158-L274 HydrophobicContact CD1-CD1 4.29Å; F158-L274 HydrophobicContact CD1-CD2 4.26Å; F158-L274 HydrophobicContact CE1-CD1 3.78Å; F158-L274 HydrophobicContact CE1-CD2 3.63Å; F158-L274 HydrophobicContact CE1-CG 4.35Å; F158-L274 HydrophobicContact CZ-CD1 4.49Å; C270-L274 WeakPolarHBondContact O-CB 3.48Å; C270-L274 PolarHBondContact O-N 3.48Å; F271-L274 HydrophobicContact CD1-CD2 4.44Å; F271-L274 PolarHBondContact O-N 3.48Å; L274-T277 WeakPolarHBondContact CA-OG1 3.18Å; L274-T277 PolarHBondContact O-OG1 2.81Å; L274-A278 WeakPolarHBondContact O-CB 3.34Å; L274-A278 PolarHBondContact O-N 3.15Å; L274-A278 VanDerWaalsContact O-N 3.15Å
275	V	90.3	Very high	88.7	Confident	31 Å²	31	41.5 Å²	41.5	19%	0.188	23%	0.234	C	C	.	.	H	α-helix	trans	-70.1	-41.4	175.8	173.3	0	0	0	0	110.5	F271 Y272 F273 T277 A278 Y279 W286 F357	F271-V275 VanDerWaalsContact O-CG2 3.31Å; F271-V275 WeakPolarHBondContact O-CG2 3.46Å; F271-V275 PolarHBondContact O-N 3.37Å; Y272-V275 PolarHBondContact O-N 3.22Å; F273-V275 VanDerWaalsContact C-N 3.34Å; F273-V275 PolarHBondContact O-N 3.32Å; V275-T277 VanDerWaalsContact C-N 3.34Å; V275-T277 PolarHBondContact O-N 2.9Å; V275-A278 WeakPolarHBondContact O-CB 3.22Å; V275-A278 PolarHBondContact O-N 3.29Å; V275-A278 VanDerWaalsContact O-N 3.1Å; V275-Y279 HydrophobicContact CG1-CD2 3.83Å; V275-Y279 HydrophobicContact CG1-CE2 3.65Å; V275-Y279 WeakPolarHBondContact O-CD2 3.48Å; V275-Y279 PolarHBondContact O-N 3.3Å; V275-Y279 VanDerWaalsContact O-N 3.14Å; V275-W286 HydrophobicContact CG1-CH2 4.03Å; V275-W286 HydrophobicContact CG1-CZ3 4.13Å; V275-F357 HydrophobicContact CG2-CD2 4.21Å; V275-F357 HydrophobicContact CG2-CE2 3.85Å; V275-F357 HydrophobicContact CG2-CZ 4.14Å
276	S	90.1	Very high	88.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-44.3	175.7	-68.5	0	0	0	0	112.3	Y272 F273 A278 Y279 G280 Y288	Y272-S276 VanDerWaalsContact O-CB 3.32Å; Y272-S276 WeakPolarHBondContact O-CB 3.42Å; Y272-S276 PolarHBondContact O-N 3.06Å; Y272-S276 PolarHBondContact O-OG 2.96Å; F273-S276 WeakPolarHBondContact O-CB 3.28Å; F273-S276 PolarHBondContact O-N 3.39Å; S276-A278 VanDerWaalsContact C-N 3.3Å; S276-A278 PolarHBondContact O-N 3.19Å; S276-Y279 PolarHBondContact O-N 3.28Å; S276-G280 CarbonylContact O-C 3.49Å; S276-G280 PolarHBondContact O-N 3.12Å; S276-G280 VanDerWaalsContact O-N 3.16Å; S276-Y288 PolarHBondContact OG-N 3.15Å
277	T	87.8	Confident	88.4	Confident	50 Å²	50	39.3 Å²	39.3	31%	0.307	22%	0.224	S	C	.	.	H	α-helix	trans	-66.8	-29.9	175.4	49.7	0	0	0	0	112.8	F273 L274 V275 G280 L281	F273-T277 HydrophobicContact CD1-CG2 4.18Å; F273-T277 HydrophobicContact CE1-CG2 3.8Å; F273-T277 HydrophobicContact CE2-CG2 4.45Å; F273-T277 HydrophobicContact CZ-CG2 3.96Å; F273-T277 WeakPolarHBondContact O-CG2 3.42Å; F273-T277 PolarHBondContact O-N 3.48Å; F273-T277 PolarHBondContact O-OG1 3.39Å; L274-T277 WeakPolarHBondContact CA-OG1 3.18Å; L274-T277 PolarHBondContact O-OG1 2.81Å; V275-T277 VanDerWaalsContact C-N 3.34Å; V275-T277 PolarHBondContact O-N 2.9Å; T277-G280 PolarHBondContact O-N 3.39Å; T277-L281 HydrophobicContact CG2-CD1 4.38Å; T277-L281 HydrophobicContact CG2-CD2 3.77Å; T277-L281 HydrophobicContact CG2-CG 4.2Å
278	A	88.8	Confident	88.2	Confident	86 Å²	86	35.7 Å²	35.7	71%	0.711	21%	0.211	S	C	*	.	H	α-helix	trans	-72.9	-35.2	178	0	0	0	0	0	113.8	L274 V275 S276 G280	L274-A278 WeakPolarHBondContact O-CB 3.34Å; L274-A278 PolarHBondContact O-N 3.15Å; L274-A278 VanDerWaalsContact O-N 3.15Å; V275-A278 WeakPolarHBondContact O-CB 3.22Å; V275-A278 PolarHBondContact O-N 3.29Å; V275-A278 VanDerWaalsContact O-N 3.1Å; S276-A278 VanDerWaalsContact C-N 3.3Å; S276-A278 PolarHBondContact O-N 3.19Å; A278-G280 VanDerWaalsContact C-N 3.32Å
279	Y	88.6	Confident	87.7	Confident	88 Å²	88	37 Å²	37	35%	0.345	22%	0.217	S	C	.	.	H	α-helix	trans	-76.4	-21.6	171.7	-76.8	-76.9	0	0	0	112.6	V275 S276 E351 Q354	V275-Y279 HydrophobicContact CG1-CD2 3.83Å; V275-Y279 HydrophobicContact CG1-CE2 3.65Å; V275-Y279 WeakPolarHBondContact O-CD2 3.48Å; V275-Y279 PolarHBondContact O-N 3.3Å; V275-Y279 VanDerWaalsContact O-N 3.14Å; S276-Y279 PolarHBondContact O-N 3.28Å; Y279-E351 WeakPolarHBondContact CE1-OE2 3.24Å; Y279-Q354 HydrophobicContact CE2-CG 4.13Å
280	G	84.9	Confident	87	Confident	29 Å²	29	38.9 Å²	38.9	30%	0.299	23%	0.229	S	C	.	.			trans	103.6	123.8	-175.2	0	0	0	0	0	110.2	S276 T277 A278 S283 V287	S276-G280 CarbonylContact O-C 3.49Å; S276-G280 PolarHBondContact O-N 3.12Å; S276-G280 VanDerWaalsContact O-N 3.16Å; T277-G280 PolarHBondContact O-N 3.39Å; A278-G280 VanDerWaalsContact C-N 3.32Å; G280-S283 VanDerWaalsContact O-CB 3.31Å; G280-S283 WeakPolarHBondContact O-CB 3.4Å; G280-S283 PolarHBondContact O-N 3.38Å; G280-S283 PolarHBondContact O-OG 2.85Å; G280-V287 WeakPolarHBondContact O-CG1 3.06Å
281	L	81.1	Confident	86.2	Confident	80 Å²	80	46 Å²	46	42%	0.419	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	141.8	-178	-62.9	173.3	0	0	0	110.7	F273 T277 S283 Y288	F273-L281 HydrophobicContact CE2-CD2 4.4Å; T277-L281 HydrophobicContact CG2-CD1 4.38Å; T277-L281 HydrophobicContact CG2-CD2 3.77Å; T277-L281 HydrophobicContact CG2-CG 4.2Å; L281-S283 PolarHBondContact O-N 2.96Å; L281-Y288 HydrophobicContact CD2-CD1 4.05Å; L281-Y288 HydrophobicContact CD2-CG 4.49Å
282	E	80.1	Confident	85.6	Confident	97 Å²	97	47.8 Å²	47.8	45%	0.453	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	14.4	177.1	-64.2	171.3	-178.6	0	0	115.6	D284 Y288 N289 S290	E282-D284 VanDerWaalsContact C-N 3.35Å; E282-Y288 PolarHBondContact N-O 3.25Å; E282-Y288 VanDerWaalsContact N-O 3.13Å; E282-N289 HydrophobicContact CG-CB 4.2Å; E282-S290 VanDerWaalsContact OE1-CB 3.31Å; E282-S290 WeakPolarHBondContact OE1-CB 3.39Å; E282-S290 PolarHBondContact OE1-N 2.71Å; E282-S290 PolarHBondContact OE1-OG 3.1Å
283	S	83.2	Confident	84.9	Confident	74 Å²	74	49.9 Å²	49.9	52%	0.517	28%	0.279	S	S	.	.	S	Bend	trans	-66.9	-35	177.6	51.2	0	0	0	0	113.2	G280 L281	G280-S283 VanDerWaalsContact O-CB 3.31Å; G280-S283 WeakPolarHBondContact O-CB 3.4Å; G280-S283 PolarHBondContact O-N 3.38Å; G280-S283 PolarHBondContact O-OG 2.85Å; L281-S283 PolarHBondContact O-N 2.96Å
284	D	85.8	Confident	83.9	Confident	32 Å²	32	56.9 Å²	56.9	17%	0.171	32%	0.315	C	S	.	.	S	Bend	trans	-148.9	180	-177.6	74.2	35.2	0	0	0	112.7	E282 W286 V287 I350 Q354	E282-D284 VanDerWaalsContact C-N 3.35Å; D284-W286 WeakPolarHBondContact OD1-CA 3.12Å; D284-W286 WeakPolarHBondContact OD1-CB 2.78Å; D284-W286 PolarHBondContact OD1-N 2.96Å; D284-V287 WeakPolarHBondContact OD1-CB 3.31Å; D284-V287 VanDerWaalsContact OD1-CG2 3.31Å; D284-V287 WeakPolarHBondContact OD1-CG2 3.3Å; D284-V287 PolarHBondContact OD1-N 3.1Å; D284-I350 HydrophobicContact CB-CD1 3.63Å; D284-Q354 PolarHBondContact OD2-NE2 3.47Å
285	S	85.3	Confident	83.1	Confident	55 Å²	55	56.5 Å²	56.5	39%	0.385	31%	0.314	S	S	.	.	S	Bend	trans	-77	-20.3	-178.4	71.1	0	0	0	0	113.5	R292 P347	S285-R292 VanDerWaalsContact O-CZ 3.24Å; S285-R292 PolarHBondContact O-NH1 3.43Å; S285-R292 VanDerWaalsContact O-NH1 3.1Å; S285-R292 PolarHBondContact O-NH2 3.27Å; S285-P347 VanDerWaalsContact O-CB 3.32Å; S285-P347 WeakPolarHBondContact O-CB 3.25Å
286	W	88.8	Confident	82.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-80.1	-43.2	177.6	-178.1	84.6	0	0	0	111.3	Y272 V275 D284 W335 P349 Q354 F357 T358	Y272-W286 AromaticContact CD2-CH2 3.96Å; Y272-W286 HydrophobicContact CD2-CH2 3.96Å; Y272-W286 AromaticContact CD2-CZ2 3.99Å; Y272-W286 HydrophobicContact CD2-CZ2 3.99Å; Y272-W286 HydrophobicContact CE2-CD2 4.46Å; Y272-W286 AromaticContact CE2-CH2 3.85Å; Y272-W286 HydrophobicContact CE2-CH2 3.85Å; Y272-W286 AromaticContact CE2-CZ2 3.73Å; Y272-W286 HydrophobicContact CE2-CZ2 3.73Å; Y272-W286 HydrophobicContact CE2-CZ3 4.26Å; Y272-W286 PolarHBondContact OH-O 2.96Å; V275-W286 HydrophobicContact CG1-CH2 4.03Å; V275-W286 HydrophobicContact CG1-CZ3 4.13Å; D284-W286 WeakPolarHBondContact OD1-CA 3.12Å; D284-W286 WeakPolarHBondContact OD1-CB 2.78Å; D284-W286 PolarHBondContact OD1-N 2.96Å; W286-W335 AromaticContact CE2-CZ2 3.96Å; W286-W335 HydrophobicContact CZ2-CH2 4.18Å; W286-W335 AromaticContact CZ2-CZ2 3.62Å; W286-W335 HydrophobicContact CZ2-CZ2 3.62Å; W286-W335 AromaticContact NE1-CZ2 3.8Å; W286-W335 AromaticContact NE1-NE1 3.85Å; W286-P349 VanDerWaalsContact CD1-CA 3.47Å; W286-P349 HydrophobicContact CG-CB 4.15Å; W286-Q354 HydrophobicContact CD2-CB 3.94Å; W286-Q354 HydrophobicContact CD2-CG 4Å; W286-Q354 HydrophobicContact CE3-CB 3.99Å; W286-Q354 VanDerWaalsContact CE3-CD 3.47Å; W286-Q354 HydrophobicContact CE3-CG 3.54Å; W286-Q354 HydrophobicContact CG-CB 4.46Å; W286-Q354 HydrophobicContact CH2-CB 4.44Å; W286-Q354 HydrophobicContact CH2-CG 4.4Å; W286-Q354 HydrophobicContact CZ2-CB 4.4Å; W286-Q354 HydrophobicContact CZ3-CB 4.24Å; W286-Q354 HydrophobicContact CZ3-CG 3.77Å; W286-F357 AromaticContact CH2-CD1 3.72Å; W286-F357 HydrophobicContact CH2-CD1 3.72Å; W286-F357 HydrophobicContact CH2-CE1 4.13Å; W286-F357 AromaticContact CZ2-CD1 3.69Å; W286-F357 HydrophobicContact CZ2-CD1 3.69Å; W286-F357 HydrophobicContact CZ2-CE1 4.2Å; W286-T358 PolarHBondContact NE1-OG1 3.19Å
287	V	88.6	Confident	80.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-60.1	155.5	179.3	176.2	0	0	0	0	111	G280 D284 N289	G280-V287 WeakPolarHBondContact O-CG1 3.06Å; D284-V287 WeakPolarHBondContact OD1-CB 3.31Å; D284-V287 VanDerWaalsContact OD1-CG2 3.31Å; D284-V287 WeakPolarHBondContact OD1-CG2 3.3Å; D284-V287 PolarHBondContact OD1-N 3.1Å; V287-N289 PolarHBondContact O-N 3.34Å
288	Y	86.7	Confident	79.6	Confident	3 Å²	3	64.5 Å²	64.5	1%	0.012	35%	0.353	C	S	.	.			trans	-47.6	127.3	171.2	176.4	-87.8	0	0	0	111.3	F273 S276 L281 E282 H328 L331	F273-Y288 HydrophobicContact CD2-CG 4.48Å; F273-Y288 HydrophobicContact CE2-CG 4.35Å; S276-Y288 PolarHBondContact OG-N 3.15Å; L281-Y288 HydrophobicContact CD2-CD1 4.05Å; L281-Y288 HydrophobicContact CD2-CG 4.49Å; E282-Y288 PolarHBondContact N-O 3.25Å; E282-Y288 VanDerWaalsContact N-O 3.13Å; Y288-H328 AromaticContact CE1-CD2 3.39Å; Y288-H328 WeakPolarHBondContact CE1-CD2 3.29Å; Y288-H328 AromaticContact CE1-NE2 3.76Å; Y288-H328 AromaticContact CE2-CD2 3.87Å; Y288-H328 AromaticContact CZ-CD2 3.25Å; Y288-H328 PolarHBondContact OH-CD2 3.48Å; Y288-H328 VanDerWaalsContact OH-CD2 3.26Å; Y288-L331 HydrophobicContact CD2-CB 4.34Å; Y288-L331 HydrophobicContact CD2-CD2 3.65Å; Y288-L331 HydrophobicContact CD2-CG 4.42Å; Y288-L331 HydrophobicContact CE2-CB 3.95Å; Y288-L331 HydrophobicContact CE2-CD2 3.53Å; Y288-L331 HydrophobicContact CE2-CG 4.32Å
289	N	83	Confident	78.2	Confident	36 Å²	36	66.3 Å²	66.3	19%	0.193	35%	0.351	C	S	.	.			trans	-131.6	124.1	173.5	-179.2	-20.9	0	0	0	109	E282 V287 E291 R292 L331	E282-N289 HydrophobicContact CG-CB 4.2Å; V287-N289 PolarHBondContact O-N 3.34Å; N289-E291 VanDerWaalsContact C-N 3.28Å; N289-E291 PolarHBondContact O-N 2.59Å; N289-E291 WeakPolarHBondContact OD1-CB 3.25Å; N289-E291 WeakPolarHBondContact OD1-CG 3.22Å; N289-E291 PolarHBondContact OD1-N 3.45Å; N289-R292 PolarHBondContact O-N 2.76Å; N289-L331 WeakPolarHBondContact O-CD2 3.35Å
290	S	78.1	Confident	76.7	Confident	38 Å²	38	64.6 Å²	64.6	27%	0.266	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-67.1	-26.5	-176.2	65.9	0	0	0	0	113.3	E282 R292 I293	E282-S290 VanDerWaalsContact OE1-CB 3.31Å; E282-S290 WeakPolarHBondContact OE1-CB 3.39Å; E282-S290 PolarHBondContact OE1-N 2.71Å; E282-S290 PolarHBondContact OE1-OG 3.1Å; S290-R292 PolarHBondContact O-N 3.4Å; S290-I293 PolarHBondContact O-N 3.33Å
291	E	74.2	Confident	75.2	Confident	151 Å²	151	67.2 Å²	67.2	71%	0.706	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-68.3	-14.7	-178.8	-60.6	-174.3	155.8	0	0	113.4	N289 I293	N289-E291 VanDerWaalsContact C-N 3.28Å; N289-E291 PolarHBondContact O-N 2.59Å; N289-E291 WeakPolarHBondContact OD1-CB 3.25Å; N289-E291 WeakPolarHBondContact OD1-CG 3.22Å; N289-E291 PolarHBondContact OD1-N 3.45Å; E291-I293 VanDerWaalsContact C-N 3.26Å; E291-I293 PolarHBondContact O-N 3.48Å
292	R	78.6	Confident	73.7	Confident	99 Å²	99	70.7 Å²	70.7	37%	0.374	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-67.2	-25.2	178.3	-73.3	-174.3	160.3	149	1.5	114	S285 N289 S290 L331	S285-R292 VanDerWaalsContact O-CZ 3.24Å; S285-R292 PolarHBondContact O-NH1 3.43Å; S285-R292 VanDerWaalsContact O-NH1 3.1Å; S285-R292 PolarHBondContact O-NH2 3.27Å; N289-R292 PolarHBondContact O-N 2.76Å; S290-R292 PolarHBondContact O-N 3.4Å; R292-L331 HydrophobicContact CB-CD1 4.03Å; R292-L331 HydrophobicContact CB-CD2 4.05Å
293	I	77.7	Confident	72.2	Confident	46 Å²	46	70.6 Å²	70.6	24%	0.236	40%	0.4	C	S	.	.	S	Bend	trans	-108.3	95.6	174	-60.4	178.4	0	0	0	107.2	S290 E291 Y322 K327 L331	S290-I293 PolarHBondContact O-N 3.33Å; E291-I293 VanDerWaalsContact C-N 3.26Å; E291-I293 PolarHBondContact O-N 3.48Å; I293-Y322 HydrophobicContact CG2-CD2 4.45Å; I293-K327 HydrophobicContact CB-CD 4.46Å; I293-K327 HydrophobicContact CD1-CB 4.38Å; I293-K327 HydrophobicContact CG2-CG 4.36Å; I293-K327 PolarHBondContact O-NZ 3.27Å; I293-L331 HydrophobicContact CD1-CB 3.97Å; I293-L331 HydrophobicContact CD1-CD1 4.4Å; I293-L331 HydrophobicContact CG1-CD1 4.31Å
294	L	70.8	Confident	70.7	Confident	151 Å²	151	73.7 Å²	73.7	79%	0.791	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-62.5	132.4	175.9	-69.9	160.3	0	0	0	110
295	D	72.2	Confident	69.1	Low	40 Å²	40	76.3 Å²	76.3	21%	0.214	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-71.6	148.4	169.2	-70.7	-44.4	0	0	0	110.4	T297 V319 Q321 Y322 K327	D295-T297 PolarHBondContact O-N 2.98Å; D295-V319 HydrophobicContact CB-CG1 3.54Å; D295-Q321 WeakPolarHBondContact OD1-CA 3.01Å; D295-Y322 PolarHBondContact OD1-N 3.46Å; D295-Y322 VanDerWaalsContact OD1-N 3.1Å; D295-K327 WeakPolarHBondContact OD1-CE 3.37Å; D295-K327 IonicContact OD1-NZ 3.53Å; D295-K327 PolarHBondContact OD1-NZ 2.92Å; D295-K327 IonicContact OD2-NZ 2.87Å; D295-K327 PolarHBondContact OD2-NZ 3.16Å
296	V	70.4	Confident	67.4	Low	58 Å²	58	83 Å²	83	35%	0.352	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	117	-178.9	-179	0	0	0	0	108.9	F298 I320 Y322	V296-F298 HydrophobicContact CG1-CE1 4.47Å; V296-F298 HydrophobicContact CG1-CE2 4.17Å; V296-F298 HydrophobicContact CG1-CZ 4.02Å; V296-I320 PolarHBondContact N-O 3.43Å; V296-I320 PolarHBondContact O-N 3.23Å; V296-Y322 HydrophobicContact CG2-CE2 4.21Å
297	T	65.2	Low	65.6	Low	80 Å²	80	90.7 Å²	90.7	49%	0.491	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.2	174.4	57.3	0	0	0	0	110.2	D295 V319	D295-T297 PolarHBondContact O-N 2.98Å; T297-V319 HydrophobicContact CG2-CG1 4.41Å; T297-V319 HydrophobicContact CG2-CG2 4.16Å
298	F	60.8	Low	63.8	Low	112 Å²	112	96.3 Å²	96.3	49%	0.491	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.6	172.7	-57.8	-91.2	0	0	0	110.7	V296 C317 G318 I320	V296-F298 HydrophobicContact CG1-CE1 4.47Å; V296-F298 HydrophobicContact CG1-CE2 4.17Å; V296-F298 HydrophobicContact CG1-CZ 4.02Å; F298-C317 PolarHBondContact O-N 3.16Å; F298-G318 PolarHBondContact N-O 3.11Å; F298-I320 HydrophobicContact CE2-CD1 3.49Å; F298-I320 VanDerWaalsContact CE2-CD1 3.49Å; F298-I320 HydrophobicContact CE2-CG1 3.85Å; F298-I320 HydrophobicContact CZ-CD1 3.71Å
299	D	58.3	Low	61.8	Low	123 Å²	123	102.5 Å²	102.5	66%	0.658	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.2	119.5	169.9	-78.4	-17.9	0	0	0	109.6	A301	D299-A301 PolarHBondContact O-N 2.97Å
300	C	56.9	Low	60.3	Low	53 Å²	53	109.7 Å²	109.7	36%	0.358	61%	0.606	S	S	.	*			trans	-74.4	22	178.9	-111.5	0	0	0	0	113.8	N302 C305 C317	C300-N302 PolarHBondContact O-N 3.28Å; C300-N302 VanDerWaalsContact O-N 3.13Å; C300-C305 PolarHBondContact SG-SG 2.91Å; C300-C317 HydrophobicContact CB-CB 3.57Å; C300-C317 WeakPolarHBondContact CB-SG 3.47Å; C300-C317 WeakPolarHBondContact SG-CB 3.5Å; C300-C317 CovalentContact SG-SG 2.01Å; C300-C317 PolarHBondContact SG-SG 3.36Å
301	A	52.8	Low	58.9	Low	84 Å²	84	114 Å²	114	69%	0.694	63%	0.63	S	S	*	*			trans	-75	-1.8	-164.4	0	0	0	0	0	115.3	D299	D299-A301 PolarHBondContact O-N 2.97Å
302	N	51	Low	57.3	Low	152 Å²	152	114.5 Å²	114.5	81%	0.813	64%	0.643	S	S	*	*	S	Bend	trans	-147.4	103.6	172.2	-90.2	-32.8	0	0	0	111.1	C300	C300-N302 PolarHBondContact O-N 3.28Å; C300-N302 VanDerWaalsContact O-N 3.13Å
303	S	48.8	Very low	55.7	Low	96 Å²	96	112 Å²	112	67%	0.671	65%	0.649	S	S	*	*	S	Bend	trans	99.3	114.6	159.4	-34.7	0	0	0	0	117.9
304	T	50.6	Low	54	Low	138 Å²	138	116.3 Å²	116.3	85%	0.847	68%	0.677	S	S	*	*			trans	80.1	6.1	144.9	60.7	0	0	0	0	122.3	Q306	T304-Q306 PolarHBondContact O-N 3.42Å
305	C	53.2	Low	52.7	Low	87 Å²	87	112.3 Å²	112.3	59%	0.588	67%	0.672	S	S	*	*			trans	-80.3	90.2	172.8	-63.6	0	0	0	0	111.8	C300 Q307	C300-C305 PolarHBondContact SG-SG 2.91Å; C305-Q307 PolarHBondContact O-N 2.94Å
306	Q	49.5	Very low	51.6	Low	197 Å²	197	114.5 Å²	114.5	92%	0.921	69%	0.687	S	S	*	*			trans	-71.8	95.3	165.3	-80.9	169.9	-37.1	0	0	109.4	T304	T304-Q306 PolarHBondContact O-N 3.42Å
307	Q	49.9	Very low	50.8	Low	161 Å²	161	113.7 Å²	113.7	75%	0.752	68%	0.684	S	S	*	*			trans	-121.6	140.4	163.1	-76.4	-176.8	-27.8	0	0	109.6	C305	C305-Q307 PolarHBondContact O-N 2.94Å
308	P	51.4	Low	50.4	Low	118 Å²	118	112.3 Å²	112.3	77%	0.766	69%	0.685	S	S	*	*			trans	-67.2	148.1	-171.9	25.6	-31.8	0	0	0	112.5	E310	P308-E310 PolarHBondContact O-N 3.04Å; P308-E310 VanDerWaalsContact O-N 3.16Å
309	P	45.1	Very low	50.6	Low	132 Å²	132	110.4 Å²	110.4	86%	0.857	68%	0.683	S	S	*	*	S	Bend	trans	-86.3	92	-165.3	34.2	-32.1	0	0	0	111.4
310	E	50.1	Low	51.1	Low	187 Å²	187	109 Å²	109	87%	0.874	67%	0.674	S	S	*	*			trans	-133	10.8	167.3	-144.5	169.6	-161.1	0	0	114	P308	P308-E310 PolarHBondContact O-N 3.04Å; P308-E310 VanDerWaalsContact O-N 3.16Å
311	V	50.5	Low	51.8	Low	128 Å²	128	113.6 Å²	113.6	78%	0.776	69%	0.69	S	S	*	*			trans	-134.5	86.8	175	-169.6	0	0	0	0	110	G313	V311-G313 PolarHBondContact O-N 3.37Å
312	V	40.1	Very low	53	Low	163 Å²	163	114.3 Å²	114.3	99%	0.988	68%	0.676	S	S	*	*			trans	-78.3	97.2	163	177.2	0	0	0	0	107
313	G	43.7	Very low	54.4	Low	47 Å²	47	111.2 Å²	111.2	49%	0.485	66%	0.664	S	S	.	*	S	Bend	trans	160.8	102.8	172.3	0	0	0	0	0	113.2	V311	V311-G313 PolarHBondContact O-N 3.37Å
314	T	44	Very low	56	Low	135 Å²	135	111.1 Å²	111.1	83%	0.828	66%	0.655	S	S	*	*			trans	61.8	70.6	164.7	66.9	0	0	0	0	118.6	T316	T314-T316 PolarHBondContact O-N 2.99Å
315	G	41.8	Very low	57.7	Low	67 Å²	67	106.3 Å²	106.3	69%	0.691	62%	0.624	S	S	*	*				63.8	-4.7	111	0	0	0	0	0	124.5
316	T	50.1	Low	59.3	Low	86 Å²	86	105.9 Å²	105.9	53%	0.528	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.4	117.9	-177	59	0	0	0	0	113.5	T314	T314-T316 PolarHBondContact O-N 2.99Å
317	C	52.7	Low	61	Low	42 Å²	42	97.5 Å²	97.5	28%	0.284	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.2	98.5	174.1	-87	0	0	0	0	110.4	F298 C300	F298-C317 PolarHBondContact O-N 3.16Å; C300-C317 HydrophobicContact CB-CB 3.57Å; C300-C317 WeakPolarHBondContact CB-SG 3.47Å; C300-C317 WeakPolarHBondContact SG-CB 3.5Å; C300-C317 CovalentContact SG-SG 2.01Å; C300-C317 PolarHBondContact SG-SG 3.36Å
318	G	57.7	Low	62.9	Low	50 Å²	50	90.3 Å²	90.3	52%	0.515	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	76.2	129.4	169.2	0	0	0	0	0	115.3	F298	F298-G318 PolarHBondContact N-O 3.11Å
319	V	65.2	Low	64.8	Low	73 Å²	73	86.9 Å²	86.9	44%	0.442	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.3	175.2	-175.2	0	0	0	0	108.1	D295 T297 Q321	D295-V319 HydrophobicContact CB-CG1 3.54Å; T297-V319 HydrophobicContact CG2-CG1 4.41Å; T297-V319 HydrophobicContact CG2-CG2 4.16Å; V319-Q321 HydrophobicContact CG1-CG 3.94Å; V319-Q321 PolarHBondContact O-N 2.94Å
320	I	68.9	Low	67	Low	92 Å²	92	84.5 Å²	84.5	47%	0.472	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	101.6	167.9	-65.1	171.5	0	0	0	107.2	V296 F298	V296-I320 PolarHBondContact N-O 3.43Å; V296-I320 PolarHBondContact O-N 3.23Å; F298-I320 HydrophobicContact CE2-CD1 3.49Å; F298-I320 VanDerWaalsContact CE2-CD1 3.49Å; F298-I320 HydrophobicContact CE2-CG1 3.85Å; F298-I320 HydrophobicContact CZ-CD1 3.71Å
321	Q	70.8	Confident	68.9	Low	150 Å²	150	76.6 Å²	76.6	70%	0.701	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-81.5	121.1	176.3	-67	-178	-32.2	0	0	110.4	D295 V319	D295-Q321 WeakPolarHBondContact OD1-CA 3.01Å; V319-Q321 HydrophobicContact CG1-CG 3.94Å; V319-Q321 PolarHBondContact O-N 2.94Å
322	Y	77.5	Confident	70.9	Confident	100 Å²	100	70.5 Å²	70.5	39%	0.392	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-67.7	145.3	171.8	-67.7	-72.7	0	0	0	110.6	I293 D295 V296 I324	I293-Y322 HydrophobicContact CG2-CD2 4.45Å; D295-Y322 PolarHBondContact OD1-N 3.46Å; D295-Y322 VanDerWaalsContact OD1-N 3.1Å; V296-Y322 HydrophobicContact CG2-CE2 4.21Å; Y322-I324 PolarHBondContact O-N 3.41Å
323	P	81.8	Confident	73.4	Confident	86 Å²	86	65 Å²	65	56%	0.558	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-54.5	133.5	175.7	-23.3	32.2	0	0	0	111.1	L325 L326 K327	P323-L325 VanDerWaalsContact C-N 3.3Å; P323-L325 PolarHBondContact O-N 2.89Å; P323-L326 HydrophobicContact CB-CB 4.22Å; P323-L326 WeakPolarHBondContact O-CA 3.25Å; P323-L326 WeakPolarHBondContact O-CB 3.24Å; P323-L326 PolarHBondContact O-N 3.5Å; P323-K327 PolarHBondContact O-N 2.88Å; P323-K327 VanDerWaalsContact O-N 3.13Å
324	I	82	Confident	75.7	Confident	94 Å²	94	69.6 Å²	69.6	48%	0.482	39%	0.389	S	S	.	.	H	α-helix	trans	-59	-41.5	-172.6	-157.2	170.3	0	0	0	112.2	Y322 L326 K327 H328	Y322-I324 PolarHBondContact O-N 3.41Å; I324-L326 VanDerWaalsContact C-N 3.28Å; I324-L326 PolarHBondContact O-N 2.85Å; I324-K327 WeakPolarHBondContact O-CB 3.23Å; I324-K327 PolarHBondContact O-N 3.32Å; I324-K327 VanDerWaalsContact O-N 3.07Å; I324-H328 VanDerWaalsContact O-CG 3.26Å; I324-H328 PolarHBondContact O-N 3.45Å; I324-H328 PolarHBondContact O-ND1 3.22Å
325	L	86	Confident	78	Confident	38 Å²	38	63.5 Å²	63.5	20%	0.199	35%	0.351	C	S	.	.	H	α-helix	trans	-57.9	-38.3	174.6	-179.5	65.9	0	0	0	112.9	F160 L163 P323 H328 Y329	F160-L325 HydrophobicContact CB-CD1 3.62Å; F160-L325 HydrophobicContact CD1-CD1 4.12Å; F160-L325 HydrophobicContact CG-CD1 3.97Å; L163-L325 HydrophobicContact CD1-CD2 3.91Å; P323-L325 VanDerWaalsContact C-N 3.3Å; P323-L325 PolarHBondContact O-N 2.89Å; L325-H328 PolarHBondContact O-N 2.92Å; L325-Y329 WeakPolarHBondContact O-CB 3.4Å; L325-Y329 PolarHBondContact O-N 2.8Å
326	L	86.3	Confident	80.5	Confident	77 Å²	77	60.3 Å²	60.3	40%	0.403	32%	0.318	S	S	.	.	H	α-helix	trans	-67.7	-42	177.4	-176.3	66	0	0	0	110.3	P323 I324 Y329 L330	P323-L326 HydrophobicContact CB-CB 4.22Å; P323-L326 WeakPolarHBondContact O-CA 3.25Å; P323-L326 WeakPolarHBondContact O-CB 3.24Å; P323-L326 PolarHBondContact O-N 3.5Å; I324-L326 VanDerWaalsContact C-N 3.28Å; I324-L326 PolarHBondContact O-N 2.85Å; L326-Y329 PolarHBondContact O-N 2.84Å; L326-L330 HydrophobicContact CD1-CD1 3.77Å; L326-L330 HydrophobicContact CD1-CG 3.9Å; L326-L330 HydrophobicContact CD2-CD1 4.37Å; L326-L330 HydrophobicContact CG-CD1 3.75Å; L326-L330 HydrophobicContact CG-CG 4.21Å; L326-L330 VanDerWaalsContact O-CB 3.31Å; L326-L330 WeakPolarHBondContact O-CB 3.1Å; L326-L330 VanDerWaalsContact O-CG 3.28Å; L326-L330 WeakPolarHBondContact O-CG 3.04Å; L326-L330 PolarHBondContact O-N 3.18Å
327	K	86.4	Confident	82.5	Confident	22 Å²	22	57.3 Å²	57.3	10%	0.096	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-45.8	174.1	-63.6	-170.8	-179.1	-170.1	0	111.3	I293 D295 P323 I324 Y329 L331	I293-K327 HydrophobicContact CB-CD 4.46Å; I293-K327 HydrophobicContact CD1-CB 4.38Å; I293-K327 HydrophobicContact CG2-CG 4.36Å; I293-K327 PolarHBondContact O-NZ 3.27Å; D295-K327 WeakPolarHBondContact OD1-CE 3.37Å; D295-K327 IonicContact OD1-NZ 3.53Å; D295-K327 PolarHBondContact OD1-NZ 2.92Å; D295-K327 IonicContact OD2-NZ 2.87Å; D295-K327 PolarHBondContact OD2-NZ 3.16Å; P323-K327 PolarHBondContact O-N 2.88Å; P323-K327 VanDerWaalsContact O-N 3.13Å; I324-K327 WeakPolarHBondContact O-CB 3.23Å; I324-K327 PolarHBondContact O-N 3.32Å; I324-K327 VanDerWaalsContact O-N 3.07Å; K327-Y329 PolarHBondContact O-N 3.42Å; K327-L331 WeakPolarHBondContact O-CB 3.33Å; K327-L331 PolarHBondContact O-N 2.82Å; K327-L331 VanDerWaalsContact O-N 3.14Å
328	H	89	Confident	84.3	Confident	9 Å²	9	56.1 Å²	56.1	4%	0.042	29%	0.292	C	S	.	.	H	α-helix	trans	-52.8	-55.3	175.7	-68.5	150.7	0	0	0	110.7	F160 E162 F273 Y288 I324 L325 C332	F160-H328 HydrophobicContact CD1-CB 3.98Å; F160-H328 HydrophobicContact CE1-CB 3.76Å; E162-H328 IonicContact OE1-CE1 2.85Å; E162-H328 PolarHBondContact OE1-CE1 3.29Å; E162-H328 IonicContact OE1-ND1 2.75Å; E162-H328 IonicContact OE2-CE1 3.26Å; E162-H328 IonicContact OE2-ND1 3.39Å; E162-H328 PolarHBondContact OE2-ND1 2.94Å; F273-H328 HydrophobicContact CD2-CB 4.48Å; F273-H328 HydrophobicContact CE2-CB 3.93Å; F273-H328 AromaticContact CE2-CD2 3.58Å; F273-H328 AromaticContact CE2-CG 3.82Å; F273-H328 HydrophobicContact CZ-CB 4.26Å; F273-H328 AromaticContact CZ-CD2 3.95Å; F273-H328 AromaticContact CZ-CG 3.96Å; Y288-H328 AromaticContact CE1-CD2 3.39Å; Y288-H328 WeakPolarHBondContact CE1-CD2 3.29Å; Y288-H328 AromaticContact CE1-NE2 3.76Å; Y288-H328 AromaticContact CE2-CD2 3.87Å; Y288-H328 AromaticContact CZ-CD2 3.25Å; Y288-H328 PolarHBondContact OH-CD2 3.48Å; Y288-H328 VanDerWaalsContact OH-CD2 3.26Å; I324-H328 VanDerWaalsContact O-CG 3.26Å; I324-H328 PolarHBondContact O-N 3.45Å; I324-H328 PolarHBondContact O-ND1 3.22Å; L325-H328 PolarHBondContact O-N 2.92Å; H328-C332 WeakPolarHBondContact O-CB 3.38Å; H328-C332 PolarHBondContact O-N 2.64Å; H328-C332 PolarHBondContact O-SG 3.44Å
329	Y	91.9	Very high	86	Confident	47 Å²	47	53.8 Å²	53.8	18%	0.184	27%	0.268	C	S	.	.	H	α-helix	trans	-68.3	-47.8	-176.1	-174.7	-100.3	0	0	0	113.2	F160 H266 T269 L325 L326 K327 C332 L333	F160-Y329 AromaticContact CE2-CD2 3.71Å; F160-Y329 HydrophobicContact CE2-CD2 3.71Å; F160-Y329 HydrophobicContact CE2-CE2 4.43Å; F160-Y329 AromaticContact CZ-CD2 3.93Å; F160-Y329 HydrophobicContact CZ-CD2 3.93Å; H266-Y329 AromaticContact CE1-CE2 3.88Å; H266-Y329 AromaticContact ND1-CE2 3.58Å; H266-Y329 AromaticContact ND1-CZ 3.73Å; H266-Y329 PolarHBondContact ND1-OH 3.27Å; T269-Y329 HydrophobicContact CG2-CD2 3.83Å; T269-Y329 HydrophobicContact CG2-CE2 3.77Å; L325-Y329 WeakPolarHBondContact O-CB 3.4Å; L325-Y329 PolarHBondContact O-N 2.8Å; L326-Y329 PolarHBondContact O-N 2.84Å; K327-Y329 PolarHBondContact O-N 3.42Å; Y329-C332 PolarHBondContact O-N 2.77Å; Y329-L333 HydrophobicContact CE1-CB 4.5Å; Y329-L333 HydrophobicContact CE1-CD2 3.87Å; Y329-L333 VanDerWaalsContact O-CB 3.25Å; Y329-L333 WeakPolarHBondContact O-CB 3.27Å; Y329-L333 PolarHBondContact O-N 3.08Å
330	L	91.3	Very high	87.2	Confident	82 Å²	82	50.7 Å²	50.7	43%	0.429	25%	0.249	S	C	.	.	H	α-helix	trans	-65.6	-41.7	-175.1	-71.6	-179.7	0	0	0	112.6	L326 L333 Y334	L326-L330 HydrophobicContact CD1-CD1 3.77Å; L326-L330 HydrophobicContact CD1-CG 3.9Å; L326-L330 HydrophobicContact CD2-CD1 4.37Å; L326-L330 HydrophobicContact CG-CD1 3.75Å; L326-L330 HydrophobicContact CG-CG 4.21Å; L326-L330 VanDerWaalsContact O-CB 3.31Å; L326-L330 WeakPolarHBondContact O-CB 3.1Å; L326-L330 VanDerWaalsContact O-CG 3.28Å; L326-L330 WeakPolarHBondContact O-CG 3.04Å; L326-L330 PolarHBondContact O-N 3.18Å; L330-L333 PolarHBondContact O-N 3.35Å; L330-Y334 WeakPolarHBondContact O-CB 3.27Å; L330-Y334 PolarHBondContact O-N 2.94Å
331	L	90.1	Very high	88.2	Confident	21 Å²	21	50 Å²	50	11%	0.11	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-42.5	178.6	-170.5	66.4	0	0	0	111.2	Y288 N289 R292 I293 K327 L333 Y334 W335	Y288-L331 HydrophobicContact CD2-CB 4.34Å; Y288-L331 HydrophobicContact CD2-CD2 3.65Å; Y288-L331 HydrophobicContact CD2-CG 4.42Å; Y288-L331 HydrophobicContact CE2-CB 3.95Å; Y288-L331 HydrophobicContact CE2-CD2 3.53Å; Y288-L331 HydrophobicContact CE2-CG 4.32Å; N289-L331 WeakPolarHBondContact O-CD2 3.35Å; R292-L331 HydrophobicContact CB-CD1 4.03Å; R292-L331 HydrophobicContact CB-CD2 4.05Å; I293-L331 HydrophobicContact CD1-CB 3.97Å; I293-L331 HydrophobicContact CD1-CD1 4.4Å; I293-L331 HydrophobicContact CG1-CD1 4.31Å; K327-L331 WeakPolarHBondContact O-CB 3.33Å; K327-L331 PolarHBondContact O-N 2.82Å; K327-L331 VanDerWaalsContact O-N 3.14Å; L331-L333 VanDerWaalsContact C-N 3.32Å; L331-L333 PolarHBondContact O-N 2.85Å; L331-Y334 PolarHBondContact O-N 3.22Å; L331-W335 PolarHBondContact O-N 3.49Å
332	C	92.4	Very high	89	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.7	-36	177.2	-65.6	0	0	0	0	111.8	T269 Y272 H328 Y329 W335 A336	T269-C332 HydrophobicContact CG2-CB 3.6Å; Y272-C332 HydrophobicContact CD1-CB 3.76Å; Y272-C332 VanDerWaalsContact CD1-SG 3.56Å; Y272-C332 HydrophobicContact CE1-CB 4.33Å; H328-C332 WeakPolarHBondContact O-CB 3.38Å; H328-C332 PolarHBondContact O-N 2.64Å; H328-C332 PolarHBondContact O-SG 3.44Å; Y329-C332 PolarHBondContact O-N 2.77Å; C332-W335 PolarHBondContact O-N 3.44Å; C332-A336 WeakPolarHBondContact O-CB 3.39Å; C332-A336 PolarHBondContact O-N 3.13Å
333	L	93.1	Very high	89.6	Confident	47 Å²	47	44.3 Å²	44.3	25%	0.246	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-40	176.5	-180	64.8	0	0	0	111.3	F265 T269 Y329 L330 L331 A336 A337	F265-L333 HydrophobicContact CB-CD1 4.07Å; T269-L333 HydrophobicContact CG2-CB 4Å; T269-L333 VanDerWaalsContact OG1-CA 3.26Å; T269-L333 WeakPolarHBondContact OG1-CA 3.49Å; T269-L333 VanDerWaalsContact OG1-CD1 3.23Å; T269-L333 WeakPolarHBondContact OG1-CD1 3.45Å; Y329-L333 HydrophobicContact CE1-CB 4.5Å; Y329-L333 HydrophobicContact CE1-CD2 3.87Å; Y329-L333 VanDerWaalsContact O-CB 3.25Å; Y329-L333 WeakPolarHBondContact O-CB 3.27Å; Y329-L333 PolarHBondContact O-N 3.08Å; L330-L333 PolarHBondContact O-N 3.35Å; L331-L333 VanDerWaalsContact C-N 3.32Å; L331-L333 PolarHBondContact O-N 2.85Å; L333-A336 PolarHBondContact O-N 3.39Å; L333-A337 VanDerWaalsContact O-CB 3.25Å; L333-A337 WeakPolarHBondContact O-CB 3.2Å; L333-A337 PolarHBondContact O-N 2.68Å
334	Y	91.6	Very high	89.5	Confident	144 Å²	144	41.9 Å²	41.9	57%	0.565	22%	0.224	S	C	*	.	H	α-helix	trans	-60.5	-47.3	173	178.4	-108.2	0	0	0	111.3	L330 L331 A337 L338	L330-Y334 WeakPolarHBondContact O-CB 3.27Å; L330-Y334 PolarHBondContact O-N 2.94Å; L331-Y334 PolarHBondContact O-N 3.22Å; Y334-A337 PolarHBondContact O-N 2.83Å; Y334-L338 HydrophobicContact CD1-CD1 4.01Å; Y334-L338 HydrophobicContact CE1-CD1 3.45Å; Y334-L338 VanDerWaalsContact CE1-CD1 3.45Å; Y334-L338 HydrophobicContact CE1-CG 4.31Å; Y334-L338 HydrophobicContact CE2-CD1 4.19Å; Y334-L338 HydrophobicContact CE2-CD2 4.39Å; Y334-L338 HydrophobicContact CE2-CG 4.24Å; Y334-L338 WeakPolarHBondContact O-CG 3.32Å; Y334-L338 PolarHBondContact O-N 2.88Å
335	W	92.4	Very high	89.8	Confident	7 Å²	7	44.5 Å²	44.5	3%	0.027	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-50	174.9	-174.5	98	0	0	0	111.8	Y272 W286 L331 C332 A337 L338 V339 F357 T358	Y272-W335 HydrophobicContact CD1-CB 4.25Å; Y272-W335 HydrophobicContact CD1-CD2 4.21Å; Y272-W335 HydrophobicContact CD1-CE3 4.17Å; Y272-W335 HydrophobicContact CD1-CG 4.24Å; Y272-W335 AromaticContact CD2-CD2 3.43Å; Y272-W335 HydrophobicContact CD2-CD2 3.43Å; Y272-W335 VanDerWaalsContact CD2-CD2 3.43Å; Y272-W335 AromaticContact CD2-CE2 3.6Å; Y272-W335 AromaticContact CD2-CE3 3.39Å; Y272-W335 HydrophobicContact CD2-CE3 3.39Å; Y272-W335 HydrophobicContact CD2-CG 4.12Å; Y272-W335 AromaticContact CD2-CH2 3.8Å; Y272-W335 HydrophobicContact CD2-CH2 3.8Å; Y272-W335 AromaticContact CD2-CZ2 3.8Å; Y272-W335 HydrophobicContact CD2-CZ2 3.8Å; Y272-W335 AromaticContact CD2-CZ3 3.59Å; Y272-W335 HydrophobicContact CD2-CZ3 3.59Å; Y272-W335 HydrophobicContact CE1-CB 3.97Å; Y272-W335 HydrophobicContact CE1-CD2 4.23Å; Y272-W335 AromaticContact CE1-CG 3.91Å; Y272-W335 HydrophobicContact CE1-CG 3.91Å; Y272-W335 AromaticContact CE2-CD1 3.77Å; Y272-W335 AromaticContact CE2-CD2 3.44Å; Y272-W335 HydrophobicContact CE2-CD2 3.44Å; Y272-W335 VanDerWaalsContact CE2-CD2 3.44Å; Y272-W335 AromaticContact CE2-CE2 3.35Å; Y272-W335 AromaticContact CE2-CE3 3.94Å; Y272-W335 HydrophobicContact CE2-CE3 3.94Å; Y272-W335 AromaticContact CE2-CG 3.76Å; Y272-W335 HydrophobicContact CE2-CG 3.76Å; Y272-W335 HydrophobicContact CE2-CH2 4.32Å; Y272-W335 AromaticContact CE2-CZ2 3.84Å; Y272-W335 HydrophobicContact CE2-CZ2 3.84Å; Y272-W335 HydrophobicContact CE2-CZ3 4.36Å; Y272-W335 AromaticContact CE2-NE1 3.51Å; Y272-W335 AromaticContact CG-CD2 3.81Å; Y272-W335 HydrophobicContact CG-CD2 3.81Å; Y272-W335 AromaticContact CG-CE3 3.5Å; Y272-W335 HydrophobicContact CG-CE3 3.5Å; Y272-W335 VanDerWaalsContact CG-CE3 3.5Å; Y272-W335 HydrophobicContact CG-CG 4.32Å; Y272-W335 AromaticContact CG-CZ3 3.94Å; Y272-W335 HydrophobicContact CG-CZ3 3.94Å; Y272-W335 AromaticContact CZ-CD1 3.62Å; Y272-W335 AromaticContact CZ-CD2 3.84Å; Y272-W335 AromaticContact CZ-CG 3.62Å; Y272-W335 AromaticContact CZ-NE1 3.85Å; W286-W335 AromaticContact CE2-CZ2 3.96Å; W286-W335 HydrophobicContact CZ2-CH2 4.18Å; W286-W335 AromaticContact CZ2-CZ2 3.62Å; W286-W335 HydrophobicContact CZ2-CZ2 3.62Å; W286-W335 AromaticContact NE1-CZ2 3.8Å; W286-W335 AromaticContact NE1-NE1 3.85Å; L331-W335 PolarHBondContact O-N 3.49Å; C332-W335 PolarHBondContact O-N 3.44Å; W335-A337 VanDerWaalsContact C-N 3.31Å; W335-A337 PolarHBondContact O-N 2.87Å; W335-L338 PolarHBondContact O-N 2.86Å; W335-V339 HydrophobicContact CD2-CG2 4.04Å; W335-V339 HydrophobicContact CE3-CG2 4.15Å; W335-V339 HydrophobicContact CH2-CB 4.49Å; W335-V339 HydrophobicContact CH2-CG1 4.49Å; W335-V339 HydrophobicContact CH2-CG2 3.87Å; W335-V339 HydrophobicContact CZ2-CG2 3.77Å; W335-V339 HydrophobicContact CZ3-CB 4.42Å; W335-V339 HydrophobicContact CZ3-CG2 4.07Å; W335-V339 WeakPolarHBondContact O-CG2 3.29Å; W335-V339 PolarHBondContact O-N 2.82Å; W335-V339 VanDerWaalsContact O-N 3.08Å; W335-F357 AromaticContact CH2-CD1 3.92Å; W335-F357 HydrophobicContact CH2-CD1 3.92Å; W335-F357 AromaticContact CH2-CE1 3.54Å; W335-F357 HydrophobicContact CH2-CE1 3.54Å; W335-F357 HydrophobicContact CZ2-CE1 4.46Å; W335-F357 AromaticContact CZ3-CE1 3.9Å; W335-F357 HydrophobicContact CZ3-CE1 3.9Å; W335-T358 HydrophobicContact CZ2-CG2 4.36Å
336	A	92.6	Very high	89.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-39.9	179.8	0	0	0	0	0	112	A268 C332 L333 L340	A268-A336 HydrophobicContact CB-CB 3.9Å; C332-A336 WeakPolarHBondContact O-CB 3.39Å; C332-A336 PolarHBondContact O-N 3.13Å; L333-A336 PolarHBondContact O-N 3.39Å; A336-L340 VanDerWaalsContact O-CB 3.24Å; A336-L340 WeakPolarHBondContact O-CB 3.37Å; A336-L340 VanDerWaalsContact O-CG 3.28Å; A336-L340 WeakPolarHBondContact O-CG 3.17Å; A336-L340 PolarHBondContact O-N 3Å
337	A	92.1	Very high	89.8	Confident	22 Å²	22	42.3 Å²	42.3	18%	0.182	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-45.4	176.5	0	0	0	0	0	111.8	F265 L333 Y334 W335 V339 I341	F265-A337 HydrophobicContact CD2-CB 4.42Å; F265-A337 HydrophobicContact CE2-CB 4.21Å; L333-A337 VanDerWaalsContact O-CB 3.25Å; L333-A337 WeakPolarHBondContact O-CB 3.2Å; L333-A337 PolarHBondContact O-N 2.68Å; Y334-A337 PolarHBondContact O-N 2.83Å; W335-A337 VanDerWaalsContact C-N 3.31Å; W335-A337 PolarHBondContact O-N 2.87Å; A337-V339 VanDerWaalsContact C-N 3.35Å; A337-V339 PolarHBondContact O-N 3.43Å; A337-I341 HydrophobicContact CB-CD1 4.29Å; A337-I341 WeakPolarHBondContact O-CB 3.21Å; A337-I341 WeakPolarHBondContact O-CG1 3.33Å; A337-I341 PolarHBondContact O-N 3.28Å
338	L	91.9	Very high	89.9	Confident	18 Å²	18	46 Å²	46	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-43.2	178	-73.1	177.1	0	0	0	112.4	Y334 W335 S342 V343 E345	Y334-L338 HydrophobicContact CD1-CD1 4.01Å; Y334-L338 HydrophobicContact CE1-CD1 3.45Å; Y334-L338 VanDerWaalsContact CE1-CD1 3.45Å; Y334-L338 HydrophobicContact CE1-CG 4.31Å; Y334-L338 HydrophobicContact CE2-CD1 4.19Å; Y334-L338 HydrophobicContact CE2-CD2 4.39Å; Y334-L338 HydrophobicContact CE2-CG 4.24Å; Y334-L338 WeakPolarHBondContact O-CG 3.32Å; Y334-L338 PolarHBondContact O-N 2.88Å; W335-L338 PolarHBondContact O-N 2.86Å; L338-S342 PolarHBondContact O-N 3.1Å; L338-V343 HydrophobicContact CD2-CB 3.85Å; L338-V343 HydrophobicContact CD2-CG1 3.89Å; L338-V343 HydrophobicContact CD2-CG2 4.32Å; L338-V343 PolarHBondContact O-N 3.43Å; L338-E345 HydrophobicContact CD1-CB 4.31Å; L338-E345 HydrophobicContact CD2-CB 4.38Å
339	V	92	Very high	90	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-70.8	-47.1	-179.7	175.2	0	0	0	0	111.1	W335 A337 S342 Q346 N361 F362	W335-V339 HydrophobicContact CD2-CG2 4.04Å; W335-V339 HydrophobicContact CE3-CG2 4.15Å; W335-V339 HydrophobicContact CH2-CB 4.49Å; W335-V339 HydrophobicContact CH2-CG1 4.49Å; W335-V339 HydrophobicContact CH2-CG2 3.87Å; W335-V339 HydrophobicContact CZ2-CG2 3.77Å; W335-V339 HydrophobicContact CZ3-CB 4.42Å; W335-V339 HydrophobicContact CZ3-CG2 4.07Å; W335-V339 WeakPolarHBondContact O-CG2 3.29Å; W335-V339 PolarHBondContact O-N 2.82Å; W335-V339 VanDerWaalsContact O-N 3.08Å; A337-V339 VanDerWaalsContact C-N 3.35Å; A337-V339 PolarHBondContact O-N 3.43Å; V339-S342 PolarHBondContact O-N 3.37Å; V339-Q346 HydrophobicContact CG2-CB 4.38Å; V339-Q346 HydrophobicContact CG2-CG 3.94Å; V339-N361 HydrophobicContact CG1-CB 3.62Å; V339-F362 HydrophobicContact CG1-CB 4.21Å
340	L	90.9	Very high	90	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	27%	0.265	C	S	.	.	H	α-helix	trans	-74.1	-30.3	-176.9	-69.6	174.2	0	0	0	113.4	I264 F265 A268 A336 S342 G365 L369	I264-L340 HydrophobicContact CG2-CD1 3.98Å; F265-L340 HydrophobicContact CD1-CB 4.24Å; F265-L340 HydrophobicContact CD1-CD1 3.45Å; F265-L340 VanDerWaalsContact CD1-CD1 3.45Å; F265-L340 HydrophobicContact CE1-CB 3.73Å; F265-L340 HydrophobicContact CE1-CD1 3.82Å; F265-L340 HydrophobicContact CE1-CG 4.47Å; F265-L340 HydrophobicContact CG-CD1 4.41Å; F265-L340 HydrophobicContact CZ-CB 4.5Å; A268-L340 HydrophobicContact CB-CD1 3.65Å; A268-L340 HydrophobicContact CB-CG 4.49Å; A336-L340 VanDerWaalsContact O-CB 3.24Å; A336-L340 WeakPolarHBondContact O-CB 3.37Å; A336-L340 VanDerWaalsContact O-CG 3.28Å; A336-L340 WeakPolarHBondContact O-CG 3.17Å; A336-L340 PolarHBondContact O-N 3Å; L340-S342 PolarHBondContact O-N 2.91Å; L340-G365 CarbonylContact O-C 3.59Å; L340-G365 WeakPolarHBondContact O-CA 3.44Å; L340-L369 WeakPolarHBondContact O-CD1 3.42Å
341	I	90.5	Very high	89.9	Confident	79 Å²	79	49.5 Å²	49.5	41%	0.405	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-6	173.7	-60.6	171.4	0	0	0	111.1	F265 A337 V343	F265-I341 HydrophobicContact CE2-CD1 3.98Å; F265-I341 HydrophobicContact CE2-CG1 4.29Å; F265-I341 HydrophobicContact CZ-CD1 3.84Å; F265-I341 HydrophobicContact CZ-CG1 3.64Å; A337-I341 HydrophobicContact CB-CD1 4.29Å; A337-I341 WeakPolarHBondContact O-CB 3.21Å; A337-I341 WeakPolarHBondContact O-CG1 3.33Å; A337-I341 PolarHBondContact O-N 3.28Å; I341-V343 VanDerWaalsContact C-N 3.32Å; I341-V343 HydrophobicContact CB-CG2 4.08Å; I341-V343 HydrophobicContact CG2-CG2 3.77Å; I341-V343 PolarHBondContact O-N 2.75Å
342	S	88.3	Confident	90	Very high	50 Å²	50	55.3 Å²	55.3	35%	0.35	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	36.5	-177.3	62.5	0	0	0	0	114	L338 V339 L340	L338-S342 PolarHBondContact O-N 3.1Å; V339-S342 PolarHBondContact O-N 3.37Å; L340-S342 PolarHBondContact O-N 2.91Å
343	V	88.2	Confident	89.9	Confident	80 Å²	80	56.8 Å²	56.8	49%	0.485	31%	0.312	S	S	.	.			trans	-77.8	-43.3	175.9	-177.6	0	0	0	0	110.7	L338 I341 E345	L338-V343 HydrophobicContact CD2-CB 3.85Å; L338-V343 HydrophobicContact CD2-CG1 3.89Å; L338-V343 HydrophobicContact CD2-CG2 4.32Å; L338-V343 PolarHBondContact O-N 3.43Å; I341-V343 VanDerWaalsContact C-N 3.32Å; I341-V343 HydrophobicContact CB-CG2 4.08Å; I341-V343 HydrophobicContact CG2-CG2 3.77Å; I341-V343 PolarHBondContact O-N 2.75Å; V343-E345 HydrophobicContact CG1-CB 4.5Å; V343-E345 HydrophobicContact CG1-CG 3.94Å
344	G	81.5	Confident	89.9	Confident	35 Å²	35	54.6 Å²	54.6	36%	0.361	30%	0.3	S	S	.	.			trans	88.9	1.6	171.6	0	0	0	0	0	116.8	Q346	G344-Q346 PolarHBondContact O-N 3.13Å; G344-Q346 PolarHBondContact O-OE1 2.85Å
345	E	86.7	Confident	89.9	Confident	149 Å²	149	53.3 Å²	53.3	70%	0.696	30%	0.295	S	S	*	.			trans	-81.7	19.4	-178	-63.8	-68.1	158.5	0	0	113.9	L338 V343	L338-E345 HydrophobicContact CD1-CB 4.31Å; L338-E345 HydrophobicContact CD2-CB 4.38Å; V343-E345 HydrophobicContact CG1-CB 4.5Å; V343-E345 HydrophobicContact CG1-CG 3.94Å
346	Q	86.1	Confident	89.9	Confident	36 Å²	36	56.9 Å²	56.9	17%	0.168	32%	0.318	C	S	.	.	S	Bend	trans	-78.7	157.2	177	71.6	-76.3	-22.8	0	0	111.8	V339 G344	V339-Q346 HydrophobicContact CG2-CB 4.38Å; V339-Q346 HydrophobicContact CG2-CG 3.94Å; G344-Q346 PolarHBondContact O-N 3.13Å; G344-Q346 PolarHBondContact O-OE1 2.85Å
347	P	87.4	Confident	89.9	Confident	32 Å²	32	58.9 Å²	58.9	21%	0.208	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-55.7	146.7	174.1	-16.2	26.2	0	0	0	111.7	S285	S285-P347 VanDerWaalsContact O-CB 3.32Å; S285-P347 WeakPolarHBondContact O-CB 3.25Å
348	V	89	Confident	89.9	Confident	101 Å²	101	58.3 Å²	58.3	61%	0.612	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-71	129.2	-179	-67.7	0	0	0	0	110.7
349	P	91	Very high	89.9	Confident	14 Å²	14	62.2 Å²	62.2	9%	0.091	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-65	146.6	171.8	26.6	-32.5	0	0	0	110.4	W286 Q354 Y355	W286-P349 VanDerWaalsContact CD1-CA 3.47Å; W286-P349 HydrophobicContact CG-CB 4.15Å; P349-Q354 HydrophobicContact CB-CB 3.55Å; P349-Y355 HydrophobicContact CB-CD1 4.44Å; P349-Y355 HydrophobicContact CB-CD2 4.09Å; P349-Y355 HydrophobicContact CB-CE2 4.33Å; P349-Y355 HydrophobicContact CB-CG 4.14Å; P349-Y355 HydrophobicContact CG-CD1 3.57Å; P349-Y355 HydrophobicContact CG-CD2 4.06Å; P349-Y355 HydrophobicContact CG-CE1 3.68Å; P349-Y355 HydrophobicContact CG-CE2 4.17Å; P349-Y355 HydrophobicContact CG-CG 3.76Å; P349-Y355 WeakPolarHBondContact O-CE2 3.42Å; P349-Y355 PolarHBondContact O-OH 3.16Å
350	I	90.5	Very high	89.9	Confident	96 Å²	96	66.4 Å²	66.4	49%	0.492	37%	0.366	S	S	.	.			trans	-107	-47.1	-177.5	-65.7	158.7	0	0	0	109.9	D284	D284-I350 HydrophobicContact CB-CD1 3.63Å
351	E	89.8	Confident	89.9	Confident	101 Å²	101	67.2 Å²	67.2	47%	0.472	37%	0.371	S	S	.	.	S	Bend	trans	-88	151.9	179.5	-65	-164.8	-179.9	0	0	113.6	Y279 G353 Q354 Y355	Y279-E351 WeakPolarHBondContact CE1-OE2 3.24Å; E351-G353 PolarHBondContact O-N 2.68Å; E351-Q354 HydrophobicContact CB-CG 4.15Å; E351-Q354 WeakPolarHBondContact O-CB 3.47Å; E351-Q354 PolarHBondContact O-N 3.37Å; E351-Y355 WeakPolarHBondContact O-CD2 3.24Å; E351-Y355 PolarHBondContact O-N 3.49Å
352	I	91.9	Very high	90	Very high	142 Å²	142	67.2 Å²	67.2	73%	0.728	37%	0.368	S	S	*	.	H	α-helix	trans	-54.5	-40.9	179.5	-60.8	172	0	0	0	111.4	Q354 Y355 V356	I352-Q354 VanDerWaalsContact C-N 3.32Å; I352-Q354 PolarHBondContact O-N 3.42Å; I352-Y355 WeakPolarHBondContact O-CB 3.42Å; I352-Y355 PolarHBondContact O-N 2.92Å; I352-V356 WeakPolarHBondContact O-CG2 3.39Å; I352-V356 PolarHBondContact O-N 3.37Å
353	G	90.6	Very high	90.1	Very high	32 Å²	32	68.3 Å²	68.3	33%	0.33	37%	0.372	S	S	.	.	H	α-helix	trans	-62.6	-37.6	178.3	0	0	0	0	0	112.9	E351 V356 F357	E351-G353 PolarHBondContact O-N 2.68Å; G353-V356 PolarHBondContact O-N 3.27Å; G353-F357 WeakPolarHBondContact O-CB 3.25Å; G353-F357 PolarHBondContact O-N 3.38Å
354	Q	92.3	Very high	90.2	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-70.2	-38.5	176.2	-57.9	173.3	-7.6	0	0	111.6	Y279 D284 W286 P349 E351 I352 F357 T358	Y279-Q354 HydrophobicContact CE2-CG 4.13Å; D284-Q354 PolarHBondContact OD2-NE2 3.47Å; W286-Q354 HydrophobicContact CD2-CB 3.94Å; W286-Q354 HydrophobicContact CD2-CG 4Å; W286-Q354 HydrophobicContact CE3-CB 3.99Å; W286-Q354 VanDerWaalsContact CE3-CD 3.47Å; W286-Q354 HydrophobicContact CE3-CG 3.54Å; W286-Q354 HydrophobicContact CG-CB 4.46Å; W286-Q354 HydrophobicContact CH2-CB 4.44Å; W286-Q354 HydrophobicContact CH2-CG 4.4Å; W286-Q354 HydrophobicContact CZ2-CB 4.4Å; W286-Q354 HydrophobicContact CZ3-CB 4.24Å; W286-Q354 HydrophobicContact CZ3-CG 3.77Å; P349-Q354 HydrophobicContact CB-CB 3.55Å; E351-Q354 HydrophobicContact CB-CG 4.15Å; E351-Q354 WeakPolarHBondContact O-CB 3.47Å; E351-Q354 PolarHBondContact O-N 3.37Å; I352-Q354 VanDerWaalsContact C-N 3.32Å; I352-Q354 PolarHBondContact O-N 3.42Å; Q354-F357 PolarHBondContact O-N 3.34Å; Q354-T358 WeakPolarHBondContact O-CB 3.49Å; Q354-T358 PolarHBondContact O-N 3.48Å; Q354-T358 PolarHBondContact O-OG1 3.21Å
355	Y	91.9	Very high	90.4	Very high	117 Å²	117	64.6 Å²	64.6	46%	0.459	35%	0.347	S	S	.	.	H	α-helix	trans	-58.7	-50.7	171.7	-85.7	-81.4	0	0	0	111.1	P349 E351 I352 F357 T358 I359	P349-Y355 HydrophobicContact CB-CD1 4.44Å; P349-Y355 HydrophobicContact CB-CD2 4.09Å; P349-Y355 HydrophobicContact CB-CE2 4.33Å; P349-Y355 HydrophobicContact CB-CG 4.14Å; P349-Y355 HydrophobicContact CG-CD1 3.57Å; P349-Y355 HydrophobicContact CG-CD2 4.06Å; P349-Y355 HydrophobicContact CG-CE1 3.68Å; P349-Y355 HydrophobicContact CG-CE2 4.17Å; P349-Y355 HydrophobicContact CG-CG 3.76Å; P349-Y355 WeakPolarHBondContact O-CE2 3.42Å; P349-Y355 PolarHBondContact O-OH 3.16Å; E351-Y355 WeakPolarHBondContact O-CD2 3.24Å; E351-Y355 PolarHBondContact O-N 3.49Å; I352-Y355 WeakPolarHBondContact O-CB 3.42Å; I352-Y355 PolarHBondContact O-N 2.92Å; Y355-F357 PolarHBondContact O-N 3.34Å; Y355-T358 PolarHBondContact O-N 2.98Å; Y355-I359 WeakPolarHBondContact O-CB 3.37Å; Y355-I359 WeakPolarHBondContact O-CD1 3.42Å; Y355-I359 WeakPolarHBondContact O-CG1 3.19Å; Y355-I359 PolarHBondContact O-N 3.34Å
356	V	93.4	Very high	90.4	Very high	83 Å²	83	59.9 Å²	59.9	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-46.5	179.1	173.8	0	0	0	0	110.8	I352 G353 T358 I359 V360	I352-V356 WeakPolarHBondContact O-CG2 3.39Å; I352-V356 PolarHBondContact O-N 3.37Å; G353-V356 PolarHBondContact O-N 3.27Å; V356-T358 PolarHBondContact O-N 3.2Å; V356-I359 PolarHBondContact O-N 3.3Å; V356-V360 HydrophobicContact CG1-CG2 4.27Å; V356-V360 WeakPolarHBondContact O-CB 3.24Å; V356-V360 VanDerWaalsContact O-CG2 3.25Å; V356-V360 WeakPolarHBondContact O-CG2 3.48Å; V356-V360 PolarHBondContact O-N 3.39Å
357	F	92.2	Very high	90.4	Very high	41 Å²	41	63.8 Å²	63.8	18%	0.18	35%	0.35	C	S	.	.	H	α-helix	trans	-60.6	-44.6	178.4	-179.6	-97.6	0	0	0	112.3	F271 Y272 V275 W286 W335 G353 Q354 Y355 N361	F271-F357 HydrophobicContact CB-CZ 4.42Å; Y272-F357 HydrophobicContact CD2-CE1 4.19Å; V275-F357 HydrophobicContact CG2-CD2 4.21Å; V275-F357 HydrophobicContact CG2-CE2 3.85Å; V275-F357 HydrophobicContact CG2-CZ 4.14Å; W286-F357 AromaticContact CH2-CD1 3.72Å; W286-F357 HydrophobicContact CH2-CD1 3.72Å; W286-F357 HydrophobicContact CH2-CE1 4.13Å; W286-F357 AromaticContact CZ2-CD1 3.69Å; W286-F357 HydrophobicContact CZ2-CD1 3.69Å; W286-F357 HydrophobicContact CZ2-CE1 4.2Å; W335-F357 AromaticContact CH2-CD1 3.92Å; W335-F357 HydrophobicContact CH2-CD1 3.92Å; W335-F357 AromaticContact CH2-CE1 3.54Å; W335-F357 HydrophobicContact CH2-CE1 3.54Å; W335-F357 HydrophobicContact CZ2-CE1 4.46Å; W335-F357 AromaticContact CZ3-CE1 3.9Å; W335-F357 HydrophobicContact CZ3-CE1 3.9Å; G353-F357 WeakPolarHBondContact O-CB 3.25Å; G353-F357 PolarHBondContact O-N 3.38Å; Q354-F357 PolarHBondContact O-N 3.34Å; Y355-F357 PolarHBondContact O-N 3.34Å; F357-N361 WeakPolarHBondContact CE1-ND2 3.34Å; F357-N361 WeakPolarHBondContact CE2-ND2 3.42Å; F357-N361 VanDerWaalsContact CZ-ND2 3.25Å; F357-N361 WeakPolarHBondContact CZ-ND2 3.36Å; F357-N361 PolarHBondContact O-N 3.44Å; F357-N361 PolarHBondContact O-ND2 3.45Å
358	T	91.7	Very high	90.2	Very high	10 Å²	10	65 Å²	65	6%	0.061	35%	0.354	C	S	.	.	H	α-helix	trans	-65.8	-44	178.9	-56.2	0	0	0	0	111.3	W286 W335 Q354 Y355 V356 N361 F362	W286-T358 PolarHBondContact NE1-OG1 3.19Å; W335-T358 HydrophobicContact CZ2-CG2 4.36Å; Q354-T358 WeakPolarHBondContact O-CB 3.49Å; Q354-T358 PolarHBondContact O-N 3.48Å; Q354-T358 PolarHBondContact O-OG1 3.21Å; Y355-T358 PolarHBondContact O-N 2.98Å; V356-T358 PolarHBondContact O-N 3.2Å; T358-N361 PolarHBondContact O-N 3.28Å; T358-F362 WeakPolarHBondContact O-CB 3.14Å; T358-F362 PolarHBondContact O-N 3.43Å
359	I	92	Very high	89.7	Confident	100 Å²	100	62.8 Å²	62.8	51%	0.513	34%	0.338	S	S	.	.	H	α-helix	trans	-63.3	-45.2	177.9	-68.8	165.6	0	0	0	111.1	Y355 V356 N361 F362 V363	Y355-I359 WeakPolarHBondContact O-CB 3.37Å; Y355-I359 WeakPolarHBondContact O-CD1 3.42Å; Y355-I359 WeakPolarHBondContact O-CG1 3.19Å; Y355-I359 PolarHBondContact O-N 3.34Å; V356-I359 PolarHBondContact O-N 3.3Å; I359-N361 PolarHBondContact O-N 3.44Å; I359-F362 PolarHBondContact O-N 3.25Å; I359-V363 HydrophobicContact CG2-CG2 4.34Å; I359-V363 WeakPolarHBondContact O-CG2 3.46Å; I359-V363 PolarHBondContact O-N 3.21Å
360	V	92.4	Very high	89	Confident	89 Å²	89	65 Å²	65	54%	0.539	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-44.5	178.6	169.4	0	0	0	0	110.9	V356 V363 A364	V356-V360 HydrophobicContact CG1-CG2 4.27Å; V356-V360 WeakPolarHBondContact O-CB 3.24Å; V356-V360 VanDerWaalsContact O-CG2 3.25Å; V356-V360 WeakPolarHBondContact O-CG2 3.48Å; V356-V360 PolarHBondContact O-N 3.39Å; V360-V363 PolarHBondContact O-N 3.47Å; V360-A364 VanDerWaalsContact O-CB 3.24Å; V360-A364 WeakPolarHBondContact O-CB 3.37Å; V360-A364 PolarHBondContact O-N 3.41Å
361	N	91.5	Very high	88.1	Confident	25 Å²	25	61.9 Å²	61.9	13%	0.134	35%	0.35	C	S	.	.	H	α-helix	trans	-66.6	-38.2	176.7	-79.6	-72.7	0	0	0	112.3	V339 F357 T358 I359 A364 G365	V339-N361 HydrophobicContact CG1-CB 3.62Å; F357-N361 WeakPolarHBondContact CE1-ND2 3.34Å; F357-N361 WeakPolarHBondContact CE2-ND2 3.42Å; F357-N361 VanDerWaalsContact CZ-ND2 3.25Å; F357-N361 WeakPolarHBondContact CZ-ND2 3.36Å; F357-N361 PolarHBondContact O-N 3.44Å; F357-N361 PolarHBondContact O-ND2 3.45Å; T358-N361 PolarHBondContact O-N 3.28Å; I359-N361 PolarHBondContact O-N 3.44Å; N361-A364 PolarHBondContact O-N 2.86Å; N361-G365 PolarHBondContact O-N 2.68Å
362	F	91.2	Very high	87.2	Confident	78 Å²	78	58.8 Å²	58.8	34%	0.342	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-45.6	176.4	-171.4	-90.1	0	0	0	111.8	V339 T358 I359 G365 T366	V339-F362 HydrophobicContact CG1-CB 4.21Å; T358-F362 WeakPolarHBondContact O-CB 3.14Å; T358-F362 PolarHBondContact O-N 3.43Å; I359-F362 PolarHBondContact O-N 3.25Å; F362-G365 PolarHBondContact O-N 3.45Å; F362-T366 HydrophobicContact CD1-CG2 4.22Å; F362-T366 HydrophobicContact CE1-CG2 3.96Å; F362-T366 HydrophobicContact CZ-CG2 4.43Å; F362-T366 WeakPolarHBondContact O-CG2 3.37Å; F362-T366 PolarHBondContact O-N 3.1Å; F362-T366 PolarHBondContact O-OG1 3.5Å; F362-T366 VanDerWaalsContact O-OG1 3.1Å
363	V	91.3	Very high	85.8	Confident	73 Å²	73	56.8 Å²	56.8	44%	0.442	33%	0.326	S	S	.	.	H	α-helix	trans	-64.1	-42.7	174.9	174.1	0	0	0	0	110.8	I359 V360 G365 T366 L367	I359-V363 HydrophobicContact CG2-CG2 4.34Å; I359-V363 WeakPolarHBondContact O-CG2 3.46Å; I359-V363 PolarHBondContact O-N 3.21Å; V360-V363 PolarHBondContact O-N 3.47Å; V363-G365 PolarHBondContact O-N 3.27Å; V363-T366 WeakPolarHBondContact CA-OG1 3.37Å; V363-T366 PolarHBondContact O-N 2.88Å; V363-T366 PolarHBondContact O-OG1 2.94Å; V363-L367 HydrophobicContact CG1-CD1 4.03Å; V363-L367 HydrophobicContact CG1-CG 4.42Å; V363-L367 WeakPolarHBondContact O-CB 3.41Å; V363-L367 VanDerWaalsContact O-CG 3.25Å; V363-L367 WeakPolarHBondContact O-CG 3.21Å; V363-L367 PolarHBondContact O-N 3.34Å
364	A	89.1	Confident	84.1	Confident	36 Å²	36	56 Å²	56	30%	0.298	32%	0.318	S	S	.	.	H	α-helix	trans	-61.2	-44.9	175.1	0	0	0	0	0	111.7	V360 N361 L367 I368	V360-A364 VanDerWaalsContact O-CB 3.24Å; V360-A364 WeakPolarHBondContact O-CB 3.37Å; V360-A364 PolarHBondContact O-N 3.41Å; N361-A364 PolarHBondContact O-N 2.86Å; A364-L367 PolarHBondContact O-N 2.8Å; A364-I368 WeakPolarHBondContact O-CB 3.35Å; A364-I368 WeakPolarHBondContact O-CD1 3.17Å; A364-I368 WeakPolarHBondContact O-CG1 3.13Å; A364-I368 PolarHBondContact O-N 2.84Å
365	G	87.6	Confident	82.2	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-49.7	176.8	0	0	0	0	0	112.9	L340 N361 F362 V363 L367 I368 L369	L340-G365 CarbonylContact O-C 3.59Å; L340-G365 WeakPolarHBondContact O-CA 3.44Å; N361-G365 PolarHBondContact O-N 2.68Å; F362-G365 PolarHBondContact O-N 3.45Å; V363-G365 PolarHBondContact O-N 3.27Å; G365-L367 PolarHBondContact O-N 3.19Å; G365-I368 PolarHBondContact O-N 3.06Å; G365-L369 WeakPolarHBondContact O-CG 3.48Å; G365-L369 PolarHBondContact O-N 3.49Å
366	T	86.3	Confident	80.1	Confident	51 Å²	51	64.8 Å²	64.8	31%	0.313	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-41.7	177	54	0	0	0	0	112.4	F362 V363 A370	F362-T366 HydrophobicContact CD1-CG2 4.22Å; F362-T366 HydrophobicContact CE1-CG2 3.96Å; F362-T366 HydrophobicContact CZ-CG2 4.43Å; F362-T366 WeakPolarHBondContact O-CG2 3.37Å; F362-T366 PolarHBondContact O-N 3.1Å; F362-T366 PolarHBondContact O-OG1 3.5Å; F362-T366 VanDerWaalsContact O-OG1 3.1Å; V363-T366 WeakPolarHBondContact CA-OG1 3.37Å; V363-T366 PolarHBondContact O-N 2.88Å; V363-T366 PolarHBondContact O-OG1 2.94Å; T366-A370 VanDerWaalsContact O-CB 3.25Å; T366-A370 WeakPolarHBondContact O-CB 3.32Å; T366-A370 PolarHBondContact O-N 3.49Å
367	L	86.3	Confident	77.6	Confident	118 Å²	118	65.3 Å²	65.3	62%	0.618	36%	0.357	S	S	*	.	H	α-helix	trans	-65.4	-39.7	174.6	-71.4	176	0	0	0	112.4	V363 A364 G365 G371	V363-L367 HydrophobicContact CG1-CD1 4.03Å; V363-L367 HydrophobicContact CG1-CG 4.42Å; V363-L367 WeakPolarHBondContact O-CB 3.41Å; V363-L367 VanDerWaalsContact O-CG 3.25Å; V363-L367 WeakPolarHBondContact O-CG 3.21Å; V363-L367 PolarHBondContact O-N 3.34Å; A364-L367 PolarHBondContact O-N 2.8Å; G365-L367 PolarHBondContact O-N 3.19Å; L367-G371 PolarHBondContact O-N 2.85Å
368	I	82.3	Confident	75.1	Confident	56 Å²	56	67.5 Å²	67.5	29%	0.287	37%	0.374	S	S	.	.	H	α-helix	trans	-64.9	-50.3	176.8	-72.7	163.2	0	0	0	109.7	I264 A364 G365 A370 G371 L372	I264-I368 HydrophobicContact CD1-CD1 4.32Å; I264-I368 HydrophobicContact CD1-CG2 3.89Å; I264-I368 HydrophobicContact CG2-CD1 3.87Å; A364-I368 WeakPolarHBondContact O-CB 3.35Å; A364-I368 WeakPolarHBondContact O-CD1 3.17Å; A364-I368 WeakPolarHBondContact O-CG1 3.13Å; A364-I368 PolarHBondContact O-N 2.84Å; G365-I368 PolarHBondContact O-N 3.06Å; I368-A370 VanDerWaalsContact C-N 3.35Å; I368-A370 PolarHBondContact O-N 3.21Å; I368-G371 CarbonylContact O-C 3.54Å; I368-G371 WeakPolarHBondContact O-CA 3.24Å; I368-G371 PolarHBondContact O-N 3Å; I368-G371 VanDerWaalsContact O-N 3.13Å; I368-L372 HydrophobicContact CG2-CD1 3.66Å; I368-L372 HydrophobicContact CG2-CG 4.11Å; I368-L372 WeakPolarHBondContact O-CB 3.34Å; I368-L372 WeakPolarHBondContact O-CG 3.44Å; I368-L372 PolarHBondContact O-N 3.14Å
369	L	79	Confident	72.7	Confident	55 Å²	55	72 Å²	72	29%	0.288	40%	0.397	S	S	.	.	H	α-helix	trans	-58.7	-45.3	176.4	-70	174.5	0	0	0	111.8	L340 G365 G371 L372 I373	L340-L369 WeakPolarHBondContact O-CD1 3.42Å; G365-L369 WeakPolarHBondContact O-CG 3.48Å; G365-L369 PolarHBondContact O-N 3.49Å; L369-G371 VanDerWaalsContact C-N 3.32Å; L369-G371 PolarHBondContact O-N 2.98Å; L369-L372 PolarHBondContact O-N 3.12Å; L369-I373 WeakPolarHBondContact O-CB 3.37Å; L369-I373 WeakPolarHBondContact O-CD1 2.93Å; L369-I373 VanDerWaalsContact O-CG1 3.24Å; L369-I373 WeakPolarHBondContact O-CG1 3.16Å; L369-I373 PolarHBondContact O-N 3.04Å
370	A	76.8	Confident	70.3	Confident	60 Å²	60	76.8 Å²	76.8	50%	0.496	41%	0.41	S	S	.	.	H	α-helix	trans	-60.3	-42.6	175.2	0	0	0	0	0	111.4	T366 I368 I373 G374	T366-A370 VanDerWaalsContact O-CB 3.25Å; T366-A370 WeakPolarHBondContact O-CB 3.32Å; T366-A370 PolarHBondContact O-N 3.49Å; I368-A370 VanDerWaalsContact C-N 3.35Å; I368-A370 PolarHBondContact O-N 3.21Å; A370-I373 PolarHBondContact O-N 3.27Å; A370-G374 PolarHBondContact O-N 3.43Å
371	G	71.4	Confident	67.8	Low	32 Å²	32	76.2 Å²	76.2	33%	0.33	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-45.2	174.5	0	0	0	0	0	112.8	L367 I368 L369 I373 G374 R375	L367-G371 PolarHBondContact O-N 2.85Å; I368-G371 CarbonylContact O-C 3.54Å; I368-G371 WeakPolarHBondContact O-CA 3.24Å; I368-G371 PolarHBondContact O-N 3Å; I368-G371 VanDerWaalsContact O-N 3.13Å; L369-G371 VanDerWaalsContact C-N 3.32Å; L369-G371 PolarHBondContact O-N 2.98Å; G371-I373 VanDerWaalsContact C-N 3.27Å; G371-I373 PolarHBondContact O-N 2.9Å; G371-G374 PolarHBondContact O-N 3.21Å; G371-G374 VanDerWaalsContact O-N 3.13Å; G371-R375 VanDerWaalsContact O-CB 3.24Å; G371-R375 WeakPolarHBondContact O-CB 3.03Å; G371-R375 PolarHBondContact O-N 3.19Å
372	L	69.6	Low	65.4	Low	36 Å²	36	82.3 Å²	82.3	19%	0.188	45%	0.446	C	S	.	.	H	α-helix	trans	-66	-28.7	177.5	-66	168.6	0	0	0	112.1	L257 V261 I368 L369 N395	L257-L372 HydrophobicContact CD1-CD2 3.27Å; L257-L372 HydrophobicContact CG-CD2 4.15Å; V261-L372 HydrophobicContact CG2-CD1 3.6Å; V261-L372 HydrophobicContact CG2-CD2 4.17Å; I368-L372 HydrophobicContact CG2-CD1 3.66Å; I368-L372 HydrophobicContact CG2-CG 4.11Å; I368-L372 WeakPolarHBondContact O-CB 3.34Å; I368-L372 WeakPolarHBondContact O-CG 3.44Å; I368-L372 PolarHBondContact O-N 3.14Å; L369-L372 PolarHBondContact O-N 3.12Å; L372-N395 PolarHBondContact O-ND2 3.27Å
373	I	63.7	Low	63.1	Low	99 Å²	99	83.5 Å²	83.5	51%	0.508	46%	0.464	S	S	.	.	H	α-helix	trans	-79.7	-34.4	172.1	-65	164.8	0	0	0	110.6	L369 A370 G371 S394	L369-I373 WeakPolarHBondContact O-CB 3.37Å; L369-I373 WeakPolarHBondContact O-CD1 2.93Å; L369-I373 VanDerWaalsContact O-CG1 3.24Å; L369-I373 WeakPolarHBondContact O-CG1 3.16Å; L369-I373 PolarHBondContact O-N 3.04Å; A370-I373 PolarHBondContact O-N 3.27Å; G371-I373 VanDerWaalsContact C-N 3.27Å; G371-I373 PolarHBondContact O-N 2.9Å; I373-S394 WeakPolarHBondContact O-CA 3.41Å
374	G	53.3	Low	60.3	Low	17 Å²	17	89.6 Å²	89.6	18%	0.175	49%	0.485	C	S	.	.	H	α-helix	trans	-103.6	-7.3	-167.3	0	0	0	0	0	118.1	A370 G371 K376 T377	A370-G374 PolarHBondContact O-N 3.43Å; G371-G374 PolarHBondContact O-N 3.21Å; G371-G374 VanDerWaalsContact O-N 3.13Å; G374-K376 PolarHBondContact O-N 2.9Å; G374-T377 PolarHBondContact O-N 2.86Å
375	R	53.5	Low	57.8	Low	196 Å²	196	99.2 Å²	99.2	74%	0.74	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	6.4	-163.2	-133.9	173.9	169.1	151.2	-2.7	118.8	G371	G371-R375 VanDerWaalsContact O-CB 3.24Å; G371-R375 WeakPolarHBondContact O-CB 3.03Å; G371-R375 PolarHBondContact O-N 3.19Å
376	K	47.5	Very low	55.2	Low	105 Å²	105	105.5 Å²	105.5	46%	0.457	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.4	-9	157.9	-62.9	-145.5	-179.9	-175.6	0	115.2	G374 I398	G374-K376 PolarHBondContact O-N 2.9Å; K376-I398 HydrophobicContact CB-CD1 3.42Å; K376-I398 VanDerWaalsContact CB-CD1 3.42Å; K376-I398 HydrophobicContact CD-CD1 3.84Å; K376-I398 HydrophobicContact CD-CG2 4.31Å; K376-I398 HydrophobicContact CG-CD1 3.53Å
377	T	40.6	Very low	52.7	Low	93 Å²	93	114.2 Å²	114.2	57%	0.571	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-25.7	179.6	-47	0	0	0	0	112.1	G374	G374-T377 PolarHBondContact O-N 2.86Å
378	T	39.7	Very low	50.1	Low	88 Å²	88	114 Å²	114	54%	0.54	59%	0.589	S	S	.	*	S	Bend	trans	-102	-22.1	-169.4	-43.6	0	0	0	0	115.1	Y380 A381	T378-Y380 PolarHBondContact O-N 3.47Å; T378-A381 PolarHBondContact O-N 3.01Å
379	L	42.2	Very low	47.7	Very low	104 Å²	104	117.4 Å²	117.4	55%	0.545	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-8.6	-174.5	-144.7	77.3	0	0	0	114.9
380	Y	40.8	Very low	45.5	Very low	201 Å²	201	122 Å²	122	79%	0.788	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-9	166.9	-65.1	-73.8	0	0	0	113	T378	T378-Y380 PolarHBondContact O-N 3.47Å
381	A	41.1	Very low	43.7	Very low	77 Å²	77	123.6 Å²	123.6	64%	0.636	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-9.5	-177.7	0	0	0	0	0	114	T378	T378-A381 PolarHBondContact O-N 3.01Å
382	L	40.2	Very low	42.1	Very low	153 Å²	153	129.8 Å²	129.8	80%	0.801	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	4.4	176.2	-84.4	157.9	0	0	0	114
383	S	42	Very low	40.6	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	68%	0.678	S	S	*	*	S	Bend	trans	-116.7	89.9	172.9	-143.2	0	0	0	0	110.3
384	F	33.9	Very low	39.6	Very low	201 Å²	201	130.1 Å²	130.1	88%	0.882	67%	0.666	S	S	*	*	S	Bend	trans	35.3	86.6	151.2	-107.4	-103.4	0	0	0	117.4
385	R	35.9	Very low	39.2	Very low	239 Å²	239	130.9 Å²	130.9	90%	0.902	67%	0.666	S	S	*	*			trans	172.4	126.6	132.2	-96.1	-176	-169.9	-172.1	3.6	111.7
386	P	33.2	Very low	39	Very low	132 Å²	132	126.4 Å²	126.4	86%	0.857	66%	0.66	S	S	*	*			trans	-91.6	103.4	171.4	33.7	-25.6	0	0	0	109.6
387	R	33.8	Very low	38.6	Very low	234 Å²	234	126.2 Å²	126.2	88%	0.883	66%	0.657	S	S	*	*			trans	-162.3	128.2	152.8	-127.8	168.4	-175.2	163.9	1.5	110.7
388	C	31.9	Very low	38.9	Very low	115 Å²	115	124.2 Å²	124.2	78%	0.777	64%	0.642	S	S	*	*			trans	84.1	91.8	173.8	-49.5	0	0	0	0	114.2
389	V	31.3	Very low	39.4	Very low	126 Å²	126	121 Å²	121	76%	0.764	62%	0.622	S	S	*	*				65.8	102	70.9	-177	0	0	0	0	112.2
390	I	33	Very low	39.9	Very low	153 Å²	153	119.8 Å²	119.8	79%	0.785	62%	0.619	S	S	*	*			trans	72.2	97.8	155.1	-51.2	161.3	0	0	0	117.3
391	S	38.7	Very low	40.3	Very low	93 Å²	93	112.5 Å²	112.5	65%	0.65	60%	0.6	S	S	*	*				-158.1	103.8	129	-162.7	0	0	0	0	110.7	R397	S391-R397 PolarHBondContact OG-NH2 3.2Å
392	K	37.9	Very low	41	Very low	162 Å²	162	110.6 Å²	110.6	70%	0.704	59%	0.588	S	S	*	*			trans	-61.1	151.4	174.8	-65.5	178.9	172.5	179.2	0	111.1	R397	K392-R397 PolarHBondContact O-NH1 3.42Å; K392-R397 PolarHBondContact O-NH2 2.6Å; K392-R397 VanDerWaalsContact O-NH2 3.1Å
393	N	38.7	Very low	41.9	Very low	106 Å²	106	110.1 Å²	110.1	57%	0.567	58%	0.583	S	S	*	*			trans	84.8	123.3	147.8	-53.7	-10.1	0	0	0	123.2	R397	N393-R397 VanDerWaalsContact O-CB 3.27Å; N393-R397 WeakPolarHBondContact O-CB 3.25Å; N393-R397 WeakPolarHBondContact O-CD 3.41Å
394	S	42.8	Very low	43.2	Very low	35 Å²	35	108.4 Å²	108.4	25%	0.245	57%	0.566	C	S	.	*			trans	61.1	134.7	138.8	73.7	0	0	0	0	122.8	I373 V396 R397 I398	I373-S394 WeakPolarHBondContact O-CA 3.41Å; S394-V396 PolarHBondContact O-N 2.93Å; S394-R397 CarbonylContact O-C 3.32Å; S394-R397 VanDerWaalsContact O-CA 3.32Å; S394-R397 WeakPolarHBondContact O-CA 3.45Å; S394-R397 VanDerWaalsContact O-CB 3.27Å; S394-R397 WeakPolarHBondContact O-CB 3.42Å; S394-R397 PolarHBondContact O-N 3.28Å; S394-I398 PolarHBondContact O-N 3.18Å
395	N	45.6	Very low	44.8	Very low	33 Å²	33	104.9 Å²	104.9	18%	0.176	55%	0.552	C	S	.	*	H	α-helix	trans	-56.3	-29.1	173.5	-81	-27.5	0	0	0	114.1	L372 R397 I398 V399	L372-N395 PolarHBondContact O-ND2 3.27Å; N395-R397 VanDerWaalsContact C-N 3.3Å; N395-R397 PolarHBondContact O-N 3.21Å; N395-I398 PolarHBondContact O-N 3.48Å; N395-I398 VanDerWaalsContact O-N 3.08Å; N395-V399 PolarHBondContact O-N 3.07Å
396	V	47.4	Very low	46.4	Very low	102 Å²	102	99.9 Å²	99.9	62%	0.618	54%	0.539	S	S	*	.	H	α-helix	trans	-63.1	-39.3	170.5	-178.8	0	0	0	0	110.6	S394 I398 V399 V400	S394-V396 PolarHBondContact O-N 2.93Å; V396-I398 VanDerWaalsContact C-N 3.3Å; V396-I398 PolarHBondContact O-N 3.48Å; V396-V399 PolarHBondContact O-N 3.13Å; V396-V400 HydrophobicContact CG1-CG2 4.32Å; V396-V400 WeakPolarHBondContact O-CB 3.35Å; V396-V400 WeakPolarHBondContact O-CG2 3.31Å; V396-V400 PolarHBondContact O-N 3.36Å
397	R	39.7	Very low	48.4	Very low	102 Å²	102	100.1 Å²	100.1	39%	0.385	52%	0.523	S	S	.	.	H	α-helix	trans	-72.2	-16.9	172.7	-78.3	-176.1	58.9	-168.4	-19	113.4	S391 K392 N393 S394 N395 A401	S391-R397 PolarHBondContact OG-NH2 3.2Å; K392-R397 PolarHBondContact O-NH1 3.42Å; K392-R397 PolarHBondContact O-NH2 2.6Å; K392-R397 VanDerWaalsContact O-NH2 3.1Å; N393-R397 VanDerWaalsContact O-CB 3.27Å; N393-R397 WeakPolarHBondContact O-CB 3.25Å; N393-R397 WeakPolarHBondContact O-CD 3.41Å; S394-R397 CarbonylContact O-C 3.32Å; S394-R397 VanDerWaalsContact O-CA 3.32Å; S394-R397 WeakPolarHBondContact O-CA 3.45Å; S394-R397 VanDerWaalsContact O-CB 3.27Å; S394-R397 WeakPolarHBondContact O-CB 3.42Å; S394-R397 PolarHBondContact O-N 3.28Å; N395-R397 VanDerWaalsContact C-N 3.3Å; N395-R397 PolarHBondContact O-N 3.21Å; R397-A401 WeakPolarHBondContact O-CA 3.32Å; R397-A401 WeakPolarHBondContact O-CB 3.32Å; R397-A401 PolarHBondContact O-N 3.43Å
398	I	47.5	Very low	50.4	Low	50 Å²	50	92.4 Å²	92.4	26%	0.256	51%	0.505	S	S	.	.	H	α-helix	trans	-79.4	-37.7	174	-60.1	176	0	0	0	110.3	K376 S394 N395 V396 G402	K376-I398 HydrophobicContact CB-CD1 3.42Å; K376-I398 VanDerWaalsContact CB-CD1 3.42Å; K376-I398 HydrophobicContact CD-CD1 3.84Å; K376-I398 HydrophobicContact CD-CG2 4.31Å; K376-I398 HydrophobicContact CG-CD1 3.53Å; S394-I398 PolarHBondContact O-N 3.18Å; N395-I398 PolarHBondContact O-N 3.48Å; N395-I398 VanDerWaalsContact O-N 3.08Å; V396-I398 VanDerWaalsContact C-N 3.3Å; V396-I398 PolarHBondContact O-N 3.48Å; I398-G402 VanDerWaalsContact O-CA 3.29Å; I398-G402 WeakPolarHBondContact O-CA 3.24Å; I398-G402 PolarHBondContact O-N 3.47Å
399	V	50.2	Low	52.6	Low	22 Å²	22	91.2 Å²	91.2	13%	0.133	49%	0.494	C	S	.	.	H	α-helix	trans	-63.3	-52.2	169.9	163.9	0	0	0	0	109.7	N250 N395 V396 M403	N250-V399 HydrophobicContact CB-CB 4.01Å; N250-V399 HydrophobicContact CB-CG1 3.63Å; N250-V399 HydrophobicContact CB-CG2 3.81Å; N250-V399 PolarHBondContact ND2-O 2.95Å; N250-V399 WeakPolarHBondContact O-CG2 3.37Å; N395-V399 PolarHBondContact O-N 3.07Å; V396-V399 PolarHBondContact O-N 3.13Å; V399-M403 HydrophobicContact CG1-SD 4.03Å; V399-M403 WeakPolarHBondContact O-CB 3.41Å; V399-M403 WeakPolarHBondContact O-CG 3.25Å; V399-M403 PolarHBondContact O-N 3.48Å
400	V	51.5	Low	55	Low	78 Å²	78	86.7 Å²	86.7	47%	0.473	46%	0.464	S	S	.	.	H	α-helix	trans	-69	-45	-179.3	174.2	0	0	0	0	111.8	V396 M403 N404	V396-V400 HydrophobicContact CG1-CG2 4.32Å; V396-V400 WeakPolarHBondContact O-CB 3.35Å; V396-V400 WeakPolarHBondContact O-CG2 3.31Å; V396-V400 PolarHBondContact O-N 3.36Å; V400-M403 PolarHBondContact O-N 3.06Å; V400-N404 WeakPolarHBondContact O-CB 3.46Å; V400-N404 PolarHBondContact O-N 2.61Å
401	A	50.3	Low	57.4	Low	47 Å²	47	86.7 Å²	86.7	39%	0.388	45%	0.454	S	S	.	.	H	α-helix	trans	-73.1	-29.5	178.6	0	0	0	0	0	112	R397 N404 Q405	R397-A401 WeakPolarHBondContact O-CA 3.32Å; R397-A401 WeakPolarHBondContact O-CB 3.32Å; R397-A401 PolarHBondContact O-N 3.43Å; A401-N404 CarbonylContact O-C 3.53Å; A401-N404 PolarHBondContact O-N 3.47Å; A401-Q405 WeakPolarHBondContact O-CA 3.34Å; A401-Q405 WeakPolarHBondContact O-CB 3.28Å; A401-Q405 PolarHBondContact O-N 3.33Å
402	G	56.6	Low	59.6	Low	37 Å²	37	86.2 Å²	86.2	38%	0.381	45%	0.451	S	S	.	.	H	α-helix	trans	-67.2	-47.7	171.4	0	0	0	0	0	111.3	I398 N404 Q405	I398-G402 VanDerWaalsContact O-CA 3.29Å; I398-G402 WeakPolarHBondContact O-CA 3.24Å; I398-G402 PolarHBondContact O-N 3.47Å; G402-N404 PolarHBondContact O-N 3.35Å; G402-Q405 PolarHBondContact O-N 3.33Å
403	M	58.6	Low	61.9	Low	144 Å²	144	81.9 Å²	81.9	71%	0.709	44%	0.441	S	S	*	.	H	α-helix	trans	-62.8	-33.1	174.2	-69.7	172.6	72	0	0	112.4	N250 V399 V400	N250-M403 HydrophobicContact CB-SD 4.41Å; N250-M403 WeakPolarHBondContact ND2-CG 3.42Å; V399-M403 HydrophobicContact CG1-SD 4.03Å; V399-M403 WeakPolarHBondContact O-CB 3.41Å; V399-M403 WeakPolarHBondContact O-CG 3.25Å; V399-M403 PolarHBondContact O-N 3.48Å; V400-M403 PolarHBondContact O-N 3.06Å
404	N	67.7	Low	64.3	Low	66 Å²	66	78.3 Å²	78.3	35%	0.353	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	10.6	-175.6	-151.1	29.6	0	0	0	112.7	V400 A401 G402 R407 S408	V400-N404 WeakPolarHBondContact O-CB 3.46Å; V400-N404 PolarHBondContact O-N 2.61Å; A401-N404 CarbonylContact O-C 3.53Å; A401-N404 PolarHBondContact O-N 3.47Å; G402-N404 PolarHBondContact O-N 3.35Å; N404-R407 PolarHBondContact O-N 3.48Å; N404-R407 VanDerWaalsContact OD1-CB 3.25Å; N404-R407 WeakPolarHBondContact OD1-CB 3.1Å; N404-R407 VanDerWaalsContact OD1-CD 3.22Å; N404-R407 WeakPolarHBondContact OD1-CD 3.35Å; N404-S408 VanDerWaalsContact O-CB 3.26Å; N404-S408 WeakPolarHBondContact O-CB 3.41Å; N404-S408 PolarHBondContact O-N 3.16Å
405	Q	69.5	Low	66.5	Low	126 Å²	126	79.5 Å²	79.5	59%	0.589	42%	0.424	S	S	*	.	H	α-helix	trans	-67.1	-48.1	-169.1	-168.9	174	-8.2	0	0	111.1	A401 G402 R407 S408 T409	A401-Q405 WeakPolarHBondContact O-CA 3.34Å; A401-Q405 WeakPolarHBondContact O-CB 3.28Å; A401-Q405 PolarHBondContact O-N 3.33Å; G402-Q405 PolarHBondContact O-N 3.33Å; Q405-R407 VanDerWaalsContact C-N 3.3Å; Q405-R407 PolarHBondContact O-N 3.02Å; Q405-S408 PolarHBondContact O-N 3.43Å; Q405-T409 WeakPolarHBondContact O-CB 3.44Å; Q405-T409 PolarHBondContact O-N 2.98Å; Q405-T409 PolarHBondContact O-OG1 3.31Å
406	Q	69.6	Low	68.7	Low	135 Å²	135	79.8 Å²	79.8	63%	0.631	43%	0.434	S	S	*	.	H	α-helix	trans	-61.6	-42.3	178	-68.8	-178.5	-14.8	0	0	110.7	T409 F410	Q406-T409 PolarHBondContact O-N 2.87Å; Q406-F410 WeakPolarHBondContact O-CB 3.25Å; Q406-F410 PolarHBondContact O-N 3.31Å
407	R	75.1	Confident	70.8	Confident	136 Å²	136	76.9 Å²	76.9	51%	0.513	42%	0.417	S	S	.	.	H	α-helix	trans	-66.4	-40.3	176.7	-174.9	169.7	-174.9	-169.3	2.8	113.1	N404 Q405 R411 W442	N404-R407 PolarHBondContact O-N 3.48Å; N404-R407 VanDerWaalsContact OD1-CB 3.25Å; N404-R407 WeakPolarHBondContact OD1-CB 3.1Å; N404-R407 VanDerWaalsContact OD1-CD 3.22Å; N404-R407 WeakPolarHBondContact OD1-CD 3.35Å; Q405-R407 VanDerWaalsContact C-N 3.3Å; Q405-R407 PolarHBondContact O-N 3.02Å; R407-R411 WeakPolarHBondContact O-CB 3.24Å; R407-R411 PolarHBondContact O-N 3.17Å; R407-W442 HydrophobicContact CB-CH2 3.46Å; R407-W442 VanDerWaalsContact CB-CH2 3.46Å; R407-W442 HydrophobicContact CB-CZ2 3.74Å; R407-W442 HydrophobicContact CG-CH2 3.77Å; R407-W442 HydrophobicContact CG-CZ2 3.57Å
408	S	76	Confident	73.2	Confident	72 Å²	72	75.2 Å²	75.2	50%	0.503	41%	0.412	S	S	.	.	H	α-helix	trans	-65.3	-44.2	176.1	-173.8	0	0	0	0	111.1	N404 Q405 R411 S412	N404-S408 VanDerWaalsContact O-CB 3.26Å; N404-S408 WeakPolarHBondContact O-CB 3.41Å; N404-S408 PolarHBondContact O-N 3.16Å; Q405-S408 PolarHBondContact O-N 3.43Å; S408-R411 PolarHBondContact O-N 3.23Å; S408-S412 WeakPolarHBondContact O-CB 3.31Å; S408-S412 PolarHBondContact O-N 3.45Å
409	T	77.9	Confident	75.3	Confident	90 Å²	90	77 Å²	77	55%	0.552	42%	0.423	S	S	*	.	H	α-helix	trans	-63.4	-47.5	178.8	-53.6	0	0	0	0	110.9	Q405 Q406 S412 C413	Q405-T409 WeakPolarHBondContact O-CB 3.44Å; Q405-T409 PolarHBondContact O-N 2.98Å; Q405-T409 PolarHBondContact O-OG1 3.31Å; Q406-T409 PolarHBondContact O-N 2.87Å; T409-S412 PolarHBondContact O-N 2.8Å; T409-C413 PolarHBondContact O-N 3.22Å
410	F	80.8	Confident	77.3	Confident	32 Å²	32	81.3 Å²	81.3	14%	0.14	44%	0.44	C	S	.	.	H	α-helix	trans	-63	-44.2	175.6	-177.6	-93.4	0	0	0	111.9	Q406 S412 C413 F414 F438 V441 W442 A447	Q406-F410 WeakPolarHBondContact O-CB 3.25Å; Q406-F410 PolarHBondContact O-N 3.31Å; F410-S412 PolarHBondContact O-N 3.47Å; F410-C413 WeakPolarHBondContact O-CB 3.39Å; F410-C413 PolarHBondContact O-N 3.07Å; F410-F414 WeakPolarHBondContact O-CB 3.41Å; F410-F414 PolarHBondContact O-N 2.75Å; F410-F438 HydrophobicContact CE2-CD1 4.07Å; F410-F438 HydrophobicContact CZ-CB 4.43Å; F410-F438 AromaticContact CZ-CD1 3.75Å; F410-F438 HydrophobicContact CZ-CD1 3.75Å; F410-F438 WeakPolarHBondContact CZ-O 3.32Å; F410-V441 HydrophobicContact CE2-CG1 4.4Å; F410-W442 HydrophobicContact CB-CE3 3.69Å; F410-W442 HydrophobicContact CB-CH2 4.42Å; F410-W442 HydrophobicContact CB-CZ3 3.42Å; F410-W442 VanDerWaalsContact CB-CZ3 3.42Å; F410-W442 HydrophobicContact CD1-CB 4.39Å; F410-W442 AromaticContact CD1-CD2 3.72Å; F410-W442 HydrophobicContact CD1-CD2 3.72Å; F410-W442 AromaticContact CD1-CE3 3.17Å; F410-W442 HydrophobicContact CD1-CE3 3.17Å; F410-W442 HydrophobicContact CD1-CG 4.23Å; F410-W442 AromaticContact CD1-CZ3 3.8Å; F410-W442 HydrophobicContact CD1-CZ3 3.8Å; F410-W442 AromaticContact CD2-CE3 3.78Å; F410-W442 HydrophobicContact CD2-CE3 3.78Å; F410-W442 HydrophobicContact CD2-CZ3 4.28Å; F410-W442 HydrophobicContact CE1-CB 3.64Å; F410-W442 AromaticContact CE1-CD2 3.88Å; F410-W442 HydrophobicContact CE1-CD2 3.88Å; F410-W442 AromaticContact CE1-CE3 3.65Å; F410-W442 HydrophobicContact CE1-CE3 3.65Å; F410-W442 AromaticContact CE1-CG 3.89Å; F410-W442 HydrophobicContact CE1-CG 3.89Å; F410-W442 HydrophobicContact CE2-CB 4.48Å; F410-W442 HydrophobicContact CE2-CE3 4.18Å; F410-W442 HydrophobicContact CG-CD2 4.23Å; F410-W442 AromaticContact CG-CE3 3.24Å; F410-W442 HydrophobicContact CG-CE3 3.24Å; F410-W442 AromaticContact CG-CZ3 3.57Å; F410-W442 HydrophobicContact CG-CZ3 3.57Å; F410-W442 HydrophobicContact CZ-CB 3.69Å; F410-W442 HydrophobicContact CZ-CE3 4.12Å; F410-W442 HydrophobicContact CZ-CG 4.38Å; F410-A447 HydrophobicContact CD2-CB 3.56Å; F410-A447 HydrophobicContact CE2-CB 3.89Å; F410-A447 HydrophobicContact CG-CB 4.36Å
411	R	83.4	Confident	79.3	Confident	152 Å²	152	78 Å²	78	57%	0.574	42%	0.419	S	S	*	.	H	α-helix	trans	-62.6	-42	178.1	-175.4	168.3	-175.7	168.7	2.6	112	R407 S408 F414 D415	R407-R411 WeakPolarHBondContact O-CB 3.24Å; R407-R411 PolarHBondContact O-N 3.17Å; S408-R411 PolarHBondContact O-N 3.23Å; R411-F414 PolarHBondContact O-N 2.81Å; R411-D415 WeakPolarHBondContact O-CB 3.38Å; R411-D415 PolarHBondContact O-N 3.04Å
412	S	85.9	Confident	81.2	Confident	83 Å²	83	81.4 Å²	81.4	58%	0.58	43%	0.427	S	S	*	.	H	α-helix	trans	-60.6	-44.6	175	-175.9	0	0	0	0	111.8	S408 T409 F410 D415 G416	S408-S412 WeakPolarHBondContact O-CB 3.31Å; S408-S412 PolarHBondContact O-N 3.45Å; T409-S412 PolarHBondContact O-N 2.8Å; F410-S412 PolarHBondContact O-N 3.47Å; S412-D415 PolarHBondContact O-N 3.24Å; S412-G416 PolarHBondContact O-N 2.98Å
413	C	85.9	Confident	82.9	Confident	72 Å²	72	86.2 Å²	86.2	49%	0.486	44%	0.441	S	S	.	.	H	α-helix	trans	-60.7	-46.8	174	-175.9	0	0	0	0	111.5	T409 F410 D415 G416 V417	T409-C413 PolarHBondContact O-N 3.22Å; F410-C413 WeakPolarHBondContact O-CB 3.39Å; F410-C413 PolarHBondContact O-N 3.07Å; C413-D415 PolarHBondContact O-N 3.32Å; C413-G416 PolarHBondContact O-N 3.47Å; C413-V417 WeakPolarHBondContact O-CG2 3.5Å; C413-V417 PolarHBondContact O-N 3.27Å
414	F	87.6	Confident	84.6	Confident	30 Å²	30	87.9 Å²	87.9	13%	0.132	44%	0.44	C	S	.	.	H	α-helix	trans	-62.3	-43	179	-179.3	-120.2	0	0	0	112.9	F410 R411 G416 V417 K418 I435 F438	F410-F414 WeakPolarHBondContact O-CB 3.41Å; F410-F414 PolarHBondContact O-N 2.75Å; R411-F414 PolarHBondContact O-N 2.81Å; F414-G416 VanDerWaalsContact C-N 3.31Å; F414-V417 PolarHBondContact O-N 2.92Å; F414-K418 HydrophobicContact CD1-CD 4.32Å; F414-K418 HydrophobicContact CE1-CD 4.09Å; F414-K418 HydrophobicContact CZ-CD 4.35Å; F414-K418 WeakPolarHBondContact O-CG 3.31Å; F414-K418 PolarHBondContact O-N 2.84Å; F414-I435 HydrophobicContact CE2-CG1 4.26Å; F414-I435 HydrophobicContact CZ-CG1 4.23Å; F414-I435 HydrophobicContact CZ-CG2 4.16Å; F414-F438 HydrophobicContact CD2-CB 3.63Å; F414-F438 AromaticContact CD2-CD1 3.91Å; F414-F438 HydrophobicContact CD2-CD1 3.91Å; F414-F438 HydrophobicContact CD2-CD2 4.15Å; F414-F438 AromaticContact CD2-CG 3.63Å; F414-F438 HydrophobicContact CD2-CG 3.63Å; F414-F438 HydrophobicContact CE2-CB 3.58Å; F414-F438 HydrophobicContact CE2-CD2 4.4Å; F414-F438 HydrophobicContact CE2-CG 4Å
415	D	89.3	Confident	85.8	Confident	60 Å²	60	93.6 Å²	93.6	32%	0.321	46%	0.462	S	S	.	.	H	α-helix	trans	-65.9	-36.3	175.5	-68	-21.9	0	0	0	110.7	R411 S412 C413 K418 N419	R411-D415 WeakPolarHBondContact O-CB 3.38Å; R411-D415 PolarHBondContact O-N 3.04Å; S412-D415 PolarHBondContact O-N 3.24Å; C413-D415 PolarHBondContact O-N 3.32Å; D415-K418 PolarHBondContact O-N 3.11Å; D415-N419 WeakPolarHBondContact O-CB 3.49Å; D415-N419 VanDerWaalsContact O-CG 3.23Å; D415-N419 PolarHBondContact O-N 3.07Å; D415-N419 PolarHBondContact O-ND2 2.97Å
416	G	91.7	Very high	86.8	Confident	39 Å²	39	89.1 Å²	89.1	40%	0.402	44%	0.443	S	S	.	.	H	α-helix	trans	-59.8	-44.6	171	0	0	0	0	0	113.4	S412 C413 F414 N419 F420	S412-G416 PolarHBondContact O-N 2.98Å; C413-G416 PolarHBondContact O-N 3.47Å; F414-G416 VanDerWaalsContact C-N 3.31Å; G416-N419 PolarHBondContact O-N 3.42Å; G416-F420 PolarHBondContact O-N 3.47Å
417	V	91.2	Very high	88	Confident	42 Å²	42	88 Å²	88	26%	0.255	44%	0.441	S	S	.	.	H	α-helix	trans	-67.7	-38.8	176.6	176	0	0	0	0	111.6	C413 F414 F420 M421 V434 F438	C413-V417 WeakPolarHBondContact O-CG2 3.5Å; C413-V417 PolarHBondContact O-N 3.27Å; F414-V417 PolarHBondContact O-N 2.92Å; V417-F420 WeakPolarHBondContact O-CB 3.2Å; V417-F420 PolarHBondContact O-N 3.46Å; V417-M421 HydrophobicContact CG1-CE 4.22Å; V417-M421 WeakPolarHBondContact O-CG 3.49Å; V417-M421 PolarHBondContact O-N 3.35Å; V417-V434 HydrophobicContact CG1-CG1 3.96Å; V417-F438 HydrophobicContact CB-CE2 4.3Å; V417-F438 HydrophobicContact CB-CZ 4.39Å; V417-F438 HydrophobicContact CG1-CE2 3.95Å; V417-F438 HydrophobicContact CG1-CZ 4.47Å; V417-F438 HydrophobicContact CG2-CE2 4.15Å; V417-F438 HydrophobicContact CG2-CZ 3.83Å
418	K	90.7	Very high	88.8	Confident	66 Å²	66	86 Å²	86	29%	0.287	44%	0.44	S	S	.	.	H	α-helix	trans	-59.7	-49.9	173.3	-78.5	178.4	171.4	173.5	0	112.1	F414 D415 F420 M421 E422	F414-K418 HydrophobicContact CD1-CD 4.32Å; F414-K418 HydrophobicContact CE1-CD 4.09Å; F414-K418 HydrophobicContact CZ-CD 4.35Å; F414-K418 WeakPolarHBondContact O-CG 3.31Å; F414-K418 PolarHBondContact O-N 2.84Å; D415-K418 PolarHBondContact O-N 3.11Å; K418-F420 PolarHBondContact O-N 3.39Å; K418-M421 HydrophobicContact CG-CE 4.19Å; K418-M421 PolarHBondContact O-N 3.32Å; K418-M421 VanDerWaalsContact O-N 3.08Å; K418-E422 PolarHBondContact O-N 3.28Å
419	N	91.4	Very high	89.5	Confident	89 Å²	89	88.7 Å²	88.7	48%	0.476	45%	0.445	S	S	.	.	H	α-helix	trans	-57.5	-41.1	176.5	-71	-16.8	0	0	0	110.8	D415 G416 E422 M423	D415-N419 WeakPolarHBondContact O-CB 3.49Å; D415-N419 VanDerWaalsContact O-CG 3.23Å; D415-N419 PolarHBondContact O-N 3.07Å; D415-N419 PolarHBondContact O-ND2 2.97Å; G416-N419 PolarHBondContact O-N 3.42Å; N419-E422 PolarHBondContact O-N 2.99Å; N419-M423 WeakPolarHBondContact O-CB 3.34Å; N419-M423 VanDerWaalsContact O-CG 3.26Å; N419-M423 WeakPolarHBondContact O-CG 3.26Å; N419-M423 PolarHBondContact O-N 3.48Å
420	F	93.3	Very high	90.2	Very high	111 Å²	111	88.5 Å²	88.5	49%	0.487	44%	0.44	S	S	.	.	H	α-helix	trans	-61.4	-44	175.2	-177.2	-97	0	0	0	113	G416 V417 K418 E422 M423 R424	G416-F420 PolarHBondContact O-N 3.47Å; V417-F420 WeakPolarHBondContact O-CB 3.2Å; V417-F420 PolarHBondContact O-N 3.46Å; K418-F420 PolarHBondContact O-N 3.39Å; F420-E422 VanDerWaalsContact C-N 3.33Å; F420-E422 PolarHBondContact O-N 3.46Å; F420-M423 PolarHBondContact O-N 3.4Å; F420-R424 HydrophobicContact CD2-CG 4.45Å; F420-R424 HydrophobicContact CE1-CG 4.16Å; F420-R424 HydrophobicContact CE2-CG 4.08Å; F420-R424 HydrophobicContact CZ-CG 3.93Å; F420-R424 WeakPolarHBondContact O-CB 3.49Å; F420-R424 WeakPolarHBondContact O-CG 3.27Å; F420-R424 PolarHBondContact O-N 2.94Å
421	M	92.6	Very high	90.8	Very high	8 Å²	8	90.2 Å²	90.2	4%	0.039	45%	0.445	C	S	.	.	H	α-helix	trans	-65.3	-35.5	177.7	-71.1	-172.8	-66.3	0	0	112.8	V417 K418 K425 V426 R431 V434 I435	V417-M421 HydrophobicContact CG1-CE 4.22Å; V417-M421 WeakPolarHBondContact O-CG 3.49Å; V417-M421 PolarHBondContact O-N 3.35Å; K418-M421 HydrophobicContact CG-CE 4.19Å; K418-M421 PolarHBondContact O-N 3.32Å; K418-M421 VanDerWaalsContact O-N 3.08Å; M421-K425 PolarHBondContact O-N 3.36Å; M421-V426 HydrophobicContact CB-CB 4.26Å; M421-V426 HydrophobicContact CB-CG2 4.26Å; M421-V426 HydrophobicContact CG-CB 4.5Å; M421-V426 HydrophobicContact CG-CG2 4.35Å; M421-V426 PolarHBondContact O-N 3.07Å; M421-R431 HydrophobicContact CE-CG 3.86Å; M421-R431 HydrophobicContact SD-CB 4.19Å; M421-R431 HydrophobicContact SD-CG 3.9Å; M421-V434 HydrophobicContact CE-CB 4.47Å; M421-V434 HydrophobicContact CE-CG1 4.1Å; M421-V434 HydrophobicContact SD-CB 3.88Å; M421-V434 HydrophobicContact SD-CG1 3.87Å; M421-V434 HydrophobicContact SD-CG2 4.18Å; M421-I435 HydrophobicContact CE-CG1 4.38Å
422	E	90.6	Very high	91.2	Very high	119 Å²	119	89.6 Å²	89.6	56%	0.556	45%	0.447	S	S	*	.	H	α-helix	trans	-70.7	-48.6	175.8	-71.7	179.3	-177.2	0	0	111.5	K418 N419 F420 R424 K425	K418-E422 PolarHBondContact O-N 3.28Å; N419-E422 PolarHBondContact O-N 2.99Å; F420-E422 VanDerWaalsContact C-N 3.33Å; F420-E422 PolarHBondContact O-N 3.46Å; E422-R424 VanDerWaalsContact C-N 3.26Å; E422-R424 PolarHBondContact O-N 3.36Å; E422-K425 PolarHBondContact O-N 3.49Å
423	M	93.2	Very high	91.5	Very high	138 Å²	138	91.1 Å²	91.1	68%	0.68	44%	0.44	S	S	*	.	H	α-helix	trans	-58	-37.9	177.1	-74.6	-171.9	-63.7	0	0	112.5	N419 F420 K425	N419-M423 WeakPolarHBondContact O-CB 3.34Å; N419-M423 VanDerWaalsContact O-CG 3.26Å; N419-M423 WeakPolarHBondContact O-CG 3.26Å; N419-M423 PolarHBondContact O-N 3.48Å; F420-M423 PolarHBondContact O-N 3.4Å; M423-K425 VanDerWaalsContact C-N 3.34Å
424	R	94	Very high	91.8	Very high	179 Å²	179	89.5 Å²	89.5	68%	0.675	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	2.6	179.1	-65.2	-63.6	-171.7	-137.2	2.2	113.9	F420 E422 V426	F420-R424 HydrophobicContact CD2-CG 4.45Å; F420-R424 HydrophobicContact CE1-CG 4.16Å; F420-R424 HydrophobicContact CE2-CG 4.08Å; F420-R424 HydrophobicContact CZ-CG 3.93Å; F420-R424 WeakPolarHBondContact O-CB 3.49Å; F420-R424 WeakPolarHBondContact O-CG 3.27Å; F420-R424 PolarHBondContact O-N 2.94Å; E422-R424 VanDerWaalsContact C-N 3.26Å; E422-R424 PolarHBondContact O-N 3.36Å; R424-V426 HydrophobicContact CB-CG2 4.02Å; R424-V426 PolarHBondContact O-N 3.21Å
425	K	91.6	Very high	92	Very high	187 Å²	187	90.7 Å²	90.7	81%	0.813	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	45.1	-177.5	-61	-176.8	179.4	-179.3	0	112.8	M421 E422 M423	M421-K425 PolarHBondContact O-N 3.36Å; E422-K425 PolarHBondContact O-N 3.49Å; M423-K425 VanDerWaalsContact C-N 3.34Å
426	V	92.3	Very high	92.1	Very high	32 Å²	32	90.7 Å²	90.7	19%	0.194	44%	0.439	C	S	.	.			trans	-63.5	140	-179.6	177.7	0	0	0	0	110.5	M421 R424 L430 R431	M421-V426 HydrophobicContact CB-CB 4.26Å; M421-V426 HydrophobicContact CB-CG2 4.26Å; M421-V426 HydrophobicContact CG-CB 4.5Å; M421-V426 HydrophobicContact CG-CG2 4.35Å; M421-V426 PolarHBondContact O-N 3.07Å; R424-V426 HydrophobicContact CB-CG2 4.02Å; R424-V426 PolarHBondContact O-N 3.21Å; V426-L430 HydrophobicContact CG1-CB 3.87Å; V426-L430 HydrophobicContact CG1-CD2 3.69Å; V426-L430 HydrophobicContact CG1-CG 3.92Å; V426-R431 PolarHBondContact O-NH2 2.9Å
427	N	93.3	Very high	92.1	Very high	110 Å²	110	92.7 Å²	92.7	59%	0.588	44%	0.435	S	S	*	.			trans	-49.9	140.3	176.7	-174.8	3	0	0	0	111.4	E429 L430 R431	N427-E429 PolarHBondContact O-N 2.89Å; N427-E429 PolarHBondContact OD1-N 3.15Å; N427-L430 PolarHBondContact O-N 2.95Å; N427-R431 PolarHBondContact O-N 3.33Å
428	L	92	Very high	92	Very high	96 Å²	96	92 Å²	92	50%	0.503	43%	0.428	S	S	.	.	H	α-helix	trans	-58.9	-34	-177.6	-169.8	67.4	0	0	0	112.5	R431 K432	L428-R431 PolarHBondContact O-N 3.03Å; L428-K432 WeakPolarHBondContact O-CG 3.47Å; L428-K432 PolarHBondContact O-N 3.2Å
429	E	91.8	Very high	92	Very high	128 Å²	128	91.6 Å²	91.6	60%	0.598	43%	0.432	S	S	*	.	H	α-helix	trans	-65.1	-47.8	177.7	-171.1	179.9	178.3	0	0	112.1	N427 R431 K432 R433	N427-E429 PolarHBondContact O-N 2.89Å; N427-E429 PolarHBondContact OD1-N 3.15Å; E429-R431 VanDerWaalsContact C-N 3.32Å; E429-R431 PolarHBondContact O-N 2.82Å; E429-K432 PolarHBondContact O-N 2.91Å; E429-R433 PolarHBondContact O-N 3.06Å
430	L	92.4	Very high	91.9	Very high	86 Å²	86	88.7 Å²	88.7	45%	0.45	41%	0.414	S	S	.	.	H	α-helix	trans	-64.8	-38.9	176.7	-177.9	57.7	0	0	0	110.9	V426 N427 K432 R433 V434	V426-L430 HydrophobicContact CG1-CB 3.87Å; V426-L430 HydrophobicContact CG1-CD2 3.69Å; V426-L430 HydrophobicContact CG1-CG 3.92Å; N427-L430 PolarHBondContact O-N 2.95Å; L430-K432 PolarHBondContact O-N 3.27Å; L430-R433 PolarHBondContact O-N 2.91Å; L430-V434 HydrophobicContact CD1-CG2 4.27Å; L430-V434 HydrophobicContact CG-CG2 4.43Å; L430-V434 WeakPolarHBondContact O-CG2 3.33Å; L430-V434 PolarHBondContact O-N 3.45Å
431	R	91.7	Very high	91.6	Very high	67 Å²	67	84 Å²	84	25%	0.253	40%	0.395	S	S	.	.	H	α-helix	trans	-58.9	-45.9	174.9	-170.9	-177.1	-55	161.2	7.7	112.1	M421 V426 N427 L428 E429 V434 I435	M421-R431 HydrophobicContact CE-CG 3.86Å; M421-R431 HydrophobicContact SD-CB 4.19Å; M421-R431 HydrophobicContact SD-CG 3.9Å; V426-R431 PolarHBondContact O-NH2 2.9Å; N427-R431 PolarHBondContact O-N 3.33Å; L428-R431 PolarHBondContact O-N 3.03Å; E429-R431 VanDerWaalsContact C-N 3.32Å; E429-R431 PolarHBondContact O-N 2.82Å; R431-V434 PolarHBondContact O-N 2.92Å; R431-I435 HydrophobicContact CG-CD1 3.99Å; R431-I435 WeakPolarHBondContact O-CB 2.92Å; R431-I435 VanDerWaalsContact O-CG1 3.29Å; R431-I435 WeakPolarHBondContact O-CG1 3.26Å; R431-I435 PolarHBondContact O-N 3.44Å
432	K	92.1	Very high	91.2	Very high	140 Å²	140	87.9 Å²	87.9	61%	0.609	41%	0.409	S	S	*	.	H	α-helix	trans	-60.9	-42.9	176.1	-75.9	178.2	179.3	-177.9	0	111.6	L428 E429 L430 I435 S436	L428-K432 WeakPolarHBondContact O-CG 3.47Å; L428-K432 PolarHBondContact O-N 3.2Å; E429-K432 PolarHBondContact O-N 2.91Å; L430-K432 PolarHBondContact O-N 3.27Å; K432-I435 PolarHBondContact O-N 3.25Å; K432-S436 WeakPolarHBondContact O-CB 3.09Å; K432-S436 PolarHBondContact O-N 3.33Å
433	R	92.7	Very high	91	Very high	115 Å²	115	88.3 Å²	88.3	43%	0.434	41%	0.411	S	S	.	.	H	α-helix	trans	-62.4	-47.5	177	-73.1	175.6	63.9	-166	-1.4	112.4	E429 L430 I435 S436 W437 D504	E429-R433 PolarHBondContact O-N 3.06Å; L430-R433 PolarHBondContact O-N 2.91Å; R433-I435 PolarHBondContact O-N 3.37Å; R433-S436 PolarHBondContact O-N 2.86Å; R433-W437 PolarHBondContact O-N 3.39Å; R433-D504 IonicContact CZ-OD1 3.09Å; R433-D504 IonicContact NH2-OD1 2.68Å; R433-D504 PolarHBondContact NH2-OD1 3.19Å
434	V	92.5	Very high	90.4	Very high	38 Å²	38	85.2 Å²	85.2	23%	0.23	40%	0.395	C	S	.	.	H	α-helix	trans	-60.4	-46.2	177.6	172.5	0	0	0	0	110.9	V417 M421 L430 R431 S436 W437 F438	V417-V434 HydrophobicContact CG1-CG1 3.96Å; M421-V434 HydrophobicContact CE-CB 4.47Å; M421-V434 HydrophobicContact CE-CG1 4.1Å; M421-V434 HydrophobicContact SD-CB 3.88Å; M421-V434 HydrophobicContact SD-CG1 3.87Å; M421-V434 HydrophobicContact SD-CG2 4.18Å; L430-V434 HydrophobicContact CD1-CG2 4.27Å; L430-V434 HydrophobicContact CG-CG2 4.43Å; L430-V434 WeakPolarHBondContact O-CG2 3.33Å; L430-V434 PolarHBondContact O-N 3.45Å; R431-V434 PolarHBondContact O-N 2.92Å; V434-S436 PolarHBondContact O-N 2.79Å; V434-W437 PolarHBondContact O-N 2.59Å; V434-F438 HydrophobicContact CG1-CD2 3.77Å; V434-F438 HydrophobicContact CG1-CE2 3.89Å; V434-F438 WeakPolarHBondContact O-CD2 3.46Å; V434-F438 PolarHBondContact O-N 3.08Å
435	I	91.9	Very high	89.2	Confident	55 Å²	55	84.8 Å²	84.8	28%	0.282	40%	0.398	S	S	.	.	H	α-helix	trans	-60.6	-45.7	177.3	-70.7	168.9	0	0	0	111	F414 M421 R431 K432 R433 W437 F438 T439	F414-I435 HydrophobicContact CE2-CG1 4.26Å; F414-I435 HydrophobicContact CZ-CG1 4.23Å; F414-I435 HydrophobicContact CZ-CG2 4.16Å; M421-I435 HydrophobicContact CE-CG1 4.38Å; R431-I435 HydrophobicContact CG-CD1 3.99Å; R431-I435 WeakPolarHBondContact O-CB 2.92Å; R431-I435 VanDerWaalsContact O-CG1 3.29Å; R431-I435 WeakPolarHBondContact O-CG1 3.26Å; R431-I435 PolarHBondContact O-N 3.44Å; K432-I435 PolarHBondContact O-N 3.25Å; R433-I435 PolarHBondContact O-N 3.37Å; I435-W437 VanDerWaalsContact C-N 3.32Å; I435-W437 PolarHBondContact O-N 3.03Å; I435-F438 PolarHBondContact O-N 3.32Å; I435-T439 PolarHBondContact O-N 2.87Å; I435-T439 PolarHBondContact O-OG1 2.99Å
436	S	91.6	Very high	88.1	Confident	59 Å²	59	77.9 Å²	77.9	41%	0.413	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-40.2	178.3	-176.4	0	0	0	0	112.3	K432 R433 V434 T439 Y440	K432-S436 WeakPolarHBondContact O-CB 3.09Å; K432-S436 PolarHBondContact O-N 3.33Å; R433-S436 PolarHBondContact O-N 2.86Å; V434-S436 PolarHBondContact O-N 2.79Å; S436-T439 PolarHBondContact O-N 2.96Å; S436-Y440 PolarHBondContact O-N 2.98Å
437	W	92	Very high	86.5	Confident	82 Å²	82	78.5 Å²	78.5	31%	0.311	38%	0.377	S	S	.	.	H	α-helix	trans	-63.8	-47.6	174.9	179.5	90.6	0	0	0	111.9	R433 V434 I435 T439 Y440 V441 I499 F570	R433-W437 PolarHBondContact O-N 3.39Å; V434-W437 PolarHBondContact O-N 2.59Å; I435-W437 VanDerWaalsContact C-N 3.32Å; I435-W437 PolarHBondContact O-N 3.03Å; W437-T439 VanDerWaalsContact C-N 3.34Å; W437-T439 PolarHBondContact O-N 3.15Å; W437-Y440 WeakPolarHBondContact O-CB 3.41Å; W437-Y440 PolarHBondContact O-N 3.08Å; W437-V441 HydrophobicContact CD2-CG2 4.03Å; W437-V441 HydrophobicContact CE3-CG2 4.25Å; W437-V441 HydrophobicContact CH2-CG2 4.06Å; W437-V441 HydrophobicContact CZ2-CG2 3.84Å; W437-V441 HydrophobicContact CZ3-CG2 4.26Å; W437-V441 WeakPolarHBondContact O-CG2 3.37Å; W437-V441 PolarHBondContact O-N 3.31Å; W437-I499 PolarHBondContact NE1-O 3.21Å; W437-F570 HydrophobicContact CB-CE1 4.47Å
438	F	89.2	Confident	85.3	Confident	26 Å²	26	77.1 Å²	77.1	11%	0.114	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-42.3	176.7	-92.8	-81.7	0	0	0	112	F410 F414 V417 V434 I435 Y440 V441 W442	F410-F438 HydrophobicContact CE2-CD1 4.07Å; F410-F438 HydrophobicContact CZ-CB 4.43Å; F410-F438 AromaticContact CZ-CD1 3.75Å; F410-F438 HydrophobicContact CZ-CD1 3.75Å; F410-F438 WeakPolarHBondContact CZ-O 3.32Å; F414-F438 HydrophobicContact CD2-CB 3.63Å; F414-F438 AromaticContact CD2-CD1 3.91Å; F414-F438 HydrophobicContact CD2-CD1 3.91Å; F414-F438 HydrophobicContact CD2-CD2 4.15Å; F414-F438 AromaticContact CD2-CG 3.63Å; F414-F438 HydrophobicContact CD2-CG 3.63Å; F414-F438 HydrophobicContact CE2-CB 3.58Å; F414-F438 HydrophobicContact CE2-CD2 4.4Å; F414-F438 HydrophobicContact CE2-CG 4Å; V417-F438 HydrophobicContact CB-CE2 4.3Å; V417-F438 HydrophobicContact CB-CZ 4.39Å; V417-F438 HydrophobicContact CG1-CE2 3.95Å; V417-F438 HydrophobicContact CG1-CZ 4.47Å; V417-F438 HydrophobicContact CG2-CE2 4.15Å; V417-F438 HydrophobicContact CG2-CZ 3.83Å; V434-F438 HydrophobicContact CG1-CD2 3.77Å; V434-F438 HydrophobicContact CG1-CE2 3.89Å; V434-F438 WeakPolarHBondContact O-CD2 3.46Å; V434-F438 PolarHBondContact O-N 3.08Å; I435-F438 PolarHBondContact O-N 3.32Å; F438-Y440 VanDerWaalsContact C-N 3.34Å; F438-Y440 PolarHBondContact O-N 3.41Å; F438-V441 PolarHBondContact O-N 3.49Å; F438-W442 PolarHBondContact O-N 3.19Å
439	T	88.8	Confident	84.3	Confident	59 Å²	59	77.4 Å²	77.4	36%	0.362	37%	0.37	S	S	.	.	H	α-helix	trans	-60.3	-43.9	175.6	-59.2	0	0	0	0	111.5	I435 S436 W437 W442 E443	I435-T439 PolarHBondContact O-N 2.87Å; I435-T439 PolarHBondContact O-OG1 2.99Å; S436-T439 PolarHBondContact O-N 2.96Å; W437-T439 VanDerWaalsContact C-N 3.34Å; W437-T439 PolarHBondContact O-N 3.15Å; T439-W442 WeakPolarHBondContact O-CB 3.39Å; T439-W442 PolarHBondContact O-N 3.44Å; T439-E443 HydrophobicContact CG2-CG 4.43Å; T439-E443 WeakPolarHBondContact CG2-OE1 3.43Å; T439-E443 WeakPolarHBondContact O-CG 3.35Å; T439-E443 PolarHBondContact O-N 3.25Å
440	Y	89.8	Confident	83.6	Confident	28 Å²	28	75 Å²	75	11%	0.11	36%	0.359	C	S	.	.	H	α-helix	trans	-61.8	-45.3	177.4	-178.9	-94.8	0	0	0	112.5	S436 W437 F438 W442 E443 Q444 I499 F570	S436-Y440 PolarHBondContact O-N 2.98Å; W437-Y440 WeakPolarHBondContact O-CB 3.41Å; W437-Y440 PolarHBondContact O-N 3.08Å; F438-Y440 VanDerWaalsContact C-N 3.34Å; F438-Y440 PolarHBondContact O-N 3.41Å; Y440-W442 VanDerWaalsContact C-N 3.27Å; Y440-W442 PolarHBondContact O-N 3.47Å; Y440-E443 PolarHBondContact O-N 3.05Å; Y440-Q444 HydrophobicContact CD1-CG 4.28Å; Y440-Q444 HydrophobicContact CD2-CG 4.27Å; Y440-Q444 HydrophobicContact CE1-CG 3.85Å; Y440-Q444 HydrophobicContact CE2-CG 3.85Å; Y440-Q444 HydrophobicContact CG-CG 4.48Å; Y440-Q444 WeakPolarHBondContact O-CG 3.23Å; Y440-Q444 PolarHBondContact O-N 3.28Å; Y440-I499 HydrophobicContact CD1-CG2 3.89Å; Y440-I499 HydrophobicContact CE1-CG2 3.79Å; Y440-F570 HydrophobicContact CD1-CB 4.22Å; Y440-F570 AromaticContact CD1-CD1 3.77Å; Y440-F570 HydrophobicContact CD1-CD1 3.77Å; Y440-F570 HydrophobicContact CD1-CE1 4.37Å; Y440-F570 HydrophobicContact CD1-CG 4.04Å; Y440-F570 HydrophobicContact CD2-CB 3.95Å; Y440-F570 HydrophobicContact CD2-CD1 4.12Å; Y440-F570 AromaticContact CD2-CD2 3.77Å; Y440-F570 HydrophobicContact CD2-CD2 3.77Å; Y440-F570 HydrophobicContact CD2-CE2 4.3Å; Y440-F570 AromaticContact CD2-CG 3.67Å; Y440-F570 HydrophobicContact CD2-CG 3.67Å; Y440-F570 HydrophobicContact CE1-CB 3.86Å; Y440-F570 HydrophobicContact CE1-CD1 4.21Å; Y440-F570 HydrophobicContact CE1-CG 4.2Å; Y440-F570 HydrophobicContact CE2-CB 3.54Å; Y440-F570 HydrophobicContact CE2-CD2 4.13Å; Y440-F570 AromaticContact CE2-CG 3.83Å; Y440-F570 HydrophobicContact CE2-CG 3.83Å; Y440-F570 HydrophobicContact CG-CB 4.25Å; Y440-F570 AromaticContact CG-CD1 3.71Å; Y440-F570 HydrophobicContact CG-CD1 3.71Å; Y440-F570 HydrophobicContact CG-CD2 4.14Å; Y440-F570 HydrophobicContact CG-CE1 4.06Å; Y440-F570 HydrophobicContact CG-CE2 4.45Å; Y440-F570 AromaticContact CG-CG 3.76Å; Y440-F570 HydrophobicContact CG-CG 3.76Å; Y440-F570 HydrophobicContact CG-CZ 4.41Å; Y440-F570 VanDerWaalsContact CZ-CB 3.49Å
441	V	87.8	Confident	82.9	Confident	13 Å²	13	76.1 Å²	76.1	8%	0.079	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-39.1	177.3	173.2	0	0	0	0	111.3	F410 W437 F438 K445 H446 I499	F410-V441 HydrophobicContact CE2-CG1 4.4Å; W437-V441 HydrophobicContact CD2-CG2 4.03Å; W437-V441 HydrophobicContact CE3-CG2 4.25Å; W437-V441 HydrophobicContact CH2-CG2 4.06Å; W437-V441 HydrophobicContact CZ2-CG2 3.84Å; W437-V441 HydrophobicContact CZ3-CG2 4.26Å; W437-V441 WeakPolarHBondContact O-CG2 3.37Å; W437-V441 PolarHBondContact O-N 3.31Å; F438-V441 PolarHBondContact O-N 3.49Å; V441-K445 PolarHBondContact O-N 3.4Å; V441-H446 HydrophobicContact CG1-CB 4.24Å; V441-H446 PolarHBondContact O-N 2.86Å; V441-I499 HydrophobicContact CG2-CD1 4.03Å
442	W	84.7	Confident	82.3	Confident	89 Å²	89	75.6 Å²	75.6	34%	0.337	38%	0.376	S	S	.	.	H	α-helix	trans	-66.1	-47.5	176.7	-177.3	-107	0	0	0	112.5	R407 F410 F438 T439 Y440 K445 A447	R407-W442 HydrophobicContact CB-CH2 3.46Å; R407-W442 VanDerWaalsContact CB-CH2 3.46Å; R407-W442 HydrophobicContact CB-CZ2 3.74Å; R407-W442 HydrophobicContact CG-CH2 3.77Å; R407-W442 HydrophobicContact CG-CZ2 3.57Å; F410-W442 HydrophobicContact CB-CE3 3.69Å; F410-W442 HydrophobicContact CB-CH2 4.42Å; F410-W442 HydrophobicContact CB-CZ3 3.42Å; F410-W442 VanDerWaalsContact CB-CZ3 3.42Å; F410-W442 HydrophobicContact CD1-CB 4.39Å; F410-W442 AromaticContact CD1-CD2 3.72Å; F410-W442 HydrophobicContact CD1-CD2 3.72Å; F410-W442 AromaticContact CD1-CE3 3.17Å; F410-W442 HydrophobicContact CD1-CE3 3.17Å; F410-W442 HydrophobicContact CD1-CG 4.23Å; F410-W442 AromaticContact CD1-CZ3 3.8Å; F410-W442 HydrophobicContact CD1-CZ3 3.8Å; F410-W442 AromaticContact CD2-CE3 3.78Å; F410-W442 HydrophobicContact CD2-CE3 3.78Å; F410-W442 HydrophobicContact CD2-CZ3 4.28Å; F410-W442 HydrophobicContact CE1-CB 3.64Å; F410-W442 AromaticContact CE1-CD2 3.88Å; F410-W442 HydrophobicContact CE1-CD2 3.88Å; F410-W442 AromaticContact CE1-CE3 3.65Å; F410-W442 HydrophobicContact CE1-CE3 3.65Å; F410-W442 AromaticContact CE1-CG 3.89Å; F410-W442 HydrophobicContact CE1-CG 3.89Å; F410-W442 HydrophobicContact CE2-CB 4.48Å; F410-W442 HydrophobicContact CE2-CE3 4.18Å; F410-W442 HydrophobicContact CG-CD2 4.23Å; F410-W442 AromaticContact CG-CE3 3.24Å; F410-W442 HydrophobicContact CG-CE3 3.24Å; F410-W442 AromaticContact CG-CZ3 3.57Å; F410-W442 HydrophobicContact CG-CZ3 3.57Å; F410-W442 HydrophobicContact CZ-CB 3.69Å; F410-W442 HydrophobicContact CZ-CE3 4.12Å; F410-W442 HydrophobicContact CZ-CG 4.38Å; F438-W442 PolarHBondContact O-N 3.19Å; T439-W442 WeakPolarHBondContact O-CB 3.39Å; T439-W442 PolarHBondContact O-N 3.44Å; Y440-W442 VanDerWaalsContact C-N 3.27Å; Y440-W442 PolarHBondContact O-N 3.47Å; W442-K445 PolarHBondContact O-N 2.96Å; W442-A447 HydrophobicContact CE3-CB 4.03Å; W442-A447 HydrophobicContact CZ3-CB 4.28Å
443	E	84.8	Confident	81.7	Confident	127 Å²	127	72.5 Å²	72.5	59%	0.593	37%	0.369	S	S	*	.	H	α-helix	trans	-66.2	-39.9	-177.5	-73.9	174.2	-179.3	0	0	112.8	T439 Y440 K445	T439-E443 HydrophobicContact CG2-CG 4.43Å; T439-E443 WeakPolarHBondContact CG2-OE1 3.43Å; T439-E443 WeakPolarHBondContact O-CG 3.35Å; T439-E443 PolarHBondContact O-N 3.25Å; Y440-E443 PolarHBondContact O-N 3.05Å; E443-K445 PolarHBondContact O-N 3.32Å
444	Q	80.8	Confident	81.1	Confident	74 Å²	74	68.5 Å²	68.5	35%	0.346	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	4.1	178	-61.7	-61.7	-46.4	0	0	113.4	Y440 H446	Y440-Q444 HydrophobicContact CD1-CG 4.28Å; Y440-Q444 HydrophobicContact CD2-CG 4.27Å; Y440-Q444 HydrophobicContact CE1-CG 3.85Å; Y440-Q444 HydrophobicContact CE2-CG 3.85Å; Y440-Q444 HydrophobicContact CG-CG 4.48Å; Y440-Q444 WeakPolarHBondContact O-CG 3.23Å; Y440-Q444 PolarHBondContact O-N 3.28Å; Q444-H446 WeakPolarHBondContact CB-CD2 3.35Å; Q444-H446 PolarHBondContact O-N 3.1Å
445	K	69.8	Low	80.6	Confident	169 Å²	169	70.5 Å²	70.5	74%	0.735	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	18.3	-178.7	-56.5	-177.5	-179.9	179.7	0	114.9	V441 W442 E443 A447	V441-K445 PolarHBondContact O-N 3.4Å; W442-K445 PolarHBondContact O-N 2.96Å; E443-K445 PolarHBondContact O-N 3.32Å; K445-A447 PolarHBondContact O-N 3.37Å
446	H	67.7	Low	80	Confident	43 Å²	43	75.7 Å²	75.7	20%	0.199	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	2.9	174.8	-67.4	-52.2	0	0	0	113.2	V441 Q444 I448 I499 E572	V441-H446 HydrophobicContact CG1-CB 4.24Å; V441-H446 PolarHBondContact O-N 2.86Å; Q444-H446 WeakPolarHBondContact CB-CD2 3.35Å; Q444-H446 PolarHBondContact O-N 3.1Å; H446-I448 PolarHBondContact O-N 3.14Å; H446-I499 HydrophobicContact CB-CD1 3.99Å; H446-E572 IonicContact CD2-OE1 3.55Å; H446-E572 IonicContact CE1-OE2 3.8Å; H446-E572 VanDerWaalsContact NE2-CD 3.32Å; H446-E572 IonicContact NE2-OE1 2.63Å; H446-E572 PolarHBondContact NE2-OE1 3.49Å; H446-E572 IonicContact NE2-OE2 3.57Å; H446-E572 PolarHBondContact NE2-OE2 3.26Å
447	A	59.3	Low	79.7	Confident	44 Å²	44	75.5 Å²	75.5	36%	0.364	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-4.8	175.5	0	0	0	0	0	113.9	F410 W442 K445	F410-A447 HydrophobicContact CD2-CB 3.56Å; F410-A447 HydrophobicContact CE2-CB 3.89Å; F410-A447 HydrophobicContact CG-CB 4.36Å; W442-A447 HydrophobicContact CE3-CB 4.03Å; W442-A447 HydrophobicContact CZ3-CB 4.28Å; K445-A447 PolarHBondContact O-N 3.37Å
448	I	67.9	Low	79.6	Confident	82 Å²	82	74.1 Å²	74.1	42%	0.421	40%	0.396	S	S	.	.	S	Bend	trans	-82.6	127.4	175.3	-56.8	173.8	0	0	0	108.1	H446 E450 V453	H446-I448 PolarHBondContact O-N 3.14Å; I448-E450 PolarHBondContact O-N 3.47Å; I448-V453 HydrophobicContact CG2-CG2 3.69Å
449	N	71.3	Confident	79.4	Confident	101 Å²	101	77.7 Å²	77.7	54%	0.54	42%	0.416	S	S	.	.			trans	-71.3	92.7	175.5	-171.2	-8.5	0	0	0	109.5	D451 A452 V453	N449-D451 PolarHBondContact O-N 3.37Å; N449-D451 PolarHBondContact OD1-N 3.19Å; N449-A452 HydrophobicContact CB-CB 4.03Å; N449-A452 PolarHBondContact O-N 3.41Å; N449-A452 VanDerWaalsContact O-N 3.13Å; N449-V453 PolarHBondContact O-N 3.38Å; N449-V453 VanDerWaalsContact O-N 3.15Å
450	E	77	Confident	79.3	Confident	77 Å²	77	79.7 Å²	79.7	36%	0.36	42%	0.424	S	S	.	.	H	α-helix	trans	-54.2	-41.3	-178	-68	-172.8	170.9	0	0	111.4	I448 A452 V453 M454	I448-E450 PolarHBondContact O-N 3.47Å; E450-A452 VanDerWaalsContact C-N 3.33Å; E450-A452 PolarHBondContact O-N 3.47Å; E450-V453 PolarHBondContact O-N 3.29Å; E450-M454 WeakPolarHBondContact O-CB 3.45Å; E450-M454 WeakPolarHBondContact O-CG 3.36Å; E450-M454 PolarHBondContact O-N 2.93Å
451	D	78.4	Confident	79.3	Confident	111 Å²	111	80 Å²	80	59%	0.594	43%	0.428	S	S	*	.	H	α-helix	trans	-61	-40.9	179.5	-68.5	-30.2	0	0	0	112.1	N449 A455	N449-D451 PolarHBondContact O-N 3.37Å; N449-D451 PolarHBondContact OD1-N 3.19Å; D451-A455 VanDerWaalsContact O-CB 3.28Å; D451-A455 WeakPolarHBondContact O-CB 3.31Å; D451-A455 PolarHBondContact O-N 2.98Å
452	A	78	Confident	79.3	Confident	56 Å²	56	84.1 Å²	84.1	46%	0.463	44%	0.442	S	S	.	.	H	α-helix	trans	-69.7	-36.5	178.5	0	0	0	0	0	112.1	N449 E450 M456	N449-A452 HydrophobicContact CB-CB 4.03Å; N449-A452 PolarHBondContact O-N 3.41Å; N449-A452 VanDerWaalsContact O-N 3.13Å; E450-A452 VanDerWaalsContact C-N 3.33Å; E450-A452 PolarHBondContact O-N 3.47Å; A452-M456 PolarHBondContact O-N 3.4Å
453	V	79.1	Confident	79.3	Confident	75 Å²	75	81.2 Å²	81.2	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-69.4	-44.6	175.5	177.5	0	0	0	0	110.5	I448 N449 E450 A455 M456	I448-V453 HydrophobicContact CG2-CG2 3.69Å; N449-V453 PolarHBondContact O-N 3.38Å; N449-V453 VanDerWaalsContact O-N 3.15Å; E450-V453 PolarHBondContact O-N 3.29Å; V453-A455 VanDerWaalsContact C-N 3.29Å; V453-A455 PolarHBondContact O-N 2.97Å; V453-M456 WeakPolarHBondContact O-CB 3.31Å; V453-M456 PolarHBondContact O-N 2.98Å
454	M	80.2	Confident	79.5	Confident	31 Å²	31	79.5 Å²	79.5	15%	0.153	43%	0.426	C	S	.	.	H	α-helix	trans	-64.3	-32.8	178.2	-70.8	-66.9	-178.9	0	0	112.4	E450 M456 L457 R462 L465 L469	E450-M454 WeakPolarHBondContact O-CB 3.45Å; E450-M454 WeakPolarHBondContact O-CG 3.36Å; E450-M454 PolarHBondContact O-N 2.93Å; M454-M456 VanDerWaalsContact C-N 3.3Å; M454-M456 PolarHBondContact O-N 2.93Å; M454-L457 PolarHBondContact O-N 3.45Å; M454-L457 HydrophobicContact SD-CD1 4.42Å; M454-R462 HydrophobicContact CB-CG 4.22Å; M454-R462 WeakPolarHBondContact O-CD 3.4Å; M454-R462 HydrophobicContact SD-CG 4.1Å; M454-L465 HydrophobicContact CE-CD2 3.64Å; M454-L465 HydrophobicContact CE-CG 3.83Å; M454-L465 HydrophobicContact SD-CD2 3.8Å; M454-L465 HydrophobicContact SD-CG 4.33Å; M454-L469 HydrophobicContact CE-CD1 3.54Å
455	A	83.1	Confident	79.9	Confident	79 Å²	79	79.1 Å²	79.1	65%	0.653	43%	0.426	S	S	*	.	H	α-helix	trans	-70.9	-21.9	176.5	0	0	0	0	0	113.8	D451 V453 L457	D451-A455 VanDerWaalsContact O-CB 3.28Å; D451-A455 WeakPolarHBondContact O-CB 3.31Å; D451-A455 PolarHBondContact O-N 2.98Å; V453-A455 VanDerWaalsContact C-N 3.29Å; V453-A455 PolarHBondContact O-N 2.97Å; A455-L457 VanDerWaalsContact C-N 3.31Å
456	M	79	Confident	80.7	Confident	164 Å²	164	71.2 Å²	71.2	81%	0.808	39%	0.393	S	S	*	.	H	α-helix	trans	-76.6	-20.6	175.9	-169.6	66.1	-162.5	0	0	112.3	A452 V453 M454	A452-M456 PolarHBondContact O-N 3.4Å; V453-M456 WeakPolarHBondContact O-CB 3.31Å; V453-M456 PolarHBondContact O-N 2.98Å; M454-M456 VanDerWaalsContact C-N 3.3Å; M454-M456 PolarHBondContact O-N 2.93Å
457	L	86.2	Confident	81.6	Confident	56 Å²	56	71.6 Å²	71.6	29%	0.293	40%	0.395	S	S	.	.	S	Bend	trans	-87.9	141.5	-176.5	-63.6	171	0	0	0	111.4	M454 A455 L461 R462 L465	M454-L457 PolarHBondContact O-N 3.45Å; M454-L457 HydrophobicContact SD-CD1 4.42Å; A455-L457 VanDerWaalsContact C-N 3.31Å; L457-L461 HydrophobicContact CB-CB 4.45Å; L457-R462 HydrophobicContact CB-CB 4.43Å; L457-L465 HydrophobicContact CD1-CD2 3.66Å
458	P	88.9	Confident	83	Confident	53 Å²	53	72.7 Å²	72.7	34%	0.344	40%	0.404	S	S	.	.			trans	-54.2	149.7	166	-23.6	31.6	0	0	0	112.1	L79 N460 L461 R462	L79-P458 HydrophobicContact CB-CG 4.21Å; L79-P458 HydrophobicContact CD1-CG 4.11Å; L79-P458 HydrophobicContact CD2-CG 4.23Å; L79-P458 HydrophobicContact CG-CG 4.43Å; P458-N460 VanDerWaalsContact C-N 3.3Å; P458-N460 PolarHBondContact O-N 3.4Å; P458-N460 VanDerWaalsContact O-N 3.16Å; P458-L461 HydrophobicContact CG-CD1 4.37Å; P458-L461 PolarHBondContact O-N 3.45Å; P458-R462 PolarHBondContact O-N 2.84Å
459	L	85.6	Confident	83.7	Confident	100 Å²	100	72.9 Å²	72.9	52%	0.524	41%	0.406	S	S	.	.	H	α-helix	trans	-50	-46.2	-174.9	179.3	61.9	0	0	0	113.1	L461 R462 T463	L459-L461 PolarHBondContact O-N 3.42Å; L459-R462 WeakPolarHBondContact O-CB 3.49Å; L459-R462 PolarHBondContact O-N 2.87Å; L459-T463 PolarHBondContact O-N 3.26Å; L459-T463 PolarHBondContact O-OG1 3.42Å
460	N	87	Confident	84.4	Confident	102 Å²	102	68.7 Å²	68.7	55%	0.545	38%	0.383	S	S	.	.	H	α-helix	trans	-60.4	-43.9	-178.7	-65.2	-11.7	0	0	0	112.2	P458 T463 Q464	P458-N460 VanDerWaalsContact C-N 3.3Å; P458-N460 PolarHBondContact O-N 3.4Å; P458-N460 VanDerWaalsContact O-N 3.16Å; N460-T463 PolarHBondContact O-N 2.77Å; N460-Q464 WeakPolarHBondContact O-CG 3.25Å; N460-Q464 PolarHBondContact O-N 2.98Å
461	L	89.6	Confident	84.7	Confident	35 Å²	35	67 Å²	67	18%	0.183	38%	0.376	C	S	.	.	H	α-helix	trans	-71.8	-37.5	179	-67.5	179.6	0	0	0	111.5	L79 L457 P458 L459 T463 Q464 L465	L79-L461 HydrophobicContact CD2-CD1 3.4Å; L457-L461 HydrophobicContact CB-CB 4.45Å; P458-L461 HydrophobicContact CG-CD1 4.37Å; P458-L461 PolarHBondContact O-N 3.45Å; L459-L461 PolarHBondContact O-N 3.42Å; L461-T463 VanDerWaalsContact C-N 3.31Å; L461-T463 PolarHBondContact O-N 2.76Å; L461-Q464 PolarHBondContact O-N 2.86Å; L461-L465 VanDerWaalsContact O-CB 3.24Å; L461-L465 WeakPolarHBondContact O-CB 3.26Å; L461-L465 PolarHBondContact O-N 2.66Å
462	R	87.1	Confident	85.1	Confident	98 Å²	98	71.2 Å²	71.2	37%	0.37	38%	0.384	S	S	.	.	H	α-helix	trans	-58.3	-45.4	172.7	-172.8	177.7	69.3	165.8	2.5	111	M454 L457 P458 L459 L465 A466 L493	M454-R462 HydrophobicContact CB-CG 4.22Å; M454-R462 WeakPolarHBondContact O-CD 3.4Å; M454-R462 HydrophobicContact SD-CG 4.1Å; L457-R462 HydrophobicContact CB-CB 4.43Å; P458-R462 PolarHBondContact O-N 2.84Å; L459-R462 WeakPolarHBondContact O-CB 3.49Å; L459-R462 PolarHBondContact O-N 2.87Å; R462-L465 PolarHBondContact O-N 3.22Å; R462-A466 VanDerWaalsContact O-CB 3.25Å; R462-A466 WeakPolarHBondContact O-CB 3.23Å; R462-A466 PolarHBondContact O-N 2.71Å; R462-L493 HydrophobicContact CG-CD2 4.11Å
463	T	85.6	Confident	85.4	Confident	29 Å²	29	69.1 Å²	69.1	18%	0.178	37%	0.365	C	S	.	.	H	α-helix	trans	-63.1	-49.2	177	-57.6	0	0	0	0	111.6	L459 N460 L461 L465 A466 I467 T489 L493	L459-T463 PolarHBondContact O-N 3.26Å; L459-T463 PolarHBondContact O-OG1 3.42Å; N460-T463 PolarHBondContact O-N 2.77Å; L461-T463 VanDerWaalsContact C-N 3.31Å; L461-T463 PolarHBondContact O-N 2.76Å; T463-L465 VanDerWaalsContact C-N 3.34Å; T463-L465 PolarHBondContact O-N 2.74Å; T463-A466 PolarHBondContact O-N 3.43Å; T463-I467 HydrophobicContact CG2-CD1 3.99Å; T463-I467 VanDerWaalsContact O-CG1 3.23Å; T463-I467 WeakPolarHBondContact O-CG1 3.43Å; T463-I467 PolarHBondContact O-N 2.9Å; T463-T489 HydrophobicContact CG2-CG2 3.25Å; T463-L493 HydrophobicContact CG2-CD1 4.28Å
464	Q	88	Confident	85.8	Confident	90 Å²	90	65.6 Å²	65.6	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-42.4	178.6	-72.8	179.6	7.5	0	0	112.3	N460 L461 I467 A468	N460-Q464 WeakPolarHBondContact O-CG 3.25Å; N460-Q464 PolarHBondContact O-N 2.98Å; L461-Q464 PolarHBondContact O-N 2.86Å; Q464-I467 PolarHBondContact O-N 3.35Å; Q464-A468 WeakPolarHBondContact O-CB 3.46Å; Q464-A468 PolarHBondContact O-N 3.5Å
465	L	88.8	Confident	86	Confident	66 Å²	66	70.4 Å²	70.4	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-66.8	-44.7	178.1	-175.9	60.1	0	0	0	111.5	M454 L457 L461 R462 T463 I467 A468 L469	M454-L465 HydrophobicContact CE-CD2 3.64Å; M454-L465 HydrophobicContact CE-CG 3.83Å; M454-L465 HydrophobicContact SD-CD2 3.8Å; M454-L465 HydrophobicContact SD-CG 4.33Å; L457-L465 HydrophobicContact CD1-CD2 3.66Å; L461-L465 VanDerWaalsContact O-CB 3.24Å; L461-L465 WeakPolarHBondContact O-CB 3.26Å; L461-L465 PolarHBondContact O-N 2.66Å; R462-L465 PolarHBondContact O-N 3.22Å; T463-L465 VanDerWaalsContact C-N 3.34Å; T463-L465 PolarHBondContact O-N 2.74Å; L465-I467 VanDerWaalsContact C-N 3.34Å; L465-I467 PolarHBondContact O-N 2.63Å; L465-A468 PolarHBondContact O-N 3.1Å; L465-A468 VanDerWaalsContact O-N 3.16Å; L465-L469 HydrophobicContact CD1-CD1 4.3Å; L465-L469 HydrophobicContact CD1-CG 4.29Å; L465-L469 HydrophobicContact CG-CD1 4.06Å; L465-L469 HydrophobicContact CG-CG 4.46Å; L465-L469 VanDerWaalsContact O-CG 3.29Å; L465-L469 WeakPolarHBondContact O-CG 3.44Å; L465-L469 PolarHBondContact O-N 3.36Å
466	A	87.1	Confident	86	Confident	4 Å²	4	71.7 Å²	71.7	3%	0.033	36%	0.355	C	S	.	.	H	α-helix	trans	-60.6	-43	176.4	0	0	0	0	0	111.9	R462 T463 L469 H470 L493	R462-A466 VanDerWaalsContact O-CB 3.25Å; R462-A466 WeakPolarHBondContact O-CB 3.23Å; R462-A466 PolarHBondContact O-N 2.71Å; T463-A466 PolarHBondContact O-N 3.43Å; A466-L469 PolarHBondContact O-N 2.9Å; A466-H470 WeakPolarHBondContact O-CB 3.46Å; A466-H470 PolarHBondContact O-CD2 3.3Å; A466-H470 PolarHBondContact O-N 3.31Å; A466-L493 HydrophobicContact CB-CD2 3.77Å; A466-L493 HydrophobicContact CB-CG 4.36Å
467	I	87.2	Confident	86.2	Confident	50 Å²	50	63.9 Å²	63.9	26%	0.256	32%	0.316	S	S	.	.	H	α-helix	trans	-59.1	-51.8	172.5	-66	164.3	0	0	0	109.2	T463 Q464 L465 L469 H470 I471 T489	T463-I467 HydrophobicContact CG2-CD1 3.99Å; T463-I467 VanDerWaalsContact O-CG1 3.23Å; T463-I467 WeakPolarHBondContact O-CG1 3.43Å; T463-I467 PolarHBondContact O-N 2.9Å; Q464-I467 PolarHBondContact O-N 3.35Å; L465-I467 VanDerWaalsContact C-N 3.34Å; L465-I467 PolarHBondContact O-N 2.63Å; I467-L469 PolarHBondContact O-N 2.97Å; I467-H470 PolarHBondContact O-N 3.46Å; I467-I471 HydrophobicContact CG2-CB 4.02Å; I467-I471 HydrophobicContact CG2-CD1 4.44Å; I467-I471 HydrophobicContact CG2-CG1 4.29Å; I467-I471 HydrophobicContact CG2-CG2 4.44Å; I467-I471 WeakPolarHBondContact O-CB 3.29Å; I467-I471 WeakPolarHBondContact O-CG2 3.4Å; I467-I471 PolarHBondContact O-N 3.23Å; I467-T489 HydrophobicContact CD1-CG2 3.69Å; I467-T489 HydrophobicContact CG1-CG2 4Å
468	A	87.6	Confident	85.7	Confident	67 Å²	67	64.1 Å²	64.1	55%	0.554	32%	0.323	S	S	*	.	H	α-helix	trans	-57.5	-37.3	-177.9	0	0	0	0	0	112.9	Q464 L465	Q464-A468 WeakPolarHBondContact O-CB 3.46Å; Q464-A468 PolarHBondContact O-N 3.5Å; L465-A468 PolarHBondContact O-N 3.1Å; L465-A468 VanDerWaalsContact O-N 3.16Å
469	L	84	Confident	85.1	Confident	86 Å²	86	62.5 Å²	62.5	45%	0.45	31%	0.311	S	S	.	.	H	α-helix	trans	-74.5	-43.6	178.9	-69	173.1	0	0	0	113.1	M454 L465 A466 I467	M454-L469 HydrophobicContact CE-CD1 3.54Å; L465-L469 HydrophobicContact CD1-CD1 4.3Å; L465-L469 HydrophobicContact CD1-CG 4.29Å; L465-L469 HydrophobicContact CG-CD1 4.06Å; L465-L469 HydrophobicContact CG-CG 4.46Å; L465-L469 VanDerWaalsContact O-CG 3.29Å; L465-L469 WeakPolarHBondContact O-CG 3.44Å; L465-L469 PolarHBondContact O-N 3.36Å; A466-L469 PolarHBondContact O-N 2.9Å; I467-L469 PolarHBondContact O-N 2.97Å
470	H	85.4	Confident	84.9	Confident	13 Å²	13	57.8 Å²	57.8	6%	0.06	29%	0.286	C	S	.	.	H	α-helix	trans	-103.1	-19	-168.1	-56.1	-55.3	0	0	0	114.7	A466 I467 R472 T473 L474 A492 L495 F574	A466-H470 WeakPolarHBondContact O-CB 3.46Å; A466-H470 PolarHBondContact O-CD2 3.3Å; A466-H470 PolarHBondContact O-N 3.31Å; I467-H470 PolarHBondContact O-N 3.46Å; H470-R472 VanDerWaalsContact C-N 3.27Å; H470-R472 PolarHBondContact O-N 3.12Å; H470-R472 VanDerWaalsContact O-N 3.15Å; H470-T473 PolarHBondContact O-N 3.3Å; H470-T473 VanDerWaalsContact O-N 3.1Å; H470-L474 HydrophobicContact CB-CD1 4.13Å; H470-L474 PolarHBondContact O-N 3.34Å; H470-A492 HydrophobicContact CB-CB 4.17Å; H470-A492 PolarHBondContact CD2-O 3.23Å; H470-A492 VanDerWaalsContact CD2-O 3.28Å; H470-L495 HydrophobicContact CB-CD1 4.09Å; H470-F574 AromaticContact CE1-CE1 3.3Å; H470-F574 WeakPolarHBondContact CE1-CE1 3.35Å; H470-F574 AromaticContact CE1-CZ 3.55Å; H470-F574 AromaticContact ND1-CE1 3.29Å; H470-F574 VanDerWaalsContact ND1-CE1 3.29Å; H470-F574 WeakPolarHBondContact ND1-CE1 3.15Å; H470-F574 AromaticContact ND1-CE2 3.7Å; H470-F574 AromaticContact ND1-CZ 3.09Å; H470-F574 WeakPolarHBondContact ND1-CZ 3.16Å
471	I	83.9	Confident	84.4	Confident	42 Å²	42	59 Å²	59	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-59.8	-34.4	-169.7	-166.5	61.8	0	0	0	113.4	I467 K475 L488	I467-I471 HydrophobicContact CG2-CB 4.02Å; I467-I471 HydrophobicContact CG2-CD1 4.44Å; I467-I471 HydrophobicContact CG2-CG1 4.29Å; I467-I471 HydrophobicContact CG2-CG2 4.44Å; I467-I471 WeakPolarHBondContact O-CB 3.29Å; I467-I471 WeakPolarHBondContact O-CG2 3.4Å; I467-I471 PolarHBondContact O-N 3.23Å; I471-K475 HydrophobicContact CD1-CD 4.31Å; I471-K475 HydrophobicContact CD1-CG 4.16Å; I471-K475 HydrophobicContact CG1-CD 4.05Å; I471-K475 HydrophobicContact CG1-CG 4.27Å; I471-K475 WeakPolarHBondContact O-CB 3.17Å; I471-K475 WeakPolarHBondContact O-CG 3.35Å; I471-K475 PolarHBondContact O-N 2.81Å; I471-L488 HydrophobicContact CD1-CD1 4.24Å
472	R	85.7	Confident	83.9	Confident	199 Å²	199	63.3 Å²	63.3	75%	0.751	31%	0.31	S	S	*	.	H	α-helix	trans	-67.1	-41.7	179.6	-66.5	-176.6	-177.5	174.3	1.4	111.5	H470 K476	H470-R472 VanDerWaalsContact C-N 3.27Å; H470-R472 PolarHBondContact O-N 3.12Å; H470-R472 VanDerWaalsContact O-N 3.15Å; R472-K476 VanDerWaalsContact O-CG 3.31Å; R472-K476 WeakPolarHBondContact O-CG 3.44Å; R472-K476 PolarHBondContact O-N 3.39Å
473	T	84.7	Confident	83.6	Confident	12 Å²	12	59.2 Å²	59.2	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-74.7	-40.6	179.5	-50.5	0	0	0	0	110.9	H470 K476 A477 I518 K520 F574	H470-T473 PolarHBondContact O-N 3.3Å; H470-T473 VanDerWaalsContact O-N 3.1Å; T473-K476 PolarHBondContact O-N 2.83Å; T473-A477 PolarHBondContact O-N 3.29Å; T473-A477 VanDerWaalsContact O-N 3.16Å; T473-I518 HydrophobicContact CG2-CG2 3.82Å; T473-K520 HydrophobicContact CG2-CB 4.34Å; T473-F574 HydrophobicContact CG2-CD2 4.12Å; T473-F574 HydrophobicContact CG2-CE2 4.17Å
474	L	86.2	Confident	83.6	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-41.5	176.8	-80.2	171.6	0	0	0	112.8	H470 K476 A477 F480 I491 A492 L495 I518	H470-L474 HydrophobicContact CB-CD1 4.13Å; H470-L474 PolarHBondContact O-N 3.34Å; L474-K476 VanDerWaalsContact C-N 3.31Å; L474-K476 PolarHBondContact O-N 2.95Å; L474-A477 WeakPolarHBondContact O-CB 3.1Å; L474-A477 PolarHBondContact O-N 2.72Å; L474-F480 HydrophobicContact CD2-CD2 4.01Å; L474-F480 HydrophobicContact CD2-CE2 4.37Å; L474-I491 HydrophobicContact CD2-CG2 4.07Å; L474-A492 HydrophobicContact CD1-CB 3.87Å; L474-L495 HydrophobicContact CD1-CD1 3.98Å; L474-L495 HydrophobicContact CD2-CD1 4.05Å; L474-L495 HydrophobicContact CG-CD1 4.04Å; L474-I518 HydrophobicContact CD2-CD1 3.71Å
475	K	84.8	Confident	83.5	Confident	133 Å²	133	62 Å²	62	58%	0.578	32%	0.318	S	S	*	.	H	α-helix	trans	-69.2	-26.7	175.8	-74.6	-175.6	175.2	-174.5	0	113.6	I471 K481	I471-K475 HydrophobicContact CD1-CD 4.31Å; I471-K475 HydrophobicContact CD1-CG 4.16Å; I471-K475 HydrophobicContact CG1-CD 4.05Å; I471-K475 HydrophobicContact CG1-CG 4.27Å; I471-K475 WeakPolarHBondContact O-CB 3.17Å; I471-K475 WeakPolarHBondContact O-CG 3.35Å; I471-K475 PolarHBondContact O-N 2.81Å; K475-K481 WeakPolarHBondContact O-CG 3.43Å
476	K	84.2	Confident	83.4	Confident	105 Å²	105	59.9 Å²	59.9	46%	0.457	31%	0.312	S	S	.	.	H	α-helix	trans	-72.5	-33.1	174	-75.1	177.4	-174.7	-175.5	0	111.5	R472 T473 L474 S478 K481 E540	R472-K476 VanDerWaalsContact O-CG 3.31Å; R472-K476 WeakPolarHBondContact O-CG 3.44Å; R472-K476 PolarHBondContact O-N 3.39Å; T473-K476 PolarHBondContact O-N 2.83Å; L474-K476 VanDerWaalsContact C-N 3.31Å; L474-K476 PolarHBondContact O-N 2.95Å; K476-S478 PolarHBondContact O-N 2.93Å; K476-S478 VanDerWaalsContact O-N 3.15Å; K476-K481 VanDerWaalsContact O-CE 3.3Å; K476-K481 WeakPolarHBondContact O-CE 3.46Å; K476-E540 IonicContact NZ-OE1 3.96Å; K476-E540 PolarHBondContact NZ-OE1 3.08Å
477	A	82.8	Confident	83.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	-61.5	113.4	178.7	0	0	0	0	0	111.4	T473 L474 L479 F480 K481 I518 G541 V543	T473-A477 PolarHBondContact O-N 3.29Å; T473-A477 VanDerWaalsContact O-N 3.16Å; L474-A477 WeakPolarHBondContact O-CB 3.1Å; L474-A477 PolarHBondContact O-N 2.72Å; A477-L479 PolarHBondContact O-N 3.22Å; A477-F480 HydrophobicContact CB-CD2 4.02Å; A477-F480 PolarHBondContact O-N 3.1Å; A477-K481 WeakPolarHBondContact O-CG 3.48Å; A477-K481 PolarHBondContact O-N 2.94Å; A477-I518 HydrophobicContact CB-CG2 4.32Å; A477-G541 WeakPolarHBondContact CA-O 3.47Å; A477-V543 HydrophobicContact CB-CG2 3.42Å; A477-V543 VanDerWaalsContact CB-CG2 3.42Å
478	S	75	Confident	83.5	Confident	62 Å²	62	57.8 Å²	57.8	43%	0.434	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.6	-178.9	56.1	0	0	0	0	113.8	K476 K598	K476-S478 PolarHBondContact O-N 2.93Å; K476-S478 VanDerWaalsContact O-N 3.15Å; S478-K598 PolarHBondContact O-NZ 2.83Å
479	L	77.3	Confident	83.5	Confident	19 Å²	19	56.2 Å²	56.2	10%	0.099	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-31	178.3	-165.9	61.5	0	0	0	112.8	A477 M516 V543 E546 L595 K598	A477-L479 PolarHBondContact O-N 3.22Å; L479-M516 HydrophobicContact CD2-SD 3.82Å; L479-V543 HydrophobicContact CB-CG2 4.31Å; L479-V543 HydrophobicContact CD2-CG1 4.08Å; L479-E546 HydrophobicContact CD2-CB 3.98Å; L479-L595 HydrophobicContact CD1-CD2 3.25Å; L479-L595 HydrophobicContact CD2-CD2 3.99Å; L479-L595 HydrophobicContact CG-CD2 3.32Å; L479-K598 HydrophobicContact CD1-CD 3.96Å
480	F	80.3	Confident	83.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	8.6	-171.3	-58.5	-65.6	0	0	0	114.1	L474 A477 D482 C483 L488 I491 M516 I518	L474-F480 HydrophobicContact CD2-CD2 4.01Å; L474-F480 HydrophobicContact CD2-CE2 4.37Å; A477-F480 HydrophobicContact CB-CD2 4.02Å; A477-F480 PolarHBondContact O-N 3.1Å; F480-D482 VanDerWaalsContact C-N 3.31Å; F480-D482 PolarHBondContact O-N 3.3Å; F480-C483 PolarHBondContact O-N 3.44Å; F480-L488 HydrophobicContact CB-CD2 3.74Å; F480-L488 HydrophobicContact CG-CD2 4.45Å; F480-I491 HydrophobicContact CD1-CD1 4.02Å; F480-I491 HydrophobicContact CE1-CD1 3.57Å; F480-I491 HydrophobicContact CZ-CD1 4.14Å; F480-M516 HydrophobicContact CE2-CE 4.4Å; F480-M516 HydrophobicContact CE2-SD 4.33Å; F480-M516 HydrophobicContact CZ-CE 3.75Å; F480-M516 HydrophobicContact CZ-SD 4.14Å; F480-I518 HydrophobicContact CD2-CD1 4.39Å; F480-I518 HydrophobicContact CE2-CD1 3.93Å
481	K	78	Confident	83.9	Confident	127 Å²	127	54.1 Å²	54.1	55%	0.552	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-39.6	-178.8	-76.5	-177.5	-178.7	-176.6	0	113.3	K475 K476 A477	K475-K481 WeakPolarHBondContact O-CG 3.43Å; K476-K481 VanDerWaalsContact O-CE 3.3Å; K476-K481 WeakPolarHBondContact O-CE 3.46Å; A477-K481 WeakPolarHBondContact O-CG 3.48Å; A477-K481 PolarHBondContact O-N 2.94Å
482	D	78.7	Confident	84.2	Confident	126 Å²	126	52.2 Å²	52.2	67%	0.674	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	11.2	-172.1	-48.5	-51.6	0	0	0	112.6	F480 L594	F480-D482 VanDerWaalsContact C-N 3.31Å; F480-D482 PolarHBondContact O-N 3.3Å; D482-L594 HydrophobicContact CB-CD2 4.24Å
483	C	81.3	Confident	84.3	Confident	13 Å²	13	45.3 Å²	45.3	9%	0.088	24%	0.24	C	C	.	.	S	Bend	trans	-84.8	150.3	-179.6	-71.4	0	0	0	0	112	F480 L487 L488	F480-C483 PolarHBondContact O-N 3.44Å; C483-L487 HydrophobicContact CB-CD2 4.15Å; C483-L488 HydrophobicContact CB-CD2 4.42Å
484	D	85.1	Confident	84.5	Confident	89 Å²	89	46.6 Å²	46.6	48%	0.476	25%	0.245	S	C	.	.			trans	-56.9	137.7	175.3	-175.8	64	0	0	0	111.6	G486 L487 L488	D484-G486 PolarHBondContact O-N 3.12Å; D484-G486 VanDerWaalsContact O-N 3.15Å; D484-G486 WeakPolarHBondContact OD2-CA 3.31Å; D484-G486 PolarHBondContact OD2-N 3.42Å; D484-L487 WeakPolarHBondContact O-CB 3.43Å; D484-L487 PolarHBondContact O-N 3.22Å; D484-L488 PolarHBondContact O-N 2.72Å
485	P	85.7	Confident	84.6	Confident	89 Å²	89	47.3 Å²	47.3	58%	0.578	25%	0.249	S	C	*	.	H	α-helix	trans	-57.6	-26.7	178.1	-26.7	35.8	0	0	0	114.4	L488 T489	P485-L488 PolarHBondContact O-N 3.43Å; P485-T489 PolarHBondContact O-N 3.44Å; P485-T489 PolarHBondContact O-OG1 3.38Å
486	G	86.2	Confident	84.8	Confident	21 Å²	21	46.6 Å²	46.6	22%	0.216	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-46.5	173.9	0	0	0	0	0	111.7	D484 L488 T489 E490 Y588	D484-G486 PolarHBondContact O-N 3.12Å; D484-G486 VanDerWaalsContact O-N 3.15Å; D484-G486 WeakPolarHBondContact OD2-CA 3.31Å; D484-G486 PolarHBondContact OD2-N 3.42Å; G486-L488 PolarHBondContact O-N 3.26Å; G486-T489 WeakPolarHBondContact O-CB 3.5Å; G486-T489 PolarHBondContact O-N 3.49Å; G486-E490 PolarHBondContact O-N 3.2Å; G486-E490 VanDerWaalsContact O-N 3.11Å; G486-Y588 WeakPolarHBondContact CA-OH 3.38Å
487	L	89	Confident	85	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-42	175.3	177.2	62.5	0	0	0	111.7	C483 D484 T489 E490 I491 L585 Y588 A591	C483-L487 HydrophobicContact CB-CD2 4.15Å; D484-L487 WeakPolarHBondContact O-CB 3.43Å; D484-L487 PolarHBondContact O-N 3.22Å; L487-T489 PolarHBondContact O-N 3.28Å; L487-E490 PolarHBondContact O-N 2.85Å; L487-I491 HydrophobicContact CD1-CD1 3.84Å; L487-I491 HydrophobicContact CD1-CG1 4.02Å; L487-I491 HydrophobicContact CD2-CD1 4.35Å; L487-I491 HydrophobicContact CG-CD1 3.78Å; L487-I491 HydrophobicContact CG-CG1 4.33Å; L487-I491 WeakPolarHBondContact O-CG1 3.41Å; L487-I491 PolarHBondContact O-N 2.89Å; L487-L585 HydrophobicContact CD1-CD2 4.37Å; L487-L585 HydrophobicContact CD2-CD2 4.08Å; L487-Y588 HydrophobicContact CB-CD1 4.28Å; L487-Y588 HydrophobicContact CB-CD2 3.94Å; L487-Y588 HydrophobicContact CB-CE1 4.46Å; L487-Y588 HydrophobicContact CB-CE2 4.15Å; L487-Y588 HydrophobicContact CB-CG 4.02Å; L487-Y588 HydrophobicContact CD1-CD2 3.81Å; L487-Y588 HydrophobicContact CD1-CE2 4.4Å; L487-Y588 HydrophobicContact CD1-CG 4.34Å; L487-Y588 HydrophobicContact CG-CD2 4.41Å; L487-A591 HydrophobicContact CD2-CB 3.32Å
488	L	88.5	Confident	85.4	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-36.5	177.2	-65.6	-179.2	0	0	0	112	I471 F480 C483 D484 P485 G486 A492	I471-L488 HydrophobicContact CD1-CD1 4.24Å; F480-L488 HydrophobicContact CB-CD2 3.74Å; F480-L488 HydrophobicContact CG-CD2 4.45Å; C483-L488 HydrophobicContact CB-CD2 4.42Å; D484-L488 PolarHBondContact O-N 2.72Å; P485-L488 PolarHBondContact O-N 3.43Å; G486-L488 PolarHBondContact O-N 3.26Å; L488-A492 VanDerWaalsContact O-CB 3.22Å; L488-A492 WeakPolarHBondContact O-CB 3.14Å; L488-A492 PolarHBondContact O-N 3.43Å
489	T	87.4	Confident	86.2	Confident	33 Å²	33	45.1 Å²	45.1	20%	0.202	24%	0.235	C	C	.	.	H	α-helix	trans	-68.6	-46.2	178.6	-60	0	0	0	0	111.6	T463 I467 P485 G486 L487 I491 A492 L493	T463-T489 HydrophobicContact CG2-CG2 3.25Å; I467-T489 HydrophobicContact CD1-CG2 3.69Å; I467-T489 HydrophobicContact CG1-CG2 4Å; P485-T489 PolarHBondContact O-N 3.44Å; P485-T489 PolarHBondContact O-OG1 3.38Å; G486-T489 WeakPolarHBondContact O-CB 3.5Å; G486-T489 PolarHBondContact O-N 3.49Å; L487-T489 PolarHBondContact O-N 3.28Å; T489-I491 PolarHBondContact O-N 3.41Å; T489-A492 PolarHBondContact O-N 3.08Å; T489-L493 PolarHBondContact O-N 3.36Å
490	E	87.9	Confident	87	Confident	55 Å²	55	45.8 Å²	45.8	26%	0.257	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-43	176	-69.9	-74.7	116.3	0	0	111.4	G486 L487 L493 K587 Y588	G486-E490 PolarHBondContact O-N 3.2Å; G486-E490 VanDerWaalsContact O-N 3.11Å; L487-E490 PolarHBondContact O-N 2.85Å; E490-L493 PolarHBondContact O-N 3.03Å; E490-K587 IonicContact OE2-NZ 2.68Å; E490-K587 PolarHBondContact OE2-NZ 3.02Å; E490-Y588 HydrophobicContact CG-CE2 4.45Å
491	I	90.2	Very high	87.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-45.3	176.5	-68.4	173.8	0	0	0	110.4	L474 F480 L487 T489 L493 K494 L495 L576 L581	L474-I491 HydrophobicContact CD2-CG2 4.07Å; F480-I491 HydrophobicContact CD1-CD1 4.02Å; F480-I491 HydrophobicContact CE1-CD1 3.57Å; F480-I491 HydrophobicContact CZ-CD1 4.14Å; L487-I491 HydrophobicContact CD1-CD1 3.84Å; L487-I491 HydrophobicContact CD1-CG1 4.02Å; L487-I491 HydrophobicContact CD2-CD1 4.35Å; L487-I491 HydrophobicContact CG-CD1 3.78Å; L487-I491 HydrophobicContact CG-CG1 4.33Å; L487-I491 WeakPolarHBondContact O-CG1 3.41Å; L487-I491 PolarHBondContact O-N 2.89Å; T489-I491 PolarHBondContact O-N 3.41Å; I491-L493 PolarHBondContact O-N 3.26Å; I491-K494 PolarHBondContact O-N 3.26Å; I491-L495 HydrophobicContact CG2-CD2 4.18Å; I491-L495 HydrophobicContact CG2-CG 4.21Å; I491-L495 WeakPolarHBondContact O-CG 3.49Å; I491-L495 PolarHBondContact O-N 3.26Å; I491-L495 VanDerWaalsContact O-N 3.16Å; I491-L576 HydrophobicContact CG2-CD1 4.39Å; I491-L576 HydrophobicContact CG2-CD2 3.98Å; I491-L581 HydrophobicContact CD1-CD1 4.46Å
492	A	88.8	Confident	88.5	Confident	3 Å²	3	43.3 Å²	43.3	3%	0.025	23%	0.234	C	C	.	.	H	α-helix	trans	-57.3	-36.2	-178.8	0	0	0	0	0	112.9	H470 L474 L488 T489 K494	H470-A492 HydrophobicContact CB-CB 4.17Å; H470-A492 PolarHBondContact CD2-O 3.23Å; H470-A492 VanDerWaalsContact CD2-O 3.28Å; L474-A492 HydrophobicContact CD1-CB 3.87Å; L488-A492 VanDerWaalsContact O-CB 3.22Å; L488-A492 WeakPolarHBondContact O-CB 3.14Å; L488-A492 PolarHBondContact O-N 3.43Å; T489-A492 PolarHBondContact O-N 3.08Å; A492-K494 VanDerWaalsContact C-N 3.28Å; A492-K494 PolarHBondContact O-N 3.49Å
493	L	87.3	Confident	89.1	Confident	54 Å²	54	39.2 Å²	39.2	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-69.3	-22	176.5	-75.6	170.1	0	0	0	114	R462 T463 A466 T489 E490 I491	R462-L493 HydrophobicContact CG-CD2 4.11Å; T463-L493 HydrophobicContact CG2-CD1 4.28Å; A466-L493 HydrophobicContact CB-CD2 3.77Å; A466-L493 HydrophobicContact CB-CG 4.36Å; T489-L493 PolarHBondContact O-N 3.36Å; E490-L493 PolarHBondContact O-N 3.03Å; I491-L493 PolarHBondContact O-N 3.26Å
494	K	88.9	Confident	89.7	Confident	38 Å²	38	40.1 Å²	40.1	17%	0.165	23%	0.226	C	C	.	.	H	α-helix	trans	-103.4	-6.3	-176.8	-60.3	-170.5	-171.8	-178.1	0	113.8	I491 A492 L576 D580 E583 S584	I491-K494 PolarHBondContact O-N 3.26Å; A492-K494 VanDerWaalsContact C-N 3.28Å; A492-K494 PolarHBondContact O-N 3.49Å; K494-L576 HydrophobicContact CB-CD1 3.96Å; K494-D580 HydrophobicContact CB-CB 4.21Å; K494-D580 HydrophobicContact CD-CB 3.6Å; K494-D580 PolarHBondContact NZ-O 3.24Å; K494-E583 IonicContact NZ-OE1 2.68Å; K494-E583 PolarHBondContact NZ-OE1 2.79Å; K494-E583 IonicContact NZ-OE2 2.61Å; K494-E583 PolarHBondContact NZ-OE2 2.9Å; K494-S584 PolarHBondContact NZ-OG 3.03Å
495	L	89.4	Confident	90.1	Very high	16 Å²	16	39.7 Å²	39.7	8%	0.084	22%	0.218	C	C	.	.			trans	-69.3	133.9	177.6	-71.4	177.3	0	0	0	111.2	H470 L474 I491 I518 F574 L576	H470-L495 HydrophobicContact CB-CD1 4.09Å; L474-L495 HydrophobicContact CD1-CD1 3.98Å; L474-L495 HydrophobicContact CD2-CD1 4.05Å; L474-L495 HydrophobicContact CG-CD1 4.04Å; I491-L495 HydrophobicContact CG2-CD2 4.18Å; I491-L495 HydrophobicContact CG2-CG 4.21Å; I491-L495 WeakPolarHBondContact O-CG 3.49Å; I491-L495 PolarHBondContact O-N 3.26Å; I491-L495 VanDerWaalsContact O-N 3.16Å; L495-I518 HydrophobicContact CD2-CD1 4.32Å; L495-F574 HydrophobicContact CB-CB 4.35Å; L495-F574 HydrophobicContact CB-CD1 4.39Å; L495-F574 HydrophobicContact CD1-CB 4.26Å; L495-F574 HydrophobicContact CD1-CG 4.34Å; L495-F574 HydrophobicContact CD2-CB 4.08Å; L495-F574 HydrophobicContact CG-CB 4.46Å; L495-L576 HydrophobicContact CD2-CB 3.92Å; L495-L576 HydrophobicContact CD2-CD1 4.21Å
496	K	89.3	Confident	90.6	Very high	119 Å²	119	36.1 Å²	36.1	52%	0.517	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.5	174.6	-66.2	-177.5	179	176.9	0	110.9	F574 A575	K496-F574 CarbonylContact O-C 3.4Å; K496-F574 WeakPolarHBondContact O-CA 3.49Å; K496-A575 PolarHBondContact N-O 3.14Å; K496-A575 PolarHBondContact O-N 2.84Å
497	L	88.9	Confident	90.9	Very high	41 Å²	41	35.4 Å²	35.4	22%	0.215	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.7	175	-175.4	66.3	0	0	0	110.6	K520 E572 F574	L497-K520 HydrophobicContact CD1-CD 4.14Å; L497-E572 HydrophobicContact CD1-CB 4.1Å; L497-F574 HydrophobicContact CB-CD1 4.37Å; L497-F574 HydrophobicContact CB-CE1 4.25Å; L497-F574 HydrophobicContact CD1-CD1 4.13Å; L497-F574 HydrophobicContact CD1-CE1 3.85Å
498	Q	90.7	Very high	91.1	Very high	65 Å²	65	42 Å²	42	30%	0.304	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.5	173.2	-63.9	-170.9	13.3	0	0	110.4	F500 L573 A575	Q498-F500 HydrophobicContact CB-CE2 3.88Å; Q498-F500 HydrophobicContact CB-CZ 4.48Å; Q498-L573 PolarHBondContact N-O 2.94Å; Q498-L573 PolarHBondContact O-N 3.16Å; Q498-A575 HydrophobicContact CG-CB 4.12Å
499	I	92.4	Very high	91.3	Very high	29 Å²	29	46.4 Å²	46.4	15%	0.149	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.1	-176.7	-58.5	170.1	0	0	0	109.3	W437 Y440 V441 H446 S571 E572	W437-I499 PolarHBondContact NE1-O 3.21Å; Y440-I499 HydrophobicContact CD1-CG2 3.89Å; Y440-I499 HydrophobicContact CE1-CG2 3.79Å; V441-I499 HydrophobicContact CG2-CD1 4.03Å; H446-I499 HydrophobicContact CB-CD1 3.99Å; I499-S571 WeakPolarHBondContact CA-O 3.42Å; I499-E572 HydrophobicContact CG1-CG 4.44Å
500	F	94.2	Very high	91.4	Very high	33 Å²	33	46.2 Å²	46.2	15%	0.145	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.3	178.3	-67.6	-89.4	0	0	0	111	Q498 D504 I506 Y517 F570 S571 L573	Q498-F500 HydrophobicContact CB-CE2 3.88Å; Q498-F500 HydrophobicContact CB-CZ 4.48Å; F500-D504 HydrophobicContact CB-CB 4.49Å; F500-D504 HydrophobicContact CD1-CB 4.46Å; F500-I506 HydrophobicContact CB-CG1 4.35Å; F500-I506 HydrophobicContact CD1-CB 4.49Å; F500-I506 HydrophobicContact CD1-CG1 3.76Å; F500-I506 HydrophobicContact CD2-CG1 4.01Å; F500-I506 HydrophobicContact CE1-CB 4.27Å; F500-I506 HydrophobicContact CE1-CG1 4Å; F500-I506 HydrophobicContact CE1-CG2 4.05Å; F500-I506 HydrophobicContact CE2-CG1 4.25Å; F500-I506 HydrophobicContact CE2-CG2 4.06Å; F500-I506 HydrophobicContact CG-CG1 3.76Å; F500-I506 HydrophobicContact CZ-CB 4.42Å; F500-I506 HydrophobicContact CZ-CG1 4.25Å; F500-I506 HydrophobicContact CZ-CG2 3.73Å; F500-Y517 HydrophobicContact CE2-CE1 4.46Å; F500-Y517 HydrophobicContact CZ-CE1 4.4Å; F500-F570 WeakPolarHBondContact O-CA 3.49Å; F500-S571 PolarHBondContact N-O 3.27Å; F500-S571 PolarHBondContact O-N 2.83Å; F500-L573 HydrophobicContact CD2-CD1 3.63Å; F500-L573 HydrophobicContact CD2-CG 3.98Å; F500-L573 HydrophobicContact CE2-CB 4.37Å; F500-L573 HydrophobicContact CE2-CD1 3.67Å; F500-L573 HydrophobicContact CE2-CG 4.22Å
501	S	93.6	Very high	91.6	Very high	14 Å²	14	47.9 Å²	47.9	10%	0.098	24%	0.242	C	C	.	.			trans	-85.3	161.2	179.4	-42.1	0	0	0	0	111.3	G503 D504 S567 G569	S501-G503 PolarHBondContact O-N 3.41Å; S501-D504 WeakPolarHBondContact CA-OD2 3.36Å; S501-D504 WeakPolarHBondContact CB-OD2 3.48Å; S501-D504 PolarHBondContact N-OD2 3.34Å; S501-D504 VanDerWaalsContact O-CB 3.31Å; S501-D504 WeakPolarHBondContact O-CB 3.48Å; S501-D504 PolarHBondContact O-N 3.24Å; S501-D504 VanDerWaalsContact O-N 3.13Å; S501-D504 PolarHBondContact OG-OD2 3.31Å; S501-S567 WeakPolarHBondContact O-CB 3.29Å; S501-G569 CarbonylContact C-O 3.58Å
502	P	94.5	Very high	91.6	Very high	61 Å²	61	52.9 Å²	52.9	40%	0.396	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	132.2	173.3	-20.2	29.2	0	0	0	111.8	D504 F570	P502-D504 VanDerWaalsContact C-N 3.28Å; P502-D504 PolarHBondContact O-N 3.26Å; P502-F570 HydrophobicContact CG-CD2 3.95Å; P502-F570 HydrophobicContact CG-CE2 3.98Å; P502-F570 HydrophobicContact CG-CG 4.4Å; P502-F570 HydrophobicContact CG-CZ 4.46Å
503	G	91.7	Very high	91.6	Very high	40 Å²	40	52.8 Å²	52.8	41%	0.412	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	-7.1	-179.2	0	0	0	0	0	115.2	S501 S567	S501-G503 PolarHBondContact O-N 3.41Å; G503-S567 WeakPolarHBondContact CA-O 3.37Å; G503-S567 PolarHBondContact N-O 2.93Å
504	D	93.9	Very high	91.7	Very high	33 Å²	33	57.2 Å²	57.2	18%	0.176	28%	0.284	C	S	.	.			trans	-68.3	134.2	177.4	-70.1	-12.4	0	0	0	110.7	R433 F500 S501 P502 R566 S567	R433-D504 IonicContact CZ-OD1 3.09Å; R433-D504 IonicContact NH2-OD1 2.68Å; R433-D504 PolarHBondContact NH2-OD1 3.19Å; F500-D504 HydrophobicContact CB-CB 4.49Å; F500-D504 HydrophobicContact CD1-CB 4.46Å; S501-D504 WeakPolarHBondContact CA-OD2 3.36Å; S501-D504 WeakPolarHBondContact CB-OD2 3.48Å; S501-D504 PolarHBondContact N-OD2 3.34Å; S501-D504 VanDerWaalsContact O-CB 3.31Å; S501-D504 WeakPolarHBondContact O-CB 3.48Å; S501-D504 PolarHBondContact O-N 3.24Å; S501-D504 VanDerWaalsContact O-N 3.13Å; S501-D504 PolarHBondContact OG-OD2 3.31Å; P502-D504 VanDerWaalsContact C-N 3.28Å; P502-D504 PolarHBondContact O-N 3.26Å; D504-R566 CarbonylContact O-C 3.58Å; D504-R566 WeakPolarHBondContact O-CA 3.45Å; D504-S567 PolarHBondContact O-N 3Å
505	Y	94.3	Very high	91.9	Very high	79 Å²	79	57.2 Å²	57.2	31%	0.31	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.8	167.7	-74.9	-90.9	0	0	0	108.7	R508 V565 R566	Y505-R508 HydrophobicContact CD1-CG 4.36Å; Y505-R508 HydrophobicContact CG-CG 4.36Å; Y505-V565 CarbonylContact C-O 3.54Å; Y505-V565 WeakPolarHBondContact CA-O 3.31Å; Y505-R566 HydrophobicContact CD1-CB 4.07Å; Y505-R566 HydrophobicContact CE1-CB 4.04Å; Y505-R566 HydrophobicContact CE1-CG 4.46Å; Y505-R566 HydrophobicContact CE2-CG 4.5Å; Y505-R566 PolarHBondContact OH-NH1 3.04Å
506	I	95	Very high	92	Very high	15 Å²	15	56.5 Å²	56.5	8%	0.077	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-38.4	176.7	-58.6	96.6	0	0	0	110.2	F500 Y517 L524 F544 V565 L573	F500-I506 HydrophobicContact CB-CG1 4.35Å; F500-I506 HydrophobicContact CD1-CB 4.49Å; F500-I506 HydrophobicContact CD1-CG1 3.76Å; F500-I506 HydrophobicContact CD2-CG1 4.01Å; F500-I506 HydrophobicContact CE1-CB 4.27Å; F500-I506 HydrophobicContact CE1-CG1 4Å; F500-I506 HydrophobicContact CE1-CG2 4.05Å; F500-I506 HydrophobicContact CE2-CG1 4.25Å; F500-I506 HydrophobicContact CE2-CG2 4.06Å; F500-I506 HydrophobicContact CG-CG1 3.76Å; F500-I506 HydrophobicContact CZ-CB 4.42Å; F500-I506 HydrophobicContact CZ-CG1 4.25Å; F500-I506 HydrophobicContact CZ-CG2 3.73Å; I506-Y517 HydrophobicContact CG2-CD2 4Å; I506-Y517 HydrophobicContact CG2-CE1 4.35Å; I506-Y517 HydrophobicContact CG2-CE2 3.81Å; I506-Y517 HydrophobicContact CG2-CG 4.34Å; I506-L524 HydrophobicContact CD1-CD1 4.44Å; I506-L524 HydrophobicContact CD1-CD2 3.75Å; I506-F544 HydrophobicContact CB-CE2 4.38Å; I506-F544 HydrophobicContact CB-CZ 4.35Å; I506-F544 HydrophobicContact CG2-CE2 3.93Å; I506-F544 HydrophobicContact CG2-CZ 3.88Å; I506-V565 HydrophobicContact CD1-CG1 4.16Å; I506-V565 PolarHBondContact N-O 3.27Å; I506-L573 HydrophobicContact CG1-CD1 3.99Å; I506-L573 HydrophobicContact CG2-CD1 4.02Å
507	C	93.9	Very high	92.2	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.034	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	148.2	170.1	55.3	0	0	0	0	109.6	R561 S564 V565	C507-R561 HydrophobicContact CB-CG 4.01Å; C507-S564 CarbonylContact O-C 3.55Å; C507-S564 WeakPolarHBondContact O-CA 3.43Å; C507-V565 PolarHBondContact O-N 3.11Å
508	R	92.9	Very high	92.4	Very high	138 Å²	138	49.8 Å²	49.8	52%	0.521	25%	0.251	S	S	.	.			trans	-108.9	148.3	170.7	-55.6	179.7	176.6	-154.4	-0.9	109.9	Y505 G510 E511 R561	Y505-R508 HydrophobicContact CD1-CG 4.36Å; Y505-R508 HydrophobicContact CG-CG 4.36Å; R508-G510 PolarHBondContact O-N 3.37Å; R508-E511 HydrophobicContact CB-CG 3.99Å; R508-E511 WeakPolarHBondContact CD-OE1 3.11Å; R508-E511 PolarHBondContact N-OE2 3.28Å; R508-E511 WeakPolarHBondContact O-CB 3.16Å; R508-E511 PolarHBondContact O-N 3.39Å; R508-R561 WeakPolarHBondContact O-CB 3.31Å
509	K	91.6	Very high	92.5	Very high	103 Å²	103	46.7 Å²	46.7	45%	0.448	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	133.3	172.7	-177.5	179.5	176.6	178.8	0	110.4	E511 D529 S564	K509-E511 PolarHBondContact O-N 2.95Å; K509-D529 WeakPolarHBondContact CD-OD1 3.28Å; K509-D529 VanDerWaalsContact NZ-CG 3.26Å; K509-D529 IonicContact NZ-OD1 2.86Å; K509-D529 PolarHBondContact NZ-OD1 2.97Å; K509-D529 IonicContact NZ-OD2 3.83Å; K509-D529 PolarHBondContact NZ-OD2 3.49Å; K509-S564 PolarHBondContact N-OG 3.26Å
510	G	89.5	Confident	92.5	Very high	30 Å²	30	47.9 Å²	47.9	31%	0.309	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	-14.4	179.8	0	0	0	0	0	115.8	R508 R560 R561	R508-G510 PolarHBondContact O-N 3.37Å; G510-R560 PolarHBondContact O-NH1 2.9Å; G510-R561 PolarHBondContact N-O 3.49Å
511	E	92	Very high	92.4	Very high	89 Å²	89	50.6 Å²	50.6	42%	0.416	25%	0.252	S	S	.	.	S	Bend	trans	-66.2	156.6	173.2	-70.5	178.6	167.2	0	0	111.6	R508 K509 R560 R561	R508-E511 HydrophobicContact CB-CG 3.99Å; R508-E511 WeakPolarHBondContact CD-OE1 3.11Å; R508-E511 PolarHBondContact N-OE2 3.28Å; R508-E511 WeakPolarHBondContact O-CB 3.16Å; R508-E511 PolarHBondContact O-N 3.39Å; K509-E511 PolarHBondContact O-N 2.95Å; E511-R560 CarbonylContact O-C 3.47Å; E511-R560 VanDerWaalsContact O-CA 3.27Å; E511-R560 WeakPolarHBondContact O-CA 3.49Å; E511-R561 HydrophobicContact CB-CG 4.28Å; E511-R561 WeakPolarHBondContact O-CG 3.46Å; E511-R561 PolarHBondContact O-N 3.09Å
512	I	90.8	Very high	92.3	Very high	106 Å²	106	51.1 Å²	51.1	54%	0.544	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-76.8	125.7	178.8	-60.6	171	0	0	0	109.5	K514 N559	I512-K514 PolarHBondContact O-N 3.34Å; I512-N559 WeakPolarHBondContact CA-O 3.17Å
513	G	88.5	Confident	92.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.261	C	S	.	.			trans	-83.1	95.8	-177.6	0	0	0	0	0	113.3	N559 R561	G513-N559 PolarHBondContact N-O 2.94Å; G513-N559 PolarHBondContact O-OD1 3.41Å; G513-R561 VanDerWaalsContact CA-CZ 3.48Å
514	K	90.3	Very high	92.6	Very high	147 Å²	147	50.2 Å²	50.2	64%	0.639	24%	0.242	S	C	*	.			trans	-82.4	-36.4	179.2	-62.5	-177.9	-178.6	179.6	0	113.9	I512 K578	I512-K514 PolarHBondContact O-N 3.34Å; K514-K578 VanDerWaalsContact O-CB 3.31Å; K514-K578 WeakPolarHBondContact O-CB 3.46Å; K514-K578 PolarHBondContact O-N 2.91Å
515	D	92.7	Very high	92.8	Very high	39 Å²	39	49.8 Å²	49.8	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	154.4	-171	-49.4	-61.7	0	0	0	111.3	Y517 R561 L576 S577	D515-Y517 HydrophobicContact CB-CE2 4.42Å; D515-R561 VanDerWaalsContact O-CZ 3.23Å; D515-R561 PolarHBondContact O-NH1 3.15Å; D515-R561 PolarHBondContact O-NH2 3.2Å; D515-L576 CarbonylContact C-O 3.56Å; D515-L576 VanDerWaalsContact CA-O 3.31Å; D515-L576 WeakPolarHBondContact CA-O 3.23Å; D515-S577 WeakPolarHBondContact OD1-CA 3.39Å; D515-S577 WeakPolarHBondContact OD1-CB 3.47Å
516	M	91.4	Very high	92.8	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	150.3	163.7	143.1	170.5	64.2	0	0	109.2	L479 F480 V543 E546 I549 A575 L576 L581	L479-M516 HydrophobicContact CD2-SD 3.82Å; F480-M516 HydrophobicContact CE2-CE 4.4Å; F480-M516 HydrophobicContact CE2-SD 4.33Å; F480-M516 HydrophobicContact CZ-CE 3.75Å; F480-M516 HydrophobicContact CZ-SD 4.14Å; M516-V543 HydrophobicContact CG-CG1 3.95Å; M516-V543 HydrophobicContact SD-CG1 3.61Å; M516-E546 HydrophobicContact SD-CB 4.3Å; M516-I549 HydrophobicContact CB-CD1 3.45Å; M516-I549 VanDerWaalsContact CB-CD1 3.45Å; M516-I549 HydrophobicContact CE-CD1 3.81Å; M516-I549 HydrophobicContact CG-CD1 4.47Å; M516-I549 HydrophobicContact SD-CD1 4.31Å; M516-A575 CarbonylContact O-C 3.54Å; M516-A575 WeakPolarHBondContact O-CA 3.34Å; M516-L576 HydrophobicContact CE-CB 4.24Å; M516-L576 HydrophobicContact CE-CD2 3.54Å; M516-L576 HydrophobicContact CE-CG 4.4Å; M516-L576 PolarHBondContact N-O 3.07Å; M516-L576 PolarHBondContact O-N 2.91Å; M516-L581 HydrophobicContact CE-CD1 4.11Å; M516-L581 HydrophobicContact CE-CD2 3.74Å; M516-L581 HydrophobicContact CE-CG 4.43Å
517	Y	93.9	Very high	92.8	Very high	17 Å²	17	46.1 Å²	46.1	7%	0.067	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.9	179.7	-61.7	-79.2	0	0	0	111.7	F500 I506 D515 V543 F544 L573 F574 A575	F500-Y517 HydrophobicContact CE2-CE1 4.46Å; F500-Y517 HydrophobicContact CZ-CE1 4.4Å; I506-Y517 HydrophobicContact CG2-CD2 4Å; I506-Y517 HydrophobicContact CG2-CE1 4.35Å; I506-Y517 HydrophobicContact CG2-CE2 3.81Å; I506-Y517 HydrophobicContact CG2-CG 4.34Å; D515-Y517 HydrophobicContact CB-CE2 4.42Å; Y517-V543 WeakPolarHBondContact O-CA 3.45Å; Y517-F544 VanDerWaalsContact CB-CE1 3.42Å; Y517-F544 HydrophobicContact CD2-CD2 4.28Å; Y517-F544 AromaticContact CD2-CE2 3.61Å; Y517-F544 HydrophobicContact CD2-CE2 3.61Å; Y517-F544 AromaticContact CD2-CZ 3.89Å; Y517-F544 HydrophobicContact CD2-CZ 3.89Å; Y517-F544 HydrophobicContact CG-CE1 4.37Å; Y517-F544 HydrophobicContact CG-CE2 4.02Å; Y517-F544 AromaticContact CG-CZ 3.81Å; Y517-F544 HydrophobicContact CG-CZ 3.81Å; Y517-F544 PolarHBondContact N-O 3.4Å; Y517-F544 PolarHBondContact O-N 3.1Å; Y517-L573 HydrophobicContact CD1-CB 4.24Å; Y517-L573 HydrophobicContact CD1-CD1 4.28Å; Y517-L573 HydrophobicContact CG-CD1 4.41Å; Y517-F574 CarbonylContact C-O 3.57Å; Y517-F574 VanDerWaalsContact CA-O 3.31Å; Y517-F574 WeakPolarHBondContact CA-O 3.37Å; Y517-A575 HydrophobicContact CD1-CB 3.87Å; Y517-A575 HydrophobicContact CE1-CB 3.69Å
518	I	93	Very high	92.7	Very high	1 Å²	1	47 Å²	47	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.1	173.2	-49.3	178.3	0	0	0	108.2	T473 L474 A477 F480 L495 K520 V543 L573 F574	T473-I518 HydrophobicContact CG2-CG2 3.82Å; L474-I518 HydrophobicContact CD2-CD1 3.71Å; A477-I518 HydrophobicContact CB-CG2 4.32Å; F480-I518 HydrophobicContact CD2-CD1 4.39Å; F480-I518 HydrophobicContact CE2-CD1 3.93Å; L495-I518 HydrophobicContact CD2-CD1 4.32Å; I518-K520 PolarHBondContact O-N 3.26Å; I518-V543 HydrophobicContact CG1-CG1 4.49Å; I518-V543 HydrophobicContact CG1-CG2 4.23Å; I518-V543 HydrophobicContact CG2-CG2 4.33Å; I518-L573 WeakPolarHBondContact O-CA 3.32Å; I518-F574 HydrophobicContact CB-CB 4.34Å; I518-F574 PolarHBondContact N-O 3.43Å; I518-F574 PolarHBondContact O-N 2.99Å
519	V	93.5	Very high	92.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	111.2	-179.2	-173.7	0	0	0	0	109.6	L524 K539 G541 S542 F544 L573	V519-L524 HydrophobicContact CG2-CD1 3.65Å; V519-L524 HydrophobicContact CG2-CG 4.32Å; V519-K539 WeakPolarHBondContact CB-O 3.44Å; V519-G541 PolarHBondContact O-N 2.89Å; V519-S542 PolarHBondContact N-O 3.22Å; V519-F544 HydrophobicContact CG2-CD1 4.18Å; V519-F544 HydrophobicContact CG2-CE1 3.98Å; V519-L573 HydrophobicContact CB-CD2 4.13Å; V519-L573 HydrophobicContact CG1-CD2 4.12Å; V519-L573 HydrophobicContact CG2-CD2 3.92Å
520	K	91	Very high	92.2	Very high	54 Å²	54	45.3 Å²	45.3	24%	0.235	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-44	174.8	-177.9	-159.5	179.3	-165.1	0	111.3	T473 L497 I518 E540 E572 F574	T473-K520 HydrophobicContact CG2-CB 4.34Å; L497-K520 HydrophobicContact CD1-CD 4.14Å; I518-K520 PolarHBondContact O-N 3.26Å; K520-E540 VanDerWaalsContact O-CD 3.24Å; K520-E540 WeakPolarHBondContact O-CG 3.25Å; K520-E572 HydrophobicContact CB-CB 4.39Å; K520-E572 WeakPolarHBondContact CB-O 2.99Å; K520-E572 HydrophobicContact CD-CB 4.23Å; K520-E572 WeakPolarHBondContact CD-OE2 3.07Å; K520-E572 WeakPolarHBondContact CE-OE2 3.46Å; K520-E572 PolarHBondContact N-O 3.46Å; K520-E572 IonicContact NZ-OE2 2.79Å; K520-E572 PolarHBondContact NZ-OE2 3.12Å; K520-F574 HydrophobicContact CB-CD2 3.95Å; K520-F574 HydrophobicContact CB-CE2 3.74Å; K520-F574 HydrophobicContact CB-CZ 4.42Å; K520-F574 HydrophobicContact CD-CD2 4.48Å; K520-F574 HydrophobicContact CD-CE1 4.28Å; K520-F574 HydrophobicContact CD-CE2 3.62Å; K520-F574 HydrophobicContact CD-CZ 3.49Å; K520-F574 VanDerWaalsContact CD-CZ 3.49Å; K520-F574 HydrophobicContact CG-CD2 4.34Å; K520-F574 HydrophobicContact CG-CE2 3.61Å; K520-F574 HydrophobicContact CG-CZ 4.04Å
521	K	92	Very high	92	Very high	90 Å²	90	44.8 Å²	44.8	39%	0.391	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	143.3	-180	-172.7	-179.7	174.7	-173.4	0	109.6	S571 E572	K521-S571 CarbonylContact O-C 3.56Å; K521-S571 WeakPolarHBondContact O-CA 3.38Å; K521-E572 HydrophobicContact CB-CB 4.07Å; K521-E572 HydrophobicContact CB-CG 4.33Å; K521-E572 PolarHBondContact N-O 3.35Å; K521-E572 VanDerWaalsContact N-O 3.13Å; K521-E572 PolarHBondContact O-N 3.13Å
522	G	92.7	Very high	91.8	Very high	25 Å²	25	46 Å²	46	26%	0.258	25%	0.247	S	C	.	.	S	Bend	trans	108.5	-179.9	178.5	0	0	0	0	0	113.2
523	L	95.9	Very high	91.9	Very high	82 Å²	82	44.2 Å²	44.2	43%	0.429	24%	0.242	S	C	.	.			trans	-124.3	128.7	-177.7	-68.5	167.7	0	0	0	108.6	T537 K539 V568	L523-T537 HydrophobicContact CB-CG2 4.47Å; L523-T537 HydrophobicContact CD2-CG2 4.07Å; L523-K539 HydrophobicContact CD2-CG 3.94Å; L523-V568 HydrophobicContact CB-CB 4.19Å; L523-V568 HydrophobicContact CB-CG2 4.32Å; L523-V568 WeakPolarHBondContact O-CB 3.3Å; L523-V568 PolarHBondContact O-N 3.1Å
524	L	96.9	Very high	92.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.6	176.3	-49.7	179.5	0	0	0	109.5	I506 V519 T537 L538 F544 V565 R566 S571 L573	I506-L524 HydrophobicContact CD1-CD1 4.44Å; I506-L524 HydrophobicContact CD1-CD2 3.75Å; V519-L524 HydrophobicContact CG2-CD1 3.65Å; V519-L524 HydrophobicContact CG2-CG 4.32Å; L524-T537 CarbonylContact O-C 3.58Å; L524-T537 VanDerWaalsContact O-CA 3.29Å; L524-T537 WeakPolarHBondContact O-CA 3.41Å; L524-L538 HydrophobicContact CB-CB 4.2Å; L524-L538 PolarHBondContact N-O 3.37Å; L524-L538 VanDerWaalsContact N-O 3.12Å; L524-L538 PolarHBondContact O-N 3.44Å; L524-F544 HydrophobicContact CD1-CD1 4.11Å; L524-F544 HydrophobicContact CD1-CE1 3.27Å; L524-F544 HydrophobicContact CD1-CZ 3.63Å; L524-V565 HydrophobicContact CB-CG1 3.88Å; L524-V565 HydrophobicContact CD1-CG1 4.02Å; L524-R566 CarbonylContact C-O 3.52Å; L524-R566 WeakPolarHBondContact CA-O 3.09Å; L524-S571 WeakPolarHBondContact CD2-OG 3.37Å; L524-L573 HydrophobicContact CD1-CD1 4.16Å; L524-L573 HydrophobicContact CD1-CD2 3.87Å
525	N	96.2	Very high	92.1	Very high	24 Å²	24	45.5 Å²	45.5	13%	0.128	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	127.8	172.7	-75	-11.7	0	0	0	109.3	V527 V534 T537 R566 V568	N525-V527 HydrophobicContact CB-CG2 4.24Å; N525-V534 HydrophobicContact CB-CG1 3.87Å; N525-V534 HydrophobicContact CB-CG2 4.15Å; N525-T537 WeakPolarHBondContact OD1-CG2 3.46Å; N525-T537 PolarHBondContact OD1-OG1 3.14Å; N525-R566 PolarHBondContact N-O 2.98Å; N525-R566 PolarHBondContact O-N 2.8Å; N525-V568 HydrophobicContact CB-CG2 4.16Å; N525-V568 VanDerWaalsContact CG-CG2 3.4Å; N525-V568 VanDerWaalsContact ND2-CG2 3.3Å; N525-V568 WeakPolarHBondContact ND2-CG2 3.4Å
526	V	95.1	Very high	92.1	Very high	17 Å²	17	47.6 Å²	47.6	10%	0.103	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.5	164.2	-174.9	0	0	0	0	106.6	L535 V536 L538 T563 S564 V565	V526-L535 HydrophobicContact CG1-CB 4.42Å; V526-L535 HydrophobicContact CG1-CD1 4.36Å; V526-L535 PolarHBondContact O-N 2.7Å; V526-V536 HydrophobicContact CB-CB 4.38Å; V526-V536 HydrophobicContact CG2-CB 4.34Å; V526-V536 PolarHBondContact N-O 3.44Å; V526-L538 HydrophobicContact CG2-CD1 4.03Å; V526-L538 HydrophobicContact CG2-CD2 4.29Å; V526-L538 HydrophobicContact CG2-CG 3.97Å; V526-T563 HydrophobicContact CG1-CG2 3.67Å; V526-T563 WeakPolarHBondContact CG1-OG1 3.14Å; V526-S564 WeakPolarHBondContact CA-O 3.46Å; V526-V565 HydrophobicContact CG2-CG2 4.38Å
527	V	94.3	Very high	92.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	139.4	-172.3	-168.8	0	0	0	0	108.9	N525 G531 T533 S564 R566	N525-V527 HydrophobicContact CB-CG2 4.24Å; V527-G531 WeakPolarHBondContact CG1-O 3.36Å; V527-T533 WeakPolarHBondContact CA-O 3.36Å; V527-S564 PolarHBondContact N-O 3.12Å; V527-R566 HydrophobicContact CG2-CB 3.94Å
528	A	91.9	Very high	92.2	Very high	23 Å²	23	51 Å²	51	19%	0.19	29%	0.293	C	S	.	.			trans	-68.8	178.6	173.5	0	0	0	0	0	111.6	D530 G531 T533 L535	A528-D530 PolarHBondContact O-N 3.38Å; A528-D530 VanDerWaalsContact O-N 3.11Å; A528-G531 PolarHBondContact O-N 2.89Å; A528-T533 WeakPolarHBondContact CB-OG1 3.31Å; A528-T533 PolarHBondContact N-O 3.41Å; A528-L535 HydrophobicContact CB-CD1 4.21Å; A528-L535 HydrophobicContact CB-CD2 4.25Å; A528-L535 HydrophobicContact CB-CG 4.2Å
529	D	87.9	Confident	92.2	Very high	119 Å²	119	57.6 Å²	57.6	64%	0.636	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.5	-177.2	-63.8	-10.6	0	0	0	113	K509 G531	K509-D529 WeakPolarHBondContact CD-OD1 3.28Å; K509-D529 VanDerWaalsContact NZ-CG 3.26Å; K509-D529 IonicContact NZ-OD1 2.86Å; K509-D529 PolarHBondContact NZ-OD1 2.97Å; K509-D529 IonicContact NZ-OD2 3.83Å; K509-D529 PolarHBondContact NZ-OD2 3.49Å; D529-G531 VanDerWaalsContact C-N 3.27Å; D529-G531 PolarHBondContact O-N 3.29Å
530	D	87.9	Confident	92.1	Very high	87 Å²	87	62.2 Å²	62.2	47%	0.465	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-13.2	176.3	67	1.1	0	0	0	113.8	A528 V532 T533	A528-D530 PolarHBondContact O-N 3.38Å; A528-D530 VanDerWaalsContact O-N 3.11Å; D530-V532 PolarHBondContact O-N 3.14Å; D530-V532 PolarHBondContact OD1-N 3.49Å; D530-T533 PolarHBondContact OD1-N 3.39Å; D530-T533 PolarHBondContact OD1-OG1 3.38Å; D530-T533 WeakPolarHBondContact OD2-CB 3.33Å; D530-T533 WeakPolarHBondContact OD2-CG2 3.49Å; D530-T533 PolarHBondContact OD2-N 3.32Å; D530-T533 PolarHBondContact OD2-OG1 3Å
531	G	84.5	Confident	91.9	Very high	20 Å²	20	60 Å²	60	21%	0.206	34%	0.336	C	S	.	.	S	Bend	trans	71.8	1.5	-176.1	0	0	0	0	0	115	V527 A528 D529 R566	V527-G531 WeakPolarHBondContact CG1-O 3.36Å; A528-G531 PolarHBondContact O-N 2.89Å; D529-G531 VanDerWaalsContact C-N 3.27Å; D529-G531 PolarHBondContact O-N 3.29Å; G531-R566 PolarHBondContact O-NH1 2.88Å
532	V	88.2	Confident	91.9	Very high	113 Å²	113	57.5 Å²	57.5	69%	0.685	33%	0.33	S	S	*	.	S	Bend	trans	-119.1	-47.2	-172.4	-179	0	0	0	0	111.4	D530 V534	D530-V532 PolarHBondContact O-N 3.14Å; D530-V532 PolarHBondContact OD1-N 3.49Å; V532-V534 PolarHBondContact O-N 3.01Å
533	T	91.7	Very high	91.8	Very high	69 Å²	69	57.1 Å²	57.1	42%	0.423	32%	0.322	S	S	.	.			trans	-75.4	123.5	-177.1	50.4	0	0	0	0	110.8	V527 A528 D530	V527-T533 WeakPolarHBondContact CA-O 3.36Å; A528-T533 WeakPolarHBondContact CB-OG1 3.31Å; A528-T533 PolarHBondContact N-O 3.41Å; D530-T533 PolarHBondContact OD1-N 3.39Å; D530-T533 PolarHBondContact OD1-OG1 3.38Å; D530-T533 WeakPolarHBondContact OD2-CB 3.33Å; D530-T533 WeakPolarHBondContact OD2-CG2 3.49Å; D530-T533 PolarHBondContact OD2-N 3.32Å; D530-T533 PolarHBondContact OD2-OG1 3Å
534	V	92.4	Very high	91.5	Very high	68 Å²	68	53.9 Å²	53.9	41%	0.412	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.4	176.7	178.8	0	0	0	0	108.2	N525 V532	N525-V534 HydrophobicContact CB-CG1 3.87Å; N525-V534 HydrophobicContact CB-CG2 4.15Å; V532-V534 PolarHBondContact O-N 3.01Å
535	L	91.2	Very high	91.1	Very high	106 Å²	106	54.6 Å²	54.6	56%	0.555	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	-49.7	178.4	-62	174.3	0	0	0	110.7	V526 A528	V526-L535 HydrophobicContact CG1-CB 4.42Å; V526-L535 HydrophobicContact CG1-CD1 4.36Å; V526-L535 PolarHBondContact O-N 2.7Å; A528-L535 HydrophobicContact CB-CD1 4.21Å; A528-L535 HydrophobicContact CB-CD2 4.25Å; A528-L535 HydrophobicContact CB-CG 4.2Å
536	V	93.1	Very high	90.5	Very high	84 Å²	84	55.3 Å²	55.3	51%	0.509	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	142.7	-176.9	-179.2	0	0	0	0	109.8	V526 L538	V526-V536 HydrophobicContact CB-CB 4.38Å; V526-V536 HydrophobicContact CG2-CB 4.34Å; V526-V536 PolarHBondContact N-O 3.44Å; V536-L538 HydrophobicContact CG1-CD2 4.27Å
537	T	94.3	Very high	89.9	Confident	64 Å²	64	55 Å²	55	39%	0.393	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.6	169.1	-58.8	0	0	0	0	110.3	L523 L524 N525	L523-T537 HydrophobicContact CB-CG2 4.47Å; L523-T537 HydrophobicContact CD2-CG2 4.07Å; L524-T537 CarbonylContact O-C 3.58Å; L524-T537 VanDerWaalsContact O-CA 3.29Å; L524-T537 WeakPolarHBondContact O-CA 3.41Å; N525-T537 WeakPolarHBondContact OD1-CG2 3.46Å; N525-T537 PolarHBondContact OD1-OG1 3.14Å
538	L	93.7	Very high	89.1	Confident	25 Å²	25	55.1 Å²	55.1	13%	0.131	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	133.4	174.9	-51.7	176.4	0	0	0	109.9	L524 V526 V536 F544 V565	L524-L538 HydrophobicContact CB-CB 4.2Å; L524-L538 PolarHBondContact N-O 3.37Å; L524-L538 VanDerWaalsContact N-O 3.12Å; L524-L538 PolarHBondContact O-N 3.44Å; V526-L538 HydrophobicContact CG2-CD1 4.03Å; V526-L538 HydrophobicContact CG2-CD2 4.29Å; V526-L538 HydrophobicContact CG2-CG 3.97Å; V536-L538 HydrophobicContact CG1-CD2 4.27Å; L538-F544 HydrophobicContact CD1-CB 3.94Å; L538-F544 HydrophobicContact CD1-CD1 3.87Å; L538-F544 HydrophobicContact CD1-CG 4.01Å; L538-V565 HydrophobicContact CD1-CG1 4.42Å
539	K	92.6	Very high	88.6	Confident	139 Å²	139	54.1 Å²	54.1	60%	0.604	30%	0.304	S	S	*	.			trans	-110.5	178.1	179.2	-64.1	-175.5	179.1	179.2	0	110	V519 L523 G541 S542	V519-K539 WeakPolarHBondContact CB-O 3.44Å; L523-K539 HydrophobicContact CD2-CG 3.94Å; K539-G541 PolarHBondContact O-N 3.4Å; K539-S542 PolarHBondContact N-OG 3.13Å; K539-S542 VanDerWaalsContact O-CB 3.24Å; K539-S542 WeakPolarHBondContact O-CB 3.32Å; K539-S542 PolarHBondContact O-N 3.33Å; K539-S542 VanDerWaalsContact O-N 3.09Å; K539-S542 PolarHBondContact O-OG 3.14Å; K539-S542 VanDerWaalsContact O-OG 3.12Å
540	E	90.7	Very high	88	Confident	98 Å²	98	49.1 Å²	49.1	46%	0.458	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	135	173.7	176.9	-177.8	161.6	0	0	111.9	K476 K520 S542	K476-E540 IonicContact NZ-OE1 3.96Å; K476-E540 PolarHBondContact NZ-OE1 3.08Å; K520-E540 VanDerWaalsContact O-CD 3.24Å; K520-E540 WeakPolarHBondContact O-CG 3.25Å; E540-S542 VanDerWaalsContact C-N 3.31Å
541	G	87.3	Confident	87.4	Confident	8 Å²	8	49.4 Å²	49.4	8%	0.082	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-8.6	-177.2	0	0	0	0	0	114.2	A477 V519 K539	A477-G541 WeakPolarHBondContact CA-O 3.47Å; V519-G541 PolarHBondContact O-N 2.89Å; K539-G541 PolarHBondContact O-N 3.4Å
542	S	90.9	Very high	87.2	Confident	36 Å²	36	48.8 Å²	48.8	25%	0.252	27%	0.271	S	S	.	.			trans	-69.3	141	169.9	-61.8	0	0	0	0	110.7	V519 K539 E540	V519-S542 PolarHBondContact N-O 3.22Å; K539-S542 PolarHBondContact N-OG 3.13Å; K539-S542 VanDerWaalsContact O-CB 3.24Å; K539-S542 WeakPolarHBondContact O-CB 3.32Å; K539-S542 PolarHBondContact O-N 3.33Å; K539-S542 VanDerWaalsContact O-N 3.09Å; K539-S542 PolarHBondContact O-OG 3.14Å; K539-S542 VanDerWaalsContact O-OG 3.12Å; E540-S542 VanDerWaalsContact C-N 3.31Å
543	V	90.3	Very high	86.4	Confident	18 Å²	18	45.9 Å²	45.9	11%	0.109	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	141.1	172.1	-176	0	0	0	0	107.8	A477 L479 M516 Y517 I518	A477-V543 HydrophobicContact CB-CG2 3.42Å; A477-V543 VanDerWaalsContact CB-CG2 3.42Å; L479-V543 HydrophobicContact CB-CG2 4.31Å; L479-V543 HydrophobicContact CD2-CG1 4.08Å; M516-V543 HydrophobicContact CG-CG1 3.95Å; M516-V543 HydrophobicContact SD-CG1 3.61Å; Y517-V543 WeakPolarHBondContact O-CA 3.45Å; I518-V543 HydrophobicContact CG1-CG1 4.49Å; I518-V543 HydrophobicContact CG1-CG2 4.23Å; I518-V543 HydrophobicContact CG2-CG2 4.33Å
544	F	90.9	Very high	85.5	Confident	14 Å²	14	42.8 Å²	42.8	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156.7	172.4	69.1	-83.7	0	0	0	111.7	I506 Y517 V519 L524 L538 E546 V565 L573	I506-F544 HydrophobicContact CB-CE2 4.38Å; I506-F544 HydrophobicContact CB-CZ 4.35Å; I506-F544 HydrophobicContact CG2-CE2 3.93Å; I506-F544 HydrophobicContact CG2-CZ 3.88Å; Y517-F544 VanDerWaalsContact CB-CE1 3.42Å; Y517-F544 HydrophobicContact CD2-CD2 4.28Å; Y517-F544 AromaticContact CD2-CE2 3.61Å; Y517-F544 HydrophobicContact CD2-CE2 3.61Å; Y517-F544 AromaticContact CD2-CZ 3.89Å; Y517-F544 HydrophobicContact CD2-CZ 3.89Å; Y517-F544 HydrophobicContact CG-CE1 4.37Å; Y517-F544 HydrophobicContact CG-CE2 4.02Å; Y517-F544 AromaticContact CG-CZ 3.81Å; Y517-F544 HydrophobicContact CG-CZ 3.81Å; Y517-F544 PolarHBondContact N-O 3.4Å; Y517-F544 PolarHBondContact O-N 3.1Å; V519-F544 HydrophobicContact CG2-CD1 4.18Å; V519-F544 HydrophobicContact CG2-CE1 3.98Å; L524-F544 HydrophobicContact CD1-CD1 4.11Å; L524-F544 HydrophobicContact CD1-CE1 3.27Å; L524-F544 HydrophobicContact CD1-CZ 3.63Å; L538-F544 HydrophobicContact CD1-CB 3.94Å; L538-F544 HydrophobicContact CD1-CD1 3.87Å; L538-F544 HydrophobicContact CD1-CG 4.01Å; F544-E546 VanDerWaalsContact C-N 3.32Å; F544-E546 WeakPolarHBondContact CA-OE2 3.27Å; F544-V565 HydrophobicContact CD2-CB 4.45Å; F544-V565 HydrophobicContact CD2-CG1 4.44Å; F544-V565 HydrophobicContact CD2-CG2 4Å; F544-V565 HydrophobicContact CE2-CB 4.21Å; F544-V565 HydrophobicContact CE2-CG1 4.12Å; F544-V565 HydrophobicContact CE2-CG2 4.26Å; F544-V565 HydrophobicContact CZ-CG1 4.28Å; F544-L573 HydrophobicContact CE1-CD1 4.04Å; F544-L573 HydrophobicContact CE1-CD2 4.43Å; F544-L573 HydrophobicContact CZ-CD1 3.71Å
545	G	88.3	Confident	84.9	Confident	14 Å²	14	40.4 Å²	40.4	14%	0.144	22%	0.221	C	C	.	.	S	Bend	trans	84.3	7.3	-179	0	0	0	0	0	114.2	L547 R561	G545-L547 VanDerWaalsContact C-N 3.31Å; G545-L547 PolarHBondContact O-N 2.93Å; G545-R561 PolarHBondContact O-NH1 3.15Å; G545-R561 VanDerWaalsContact O-NH1 3.14Å
546	E	83.4	Confident	84.4	Confident	40 Å²	40	43 Å²	43	19%	0.187	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-34	176.6	71.6	-78.9	-162.8	0	0	112.5	L479 M516 F544 S548 I549 M550	L479-E546 HydrophobicContact CD2-CB 3.98Å; M516-E546 HydrophobicContact SD-CB 4.3Å; F544-E546 VanDerWaalsContact C-N 3.32Å; F544-E546 WeakPolarHBondContact CA-OE2 3.27Å; E546-S548 PolarHBondContact O-N 3.49Å; E546-I549 VanDerWaalsContact O-CG1 3.25Å; E546-I549 WeakPolarHBondContact O-CG1 3.19Å; E546-M550 WeakPolarHBondContact O-CG 3.48Å; E546-M550 PolarHBondContact O-N 3.44Å
547	L	81.8	Confident	83.7	Confident	11 Å²	11	41.6 Å²	41.6	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-71.8	-32.1	-176.9	-63.1	177.9	0	0	0	113.8	G545 T562 I602 L603	G545-L547 VanDerWaalsContact C-N 3.31Å; G545-L547 PolarHBondContact O-N 2.93Å; L547-T562 HydrophobicContact CD1-CG2 4.44Å; L547-I602 HydrophobicContact CD1-CG2 3.8Å; L547-I602 HydrophobicContact CD2-CB 4.17Å; L547-I602 HydrophobicContact CD2-CG2 4.09Å; L547-I602 HydrophobicContact CG-CG2 4.4Å; L547-L603 HydrophobicContact CD1-CD2 4.29Å; L547-L603 HydrophobicContact CD2-CD2 4.5Å; L547-L603 HydrophobicContact CD2-CG 4.2Å
548	S	78.9	Confident	83.1	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-76.8	-33.1	-176.6	-54.9	0	0	0	0	111.9	E546 N559 R560 R561	E546-S548 PolarHBondContact O-N 3.49Å; S548-N559 PolarHBondContact O-OD1 3.03Å; S548-R560 PolarHBondContact OG-O 3.46Å; S548-R561 WeakPolarHBondContact OG-CA 3.45Å
549	I	79.8	Confident	82.8	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-77.1	-31.8	179.8	62.9	176.8	0	0	0	111.6	M516 E546 D551 K578 L581 F582	M516-I549 HydrophobicContact CB-CD1 3.45Å; M516-I549 VanDerWaalsContact CB-CD1 3.45Å; M516-I549 HydrophobicContact CE-CD1 3.81Å; M516-I549 HydrophobicContact CG-CD1 4.47Å; M516-I549 HydrophobicContact SD-CD1 4.31Å; E546-I549 VanDerWaalsContact O-CG1 3.25Å; E546-I549 WeakPolarHBondContact O-CG1 3.19Å; I549-D551 PolarHBondContact O-N 3.18Å; I549-K578 HydrophobicContact CB-CB 4.2Å; I549-K578 HydrophobicContact CB-CG 4.16Å; I549-K578 HydrophobicContact CG2-CB 4.07Å; I549-K578 VanDerWaalsContact O-CE 3.28Å; I549-K578 WeakPolarHBondContact O-CE 3.47Å; I549-L581 HydrophobicContact CD1-CD2 3.33Å; I549-L581 HydrophobicContact CG1-CD2 4.17Å; I549-F582 WeakPolarHBondContact O-CE2 3.22Å
550	M	75.5	Confident	82.6	Confident	14 Å²	14	41.5 Å²	41.5	7%	0.069	22%	0.215	C	C	.	.	S	Bend	trans	-75.4	109.2	179.9	-62.9	-73.2	-76.3	0	0	109.5	E546 I552 L581 L585 L595 L596	E546-M550 WeakPolarHBondContact O-CG 3.48Å; E546-M550 PolarHBondContact O-N 3.44Å; M550-I552 HydrophobicContact CB-CD1 3.93Å; M550-I552 HydrophobicContact CB-CG1 3.88Å; M550-I552 PolarHBondContact O-N 2.89Å; M550-L581 HydrophobicContact SD-CD2 4.45Å; M550-L585 HydrophobicContact SD-CD1 4.5Å; M550-L595 VanDerWaalsContact CE-C 3.4Å; M550-L595 HydrophobicContact CE-CB 3.55Å; M550-L595 HydrophobicContact SD-CB 4.48Å; M550-L596 HydrophobicContact CE-CB 4.24Å; M550-L596 HydrophobicContact CE-CD2 3.64Å; M550-L596 HydrophobicContact CE-CG 3.67Å
551	D	76.6	Confident	82.6	Confident	93 Å²	93	37.5 Å²	37.5	50%	0.497	20%	0.196	S	C	.	.			trans	-70.5	62.2	176.8	-70.3	-36.4	0	0	0	111.5	I549 P553 K578 F582	I549-D551 PolarHBondContact O-N 3.18Å; D551-P553 WeakPolarHBondContact O-CD 3.47Å; D551-K578 IonicContact OD1-NZ 3.01Å; D551-K578 PolarHBondContact OD1-NZ 2.62Å; D551-K578 VanDerWaalsContact OD2-CE 3.23Å; D551-K578 WeakPolarHBondContact OD2-CE 3.4Å; D551-K578 IonicContact OD2-NZ 2.68Å; D551-K578 PolarHBondContact OD2-NZ 2.69Å; D551-F582 HydrophobicContact CB-CZ 4.42Å
552	I	79.5	Confident	82.6	Confident	8 Å²	8	39 Å²	39	4%	0.041	20%	0.203	C	C	.	.			trans	-74.6	119.2	-178.5	-62.1	167.4	0	0	0	108.2	M550 N555 L596 R600 L603	M550-I552 HydrophobicContact CB-CD1 3.93Å; M550-I552 HydrophobicContact CB-CG1 3.88Å; M550-I552 PolarHBondContact O-N 2.89Å; I552-N555 WeakPolarHBondContact O-CB 3.34Å; I552-N555 PolarHBondContact O-N 3.4Å; I552-L596 HydrophobicContact CG1-CD2 3.87Å; I552-R600 HydrophobicContact CG2-CG 3.73Å; I552-L603 HydrophobicContact CB-CD1 4.11Å; I552-L603 HydrophobicContact CD1-CD1 3.7Å; I552-L603 HydrophobicContact CG2-CD1 3.96Å
553	P	71.4	Confident	82.5	Confident	52 Å²	52	39.1 Å²	39.1	34%	0.338	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	139.5	172.4	26.8	-33.4	0	0	0	109.3	D551	D551-P553 WeakPolarHBondContact O-CD 3.47Å
554	G	73.6	Confident	82.7	Confident	4 Å²	4	39 Å²	39	4%	0.041	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	-0.9	-176.9	0	0	0	0	0	114.7	R556 I610 E613	G554-R556 PolarHBondContact O-N 3.37Å; G554-I610 PolarHBondContact O-N 2.98Å; G554-E613 WeakPolarHBondContact CA-OE2 3.33Å; G554-E613 PolarHBondContact N-OE2 2.73Å
555	N	80.1	Confident	82.9	Confident	18 Å²	18	38.5 Å²	38.5	10%	0.096	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-74.1	111.3	177.5	-179	2.7	0	0	0	110.9	I552 N557 G558 L603	I552-N555 WeakPolarHBondContact O-CB 3.34Å; I552-N555 PolarHBondContact O-N 3.4Å; N555-N557 PolarHBondContact O-N 3.4Å; N555-N557 VanDerWaalsContact O-N 3.11Å; N555-N557 PolarHBondContact OD1-N 3.35Å; N555-G558 PolarHBondContact ND2-O 3.36Å; N555-G558 VanDerWaalsContact ND2-O 3.07Å; N555-G558 PolarHBondContact O-N 2.85Å; N555-L603 HydrophobicContact CB-CD1 4.02Å
556	R	78.9	Confident	83.2	Confident	160 Å²	160	40.7 Å²	40.7	60%	0.604	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.5	178.3	-70.6	179.9	-179.5	-175.6	-2.1	113.8	G554 K607 L608 I610	G554-R556 PolarHBondContact O-N 3.37Å; R556-K607 PolarHBondContact NH1-O 3.38Å; R556-L608 WeakPolarHBondContact CB-O 3.44Å; R556-L608 VanDerWaalsContact CG-O 3.31Å; R556-L608 WeakPolarHBondContact CG-O 3.18Å; R556-L608 PolarHBondContact N-O 3.13Å; R556-I610 HydrophobicContact CG-CD1 3.9Å; R556-I610 HydrophobicContact CG-CG1 3.62Å
557	N	79.2	Confident	83.8	Confident	54 Å²	54	38.9 Å²	38.9	29%	0.289	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-7.1	-176.1	-67.1	-10	0	0	0	112.7	N555 N559 R560	N555-N557 PolarHBondContact O-N 3.4Å; N555-N557 VanDerWaalsContact O-N 3.11Å; N555-N557 PolarHBondContact OD1-N 3.35Å; N557-N559 PolarHBondContact O-N 2.95Å; N557-R560 VanDerWaalsContact O-CB 3.26Å; N557-R560 WeakPolarHBondContact O-CB 3.49Å; N557-R560 PolarHBondContact O-N 2.94Å
558	G	82.4	Confident	84.4	Confident	36 Å²	36	41.8 Å²	41.8	37%	0.371	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	-135.8	-174.8	0	0	0	0	0	112.3	N555 R560	N555-G558 PolarHBondContact ND2-O 3.36Å; N555-G558 VanDerWaalsContact ND2-O 3.07Å; N555-G558 PolarHBondContact O-N 2.85Å; G558-R560 PolarHBondContact O-N 3.16Å; G558-R560 VanDerWaalsContact O-N 3.14Å
559	N	85.8	Confident	85.2	Confident	51 Å²	51	42.9 Å²	42.9	27%	0.273	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	27.6	177.7	-168.2	1.2	0	0	0	113.3	I512 G513 S548 N557	I512-N559 WeakPolarHBondContact CA-O 3.17Å; G513-N559 PolarHBondContact N-O 2.94Å; G513-N559 PolarHBondContact O-OD1 3.41Å; S548-N559 PolarHBondContact O-OD1 3.03Å; N557-N559 PolarHBondContact O-N 2.95Å
560	R	89.6	Confident	85.9	Confident	140 Å²	140	45 Å²	45	53%	0.528	24%	0.235	S	C	.	.	B	Isolated β-bridge	trans	-98.9	150.1	175.7	-60.5	-175.7	178.5	-84.9	1	111.2	G510 E511 S548 N557 G558	G510-R560 PolarHBondContact O-NH1 2.9Å; E511-R560 CarbonylContact O-C 3.47Å; E511-R560 VanDerWaalsContact O-CA 3.27Å; E511-R560 WeakPolarHBondContact O-CA 3.49Å; S548-R560 PolarHBondContact OG-O 3.46Å; N557-R560 VanDerWaalsContact O-CB 3.26Å; N557-R560 WeakPolarHBondContact O-CB 3.49Å; N557-R560 PolarHBondContact O-N 2.94Å; G558-R560 PolarHBondContact O-N 3.16Å; G558-R560 VanDerWaalsContact O-N 3.14Å
561	R	90.4	Very high	86.8	Confident	13 Å²	13	44.4 Å²	44.4	5%	0.049	23%	0.232	C	C	.	.			trans	-68.1	131.2	174.8	-64.2	-66.5	-168.3	-165.9	3.4	110	C507 R508 G510 E511 G513 D515 G545 S548	C507-R561 HydrophobicContact CB-CG 4.01Å; R508-R561 WeakPolarHBondContact O-CB 3.31Å; G510-R561 PolarHBondContact N-O 3.49Å; E511-R561 HydrophobicContact CB-CG 4.28Å; E511-R561 WeakPolarHBondContact O-CG 3.46Å; E511-R561 PolarHBondContact O-N 3.09Å; G513-R561 VanDerWaalsContact CA-CZ 3.48Å; D515-R561 VanDerWaalsContact O-CZ 3.23Å; D515-R561 PolarHBondContact O-NH1 3.15Å; D515-R561 PolarHBondContact O-NH2 3.2Å; G545-R561 PolarHBondContact O-NH1 3.15Å; G545-R561 VanDerWaalsContact O-NH1 3.14Å; S548-R561 WeakPolarHBondContact OG-CA 3.45Å
562	T	87.1	Confident	87.5	Confident	39 Å²	39	40.2 Å²	40.2	24%	0.239	21%	0.21	C	C	.	.	S	Bend	trans	-80	-27.7	-177.8	54.6	0	0	0	0	113.3	L547 L608	L547-T562 HydrophobicContact CD1-CG2 4.44Å; T562-L608 HydrophobicContact CG2-CD1 4.05Å
563	T	88.9	Confident	88.2	Confident	40 Å²	40	39.8 Å²	39.8	25%	0.245	21%	0.208	C	C	.	.	S	Bend	trans	-143.7	161.1	-175.2	-167.8	0	0	0	0	111.7	V526 V565	V526-T563 HydrophobicContact CG1-CG2 3.67Å; V526-T563 WeakPolarHBondContact CG1-OG1 3.14Å; T563-V565 HydrophobicContact CG2-CG2 4.19Å
564	S	94.1	Very high	89.2	Confident	15 Å²	15	37.6 Å²	37.6	11%	0.105	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	130.1	175	-62	0	0	0	0	110.2	C507 K509 V526 V527	C507-S564 CarbonylContact O-C 3.55Å; C507-S564 WeakPolarHBondContact O-CA 3.43Å; K509-S564 PolarHBondContact N-OG 3.26Å; V526-S564 WeakPolarHBondContact CA-O 3.46Å; V527-S564 PolarHBondContact N-O 3.12Å
565	V	95.7	Very high	90.1	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.018	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.4	179.3	-173.4	0	0	0	0	109.6	Y505 I506 C507 L524 V526 L538 F544 T563	Y505-V565 CarbonylContact C-O 3.54Å; Y505-V565 WeakPolarHBondContact CA-O 3.31Å; I506-V565 HydrophobicContact CD1-CG1 4.16Å; I506-V565 PolarHBondContact N-O 3.27Å; C507-V565 PolarHBondContact O-N 3.11Å; L524-V565 HydrophobicContact CB-CG1 3.88Å; L524-V565 HydrophobicContact CD1-CG1 4.02Å; V526-V565 HydrophobicContact CG2-CG2 4.38Å; L538-V565 HydrophobicContact CD1-CG1 4.42Å; F544-V565 HydrophobicContact CD2-CB 4.45Å; F544-V565 HydrophobicContact CD2-CG1 4.44Å; F544-V565 HydrophobicContact CD2-CG2 4Å; F544-V565 HydrophobicContact CE2-CB 4.21Å; F544-V565 HydrophobicContact CE2-CG1 4.12Å; F544-V565 HydrophobicContact CE2-CG2 4.26Å; F544-V565 HydrophobicContact CZ-CG1 4.28Å; T563-V565 HydrophobicContact CG2-CG2 4.19Å
566	R	95.5	Very high	90.7	Very high	61 Å²	61	36.8 Å²	36.8	23%	0.23	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.3	-178	-173.6	173.3	69.8	-154.9	2.8	111.1	D504 Y505 L524 N525 V527 G531	D504-R566 CarbonylContact O-C 3.58Å; D504-R566 WeakPolarHBondContact O-CA 3.45Å; Y505-R566 HydrophobicContact CD1-CB 4.07Å; Y505-R566 HydrophobicContact CE1-CB 4.04Å; Y505-R566 HydrophobicContact CE1-CG 4.46Å; Y505-R566 HydrophobicContact CE2-CG 4.5Å; Y505-R566 PolarHBondContact OH-NH1 3.04Å; L524-R566 CarbonylContact C-O 3.52Å; L524-R566 WeakPolarHBondContact CA-O 3.09Å; N525-R566 PolarHBondContact N-O 2.98Å; N525-R566 PolarHBondContact O-N 2.8Å; V527-R566 HydrophobicContact CG2-CB 3.94Å; G531-R566 PolarHBondContact O-NH1 2.88Å
567	S	96.2	Very high	91.4	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.007	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	132.7	174.3	-158.6	0	0	0	0	111.2	S501 G503 D504 G569 S571	S501-S567 WeakPolarHBondContact O-CB 3.29Å; G503-S567 WeakPolarHBondContact CA-O 3.37Å; G503-S567 PolarHBondContact N-O 2.93Å; D504-S567 PolarHBondContact O-N 3Å; S567-G569 WeakPolarHBondContact CB-O 3.48Å; S567-G569 PolarHBondContact OG-O 3.31Å; S567-S571 VanDerWaalsContact OG-CB 3.24Å; S567-S571 WeakPolarHBondContact OG-CB 3.5Å; S567-S571 PolarHBondContact OG-OG 3.15Å
568	V	94.5	Very high	92	Very high	73 Å²	73	29.7 Å²	29.7	44%	0.442	16%	0.162	S	C	.	.	S	Bend	trans	-80.4	-40.5	175.1	-178.3	0	0	0	0	110.8	L523 N525	L523-V568 HydrophobicContact CB-CB 4.19Å; L523-V568 HydrophobicContact CB-CG2 4.32Å; L523-V568 WeakPolarHBondContact O-CB 3.3Å; L523-V568 PolarHBondContact O-N 3.1Å; N525-V568 HydrophobicContact CB-CG2 4.16Å; N525-V568 VanDerWaalsContact CG-CG2 3.4Å; N525-V568 VanDerWaalsContact ND2-CG2 3.3Å; N525-V568 WeakPolarHBondContact ND2-CG2 3.4Å
569	G	94	Very high	92.4	Very high	25 Å²	25	32 Å²	32	26%	0.258	17%	0.172	S	C	.	.	S	Bend	trans	-129.3	-161	178.6	0	0	0	0	0	111.6	S501 S567 S571	S501-G569 CarbonylContact C-O 3.58Å; S567-G569 WeakPolarHBondContact CB-O 3.48Å; S567-G569 PolarHBondContact OG-O 3.31Å; G569-S571 PolarHBondContact O-N 2.61Å
570	F	94.5	Very high	92.7	Very high	46 Å²	46	31.4 Å²	31.4	20%	0.202	17%	0.169	C	C	.	.			trans	-67.7	121.2	163.6	-75.1	-78.8	0	0	0	109.2	W437 Y440 F500 P502	W437-F570 HydrophobicContact CB-CE1 4.47Å; Y440-F570 HydrophobicContact CD1-CB 4.22Å; Y440-F570 AromaticContact CD1-CD1 3.77Å; Y440-F570 HydrophobicContact CD1-CD1 3.77Å; Y440-F570 HydrophobicContact CD1-CE1 4.37Å; Y440-F570 HydrophobicContact CD1-CG 4.04Å; Y440-F570 HydrophobicContact CD2-CB 3.95Å; Y440-F570 HydrophobicContact CD2-CD1 4.12Å; Y440-F570 AromaticContact CD2-CD2 3.77Å; Y440-F570 HydrophobicContact CD2-CD2 3.77Å; Y440-F570 HydrophobicContact CD2-CE2 4.3Å; Y440-F570 AromaticContact CD2-CG 3.67Å; Y440-F570 HydrophobicContact CD2-CG 3.67Å; Y440-F570 HydrophobicContact CE1-CB 3.86Å; Y440-F570 HydrophobicContact CE1-CD1 4.21Å; Y440-F570 HydrophobicContact CE1-CG 4.2Å; Y440-F570 HydrophobicContact CE2-CB 3.54Å; Y440-F570 HydrophobicContact CE2-CD2 4.13Å; Y440-F570 AromaticContact CE2-CG 3.83Å; Y440-F570 HydrophobicContact CE2-CG 3.83Å; Y440-F570 HydrophobicContact CG-CB 4.25Å; Y440-F570 AromaticContact CG-CD1 3.71Å; Y440-F570 HydrophobicContact CG-CD1 3.71Å; Y440-F570 HydrophobicContact CG-CD2 4.14Å; Y440-F570 HydrophobicContact CG-CE1 4.06Å; Y440-F570 HydrophobicContact CG-CE2 4.45Å; Y440-F570 AromaticContact CG-CG 3.76Å; Y440-F570 HydrophobicContact CG-CG 3.76Å; Y440-F570 HydrophobicContact CG-CZ 4.41Å; Y440-F570 VanDerWaalsContact CZ-CB 3.49Å; F500-F570 WeakPolarHBondContact O-CA 3.49Å; P502-F570 HydrophobicContact CG-CD2 3.95Å; P502-F570 HydrophobicContact CG-CE2 3.98Å; P502-F570 HydrophobicContact CG-CG 4.4Å; P502-F570 HydrophobicContact CG-CZ 4.46Å
571	S	94.2	Very high	92.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.2	-177.8	-65.2	0	0	0	0	110.4	I499 F500 K521 L524 S567 G569	I499-S571 WeakPolarHBondContact CA-O 3.42Å; F500-S571 PolarHBondContact N-O 3.27Å; F500-S571 PolarHBondContact O-N 2.83Å; K521-S571 CarbonylContact O-C 3.56Å; K521-S571 WeakPolarHBondContact O-CA 3.38Å; L524-S571 WeakPolarHBondContact CD2-OG 3.37Å; S567-S571 VanDerWaalsContact OG-CB 3.24Å; S567-S571 WeakPolarHBondContact OG-CB 3.5Å; S567-S571 PolarHBondContact OG-OG 3.15Å; G569-S571 PolarHBondContact O-N 2.61Å
572	E	92.9	Very high	92.6	Very high	5 Å²	5	26.3 Å²	26.3	2%	0.023	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118	173.2	-62.8	-178.7	-158.9	0	0	108.6	H446 L497 I499 K520 K521	H446-E572 IonicContact CD2-OE1 3.55Å; H446-E572 IonicContact CE1-OE2 3.8Å; H446-E572 VanDerWaalsContact NE2-CD 3.32Å; H446-E572 IonicContact NE2-OE1 2.63Å; H446-E572 PolarHBondContact NE2-OE1 3.49Å; H446-E572 IonicContact NE2-OE2 3.57Å; H446-E572 PolarHBondContact NE2-OE2 3.26Å; L497-E572 HydrophobicContact CD1-CB 4.1Å; I499-E572 HydrophobicContact CG1-CG 4.44Å; K520-E572 HydrophobicContact CB-CB 4.39Å; K520-E572 WeakPolarHBondContact CB-O 2.99Å; K520-E572 HydrophobicContact CD-CB 4.23Å; K520-E572 WeakPolarHBondContact CD-OE2 3.07Å; K520-E572 WeakPolarHBondContact CE-OE2 3.46Å; K520-E572 PolarHBondContact N-O 3.46Å; K520-E572 IonicContact NZ-OE2 2.79Å; K520-E572 PolarHBondContact NZ-OE2 3.12Å; K521-E572 HydrophobicContact CB-CB 4.07Å; K521-E572 HydrophobicContact CB-CG 4.33Å; K521-E572 PolarHBondContact N-O 3.35Å; K521-E572 VanDerWaalsContact N-O 3.13Å; K521-E572 PolarHBondContact O-N 3.13Å
573	L	93.7	Very high	92.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	141.2	-179.5	-52	-174.5	0	0	0	109.9	Q498 F500 I506 Y517 I518 V519 L524 F544	Q498-L573 PolarHBondContact N-O 2.94Å; Q498-L573 PolarHBondContact O-N 3.16Å; F500-L573 HydrophobicContact CD2-CD1 3.63Å; F500-L573 HydrophobicContact CD2-CG 3.98Å; F500-L573 HydrophobicContact CE2-CB 4.37Å; F500-L573 HydrophobicContact CE2-CD1 3.67Å; F500-L573 HydrophobicContact CE2-CG 4.22Å; I506-L573 HydrophobicContact CG1-CD1 3.99Å; I506-L573 HydrophobicContact CG2-CD1 4.02Å; Y517-L573 HydrophobicContact CD1-CB 4.24Å; Y517-L573 HydrophobicContact CD1-CD1 4.28Å; Y517-L573 HydrophobicContact CG-CD1 4.41Å; I518-L573 WeakPolarHBondContact O-CA 3.32Å; V519-L573 HydrophobicContact CB-CD2 4.13Å; V519-L573 HydrophobicContact CG1-CD2 4.12Å; V519-L573 HydrophobicContact CG2-CD2 3.92Å; L524-L573 HydrophobicContact CD1-CD1 4.16Å; L524-L573 HydrophobicContact CD1-CD2 3.87Å; F544-L573 HydrophobicContact CE1-CD1 4.04Å; F544-L573 HydrophobicContact CE1-CD2 4.43Å; F544-L573 HydrophobicContact CZ-CD1 3.71Å
574	F	92.3	Very high	92.8	Very high	5 Å²	5	26.9 Å²	26.9	2%	0.022	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	121	164.3	-67	-60	0	0	0	109.2	H470 T473 L495 K496 L497 Y517 I518 K520	H470-F574 AromaticContact CE1-CE1 3.3Å; H470-F574 WeakPolarHBondContact CE1-CE1 3.35Å; H470-F574 AromaticContact CE1-CZ 3.55Å; H470-F574 AromaticContact ND1-CE1 3.29Å; H470-F574 VanDerWaalsContact ND1-CE1 3.29Å; H470-F574 WeakPolarHBondContact ND1-CE1 3.15Å; H470-F574 AromaticContact ND1-CE2 3.7Å; H470-F574 AromaticContact ND1-CZ 3.09Å; H470-F574 WeakPolarHBondContact ND1-CZ 3.16Å; T473-F574 HydrophobicContact CG2-CD2 4.12Å; T473-F574 HydrophobicContact CG2-CE2 4.17Å; L495-F574 HydrophobicContact CB-CB 4.35Å; L495-F574 HydrophobicContact CB-CD1 4.39Å; L495-F574 HydrophobicContact CD1-CB 4.26Å; L495-F574 HydrophobicContact CD1-CG 4.34Å; L495-F574 HydrophobicContact CD2-CB 4.08Å; L495-F574 HydrophobicContact CG-CB 4.46Å; K496-F574 CarbonylContact O-C 3.4Å; K496-F574 WeakPolarHBondContact O-CA 3.49Å; L497-F574 HydrophobicContact CB-CD1 4.37Å; L497-F574 HydrophobicContact CB-CE1 4.25Å; L497-F574 HydrophobicContact CD1-CD1 4.13Å; L497-F574 HydrophobicContact CD1-CE1 3.85Å; Y517-F574 CarbonylContact C-O 3.57Å; Y517-F574 VanDerWaalsContact CA-O 3.31Å; Y517-F574 WeakPolarHBondContact CA-O 3.37Å; I518-F574 HydrophobicContact CB-CB 4.34Å; I518-F574 PolarHBondContact N-O 3.43Å; I518-F574 PolarHBondContact O-N 2.99Å; K520-F574 HydrophobicContact CB-CD2 3.95Å; K520-F574 HydrophobicContact CB-CE2 3.74Å; K520-F574 HydrophobicContact CB-CZ 4.42Å; K520-F574 HydrophobicContact CD-CD2 4.48Å; K520-F574 HydrophobicContact CD-CE1 4.28Å; K520-F574 HydrophobicContact CD-CE2 3.62Å; K520-F574 HydrophobicContact CD-CZ 3.49Å; K520-F574 VanDerWaalsContact CD-CZ 3.49Å; K520-F574 HydrophobicContact CG-CD2 4.34Å; K520-F574 HydrophobicContact CG-CE2 3.61Å; K520-F574 HydrophobicContact CG-CZ 4.04Å
575	A	93	Very high	92.5	Very high	5 Å²	5	26.3 Å²	26.3	4%	0.041	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.1	174.6	0	0	0	0	0	110	K496 Q498 M516 Y517	K496-A575 PolarHBondContact N-O 3.14Å; K496-A575 PolarHBondContact O-N 2.84Å; Q498-A575 HydrophobicContact CG-CB 4.12Å; M516-A575 CarbonylContact O-C 3.54Å; M516-A575 WeakPolarHBondContact O-CA 3.34Å; Y517-A575 HydrophobicContact CD1-CB 3.87Å; Y517-A575 HydrophobicContact CE1-CB 3.69Å
576	L	92.8	Very high	92.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.3	168.9	-172.7	66.9	0	0	0	109	I491 K494 L495 D515 M516 D580 L581	I491-L576 HydrophobicContact CG2-CD1 4.39Å; I491-L576 HydrophobicContact CG2-CD2 3.98Å; K494-L576 HydrophobicContact CB-CD1 3.96Å; L495-L576 HydrophobicContact CD2-CB 3.92Å; L495-L576 HydrophobicContact CD2-CD1 4.21Å; D515-L576 CarbonylContact C-O 3.56Å; D515-L576 VanDerWaalsContact CA-O 3.31Å; D515-L576 WeakPolarHBondContact CA-O 3.23Å; M516-L576 HydrophobicContact CE-CB 4.24Å; M516-L576 HydrophobicContact CE-CD2 3.54Å; M516-L576 HydrophobicContact CE-CG 4.4Å; M516-L576 PolarHBondContact N-O 3.07Å; M516-L576 PolarHBondContact O-N 2.91Å; L576-D580 HydrophobicContact CD1-CB 4.11Å; L576-L581 HydrophobicContact CD2-CB 3.85Å; L576-L581 HydrophobicContact CD2-CD1 3.71Å; L576-L581 HydrophobicContact CD2-CG 4.28Å; L576-L581 HydrophobicContact CG-CB 4.28Å
577	S	93.2	Very high	91.8	Very high	22 Å²	22	35.4 Å²	35.4	15%	0.154	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	154.2	-178.4	82.6	0	0	0	0	112.4	D515 S579 D580 L581	D515-S577 WeakPolarHBondContact OD1-CA 3.39Å; D515-S577 WeakPolarHBondContact OD1-CB 3.47Å; S577-S579 PolarHBondContact O-N 3.45Å; S577-S579 PolarHBondContact OG-OG 3.42Å; S577-S579 VanDerWaalsContact OG-OG 3.14Å; S577-D580 PolarHBondContact O-N 2.98Å; S577-D580 VanDerWaalsContact OG-CB 3.24Å; S577-D580 WeakPolarHBondContact OG-CB 3.34Å; S577-D580 PolarHBondContact OG-N 3.11Å; S577-D580 PolarHBondContact OG-OD2 2.9Å; S577-L581 PolarHBondContact O-N 3.28Å
578	K	90.4	Very high	91.4	Very high	44 Å²	44	38.5 Å²	38.5	19%	0.191	20%	0.199	C	C	.	.	H	α-helix	trans	-56.1	-49.2	175.8	-179.3	176.2	177.1	175.4	0	111.4	K514 I549 D551 D580 L581 F582	K514-K578 VanDerWaalsContact O-CB 3.31Å; K514-K578 WeakPolarHBondContact O-CB 3.46Å; K514-K578 PolarHBondContact O-N 2.91Å; I549-K578 HydrophobicContact CB-CB 4.2Å; I549-K578 HydrophobicContact CB-CG 4.16Å; I549-K578 HydrophobicContact CG2-CB 4.07Å; I549-K578 VanDerWaalsContact O-CE 3.28Å; I549-K578 WeakPolarHBondContact O-CE 3.47Å; D551-K578 IonicContact OD1-NZ 3.01Å; D551-K578 PolarHBondContact OD1-NZ 2.62Å; D551-K578 VanDerWaalsContact OD2-CE 3.23Å; D551-K578 WeakPolarHBondContact OD2-CE 3.4Å; D551-K578 IonicContact OD2-NZ 2.68Å; D551-K578 PolarHBondContact OD2-NZ 2.69Å; K578-D580 VanDerWaalsContact C-N 3.33Å; K578-D580 PolarHBondContact O-N 2.98Å; K578-L581 PolarHBondContact O-N 3.15Å; K578-F582 HydrophobicContact CD-CE2 4.42Å; K578-F582 HydrophobicContact CG-CD2 3.76Å; K578-F582 HydrophobicContact CG-CE2 3.84Å; K578-F582 VanDerWaalsContact O-CD2 3.3Å; K578-F582 WeakPolarHBondContact O-CD2 3.23Å; K578-F582 PolarHBondContact O-N 3.31Å
579	S	91.2	Very high	91	Very high	83 Å²	83	39.1 Å²	39.1	58%	0.58	21%	0.205	S	C	*	.	H	α-helix	trans	-59.5	-44.4	-179.9	46.8	0	0	0	0	112	S577 L581 F582 E583	S577-S579 PolarHBondContact O-N 3.45Å; S577-S579 PolarHBondContact OG-OG 3.42Å; S577-S579 VanDerWaalsContact OG-OG 3.14Å; S579-L581 VanDerWaalsContact C-N 3.35Å; S579-L581 PolarHBondContact O-N 3.46Å; S579-F582 PolarHBondContact O-N 3.32Å; S579-E583 WeakPolarHBondContact O-CB 3.18Å; S579-E583 PolarHBondContact O-N 3.3Å
580	D	92.4	Very high	90.5	Very high	40 Å²	40	43.8 Å²	43.8	21%	0.214	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-39	-178.3	-69.1	-29.1	0	0	0	111.9	K494 L576 S577 K578 S584	K494-D580 HydrophobicContact CB-CB 4.21Å; K494-D580 HydrophobicContact CD-CB 3.6Å; K494-D580 PolarHBondContact NZ-O 3.24Å; L576-D580 HydrophobicContact CD1-CB 4.11Å; S577-D580 PolarHBondContact O-N 2.98Å; S577-D580 VanDerWaalsContact OG-CB 3.24Å; S577-D580 WeakPolarHBondContact OG-CB 3.34Å; S577-D580 PolarHBondContact OG-N 3.11Å; S577-D580 PolarHBondContact OG-OD2 2.9Å; K578-D580 VanDerWaalsContact C-N 3.33Å; K578-D580 PolarHBondContact O-N 2.98Å; D580-S584 PolarHBondContact O-N 2.97Å; D580-S584 PolarHBondContact O-OG 2.86Å; D580-S584 VanDerWaalsContact O-OG 3.04Å
581	L	90.1	Very high	90	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-65.9	-49	175.1	179.4	66.5	0	0	0	111.2	I491 M516 I549 M550 L576 S577 K578 S579 E583 S584 L585	I491-L581 HydrophobicContact CD1-CD1 4.46Å; M516-L581 HydrophobicContact CE-CD1 4.11Å; M516-L581 HydrophobicContact CE-CD2 3.74Å; M516-L581 HydrophobicContact CE-CG 4.43Å; I549-L581 HydrophobicContact CD1-CD2 3.33Å; I549-L581 HydrophobicContact CG1-CD2 4.17Å; M550-L581 HydrophobicContact SD-CD2 4.45Å; L576-L581 HydrophobicContact CD2-CB 3.85Å; L576-L581 HydrophobicContact CD2-CD1 3.71Å; L576-L581 HydrophobicContact CD2-CG 4.28Å; L576-L581 HydrophobicContact CG-CB 4.28Å; S577-L581 PolarHBondContact O-N 3.28Å; K578-L581 PolarHBondContact O-N 3.15Å; S579-L581 VanDerWaalsContact C-N 3.35Å; S579-L581 PolarHBondContact O-N 3.46Å; L581-E583 PolarHBondContact O-N 3.39Å; L581-S584 PolarHBondContact O-N 3.31Å; L581-S584 VanDerWaalsContact O-N 3.17Å; L581-L585 HydrophobicContact CD1-CD1 3.85Å; L581-L585 HydrophobicContact CD1-CD2 4.37Å; L581-L585 HydrophobicContact CD1-CG 3.87Å; L581-L585 HydrophobicContact CD2-CD1 4.11Å; L581-L585 HydrophobicContact CG-CD1 3.7Å; L581-L585 HydrophobicContact CG-CG 4.07Å; L581-L585 WeakPolarHBondContact O-CB 3.42Å; L581-L585 VanDerWaalsContact O-CG 3.3Å; L581-L585 WeakPolarHBondContact O-CG 3.29Å; L581-L585 PolarHBondContact O-N 3.48Å
582	F	88.8	Confident	89.6	Confident	44 Å²	44	45.6 Å²	45.6	19%	0.193	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-42.7	-177.7	-90.6	-91.4	0	0	0	112.1	I549 D551 K578 S579 S584 L585 E586	I549-F582 WeakPolarHBondContact O-CE2 3.22Å; D551-F582 HydrophobicContact CB-CZ 4.42Å; K578-F582 HydrophobicContact CD-CE2 4.42Å; K578-F582 HydrophobicContact CG-CD2 3.76Å; K578-F582 HydrophobicContact CG-CE2 3.84Å; K578-F582 VanDerWaalsContact O-CD2 3.3Å; K578-F582 WeakPolarHBondContact O-CD2 3.23Å; K578-F582 PolarHBondContact O-N 3.31Å; S579-F582 PolarHBondContact O-N 3.32Å; F582-S584 VanDerWaalsContact C-N 3.27Å; F582-S584 PolarHBondContact O-N 3.27Å; F582-L585 PolarHBondContact O-N 3.46Å; F582-L585 VanDerWaalsContact O-N 3.14Å; F582-E586 WeakPolarHBondContact O-CG 3.44Å; F582-E586 PolarHBondContact O-N 3.11Å
583	E	90.7	Very high	89.2	Confident	91 Å²	91	49.7 Å²	49.7	43%	0.425	25%	0.245	S	C	.	.	H	α-helix	trans	-59.3	-39.2	175.1	-170.1	-159.1	149.7	0	0	111.7	K494 S579 L581	K494-E583 IonicContact NZ-OE1 2.68Å; K494-E583 PolarHBondContact NZ-OE1 2.79Å; K494-E583 IonicContact NZ-OE2 2.61Å; K494-E583 PolarHBondContact NZ-OE2 2.9Å; S579-E583 WeakPolarHBondContact O-CB 3.18Å; S579-E583 PolarHBondContact O-N 3.3Å; L581-E583 PolarHBondContact O-N 3.39Å
584	S	89.6	Confident	88.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-71.5	-37.8	175.7	-63.3	0	0	0	0	112	K494 D580 L581 F582 K587 Y588	K494-S584 PolarHBondContact NZ-OG 3.03Å; D580-S584 PolarHBondContact O-N 2.97Å; D580-S584 PolarHBondContact O-OG 2.86Å; D580-S584 VanDerWaalsContact O-OG 3.04Å; L581-S584 PolarHBondContact O-N 3.31Å; L581-S584 VanDerWaalsContact O-N 3.17Å; F582-S584 VanDerWaalsContact C-N 3.27Å; F582-S584 PolarHBondContact O-N 3.27Å; S584-K587 PolarHBondContact O-N 3.42Å; S584-Y588 WeakPolarHBondContact O-CD2 3.48Å
585	L	87.5	Confident	88.1	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-74.9	-24.1	179.7	-70.2	-178.2	0	0	0	113.8	L487 M550 L581 F582 K587 Y588 A591 K592 L595	L487-L585 HydrophobicContact CD1-CD2 4.37Å; L487-L585 HydrophobicContact CD2-CD2 4.08Å; M550-L585 HydrophobicContact SD-CD1 4.5Å; L581-L585 HydrophobicContact CD1-CD1 3.85Å; L581-L585 HydrophobicContact CD1-CD2 4.37Å; L581-L585 HydrophobicContact CD1-CG 3.87Å; L581-L585 HydrophobicContact CD2-CD1 4.11Å; L581-L585 HydrophobicContact CG-CD1 3.7Å; L581-L585 HydrophobicContact CG-CG 4.07Å; L581-L585 WeakPolarHBondContact O-CB 3.42Å; L581-L585 VanDerWaalsContact O-CG 3.3Å; L581-L585 WeakPolarHBondContact O-CG 3.29Å; L581-L585 PolarHBondContact O-N 3.48Å; F582-L585 PolarHBondContact O-N 3.46Å; F582-L585 VanDerWaalsContact O-N 3.14Å; L585-K587 PolarHBondContact O-N 2.98Å; L585-Y588 CarbonylContact O-C 3.44Å; L585-Y588 PolarHBondContact O-N 3.45Å; L585-A591 HydrophobicContact CD2-CB 4.29Å; L585-K592 HydrophobicContact CB-CB 4.09Å; L585-K592 HydrophobicContact CB-CD 4.42Å; L585-K592 HydrophobicContact CB-CG 4.22Å; L585-L595 HydrophobicContact CD1-CD1 3.74Å; L585-L595 HydrophobicContact CD2-CD1 3.49Å; L585-L595 VanDerWaalsContact CD2-CD1 3.49Å; L585-L595 HydrophobicContact CG-CD1 4.24Å
586	E	88.3	Confident	87.7	Confident	140 Å²	140	54.7 Å²	54.7	65%	0.654	27%	0.271	S	S	*	.	H	α-helix	trans	-61.2	-33.8	171.7	-81.1	174.8	-169.2	0	0	112.1	F582	F582-E586 WeakPolarHBondContact O-CG 3.44Å; F582-E586 PolarHBondContact O-N 3.11Å
587	K	88.1	Confident	87.2	Confident	115 Å²	115	58.4 Å²	58.4	50%	0.5	29%	0.288	S	S	.	.	H	α-helix	trans	-76.8	-22.6	176.8	-57.1	178.6	-168.1	174.1	0	113.3	E490 S584 L585	E490-K587 IonicContact OE2-NZ 2.68Å; E490-K587 PolarHBondContact OE2-NZ 3.02Å; S584-K587 PolarHBondContact O-N 3.42Å; L585-K587 PolarHBondContact O-N 2.98Å
588	Y	87.7	Confident	86.6	Confident	67 Å²	67	60.1 Å²	60.1	26%	0.263	29%	0.293	S	S	.	.			trans	-126.7	77.8	-174.3	-65.5	-87.6	0	0	0	110.9	G486 L487 E490 S584 L585 E590 A591 K592	G486-Y588 WeakPolarHBondContact CA-OH 3.38Å; L487-Y588 HydrophobicContact CB-CD1 4.28Å; L487-Y588 HydrophobicContact CB-CD2 3.94Å; L487-Y588 HydrophobicContact CB-CE1 4.46Å; L487-Y588 HydrophobicContact CB-CE2 4.15Å; L487-Y588 HydrophobicContact CB-CG 4.02Å; L487-Y588 HydrophobicContact CD1-CD2 3.81Å; L487-Y588 HydrophobicContact CD1-CE2 4.4Å; L487-Y588 HydrophobicContact CD1-CG 4.34Å; L487-Y588 HydrophobicContact CG-CD2 4.41Å; E490-Y588 HydrophobicContact CG-CE2 4.45Å; S584-Y588 WeakPolarHBondContact O-CD2 3.48Å; L585-Y588 CarbonylContact O-C 3.44Å; L585-Y588 PolarHBondContact O-N 3.45Å; Y588-E590 VanDerWaalsContact C-N 3.34Å; Y588-E590 PolarHBondContact O-N 3.08Å; Y588-A591 PolarHBondContact O-N 3.44Å; Y588-K592 PolarHBondContact O-N 2.8Å; Y588-K592 VanDerWaalsContact O-N 3.07Å
589	P	86.4	Confident	86.1	Confident	86 Å²	86	58.3 Å²	58.3	56%	0.558	29%	0.287	S	S	*	.	H	α-helix	trans	-63.1	-35.4	-173	23.8	-33.9	0	0	0	113.5	A591 K592 R593	P589-A591 PolarHBondContact O-N 3.08Å; P589-K592 WeakPolarHBondContact O-CB 3.25Å; P589-K592 PolarHBondContact O-N 3.45Å; P589-R593 PolarHBondContact O-N 3.36Å
590	E	83.6	Confident	85.7	Confident	122 Å²	122	58 Å²	58	57%	0.57	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-42.2	176.3	-74	-52.8	122.2	0	0	112.3	Y588 K592 R593 L594	Y588-E590 VanDerWaalsContact C-N 3.34Å; Y588-E590 PolarHBondContact O-N 3.08Å; E590-K592 VanDerWaalsContact C-N 3.34Å; E590-R593 PolarHBondContact O-N 3.08Å; E590-R593 IonicContact OE2-CZ 3.18Å; E590-R593 IonicContact OE2-NE 2.74Å; E590-R593 PolarHBondContact OE2-NE 2.92Å; E590-R593 IonicContact OE2-NH2 2.82Å; E590-R593 PolarHBondContact OE2-NH2 2.97Å; E590-L594 PolarHBondContact O-N 2.94Å
591	A	83.9	Confident	85.3	Confident	13 Å²	13	62.6 Å²	62.6	11%	0.107	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-39.4	175.6	0	0	0	0	0	111.1	L487 L585 Y588 P589 R593 L594 L595	L487-A591 HydrophobicContact CD2-CB 3.32Å; L585-A591 HydrophobicContact CD2-CB 4.29Å; Y588-A591 PolarHBondContact O-N 3.44Å; P589-A591 PolarHBondContact O-N 3.08Å; A591-R593 VanDerWaalsContact C-N 3.33Å; A591-R593 PolarHBondContact O-N 3.16Å; A591-L594 PolarHBondContact O-N 2.91Å; A591-L595 WeakPolarHBondContact O-CB 3.36Å; A591-L595 WeakPolarHBondContact O-CG 3.41Å; A591-L595 PolarHBondContact O-N 2.97Å
592	K	85.2	Confident	84.9	Confident	71 Å²	71	64.9 Å²	64.9	31%	0.309	31%	0.305	S	S	.	.	H	α-helix	trans	-58.1	-45.1	173.4	-172	178.5	178.2	176.9	0	111.4	L585 Y588 P589 E590 L595 L596	L585-K592 HydrophobicContact CB-CB 4.09Å; L585-K592 HydrophobicContact CB-CD 4.42Å; L585-K592 HydrophobicContact CB-CG 4.22Å; Y588-K592 PolarHBondContact O-N 2.8Å; Y588-K592 VanDerWaalsContact O-N 3.07Å; P589-K592 WeakPolarHBondContact O-CB 3.25Å; P589-K592 PolarHBondContact O-N 3.45Å; E590-K592 VanDerWaalsContact C-N 3.34Å; K592-L595 PolarHBondContact O-N 3.5Å; K592-L596 HydrophobicContact CG-CD1 4.06Å; K592-L596 WeakPolarHBondContact O-CB 3.45Å; K592-L596 VanDerWaalsContact O-CG 3.26Å; K592-L596 WeakPolarHBondContact O-CG 3.24Å; K592-L596 PolarHBondContact O-N 3.44Å
593	R	83.7	Confident	84.5	Confident	92 Å²	92	62.8 Å²	62.8	35%	0.347	30%	0.295	S	S	.	.	H	α-helix	trans	-61.9	-49.7	176.9	-173.9	-177.6	62.2	75.6	2.1	111.5	P589 E590 A591 L595 L596 E597	P589-R593 PolarHBondContact O-N 3.36Å; E590-R593 PolarHBondContact O-N 3.08Å; E590-R593 IonicContact OE2-CZ 3.18Å; E590-R593 IonicContact OE2-NE 2.74Å; E590-R593 PolarHBondContact OE2-NE 2.92Å; E590-R593 IonicContact OE2-NH2 2.82Å; E590-R593 PolarHBondContact OE2-NH2 2.97Å; A591-R593 VanDerWaalsContact C-N 3.33Å; A591-R593 PolarHBondContact O-N 3.16Å; R593-L595 VanDerWaalsContact C-N 3.33Å; R593-L595 PolarHBondContact O-N 3.15Å; R593-L596 PolarHBondContact O-N 2.83Å; R593-L596 VanDerWaalsContact O-N 3.17Å; R593-E597 WeakPolarHBondContact CG-OE1 3.36Å; R593-E597 IonicContact CZ-OE1 2.78Å; R593-E597 IonicContact NH1-OE1 2.81Å; R593-E597 PolarHBondContact NH1-OE1 3.42Å; R593-E597 IonicContact NH1-OE2 2.75Å; R593-E597 PolarHBondContact NH1-OE2 2.88Å; R593-E597 WeakPolarHBondContact O-CG 3.48Å; R593-E597 PolarHBondContact O-N 3.03Å
594	L	82.9	Confident	84.2	Confident	61 Å²	61	65.6 Å²	65.6	32%	0.319	30%	0.302	S	S	.	.	H	α-helix	trans	-59.1	-43.2	179	-176.7	67.9	0	0	0	112.1	D482 E590 A591 K598	D482-L594 HydrophobicContact CB-CD2 4.24Å; E590-L594 PolarHBondContact O-N 2.94Å; A591-L594 PolarHBondContact O-N 2.91Å; L594-K598 VanDerWaalsContact O-CB 3.32Å; L594-K598 WeakPolarHBondContact O-CB 3.42Å; L594-K598 PolarHBondContact O-N 2.95Å
595	L	81	Confident	83.9	Confident	6 Å²	6	74.1 Å²	74.1	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-66.3	-40.2	177.1	-68.5	173.6	0	0	0	112	L479 M550 L585 A591 K592 R593 G599	L479-L595 HydrophobicContact CD1-CD2 3.25Å; L479-L595 HydrophobicContact CD2-CD2 3.99Å; L479-L595 HydrophobicContact CG-CD2 3.32Å; M550-L595 VanDerWaalsContact CE-C 3.4Å; M550-L595 HydrophobicContact CE-CB 3.55Å; M550-L595 HydrophobicContact SD-CB 4.48Å; L585-L595 HydrophobicContact CD1-CD1 3.74Å; L585-L595 HydrophobicContact CD2-CD1 3.49Å; L585-L595 VanDerWaalsContact CD2-CD1 3.49Å; L585-L595 HydrophobicContact CG-CD1 4.24Å; A591-L595 WeakPolarHBondContact O-CB 3.36Å; A591-L595 WeakPolarHBondContact O-CG 3.41Å; A591-L595 PolarHBondContact O-N 2.97Å; K592-L595 PolarHBondContact O-N 3.5Å; R593-L595 VanDerWaalsContact C-N 3.33Å; R593-L595 PolarHBondContact O-N 3.15Å; L595-G599 PolarHBondContact O-N 3.24Å
596	L	83.5	Confident	83.5	Confident	47 Å²	47	78 Å²	78	25%	0.246	36%	0.36	C	S	.	.	H	α-helix	trans	-66.2	-42.9	176.7	-77.3	167.6	0	0	0	111.8	M550 I552 K592 R593 G599 R600	M550-L596 HydrophobicContact CE-CB 4.24Å; M550-L596 HydrophobicContact CE-CD2 3.64Å; M550-L596 HydrophobicContact CE-CG 3.67Å; I552-L596 HydrophobicContact CG1-CD2 3.87Å; K592-L596 HydrophobicContact CG-CD1 4.06Å; K592-L596 WeakPolarHBondContact O-CB 3.45Å; K592-L596 VanDerWaalsContact O-CG 3.26Å; K592-L596 WeakPolarHBondContact O-CG 3.24Å; K592-L596 PolarHBondContact O-N 3.44Å; R593-L596 PolarHBondContact O-N 2.83Å; R593-L596 VanDerWaalsContact O-N 3.17Å; L596-G599 PolarHBondContact O-N 3.48Å; L596-R600 WeakPolarHBondContact O-CB 3.31Å; L596-R600 WeakPolarHBondContact O-CG 3.33Å; L596-R600 PolarHBondContact O-N 3.06Å
597	E	83.2	Confident	83.1	Confident	78 Å²	78	79.4 Å²	79.4	36%	0.364	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-50.1	175.2	-77.9	171.9	-170.9	0	0	110.8	R593 G599 R600 E601	R593-E597 WeakPolarHBondContact CG-OE1 3.36Å; R593-E597 IonicContact CZ-OE1 2.78Å; R593-E597 IonicContact NH1-OE1 2.81Å; R593-E597 PolarHBondContact NH1-OE1 3.42Å; R593-E597 IonicContact NH1-OE2 2.75Å; R593-E597 PolarHBondContact NH1-OE2 2.88Å; R593-E597 WeakPolarHBondContact O-CG 3.48Å; R593-E597 PolarHBondContact O-N 3.03Å; E597-G599 VanDerWaalsContact C-N 3.31Å; E597-G599 PolarHBondContact O-N 3.25Å; E597-R600 WeakPolarHBondContact O-CB 3.39Å; E597-R600 PolarHBondContact O-N 3.36Å; E597-R600 VanDerWaalsContact O-N 3.1Å; E597-E601 WeakPolarHBondContact O-CG 3.21Å; E597-E601 PolarHBondContact O-N 3.45Å
598	K	80.2	Confident	82.5	Confident	58 Å²	58	75.7 Å²	75.7	25%	0.252	35%	0.349	S	S	.	.	H	α-helix	trans	-61.1	-39.9	177.3	-157.2	174.8	-163.5	156.4	0	112.2	S478 L479 L594 E601 I602	S478-K598 PolarHBondContact O-NZ 2.83Å; L479-K598 HydrophobicContact CD1-CD 3.96Å; L594-K598 VanDerWaalsContact O-CB 3.32Å; L594-K598 WeakPolarHBondContact O-CB 3.42Å; L594-K598 PolarHBondContact O-N 2.95Å; K598-E601 PolarHBondContact O-N 2.83Å; K598-I602 WeakPolarHBondContact O-CD1 3.01Å; K598-I602 VanDerWaalsContact O-CG1 3.26Å; K598-I602 WeakPolarHBondContact O-CG1 3.31Å; K598-I602 PolarHBondContact O-N 3.07Å; K598-I602 VanDerWaalsContact O-N 3.11Å
599	G	80.9	Confident	82.1	Confident	6 Å²	6	74 Å²	74	6%	0.062	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-40.3	174	0	0	0	0	0	112.8	L595 L596 E597 I602 L603	L595-G599 PolarHBondContact O-N 3.24Å; L596-G599 PolarHBondContact O-N 3.48Å; E597-G599 VanDerWaalsContact C-N 3.31Å; E597-G599 PolarHBondContact O-N 3.25Å; G599-I602 PolarHBondContact O-N 3.41Å; G599-L603 WeakPolarHBondContact O-CG 3.42Å; G599-L603 PolarHBondContact O-N 3.16Å
600	R	83	Confident	81.5	Confident	77 Å²	77	73.1 Å²	73.1	29%	0.291	34%	0.335	S	S	.	.	H	α-helix	trans	-65.9	-41.6	174.8	-76.4	177.2	171.4	173.6	0.1	112.3	I552 L596 E597 I602 L603 R604 L609	I552-R600 HydrophobicContact CG2-CG 3.73Å; L596-R600 WeakPolarHBondContact O-CB 3.31Å; L596-R600 WeakPolarHBondContact O-CG 3.33Å; L596-R600 PolarHBondContact O-N 3.06Å; E597-R600 WeakPolarHBondContact O-CB 3.39Å; E597-R600 PolarHBondContact O-N 3.36Å; E597-R600 VanDerWaalsContact O-N 3.1Å; R600-I602 VanDerWaalsContact C-N 3.33Å; R600-I602 PolarHBondContact O-N 3.26Å; R600-L603 PolarHBondContact O-N 3.48Å; R600-R604 WeakPolarHBondContact O-CB 3.42Å; R600-R604 PolarHBondContact O-N 2.97Å; R600-L609 HydrophobicContact CB-CD1 4.04Å; R600-L609 HydrophobicContact CG-CD1 3.95Å
601	E	82.9	Confident	80.7	Confident	136 Å²	136	72.9 Å²	72.9	64%	0.636	33%	0.334	S	S	*	.	H	α-helix	trans	-59	-44.7	175.5	-73	175.9	177	0	0	111.6	E597 K598 R604 K605	E597-E601 WeakPolarHBondContact O-CG 3.21Å; E597-E601 PolarHBondContact O-N 3.45Å; K598-E601 PolarHBondContact O-N 2.83Å; E601-R604 PolarHBondContact O-N 2.95Å; E601-K605 PolarHBondContact O-N 2.83Å
602	I	81.1	Confident	79.5	Confident	50 Å²	50	79.5 Å²	79.5	26%	0.256	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-46.6	177	-63.5	164.3	0	0	0	110.5	L547 K598 G599 R600 R604 K605 D606	L547-I602 HydrophobicContact CD1-CG2 3.8Å; L547-I602 HydrophobicContact CD2-CB 4.17Å; L547-I602 HydrophobicContact CD2-CG2 4.09Å; L547-I602 HydrophobicContact CG-CG2 4.4Å; K598-I602 WeakPolarHBondContact O-CD1 3.01Å; K598-I602 VanDerWaalsContact O-CG1 3.26Å; K598-I602 WeakPolarHBondContact O-CG1 3.31Å; K598-I602 PolarHBondContact O-N 3.07Å; K598-I602 VanDerWaalsContact O-N 3.11Å; G599-I602 PolarHBondContact O-N 3.41Å; R600-I602 VanDerWaalsContact C-N 3.33Å; R600-I602 PolarHBondContact O-N 3.26Å; I602-R604 VanDerWaalsContact C-N 3.28Å; I602-R604 PolarHBondContact O-N 2.61Å; I602-K605 WeakPolarHBondContact O-CB 3.48Å; I602-K605 PolarHBondContact O-N 3.13Å; I602-D606 PolarHBondContact O-N 3.28Å
603	L	82.1	Confident	78.1	Confident	0 Å²	0	81 Å²	81	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-62.5	-33.7	177.2	-73.3	172.4	0	0	0	113	L547 I552 N555 G599 R600 K607 L608 L609	L547-L603 HydrophobicContact CD1-CD2 4.29Å; L547-L603 HydrophobicContact CD2-CD2 4.5Å; L547-L603 HydrophobicContact CD2-CG 4.2Å; I552-L603 HydrophobicContact CB-CD1 4.11Å; I552-L603 HydrophobicContact CD1-CD1 3.7Å; I552-L603 HydrophobicContact CG2-CD1 3.96Å; N555-L603 HydrophobicContact CB-CD1 4.02Å; G599-L603 WeakPolarHBondContact O-CG 3.42Å; G599-L603 PolarHBondContact O-N 3.16Å; R600-L603 PolarHBondContact O-N 3.48Å; L603-K607 PolarHBondContact O-N 2.7Å; L603-L608 HydrophobicContact CD2-CB 3.89Å; L603-L608 HydrophobicContact CD2-CD1 4.41Å; L603-L608 PolarHBondContact O-N 3.27Å; L603-L609 HydrophobicContact CB-CB 4.03Å; L603-L609 HydrophobicContact CB-CD1 4Å; L603-L609 HydrophobicContact CD1-CD1 4.42Å; L603-L609 PolarHBondContact O-N 3.41Å
604	R	84.1	Confident	76.5	Confident	150 Å²	150	81.6 Å²	81.6	57%	0.566	39%	0.391	S	S	*	.	H	α-helix	trans	-67.5	-43.6	175	-169.6	177.7	-132	140.7	0.9	111.2	R600 E601 I602 D606 K607 E611	R600-R604 WeakPolarHBondContact O-CB 3.42Å; R600-R604 PolarHBondContact O-N 2.97Å; E601-R604 PolarHBondContact O-N 2.95Å; I602-R604 VanDerWaalsContact C-N 3.28Å; I602-R604 PolarHBondContact O-N 2.61Å; R604-D606 VanDerWaalsContact C-N 3.27Å; R604-D606 PolarHBondContact O-N 3.23Å; R604-K607 PolarHBondContact O-N 3.1Å; R604-K607 VanDerWaalsContact O-N 3.1Å; R604-E611 IonicContact CZ-OE1 3Å; R604-E611 IonicContact NE-OE1 3.87Å; R604-E611 PolarHBondContact NE-OE1 3.42Å; R604-E611 IonicContact NH2-OE1 2.71Å; R604-E611 PolarHBondContact NH2-OE1 3.24Å; R604-E611 IonicContact NH2-OE2 3.46Å; R604-E611 PolarHBondContact NH2-OE2 3.42Å
605	K	83.3	Confident	75	Confident	179 Å²	179	83.2 Å²	83.2	78%	0.778	40%	0.399	S	S	*	.	H	α-helix	trans	-60	-39.2	176	-171.5	179.3	179.2	-178.2	0	111.9	E601 I602 K607	E601-K605 PolarHBondContact O-N 2.83Å; I602-K605 WeakPolarHBondContact O-CB 3.48Å; I602-K605 PolarHBondContact O-N 3.13Å; K605-K607 VanDerWaalsContact C-N 3.27Å; K605-K607 PolarHBondContact O-N 3.49Å
606	D	79.7	Confident	73.2	Confident	84 Å²	84	86.1 Å²	86.1	45%	0.449	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.3	179.1	-66.9	-9.8	0	0	0	113.4	I602 R604 L608	I602-D606 PolarHBondContact O-N 3.28Å; R604-D606 VanDerWaalsContact C-N 3.27Å; R604-D606 PolarHBondContact O-N 3.23Å; D606-L608 HydrophobicContact CB-CD1 3.94Å; D606-L608 HydrophobicContact CB-CG 4.02Å; D606-L608 PolarHBondContact O-N 2.99Å
607	K	77.8	Confident	71.5	Confident	170 Å²	170	92.1 Å²	92.1	74%	0.739	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	28.5	-175.6	-56.2	-179.8	180	179	0	113.8	R556 L603 R604 K605	R556-K607 PolarHBondContact NH1-O 3.38Å; L603-K607 PolarHBondContact O-N 2.7Å; R604-K607 PolarHBondContact O-N 3.1Å; R604-K607 VanDerWaalsContact O-N 3.1Å; K605-K607 VanDerWaalsContact C-N 3.27Å; K605-K607 PolarHBondContact O-N 3.49Å
608	L	77.3	Confident	69.5	Low	36 Å²	36	93.7 Å²	93.7	19%	0.188	45%	0.454	C	S	.	.			trans	-97.8	-1.9	-179.3	-67.4	176.6	0	0	0	113.4	R556 T562 L603 D606	R556-L608 WeakPolarHBondContact CB-O 3.44Å; R556-L608 VanDerWaalsContact CG-O 3.31Å; R556-L608 WeakPolarHBondContact CG-O 3.18Å; R556-L608 PolarHBondContact N-O 3.13Å; T562-L608 HydrophobicContact CG2-CD1 4.05Å; L603-L608 HydrophobicContact CD2-CB 3.89Å; L603-L608 HydrophobicContact CD2-CD1 4.41Å; L603-L608 PolarHBondContact O-N 3.27Å; D606-L608 HydrophobicContact CB-CD1 3.94Å; D606-L608 HydrophobicContact CB-CG 4.02Å; D606-L608 PolarHBondContact O-N 2.99Å
609	L	77.5	Confident	68	Low	31 Å²	31	95.4 Å²	95.4	16%	0.162	47%	0.469	C	S	.	.	B	Isolated β-bridge	trans	-95.4	128.3	178.5	-162.1	135.4	0	0	0	110.9	R600 L603 E611	R600-L609 HydrophobicContact CB-CD1 4.04Å; R600-L609 HydrophobicContact CG-CD1 3.95Å; L603-L609 HydrophobicContact CB-CB 4.03Å; L603-L609 HydrophobicContact CB-CD1 4Å; L603-L609 HydrophobicContact CD1-CD1 4.42Å; L603-L609 PolarHBondContact O-N 3.41Å; L609-E611 HydrophobicContact CD2-CB 4.47Å; L609-E611 HydrophobicContact CD2-CG 3.9Å; L609-E611 PolarHBondContact O-N 3.44Å
610	I	74	Confident	66.4	Low	69 Å²	69	102.4 Å²	102.4	35%	0.354	50%	0.498	S	S	.	.			trans	-83.7	100.4	169.5	-57.2	169.4	0	0	0	107	G554 R556 N612 E613	G554-I610 PolarHBondContact O-N 2.98Å; R556-I610 HydrophobicContact CG-CD1 3.9Å; R556-I610 HydrophobicContact CG-CG1 3.62Å; I610-N612 PolarHBondContact O-N 3.07Å; I610-N612 VanDerWaalsContact O-N 3.14Å; I610-E613 PolarHBondContact O-N 3.13Å
611	E	68	Low	64.6	Low	117 Å²	117	104.8 Å²	104.8	55%	0.547	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.1	-176.3	-61	-167.3	165.9	0	0	113.5	R604 L609	R604-E611 IonicContact CZ-OE1 3Å; R604-E611 IonicContact NE-OE1 3.87Å; R604-E611 PolarHBondContact NE-OE1 3.42Å; R604-E611 IonicContact NH2-OE1 2.71Å; R604-E611 PolarHBondContact NH2-OE1 3.24Å; R604-E611 IonicContact NH2-OE2 3.46Å; R604-E611 PolarHBondContact NH2-OE2 3.42Å; L609-E611 HydrophobicContact CD2-CB 4.47Å; L609-E611 HydrophobicContact CD2-CG 3.9Å; L609-E611 PolarHBondContact O-N 3.44Å
612	N	58.2	Low	62.7	Low	152 Å²	152	103.8 Å²	103.8	81%	0.813	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	6.1	-175.4	-64.6	-19	0	0	0	114.2	I610 P614	I610-N612 PolarHBondContact O-N 3.07Å; I610-N612 VanDerWaalsContact O-N 3.14Å; N612-P614 WeakPolarHBondContact O-CD 3.44Å
613	E	56.5	Low	61.1	Low	102 Å²	102	110.3 Å²	110.3	48%	0.477	54%	0.541	S	S	.	.	S	Bend	trans	-81.2	117.5	171.1	-148.4	173.4	-137.3	0	0	107.8	G554 I610 L615	G554-E613 WeakPolarHBondContact CA-OE2 3.33Å; G554-E613 PolarHBondContact N-OE2 2.73Å; I610-E613 PolarHBondContact O-N 3.13Å; E613-L615 PolarHBondContact O-N 3.09Å; E613-L615 VanDerWaalsContact O-N 3.12Å
614	P	49.5	Very low	59.3	Low	105 Å²	105	119.2 Å²	119.2	68%	0.682	58%	0.583	S	S	*	*			trans	-57.5	125.9	177.6	22.7	-29.9	0	0	0	107.2	N612 P616	N612-P614 WeakPolarHBondContact O-CD 3.44Å; P614-P616 VanDerWaalsContact O-N 3.15Å
615	L	50.5	Low	57.3	Low	94 Å²	94	119.5 Å²	119.5	49%	0.492	59%	0.591	S	S	.	*			trans	-45.5	131.7	155.9	-91.6	93.5	0	0	0	104.8	E613 K617	E613-L615 PolarHBondContact O-N 3.09Å; E613-L615 VanDerWaalsContact O-N 3.12Å; L615-K617 VanDerWaalsContact C-N 3.32Å; L615-K617 PolarHBondContact O-N 3.17Å
616	P	45.1	Very low	55.5	Low	67 Å²	67	120.1 Å²	120.1	44%	0.435	60%	0.597	S	S	.	*			trans	-56.9	113	171.1	-5	16.3	0	0	0	104.2	P614 N618 V619	P614-P616 VanDerWaalsContact O-N 3.15Å; P616-N618 PolarHBondContact O-N 3.34Å; P616-V619 HydrophobicContact CB-CG2 3.86Å; P616-V619 HydrophobicContact CG-CG2 3.67Å; P616-V619 PolarHBondContact O-N 3.42Å
617	K	47.8	Very low	54.1	Low	173 Å²	173	124.7 Å²	124.7	75%	0.752	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.7	-15.1	174.7	-75.8	-176.2	172.4	-177.7	0	110.3	L615	L615-K617 VanDerWaalsContact C-N 3.32Å; L615-K617 PolarHBondContact O-N 3.17Å
618	N	41	Very low	53	Low	112 Å²	112	121.1 Å²	121.1	60%	0.599	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	5.7	179.5	-56.6	-5.1	0	0	0	115.7	P616 L622	P616-N618 PolarHBondContact O-N 3.34Å; N618-L622 HydrophobicContact CB-CD1 4.48Å; N618-L622 HydrophobicContact CB-CG 4.47Å; N618-L622 WeakPolarHBondContact O-CD1 3.49Å; N618-L622 WeakPolarHBondContact O-CG 3.37Å
619	V	47.1	Very low	52.3	Low	94 Å²	94	128 Å²	128	57%	0.57	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-25.4	175.1	178.4	0	0	0	0	112.7	P616	P616-V619 HydrophobicContact CB-CG2 3.86Å; P616-V619 HydrophobicContact CG-CG2 3.67Å; P616-V619 PolarHBondContact O-N 3.42Å
620	F	47.4	Very low	52.1	Low	153 Å²	153	133.2 Å²	133.2	67%	0.671	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-25	176.9	-100.9	-91.1	0	0	0	113.6
621	D	44.9	Very low	52.1	Low	127 Å²	127	133.1 Å²	133.1	68%	0.679	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-94.6	4.2	-177	-65.2	-17.4	0	0	0	114.7	F623	D621-F623 PolarHBondContact O-N 3.34Å
622	L	44.9	Very low	52.4	Low	114 Å²	114	131.3 Å²	131.3	60%	0.597	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-77.9	3.4	176.8	-88	174.6	0	0	0	114.4	N618	N618-L622 HydrophobicContact CB-CD1 4.48Å; N618-L622 HydrophobicContact CB-CG 4.47Å; N618-L622 WeakPolarHBondContact O-CD1 3.49Å; N618-L622 WeakPolarHBondContact O-CG 3.37Å
623	F	46	Very low	53.4	Low	187 Å²	187	127.9 Å²	127.9	82%	0.82	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-93.9	-1.1	-177.1	-74.4	-75.6	0	0	0	115	D621	D621-F623 PolarHBondContact O-N 3.34Å
624	E	45.5	Very low	54.7	Low	188 Å²	188	128.5 Å²	128.5	88%	0.879	63%	0.63	S	S	*	*			trans	-127.9	11.7	-174.9	-97.9	-177.5	170.8	0	0	116.7	E626	E624-E626 PolarHBondContact O-N 2.85Å; E624-E626 VanDerWaalsContact O-N 3.13Å
625	Q	42.4	Very low	56.4	Low	156 Å²	156	128.1 Å²	128.1	73%	0.729	62%	0.622	S	S	*	*			trans	-75.8	108.4	172.7	-107.9	-178.9	-17.7	0	0	111.9	Y627	Q625-Y627 PolarHBondContact O-N 3.24Å
626	E	44.6	Very low	58.1	Low	192 Å²	192	126.8 Å²	126.8	90%	0.897	62%	0.62	S	S	*	*			trans	-39.1	101.5	167.1	-158.2	165.3	-157.9	0	0	111	E624 D628	E624-E626 PolarHBondContact O-N 2.85Å; E624-E626 VanDerWaalsContact O-N 3.13Å; E626-D628 PolarHBondContact O-N 2.96Å
627	Y	50.9	Low	60.1	Low	179 Å²	179	131.2 Å²	131.2	70%	0.702	63%	0.628	S	S	*	*			trans	-63.7	132.9	178.7	-82.9	-98.5	0	0	0	109.8	Q625 Y629 L632	Q625-Y627 PolarHBondContact O-N 3.24Å; Y627-Y629 PolarHBondContact O-N 3.05Å; Y627-L632 HydrophobicContact CD1-CD1 3.91Å; Y627-L632 HydrophobicContact CD1-CG 4.29Å; Y627-L632 HydrophobicContact CG-CD1 3.72Å
628	D	54.6	Low	62.2	Low	96 Å²	96	127 Å²	127	51%	0.513	61%	0.614	S	S	.	*			trans	-51.1	100.1	166.3	175.7	29.2	0	0	0	109.6	E626 E630 S631 L632	E626-D628 PolarHBondContact O-N 2.96Å; D628-E630 PolarHBondContact O-N 3.48Å; D628-S631 PolarHBondContact O-N 2.87Å; D628-S631 VanDerWaalsContact O-N 3.16Å; D628-S631 WeakPolarHBondContact OD2-CB 3.47Å; D628-S631 PolarHBondContact OD2-N 3.15Å; D628-S631 PolarHBondContact OD2-OG 3.46Å; D628-L632 PolarHBondContact O-N 3.41Å
629	Y	61.9	Low	64.5	Low	179 Å²	179	125.5 Å²	125.5	70%	0.702	61%	0.605	S	S	*	*	H	α-helix	trans	-58.1	-24.3	-172.9	-122.4	-90.3	0	0	0	111.3	Y627 N633	Y627-Y629 PolarHBondContact O-N 3.05Å; Y629-N633 VanDerWaalsContact O-CB 3.25Å; Y629-N633 WeakPolarHBondContact O-CB 3.49Å; Y629-N633 PolarHBondContact O-N 2.72Å; Y629-N633 PolarHBondContact O-ND2 2.87Å; Y629-N633 VanDerWaalsContact O-ND2 3.11Å
630	E	73.6	Confident	66.5	Low	141 Å²	141	125.5 Å²	125.5	66%	0.659	61%	0.605	S	S	*	*	H	α-helix	trans	-75.6	-44.8	-179	-158.4	146.5	-149.9	0	0	111.8	D628 N633 Q634	D628-E630 PolarHBondContact O-N 3.48Å; E630-N633 PolarHBondContact O-N 3.43Å; E630-Q634 WeakPolarHBondContact O-CB 3.35Å; E630-Q634 PolarHBondContact O-N 2.98Å
631	S	74.8	Confident	68.6	Low	67 Å²	67	122.9 Å²	122.9	47%	0.469	60%	0.598	S	S	.	*	H	α-helix	trans	-63.3	-41.8	173.5	-68	0	0	0	0	112.5	D628 Q634 L635	D628-S631 PolarHBondContact O-N 2.87Å; D628-S631 VanDerWaalsContact O-N 3.16Å; D628-S631 WeakPolarHBondContact OD2-CB 3.47Å; D628-S631 PolarHBondContact OD2-N 3.15Å; D628-S631 PolarHBondContact OD2-OG 3.46Å; S631-Q634 PolarHBondContact O-N 3.33Å; S631-L635 WeakPolarHBondContact O-CB 3.45Å; S631-L635 PolarHBondContact O-N 2.86Å
632	L	73.8	Confident	70.8	Confident	80 Å²	80	122 Å²	122	42%	0.419	59%	0.593	S	S	.	*	H	α-helix	trans	-64.5	-41	175.1	-101.7	170.3	0	0	0	112	Y627 D628 Q634 L635 S636	Y627-L632 HydrophobicContact CD1-CD1 3.91Å; Y627-L632 HydrophobicContact CD1-CG 4.29Å; Y627-L632 HydrophobicContact CG-CD1 3.72Å; D628-L632 PolarHBondContact O-N 3.41Å; L632-Q634 VanDerWaalsContact C-N 3.31Å; L632-Q634 PolarHBondContact O-N 3.46Å; L632-L635 PolarHBondContact O-N 2.9Å; L632-S636 VanDerWaalsContact O-CB 3.25Å; L632-S636 WeakPolarHBondContact O-CB 3.39Å; L632-S636 PolarHBondContact O-N 2.98Å
633	N	78.6	Confident	73	Confident	80 Å²	80	123.7 Å²	123.7	43%	0.428	60%	0.595	S	S	.	*	H	α-helix	trans	-67.2	-32.2	175.5	-82.5	-29.9	0	0	0	112.4	Y629 E630 R637	Y629-N633 VanDerWaalsContact O-CB 3.25Å; Y629-N633 WeakPolarHBondContact O-CB 3.49Å; Y629-N633 PolarHBondContact O-N 2.72Å; Y629-N633 PolarHBondContact O-ND2 2.87Å; Y629-N633 VanDerWaalsContact O-ND2 3.11Å; E630-N633 PolarHBondContact O-N 3.43Å; N633-R637 WeakPolarHBondContact O-CB 3.35Å; N633-R637 VanDerWaalsContact O-CG 3.31Å; N633-R637 WeakPolarHBondContact O-CG 3.45Å; N633-R637 PolarHBondContact O-N 3.24Å; N633-R637 VanDerWaalsContact O-N 3.1Å; N633-R637 PolarHBondContact O-NE 3.38Å
634	Q	84.7	Confident	75.1	Confident	114 Å²	114	122.9 Å²	122.9	53%	0.533	59%	0.587	S	S	.	*	H	α-helix	trans	-72.5	-42	174.8	-161.1	162.1	2.2	0	0	111.7	E630 S631 L632 R637 N638	E630-Q634 WeakPolarHBondContact O-CB 3.35Å; E630-Q634 PolarHBondContact O-N 2.98Å; S631-Q634 PolarHBondContact O-N 3.33Å; L632-Q634 VanDerWaalsContact C-N 3.31Å; L632-Q634 PolarHBondContact O-N 3.46Å; Q634-R637 PolarHBondContact O-N 3.38Å; Q634-N638 VanDerWaalsContact O-CG 3.29Å; Q634-N638 PolarHBondContact O-N 3.3Å; Q634-N638 PolarHBondContact O-ND2 2.86Å
635	L	84.5	Confident	77.3	Confident	98 Å²	98	119.2 Å²	119.2	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-65	-42.1	174.3	-174.6	64	0	0	0	111.9	S631 L632 R637 N638 I639	S631-L635 WeakPolarHBondContact O-CB 3.45Å; S631-L635 PolarHBondContact O-N 2.86Å; L632-L635 PolarHBondContact O-N 2.9Å; L635-R637 PolarHBondContact O-N 2.84Å; L635-N638 PolarHBondContact O-N 2.93Å; L635-I639 HydrophobicContact CD1-CD1 4.45Å; L635-I639 HydrophobicContact CG-CD1 4Å; L635-I639 WeakPolarHBondContact O-CG1 3.2Å; L635-I639 PolarHBondContact O-N 2.67Å
636	S	86.3	Confident	79.6	Confident	65 Å²	65	117 Å²	117	46%	0.455	56%	0.562	S	S	.	*	H	α-helix	trans	-59.3	-45	175.4	-175.8	0	0	0	0	111.3	L632 N638 I639 V640	L632-S636 VanDerWaalsContact O-CB 3.25Å; L632-S636 WeakPolarHBondContact O-CB 3.39Å; L632-S636 PolarHBondContact O-N 2.98Å; S636-N638 VanDerWaalsContact C-N 3.35Å; S636-N638 PolarHBondContact O-N 3.48Å; S636-I639 PolarHBondContact O-N 3.4Å; S636-V640 WeakPolarHBondContact O-CG2 3.46Å; S636-V640 PolarHBondContact O-N 3.22Å
637	R	87.5	Confident	81.7	Confident	160 Å²	160	110.4 Å²	110.4	60%	0.604	54%	0.54	S	S	*	.	H	α-helix	trans	-59.9	-42.4	173.7	-78.4	-175.7	-80.1	-170.2	-1.6	112.3	N633 Q634 L635 V640 N641	N633-R637 WeakPolarHBondContact O-CB 3.35Å; N633-R637 VanDerWaalsContact O-CG 3.31Å; N633-R637 WeakPolarHBondContact O-CG 3.45Å; N633-R637 PolarHBondContact O-N 3.24Å; N633-R637 VanDerWaalsContact O-N 3.1Å; N633-R637 PolarHBondContact O-NE 3.38Å; Q634-R637 PolarHBondContact O-N 3.38Å; L635-R637 PolarHBondContact O-N 2.84Å; R637-V640 PolarHBondContact O-N 3.03Å; R637-N641 PolarHBondContact O-N 2.93Å
638	N	91.2	Very high	83.7	Confident	86 Å²	86	107 Å²	107	46%	0.46	53%	0.531	S	S	.	.	H	α-helix	trans	-65.5	-41.4	177	-70.2	-17.2	0	0	0	112.4	Q634 L635 S636 N641 L642	Q634-N638 VanDerWaalsContact O-CG 3.29Å; Q634-N638 PolarHBondContact O-N 3.3Å; Q634-N638 PolarHBondContact O-ND2 2.86Å; L635-N638 PolarHBondContact O-N 2.93Å; S636-N638 VanDerWaalsContact C-N 3.35Å; S636-N638 PolarHBondContact O-N 3.48Å; N638-N641 PolarHBondContact O-N 3.47Å; N638-L642 WeakPolarHBondContact O-CB 3.22Å; N638-L642 WeakPolarHBondContact O-CG 3.36Å; N638-L642 PolarHBondContact O-N 3.44Å
639	I	88.6	Confident	85.4	Confident	80 Å²	80	108.5 Å²	108.5	41%	0.41	53%	0.533	S	S	.	.	H	α-helix	trans	-64.2	-41.7	176.8	-70.9	169.8	0	0	0	110.9	L635 S636 N641 L642 K643	L635-I639 HydrophobicContact CD1-CD1 4.45Å; L635-I639 HydrophobicContact CG-CD1 4Å; L635-I639 WeakPolarHBondContact O-CG1 3.2Å; L635-I639 PolarHBondContact O-N 2.67Å; S636-I639 PolarHBondContact O-N 3.4Å; I639-N641 VanDerWaalsContact C-N 3.35Å; I639-L642 PolarHBondContact O-N 3.11Å; I639-K643 HydrophobicContact CG2-CD 4.5Å; I639-K643 WeakPolarHBondContact O-CB 3.43Å; I639-K643 WeakPolarHBondContact O-CG 3.43Å; I639-K643 PolarHBondContact O-N 3.07Å
640	V	90	Very high	86.7	Confident	94 Å²	94	105 Å²	105	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-62.9	-43	176.2	172	0	0	0	0	110.7	S636 R637 K643 R644	S636-V640 WeakPolarHBondContact O-CG2 3.46Å; S636-V640 PolarHBondContact O-N 3.22Å; R637-V640 PolarHBondContact O-N 3.03Å; V640-K643 PolarHBondContact O-N 3.43Å; V640-R644 PolarHBondContact O-N 3.46Å; V640-R644 VanDerWaalsContact O-N 3.08Å
641	N	91.1	Very high	87.5	Confident	97 Å²	97	102.6 Å²	102.6	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-42.5	176.1	-117.8	-4.2	0	0	0	112.4	R637 N638 I639 R644 Q645	R637-N641 PolarHBondContact O-N 2.93Å; N638-N641 PolarHBondContact O-N 3.47Å; I639-N641 VanDerWaalsContact C-N 3.35Å; N641-R644 PolarHBondContact O-N 3.42Å; N641-Q645 WeakPolarHBondContact O-CG 3.39Å; N641-Q645 PolarHBondContact O-N 3.42Å
642	L	91.1	Very high	88.3	Confident	110 Å²	110	104.5 Å²	104.5	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-64.9	-41	176.6	-77.9	166.7	0	0	0	112.3	N638 I639 R644 Q645 L646	N638-L642 WeakPolarHBondContact O-CB 3.22Å; N638-L642 WeakPolarHBondContact O-CG 3.36Å; N638-L642 PolarHBondContact O-N 3.44Å; I639-L642 PolarHBondContact O-N 3.11Å; L642-R644 VanDerWaalsContact C-N 3.3Å; L642-R644 PolarHBondContact O-N 3.43Å; L642-Q645 PolarHBondContact O-N 3.19Å; L642-L646 WeakPolarHBondContact O-CB 3.5Å; L642-L646 PolarHBondContact O-N 3.37Å
643	K	91.3	Very high	89	Confident	149 Å²	149	105.1 Å²	105.1	65%	0.648	53%	0.525	S	S	*	.	H	α-helix	trans	-60.8	-40	174	-81.9	-173.4	175.7	-178.1	0	111.7	I639 V640 L646 A647	I639-K643 HydrophobicContact CG2-CD 4.5Å; I639-K643 WeakPolarHBondContact O-CB 3.43Å; I639-K643 WeakPolarHBondContact O-CG 3.43Å; I639-K643 PolarHBondContact O-N 3.07Å; V640-K643 PolarHBondContact O-N 3.43Å; K643-L646 PolarHBondContact O-N 3Å; K643-A647 WeakPolarHBondContact O-CB 3.36Å; K643-A647 PolarHBondContact O-N 3.15Å
644	R	90.7	Very high	89.6	Confident	170 Å²	170	108 Å²	108	64%	0.642	53%	0.534	S	S	*	.	H	α-helix	trans	-64.4	-46.7	176.3	-172.1	176.4	177.7	149.3	0.9	111.6	V640 N641 L642 L646 A647 E648	V640-R644 PolarHBondContact O-N 3.46Å; V640-R644 VanDerWaalsContact O-N 3.08Å; N641-R644 PolarHBondContact O-N 3.42Å; L642-R644 VanDerWaalsContact C-N 3.3Å; L642-R644 PolarHBondContact O-N 3.43Å; R644-L646 VanDerWaalsContact C-N 3.33Å; R644-L646 PolarHBondContact O-N 2.83Å; R644-A647 PolarHBondContact O-N 3.11Å; R644-E648 IonicContact NE-OE1 3.33Å; R644-E648 WeakPolarHBondContact O-CG 3.47Å; R644-E648 PolarHBondContact O-N 2.93Å
645	Q	91.4	Very high	89.9	Confident	111 Å²	111	111 Å²	111	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-62.1	-39.5	175.8	-70.6	-178.9	10.1	0	0	112.4	N641 L642 E648 K649	N641-Q645 WeakPolarHBondContact O-CG 3.39Å; N641-Q645 PolarHBondContact O-N 3.42Å; L642-Q645 PolarHBondContact O-N 3.19Å; Q645-E648 PolarHBondContact O-N 2.97Å; Q645-K649 WeakPolarHBondContact O-CB 3.4Å; Q645-K649 WeakPolarHBondContact O-CG 3.47Å; Q645-K649 PolarHBondContact O-N 3.27Å
646	L	90.1	Very high	90.3	Very high	110 Å²	110	110.3 Å²	110.3	58%	0.576	54%	0.54	S	S	*	.	H	α-helix	trans	-64.8	-40.9	176.5	-173.2	69.4	0	0	0	111.6	L642 K643 R644 K649 N650	L642-L646 WeakPolarHBondContact O-CB 3.5Å; L642-L646 PolarHBondContact O-N 3.37Å; K643-L646 PolarHBondContact O-N 3Å; R644-L646 VanDerWaalsContact C-N 3.33Å; R644-L646 PolarHBondContact O-N 2.83Å; L646-K649 PolarHBondContact O-N 3.34Å; L646-N650 WeakPolarHBondContact O-CB 3.35Å; L646-N650 PolarHBondContact O-N 3.47Å
647	A	90.1	Very high	90.4	Very high	52 Å²	52	110.6 Å²	110.6	43%	0.43	54%	0.541	S	S	.	.	H	α-helix	trans	-63.9	-43.7	175.9	0	0	0	0	0	111.8	K643 R644 N650 I651	K643-A647 WeakPolarHBondContact O-CB 3.36Å; K643-A647 PolarHBondContact O-N 3.15Å; R644-A647 PolarHBondContact O-N 3.11Å; A647-N650 PolarHBondContact O-N 3.27Å; A647-I651 WeakPolarHBondContact O-CG1 3.16Å; A647-I651 PolarHBondContact O-N 3.02Å
648	E	91.7	Very high	90.5	Very high	109 Å²	109	106.5 Å²	106.5	51%	0.509	53%	0.531	S	S	.	.	H	α-helix	trans	-62.1	-42.7	175.5	-73.6	172.2	-171.5	0	0	111.7	R644 Q645 I651 Q652	R644-E648 IonicContact NE-OE1 3.33Å; R644-E648 WeakPolarHBondContact O-CG 3.47Å; R644-E648 PolarHBondContact O-N 2.93Å; Q645-E648 PolarHBondContact O-N 2.97Å; E648-I651 PolarHBondContact O-N 3.26Å; E648-Q652 PolarHBondContact O-N 3.39Å
649	K	90.4	Very high	90.5	Very high	127 Å²	127	107 Å²	107	55%	0.552	53%	0.534	S	S	*	.	H	α-helix	trans	-65.6	-39.6	175.1	-75.9	-69.6	177.4	-170.5	0	113	Q645 L646 I651 Q652 V653	Q645-K649 WeakPolarHBondContact O-CB 3.4Å; Q645-K649 WeakPolarHBondContact O-CG 3.47Å; Q645-K649 PolarHBondContact O-N 3.27Å; L646-K649 PolarHBondContact O-N 3.34Å; K649-I651 VanDerWaalsContact C-N 3.33Å; K649-I651 PolarHBondContact O-N 3.34Å; K649-Q652 WeakPolarHBondContact O-CB 3.26Å; K649-Q652 PolarHBondContact O-N 2.94Å; K649-V653 WeakPolarHBondContact O-CG2 3.43Å; K649-V653 PolarHBondContact O-N 2.01Å
650	N	89.5	Confident	90.5	Very high	104 Å²	104	106.6 Å²	106.6	56%	0.556	54%	0.535	S	S	*	.	H	α-helix	trans	-62.4	-39.8	174.9	-96.7	-14.7	0	0	0	112.1	L646 A647 Q652 V653 K654	L646-N650 WeakPolarHBondContact O-CB 3.35Å; L646-N650 PolarHBondContact O-N 3.47Å; A647-N650 PolarHBondContact O-N 3.27Å; N650-Q652 VanDerWaalsContact C-N 3.34Å; N650-V653 PolarHBondContact O-N 2.79Å; N650-K654 WeakPolarHBondContact O-CB 2.94Å; N650-K654 PolarHBondContact O-N 3.45Å
651	I	90.7	Very high	90.4	Very high	91 Å²	91	107.8 Å²	107.8	47%	0.467	53%	0.534	S	S	.	.	H	α-helix	trans	-64.4	-41	174.5	-66.5	166	0	0	0	110.4	A647 E648 K649 K654 R655	A647-I651 WeakPolarHBondContact O-CG1 3.16Å; A647-I651 PolarHBondContact O-N 3.02Å; E648-I651 PolarHBondContact O-N 3.26Å; K649-I651 VanDerWaalsContact C-N 3.33Å; K649-I651 PolarHBondContact O-N 3.34Å; I651-K654 PolarHBondContact O-N 3.42Å; I651-R655 WeakPolarHBondContact O-CG 3.44Å; I651-R655 PolarHBondContact O-N 2.79Å
652	Q	90.4	Very high	90.4	Very high	108 Å²	108	109.5 Å²	109.5	51%	0.505	54%	0.539	S	S	.	.	H	α-helix	trans	-63.2	-45.4	176.7	-168	176.7	11.6	0	0	111.8	E648 K649 N650 R655 T656	E648-Q652 PolarHBondContact O-N 3.39Å; K649-Q652 WeakPolarHBondContact O-CB 3.26Å; K649-Q652 PolarHBondContact O-N 2.94Å; N650-Q652 VanDerWaalsContact C-N 3.34Å; Q652-R655 PolarHBondContact O-N 2.81Å; Q652-T656 PolarHBondContact O-N 2.85Å; Q652-T656 PolarHBondContact O-OG1 2.89Å
653	V	89.8	Confident	90.4	Very high	92 Å²	92	111.9 Å²	111.9	56%	0.558	54%	0.541	S	S	*	.	H	α-helix	trans	-62.2	-44.9	177	171	0	0	0	0	110.9	K649 N650 R655 T656 C657	K649-V653 WeakPolarHBondContact O-CG2 3.43Å; K649-V653 PolarHBondContact O-N 2.01Å; N650-V653 PolarHBondContact O-N 2.79Å; V653-R655 PolarHBondContact O-N 2.91Å; V653-T656 PolarHBondContact O-N 3.1Å; V653-T656 VanDerWaalsContact O-N 3.11Å; V653-C657 PolarHBondContact O-N 3.28Å
654	K	91.4	Very high	90.1	Very high	142 Å²	142	108.5 Å²	108.5	62%	0.617	53%	0.533	S	S	*	.	H	α-helix	trans	-60.1	-46.8	178.2	-167.7	172.2	-176.7	178.5	0	111.8	N650 I651 T656 C657 D658	N650-K654 WeakPolarHBondContact O-CB 2.94Å; N650-K654 PolarHBondContact O-N 3.45Å; I651-K654 PolarHBondContact O-N 3.42Å; K654-T656 VanDerWaalsContact C-N 3.27Å; K654-T656 PolarHBondContact O-N 3.4Å; K654-C657 WeakPolarHBondContact O-CB 2.81Å; K654-C657 PolarHBondContact O-N 3.4Å; K654-D658 PolarHBondContact O-N 2.87Å
655	R	91.1	Very high	90.1	Very high	176 Å²	176	104.7 Å²	104.7	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-58.6	-39.6	174.1	-72.3	-175	-158.8	172.9	6	112.3	I651 Q652 V653 L659	I651-R655 WeakPolarHBondContact O-CG 3.44Å; I651-R655 PolarHBondContact O-N 2.79Å; Q652-R655 PolarHBondContact O-N 2.81Å; V653-R655 PolarHBondContact O-N 2.91Å; R655-L659 WeakPolarHBondContact O-CB 3.45Å; R655-L659 PolarHBondContact O-N 2.93Å
656	T	90.9	Very high	90	Very high	83 Å²	83	105.4 Å²	105.4	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-67.5	-40.7	179.7	-40.4	0	0	0	0	110.8	Q652 V653 K654 L659 T660	Q652-T656 PolarHBondContact O-N 2.85Å; Q652-T656 PolarHBondContact O-OG1 2.89Å; V653-T656 PolarHBondContact O-N 3.1Å; V653-T656 VanDerWaalsContact O-N 3.11Å; K654-T656 VanDerWaalsContact C-N 3.27Å; K654-T656 PolarHBondContact O-N 3.4Å; T656-L659 PolarHBondContact O-N 3.38Å; T656-T660 WeakPolarHBondContact O-CG2 3.15Å; T656-T660 PolarHBondContact O-N 3.31Å; T656-T660 PolarHBondContact O-OG1 2.97Å; T656-T660 VanDerWaalsContact O-OG1 3.09Å
657	C	89	Confident	89.8	Confident	71 Å²	71	105.4 Å²	105.4	48%	0.48	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-47.4	175.4	-165.2	0	0	0	0	111.7	V653 K654 L659 T660 E661	V653-C657 PolarHBondContact O-N 3.28Å; K654-C657 WeakPolarHBondContact O-CB 2.81Å; K654-C657 PolarHBondContact O-N 3.4Å; C657-L659 VanDerWaalsContact C-N 3.31Å; C657-L659 PolarHBondContact O-N 2.94Å; C657-T660 VanDerWaalsContact CA-OG1 3.3Å; C657-T660 WeakPolarHBondContact CA-OG1 3.14Å; C657-T660 PolarHBondContact O-N 3.11Å; C657-T660 PolarHBondContact O-OG1 3.34Å; C657-E661 WeakPolarHBondContact O-CB 3.34Å; C657-E661 PolarHBondContact O-N 3.37Å
658	D	89.4	Confident	89.7	Confident	74 Å²	74	108.2 Å²	108.2	40%	0.396	53%	0.532	S	S	.	.	H	α-helix	trans	-61.3	-40.5	178.4	-61	-19	0	0	0	111	K654 E661 Q662	K654-D658 PolarHBondContact O-N 2.87Å; D658-E661 PolarHBondContact O-N 2.77Å; D658-Q662 WeakPolarHBondContact O-CG 3.31Å; D658-Q662 PolarHBondContact O-N 3.47Å
659	L	91.8	Very high	89.5	Confident	96 Å²	96	109.4 Å²	109.4	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-69.4	-34.6	178.5	-139.4	143.3	0	0	0	112	R655 T656 C657 R663	R655-L659 WeakPolarHBondContact O-CB 3.45Å; R655-L659 PolarHBondContact O-N 2.93Å; T656-L659 PolarHBondContact O-N 3.38Å; C657-L659 VanDerWaalsContact C-N 3.31Å; C657-L659 PolarHBondContact O-N 2.94Å; L659-R663 WeakPolarHBondContact O-CG 3.2Å; L659-R663 PolarHBondContact O-N 3.08Å
660	T	87.7	Confident	89.3	Confident	72 Å²	72	108 Å²	108	44%	0.442	54%	0.536	S	S	.	.	H	α-helix	trans	-69.7	-39.6	171.5	47.1	0	0	0	0	112.4	T656 C657 R663 V664	T656-T660 WeakPolarHBondContact O-CG2 3.15Å; T656-T660 PolarHBondContact O-N 3.31Å; T656-T660 PolarHBondContact O-OG1 2.97Å; T656-T660 VanDerWaalsContact O-OG1 3.09Å; C657-T660 VanDerWaalsContact CA-OG1 3.3Å; C657-T660 WeakPolarHBondContact CA-OG1 3.14Å; C657-T660 PolarHBondContact O-N 3.11Å; C657-T660 PolarHBondContact O-OG1 3.34Å; T660-R663 PolarHBondContact O-N 2.92Å; T660-V664 WeakPolarHBondContact O-CG2 3.4Å; T660-V664 PolarHBondContact O-N 3.14Å
661	E	89.3	Confident	89	Confident	119 Å²	119	107.3 Å²	107.3	56%	0.556	54%	0.538	S	S	*	.	H	α-helix	trans	-63.8	-42.6	177.4	-167.1	173.5	-173.8	0	0	111	C657 D658 R663 V664 L665	C657-E661 WeakPolarHBondContact O-CB 3.34Å; C657-E661 PolarHBondContact O-N 3.37Å; D658-E661 PolarHBondContact O-N 2.77Å; E661-R663 PolarHBondContact O-N 3.4Å; E661-V664 PolarHBondContact O-N 2.74Å; E661-L665 HydrophobicContact CG-CD1 4.49Å; E661-L665 WeakPolarHBondContact O-CG 3.33Å; E661-L665 PolarHBondContact O-N 3.49Å
662	Q	90.7	Very high	88.4	Confident	133 Å²	133	111.9 Å²	111.9	62%	0.621	55%	0.55	S	S	*	.	H	α-helix	trans	-61.3	-40.3	173.4	-74	-178.6	-8	0	0	113.1	D658 L665 Q666	D658-Q662 WeakPolarHBondContact O-CG 3.31Å; D658-Q662 PolarHBondContact O-N 3.47Å; Q662-L665 PolarHBondContact O-N 2.99Å; Q662-Q666 PolarHBondContact O-N 3.47Å
663	R	90	Very high	87.9	Confident	160 Å²	160	110 Å²	110	60%	0.604	55%	0.548	S	S	*	.	H	α-helix	trans	-65.3	-40	175.5	-80.6	178.7	167.8	-179.7	-3	112.2	L659 T660 E661 Q666 L667	L659-R663 WeakPolarHBondContact O-CG 3.2Å; L659-R663 PolarHBondContact O-N 3.08Å; T660-R663 PolarHBondContact O-N 2.92Å; E661-R663 PolarHBondContact O-N 3.4Å; R663-Q666 PolarHBondContact O-N 3.21Å; R663-L667 WeakPolarHBondContact O-CG 3.4Å; R663-L667 PolarHBondContact O-N 2.94Å
664	V	86.7	Confident	87.3	Confident	79 Å²	79	110.7 Å²	110.7	48%	0.479	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-44.8	176.1	172.3	0	0	0	0	110.4	T660 E661 Q666 L667 E668	T660-V664 WeakPolarHBondContact O-CG2 3.4Å; T660-V664 PolarHBondContact O-N 3.14Å; E661-V664 PolarHBondContact O-N 2.74Å; V664-Q666 PolarHBondContact O-N 3.36Å; V664-L667 PolarHBondContact O-N 3.34Å; V664-E668 PolarHBondContact O-N 2.93Å
665	L	89	Confident	86.5	Confident	90 Å²	90	111 Å²	111	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-40	176.5	-71.1	169.6	0	0	0	112.6	E661 Q662 E668 Q669	E661-L665 HydrophobicContact CG-CD1 4.49Å; E661-L665 WeakPolarHBondContact O-CG 3.33Å; E661-L665 PolarHBondContact O-N 3.49Å; Q662-L665 PolarHBondContact O-N 2.99Å; L665-E668 PolarHBondContact O-N 3.45Å; L665-Q669 WeakPolarHBondContact O-CG 3.23Å; L665-Q669 PolarHBondContact O-N 3.28Å
666	Q	89.3	Confident	85.6	Confident	125 Å²	125	106 Å²	106	58%	0.584	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-41.8	173.1	-84	-174.8	-20.1	0	0	112.2	Q662 R663 V664 Q669 N670	Q662-Q666 PolarHBondContact O-N 3.47Å; R663-Q666 PolarHBondContact O-N 3.21Å; V664-Q666 PolarHBondContact O-N 3.36Å; Q666-Q669 PolarHBondContact O-N 3Å; Q666-N670 WeakPolarHBondContact O-CB 3.46Å; Q666-N670 PolarHBondContact O-N 3.39Å
667	L	87.7	Confident	84.7	Confident	111 Å²	111	105.5 Å²	105.5	58%	0.581	54%	0.535	S	S	*	.	H	α-helix	trans	-64.6	-39.9	175.6	-74.4	167.8	0	0	0	111.6	R663 V664 N670 C671	R663-L667 WeakPolarHBondContact O-CG 3.4Å; R663-L667 PolarHBondContact O-N 2.94Å; V664-L667 PolarHBondContact O-N 3.34Å; L667-N670 PolarHBondContact O-N 3.06Å; L667-C671 WeakPolarHBondContact O-CB 3.45Å; L667-C671 PolarHBondContact O-N 3.47Å
668	E	86.4	Confident	84	Confident	110 Å²	110	108.3 Å²	108.3	51%	0.514	54%	0.536	S	S	.	.	H	α-helix	trans	-63.7	-40.6	174.2	-75.8	-169.1	163	0	0	112.3	V664 L665 C671 R672	V664-E668 PolarHBondContact O-N 2.93Å; L665-E668 PolarHBondContact O-N 3.45Å; E668-C671 PolarHBondContact O-N 3.44Å; E668-R672 WeakPolarHBondContact O-CB 3.41Å; E668-R672 WeakPolarHBondContact O-CG 3.35Å; E668-R672 PolarHBondContact O-N 3.3Å
669	Q	87.6	Confident	82.9	Confident	135 Å²	135	113.2 Å²	113.2	63%	0.631	55%	0.549	S	S	*	.	H	α-helix	trans	-65.6	-44.1	175.2	-76	-179.5	-8.8	0	0	112	L665 Q666 R672 S673	L665-Q669 WeakPolarHBondContact O-CG 3.23Å; L665-Q669 PolarHBondContact O-N 3.28Å; Q666-Q669 PolarHBondContact O-N 3Å; Q669-R672 PolarHBondContact O-N 3.01Å; Q669-S673 WeakPolarHBondContact O-CB 3.48Å; Q669-S673 PolarHBondContact O-N 3.41Å
670	N	87.6	Confident	81.9	Confident	98 Å²	98	116.5 Å²	116.5	52%	0.524	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-41.8	176	-73.6	-9.7	0	0	0	111.5	Q666 L667 S673 N674	Q666-N670 WeakPolarHBondContact O-CB 3.46Å; Q666-N670 PolarHBondContact O-N 3.39Å; L667-N670 PolarHBondContact O-N 3.06Å; N670-S673 PolarHBondContact O-N 3.13Å; N670-N674 WeakPolarHBondContact O-CB 3.42Å; N670-N674 VanDerWaalsContact O-CG 3.27Å; N670-N674 PolarHBondContact O-N 3Å; N670-N674 PolarHBondContact O-ND2 2.88Å
671	C	81.8	Confident	81.1	Confident	88 Å²	88	117.7 Å²	117.7	60%	0.595	57%	0.573	S	S	*	*	H	α-helix	trans	-63.3	-40.8	174.1	-83.8	0	0	0	0	112.2	L667 E668 Y675	L667-C671 WeakPolarHBondContact O-CB 3.45Å; L667-C671 PolarHBondContact O-N 3.47Å; E668-C671 PolarHBondContact O-N 3.44Å; C671-Y675 VanDerWaalsContact O-CB 3.29Å; C671-Y675 WeakPolarHBondContact O-CB 3.45Å; C671-Y675 PolarHBondContact O-N 3.04Å
672	R	79.6	Confident	79.3	Confident	188 Å²	188	123.1 Å²	123.1	71%	0.709	59%	0.588	S	S	*	*	H	α-helix	trans	-65.2	-43.1	174.7	-79.9	-174.6	-177.6	-148.1	3.2	112.3	E668 Q669 Y675 C676	E668-R672 WeakPolarHBondContact O-CB 3.41Å; E668-R672 WeakPolarHBondContact O-CG 3.35Å; E668-R672 PolarHBondContact O-N 3.3Å; Q669-R672 PolarHBondContact O-N 3.01Å; R672-Y675 PolarHBondContact O-N 3.46Å; R672-C676 PolarHBondContact O-N 3.32Å; R672-C676 PolarHBondContact O-SG 3.46Å; R672-C676 VanDerWaalsContact O-SG 3.38Å
673	S	78.8	Confident	78.7	Confident	67 Å²	67	122.7 Å²	122.7	47%	0.469	59%	0.587	S	S	.	*	H	α-helix	trans	-64.8	-43.7	178	-178.5	0	0	0	0	111.8	Q669 N670 Y675 C676 T677	Q669-S673 WeakPolarHBondContact O-CB 3.48Å; Q669-S673 PolarHBondContact O-N 3.41Å; N670-S673 PolarHBondContact O-N 3.13Å; S673-Y675 VanDerWaalsContact C-N 3.31Å; S673-Y675 PolarHBondContact O-N 3.08Å; S673-C676 PolarHBondContact O-N 3Å; S673-T677 PolarHBondContact O-N 3.46Å; S673-T677 PolarHBondContact O-OG1 2.94Å
674	N	78.4	Confident	78.1	Confident	108 Å²	108	120.7 Å²	120.7	58%	0.578	59%	0.586	S	S	*	*	H	α-helix	trans	-63.9	-35.6	174.1	-72.8	-14.8	0	0	0	112	N670 T677 W678	N670-N674 WeakPolarHBondContact O-CB 3.42Å; N670-N674 VanDerWaalsContact O-CG 3.27Å; N670-N674 PolarHBondContact O-N 3Å; N670-N674 PolarHBondContact O-ND2 2.88Å; N674-T677 VanDerWaalsContact CA-OG1 3.32Å; N674-T677 WeakPolarHBondContact CA-OG1 3.37Å; N674-T677 PolarHBondContact O-OG1 3.17Å; N674-T677 VanDerWaalsContact O-OG1 3.08Å; N674-W678 VanDerWaalsContact O-CB 3.22Å; N674-W678 WeakPolarHBondContact O-CB 3.28Å; N674-W678 PolarHBondContact O-N 2.6Å
675	Y	73.9	Confident	77.6	Confident	147 Å²	147	123 Å²	123	58%	0.576	59%	0.592	S	S	*	*	H	α-helix	trans	-70.4	-37	175.5	-164.8	-94.4	0	0	0	112.4	C671 R672 S673 R679	C671-Y675 VanDerWaalsContact O-CB 3.29Å; C671-Y675 WeakPolarHBondContact O-CB 3.45Å; C671-Y675 PolarHBondContact O-N 3.04Å; R672-Y675 PolarHBondContact O-N 3.46Å; S673-Y675 VanDerWaalsContact C-N 3.31Å; S673-Y675 PolarHBondContact O-N 3.08Å; Y675-R679 WeakPolarHBondContact O-CB 3.45Å; Y675-R679 PolarHBondContact O-N 2.75Å; Y675-R679 VanDerWaalsContact O-N 3.1Å
676	C	71.4	Confident	76.9	Confident	72 Å²	72	124.9 Å²	124.9	49%	0.486	60%	0.599	S	S	.	*	H	α-helix	trans	-67	-46.5	174.2	-73.7	0	0	0	0	112	R672 S673 W678 R679 E680	R672-C676 PolarHBondContact O-N 3.32Å; R672-C676 PolarHBondContact O-SG 3.46Å; R672-C676 VanDerWaalsContact O-SG 3.38Å; S673-C676 PolarHBondContact O-N 3Å; C676-W678 PolarHBondContact O-N 3.36Å; C676-R679 WeakPolarHBondContact O-CB 3.17Å; C676-R679 PolarHBondContact O-N 3.16Å; C676-R679 VanDerWaalsContact O-N 3.11Å; C676-E680 PolarHBondContact O-N 3.26Å
677	T	73.2	Confident	76.2	Confident	72 Å²	72	124.9 Å²	124.9	44%	0.442	60%	0.6	S	S	.	*	H	α-helix	trans	-66.1	-36.5	177.6	47.3	0	0	0	0	112.5	S673 N674 R679 E680 S681	S673-T677 PolarHBondContact O-N 3.46Å; S673-T677 PolarHBondContact O-OG1 2.94Å; N674-T677 VanDerWaalsContact CA-OG1 3.32Å; N674-T677 WeakPolarHBondContact CA-OG1 3.37Å; N674-T677 PolarHBondContact O-OG1 3.17Å; N674-T677 VanDerWaalsContact O-OG1 3.08Å; T677-R679 VanDerWaalsContact C-N 3.28Å; T677-R679 PolarHBondContact O-N 3.17Å; T677-E680 PolarHBondContact O-N 3.45Å; T677-S681 WeakPolarHBondContact O-CB 3.47Å; T677-S681 PolarHBondContact O-N 2.98Å; T677-S681 VanDerWaalsContact O-N 3.08Å; T677-S681 PolarHBondContact O-OG 3Å
678	W	73.7	Confident	75.4	Confident	130 Å²	130	125.9 Å²	125.9	49%	0.492	60%	0.601	S	S	.	*	H	α-helix	trans	-67	-29.1	172.5	-169.6	83.9	0	0	0	112.9	N674 C676 S681 R682	N674-W678 VanDerWaalsContact O-CB 3.22Å; N674-W678 WeakPolarHBondContact O-CB 3.28Å; N674-W678 PolarHBondContact O-N 2.6Å; C676-W678 PolarHBondContact O-N 3.36Å; W678-S681 WeakPolarHBondContact CA-OG 3.41Å; W678-S681 PolarHBondContact O-OG 3.16Å; W678-R682 VanDerWaalsContact CZ2-CZ 3.43Å
679	R	66.9	Low	74.6	Confident	178 Å²	178	127 Å²	127	67%	0.672	61%	0.607	S	S	*	*	H	α-helix	trans	-79.2	-29.7	176.1	-165.3	-175.1	-129.2	-168.7	2.7	113.1	Y675 C676 T677 R682	Y675-R679 WeakPolarHBondContact O-CB 3.45Å; Y675-R679 PolarHBondContact O-N 2.75Å; Y675-R679 VanDerWaalsContact O-N 3.1Å; C676-R679 WeakPolarHBondContact O-CB 3.17Å; C676-R679 PolarHBondContact O-N 3.16Å; C676-R679 VanDerWaalsContact O-N 3.11Å; T677-R679 VanDerWaalsContact C-N 3.28Å; T677-R679 PolarHBondContact O-N 3.17Å; R679-R682 VanDerWaalsContact O-OXT 3.07Å
680	E	70.8	Confident	73.6	Confident	165 Å²	165	126.4 Å²	126.4	77%	0.771	61%	0.606	S	S	*	*	H	α-helix	trans	-82.9	-21.4	176.3	-73.6	175.8	173.1	0	0	113.1	C676 T677	C676-E680 PolarHBondContact O-N 3.26Å; T677-E680 PolarHBondContact O-N 3.45Å
681	S	69.5	Low	72.5	Confident	97 Å²	97	128.8 Å²	128.8	68%	0.678	61%	0.612	S	S	*	*			trans	-86.6	-7.5	174.4	50.2	0	0	0	0	114.2	T677 W678	T677-S681 WeakPolarHBondContact O-CB 3.47Å; T677-S681 PolarHBondContact O-N 2.98Å; T677-S681 VanDerWaalsContact O-N 3.08Å; T677-S681 PolarHBondContact O-OG 3Å; W678-S681 WeakPolarHBondContact CA-OG 3.41Å; W678-S681 PolarHBondContact O-OG 3.16Å
682	R	51.7	Low	71.6	Confident	233 Å²	233	132.5 Å²	132.5	88%	0.879	61%	0.614	S	S	*	*			trans	-102.1	0	167.9	-96.4	-168.3	-178.6	-164.1	2.4	110.1	W678 R679	W678-R682 VanDerWaalsContact CZ2-CZ 3.43Å; R679-R682 VanDerWaalsContact O-OXT 3.07Å

Retrieved 682 of 682 residues in 198.8 ms (Link to these results)

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