A0A077Z6U0_TRITR Loading...

Intermediate filament protein ifa 1

AlphaFold DB , UniProt , Accession A0A077Z6U0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 620 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	38	Very low	41.1	Very low	237 Å²	237	156 Å²	156	100%	1.167	84%	0.843	S	S	*	*				0	97.6	0	-73.1	-69.6	178.5	0	0	108.4
2	P	43.4	Very low	40.8	Very low	122 Å²	122	159.8 Å²	159.8	79%	0.792	85%	0.846	S	S	*	*				-126.4	138.3	129.1	31.4	-19.8	0	0	0	110.7
3	E	40.4	Very low	40.4	Very low	186 Å²	186	156.6 Å²	156.6	87%	0.869	84%	0.837	S	S	*	*			trans	-66.9	124.8	-176.6	-67.7	174	143	0	0	111.7	K5	E3-K5 PolarHBondContact O-N 3.24Å
4	V	47.8	Very low	39.8	Very low	131 Å²	131	153.6 Å²	153.6	79%	0.794	83%	0.834	S	S	*	*			trans	-85.6	103.3	172.4	179.1	0	0	0	0	108	T6	V4-T6 PolarHBondContact O-N 3.4Å
5	K	47.8	Very low	39.5	Very low	188 Å²	188	153.3 Å²	153.3	82%	0.817	83%	0.829	S	S	*	*			trans	-67.5	108.9	171.1	-87	178.8	174.5	175.1	0	110	E3 T7	E3-K5 PolarHBondContact O-N 3.24Å; K5-T7 PolarHBondContact O-N 3.19Å
6	T	44.7	Very low	39.1	Very low	129 Å²	129	150.7 Å²	150.7	79%	0.791	83%	0.827	S	S	*	*			trans	-81.8	102.8	168.3	51.1	0	0	0	0	109.7	V4	V4-T6 PolarHBondContact O-N 3.4Å
7	T	42.1	Very low	38.8	Very low	132 Å²	132	149.9 Å²	149.9	81%	0.81	83%	0.828	S	S	*	*			trans	-85.6	105.4	169	47.6	0	0	0	0	109.8	K5 K9	K5-T7 PolarHBondContact O-N 3.19Å; T7-K9 PolarHBondContact O-N 3.34Å
8	S	38.1	Very low	38.7	Very low	117 Å²	117	152.1 Å²	152.1	82%	0.818	83%	0.831	S	S	*	*			trans	-78.7	99.4	170.1	36.5	0	0	0	0	110
9	K	38.1	Very low	38.5	Very low	194 Å²	194	147.7 Å²	147.7	84%	0.843	82%	0.824	S	S	*	*			trans	-85.4	110.2	168	-114	-176.6	177.1	-175.1	0	108.5	T7 E11	T7-K9 PolarHBondContact O-N 3.34Å; K9-E11 PolarHBondContact O-N 3.22Å
10	S	36.8	Very low	38.3	Very low	114 Å²	114	143.9 Å²	143.9	80%	0.797	82%	0.82	S	S	*	*			trans	-85.2	96.7	170.4	45.7	0	0	0	0	109.6	K12	S10-K12 PolarHBondContact O-N 3.45Å
11	E	35.4	Very low	38.1	Very low	166 Å²	166	145.8 Å²	145.8	78%	0.776	82%	0.822	S	S	*	*			trans	-78.1	108.2	167.7	-85.7	176.9	167.1	0	0	109.5	K9 T13	K9-E11 PolarHBondContact O-N 3.22Å; E11-T13 PolarHBondContact O-N 2.87Å
12	K	36.6	Very low	37.8	Very low	202 Å²	202	140.9 Å²	140.9	88%	0.878	81%	0.805	S	S	*	*			trans	-78.6	94.9	165.2	-82.2	-179.2	173.6	179.7	0	108.4	S10 S14	S10-K12 PolarHBondContact O-N 3.45Å; K12-S14 PolarHBondContact O-N 2.99Å
13	T	36.1	Very low	37.4	Very low	118 Å²	118	141 Å²	141	72%	0.724	80%	0.803	S	S	*	*			trans	-81.8	104	165	34.5	0	0	0	0	109.7	E11 I15	E11-T13 PolarHBondContact O-N 2.87Å; T13-I15 PolarHBondContact O-N 3.15Å
14	S	32	Very low	36.9	Very low	115 Å²	115	138.3 Å²	138.3	80%	0.804	79%	0.789	S	S	*	*			trans	-73.7	111.4	167.7	-56.6	0	0	0	0	108.9	K12	K12-S14 PolarHBondContact O-N 2.99Å
15	I	35.9	Very low	36.2	Very low	148 Å²	148	137.9 Å²	137.9	76%	0.759	79%	0.786	S	S	*	*			trans	-90.2	106.1	174.3	-64.3	169.3	0	0	0	107.1	T13	T13-I15 PolarHBondContact O-N 3.15Å
16	S	32	Very low	35.4	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	78%	0.781	S	S	*	*			trans	-81.3	121.4	168.7	-73.9	0	0	0	0	109.4	E18	S16-E18 PolarHBondContact O-N 3.33Å
17	T	35.1	Very low	34.9	Very low	138 Å²	138	132.7 Å²	132.7	85%	0.847	77%	0.771	S	S	*	*			trans	-80.1	96.9	179.7	-39.9	0	0	0	0	109.6
18	E	36.9	Very low	34.5	Very low	188 Å²	188	135.1 Å²	135.1	88%	0.879	77%	0.77	S	S	*	*			trans	-88.5	128	165.8	-79.7	-171.4	165.3	0	0	110.4	S16 G20	S16-E18 PolarHBondContact O-N 3.33Å; E18-G20 PolarHBondContact O-N 2.85Å
19	G	34	Very low	34.2	Very low	69 Å²	69	134.4 Å²	134.4	71%	0.711	77%	0.765	S	S	*	*			trans	-67.2	112.3	-172.2	0	0	0	0	0	113	H21	G19-H21 PolarHBondContact O-N 2.94Å
20	G	34.6	Very low	34.1	Very low	72 Å²	72	133.6 Å²	133.6	74%	0.742	76%	0.764	S	S	*	*			trans	-65.7	113.1	174.9	0	0	0	0	0	112.3	E18	E18-G20 PolarHBondContact O-N 2.85Å
21	H	34.5	Very low	34	Very low	184 Å²	184	137 Å²	137	85%	0.852	77%	0.767	S	S	*	*			trans	-79.6	119.7	164.8	-81.2	30.7	0	0	0	109.2	G19	G19-H21 PolarHBondContact O-N 2.94Å
22	T	31.9	Very low	33.9	Very low	133 Å²	133	137.8 Å²	137.8	82%	0.816	77%	0.771	S	S	*	*			trans	-93	107.8	178.5	-41.6	0	0	0	0	108.6
23	V	34.5	Very low	33.8	Very low	125 Å²	125	139.4 Å²	139.4	76%	0.758	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-91.3	120.1	172.8	179.2	0	0	0	0	108.5
24	K	29.9	Very low	33.7	Very low	129 Å²	129	139.3 Å²	139.3	56%	0.561	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-85.3	116.8	174.1	-72.5	-179.8	175.3	-179	0	109.2
25	T	33.2	Very low	33.9	Very low	122 Å²	122	140.9 Å²	140.9	75%	0.748	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-102.8	120.9	171.5	36	0	0	0	0	110.3
26	T	31.7	Very low	33.8	Very low	116 Å²	116	139.4 Å²	139.4	71%	0.712	78%	0.778	S	S	*	*			trans	-94.7	114.1	174.1	-58.9	0	0	0	0	108.6
27	V	33.1	Very low	34	Very low	93 Å²	93	144.8 Å²	144.8	56%	0.564	78%	0.782	S	S	*	*			trans	-86.3	110.4	176.4	-179.1	0	0	0	0	108.3
28	K	33.6	Very low	34	Very low	182 Å²	182	141.4 Å²	141.4	79%	0.791	78%	0.775	S	S	*	*			trans	-84.5	116.1	164.2	-88.7	-175.9	173.1	-177.6	0	108.5
29	S	32.4	Very low	33.8	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	78%	0.778	S	S	*	*			trans	-81.8	104.5	169	47.4	0	0	0	0	109
30	E	35.5	Very low	34	Very low	176 Å²	176	142.2 Å²	142.2	82%	0.822	78%	0.776	S	S	*	*			trans	-89.4	115.9	164.3	-80.7	174.8	171.3	0	0	108.3	H32	E30-H32 PolarHBondContact O-N 3.27Å
31	E	34.1	Very low	34.1	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.864	79%	0.785	S	S	*	*			trans	-70.2	122	175.8	-77.5	-178	146.4	0	0	110.2	R33	E31-R33 PolarHBondContact O-N 3.14Å
32	H	33.2	Very low	34.3	Very low	184 Å²	184	146.3 Å²	146.3	85%	0.852	78%	0.784	S	S	*	*			trans	-61.1	109.9	171.9	-77	-76.7	0	0	0	110.9	E30	E30-H32 PolarHBondContact O-N 3.27Å
33	R	35.4	Very low	34.7	Very low	235 Å²	235	146.6 Å²	146.6	89%	0.887	78%	0.78	S	S	*	*			trans	-96.6	117.4	152.4	-75.7	-171.4	177	-170.6	0.3	108.8	E31 D35	E31-R33 PolarHBondContact O-N 3.14Å; R33-D35 PolarHBondContact O-N 2.83Å; R33-D35 VanDerWaalsContact O-N 3.14Å
34	S	34.3	Very low	35	Very low	116 Å²	116	145.3 Å²	145.3	81%	0.811	78%	0.777	S	S	*	*			trans	-77	85.4	-174.2	-41.7	0	0	0	0	110.7
35	D	35.5	Very low	35.5	Very low	148 Å²	148	142.8 Å²	142.8	79%	0.791	79%	0.788	S	S	*	*			trans	-91.8	118.6	166.6	-77.9	-30.1	0	0	0	109.7	R33 Y37	R33-D35 PolarHBondContact O-N 2.83Å; R33-D35 VanDerWaalsContact O-N 3.14Å; D35-Y37 PolarHBondContact O-N 3.21Å
36	S	34.1	Very low	35.7	Very low	117 Å²	117	145.8 Å²	145.8	82%	0.818	79%	0.793	S	S	*	*			trans	-68.2	130.9	-170.1	76.5	0	0	0	0	111.5	G38	S36-G38 PolarHBondContact O-N 3.29Å
37	Y	35.5	Very low	36.6	Very low	225 Å²	225	150.9 Å²	150.9	88%	0.882	80%	0.801	S	S	*	*			trans	-62.8	98.7	178.6	-66.1	-87.1	0	0	0	112.3	D35 L39	D35-Y37 PolarHBondContact O-N 3.21Å; Y37-L39 PolarHBondContact O-N 3.36Å
38	G	35.9	Very low	36.9	Very low	68 Å²	68	157.4 Å²	157.4	70%	0.701	82%	0.815	S	S	*	*			trans	-79.7	96.6	158.3	0	0	0	0	0	109.6	S36 S40	S36-G38 PolarHBondContact O-N 3.29Å; G38-S40 VanDerWaalsContact C-N 3.29Å; G38-S40 PolarHBondContact O-N 3.38Å
39	L	33	Very low	37.7	Very low	177 Å²	177	152 Å²	152	93%	0.927	80%	0.8	S	S	*	*			trans	-66.4	82.9	171	-80.4	154	0	0	0	110	Y37	Y37-L39 PolarHBondContact O-N 3.36Å
40	S	38.3	Very low	38.7	Very low	97 Å²	97	153.7 Å²	153.7	68%	0.678	81%	0.807	S	S	*	*			trans	-89.5	111.5	162.7	52.6	0	0	0	0	109.2	G38 M42	G38-S40 VanDerWaalsContact C-N 3.29Å; G38-S40 PolarHBondContact O-N 3.38Å; S40-M42 VanDerWaalsContact C-N 3.32Å; S40-M42 PolarHBondContact O-N 3.03Å
41	N	36.4	Very low	38.9	Very low	174 Å²	174	152.4 Å²	152.4	93%	0.93	80%	0.804	S	S	*	*			trans	-57.2	89.5	168.4	-127.6	23.8	0	0	0	108.8
42	M	39.3	Very low	39.6	Very low	167 Å²	167	148.7 Å²	148.7	82%	0.823	80%	0.798	S	S	*	*			trans	-102	108.1	170.5	-82.1	-103.7	92	0	0	108.7	S40	S40-M42 VanDerWaalsContact C-N 3.32Å; S40-M42 PolarHBondContact O-N 3.03Å
43	D	39.2	Very low	40	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	79%	0.794	S	S	*	*			trans	-17.9	139.8	167.7	-160.7	11.5	0	0	0	116.9	G45	D43-G45 PolarHBondContact O-N 2.74Å
44	S	42.4	Very low	40.4	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	79%	0.794	S	S	*	*			trans	-55.9	94.5	173.3	41.9	0	0	0	0	110.8	E46	S44-E46 PolarHBondContact O-N 2.89Å
45	G	38.6	Very low	40.8	Very low	76 Å²	76	144.2 Å²	144.2	78%	0.784	79%	0.79	S	S	*	*			trans	-61.7	100.7	169	0	0	0	0	0	109.9	D43 Y47	D43-G45 PolarHBondContact O-N 2.74Å; G45-Y47 PolarHBondContact O-N 3.4Å
46	E	37.5	Very low	41	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	79%	0.79	S	S	*	*			trans	-52.7	123.5	170.5	-70.8	172	152.1	0	0	109.6	S44 R48	S44-E46 PolarHBondContact O-N 2.89Å; E46-R48 PolarHBondContact O-N 2.77Å
47	Y	52.3	Low	41.2	Very low	224 Å²	224	145.2 Å²	145.2	88%	0.878	80%	0.795	S	S	*	*			trans	-58.5	103	179.1	-177	-95.9	0	0	0	110.3	G45 S49	G45-Y47 PolarHBondContact O-N 3.4Å; Y47-S49 PolarHBondContact O-N 2.9Å
48	R	39	Very low	41.2	Very low	230 Å²	230	139.7 Å²	139.7	87%	0.868	79%	0.789	S	S	*	*			trans	-85.4	99.9	177.8	-170	174.5	-179.2	170.4	0.7	109.8	E46 T50	E46-R48 PolarHBondContact O-N 2.77Å; R48-T50 PolarHBondContact O-N 3.2Å
49	S	50.6	Low	41	Very low	67 Å²	67	147.7 Å²	147.7	47%	0.469	80%	0.798	S	S	.	*			trans	-51.4	126.2	166.6	159.7	0	0	0	0	111	Y47 I51	Y47-S49 PolarHBondContact O-N 2.9Å; S49-I51 PolarHBondContact O-N 2.99Å; S49-I51 WeakPolarHBondContact OG-CB 3.38Å; S49-I51 WeakPolarHBondContact OG-CG1 3.42Å; S49-I51 PolarHBondContact OG-N 2.89Å
50	T	53.6	Low	41.1	Very low	140 Å²	140	145.8 Å²	145.8	86%	0.859	79%	0.794	S	S	*	*			trans	-85.7	16.5	174.8	50.7	0	0	0	0	112.9	R48 S52	R48-T50 PolarHBondContact O-N 3.2Å; T50-S52 VanDerWaalsContact C-N 3.31Å; T50-S52 PolarHBondContact O-N 2.75Å
51	I	39.5	Very low	40.7	Very low	149 Å²	149	146.2 Å²	146.2	76%	0.764	80%	0.797	S	S	*	*			trans	-72.6	89.8	175.5	-60.4	171.6	0	0	0	108.3	S49	S49-I51 PolarHBondContact O-N 2.99Å; S49-I51 WeakPolarHBondContact OG-CB 3.38Å; S49-I51 WeakPolarHBondContact OG-CG1 3.42Å; S49-I51 PolarHBondContact OG-N 2.89Å
52	S	47.1	Very low	40.9	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.2	131.4	167.9	-170.8	0	0	0	0	109.4	T50 R54	T50-S52 VanDerWaalsContact C-N 3.31Å; T50-S52 PolarHBondContact O-N 2.75Å; S52-R54 PolarHBondContact O-N 3.19Å
53	A	43.4	Very low	40.7	Very low	91 Å²	91	141.6 Å²	141.6	75%	0.752	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-62.6	121.5	174.7	0	0	0	0	0	109.5
54	R	42.1	Very low	40.6	Very low	236 Å²	236	139 Å²	139	89%	0.891	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-59.5	137.8	174.1	-79.8	-176.3	173.4	-142.5	-0.6	109.9	S52 G56	S52-R54 PolarHBondContact O-N 3.19Å; R54-G56 PolarHBondContact O-N 2.94Å
55	P	43.6	Very low	40.2	Very low	113 Å²	113	140.5 Å²	140.5	73%	0.734	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-56.9	130.6	179.8	-23.8	33.2	0	0	0	111.9	F57	P55-F57 PolarHBondContact O-N 3.43Å
56	G	40.1	Very low	40	Very low	76 Å²	76	145 Å²	145	78%	0.784	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-60.5	118.3	175.3	0	0	0	0	0	110.9	R54 S58	R54-G56 PolarHBondContact O-N 2.94Å; G56-S58 PolarHBondContact O-N 3.47Å
57	F	37.8	Very low	39.8	Very low	211 Å²	211	140.9 Å²	140.9	93%	0.925	80%	0.797	S	S	*	*			trans	-67.2	99.2	169.9	-89.1	-95.5	0	0	0	109.1	P55 R59	P55-F57 PolarHBondContact O-N 3.43Å; F57-R59 PolarHBondContact O-N 2.91Å
58	S	34.9	Very low	38.9	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	79%	0.793	S	S	*	*			trans	-74.3	120.8	169.6	-161.6	0	0	0	0	109	G56 T60	G56-S58 PolarHBondContact O-N 3.47Å; S58-T60 PolarHBondContact O-N 3.44Å
59	R	33.5	Very low	39.1	Very low	235 Å²	235	130.4 Å²	130.4	89%	0.887	79%	0.79	S	S	*	*			trans	-71.5	106.8	-179.9	-64.6	174.5	174.1	-168.4	-3.2	109.1	F57	F57-R59 PolarHBondContact O-N 2.91Å
60	T	33.3	Very low	38.2	Very low	137 Å²	137	131 Å²	131	84%	0.84	81%	0.805	S	S	*	*			trans	-102.9	104.6	160.7	57.2	0	0	0	0	108.6	S58	S58-T60 PolarHBondContact O-N 3.44Å
61	S	31.4	Very low	37.3	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	81%	0.806	S	S	*	*			trans	-105.4	170.2	165.4	-49.9	0	0	0	0	108.6
62	P	40.7	Very low	36.9	Very low	124 Å²	124	124.9 Å²	124.9	81%	0.805	81%	0.807	S	S	*	*				-113.6	157.9	-84.5	33.2	-19.1	0	0	0	111.3
63	S	34.9	Very low	36.4	Very low	120 Å²	120	131 Å²	131	84%	0.839	81%	0.814	S	S	*	*			trans	-125.4	86.2	164.5	-155.3	0	0	0	0	108.4
64	A	37.5	Very low	36	Very low	87 Å²	87	133.4 Å²	133.4	72%	0.719	82%	0.819	S	S	*	*			trans	-88.8	105.1	168.5	0	0	0	0	0	107.3	L66	A64-L66 PolarHBondContact O-N 2.86Å
65	T	32.7	Very low	35.6	Very low	128 Å²	128	129.4 Å²	129.4	79%	0.785	81%	0.814	S	S	*	*			trans	-63.7	113.5	174.4	47.9	0	0	0	0	109.8	A67	T65-A67 PolarHBondContact O-N 2.78Å; T65-A67 VanDerWaalsContact O-N 3.12Å
66	L	33.9	Very low	34.8	Very low	172 Å²	172	133.4 Å²	133.4	90%	0.901	82%	0.82	S	S	*	*			trans	-64.4	104.7	166.1	-90.4	78.2	0	0	0	108.8	A64 S68	A64-L66 PolarHBondContact O-N 2.86Å; L66-S68 PolarHBondContact O-N 3.41Å
67	A	33.1	Very low	34.6	Very low	96 Å²	96	136.3 Å²	136.3	79%	0.793	82%	0.817	S	S	*	*			trans	-79.4	111.8	162.9	0	0	0	0	0	108.5	T65	T65-A67 PolarHBondContact O-N 2.78Å; T65-A67 VanDerWaalsContact O-N 3.12Å
68	S	35	Very low	34.4	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	81%	0.814	S	S	*	*			trans	-65.5	128	178	-170.5	0	0	0	0	111.3	L66 G70	L66-S68 PolarHBondContact O-N 3.41Å; S68-G70 PolarHBondContact O-N 3.32Å
69	P	42	Very low	34.3	Very low	124 Å²	124	133.2 Å²	133.2	81%	0.805	81%	0.81	S	S	*	*			trans	-83.1	98.4	168.6	12.8	3.5	0	0	0	108.7	G71	P69-G71 PolarHBondContact O-N 3.46Å
70	G	32.8	Very low	34	Very low	78 Å²	78	131.1 Å²	131.1	80%	0.804	81%	0.81	S	S	*	*			trans	-64.5	102.6	170.2	0	0	0	0	0	110.9	S68	S68-G70 PolarHBondContact O-N 3.32Å
71	G	33.1	Very low	34.2	Very low	85 Å²	85	133.1 Å²	133.1	88%	0.876	81%	0.812	S	S	*	*			trans	-77.2	117.5	170.4	0	0	0	0	0	111.4	P69	P69-G71 PolarHBondContact O-N 3.46Å
72	G	32.8	Very low	34.2	Very low	76 Å²	76	132.2 Å²	132.2	78%	0.784	82%	0.819	S	S	*	*			trans	-129	90.7	166.4	0	0	0	0	0	109.4
73	R	36.9	Very low	33.8	Very low	237 Å²	237	131.3 Å²	131.3	89%	0.894	82%	0.816	S	S	*	*			trans	-107.6	110.2	167.5	-71.1	-176.2	-179.4	169.6	0.6	107.9
74	V	34.3	Very low	33.4	Very low	140 Å²	140	131.5 Å²	131.5	85%	0.848	81%	0.812	S	S	*	*			trans	-90.3	108.3	170.1	178.7	0	0	0	0	106.9
75	L	33.8	Very low	32.9	Very low	152 Å²	152	133 Å²	133	80%	0.796	82%	0.818	S	S	*	*			trans	-106	116.7	164.1	-103.1	85.3	0	0	0	108.8
76	K	27.5	Very low	32.7	Very low	197 Å²	197	136.3 Å²	136.3	86%	0.857	82%	0.822	S	S	*	*			trans	-96.6	100.7	178.4	175.5	-169.8	-177.8	-177.1	0	108.5
77	I	34.9	Very low	32.6	Very low	138 Å²	138	132.7 Å²	132.7	71%	0.708	81%	0.81	S	S	*	*			trans	-147.4	100.9	161.4	-52.8	178.5	0	0	0	107.2
78	V	34.4	Very low	32.4	Very low	145 Å²	145	131.4 Å²	131.4	88%	0.879	81%	0.806	S	S	*	*			trans	-119.8	109.4	161	176.5	0	0	0	0	105.7
79	T	31.7	Very low	32.2	Very low	109 Å²	109	135.2 Å²	135.2	67%	0.669	81%	0.814	S	S	*	*			trans	-71.7	131.4	177.5	-60	0	0	0	0	109.5	M81	T79-M81 PolarHBondContact O-N 3.33Å
80	E	28.3	Very low	31.7	Very low	191 Å²	191	134.7 Å²	134.7	89%	0.893	81%	0.814	S	S	*	*			trans	-59.5	120.6	170.2	-61.1	172.9	169.3	0	0	109.5
81	M	35.5	Very low	32	Very low	180 Å²	180	136.5 Å²	136.5	89%	0.887	81%	0.811	S	S	*	*			trans	-126.7	122.2	165.3	-84.9	-172.8	150.5	0	0	109	T79 S83	T79-M81 PolarHBondContact O-N 3.33Å; M81-S83 PolarHBondContact O-N 2.92Å
82	G	33.2	Very low	31.9	Very low	86 Å²	86	138.1 Å²	138.1	89%	0.887	81%	0.809	S	S	*	*			trans	-45.5	124.5	-168.7	0	0	0	0	0	116
83	S	31.9	Very low	31.8	Very low	105 Å²	105	142.9 Å²	142.9	73%	0.734	81%	0.809	S	S	*	*			trans	-91.4	111.6	156.8	50.4	0	0	0	0	109.7	M81	M81-S83 PolarHBondContact O-N 2.92Å
84	T	26.9	Very low	31.5	Very low	125 Å²	125	138.9 Å²	138.9	77%	0.767	80%	0.8	S	S	*	*			trans	47.2	116.4	132.1	61.6	0	0	0	0	119.6
85	S	26.9	Very low	31.5	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	80%	0.802	S	S	*	*			trans	177	144.9	132.2	-78.4	0	0	0	0	111.9
86	F	27.7	Very low	31.4	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.864	80%	0.803	S	S	*	*			trans	71.8	125.6	148.7	179	-89.9	0	0	0	116.4
87	S	32.2	Very low	31.9	Very low	95 Å²	95	133.7 Å²	133.7	66%	0.664	81%	0.806	S	S	*	*			cis	-165.9	154.7	35.5	44.7	0	0	0	0	106.3
88	G	28.9	Very low	32.3	Very low	69 Å²	69	130.9 Å²	130.9	71%	0.711	80%	0.803	S	S	*	*				116.8	70.8	54	0	0	0	0	0	109.6
89	M	30.2	Very low	32.8	Very low	192 Å²	192	127.3 Å²	127.3	95%	0.946	79%	0.789	S	S	*	*			trans	-140.6	112.1	157.2	-70.9	-178.5	79.6	0	0	107.2
90	S	31.2	Very low	33.7	Very low	113 Å²	113	127 Å²	127	79%	0.79	79%	0.791	S	S	*	*			trans	-135.2	174.7	177.6	-41.6	0	0	0	0	108.2
91	P	39.8	Very low	35.1	Very low	116 Å²	116	121.2 Å²	121.2	75%	0.753	78%	0.776	S	S	*	*				-136.1	163.8	-106	30.1	-6.9	0	0	0	112.8
92	S	30.7	Very low	35.9	Very low	119 Å²	119	117.7 Å²	117.7	83%	0.832	76%	0.76	S	S	*	*			trans	171.2	135.4	163.5	39.8	0	0	0	0	107.5
93	F	31.3	Very low	37	Very low	176 Å²	176	119.5 Å²	119.5	77%	0.772	75%	0.748	S	S	*	*			cis	-165.5	129.6	32.9	178.5	-99.6	0	0	0	109
94	H	29.9	Very low	38.4	Very low	152 Å²	152	120.4 Å²	120.4	70%	0.704	74%	0.741	S	S	*	*			trans	11.8	115.8	153.8	-47.1	-56.7	0	0	0	121
95	Q	35.3	Very low	40.4	Very low	194 Å²	194	117.7 Å²	117.7	91%	0.907	73%	0.727	S	S	*	*				-166.8	116.2	126.8	-136.9	167.8	-9.4	0	0	113.5
96	A	31.8	Very low	42.3	Very low	97 Å²	97	120.4 Å²	120.4	80%	0.802	72%	0.719	S	S	*	*			trans	46.7	101.8	144.5	0	0	0	0	0	122.1
97	G	37.9	Very low	44.4	Very low	90 Å²	90	117.6 Å²	117.6	93%	0.928	71%	0.709	S	S	*	*	S	Bend		111.4	-22.3	119.1	0	0	0	0	0	120.6
98	A	41.8	Very low	46.4	Very low	79 Å²	79	120.5 Å²	120.5	65%	0.653	71%	0.705	S	S	*	*	S	Bend	trans	-126.4	-10.4	-174.1	0	0	0	0	0	116.4
99	A	46.6	Very low	48.5	Very low	69 Å²	69	123.3 Å²	123.3	57%	0.57	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-15.6	-176	0	0	0	0	0	114.7	A101 I102	A99-A101 VanDerWaalsContact C-N 3.32Å; A99-A101 PolarHBondContact O-N 3.37Å; A99-I102 PolarHBondContact O-N 2.83Å
100	S	50.8	Low	50.7	Low	103 Å²	103	121.2 Å²	121.2	72%	0.72	69%	0.685	S	S	*	*	H	α-helix	trans	-70.4	-25.4	-177.2	-158.4	0	0	0	0	113.4
101	A	56.3	Low	52.9	Low	70 Å²	70	123.1 Å²	123.1	58%	0.579	68%	0.679	S	S	*	*	H	α-helix	trans	-78.2	-24.5	177.8	0	0	0	0	0	113.3	A99 S105	A99-A101 VanDerWaalsContact C-N 3.32Å; A99-A101 PolarHBondContact O-N 3.37Å; A101-S105 PolarHBondContact O-N 2.98Å
102	I	53	Low	54.8	Low	105 Å²	105	123.6 Å²	123.6	54%	0.538	67%	0.672	S	S	.	*	H	α-helix	trans	-82.6	-34.1	-173.6	-61.4	174.4	0	0	0	111.8	A99 R106	A99-I102 PolarHBondContact O-N 2.83Å; I102-R106 PolarHBondContact O-N 3.07Å
103	L	56.9	Low	56.7	Low	124 Å²	124	123.2 Å²	123.2	65%	0.649	66%	0.658	S	S	*	*	H	α-helix	trans	-72.6	-40.5	176.9	-72	167.2	0	0	0	111.9	S105 R106 E107	L103-S105 PolarHBondContact O-N 3.37Å; L103-R106 PolarHBondContact O-N 3.24Å; L103-E107 PolarHBondContact O-N 3.46Å
104	E	60.8	Low	59	Low	124 Å²	124	120.4 Å²	120.4	58%	0.579	65%	0.647	S	S	*	*	H	α-helix	trans	-66.7	-26.4	176.9	-163.6	175.2	-156.6	0	0	112.6	R108	E104-R108 PolarHBondContact O-NE 3.38Å
105	S	69.4	Low	61.5	Low	68 Å²	68	117.4 Å²	117.4	48%	0.476	64%	0.636	S	S	.	*	H	α-helix	trans	-69.8	-47.5	170.5	-180	0	0	0	0	112.1	A101 L103 E109	A101-S105 PolarHBondContact O-N 2.98Å; L103-S105 PolarHBondContact O-N 3.37Å; S105-E109 PolarHBondContact O-N 2.86Å
106	R	66.8	Low	63.6	Low	177 Å²	177	112.9 Å²	112.9	67%	0.668	62%	0.618	S	S	*	*	H	α-helix	trans	-71.5	-33.9	-176.1	-81.1	-172.4	169.6	163.8	-1.1	113.7	I102 L103 R108 E109 K110	I102-R106 PolarHBondContact O-N 3.07Å; L103-R106 PolarHBondContact O-N 3.24Å; R106-R108 VanDerWaalsContact C-N 3.35Å; R106-E109 PolarHBondContact O-N 3.37Å; R106-K110 PolarHBondContact O-N 2.86Å
107	E	71.6	Confident	66.1	Low	137 Å²	137	112.5 Å²	112.5	64%	0.64	60%	0.602	S	S	*	*	H	α-helix	trans	-69.5	-35.2	178.1	-156.5	72.2	-151	0	0	111.5	L103 K111	L103-E107 PolarHBondContact O-N 3.46Å; E107-K111 WeakPolarHBondContact O-CB 3.42Å; E107-K111 PolarHBondContact O-N 3.11Å
108	R	73.8	Confident	68.2	Low	157 Å²	157	112.8 Å²	112.8	59%	0.592	58%	0.583	S	S	*	*	H	α-helix	trans	-63.4	-46.4	173.9	-111.8	-176.2	-74.2	176.5	-7.9	112	E104 R106 K110 K111 E112	E104-R108 PolarHBondContact O-NE 3.38Å; R106-R108 VanDerWaalsContact C-N 3.35Å; R108-K110 PolarHBondContact O-N 2.93Å; R108-K111 PolarHBondContact O-N 3.31Å; R108-E112 PolarHBondContact O-N 2.89Å
109	E	71.8	Confident	70.2	Confident	127 Å²	127	116.6 Å²	116.6	59%	0.593	58%	0.58	S	S	*	*	H	α-helix	trans	-66.4	-38	-176.1	-146.6	177.2	-161.5	0	0	112.4	S105 R106 E112 M113	S105-E109 PolarHBondContact O-N 2.86Å; R106-E109 PolarHBondContact O-N 3.37Å; E109-E112 PolarHBondContact O-N 3.46Å; E109-M113 PolarHBondContact O-N 3.45Å
110	K	76.5	Confident	71.9	Confident	149 Å²	149	117.7 Å²	117.7	65%	0.648	58%	0.576	S	S	*	*	H	α-helix	trans	-68.3	-38.9	176.5	-170.1	-177.6	178.4	-171.2	0	112.3	R106 R108 M113 Q114	R106-K110 PolarHBondContact O-N 2.86Å; R108-K110 PolarHBondContact O-N 2.93Å; K110-M113 PolarHBondContact O-N 2.84Å; K110-Q114 PolarHBondContact O-N 3.45Å
111	K	78.5	Confident	73.4	Confident	153 Å²	153	115.2 Å²	115.2	67%	0.665	56%	0.562	S	S	*	*	H	α-helix	trans	-68.5	-38.6	177.8	-154.9	172.3	-173.5	171.9	0	111.1	E107 R108 Q114 D115	E107-K111 WeakPolarHBondContact O-CB 3.42Å; E107-K111 PolarHBondContact O-N 3.11Å; R108-K111 PolarHBondContact O-N 3.31Å; K111-Q114 PolarHBondContact O-N 2.83Å; K111-D115 PolarHBondContact O-N 2.91Å
112	E	78.9	Confident	74.9	Confident	126 Å²	126	115.8 Å²	115.8	59%	0.589	56%	0.561	S	S	*	*	H	α-helix	trans	-62.3	-41.8	170.9	-79	-179.4	166.9	0	0	112.5	R108 E109 D115 L116	R108-E112 PolarHBondContact O-N 2.89Å; E109-E112 PolarHBondContact O-N 3.46Å; E112-D115 PolarHBondContact O-N 3.43Å; E112-L116 WeakPolarHBondContact O-CB 2.91Å; E112-L116 PolarHBondContact O-N 3.06Å
113	M	71.9	Confident	76.6	Confident	110 Å²	110	118.5 Å²	118.5	54%	0.542	57%	0.566	S	S	.	*	H	α-helix	trans	-66.4	-35.3	176.4	-92.5	-67	-79.3	0	0	113.5	E109 K110 N117	E109-M113 PolarHBondContact O-N 3.45Å; K110-M113 PolarHBondContact O-N 2.84Å; M113-N117 WeakPolarHBondContact O-CB 3.42Å; M113-N117 PolarHBondContact O-N 3.33Å
114	Q	79.7	Confident	78	Confident	118 Å²	118	117.5 Å²	117.5	55%	0.551	56%	0.56	S	S	*	*	H	α-helix	trans	-67.9	-47.1	174.8	-171.3	172.7	-1.2	0	0	111.1	K110 K111 L116 N117 D118	K110-Q114 PolarHBondContact O-N 3.45Å; K111-Q114 PolarHBondContact O-N 2.83Å; Q114-L116 VanDerWaalsContact C-N 3.28Å; Q114-L116 PolarHBondContact O-N 3.1Å; Q114-N117 PolarHBondContact O-N 2.9Å; Q114-D118 PolarHBondContact O-N 2.89Å
115	D	81.8	Confident	79.2	Confident	89 Å²	89	117.8 Å²	117.8	48%	0.476	56%	0.562	S	S	.	*	H	α-helix	trans	-59.3	-38.3	174.8	-98.8	21.9	0	0	0	112.2	K111 E112 R119	K111-D115 PolarHBondContact O-N 2.91Å; E112-D115 PolarHBondContact O-N 3.43Å; D115-R119 WeakPolarHBondContact O-CB 3.15Å; D115-R119 VanDerWaalsContact O-CG 3.22Å; D115-R119 WeakPolarHBondContact O-CG 3.33Å; D115-R119 PolarHBondContact O-N 3.11Å; D115-R119 VanDerWaalsContact O-N 3.14Å
116	L	79.5	Confident	80.2	Confident	98 Å²	98	121 Å²	121	51%	0.513	57%	0.567	S	S	.	*	H	α-helix	trans	-66.1	-43.8	175	-98.6	152.8	0	0	0	112.3	E112 Q114 R119 L120	E112-L116 WeakPolarHBondContact O-CB 2.91Å; E112-L116 PolarHBondContact O-N 3.06Å; Q114-L116 VanDerWaalsContact C-N 3.28Å; Q114-L116 PolarHBondContact O-N 3.1Å; L116-R119 PolarHBondContact O-N 3.36Å; L116-L120 WeakPolarHBondContact O-CB 3.31Å; L116-L120 PolarHBondContact O-N 3.48Å
117	N	83.8	Confident	81.4	Confident	89 Å²	89	116.2 Å²	116.2	48%	0.476	56%	0.557	S	S	.	*	H	α-helix	trans	-67.9	-39	179.3	-84.3	-18.6	0	0	0	112.6	M113 Q114 R119 L120 A121	M113-N117 WeakPolarHBondContact O-CB 3.42Å; M113-N117 PolarHBondContact O-N 3.33Å; Q114-N117 PolarHBondContact O-N 2.9Å; N117-R119 VanDerWaalsContact C-N 3.33Å; N117-R119 PolarHBondContact O-N 2.97Å; N117-L120 PolarHBondContact O-N 3.34Å; N117-A121 WeakPolarHBondContact O-CB 3.43Å; N117-A121 PolarHBondContact O-N 2.83Å
118	D	81.7	Confident	82.2	Confident	97 Å²	97	118.1 Å²	118.1	52%	0.519	56%	0.558	S	S	.	*	H	α-helix	trans	-66.4	-36.9	175.7	-72.1	-23	0	0	0	111.3	Q114 A121 S122	Q114-D118 PolarHBondContact O-N 2.89Å; D118-A121 PolarHBondContact O-N 3.46Å; D118-S122 WeakPolarHBondContact O-CB 3.49Å; D118-S122 PolarHBondContact O-N 3.47Å
119	R	84.8	Confident	83.1	Confident	159 Å²	159	116.5 Å²	116.5	60%	0.6	56%	0.556	S	S	*	*	H	α-helix	trans	-64.8	-42.7	170.8	-73.5	173.5	-170.2	-169.7	6.2	112	D115 L116 N117 S122 Y123	D115-R119 WeakPolarHBondContact O-CB 3.15Å; D115-R119 VanDerWaalsContact O-CG 3.22Å; D115-R119 WeakPolarHBondContact O-CG 3.33Å; D115-R119 PolarHBondContact O-N 3.11Å; D115-R119 VanDerWaalsContact O-N 3.14Å; L116-R119 PolarHBondContact O-N 3.36Å; N117-R119 VanDerWaalsContact C-N 3.33Å; N117-R119 PolarHBondContact O-N 2.97Å; R119-S122 PolarHBondContact O-N 3.43Å; R119-Y123 WeakPolarHBondContact O-CD2 3.35Å; R119-Y123 PolarHBondContact O-N 2.88Å
120	L	81.5	Confident	84.1	Confident	91 Å²	91	114.3 Å²	114.3	48%	0.476	55%	0.548	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.3	-111.9	156.4	0	0	0	111.6	L116 N117 Y123 I124	L116-L120 WeakPolarHBondContact O-CB 3.31Å; L116-L120 PolarHBondContact O-N 3.48Å; N117-L120 PolarHBondContact O-N 3.34Å; L120-Y123 PolarHBondContact O-N 3.49Å; L120-I124 HydrophobicContact CD2-CD1 4.41Å; L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.85Å
121	A	82.5	Confident	84.9	Confident	52 Å²	52	111.9 Å²	111.9	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-61.5	-44.7	174.6	0	0	0	0	0	111.4	N117 D118 Y123 I124 E125	N117-A121 WeakPolarHBondContact O-CB 3.43Å; N117-A121 PolarHBondContact O-N 2.83Å; D118-A121 PolarHBondContact O-N 3.46Å; A121-Y123 VanDerWaalsContact C-N 3.31Å; A121-Y123 PolarHBondContact O-N 3.32Å; A121-I124 PolarHBondContact O-N 3.22Å; A121-E125 WeakPolarHBondContact O-CB 2.82Å; A121-E125 PolarHBondContact O-N 2.79Å
122	S	87.5	Confident	85.5	Confident	81 Å²	81	107.2 Å²	107.2	57%	0.566	53%	0.529	S	S	*	.	H	α-helix	trans	-60.5	-39.3	173.8	-172.4	0	0	0	0	112.4	D118 R119 K126	D118-S122 WeakPolarHBondContact O-CB 3.49Å; D118-S122 PolarHBondContact O-N 3.47Å; R119-S122 PolarHBondContact O-N 3.43Å; S122-K126 WeakPolarHBondContact O-CB 3.37Å; S122-K126 PolarHBondContact O-N 3.32Å
123	Y	89.3	Confident	86.3	Confident	163 Å²	163	105.4 Å²	105.4	64%	0.639	52%	0.52	S	S	*	.	H	α-helix	trans	-67.2	-41.4	174.1	-80.7	-56.2	0	0	0	112.6	R119 L120 A121 K126 V127	R119-Y123 WeakPolarHBondContact O-CD2 3.35Å; R119-Y123 PolarHBondContact O-N 2.88Å; L120-Y123 PolarHBondContact O-N 3.49Å; A121-Y123 VanDerWaalsContact C-N 3.31Å; A121-Y123 PolarHBondContact O-N 3.32Å; Y123-K126 PolarHBondContact O-N 3.47Å; Y123-V127 WeakPolarHBondContact O-CB 3.27Å; Y123-V127 VanDerWaalsContact O-CG2 3.28Å; Y123-V127 WeakPolarHBondContact O-CG2 3.39Å; Y123-V127 PolarHBondContact O-N 2.89Å
124	I	86.3	Confident	87.3	Confident	102 Å²	102	105.1 Å²	105.1	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-64.4	-43.8	176.8	-69.7	166.6	0	0	0	110.5	L120 A121 K126 V127 R128	L120-I124 HydrophobicContact CD2-CD1 4.41Å; L120-I124 VanDerWaalsContact O-CG1 3.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.85Å; A121-I124 PolarHBondContact O-N 3.22Å; I124-K126 VanDerWaalsContact C-N 3.28Å; I124-K126 PolarHBondContact O-N 2.93Å; I124-V127 PolarHBondContact O-N 3.08Å; I124-R128 WeakPolarHBondContact O-CB 3.14Å; I124-R128 PolarHBondContact O-N 2.96Å
125	E	84.9	Confident	88	Confident	131 Å²	131	107.7 Å²	107.7	61%	0.612	53%	0.526	S	S	*	.	H	α-helix	trans	-60.6	-41.4	175.6	-156	74.4	-142	0	0	110.5	A121 R128 F129	A121-E125 WeakPolarHBondContact O-CB 2.82Å; A121-E125 PolarHBondContact O-N 2.79Å; E125-R128 PolarHBondContact O-N 3.35Å; E125-F129 WeakPolarHBondContact O-CB 3.43Å; E125-F129 PolarHBondContact O-N 3.46Å
126	K	91.2	Very high	88.6	Confident	135 Å²	135	109.6 Å²	109.6	59%	0.587	53%	0.53	S	S	*	.	H	α-helix	trans	-68.2	-38.9	176.9	-167.9	156	-174.2	176.2	0	112.8	S122 Y123 I124 F129 L130	S122-K126 WeakPolarHBondContact O-CB 3.37Å; S122-K126 PolarHBondContact O-N 3.32Å; Y123-K126 PolarHBondContact O-N 3.47Å; I124-K126 VanDerWaalsContact C-N 3.28Å; I124-K126 PolarHBondContact O-N 2.93Å; K126-F129 PolarHBondContact O-N 3.1Å; K126-L130 HydrophobicContact CG-CD1 4.14Å; K126-L130 WeakPolarHBondContact O-CB 3.19Å; K126-L130 VanDerWaalsContact O-CG 3.23Å; K126-L130 WeakPolarHBondContact O-CG 3.31Å; K126-L130 PolarHBondContact O-N 3.42Å
127	V	92.7	Very high	89.2	Confident	76 Å²	76	109.4 Å²	109.4	46%	0.461	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-44.9	172.9	170.5	0	0	0	0	110.1	Y123 I124 F129 L130 E131	Y123-V127 WeakPolarHBondContact O-CB 3.27Å; Y123-V127 VanDerWaalsContact O-CG2 3.28Å; Y123-V127 WeakPolarHBondContact O-CG2 3.39Å; Y123-V127 PolarHBondContact O-N 2.89Å; I124-V127 PolarHBondContact O-N 3.08Å; V127-F129 VanDerWaalsContact C-N 3.33Å; V127-F129 PolarHBondContact O-N 3.47Å; V127-L130 PolarHBondContact O-N 2.97Å; V127-E131 HydrophobicContact CG1-CG 4.26Å; V127-E131 WeakPolarHBondContact O-CB 3.06Å; V127-E131 VanDerWaalsContact O-CG 3.32Å; V127-E131 WeakPolarHBondContact O-CG 3.2Å; V127-E131 PolarHBondContact O-N 3.14Å
128	R	88	Confident	89.7	Confident	177 Å²	177	107.7 Å²	107.7	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-59	-43.6	174.3	-102.3	-174.1	107.4	165.6	5.7	112.4	I124 E125 E131 A132	I124-R128 WeakPolarHBondContact O-CB 3.14Å; I124-R128 PolarHBondContact O-N 2.96Å; E125-R128 PolarHBondContact O-N 3.35Å; R128-E131 PolarHBondContact O-N 2.97Å; R128-A132 WeakPolarHBondContact O-CB 3.35Å; R128-A132 PolarHBondContact O-N 2.87Å
129	F	93.3	Very high	90.3	Very high	124 Å²	124	108.3 Å²	108.3	54%	0.544	53%	0.53	S	S	.	.	H	α-helix	trans	-63.7	-44.5	176.7	179.6	-96.6	0	0	0	111.6	E125 K126 V127 A132 Q133	E125-F129 WeakPolarHBondContact O-CB 3.43Å; E125-F129 PolarHBondContact O-N 3.46Å; K126-F129 PolarHBondContact O-N 3.1Å; V127-F129 VanDerWaalsContact C-N 3.33Å; V127-F129 PolarHBondContact O-N 3.47Å; F129-A132 PolarHBondContact O-N 2.93Å; F129-Q133 VanDerWaalsContact CE1-CD 3.48Å; F129-Q133 HydrophobicContact CE1-CG 4.08Å; F129-Q133 HydrophobicContact CZ-CG 4.17Å; F129-Q133 PolarHBondContact O-N 3.45Å
130	L	92.9	Very high	90.7	Very high	80 Å²	80	104.1 Å²	104.1	42%	0.419	52%	0.52	S	S	.	.	H	α-helix	trans	-66.2	-39.1	176.6	-75.5	168	0	0	0	112.2	K126 V127 Q133 N134	K126-L130 HydrophobicContact CG-CD1 4.14Å; K126-L130 WeakPolarHBondContact O-CB 3.19Å; K126-L130 VanDerWaalsContact O-CG 3.23Å; K126-L130 WeakPolarHBondContact O-CG 3.31Å; K126-L130 PolarHBondContact O-N 3.42Å; V127-L130 PolarHBondContact O-N 2.97Å; L130-Q133 PolarHBondContact O-N 3.45Å; L130-N134 VanDerWaalsContact O-CB 3.3Å; L130-N134 WeakPolarHBondContact O-CB 3.41Å; L130-N134 PolarHBondContact O-N 3.3Å
131	E	91.7	Very high	91.1	Very high	98 Å²	98	104.6 Å²	104.6	46%	0.458	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-40.7	173.8	-77.3	-178.5	175.4	0	0	111.8	V127 R128 N134 R135	V127-E131 HydrophobicContact CG1-CG 4.26Å; V127-E131 WeakPolarHBondContact O-CB 3.06Å; V127-E131 VanDerWaalsContact O-CG 3.32Å; V127-E131 WeakPolarHBondContact O-CG 3.2Å; V127-E131 PolarHBondContact O-N 3.14Å; R128-E131 PolarHBondContact O-N 2.97Å; E131-N134 PolarHBondContact O-N 3.33Å; E131-R135 WeakPolarHBondContact O-CB 3.44Å; E131-R135 WeakPolarHBondContact O-CG 3.26Å; E131-R135 PolarHBondContact O-N 2.82Å
132	A	92.7	Very high	91.6	Very high	56 Å²	56	109.1 Å²	109.1	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-65.2	-42.1	174.8	0	0	0	0	0	111.6	R128 F129 R135 K136	R128-A132 WeakPolarHBondContact O-CB 3.35Å; R128-A132 PolarHBondContact O-N 2.87Å; F129-A132 PolarHBondContact O-N 2.93Å; A132-R135 PolarHBondContact O-N 3.39Å; A132-K136 PolarHBondContact O-N 2.97Å
133	Q	94.3	Very high	91.7	Very high	87 Å²	87	107.6 Å²	107.6	41%	0.407	53%	0.527	S	S	.	.	H	α-helix	trans	-64.7	-43.4	173.1	-88.6	-167.6	-23	0	0	112.4	F129 L130 R135 K136 L137	F129-Q133 VanDerWaalsContact CE1-CD 3.48Å; F129-Q133 HydrophobicContact CE1-CG 4.08Å; F129-Q133 HydrophobicContact CZ-CG 4.17Å; F129-Q133 PolarHBondContact O-N 3.45Å; L130-Q133 PolarHBondContact O-N 3.45Å; Q133-R135 VanDerWaalsContact C-N 3.32Å; Q133-R135 PolarHBondContact O-N 3.06Å; Q133-K136 CarbonylContact O-C 3.57Å; Q133-K136 WeakPolarHBondContact O-CB 3.28Å; Q133-K136 PolarHBondContact O-N 2.96Å; Q133-K136 VanDerWaalsContact O-N 3.12Å; Q133-L137 WeakPolarHBondContact O-CB 3.2Å; Q133-L137 PolarHBondContact O-N 3.34Å
134	N	93	Very high	91.5	Very high	105 Å²	105	105.2 Å²	105.2	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-62.2	-40.3	176.6	-85.5	-18.9	0	0	0	111.4	L130 E131 L137 A138	L130-N134 VanDerWaalsContact O-CB 3.3Å; L130-N134 WeakPolarHBondContact O-CB 3.41Å; L130-N134 PolarHBondContact O-N 3.3Å; E131-N134 PolarHBondContact O-N 3.33Å; N134-L137 PolarHBondContact O-N 2.91Å; N134-A138 VanDerWaalsContact O-CB 3.24Å; N134-A138 WeakPolarHBondContact O-CB 3.13Å; N134-A138 PolarHBondContact O-N 3.19Å
135	R	94.6	Very high	91.5	Very high	172 Å²	172	109.5 Å²	109.5	65%	0.649	53%	0.534	S	S	*	.	H	α-helix	trans	-60.6	-43.9	171.4	-81.4	-176.4	176.5	111.6	-2	111.8	E131 A132 Q133 A138 N139	E131-R135 WeakPolarHBondContact O-CB 3.44Å; E131-R135 WeakPolarHBondContact O-CG 3.26Å; E131-R135 PolarHBondContact O-N 2.82Å; A132-R135 PolarHBondContact O-N 3.39Å; Q133-R135 VanDerWaalsContact C-N 3.32Å; Q133-R135 PolarHBondContact O-N 3.06Å; R135-A138 PolarHBondContact O-N 2.96Å; R135-N139 WeakPolarHBondContact O-CB 3.37Å; R135-N139 PolarHBondContact O-N 3.46Å; R135-N139 PolarHBondContact O-ND2 2.87Å; R135-N139 PolarHBondContact O-OD1 2.95Å
136	K	95.1	Very high	91.5	Very high	128 Å²	128	106.2 Å²	106.2	56%	0.557	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-47.5	177.2	-172.5	-177.2	177	-66.8	0	111.7	A132 Q133 A138 N139 D140	A132-K136 PolarHBondContact O-N 2.97Å; Q133-K136 CarbonylContact O-C 3.57Å; Q133-K136 WeakPolarHBondContact O-CB 3.28Å; Q133-K136 PolarHBondContact O-N 2.96Å; Q133-K136 VanDerWaalsContact O-N 3.12Å; K136-A138 VanDerWaalsContact C-N 3.34Å; K136-A138 PolarHBondContact O-N 3.49Å; K136-N139 PolarHBondContact O-N 3.29Å; K136-D140 IonicContact NZ-OD2 2.82Å; K136-D140 PolarHBondContact NZ-OD2 3.34Å; K136-D140 WeakPolarHBondContact O-CB 3.37Å; K136-D140 VanDerWaalsContact O-CG 3.25Å; K136-D140 PolarHBondContact O-N 2.9Å
137	L	92.6	Very high	91.2	Very high	95 Å²	95	107.7 Å²	107.7	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-40	177.9	-81.1	158.1	0	0	0	112	Q133 N134 D140 L141	Q133-L137 WeakPolarHBondContact O-CB 3.2Å; Q133-L137 PolarHBondContact O-N 3.34Å; N134-L137 PolarHBondContact O-N 2.91Å; L137-D140 PolarHBondContact O-N 2.88Å; L137-L141 WeakPolarHBondContact O-CB 3.49Å; L137-L141 WeakPolarHBondContact O-CG 3.46Å; L137-L141 PolarHBondContact O-N 3.47Å
138	A	93.6	Very high	90.7	Very high	52 Å²	52	114.2 Å²	114.2	43%	0.43	54%	0.544	S	S	.	.	H	α-helix	trans	-62.4	-45.7	174.1	0	0	0	0	0	111.4	N134 R135 K136 L141 E142	N134-A138 VanDerWaalsContact O-CB 3.24Å; N134-A138 WeakPolarHBondContact O-CB 3.13Å; N134-A138 PolarHBondContact O-N 3.19Å; R135-A138 PolarHBondContact O-N 2.96Å; K136-A138 VanDerWaalsContact C-N 3.34Å; K136-A138 PolarHBondContact O-N 3.49Å; A138-L141 PolarHBondContact O-N 2.82Å; A138-E142 WeakPolarHBondContact O-CB 3.46Å; A138-E142 PolarHBondContact O-N 2.79Å
139	N	93.5	Very high	90.4	Very high	111 Å²	111	107.5 Å²	107.5	59%	0.594	53%	0.53	S	S	*	.	H	α-helix	trans	-63.3	-41.4	176	-68.5	-11.5	0	0	0	112.3	R135 K136 E142 A143	R135-N139 WeakPolarHBondContact O-CB 3.37Å; R135-N139 PolarHBondContact O-N 3.46Å; R135-N139 PolarHBondContact O-ND2 2.87Å; R135-N139 PolarHBondContact O-OD1 2.95Å; K136-N139 PolarHBondContact O-N 3.29Å; N139-E142 PolarHBondContact O-N 2.92Å; N139-A143 WeakPolarHBondContact O-CB 3.15Å; N139-A143 PolarHBondContact O-N 2.94Å
140	D	93.2	Very high	90	Very high	70 Å²	70	107.6 Å²	107.6	37%	0.374	53%	0.53	S	S	.	.	H	α-helix	trans	-65.1	-39.2	177.4	-70.2	-19	0	0	0	110.8	K136 L137 A143 L144	K136-D140 IonicContact NZ-OD2 2.82Å; K136-D140 PolarHBondContact NZ-OD2 3.34Å; K136-D140 WeakPolarHBondContact O-CB 3.37Å; K136-D140 VanDerWaalsContact O-CG 3.25Å; K136-D140 PolarHBondContact O-N 2.9Å; L137-D140 PolarHBondContact O-N 2.88Å; D140-A143 PolarHBondContact O-N 3.49Å; D140-L144 WeakPolarHBondContact O-CB 3.33Å; D140-L144 WeakPolarHBondContact O-CG 3.21Å; D140-L144 PolarHBondContact O-N 2.88Å
141	L	91.1	Very high	89.5	Confident	101 Å²	101	108.7 Å²	108.7	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-67.8	-42.3	174.5	-79.7	173.3	0	0	0	112.9	L137 A138 A143 L144 R145	L137-L141 WeakPolarHBondContact O-CB 3.49Å; L137-L141 WeakPolarHBondContact O-CG 3.46Å; L137-L141 PolarHBondContact O-N 3.47Å; A138-L141 PolarHBondContact O-N 2.82Å; L141-A143 VanDerWaalsContact C-N 3.32Å; L141-L144 PolarHBondContact O-N 3.32Å; L141-R145 WeakPolarHBondContact O-CB 3.28Å; L141-R145 WeakPolarHBondContact O-CG 3.46Å; L141-R145 PolarHBondContact O-N 2.92Å
142	E	91.7	Very high	89.3	Confident	148 Å²	148	108 Å²	108	69%	0.692	54%	0.539	S	S	*	.	H	α-helix	trans	-59.2	-45	174.3	-172.5	97.1	-145.3	0	0	110.2	A138 N139 R145 S146	A138-E142 WeakPolarHBondContact O-CB 3.46Å; A138-E142 PolarHBondContact O-N 2.79Å; N139-E142 PolarHBondContact O-N 2.92Å; E142-R145 PolarHBondContact O-N 2.87Å; E142-S146 VanDerWaalsContact O-CB 3.28Å; E142-S146 WeakPolarHBondContact O-CB 3.42Å; E142-S146 PolarHBondContact O-N 3.41Å
143	A	89.2	Confident	89.1	Confident	48 Å²	48	108.8 Å²	108.8	40%	0.397	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-43.1	177.2	0	0	0	0	0	112.3	N139 D140 L141 S146 R147	N139-A143 WeakPolarHBondContact O-CB 3.15Å; N139-A143 PolarHBondContact O-N 2.94Å; D140-A143 PolarHBondContact O-N 3.49Å; L141-A143 VanDerWaalsContact C-N 3.32Å; A143-S146 PolarHBondContact O-N 3.42Å; A143-R147 WeakPolarHBondContact O-CG 3.41Å; A143-R147 PolarHBondContact O-N 3.21Å; A143-R147 VanDerWaalsContact O-N 3.11Å
144	L	86.1	Confident	88.8	Confident	113 Å²	113	107.7 Å²	107.7	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-64.9	-46.4	175.7	-78.3	169.2	0	0	0	111.7	D140 L141 S146 R147 W148	D140-L144 WeakPolarHBondContact O-CB 3.33Å; D140-L144 WeakPolarHBondContact O-CG 3.21Å; D140-L144 PolarHBondContact O-N 2.88Å; L141-L144 PolarHBondContact O-N 3.32Å; L144-S146 VanDerWaalsContact C-N 3.31Å; L144-S146 PolarHBondContact O-N 2.82Å; L144-R147 CarbonylContact O-C 3.6Å; L144-R147 PolarHBondContact O-N 3.48Å; L144-R147 VanDerWaalsContact O-N 3.13Å; L144-W148 WeakPolarHBondContact O-CB 3.47Å; L144-W148 PolarHBondContact O-N 3.46Å
145	R	86.4	Confident	88.6	Confident	193 Å²	193	106.3 Å²	106.3	73%	0.728	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-39	176.7	-76.3	-174.6	177.7	-130.5	1.1	112.2	L141 E142 R147 W148	L141-R145 WeakPolarHBondContact O-CB 3.28Å; L141-R145 WeakPolarHBondContact O-CG 3.46Å; L141-R145 PolarHBondContact O-N 2.92Å; E142-R145 PolarHBondContact O-N 2.87Å; R145-R147 VanDerWaalsContact C-N 3.28Å; R145-R147 PolarHBondContact O-N 2.95Å; R145-W148 PolarHBondContact O-N 2.96Å
146	S	85.3	Confident	88.6	Confident	61 Å²	61	104.4 Å²	104.4	43%	0.427	53%	0.534	S	S	.	.	H	α-helix	trans	-65.8	-30.8	176	-173.9	0	0	0	0	112.3	E142 A143 L144 K150	E142-S146 VanDerWaalsContact O-CB 3.28Å; E142-S146 WeakPolarHBondContact O-CB 3.42Å; E142-S146 PolarHBondContact O-N 3.41Å; A143-S146 PolarHBondContact O-N 3.42Å; L144-S146 VanDerWaalsContact C-N 3.31Å; L144-S146 PolarHBondContact O-N 2.82Å; S146-K150 WeakPolarHBondContact O-CD 3.38Å; S146-K150 WeakPolarHBondContact O-CE 3.43Å; S146-K150 PolarHBondContact O-NZ 3.43Å; S146-K150 PolarHBondContact OG-NZ 2.94Å
147	R	84.5	Confident	88.5	Confident	166 Å²	166	105 Å²	105	63%	0.626	54%	0.539	S	S	*	.	H	α-helix	trans	-87.6	-28.4	176.9	-69.7	175.1	-178	-122.2	2.6	113.3	A143 L144 R145 G149 K150 D151	A143-R147 WeakPolarHBondContact O-CG 3.41Å; A143-R147 PolarHBondContact O-N 3.21Å; A143-R147 VanDerWaalsContact O-N 3.11Å; L144-R147 CarbonylContact O-C 3.6Å; L144-R147 PolarHBondContact O-N 3.48Å; L144-R147 VanDerWaalsContact O-N 3.13Å; R145-R147 VanDerWaalsContact C-N 3.28Å; R145-R147 PolarHBondContact O-N 2.95Å; R147-G149 PolarHBondContact O-N 3.4Å; R147-K150 WeakPolarHBondContact O-CB 3.37Å; R147-K150 PolarHBondContact O-N 3.41Å; R147-D151 PolarHBondContact O-N 2.91Å
148	W	81.9	Confident	88.5	Confident	214 Å²	214	106 Å²	106	81%	0.811	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	122.4	-177.3	-164.6	-5.4	0	0	0	110.2	L144 R145 K150	L144-W148 WeakPolarHBondContact O-CB 3.47Å; L144-W148 PolarHBondContact O-N 3.46Å; R145-W148 PolarHBondContact O-N 2.96Å; W148-K150 VanDerWaalsContact C-N 3.25Å; W148-K150 PolarHBondContact O-N 2.85Å
149	G	81.7	Confident	88.5	Confident	36 Å²	36	111.2 Å²	111.2	37%	0.371	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	88.6	-27.5	-179.6	0	0	0	0	0	113.4	R147 T152 S153	R147-G149 PolarHBondContact O-N 3.4Å; G149-T152 PolarHBondContact O-N 3.3Å; G149-S153 WeakPolarHBondContact O-CB 3.47Å; G149-S153 PolarHBondContact O-N 3.38Å
150	K	85.3	Confident	88.6	Confident	125 Å²	125	112.3 Å²	112.3	54%	0.543	55%	0.554	S	S	.	*	H	α-helix	trans	-65.3	-44.1	173.4	-65.9	-171.7	-173.7	152.5	0	111.3	S146 R147 W148 S153 S154	S146-K150 WeakPolarHBondContact O-CD 3.38Å; S146-K150 WeakPolarHBondContact O-CE 3.43Å; S146-K150 PolarHBondContact O-NZ 3.43Å; S146-K150 PolarHBondContact OG-NZ 2.94Å; R147-K150 WeakPolarHBondContact O-CB 3.37Å; R147-K150 PolarHBondContact O-N 3.41Å; W148-K150 VanDerWaalsContact C-N 3.25Å; W148-K150 PolarHBondContact O-N 2.85Å; K150-S153 PolarHBondContact O-N 3.45Å; K150-S154 VanDerWaalsContact O-CB 3.28Å; K150-S154 WeakPolarHBondContact O-CB 3.42Å; K150-S154 PolarHBondContact O-N 3.49Å
151	D	82.7	Confident	88.7	Confident	103 Å²	103	110.8 Å²	110.8	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-64.7	-42.8	177.8	-65.1	-15.8	0	0	0	111.1	R147 S154 V155	R147-D151 PolarHBondContact O-N 2.91Å; D151-S154 PolarHBondContact O-N 2.95Å; D151-V155 VanDerWaalsContact O-CG2 3.32Å; D151-V155 WeakPolarHBondContact O-CG2 3.48Å; D151-V155 PolarHBondContact O-N 3.43Å
152	T	87.7	Confident	88.9	Confident	84 Å²	84	111.2 Å²	111.2	52%	0.515	55%	0.554	S	S	.	*	H	α-helix	trans	-65.8	-40.4	176.4	-48.7	0	0	0	0	112.2	G149 K156	G149-T152 PolarHBondContact O-N 3.3Å; T152-K156 WeakPolarHBondContact O-CB 3.27Å; T152-K156 WeakPolarHBondContact O-CG 3.28Å; T152-K156 PolarHBondContact O-N 3.22Å
153	S	88.7	Confident	89	Confident	72 Å²	72	109 Å²	109	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-64.3	-44.4	175.5	-172	0	0	0	0	111	G149 K150 V155 K156 Q157	G149-S153 WeakPolarHBondContact O-CB 3.47Å; G149-S153 PolarHBondContact O-N 3.38Å; K150-S153 PolarHBondContact O-N 3.45Å; S153-V155 PolarHBondContact O-N 2.92Å; S153-K156 PolarHBondContact O-N 2.9Å; S153-Q157 WeakPolarHBondContact O-CB 3.49Å; S153-Q157 PolarHBondContact O-N 2.92Å
154	S	87.6	Confident	89.3	Confident	64 Å²	64	109.5 Å²	109.5	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-59.7	-47.6	176.3	177	0	0	0	0	111.4	K150 D151 K156 Q157 M158	K150-S154 VanDerWaalsContact O-CB 3.28Å; K150-S154 WeakPolarHBondContact O-CB 3.42Å; K150-S154 PolarHBondContact O-N 3.49Å; D151-S154 PolarHBondContact O-N 2.95Å; S154-K156 PolarHBondContact O-N 3.37Å; S154-Q157 PolarHBondContact O-N 2.9Å; S154-M158 VanDerWaalsContact O-CG 3.23Å; S154-M158 WeakPolarHBondContact O-CG 3.17Å; S154-M158 PolarHBondContact O-N 3.08Å
155	V	89.1	Confident	89.8	Confident	77 Å²	77	110.1 Å²	110.1	47%	0.467	55%	0.551	S	S	.	*	H	α-helix	trans	-63.7	-41.8	178	171.6	0	0	0	0	112.1	D151 S153 M158 Y159	D151-V155 VanDerWaalsContact O-CG2 3.32Å; D151-V155 WeakPolarHBondContact O-CG2 3.48Å; D151-V155 PolarHBondContact O-N 3.43Å; S153-V155 PolarHBondContact O-N 2.92Å; V155-M158 PolarHBondContact O-N 3.35Å; V155-Y159 HydrophobicContact CG1-CD2 3.62Å; V155-Y159 HydrophobicContact CG1-CE2 3.41Å; V155-Y159 VanDerWaalsContact CG1-CE2 3.41Å; V155-Y159 VanDerWaalsContact O-CD2 3.27Å; V155-Y159 WeakPolarHBondContact O-CD2 3.26Å; V155-Y159 PolarHBondContact O-N 2.84Å
156	K	92.9	Very high	90.3	Very high	131 Å²	131	103.2 Å²	103.2	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-61.4	-46.3	174.9	-77.1	-177.6	178	-172.2	0	111.8	T152 S153 S154 M158 Y159 E160	T152-K156 WeakPolarHBondContact O-CB 3.27Å; T152-K156 WeakPolarHBondContact O-CG 3.28Å; T152-K156 PolarHBondContact O-N 3.22Å; S153-K156 PolarHBondContact O-N 2.9Å; S154-K156 PolarHBondContact O-N 3.37Å; K156-M158 VanDerWaalsContact C-N 3.29Å; K156-M158 PolarHBondContact O-N 3.49Å; K156-Y159 PolarHBondContact O-N 2.72Å; K156-E160 WeakPolarHBondContact O-CB 3.5Å; K156-E160 WeakPolarHBondContact O-CG 3.34Å; K156-E160 PolarHBondContact O-N 3.43Å
157	Q	93.9	Very high	90.8	Very high	140 Å²	140	108.6 Å²	108.6	65%	0.654	55%	0.546	S	S	*	.	H	α-helix	trans	-62.1	-38.2	178.7	-168.9	171.1	30.9	0	0	111.8	S153 S154 G161	S153-Q157 WeakPolarHBondContact O-CB 3.49Å; S153-Q157 PolarHBondContact O-N 2.92Å; S154-Q157 PolarHBondContact O-N 2.9Å; Q157-G161 PolarHBondContact O-N 3.43Å
158	M	93	Very high	91.3	Very high	118 Å²	118	107.1 Å²	107.1	58%	0.581	54%	0.544	S	S	*	.	H	α-helix	trans	-62	-52.2	172.3	-68.9	-68	-63.5	0	0	111	S154 V155 K156 E160 G161 E162	S154-M158 VanDerWaalsContact O-CG 3.23Å; S154-M158 WeakPolarHBondContact O-CG 3.17Å; S154-M158 PolarHBondContact O-N 3.08Å; V155-M158 PolarHBondContact O-N 3.35Å; K156-M158 VanDerWaalsContact C-N 3.29Å; K156-M158 PolarHBondContact O-N 3.49Å; M158-E160 PolarHBondContact O-N 2.99Å; M158-G161 PolarHBondContact O-N 2.89Å; M158-E162 WeakPolarHBondContact O-CG 3.26Å; M158-E162 PolarHBondContact O-N 2.84Å
159	Y	92.5	Very high	92.1	Very high	160 Å²	160	102.4 Å²	102.4	63%	0.627	53%	0.534	S	S	*	.	H	α-helix	trans	-64.7	-37.1	179.9	-77.4	-55.6	0	0	0	113.7	V155 K156 G161 E162 L163	V155-Y159 HydrophobicContact CG1-CD2 3.62Å; V155-Y159 HydrophobicContact CG1-CE2 3.41Å; V155-Y159 VanDerWaalsContact CG1-CE2 3.41Å; V155-Y159 VanDerWaalsContact O-CD2 3.27Å; V155-Y159 WeakPolarHBondContact O-CD2 3.26Å; V155-Y159 PolarHBondContact O-N 2.84Å; K156-Y159 PolarHBondContact O-N 2.72Å; Y159-G161 VanDerWaalsContact C-N 3.32Å; Y159-E162 PolarHBondContact O-N 3.46Å; Y159-L163 WeakPolarHBondContact O-CB 3.47Å; Y159-L163 WeakPolarHBondContact O-CG 3.43Å; Y159-L163 PolarHBondContact O-N 2.84Å
160	E	95.6	Very high	92.8	Very high	134 Å²	134	106.1 Å²	106.1	63%	0.626	54%	0.544	S	S	*	.	H	α-helix	trans	-64	-39.6	173.5	-76.2	175.1	-177.2	0	0	111.2	K156 M158 A164	K156-E160 WeakPolarHBondContact O-CB 3.5Å; K156-E160 WeakPolarHBondContact O-CG 3.34Å; K156-E160 PolarHBondContact O-N 3.43Å; M158-E160 PolarHBondContact O-N 2.99Å; E160-A164 VanDerWaalsContact O-CB 3.3Å; E160-A164 WeakPolarHBondContact O-CB 3.41Å; E160-A164 PolarHBondContact O-N 3.45Å
161	G	94.9	Very high	93.4	Very high	38 Å²	38	104.6 Å²	104.6	39%	0.392	54%	0.542	S	S	.	.	H	α-helix	trans	-60.8	-50.7	172.8	0	0	0	0	0	112.4	Q157 M158 Y159 L163 A164 E165	Q157-G161 PolarHBondContact O-N 3.43Å; M158-G161 PolarHBondContact O-N 2.89Å; Y159-G161 VanDerWaalsContact C-N 3.32Å; G161-L163 PolarHBondContact O-N 2.72Å; G161-A164 WeakPolarHBondContact O-CB 3.4Å; G161-A164 PolarHBondContact O-N 3.25Å; G161-E165 WeakPolarHBondContact O-CB 3.34Å; G161-E165 PolarHBondContact O-N 2.92Å
162	E	95.4	Very high	94	Very high	110 Å²	110	103 Å²	103	51%	0.514	53%	0.534	S	S	.	.	H	α-helix	trans	-63.1	-39.5	178.6	-65.1	-66.7	147.6	0	0	112.1	M158 Y159 E165 A166	M158-E162 WeakPolarHBondContact O-CG 3.26Å; M158-E162 PolarHBondContact O-N 2.84Å; Y159-E162 PolarHBondContact O-N 3.46Å; E162-E165 PolarHBondContact O-N 3.47Å; E162-A166 VanDerWaalsContact O-CB 3.32Å; E162-A166 WeakPolarHBondContact O-CB 3.34Å; E162-A166 PolarHBondContact O-N 3.39Å
163	L	95.3	Very high	94.4	Very high	102 Å²	102	103 Å²	103	53%	0.534	53%	0.534	S	S	.	.	H	α-helix	trans	-66.4	-39.4	175.1	-80.2	168.1	0	0	0	111.9	Y159 G161 R167	Y159-L163 WeakPolarHBondContact O-CB 3.47Å; Y159-L163 WeakPolarHBondContact O-CG 3.43Å; Y159-L163 PolarHBondContact O-N 2.84Å; G161-L163 PolarHBondContact O-N 2.72Å; L163-R167 WeakPolarHBondContact O-CB 3.47Å; L163-R167 VanDerWaalsContact O-CG 3.26Å; L163-R167 WeakPolarHBondContact O-CG 3.44Å; L163-R167 PolarHBondContact O-N 2.86Å
164	A	95.8	Very high	94.7	Very high	59 Å²	59	102.2 Å²	102.2	49%	0.488	53%	0.531	S	S	.	.	H	α-helix	trans	-65.1	-41.5	174.8	0	0	0	0	0	111.1	E160 G161 R167 K168	E160-A164 VanDerWaalsContact O-CB 3.3Å; E160-A164 WeakPolarHBondContact O-CB 3.41Å; E160-A164 PolarHBondContact O-N 3.45Å; G161-A164 WeakPolarHBondContact O-CB 3.4Å; G161-A164 PolarHBondContact O-N 3.25Å; A164-R167 PolarHBondContact O-N 3.47Å; A164-K168 WeakPolarHBondContact O-CB 3.08Å; A164-K168 PolarHBondContact O-N 2.92Å
165	E	95.7	Very high	95.2	Very high	126 Å²	126	105.8 Å²	105.8	59%	0.589	54%	0.539	S	S	*	.	H	α-helix	trans	-66.3	-42.8	176.5	-172.4	165	-166.8	0	0	112.1	G161 E162 R167 K168 L169	G161-E165 WeakPolarHBondContact O-CB 3.34Å; G161-E165 PolarHBondContact O-N 2.92Å; E162-E165 PolarHBondContact O-N 3.47Å; E165-R167 PolarHBondContact O-N 3.29Å; E165-K168 PolarHBondContact O-N 2.89Å; E165-L169 WeakPolarHBondContact O-CB 3.5Å; E165-L169 PolarHBondContact O-N 3.48Å
166	A	96	Very high	95.5	Very high	48 Å²	48	105.6 Å²	105.6	40%	0.397	54%	0.54	S	S	.	.	H	α-helix	trans	-62.7	-41.7	175.2	0	0	0	0	0	112.3	E162 L169 I170	E162-A166 VanDerWaalsContact O-CB 3.32Å; E162-A166 WeakPolarHBondContact O-CB 3.34Å; E162-A166 PolarHBondContact O-N 3.39Å; A166-L169 PolarHBondContact O-N 3.09Å; A166-I170 WeakPolarHBondContact O-CG1 3.29Å; A166-I170 PolarHBondContact O-N 3.1Å
167	R	95.8	Very high	95.7	Very high	174 Å²	174	105.3 Å²	105.3	66%	0.657	54%	0.539	S	S	*	.	H	α-helix	trans	-63.4	-45.5	174.8	-75.6	174.4	-176.5	-168.8	2	111.4	L163 A164 E165 L169 I170 D171	L163-R167 WeakPolarHBondContact O-CB 3.47Å; L163-R167 VanDerWaalsContact O-CG 3.26Å; L163-R167 WeakPolarHBondContact O-CG 3.44Å; L163-R167 PolarHBondContact O-N 2.86Å; A164-R167 PolarHBondContact O-N 3.47Å; E165-R167 PolarHBondContact O-N 3.29Å; R167-L169 VanDerWaalsContact C-N 3.31Å; R167-L169 PolarHBondContact O-N 3.32Å; R167-I170 PolarHBondContact O-N 3.47Å; R167-D171 PolarHBondContact O-N 3.37Å
168	K	96.6	Very high	95.8	Very high	134 Å²	134	101.2 Å²	101.2	58%	0.583	53%	0.529	S	S	*	.	H	α-helix	trans	-58.7	-44.2	175.5	-175.8	-173.9	173.2	-168.8	0	111.3	A164 E165 I170 D171 D172	A164-K168 WeakPolarHBondContact O-CB 3.08Å; A164-K168 PolarHBondContact O-N 2.92Å; E165-K168 PolarHBondContact O-N 2.89Å; K168-I170 PolarHBondContact O-N 3.43Å; K168-D171 PolarHBondContact O-N 2.96Å; K168-D172 WeakPolarHBondContact O-CB 3.22Å; K168-D172 VanDerWaalsContact O-CG 3.27Å; K168-D172 PolarHBondContact O-N 2.73Å
169	L	97.2	Very high	96	Very high	116 Å²	116	97.3 Å²	97.3	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-62.7	-40.6	177.6	-174.7	66.8	0	0	0	112.1	E165 A166 R167 T173	E165-L169 WeakPolarHBondContact O-CB 3.5Å; E165-L169 PolarHBondContact O-N 3.48Å; A166-L169 PolarHBondContact O-N 3.09Å; R167-L169 VanDerWaalsContact C-N 3.31Å; R167-L169 PolarHBondContact O-N 3.32Å; L169-T173 VanDerWaalsContact O-CB 3.26Å; L169-T173 WeakPolarHBondContact O-CB 3.33Å; L169-T173 PolarHBondContact O-N 3.4Å; L169-T173 PolarHBondContact O-OG1 3.31Å
170	I	97.3	Very high	96.1	Very high	113 Å²	113	94.2 Å²	94.2	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-62.2	-47.7	174.2	-71	166.5	0	0	0	110.4	A166 R167 K168 D172 T173 A174	A166-I170 WeakPolarHBondContact O-CG1 3.29Å; A166-I170 PolarHBondContact O-N 3.1Å; R167-I170 PolarHBondContact O-N 3.47Å; K168-I170 PolarHBondContact O-N 3.43Å; I170-D172 PolarHBondContact O-N 3Å; I170-T173 PolarHBondContact O-N 3.31Å; I170-A174 VanDerWaalsContact O-CB 3.32Å; I170-A174 WeakPolarHBondContact O-CB 3.43Å; I170-A174 PolarHBondContact O-N 2.88Å
171	D	96.6	Very high	96.2	Very high	94 Å²	94	92.8 Å²	92.8	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-42.7	-179.9	-71.6	-17.8	0	0	0	111.7	R167 K168 A174 K175	R167-D171 PolarHBondContact O-N 3.37Å; K168-D171 PolarHBondContact O-N 2.96Å; D171-A174 PolarHBondContact O-N 2.82Å; D171-K175 VanDerWaalsContact O-CG 3.29Å; D171-K175 WeakPolarHBondContact O-CG 3.5Å; D171-K175 PolarHBondContact O-N 2.96Å
172	D	96.8	Very high	96.3	Very high	70 Å²	70	93.5 Å²	93.5	37%	0.374	51%	0.506	S	S	.	.	H	α-helix	trans	-68.4	-39.4	178.4	-70	-18.1	0	0	0	111.3	K168 I170 K175 S176	K168-D172 WeakPolarHBondContact O-CB 3.22Å; K168-D172 VanDerWaalsContact O-CG 3.27Å; K168-D172 PolarHBondContact O-N 2.73Å; I170-D172 PolarHBondContact O-N 3Å; D172-K175 PolarHBondContact O-N 3.2Å; D172-K175 IonicContact OD1-NZ 3.55Å; D172-S176 WeakPolarHBondContact O-CB 3.27Å; D172-S176 PolarHBondContact O-N 3.46Å
173	T	95.4	Very high	96.4	Very high	84 Å²	84	92.2 Å²	92.2	52%	0.515	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-40.4	174.6	-55.5	0	0	0	0	111.4	L169 I170 S176 K177	L169-T173 VanDerWaalsContact O-CB 3.26Å; L169-T173 WeakPolarHBondContact O-CB 3.33Å; L169-T173 PolarHBondContact O-N 3.4Å; L169-T173 PolarHBondContact O-OG1 3.31Å; I170-T173 PolarHBondContact O-N 3.31Å; T173-S176 PolarHBondContact O-N 2.88Å; T173-K177 WeakPolarHBondContact O-CB 3.39Å; T173-K177 PolarHBondContact O-N 3.45Å
174	A	96.1	Very high	96.4	Very high	54 Å²	54	91.7 Å²	91.7	45%	0.446	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-41.6	177.1	0	0	0	0	0	111.9	I170 D171 K177 A178	I170-A174 VanDerWaalsContact O-CB 3.32Å; I170-A174 WeakPolarHBondContact O-CB 3.43Å; I170-A174 PolarHBondContact O-N 2.88Å; D171-A174 PolarHBondContact O-N 2.82Å; A174-K177 PolarHBondContact O-N 3.47Å; A174-A178 WeakPolarHBondContact O-CB 3.15Å; A174-A178 PolarHBondContact O-N 2.71Å
175	K	96.7	Very high	96.5	Very high	140 Å²	140	91.9 Å²	91.9	61%	0.609	49%	0.494	S	S	*	.	H	α-helix	trans	-61.5	-45.3	172.8	-72.4	169.2	-167.5	162.1	0	111.8	D171 D172 A178 G179	D171-K175 VanDerWaalsContact O-CG 3.29Å; D171-K175 WeakPolarHBondContact O-CG 3.5Å; D171-K175 PolarHBondContact O-N 2.96Å; D172-K175 PolarHBondContact O-N 3.2Å; D172-K175 IonicContact OD1-NZ 3.55Å; K175-A178 PolarHBondContact O-N 2.91Å; K175-G179 PolarHBondContact O-N 3.28Å
176	S	96.4	Very high	96.6	Very high	72 Å²	72	92.6 Å²	92.6	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-46.7	177.7	179.4	0	0	0	0	111.5	D172 T173 A178 G179 L180	D172-S176 WeakPolarHBondContact O-CB 3.27Å; D172-S176 PolarHBondContact O-N 3.46Å; T173-S176 PolarHBondContact O-N 2.88Å; S176-A178 PolarHBondContact O-N 2.92Å; S176-G179 PolarHBondContact O-N 3.17Å; S176-L180 WeakPolarHBondContact O-CG 3.33Å; S176-L180 PolarHBondContact O-N 3.48Å
177	K	95.9	Very high	96.6	Very high	125 Å²	125	94.2 Å²	94.2	54%	0.543	49%	0.493	S	S	.	.	H	α-helix	trans	-57.2	-49.3	174.9	178	-178.5	169.1	-178.3	0	111.9	T173 A174 G179 L180 E181	T173-K177 WeakPolarHBondContact O-CB 3.39Å; T173-K177 PolarHBondContact O-N 3.45Å; A174-K177 PolarHBondContact O-N 3.47Å; K177-G179 VanDerWaalsContact C-N 3.28Å; K177-G179 PolarHBondContact O-N 3.36Å; K177-L180 PolarHBondContact O-N 2.95Å; K177-E181 WeakPolarHBondContact CE-OE1 3.38Å; K177-E181 HydrophobicContact CG-CG 4.44Å; K177-E181 IonicContact NZ-OE1 3.61Å; K177-E181 WeakPolarHBondContact O-CG 3.23Å; K177-E181 PolarHBondContact O-N 3.36Å
178	A	96.3	Very high	96.7	Very high	54 Å²	54	91.8 Å²	91.8	45%	0.446	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-36.8	178.2	0	0	0	0	0	112.1	A174 K175 S176 S182	A174-A178 WeakPolarHBondContact O-CB 3.15Å; A174-A178 PolarHBondContact O-N 2.71Å; K175-A178 PolarHBondContact O-N 2.91Å; S176-A178 PolarHBondContact O-N 2.92Å; A178-S182 WeakPolarHBondContact O-CB 3.48Å; A178-S182 PolarHBondContact O-N 2.94Å
179	G	96.8	Very high	96.7	Very high	36 Å²	36	89.2 Å²	89.2	37%	0.371	49%	0.485	S	S	.	.	H	α-helix	trans	-62.2	-47.1	173.4	0	0	0	0	0	112.6	K175 S176 K177 S182 Q183	K175-G179 PolarHBondContact O-N 3.28Å; S176-G179 PolarHBondContact O-N 3.17Å; K177-G179 VanDerWaalsContact C-N 3.28Å; K177-G179 PolarHBondContact O-N 3.36Å; G179-S182 WeakPolarHBondContact O-CB 3.45Å; G179-S182 PolarHBondContact O-N 2.92Å; G179-Q183 PolarHBondContact O-N 3.01Å
180	L	95.9	Very high	96.7	Very high	96 Å²	96	88.1 Å²	88.1	50%	0.503	48%	0.477	S	S	.	.	H	α-helix	trans	-65.3	-41.9	177	-71.1	172.4	0	0	0	112.1	S176 K177 S182 Q183 I184	S176-L180 WeakPolarHBondContact O-CG 3.33Å; S176-L180 PolarHBondContact O-N 3.48Å; K177-L180 PolarHBondContact O-N 2.95Å; L180-S182 VanDerWaalsContact C-N 3.34Å; L180-S182 PolarHBondContact O-N 3.18Å; L180-Q183 PolarHBondContact O-N 2.73Å; L180-I184 WeakPolarHBondContact O-CB 3.38Å; L180-I184 VanDerWaalsContact O-CG1 3.27Å; L180-I184 WeakPolarHBondContact O-CG1 3.3Å; L180-I184 PolarHBondContact O-N 2.98Å
181	E	98	Very high	96.6	Very high	103 Å²	103	87.5 Å²	87.5	48%	0.481	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-41.7	175.6	-74.4	174.6	167.5	0	0	111.6	K177 Q183 I184 S185	K177-E181 WeakPolarHBondContact CE-OE1 3.38Å; K177-E181 HydrophobicContact CG-CG 4.44Å; K177-E181 IonicContact NZ-OE1 3.61Å; K177-E181 WeakPolarHBondContact O-CG 3.23Å; K177-E181 PolarHBondContact O-N 3.36Å; E181-Q183 VanDerWaalsContact C-N 3.34Å; E181-Q183 PolarHBondContact O-N 3.33Å; E181-I184 PolarHBondContact O-N 3.22Å; E181-S185 WeakPolarHBondContact O-CB 3.43Å; E181-S185 PolarHBondContact O-N 2.98Å
182	S	96.2	Very high	96.7	Very high	54 Å²	54	85.7 Å²	85.7	38%	0.378	47%	0.472	S	S	.	.	H	α-helix	trans	-61.9	-40.2	172.9	173.5	0	0	0	0	112.3	A178 G179 L180 R186	A178-S182 WeakPolarHBondContact O-CB 3.48Å; A178-S182 PolarHBondContact O-N 2.94Å; G179-S182 WeakPolarHBondContact O-CB 3.45Å; G179-S182 PolarHBondContact O-N 2.92Å; L180-S182 VanDerWaalsContact C-N 3.34Å; L180-S182 PolarHBondContact O-N 3.18Å; S182-R186 WeakPolarHBondContact O-CB 3.23Å; S182-R186 WeakPolarHBondContact O-CG 3.5Å; S182-R186 PolarHBondContact O-N 2.79Å; S182-R186 PolarHBondContact O-NE 2.92Å; S182-R186 PolarHBondContact OG-NE 3.23Å; S182-R186 PolarHBondContact OG-NH2 3.37Å; S182-R186 VanDerWaalsContact OG-NH2 3.12Å
183	Q	96.9	Very high	96.6	Very high	82 Å²	82	86.7 Å²	86.7	38%	0.383	48%	0.477	S	S	.	.	H	α-helix	trans	-70.1	-42.9	178.2	-173	176.7	-5.8	0	0	111.6	G179 L180 E181 S185 R186 L187	G179-Q183 PolarHBondContact O-N 3.01Å; L180-Q183 PolarHBondContact O-N 2.73Å; E181-Q183 VanDerWaalsContact C-N 3.34Å; E181-Q183 PolarHBondContact O-N 3.33Å; Q183-S185 VanDerWaalsContact C-N 3.34Å; Q183-S185 PolarHBondContact O-N 3.41Å; Q183-R186 PolarHBondContact O-N 3.18Å; Q183-L187 HydrophobicContact CG-CD1 4.07Å; Q183-L187 HydrophobicContact CG-CG 4.42Å; Q183-L187 WeakPolarHBondContact O-CB 3.27Å; Q183-L187 WeakPolarHBondContact O-CG 3.26Å; Q183-L187 PolarHBondContact O-N 3.33Å
184	I	96.7	Very high	96.6	Very high	91 Å²	91	88.9 Å²	88.9	47%	0.467	48%	0.48	S	S	.	.	H	α-helix	trans	-59.2	-46.8	174.8	-70.8	165.7	0	0	0	110	L180 E181 R186 L187 Q188	L180-I184 WeakPolarHBondContact O-CB 3.38Å; L180-I184 VanDerWaalsContact O-CG1 3.27Å; L180-I184 WeakPolarHBondContact O-CG1 3.3Å; L180-I184 PolarHBondContact O-N 2.98Å; E181-I184 PolarHBondContact O-N 3.22Å; I184-R186 VanDerWaalsContact C-N 3.33Å; I184-R186 PolarHBondContact O-N 2.94Å; I184-L187 PolarHBondContact O-N 3Å; I184-Q188 HydrophobicContact CG2-CG 4.34Å; I184-Q188 WeakPolarHBondContact O-CB 3.45Å; I184-Q188 VanDerWaalsContact O-CG 3.24Å; I184-Q188 WeakPolarHBondContact O-CG 3.3Å; I184-Q188 PolarHBondContact O-N 2.99Å
185	S	97.5	Very high	96.6	Very high	64 Å²	64	94.5 Å²	94.5	45%	0.448	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-40.5	178	-174.6	0	0	0	0	112.1	E181 Q183 Q188 T189	E181-S185 WeakPolarHBondContact O-CB 3.43Å; E181-S185 PolarHBondContact O-N 2.98Å; Q183-S185 VanDerWaalsContact C-N 3.34Å; Q183-S185 PolarHBondContact O-N 3.41Å; S185-Q188 PolarHBondContact O-N 2.9Å; S185-T189 PolarHBondContact O-N 3.41Å; S185-T189 VanDerWaalsContact O-N 3.07Å; S185-T189 PolarHBondContact O-OG1 2.9Å
186	R	96.8	Very high	96.7	Very high	141 Å²	141	93.6 Å²	93.6	53%	0.532	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-48.1	175.4	-80.4	-178.1	-85.4	165.5	-7.8	112.1	S182 Q183 I184 Q188 T189 E190	S182-R186 WeakPolarHBondContact O-CB 3.23Å; S182-R186 WeakPolarHBondContact O-CG 3.5Å; S182-R186 PolarHBondContact O-N 2.79Å; S182-R186 PolarHBondContact O-NE 2.92Å; S182-R186 PolarHBondContact OG-NE 3.23Å; S182-R186 PolarHBondContact OG-NH2 3.37Å; S182-R186 VanDerWaalsContact OG-NH2 3.12Å; Q183-R186 PolarHBondContact O-N 3.18Å; I184-R186 VanDerWaalsContact C-N 3.33Å; I184-R186 PolarHBondContact O-N 2.94Å; R186-Q188 VanDerWaalsContact C-N 3.29Å; R186-Q188 PolarHBondContact O-N 3.2Å; R186-T189 WeakPolarHBondContact CA-OG1 3.28Å; R186-T189 PolarHBondContact O-N 3Å; R186-T189 PolarHBondContact O-OG1 2.85Å; R186-E190 WeakPolarHBondContact O-CG 3.4Å; R186-E190 PolarHBondContact O-N 2.89Å
187	L	96.9	Very high	96.7	Very high	82 Å²	82	96 Å²	96	43%	0.429	49%	0.487	S	S	.	.	H	α-helix	trans	-62.9	-35.8	177.2	-71.3	173.1	0	0	0	111.9	Q183 I184 E190 L191	Q183-L187 HydrophobicContact CG-CD1 4.07Å; Q183-L187 HydrophobicContact CG-CG 4.42Å; Q183-L187 WeakPolarHBondContact O-CB 3.27Å; Q183-L187 WeakPolarHBondContact O-CG 3.26Å; Q183-L187 PolarHBondContact O-N 3.33Å; I184-L187 PolarHBondContact O-N 3Å; L187-E190 PolarHBondContact O-N 3.4Å; L187-L191 WeakPolarHBondContact O-CB 3.28Å; L187-L191 VanDerWaalsContact O-CG 3.28Å; L187-L191 WeakPolarHBondContact O-CG 3.39Å; L187-L191 PolarHBondContact O-N 2.94Å
188	Q	98.1	Very high	96.7	Very high	123 Å²	123	98 Å²	98	58%	0.575	49%	0.492	S	S	*	.	H	α-helix	trans	-64.5	-42.9	174.1	-77.6	174.8	-16.7	0	0	112.1	I184 S185 R186 L191 A192	I184-Q188 HydrophobicContact CG2-CG 4.34Å; I184-Q188 WeakPolarHBondContact O-CB 3.45Å; I184-Q188 VanDerWaalsContact O-CG 3.24Å; I184-Q188 WeakPolarHBondContact O-CG 3.3Å; I184-Q188 PolarHBondContact O-N 2.99Å; S185-Q188 PolarHBondContact O-N 2.9Å; R186-Q188 VanDerWaalsContact C-N 3.29Å; R186-Q188 PolarHBondContact O-N 3.2Å; Q188-L191 PolarHBondContact O-N 3.39Å; Q188-A192 WeakPolarHBondContact O-CB 3.41Å; Q188-A192 PolarHBondContact O-N 3.41Å
189	T	96.9	Very high	96.7	Very high	79 Å²	79	100.9 Å²	100.9	49%	0.485	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-42.3	174.9	48.1	0	0	0	0	111.9	S185 R186 L191 A192 D193	S185-T189 PolarHBondContact O-N 3.41Å; S185-T189 VanDerWaalsContact O-N 3.07Å; S185-T189 PolarHBondContact O-OG1 2.9Å; R186-T189 WeakPolarHBondContact CA-OG1 3.28Å; R186-T189 PolarHBondContact O-N 3Å; R186-T189 PolarHBondContact O-OG1 2.85Å; T189-L191 PolarHBondContact O-N 3.31Å; T189-A192 PolarHBondContact O-N 3.3Å; T189-D193 PolarHBondContact O-N 3.32Å
190	E	96.9	Very high	96.7	Very high	94 Å²	94	103.4 Å²	103.4	44%	0.439	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-43.2	176.9	-72.6	172.6	-165.2	0	0	111.7	R186 L187 A192 D193 F194	R186-E190 WeakPolarHBondContact O-CG 3.4Å; R186-E190 PolarHBondContact O-N 2.89Å; L187-E190 PolarHBondContact O-N 3.4Å; E190-A192 VanDerWaalsContact C-N 3.33Å; E190-A192 PolarHBondContact O-N 2.92Å; E190-D193 PolarHBondContact O-N 3Å; E190-F194 HydrophobicContact CB-CD2 4.48Å; E190-F194 HydrophobicContact CB-CE2 4.35Å; E190-F194 WeakPolarHBondContact O-CD2 3.45Å; E190-F194 PolarHBondContact O-N 3.45Å
191	L	95.9	Very high	96.6	Very high	100 Å²	100	101.7 Å²	101.7	52%	0.524	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-39.1	175.1	-77.5	174.9	0	0	0	112.3	L187 Q188 T189 R195	L187-L191 WeakPolarHBondContact O-CB 3.28Å; L187-L191 VanDerWaalsContact O-CG 3.28Å; L187-L191 WeakPolarHBondContact O-CG 3.39Å; L187-L191 PolarHBondContact O-N 2.94Å; Q188-L191 PolarHBondContact O-N 3.39Å; T189-L191 PolarHBondContact O-N 3.31Å; L191-R195 WeakPolarHBondContact O-CB 3.27Å; L191-R195 VanDerWaalsContact O-CG 3.24Å; L191-R195 WeakPolarHBondContact O-CG 3.39Å; L191-R195 PolarHBondContact O-N 3.04Å
192	A	96.9	Very high	96.6	Very high	55 Å²	55	99.8 Å²	99.8	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-64.4	-42.5	175.4	0	0	0	0	0	111.5	Q188 T189 E190 R195 K196	Q188-A192 WeakPolarHBondContact O-CB 3.41Å; Q188-A192 PolarHBondContact O-N 3.41Å; T189-A192 PolarHBondContact O-N 3.3Å; E190-A192 VanDerWaalsContact C-N 3.33Å; E190-A192 PolarHBondContact O-N 2.92Å; A192-R195 PolarHBondContact O-N 3.46Å; A192-K196 PolarHBondContact O-N 2.87Å
193	D	96.7	Very high	96.6	Very high	92 Å²	92	104.1 Å²	104.1	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-41.9	176.7	-74.6	-18	0	0	0	112.3	T189 E190 K196 K197	T189-D193 PolarHBondContact O-N 3.32Å; E190-D193 PolarHBondContact O-N 3Å; D193-K196 PolarHBondContact O-N 3.46Å; D193-K197 WeakPolarHBondContact O-CB 3.17Å; D193-K197 VanDerWaalsContact O-CG 3.28Å; D193-K197 WeakPolarHBondContact O-CG 3.35Å; D193-K197 PolarHBondContact O-N 2.94Å
194	F	94.8	Very high	96.6	Very high	129 Å²	129	105.8 Å²	105.8	57%	0.566	51%	0.509	S	S	*	.	H	α-helix	trans	-65	-40.1	175.1	-76.1	-56.3	0	0	0	112.2	E190 K197 Y198	E190-F194 HydrophobicContact CB-CD2 4.48Å; E190-F194 HydrophobicContact CB-CE2 4.35Å; E190-F194 WeakPolarHBondContact O-CD2 3.45Å; E190-F194 PolarHBondContact O-N 3.45Å; F194-K197 PolarHBondContact O-N 3.42Å; F194-Y198 WeakPolarHBondContact O-CB 3.32Å; F194-Y198 PolarHBondContact O-N 2.85Å
195	R	96.4	Very high	96.5	Very high	172 Å²	172	107.7 Å²	107.7	65%	0.649	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-47.7	173.7	-77.6	174.4	179.2	-169.8	0	111.4	L191 A192 K197 Y198 E199	L191-R195 WeakPolarHBondContact O-CB 3.27Å; L191-R195 VanDerWaalsContact O-CG 3.24Å; L191-R195 WeakPolarHBondContact O-CG 3.39Å; L191-R195 PolarHBondContact O-N 3.04Å; A192-R195 PolarHBondContact O-N 3.46Å; R195-K197 PolarHBondContact O-N 2.64Å; R195-Y198 WeakPolarHBondContact O-CB 2.98Å; R195-Y198 PolarHBondContact O-N 2.95Å; R195-E199 WeakPolarHBondContact O-CG 3.35Å; R195-E199 PolarHBondContact O-N 2.9Å
196	K	97.6	Very high	96.4	Very high	121 Å²	121	110.1 Å²	110.1	53%	0.526	52%	0.515	S	S	.	.	H	α-helix	trans	-59.1	-46.2	176.6	-179	178	174.9	-176.4	0	112.1	A192 D193 Y198 E199 E200	A192-K196 PolarHBondContact O-N 2.87Å; D193-K196 PolarHBondContact O-N 3.46Å; K196-Y198 VanDerWaalsContact C-N 3.31Å; K196-Y198 PolarHBondContact O-N 2.97Å; K196-E199 PolarHBondContact O-N 3.21Å; K196-E200 WeakPolarHBondContact CE-OE1 3.29Å; K196-E200 WeakPolarHBondContact O-CG 3.37Å; K196-E200 PolarHBondContact O-N 3.19Å
197	K	97.3	Very high	96.4	Very high	124 Å²	124	104.9 Å²	104.9	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-38.8	176.4	-73.1	170.4	-175.8	170.8	0	112.1	D193 F194 R195 A201	D193-K197 WeakPolarHBondContact O-CB 3.17Å; D193-K197 VanDerWaalsContact O-CG 3.28Å; D193-K197 WeakPolarHBondContact O-CG 3.35Å; D193-K197 PolarHBondContact O-N 2.94Å; F194-K197 PolarHBondContact O-N 3.42Å; R195-K197 PolarHBondContact O-N 2.64Å; K197-A201 WeakPolarHBondContact O-CB 3.38Å; K197-A201 PolarHBondContact O-N 2.86Å
198	Y	94.8	Very high	96.3	Very high	166 Å²	166	104.8 Å²	104.8	65%	0.651	51%	0.505	S	S	*	.	H	α-helix	trans	-65.7	-46.2	176.1	-178.7	-96.1	0	0	0	111.5	F194 R195 K196 E200 A201 V202	F194-Y198 WeakPolarHBondContact O-CB 3.32Å; F194-Y198 PolarHBondContact O-N 2.85Å; R195-Y198 WeakPolarHBondContact O-CB 2.98Å; R195-Y198 PolarHBondContact O-N 2.95Å; K196-Y198 VanDerWaalsContact C-N 3.31Å; K196-Y198 PolarHBondContact O-N 2.97Å; Y198-E200 VanDerWaalsContact C-N 3.33Å; Y198-E200 PolarHBondContact O-N 3.44Å; Y198-A201 PolarHBondContact O-N 3.41Å; Y198-V202 HydrophobicContact CD1-CG2 4.13Å; Y198-V202 HydrophobicContact CE1-CG2 3.73Å; Y198-V202 HydrophobicContact CE2-CG2 4.43Å; Y198-V202 WeakPolarHBondContact O-CG2 3.27Å; Y198-V202 PolarHBondContact O-N 3.42Å
199	E	96.2	Very high	96.3	Very high	114 Å²	114	106.3 Å²	106.3	53%	0.533	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-39.6	175.9	-72.4	172.8	-166	0	0	112.4	R195 K196 V202 R203	R195-E199 WeakPolarHBondContact O-CG 3.35Å; R195-E199 PolarHBondContact O-N 2.9Å; K196-E199 PolarHBondContact O-N 3.21Å; E199-V202 PolarHBondContact O-N 3.34Å; E199-R203 WeakPolarHBondContact O-CB 3.41Å; E199-R203 PolarHBondContact O-N 3.18Å
200	E	96.5	Very high	96.2	Very high	90 Å²	90	108.8 Å²	108.8	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-63.7	-43.9	173.2	-75.1	168.2	-173.7	0	0	112.5	K196 Y198 V202 R203 Q204	K196-E200 WeakPolarHBondContact CE-OE1 3.29Å; K196-E200 WeakPolarHBondContact O-CG 3.37Å; K196-E200 PolarHBondContact O-N 3.19Å; Y198-E200 VanDerWaalsContact C-N 3.33Å; Y198-E200 PolarHBondContact O-N 3.44Å; E200-V202 PolarHBondContact O-N 2.89Å; E200-R203 PolarHBondContact O-N 3Å; E200-Q204 PolarHBondContact O-N 3.03Å
201	A	95.6	Very high	96.3	Very high	59 Å²	59	107.7 Å²	107.7	49%	0.488	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-39	176.5	0	0	0	0	0	112.4	K197 Y198 Q204 R205	K197-A201 WeakPolarHBondContact O-CB 3.38Å; K197-A201 PolarHBondContact O-N 2.86Å; Y198-A201 PolarHBondContact O-N 3.41Å; A201-Q204 PolarHBondContact O-N 3.42Å; A201-R205 WeakPolarHBondContact O-CB 3.32Å; A201-R205 PolarHBondContact O-N 3.26Å
202	V	96.5	Very high	96.3	Very high	63 Å²	63	107.6 Å²	107.6	38%	0.382	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-47.2	175	170.6	0	0	0	0	110.7	Y198 E199 E200 Q204 R205 E206	Y198-V202 HydrophobicContact CD1-CG2 4.13Å; Y198-V202 HydrophobicContact CE1-CG2 3.73Å; Y198-V202 HydrophobicContact CE2-CG2 4.43Å; Y198-V202 WeakPolarHBondContact O-CG2 3.27Å; Y198-V202 PolarHBondContact O-N 3.42Å; E199-V202 PolarHBondContact O-N 3.34Å; E200-V202 PolarHBondContact O-N 2.89Å; V202-Q204 VanDerWaalsContact C-N 3.32Å; V202-Q204 PolarHBondContact O-N 2.97Å; V202-R205 PolarHBondContact O-N 2.94Å; V202-E206 PolarHBondContact O-N 2.9Å
203	R	97	Very high	96.3	Very high	146 Å²	146	108.6 Å²	108.6	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-60.4	-40.8	177.4	-170.1	-175.4	-53.8	98.6	8.4	112.3	E199 E200 E206 G207	E199-R203 WeakPolarHBondContact O-CB 3.41Å; E199-R203 PolarHBondContact O-N 3.18Å; E200-R203 PolarHBondContact O-N 3Å; R203-E206 PolarHBondContact O-N 2.67Å; R203-G207 PolarHBondContact O-N 3.32Å
204	Q	96.4	Very high	96.3	Very high	117 Å²	117	105.6 Å²	105.6	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-44.7	176	-174.8	60.7	40.4	0	0	111.4	E200 A201 V202 E206 G207 D208	E200-Q204 PolarHBondContact O-N 3.03Å; A201-Q204 PolarHBondContact O-N 3.42Å; V202-Q204 VanDerWaalsContact C-N 3.32Å; V202-Q204 PolarHBondContact O-N 2.97Å; Q204-E206 VanDerWaalsContact C-N 3.26Å; Q204-E206 PolarHBondContact O-N 3.44Å; Q204-G207 PolarHBondContact O-N 3.5Å; Q204-D208 PolarHBondContact NE2-OD1 3.48Å; Q204-D208 WeakPolarHBondContact O-CB 3.46Å; Q204-D208 VanDerWaalsContact O-CG 3.27Å; Q204-D208 PolarHBondContact O-N 3.28Å
205	R	94.7	Very high	96.3	Very high	130 Å²	130	103.9 Å²	103.9	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-60.2	-37.8	176.8	-178	-175	177.8	-121.8	4.2	111.9	A201 V202 R209	A201-R205 WeakPolarHBondContact O-CB 3.32Å; A201-R205 PolarHBondContact O-N 3.26Å; V202-R205 PolarHBondContact O-N 2.94Å; R205-R209 VanDerWaalsContact O-CB 3.32Å; R205-R209 WeakPolarHBondContact O-CB 3.3Å; R205-R209 PolarHBondContact O-N 2.81Å
206	E	95.9	Very high	96.4	Very high	115 Å²	115	100.5 Å²	100.5	54%	0.537	49%	0.493	S	S	.	.	H	α-helix	trans	-67.4	-45.9	176.7	-168.4	160.8	-152.2	0	0	111.4	V202 R203 Q204 D208 R209 E210	V202-E206 PolarHBondContact O-N 2.9Å; R203-E206 PolarHBondContact O-N 2.67Å; Q204-E206 VanDerWaalsContact C-N 3.26Å; Q204-E206 PolarHBondContact O-N 3.44Å; E206-D208 PolarHBondContact O-N 3.14Å; E206-R209 WeakPolarHBondContact O-CB 3.39Å; E206-R209 PolarHBondContact O-N 3.45Å; E206-R209 VanDerWaalsContact O-N 3.15Å; E206-E210 WeakPolarHBondContact O-CG 3.33Å; E206-E210 PolarHBondContact O-N 2.86Å
207	G	96.2	Very high	96.4	Very high	32 Å²	32	98.5 Å²	98.5	33%	0.33	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-39.4	173.8	0	0	0	0	0	113.7	R203 Q204 R209 E210 S211	R203-G207 PolarHBondContact O-N 3.32Å; Q204-G207 PolarHBondContact O-N 3.5Å; G207-R209 VanDerWaalsContact C-N 3.33Å; G207-E210 PolarHBondContact O-N 2.92Å; G207-S211 WeakPolarHBondContact O-CB 3.29Å; G207-S211 PolarHBondContact O-N 3.01Å
208	D	95.3	Very high	96.4	Very high	80 Å²	80	97.2 Å²	97.2	43%	0.428	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-39	174	-68.7	-17.1	0	0	0	111.1	Q204 E206 S211 I212	Q204-D208 PolarHBondContact NE2-OD1 3.48Å; Q204-D208 WeakPolarHBondContact O-CB 3.46Å; Q204-D208 VanDerWaalsContact O-CG 3.27Å; Q204-D208 PolarHBondContact O-N 3.28Å; E206-D208 PolarHBondContact O-N 3.14Å; D208-S211 WeakPolarHBondContact O-CB 3.45Å; D208-S211 PolarHBondContact O-N 3.46Å; D208-I212 VanDerWaalsContact O-CG1 3.26Å; D208-I212 WeakPolarHBondContact O-CG1 3.4Å; D208-I212 PolarHBondContact O-N 3.13Å
209	R	96.9	Very high	96.4	Very high	155 Å²	155	93.9 Å²	93.9	59%	0.585	48%	0.48	S	S	*	.	H	α-helix	trans	-63.7	-47.2	176.3	-178	-178.8	177.2	130.2	2.7	111.5	R205 E206 G207 S211 I212 D213	R205-R209 VanDerWaalsContact O-CB 3.32Å; R205-R209 WeakPolarHBondContact O-CB 3.3Å; R205-R209 PolarHBondContact O-N 2.81Å; E206-R209 WeakPolarHBondContact O-CB 3.39Å; E206-R209 PolarHBondContact O-N 3.45Å; E206-R209 VanDerWaalsContact O-N 3.15Å; G207-R209 VanDerWaalsContact C-N 3.33Å; R209-S211 VanDerWaalsContact C-N 3.29Å; R209-S211 PolarHBondContact O-N 2.95Å; R209-I212 PolarHBondContact O-N 3.37Å; R209-D213 PolarHBondContact O-N 3.45Å
210	E	96.8	Very high	96.4	Very high	130 Å²	130	92.1 Å²	92.1	61%	0.607	48%	0.479	S	S	*	.	H	α-helix	trans	-60.1	-39.9	175.6	-70.3	176.5	172.7	0	0	111.9	E206 G207 D213 G214	E206-E210 WeakPolarHBondContact O-CG 3.33Å; E206-E210 PolarHBondContact O-N 2.86Å; G207-E210 PolarHBondContact O-N 2.92Å; E210-D213 PolarHBondContact O-N 3.47Å; E210-G214 PolarHBondContact O-N 2.98Å
211	S	97	Very high	96.4	Very high	71 Å²	71	93.6 Å²	93.6	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-43.8	175.2	-175	0	0	0	0	112	G207 D208 R209 G214 L215	G207-S211 WeakPolarHBondContact O-CB 3.29Å; G207-S211 PolarHBondContact O-N 3.01Å; D208-S211 WeakPolarHBondContact O-CB 3.45Å; D208-S211 PolarHBondContact O-N 3.46Å; R209-S211 VanDerWaalsContact C-N 3.29Å; R209-S211 PolarHBondContact O-N 2.95Å; S211-G214 PolarHBondContact O-N 3.18Å; S211-L215 WeakPolarHBondContact O-CB 3.39Å; S211-L215 WeakPolarHBondContact O-CG 3.47Å; S211-L215 PolarHBondContact O-N 2.98Å
212	I	96.1	Very high	96.5	Very high	98 Å²	98	96.6 Å²	96.6	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-46.9	174.7	-70.8	165.3	0	0	0	110.7	D208 R209 G214 L215 L216	D208-I212 VanDerWaalsContact O-CG1 3.26Å; D208-I212 WeakPolarHBondContact O-CG1 3.4Å; D208-I212 PolarHBondContact O-N 3.13Å; R209-I212 PolarHBondContact O-N 3.37Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 3.06Å; I212-L215 PolarHBondContact O-N 3.48Å; I212-L216 HydrophobicContact CG2-CD1 4.02Å; I212-L216 HydrophobicContact CG2-CG 4.35Å; I212-L216 WeakPolarHBondContact O-CG 3.46Å; I212-L216 PolarHBondContact O-N 3.17Å
213	D	96.7	Very high	96.5	Very high	76 Å²	76	99.6 Å²	99.6	41%	0.406	50%	0.499	S	S	.	.	H	α-helix	trans	-62.5	-38.8	179.2	-70.3	-18.4	0	0	0	111.3	R209 E210 L216 T217	R209-D213 PolarHBondContact O-N 3.45Å; E210-D213 PolarHBondContact O-N 3.47Å; D213-L216 PolarHBondContact O-N 3.43Å; D213-T217 PolarHBondContact O-N 3.22Å; D213-T217 PolarHBondContact O-OG1 2.91Å
214	G	97	Very high	96.4	Very high	30 Å²	30	95.6 Å²	95.6	31%	0.309	50%	0.496	S	S	.	.	H	α-helix	trans	-63.9	-43.5	172.6	0	0	0	0	0	113.1	E210 S211 I212 T217 Q218	E210-G214 PolarHBondContact O-N 2.98Å; S211-G214 PolarHBondContact O-N 3.18Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 3.06Å; G214-T217 PolarHBondContact O-N 3.33Å; G214-Q218 WeakPolarHBondContact O-CG 3.48Å; G214-Q218 PolarHBondContact O-N 3.4Å
215	L	96.5	Very high	96.5	Very high	92 Å²	92	95.2 Å²	95.2	48%	0.482	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-38.2	175.9	-74.5	171.3	0	0	0	112.3	S211 I212 T217 Q218 L219	S211-L215 WeakPolarHBondContact O-CB 3.39Å; S211-L215 WeakPolarHBondContact O-CG 3.47Å; S211-L215 PolarHBondContact O-N 2.98Å; I212-L215 PolarHBondContact O-N 3.48Å; L215-T217 VanDerWaalsContact C-N 3.34Å; L215-Q218 PolarHBondContact O-N 3.17Å; L215-L219 WeakPolarHBondContact O-CB 3.25Å; L215-L219 VanDerWaalsContact O-CG 3.31Å; L215-L219 WeakPolarHBondContact O-CG 3.43Å; L215-L219 PolarHBondContact O-N 2.87Å
216	L	96.6	Very high	96.4	Very high	102 Å²	102	90.6 Å²	90.6	53%	0.534	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-40.6	175	-73	173.2	0	0	0	111.5	I212 D213 L219 S220	I212-L216 HydrophobicContact CG2-CD1 4.02Å; I212-L216 HydrophobicContact CG2-CG 4.35Å; I212-L216 WeakPolarHBondContact O-CG 3.46Å; I212-L216 PolarHBondContact O-N 3.17Å; D213-L216 PolarHBondContact O-N 3.43Å; L216-L219 PolarHBondContact O-N 2.93Å; L216-S220 PolarHBondContact O-N 3.36Å
217	T	97.5	Very high	96.4	Very high	79 Å²	79	88.8 Å²	88.8	49%	0.485	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-48.4	175.1	-55.6	0	0	0	0	110.9	D213 G214 L215 L219 S220 E221	D213-T217 PolarHBondContact O-N 3.22Å; D213-T217 PolarHBondContact O-OG1 2.91Å; G214-T217 PolarHBondContact O-N 3.33Å; L215-T217 VanDerWaalsContact C-N 3.34Å; T217-L219 PolarHBondContact O-N 2.93Å; T217-S220 WeakPolarHBondContact O-CB 3.37Å; T217-S220 PolarHBondContact O-N 3.38Å; T217-E221 WeakPolarHBondContact O-CG 3.27Å; T217-E221 PolarHBondContact O-N 2.91Å
218	Q	97.6	Very high	96.4	Very high	96 Å²	96	92.7 Å²	92.7	45%	0.449	49%	0.491	S	S	.	.	H	α-helix	trans	-61	-41.6	176.7	-71.1	173.6	33.3	0	0	112.5	G214 L215 S220 E221 F222	G214-Q218 WeakPolarHBondContact O-CG 3.48Å; G214-Q218 PolarHBondContact O-N 3.4Å; L215-Q218 PolarHBondContact O-N 3.17Å; Q218-S220 VanDerWaalsContact C-N 3.33Å; Q218-S220 PolarHBondContact O-N 3.43Å; Q218-E221 PolarHBondContact O-N 3.14Å; Q218-F222 HydrophobicContact CB-CE2 4.26Å; Q218-F222 WeakPolarHBondContact O-CD2 3.39Å; Q218-F222 WeakPolarHBondContact O-CG 3.39Å; Q218-F222 PolarHBondContact O-N 3.32Å
219	L	95.1	Very high	96.4	Very high	97 Å²	97	92.7 Å²	92.7	51%	0.508	49%	0.491	S	S	.	.	H	α-helix	trans	-61	-43.2	175.3	-77.1	170.9	0	0	0	111.3	L215 L216 T217 E221 F222 E223	L215-L219 WeakPolarHBondContact O-CB 3.25Å; L215-L219 VanDerWaalsContact O-CG 3.31Å; L215-L219 WeakPolarHBondContact O-CG 3.43Å; L215-L219 PolarHBondContact O-N 2.87Å; L216-L219 PolarHBondContact O-N 2.93Å; T217-L219 PolarHBondContact O-N 2.93Å; L219-E221 VanDerWaalsContact C-N 3.34Å; L219-E221 PolarHBondContact O-N 3.02Å; L219-F222 PolarHBondContact O-N 2.95Å; L219-E223 WeakPolarHBondContact O-CB 3.46Å; L219-E223 VanDerWaalsContact O-CG 3.3Å; L219-E223 WeakPolarHBondContact O-CG 3.26Å; L219-E223 PolarHBondContact O-N 3.24Å
220	S	96.6	Very high	96.4	Very high	76 Å²	76	93 Å²	93	53%	0.531	49%	0.492	S	S	.	.	H	α-helix	trans	-61.9	-41.3	176.2	-171.3	0	0	0	0	112.2	L216 T217 Q218 E223 A224	L216-S220 PolarHBondContact O-N 3.36Å; T217-S220 WeakPolarHBondContact O-CB 3.37Å; T217-S220 PolarHBondContact O-N 3.38Å; Q218-S220 VanDerWaalsContact C-N 3.33Å; Q218-S220 PolarHBondContact O-N 3.43Å; S220-E223 PolarHBondContact O-N 3.49Å; S220-A224 WeakPolarHBondContact O-CB 3.47Å; S220-A224 PolarHBondContact O-N 2.97Å
221	E	96.9	Very high	96.3	Very high	122 Å²	122	95.9 Å²	95.9	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-62.8	-47.9	175.1	-70.9	174	-176.4	0	0	111.9	T217 Q218 L219 E223 A224 E225	T217-E221 WeakPolarHBondContact O-CG 3.27Å; T217-E221 PolarHBondContact O-N 2.91Å; Q218-E221 PolarHBondContact O-N 3.14Å; L219-E221 VanDerWaalsContact C-N 3.34Å; L219-E221 PolarHBondContact O-N 3.02Å; E221-E223 PolarHBondContact O-N 3.16Å; E221-A224 PolarHBondContact O-N 3.37Å; E221-E225 WeakPolarHBondContact O-CB 3.5Å; E221-E225 PolarHBondContact O-N 2.95Å
222	F	96.9	Very high	96.4	Very high	122 Å²	122	100.7 Å²	100.7	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-37.5	177.6	-70.3	-48.3	0	0	0	112.7	Q218 L219 E225 A226	Q218-F222 HydrophobicContact CB-CE2 4.26Å; Q218-F222 WeakPolarHBondContact O-CD2 3.39Å; Q218-F222 WeakPolarHBondContact O-CG 3.39Å; Q218-F222 PolarHBondContact O-N 3.32Å; L219-F222 PolarHBondContact O-N 2.95Å; F222-E225 PolarHBondContact O-N 3.4Å; F222-A226 VanDerWaalsContact O-CB 3.25Å; F222-A226 WeakPolarHBondContact O-CB 3.38Å; F222-A226 PolarHBondContact O-N 3.4Å
223	E	96.1	Very high	96.2	Very high	126 Å²	126	100.9 Å²	100.9	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-64	-43.4	174.2	-77.2	-179.8	178.7	0	0	111.5	L219 S220 E221 A226 N227	L219-E223 WeakPolarHBondContact O-CB 3.46Å; L219-E223 VanDerWaalsContact O-CG 3.3Å; L219-E223 WeakPolarHBondContact O-CG 3.26Å; L219-E223 PolarHBondContact O-N 3.24Å; S220-E223 PolarHBondContact O-N 3.49Å; E221-E223 PolarHBondContact O-N 3.16Å; E223-A226 PolarHBondContact O-N 3.16Å; E223-N227 WeakPolarHBondContact O-CB 3.38Å; E223-N227 PolarHBondContact O-N 3.44Å; E223-N227 PolarHBondContact O-ND2 3.06Å
224	A	95.9	Very high	96.1	Very high	61 Å²	61	102.7 Å²	102.7	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-63.5	-44.5	175.8	0	0	0	0	0	111.8	S220 E221 N227 L228	S220-A224 WeakPolarHBondContact O-CB 3.47Å; S220-A224 PolarHBondContact O-N 2.97Å; E221-A224 PolarHBondContact O-N 3.37Å; A224-N227 PolarHBondContact O-N 2.91Å; A224-L228 WeakPolarHBondContact O-CB 3.22Å; A224-L228 PolarHBondContact O-N 2.87Å
225	E	97.4	Very high	96	Very high	109 Å²	109	103.1 Å²	103.1	51%	0.509	52%	0.517	S	S	.	.	H	α-helix	trans	-62.7	-46.7	176.6	-173.9	178.5	-173.7	0	0	111.6	E221 F222 N227 L228 L229	E221-E225 WeakPolarHBondContact O-CB 3.5Å; E221-E225 PolarHBondContact O-N 2.95Å; F222-E225 PolarHBondContact O-N 3.4Å; E225-N227 VanDerWaalsContact C-N 3.29Å; E225-N227 PolarHBondContact O-N 3.03Å; E225-L228 PolarHBondContact O-N 3.41Å; E225-L228 VanDerWaalsContact O-N 3.17Å; E225-L229 HydrophobicContact CG-CD1 4.1Å; E225-L229 HydrophobicContact CG-CG 4.4Å; E225-L229 WeakPolarHBondContact O-CB 3.38Å; E225-L229 WeakPolarHBondContact O-CG 3.48Å; E225-L229 PolarHBondContact O-N 3.24Å
226	A	92.9	Very high	96	Very high	34 Å²	34	103 Å²	103	28%	0.281	52%	0.516	S	S	.	.	H	α-helix	trans	-59.7	-40.6	177.3	0	0	0	0	0	111.7	F222 E223 R230	F222-A226 VanDerWaalsContact O-CB 3.25Å; F222-A226 WeakPolarHBondContact O-CB 3.38Å; F222-A226 PolarHBondContact O-N 3.4Å; E223-A226 PolarHBondContact O-N 3.16Å; A226-R230 WeakPolarHBondContact O-CB 3.42Å; A226-R230 VanDerWaalsContact O-CG 3.24Å; A226-R230 WeakPolarHBondContact O-CG 3.37Å; A226-R230 PolarHBondContact O-N 3.47Å
227	N	96.1	Very high	95.9	Very high	77 Å²	77	104.3 Å²	104.3	41%	0.412	52%	0.519	S	S	.	.	H	α-helix	trans	-67.5	-38.7	176.7	-72.8	-31	0	0	0	112.4	E223 A224 E225 R230 R231	E223-N227 WeakPolarHBondContact O-CB 3.38Å; E223-N227 PolarHBondContact O-N 3.44Å; E223-N227 PolarHBondContact O-ND2 3.06Å; A224-N227 PolarHBondContact O-N 2.91Å; E225-N227 VanDerWaalsContact C-N 3.29Å; E225-N227 PolarHBondContact O-N 3.03Å; N227-R230 PolarHBondContact OD1-NH1 2.96Å; N227-R231 WeakPolarHBondContact O-CG 3.5Å; N227-R231 PolarHBondContact O-N 2.9Å; N227-R231 VanDerWaalsContact O-N 3.12Å
228	L	95.8	Very high	95.9	Very high	113 Å²	113	105.4 Å²	105.4	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-44.8	175.1	-176.9	133.3	0	0	0	111.8	A224 E225 R231 R232	A224-L228 WeakPolarHBondContact O-CB 3.22Å; A224-L228 PolarHBondContact O-N 2.87Å; E225-L228 PolarHBondContact O-N 3.41Å; E225-L228 VanDerWaalsContact O-N 3.17Å; L228-R231 PolarHBondContact O-N 2.86Å; L228-R232 WeakPolarHBondContact O-CB 3.34Å; L228-R232 PolarHBondContact O-N 2.92Å
229	L	95.9	Very high	95.8	Very high	80 Å²	80	106.1 Å²	106.1	42%	0.419	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-41.3	176.5	-71.9	175.2	0	0	0	112	E225 R232 L233	E225-L229 HydrophobicContact CG-CD1 4.1Å; E225-L229 HydrophobicContact CG-CG 4.4Å; E225-L229 WeakPolarHBondContact O-CB 3.38Å; E225-L229 WeakPolarHBondContact O-CG 3.48Å; E225-L229 PolarHBondContact O-N 3.24Å; L229-R232 PolarHBondContact O-N 3.28Å; L229-L233 WeakPolarHBondContact O-CB 3.43Å; L229-L233 WeakPolarHBondContact O-CG 3.26Å; L229-L233 PolarHBondContact O-N 3.45Å
230	R	96.6	Very high	95.7	Very high	161 Å²	161	104.3 Å²	104.3	61%	0.608	52%	0.524	S	S	*	.	H	α-helix	trans	-59.5	-46	174.3	-76.7	173.5	-174.7	139	1.2	112.1	A226 N227 R232 L233 Q234	A226-R230 WeakPolarHBondContact O-CB 3.42Å; A226-R230 VanDerWaalsContact O-CG 3.24Å; A226-R230 WeakPolarHBondContact O-CG 3.37Å; A226-R230 PolarHBondContact O-N 3.47Å; N227-R230 PolarHBondContact OD1-NH1 2.96Å; R230-R232 VanDerWaalsContact C-N 3.34Å; R230-R232 PolarHBondContact O-N 3.49Å; R230-L233 PolarHBondContact O-N 3.25Å; R230-Q234 WeakPolarHBondContact O-CB 3.4Å; R230-Q234 PolarHBondContact O-N 2.94Å
231	R	96	Very high	95.7	Very high	191 Å²	191	102.8 Å²	102.8	72%	0.721	52%	0.516	S	S	*	.	H	α-helix	trans	-63.4	-39.6	176.3	-71.3	176.2	-174.4	173.3	3.4	112.1	N227 L228 Q234 G235	N227-R231 WeakPolarHBondContact O-CG 3.5Å; N227-R231 PolarHBondContact O-N 2.9Å; N227-R231 VanDerWaalsContact O-N 3.12Å; L228-R231 PolarHBondContact O-N 2.86Å; R231-Q234 PolarHBondContact O-N 2.96Å; R231-G235 PolarHBondContact O-N 3.49Å
232	R	97.1	Very high	95.6	Very high	172 Å²	172	105.6 Å²	105.6	65%	0.649	52%	0.522	S	S	*	.	H	α-helix	trans	-66.3	-43.2	176.8	-175.9	174.7	179.6	167.5	0.1	112	L228 L229 R230 G235 L236	L228-R232 WeakPolarHBondContact O-CB 3.34Å; L228-R232 PolarHBondContact O-N 2.92Å; L229-R232 PolarHBondContact O-N 3.28Å; R230-R232 VanDerWaalsContact C-N 3.34Å; R230-R232 PolarHBondContact O-N 3.49Å; R232-G235 PolarHBondContact O-N 2.87Å; R232-L236 HydrophobicContact CG-CD1 4.32Å; R232-L236 WeakPolarHBondContact O-CG 3.25Å; R232-L236 PolarHBondContact O-N 3.28Å
233	L	92.3	Very high	95.6	Very high	102 Å²	102	104.5 Å²	104.5	53%	0.534	52%	0.521	S	S	.	.	H	α-helix	trans	-60.2	-47.3	174.9	-80.1	170.3	0	0	0	110.9	L229 R230 G235 L236 E237	L229-L233 WeakPolarHBondContact O-CB 3.43Å; L229-L233 WeakPolarHBondContact O-CG 3.26Å; L229-L233 PolarHBondContact O-N 3.45Å; R230-L233 PolarHBondContact O-N 3.25Å; L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 3.45Å; L233-L236 PolarHBondContact O-N 3.48Å; L233-L236 VanDerWaalsContact O-N 3.16Å; L233-E237 WeakPolarHBondContact O-CG 3.34Å; L233-E237 PolarHBondContact O-N 3.35Å
234	Q	95.7	Very high	95.6	Very high	115 Å²	115	106 Å²	106	54%	0.537	53%	0.525	S	S	.	.	H	α-helix	trans	-57.3	-46	176.3	-175.3	-179.2	-0.4	0	0	111.9	R230 R231 L236 E237 D238	R230-Q234 WeakPolarHBondContact O-CB 3.4Å; R230-Q234 PolarHBondContact O-N 2.94Å; R231-Q234 PolarHBondContact O-N 2.96Å; Q234-L236 VanDerWaalsContact C-N 3.33Å; Q234-L236 PolarHBondContact O-N 2.85Å; Q234-E237 PolarHBondContact O-N 3.39Å; Q234-D238 PolarHBondContact O-N 2.95Å
235	G	94.4	Very high	95.7	Very high	39 Å²	39	110.7 Å²	110.7	40%	0.402	54%	0.535	S	S	.	.	H	α-helix	trans	-61.1	-39.4	177	0	0	0	0	0	113.4	R231 R232 L233 E239	R231-G235 PolarHBondContact O-N 3.49Å; R232-G235 PolarHBondContact O-N 2.87Å; L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 3.45Å; G235-E239 WeakPolarHBondContact O-CB 3.26Å; G235-E239 PolarHBondContact O-N 2.95Å
236	L	96	Very high	95.6	Very high	90 Å²	90	109.2 Å²	109.2	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-70.1	-36.2	175.8	-71.6	172.3	0	0	0	112.5	R232 L233 Q234 E239 A240	R232-L236 HydrophobicContact CG-CD1 4.32Å; R232-L236 WeakPolarHBondContact O-CG 3.25Å; R232-L236 PolarHBondContact O-N 3.28Å; L233-L236 PolarHBondContact O-N 3.48Å; L233-L236 VanDerWaalsContact O-N 3.16Å; Q234-L236 VanDerWaalsContact C-N 3.33Å; Q234-L236 PolarHBondContact O-N 2.85Å; L236-E239 PolarHBondContact O-N 3.38Å; L236-A240 VanDerWaalsContact O-CB 3.27Å; L236-A240 WeakPolarHBondContact O-CB 3.48Å; L236-A240 PolarHBondContact O-N 2.87Å
237	E	96	Very high	95.6	Very high	129 Å²	129	111.8 Å²	111.8	60%	0.603	54%	0.537	S	S	*	.	H	α-helix	trans	-64.8	-43.6	175.2	-74.5	174.6	166.5	0	0	111.4	L233 Q234 A240 A241	L233-E237 WeakPolarHBondContact O-CG 3.34Å; L233-E237 PolarHBondContact O-N 3.35Å; Q234-E237 PolarHBondContact O-N 3.39Å; E237-A240 PolarHBondContact O-N 3.29Å; E237-A241 WeakPolarHBondContact O-CB 3.42Å; E237-A241 PolarHBondContact O-N 3.01Å
238	D	96.2	Very high	95.6	Very high	102 Å²	102	112.3 Å²	112.3	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.5	-73.9	-28.2	0	0	0	111.7	Q234 A241 R242	Q234-D238 PolarHBondContact O-N 2.95Å; D238-A241 PolarHBondContact O-N 3.48Å; D238-R242 WeakPolarHBondContact O-CB 3.41Å; D238-R242 PolarHBondContact O-N 2.97Å
239	E	95.7	Very high	95.6	Very high	111 Å²	111	112.5 Å²	112.5	52%	0.519	54%	0.535	S	S	.	.	H	α-helix	trans	-64.9	-46.1	175.6	-174.8	173.3	-167	0	0	111.8	G235 L236 A241 R242 L243	G235-E239 WeakPolarHBondContact O-CB 3.26Å; G235-E239 PolarHBondContact O-N 2.95Å; L236-E239 PolarHBondContact O-N 3.38Å; E239-A241 VanDerWaalsContact C-N 3.31Å; E239-A241 PolarHBondContact O-N 2.86Å; E239-R242 WeakPolarHBondContact O-CB 3.34Å; E239-R242 PolarHBondContact O-N 3.44Å; E239-R242 VanDerWaalsContact O-N 3.17Å; E239-L243 HydrophobicContact CG-CD1 4.12Å; E239-L243 HydrophobicContact CG-CG 4.46Å; E239-L243 WeakPolarHBondContact O-CG 3.49Å; E239-L243 PolarHBondContact O-N 3.19Å
240	A	93.2	Very high	95.7	Very high	58 Å²	58	112.6 Å²	112.6	48%	0.479	54%	0.536	S	S	.	.	H	α-helix	trans	-60.7	-40.7	176.3	0	0	0	0	0	111.6	L236 E237 K244	L236-A240 VanDerWaalsContact O-CB 3.27Å; L236-A240 WeakPolarHBondContact O-CB 3.48Å; L236-A240 PolarHBondContact O-N 2.87Å; E237-A240 PolarHBondContact O-N 3.29Å; A240-K244 VanDerWaalsContact O-CB 3.26Å; A240-K244 WeakPolarHBondContact O-CB 3.43Å; A240-K244 PolarHBondContact O-N 3Å
241	A	96.1	Very high	95.7	Very high	44 Å²	44	110.5 Å²	110.5	36%	0.364	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-40.5	175.5	0	0	0	0	0	112.1	E237 D238 E239 K245	E237-A241 WeakPolarHBondContact O-CB 3.42Å; E237-A241 PolarHBondContact O-N 3.01Å; D238-A241 PolarHBondContact O-N 3.48Å; E239-A241 VanDerWaalsContact C-N 3.31Å; E239-A241 PolarHBondContact O-N 2.86Å; A241-K245 WeakPolarHBondContact O-CG 3.26Å; A241-K245 PolarHBondContact O-N 2.94Å; A241-K245 VanDerWaalsContact O-N 3.14Å
242	R	96.3	Very high	95.7	Very high	182 Å²	182	105.2 Å²	105.2	69%	0.687	53%	0.525	S	S	*	.	H	α-helix	trans	-64.2	-50.7	175.1	180	-177.1	168.2	-177.3	-3	111.6	D238 E239 K244 K245 E246	D238-R242 WeakPolarHBondContact O-CB 3.41Å; D238-R242 PolarHBondContact O-N 2.97Å; E239-R242 WeakPolarHBondContact O-CB 3.34Å; E239-R242 PolarHBondContact O-N 3.44Å; E239-R242 VanDerWaalsContact O-N 3.17Å; R242-K244 VanDerWaalsContact C-N 3.28Å; R242-K244 PolarHBondContact O-N 3.3Å; R242-K245 PolarHBondContact O-N 2.83Å; R242-E246 PolarHBondContact O-N 2.85Å
243	L	96.3	Very high	95.7	Very high	98 Å²	98	101.5 Å²	101.5	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-37.8	178.8	-72.3	174.1	0	0	0	111.6	E239 E246 N247	E239-L243 HydrophobicContact CG-CD1 4.12Å; E239-L243 HydrophobicContact CG-CG 4.46Å; E239-L243 WeakPolarHBondContact O-CG 3.49Å; E239-L243 PolarHBondContact O-N 3.19Å; L243-E246 PolarHBondContact O-N 3.39Å; L243-N247 WeakPolarHBondContact O-CB 3.43Å; L243-N247 PolarHBondContact O-N 3.23Å
244	K	96.6	Very high	95.9	Very high	157 Å²	157	100.9 Å²	100.9	68%	0.683	51%	0.512	S	S	*	.	H	α-helix	trans	-62.8	-44.4	175.1	-174	176.8	-178.2	177.8	0	112.4	A240 R242 E246 N247 V248	A240-K244 VanDerWaalsContact O-CB 3.26Å; A240-K244 WeakPolarHBondContact O-CB 3.43Å; A240-K244 PolarHBondContact O-N 3Å; R242-K244 VanDerWaalsContact C-N 3.28Å; R242-K244 PolarHBondContact O-N 3.3Å; K244-E246 VanDerWaalsContact C-N 3.35Å; K244-N247 PolarHBondContact O-N 3.17Å; K244-V248 WeakPolarHBondContact O-CG2 3.47Å; K244-V248 PolarHBondContact O-N 2.96Å; K244-V248 VanDerWaalsContact O-N 3.13Å
245	K	96.4	Very high	95.9	Very high	161 Å²	161	100.4 Å²	100.4	70%	0.7	51%	0.51	S	S	*	.	H	α-helix	trans	-62.9	-42.7	175.9	-73.1	174.3	-177.4	174.2	0	111.5	A241 R242 V248 R249	A241-K245 WeakPolarHBondContact O-CG 3.26Å; A241-K245 PolarHBondContact O-N 2.94Å; A241-K245 VanDerWaalsContact O-N 3.14Å; R242-K245 PolarHBondContact O-N 2.83Å; K245-V248 PolarHBondContact O-N 3.12Å; K245-R249 PolarHBondContact O-N 3.36Å
246	E	96.3	Very high	96	Very high	78 Å²	78	104.8 Å²	104.8	36%	0.364	52%	0.518	S	S	.	.	H	α-helix	trans	-65.1	-41.7	177.7	-177.9	163.5	-161	0	0	112.2	R242 L243 K244 V248 R249 L250	R242-E246 PolarHBondContact O-N 2.85Å; L243-E246 PolarHBondContact O-N 3.39Å; K244-E246 VanDerWaalsContact C-N 3.35Å; E246-V248 PolarHBondContact O-N 2.93Å; E246-R249 WeakPolarHBondContact O-CB 3.38Å; E246-R249 PolarHBondContact O-N 3.32Å; E246-L250 HydrophobicContact CG-CD1 4.05Å; E246-L250 HydrophobicContact CG-CG 4.41Å; E246-L250 WeakPolarHBondContact O-CG 3.34Å; E246-L250 PolarHBondContact O-N 3.47Å
247	N	93.3	Very high	96	Very high	88 Å²	88	103.3 Å²	103.3	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-44.3	176.6	-162.6	-79.6	0	0	0	111.7	L243 K244 R249 L250 Q251	L243-N247 WeakPolarHBondContact O-CB 3.43Å; L243-N247 PolarHBondContact O-N 3.23Å; K244-N247 PolarHBondContact O-N 3.17Å; N247-R249 PolarHBondContact O-N 2.96Å; N247-L250 PolarHBondContact O-N 3.36Å; N247-Q251 WeakPolarHBondContact O-CB 3.48Å; N247-Q251 VanDerWaalsContact O-CG 3.26Å; N247-Q251 WeakPolarHBondContact O-CG 3.41Å; N247-Q251 PolarHBondContact O-N 2.88Å; N247-Q251 PolarHBondContact OD1-NE2 3.47Å
248	V	96.2	Very high	96	Very high	87 Å²	87	104 Å²	104	53%	0.527	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-42	175.7	172.9	0	0	0	0	111.4	K244 K245 E246 Q251 S252	K244-V248 WeakPolarHBondContact O-CG2 3.47Å; K244-V248 PolarHBondContact O-N 2.96Å; K244-V248 VanDerWaalsContact O-N 3.13Å; K245-V248 PolarHBondContact O-N 3.12Å; E246-V248 PolarHBondContact O-N 2.93Å; V248-Q251 PolarHBondContact O-N 3.48Å; V248-S252 PolarHBondContact O-N 3.26Å
249	R	95.6	Very high	96.1	Very high	117 Å²	117	102.3 Å²	102.3	44%	0.442	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-50.1	175.8	-175.3	-172.6	66.7	83.9	2.7	111.1	K245 E246 N247 Q251 S252 E253	K245-R249 PolarHBondContact O-N 3.36Å; E246-R249 WeakPolarHBondContact O-CB 3.38Å; E246-R249 PolarHBondContact O-N 3.32Å; N247-R249 PolarHBondContact O-N 2.96Å; R249-Q251 VanDerWaalsContact C-N 3.33Å; R249-Q251 PolarHBondContact O-N 3.35Å; R249-S252 PolarHBondContact O-N 2.87Å; R249-E253 IonicContact CZ-OE1 3.84Å; R249-E253 IonicContact CZ-OE2 2.75Å; R249-E253 IonicContact NH1-OE1 3.85Å; R249-E253 PolarHBondContact NH1-OE1 3.02Å; R249-E253 IonicContact NH1-OE2 2.68Å; R249-E253 PolarHBondContact NH1-OE2 3.35Å; R249-E253 WeakPolarHBondContact O-CG 3.39Å; R249-E253 PolarHBondContact O-N 3.23Å
250	L	97	Very high	96.1	Very high	82 Å²	82	101.2 Å²	101.2	43%	0.429	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-37.6	179.6	-71.1	173.4	0	0	0	112.1	E246 N247 E253 L254	E246-L250 HydrophobicContact CG-CD1 4.05Å; E246-L250 HydrophobicContact CG-CG 4.41Å; E246-L250 WeakPolarHBondContact O-CG 3.34Å; E246-L250 PolarHBondContact O-N 3.47Å; N247-L250 PolarHBondContact O-N 3.36Å; L250-E253 PolarHBondContact O-N 2.89Å; L250-L254 WeakPolarHBondContact O-CB 3.27Å; L250-L254 PolarHBondContact O-N 3.04Å
251	Q	97	Very high	96.3	Very high	117 Å²	117	103.6 Å²	103.6	55%	0.547	51%	0.511	S	S	.	.	H	α-helix	trans	-63.1	-42	173.6	-76.4	178.1	-7.4	0	0	111.9	N247 V248 R249 L254 Q255	N247-Q251 WeakPolarHBondContact O-CB 3.48Å; N247-Q251 VanDerWaalsContact O-CG 3.26Å; N247-Q251 WeakPolarHBondContact O-CG 3.41Å; N247-Q251 PolarHBondContact O-N 2.88Å; N247-Q251 PolarHBondContact OD1-NE2 3.47Å; V248-Q251 PolarHBondContact O-N 3.48Å; R249-Q251 VanDerWaalsContact C-N 3.33Å; R249-Q251 PolarHBondContact O-N 3.35Å; Q251-L254 PolarHBondContact O-N 3.02Å; Q251-Q255 WeakPolarHBondContact O-CB 3.39Å; Q251-Q255 PolarHBondContact O-N 2.76Å
252	S	96	Very high	96.3	Very high	80 Å²	80	106.2 Å²	106.2	56%	0.559	52%	0.519	S	S	*	.	H	α-helix	trans	-66.1	-41.4	176.5	-176.2	0	0	0	0	112.1	V248 R249 Q255 K256	V248-S252 PolarHBondContact O-N 3.26Å; R249-S252 PolarHBondContact O-N 2.87Å; S252-Q255 PolarHBondContact O-N 3.27Å; S252-K256 PolarHBondContact O-N 2.87Å
253	E	96.7	Very high	96.3	Very high	94 Å²	94	102.6 Å²	102.6	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-65	-41.8	176	-75.3	172.1	-171.8	0	0	111.7	R249 L250 K256 A257	R249-E253 IonicContact CZ-OE1 3.84Å; R249-E253 IonicContact CZ-OE2 2.75Å; R249-E253 IonicContact NH1-OE1 3.85Å; R249-E253 PolarHBondContact NH1-OE1 3.02Å; R249-E253 IonicContact NH1-OE2 2.68Å; R249-E253 PolarHBondContact NH1-OE2 3.35Å; R249-E253 WeakPolarHBondContact O-CG 3.39Å; R249-E253 PolarHBondContact O-N 3.23Å; L250-E253 PolarHBondContact O-N 2.89Å; E253-K256 PolarHBondContact O-N 3.5Å; E253-A257 WeakPolarHBondContact O-CB 3.3Å; E253-A257 PolarHBondContact O-N 2.92Å
254	L	96.1	Very high	96.2	Very high	89 Å²	89	103.2 Å²	103.2	47%	0.466	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-40.5	175.7	-178	144.5	0	0	0	111.8	L250 Q251 K256 A257 R258	L250-L254 WeakPolarHBondContact O-CB 3.27Å; L250-L254 PolarHBondContact O-N 3.04Å; Q251-L254 PolarHBondContact O-N 3.02Å; L254-K256 VanDerWaalsContact C-N 3.35Å; L254-A257 PolarHBondContact O-N 3.3Å; L254-R258 VanDerWaalsContact CD2-CZ 3.5Å; L254-R258 WeakPolarHBondContact O-CG 3.34Å; L254-R258 PolarHBondContact O-N 2.88Å
255	Q	96.4	Very high	96.2	Very high	105 Å²	105	97.6 Å²	97.6	49%	0.491	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-41	176	-174.2	61.4	14.9	0	0	111.5	Q251 S252 R258 T259	Q251-Q255 WeakPolarHBondContact O-CB 3.39Å; Q251-Q255 PolarHBondContact O-N 2.76Å; S252-Q255 PolarHBondContact O-N 3.27Å; Q255-R258 WeakPolarHBondContact O-CB 3.49Å; Q255-R258 PolarHBondContact O-N 3.42Å; Q255-T259 PolarHBondContact O-N 2.89Å; Q255-T259 PolarHBondContact O-OG1 3.42Å
256	K	96.2	Very high	96.2	Very high	132 Å²	132	94.6 Å²	94.6	57%	0.574	48%	0.48	S	S	*	.	H	α-helix	trans	-62.7	-45.8	174.4	-173.7	-174.7	174.6	-171.1	0	111.7	S252 E253 L254 R258 T259 D260	S252-K256 PolarHBondContact O-N 2.87Å; E253-K256 PolarHBondContact O-N 3.5Å; L254-K256 VanDerWaalsContact C-N 3.35Å; K256-R258 PolarHBondContact O-N 3.5Å; K256-T259 WeakPolarHBondContact CA-OG1 3.46Å; K256-T259 PolarHBondContact O-N 3.46Å; K256-T259 PolarHBondContact O-OG1 2.9Å; K256-D260 WeakPolarHBondContact O-CB 3.28Å; K256-D260 PolarHBondContact O-N 2.98Å
257	A	95.7	Very high	96.2	Very high	59 Å²	59	93 Å²	93	49%	0.488	47%	0.474	S	S	.	.	H	α-helix	trans	-61.4	-34.2	177.4	0	0	0	0	0	112.3	E253 L254 L261	E253-A257 WeakPolarHBondContact O-CB 3.3Å; E253-A257 PolarHBondContact O-N 2.92Å; L254-A257 PolarHBondContact O-N 3.3Å; A257-L261 WeakPolarHBondContact O-CB 3.38Å; A257-L261 PolarHBondContact O-N 2.88Å
258	R	97.5	Very high	96.4	Very high	142 Å²	142	95 Å²	95	54%	0.536	48%	0.475	S	S	.	.	H	α-helix	trans	-65.6	-47.8	172.6	-76	176.3	173.8	176.5	-2.1	112.2	L254 Q255 K256 D260 L261 D262	L254-R258 VanDerWaalsContact CD2-CZ 3.5Å; L254-R258 WeakPolarHBondContact O-CG 3.34Å; L254-R258 PolarHBondContact O-N 2.88Å; Q255-R258 WeakPolarHBondContact O-CB 3.49Å; Q255-R258 PolarHBondContact O-N 3.42Å; K256-R258 PolarHBondContact O-N 3.5Å; R258-D260 VanDerWaalsContact C-N 3.29Å; R258-D260 PolarHBondContact O-N 3.39Å; R258-L261 PolarHBondContact O-N 3.36Å; R258-D262 PolarHBondContact O-N 3.01Å
259	T	96.6	Very high	96.4	Very high	67 Å²	67	94.2 Å²	94.2	41%	0.411	47%	0.467	S	S	.	.	H	α-helix	trans	-63	-38.1	177.9	53.2	0	0	0	0	112	Q255 K256 D262 Q263	Q255-T259 PolarHBondContact O-N 2.89Å; Q255-T259 PolarHBondContact O-OG1 3.42Å; K256-T259 WeakPolarHBondContact CA-OG1 3.46Å; K256-T259 PolarHBondContact O-N 3.46Å; K256-T259 PolarHBondContact O-OG1 2.9Å; T259-D262 PolarHBondContact O-N 2.97Å; T259-Q263 WeakPolarHBondContact O-CB 3.49Å; T259-Q263 PolarHBondContact O-N 3.48Å
260	D	97.4	Very high	96.4	Very high	89 Å²	89	92.6 Å²	92.6	48%	0.476	47%	0.467	S	S	.	.	H	α-helix	trans	-66.5	-40.1	176.9	-65.5	-11.9	0	0	0	110.8	K256 R258 Q263 E264	K256-D260 WeakPolarHBondContact O-CB 3.28Å; K256-D260 PolarHBondContact O-N 2.98Å; R258-D260 VanDerWaalsContact C-N 3.29Å; R258-D260 PolarHBondContact O-N 3.39Å; D260-Q263 PolarHBondContact O-N 3.17Å; D260-E264 WeakPolarHBondContact O-CB 3.33Å; D260-E264 PolarHBondContact O-N 3.46Å
261	L	97.4	Very high	96.3	Very high	107 Å²	107	95.6 Å²	95.6	56%	0.56	47%	0.474	S	S	*	.	H	α-helix	trans	-64.6	-42.8	174.4	177.6	64.3	0	0	0	112.4	A257 R258 E264 T265	A257-L261 WeakPolarHBondContact O-CB 3.38Å; A257-L261 PolarHBondContact O-N 2.88Å; R258-L261 PolarHBondContact O-N 3.36Å; L261-E264 PolarHBondContact O-N 2.93Å; L261-T265 VanDerWaalsContact O-CB 3.29Å; L261-T265 WeakPolarHBondContact O-CB 3.37Å; L261-T265 PolarHBondContact O-N 3.48Å; L261-T265 PolarHBondContact O-OG1 3.3Å
262	D	96	Very high	96.3	Very high	100 Å²	100	96.1 Å²	96.1	54%	0.535	48%	0.476	S	S	.	.	H	α-helix	trans	-63.9	-44.3	177.4	-70.3	-24.4	0	0	0	110.5	R258 T259 T265 L266	R258-D262 PolarHBondContact O-N 3.01Å; T259-D262 PolarHBondContact O-N 2.97Å; D262-T265 WeakPolarHBondContact O-CB 3.39Å; D262-T265 PolarHBondContact O-N 2.8Å; D262-L266 WeakPolarHBondContact O-CG 3.37Å; D262-L266 PolarHBondContact O-N 3.39Å
263	Q	95.2	Very high	96.3	Very high	105 Å²	105	96.5 Å²	96.5	49%	0.491	47%	0.472	S	S	.	.	H	α-helix	trans	-61.8	-45.8	176.7	-174.8	60.9	45.8	0	0	111.8	T259 D260 T265 L266 N267	T259-Q263 WeakPolarHBondContact O-CB 3.49Å; T259-Q263 PolarHBondContact O-N 3.48Å; D260-Q263 PolarHBondContact O-N 3.17Å; Q263-T265 PolarHBondContact O-N 2.8Å; Q263-L266 PolarHBondContact O-N 2.69Å; Q263-N267 PolarHBondContact NE2-OD1 3.3Å; Q263-N267 PolarHBondContact O-N 2.75Å; Q263-N267 PolarHBondContact O-ND2 3.25Å; Q263-N267 PolarHBondContact O-OD1 2.88Å
264	E	95.3	Very high	96.3	Very high	112 Å²	112	97.3 Å²	97.3	52%	0.523	48%	0.476	S	S	.	.	H	α-helix	trans	-66.3	-29.8	177.4	-170.4	56.5	-157.2	0	0	111.8	D260 L261 N267 R268	D260-E264 WeakPolarHBondContact O-CB 3.33Å; D260-E264 PolarHBondContact O-N 3.46Å; L261-E264 PolarHBondContact O-N 2.93Å; E264-N267 PolarHBondContact OE2-ND2 2.98Å; E264-R268 WeakPolarHBondContact O-CB 3.34Å; E264-R268 PolarHBondContact O-N 2.96Å
265	T	95.4	Very high	96.2	Very high	39 Å²	39	97 Å²	97	24%	0.239	48%	0.478	C	S	.	.	H	α-helix	trans	-70.3	-40.5	174.9	-60.1	0	0	0	0	112.4	L261 D262 Q263 R268 I269	L261-T265 VanDerWaalsContact O-CB 3.29Å; L261-T265 WeakPolarHBondContact O-CB 3.37Å; L261-T265 PolarHBondContact O-N 3.48Å; L261-T265 PolarHBondContact O-OG1 3.3Å; D262-T265 WeakPolarHBondContact O-CB 3.39Å; D262-T265 PolarHBondContact O-N 2.8Å; Q263-T265 PolarHBondContact O-N 2.8Å; T265-R268 PolarHBondContact O-N 3.39Å; T265-R268 PolarHBondContact OG1-NH1 3.25Å; T265-I269 HydrophobicContact CG2-CD1 4.21Å; T265-I269 VanDerWaalsContact O-CG1 3.29Å; T265-I269 WeakPolarHBondContact O-CG1 3.46Å; T265-I269 PolarHBondContact O-N 2.94Å; T265-I269 VanDerWaalsContact O-N 3.1Å
266	L	96.4	Very high	96.2	Very high	97 Å²	97	96.7 Å²	96.7	51%	0.508	48%	0.476	S	S	.	.	H	α-helix	trans	-62.6	-49.3	171.2	-69.1	174.9	0	0	0	111.1	D262 Q263 R268 I269 D270	D262-L266 WeakPolarHBondContact O-CG 3.37Å; D262-L266 PolarHBondContact O-N 3.39Å; Q263-L266 PolarHBondContact O-N 2.69Å; L266-R268 VanDerWaalsContact C-N 3.29Å; L266-R268 PolarHBondContact O-N 3.49Å; L266-I269 PolarHBondContact O-N 3.44Å; L266-I269 VanDerWaalsContact O-N 3.09Å; L266-D270 PolarHBondContact O-N 2.79Å
267	N	96.8	Very high	96.2	Very high	44 Å²	44	94.4 Å²	94.4	24%	0.235	47%	0.473	C	S	.	.	H	α-helix	trans	-55.3	-45.3	177.5	-64.3	-16.7	0	0	0	111.2	Q263 E264 I269 D270 Y271	Q263-N267 PolarHBondContact NE2-OD1 3.3Å; Q263-N267 PolarHBondContact O-N 2.75Å; Q263-N267 PolarHBondContact O-ND2 3.25Å; Q263-N267 PolarHBondContact O-OD1 2.88Å; E264-N267 PolarHBondContact OE2-ND2 2.98Å; N267-I269 PolarHBondContact O-N 3Å; N267-D270 PolarHBondContact O-N 3.46Å; N267-Y271 HydrophobicContact CB-CD2 4.46Å; N267-Y271 HydrophobicContact CB-CE2 4.11Å; N267-Y271 WeakPolarHBondContact O-CD2 3.49Å; N267-Y271 PolarHBondContact O-N 2.9Å
268	R	96.5	Very high	96.2	Very high	131 Å²	131	96.1 Å²	96.1	49%	0.494	47%	0.473	S	S	.	.	H	α-helix	trans	-61.4	-42.7	177.9	-173.1	-178.7	72.2	-104.4	1.9	112.4	E264 T265 L266 Q272	E264-R268 WeakPolarHBondContact O-CB 3.34Å; E264-R268 PolarHBondContact O-N 2.96Å; T265-R268 PolarHBondContact O-N 3.39Å; T265-R268 PolarHBondContact OG1-NH1 3.25Å; L266-R268 VanDerWaalsContact C-N 3.29Å; L266-R268 PolarHBondContact O-N 3.49Å; R268-Q272 VanDerWaalsContact O-CB 3.3Å; R268-Q272 WeakPolarHBondContact O-CB 3.31Å; R268-Q272 PolarHBondContact O-N 3.02Å
269	I	96.8	Very high	96.2	Very high	71 Å²	71	93.6 Å²	93.6	36%	0.364	47%	0.47	S	S	.	.	H	α-helix	trans	-65.3	-43.6	177.5	-68.4	164.7	0	0	0	110.2	T265 L266 N267 Y271 Q272 N273	T265-I269 HydrophobicContact CG2-CD1 4.21Å; T265-I269 VanDerWaalsContact O-CG1 3.29Å; T265-I269 WeakPolarHBondContact O-CG1 3.46Å; T265-I269 PolarHBondContact O-N 2.94Å; T265-I269 VanDerWaalsContact O-N 3.1Å; L266-I269 PolarHBondContact O-N 3.44Å; L266-I269 VanDerWaalsContact O-N 3.09Å; N267-I269 PolarHBondContact O-N 3Å; I269-Y271 PolarHBondContact O-N 3.04Å; I269-Q272 PolarHBondContact O-N 3.39Å; I269-N273 WeakPolarHBondContact O-CB 3.4Å; I269-N273 VanDerWaalsContact O-CG 3.28Å; I269-N273 PolarHBondContact O-N 2.86Å; I269-N273 PolarHBondContact O-ND2 2.92Å
270	D	96.2	Very high	96.1	Very high	83 Å²	83	95.6 Å²	95.6	44%	0.444	48%	0.475	S	S	.	.	H	α-helix	trans	-61.1	-45.2	177.5	-71.6	-22	0	0	0	111.4	L266 N267 N273 Q274	L266-D270 PolarHBondContact O-N 2.79Å; N267-D270 PolarHBondContact O-N 3.46Å; D270-N273 PolarHBondContact O-N 2.88Å; D270-Q274 VanDerWaalsContact O-CG 3.28Å; D270-Q274 WeakPolarHBondContact O-CG 3.32Å; D270-Q274 PolarHBondContact O-N 2.87Å
271	Y	94.9	Very high	96	Very high	144 Å²	144	96.2 Å²	96.2	57%	0.565	48%	0.475	S	S	*	.	H	α-helix	trans	-65.3	-38.7	174.8	-66.9	-49.2	0	0	0	112.5	N267 I269 N273 Q274 V275	N267-Y271 HydrophobicContact CB-CD2 4.46Å; N267-Y271 HydrophobicContact CB-CE2 4.11Å; N267-Y271 WeakPolarHBondContact O-CD2 3.49Å; N267-Y271 PolarHBondContact O-N 2.9Å; I269-Y271 PolarHBondContact O-N 3.04Å; Y271-N273 VanDerWaalsContact C-N 3.35Å; Y271-Q274 PolarHBondContact O-N 3.45Å; Y271-V275 WeakPolarHBondContact O-CB 3.49Å; Y271-V275 VanDerWaalsContact O-CG2 3.27Å; Y271-V275 WeakPolarHBondContact O-CG2 3.45Å; Y271-V275 PolarHBondContact O-N 3.42Å
272	Q	97.1	Very high	95.8	Very high	129 Å²	129	95.1 Å²	95.1	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-64.1	-40.9	175.8	-174.6	176.5	-19.2	0	0	111.6	R268 I269 V275 Q276	R268-Q272 VanDerWaalsContact O-CB 3.3Å; R268-Q272 WeakPolarHBondContact O-CB 3.31Å; R268-Q272 PolarHBondContact O-N 3.02Å; I269-Q272 PolarHBondContact O-N 3.39Å; Q272-V275 PolarHBondContact O-N 3.36Å; Q272-Q276 WeakPolarHBondContact O-CB 3.39Å; Q272-Q276 PolarHBondContact O-N 3.48Å
273	N	95.4	Very high	95.8	Very high	87 Å²	87	94.1 Å²	94.1	47%	0.465	46%	0.463	S	S	.	.	H	α-helix	trans	-65.3	-44	175.1	-72.8	-18.5	0	0	0	111.3	I269 D270 Y271 V275 Q276 T277	I269-N273 WeakPolarHBondContact O-CB 3.4Å; I269-N273 VanDerWaalsContact O-CG 3.28Å; I269-N273 PolarHBondContact O-N 2.86Å; I269-N273 PolarHBondContact O-ND2 2.92Å; D270-N273 PolarHBondContact O-N 2.88Å; Y271-N273 VanDerWaalsContact C-N 3.35Å; N273-V275 VanDerWaalsContact C-N 3.34Å; N273-V275 PolarHBondContact O-N 3.08Å; N273-Q276 PolarHBondContact O-N 3.43Å; N273-T277 PolarHBondContact O-N 2.51Å; N273-T277 PolarHBondContact O-OG1 2.81Å; N273-T277 VanDerWaalsContact O-OG1 3.08Å
274	Q	96.1	Very high	95.7	Very high	112 Å²	112	95.5 Å²	95.5	52%	0.523	47%	0.468	S	S	.	.	H	α-helix	trans	-60	-44.5	175.5	-73.4	172.5	24.1	0	0	111.7	D270 Y271 Q276 T277 L278	D270-Q274 VanDerWaalsContact O-CG 3.28Å; D270-Q274 WeakPolarHBondContact O-CG 3.32Å; D270-Q274 PolarHBondContact O-N 2.87Å; Y271-Q274 PolarHBondContact O-N 3.45Å; Q274-Q276 VanDerWaalsContact C-N 3.34Å; Q274-Q276 PolarHBondContact O-N 3.29Å; Q274-T277 PolarHBondContact O-N 3.37Å; Q274-L278 WeakPolarHBondContact O-CB 3.49Å; Q274-L278 VanDerWaalsContact O-CG 3.26Å; Q274-L278 WeakPolarHBondContact O-CG 3.42Å; Q274-L278 PolarHBondContact O-N 2.88Å
275	V	95.8	Very high	95.7	Very high	83 Å²	83	93.6 Å²	93.6	50%	0.503	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-43.2	175.5	169.3	0	0	0	0	110.9	Y271 Q272 N273 L278 L279	Y271-V275 WeakPolarHBondContact O-CB 3.49Å; Y271-V275 VanDerWaalsContact O-CG2 3.27Å; Y271-V275 WeakPolarHBondContact O-CG2 3.45Å; Y271-V275 PolarHBondContact O-N 3.42Å; Q272-V275 PolarHBondContact O-N 3.36Å; N273-V275 VanDerWaalsContact C-N 3.34Å; N273-V275 PolarHBondContact O-N 3.08Å; V275-L278 PolarHBondContact O-N 3Å; V275-L279 HydrophobicContact CG1-CD1 4.06Å; V275-L279 HydrophobicContact CG1-CG 4.48Å; V275-L279 VanDerWaalsContact O-CG 3.29Å; V275-L279 WeakPolarHBondContact O-CG 3.46Å; V275-L279 PolarHBondContact O-N 2.79Å
276	Q	96.6	Very high	95.6	Very high	98 Å²	98	99.4 Å²	99.4	46%	0.458	48%	0.478	S	S	.	.	H	α-helix	trans	-63.2	-47	177.5	-177.8	61.8	39.7	0	0	112	Q272 N273 Q274 L278 L279 E280	Q272-Q276 WeakPolarHBondContact O-CB 3.39Å; Q272-Q276 PolarHBondContact O-N 3.48Å; N273-Q276 PolarHBondContact O-N 3.43Å; Q274-Q276 VanDerWaalsContact C-N 3.34Å; Q274-Q276 PolarHBondContact O-N 3.29Å; Q276-L278 VanDerWaalsContact C-N 3.32Å; Q276-L278 PolarHBondContact O-N 3.36Å; Q276-L279 PolarHBondContact O-N 2.69Å; Q276-E280 WeakPolarHBondContact CG-OE1 3.47Å; Q276-E280 PolarHBondContact NE2-OE1 2.68Å; Q276-E280 WeakPolarHBondContact O-CG 3.46Å; Q276-E280 PolarHBondContact O-N 3.18Å
277	T	95.3	Very high	95.6	Very high	84 Å²	84	103.2 Å²	103.2	52%	0.515	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-43.1	176.5	-58.7	0	0	0	0	111.5	N273 Q274 L279 E280 E281	N273-T277 PolarHBondContact O-N 2.51Å; N273-T277 PolarHBondContact O-OG1 2.81Å; N273-T277 VanDerWaalsContact O-OG1 3.08Å; Q274-T277 PolarHBondContact O-N 3.37Å; T277-L279 PolarHBondContact O-N 2.8Å; T277-E280 PolarHBondContact O-N 3.13Å; T277-E281 WeakPolarHBondContact O-CB 3.4Å; T277-E281 PolarHBondContact O-N 3.03Å
278	L	96	Very high	95.5	Very high	94 Å²	94	103.5 Å²	103.5	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-66.3	-36.1	177.2	-71.7	171	0	0	0	112.4	Q274 V275 Q276 E281 I282	Q274-L278 WeakPolarHBondContact O-CB 3.49Å; Q274-L278 VanDerWaalsContact O-CG 3.26Å; Q274-L278 WeakPolarHBondContact O-CG 3.42Å; Q274-L278 PolarHBondContact O-N 2.88Å; V275-L278 PolarHBondContact O-N 3Å; Q276-L278 VanDerWaalsContact C-N 3.32Å; Q276-L278 PolarHBondContact O-N 3.36Å; L278-E281 PolarHBondContact O-N 3.39Å; L278-I282 WeakPolarHBondContact O-CB 3.25Å; L278-I282 WeakPolarHBondContact O-CD1 3.24Å; L278-I282 VanDerWaalsContact O-CG1 3.22Å; L278-I282 WeakPolarHBondContact O-CG1 3.4Å; L278-I282 PolarHBondContact O-N 2.97Å
279	L	96.5	Very high	95.2	Very high	89 Å²	89	101.7 Å²	101.7	47%	0.466	49%	0.486	S	S	.	.	H	α-helix	trans	-65.4	-43.3	174.4	-73.9	171.3	0	0	0	111.5	V275 Q276 T277 E281 I282 D283	V275-L279 HydrophobicContact CG1-CD1 4.06Å; V275-L279 HydrophobicContact CG1-CG 4.48Å; V275-L279 VanDerWaalsContact O-CG 3.29Å; V275-L279 WeakPolarHBondContact O-CG 3.46Å; V275-L279 PolarHBondContact O-N 2.79Å; Q276-L279 PolarHBondContact O-N 2.69Å; T277-L279 PolarHBondContact O-N 2.8Å; L279-E281 VanDerWaalsContact C-N 3.34Å; L279-I282 PolarHBondContact O-N 2.81Å; L279-D283 WeakPolarHBondContact O-CB 3.26Å; L279-D283 PolarHBondContact O-N 3.48Å
280	E	95.6	Very high	95	Very high	109 Å²	109	102.7 Å²	102.7	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-39.1	175.6	-72.2	170.1	-167.2	0	0	112.1	Q276 T277 D283 F284	Q276-E280 WeakPolarHBondContact CG-OE1 3.47Å; Q276-E280 PolarHBondContact NE2-OE1 2.68Å; Q276-E280 WeakPolarHBondContact O-CG 3.46Å; Q276-E280 PolarHBondContact O-N 3.18Å; T277-E280 PolarHBondContact O-N 3.13Å; E280-D283 PolarHBondContact O-N 3.03Å; E280-F284 WeakPolarHBondContact O-CB 3.43Å; E280-F284 PolarHBondContact O-N 3.47Å
281	E	95.6	Very high	94.8	Very high	103 Å²	103	103.1 Å²	103.1	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-45.2	175.6	-173.3	176.8	-176.5	0	0	111.5	T277 L278 L279 D283 F284 I285	T277-E281 WeakPolarHBondContact O-CB 3.4Å; T277-E281 PolarHBondContact O-N 3.03Å; L278-E281 PolarHBondContact O-N 3.39Å; L279-E281 VanDerWaalsContact C-N 3.34Å; E281-D283 VanDerWaalsContact C-N 3.34Å; E281-D283 PolarHBondContact O-N 3.01Å; E281-F284 PolarHBondContact O-N 3.09Å; E281-I285 HydrophobicContact CG-CD1 3.95Å; E281-I285 VanDerWaalsContact O-CG1 3.27Å; E281-I285 WeakPolarHBondContact O-CG1 3.47Å; E281-I285 PolarHBondContact O-N 3.42Å
282	I	93.2	Very high	94.6	Very high	83 Å²	83	100.6 Å²	100.6	43%	0.426	49%	0.485	S	S	.	.	H	α-helix	trans	-60.3	-44.9	175.2	-71.6	166.5	0	0	0	110.8	L278 L279 I285 R286	L278-I282 WeakPolarHBondContact O-CB 3.25Å; L278-I282 WeakPolarHBondContact O-CD1 3.24Å; L278-I282 VanDerWaalsContact O-CG1 3.22Å; L278-I282 WeakPolarHBondContact O-CG1 3.4Å; L278-I282 PolarHBondContact O-N 2.97Å; L279-I282 PolarHBondContact O-N 2.81Å; I282-I285 PolarHBondContact O-N 2.8Å; I282-R286 WeakPolarHBondContact O-CB 3.42Å; I282-R286 VanDerWaalsContact O-CG 3.26Å; I282-R286 WeakPolarHBondContact O-CG 3.46Å; I282-R286 PolarHBondContact O-N 3.49Å
283	D	94.8	Very high	94	Very high	79 Å²	79	98.4 Å²	98.4	42%	0.422	48%	0.476	S	S	.	.	H	α-helix	trans	-66.2	-37.5	178.8	-83.3	-13	0	0	0	112.3	L279 E280 E281 R287	L279-D283 WeakPolarHBondContact O-CB 3.26Å; L279-D283 PolarHBondContact O-N 3.48Å; E280-D283 PolarHBondContact O-N 3.03Å; E281-D283 VanDerWaalsContact C-N 3.34Å; E281-D283 PolarHBondContact O-N 3.01Å; D283-R287 WeakPolarHBondContact O-CG 3.34Å; D283-R287 PolarHBondContact O-N 2.88Å; D283-R287 VanDerWaalsContact O-N 3.08Å
284	F	94.3	Very high	93.6	Very high	135 Å²	135	100.1 Å²	100.1	59%	0.592	48%	0.48	S	S	*	.	H	α-helix	trans	-62.3	-52.1	174.4	175.9	-101.9	0	0	0	111.1	E280 E281 R286 R287 V288	E280-F284 WeakPolarHBondContact O-CB 3.43Å; E280-F284 PolarHBondContact O-N 3.47Å; E281-F284 PolarHBondContact O-N 3.09Å; F284-R286 VanDerWaalsContact C-N 3.29Å; F284-R286 PolarHBondContact O-N 3.39Å; F284-R287 PolarHBondContact O-N 3.41Å; F284-R287 VanDerWaalsContact O-N 3.14Å; F284-V288 HydrophobicContact CD1-CG2 4.28Å; F284-V288 HydrophobicContact CD2-CG2 4.4Å; F284-V288 HydrophobicContact CE1-CG2 3.85Å; F284-V288 HydrophobicContact CE2-CG2 3.98Å; F284-V288 HydrophobicContact CZ-CG2 3.68Å; F284-V288 WeakPolarHBondContact O-CG2 3.44Å; F284-V288 PolarHBondContact O-N 3.4Å
285	I	95.4	Very high	93	Very high	72 Å²	72	99.8 Å²	99.8	37%	0.369	48%	0.478	S	S	.	.	H	α-helix	trans	-59.3	-42.1	179.7	-67.7	167.7	0	0	0	110.6	E281 I282 R287 V288 H289	E281-I285 HydrophobicContact CG-CD1 3.95Å; E281-I285 VanDerWaalsContact O-CG1 3.27Å; E281-I285 WeakPolarHBondContact O-CG1 3.47Å; E281-I285 PolarHBondContact O-N 3.42Å; I282-I285 PolarHBondContact O-N 2.8Å; I285-R287 PolarHBondContact O-N 3.4Å; I285-V288 PolarHBondContact O-N 2.91Å; I285-H289 WeakPolarHBondContact CG2-NE2 3.43Å; I285-H289 PolarHBondContact O-CD2 3.08Å; I285-H289 PolarHBondContact O-N 3.16Å
286	R	93.6	Very high	92.3	Very high	161 Å²	161	101.3 Å²	101.3	61%	0.608	48%	0.483	S	S	*	.	H	α-helix	trans	-59.5	-45.7	175.6	-77	175.9	175.6	-154.9	-1	112.5	I282 F284 H289 D290	I282-R286 WeakPolarHBondContact O-CB 3.42Å; I282-R286 VanDerWaalsContact O-CG 3.26Å; I282-R286 WeakPolarHBondContact O-CG 3.46Å; I282-R286 PolarHBondContact O-N 3.49Å; F284-R286 VanDerWaalsContact C-N 3.29Å; F284-R286 PolarHBondContact O-N 3.39Å; R286-H289 PolarHBondContact O-N 2.97Å; R286-D290 WeakPolarHBondContact O-CB 3.08Å; R286-D290 VanDerWaalsContact O-CG 3.31Å; R286-D290 PolarHBondContact O-N 2.95Å
287	R	94.4	Very high	91.5	Very high	177 Å²	177	102.8 Å²	102.8	67%	0.668	49%	0.49	S	S	*	.	H	α-helix	trans	-65.7	-39.6	178.7	-71.7	175.7	-166.9	164.6	8.6	112.6	D283 F284 I285 Q291	D283-R287 WeakPolarHBondContact O-CG 3.34Å; D283-R287 PolarHBondContact O-N 2.88Å; D283-R287 VanDerWaalsContact O-N 3.08Å; F284-R287 PolarHBondContact O-N 3.41Å; F284-R287 VanDerWaalsContact O-N 3.14Å; I285-R287 PolarHBondContact O-N 3.4Å; R287-Q291 WeakPolarHBondContact O-CB 3.32Å; R287-Q291 PolarHBondContact O-N 3.41Å
288	V	95	Very high	90.6	Very high	49 Å²	49	102 Å²	102	30%	0.297	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-51.1	176.7	171.3	0	0	0	0	109.7	F284 I285 D290 Q291 E292	F284-V288 HydrophobicContact CD1-CG2 4.28Å; F284-V288 HydrophobicContact CD2-CG2 4.4Å; F284-V288 HydrophobicContact CE1-CG2 3.85Å; F284-V288 HydrophobicContact CE2-CG2 3.98Å; F284-V288 HydrophobicContact CZ-CG2 3.68Å; F284-V288 WeakPolarHBondContact O-CG2 3.44Å; F284-V288 PolarHBondContact O-N 3.4Å; I285-V288 PolarHBondContact O-N 2.91Å; V288-D290 PolarHBondContact O-N 2.87Å; V288-Q291 WeakPolarHBondContact O-CB 3.3Å; V288-Q291 PolarHBondContact O-N 3.21Å; V288-Q291 VanDerWaalsContact O-N 3.1Å; V288-E292 HydrophobicContact CG1-CG 4.34Å; V288-E292 WeakPolarHBondContact O-CG 3.36Å; V288-E292 PolarHBondContact O-N 2.91Å
289	H	90.8	Very high	89.4	Confident	93 Å²	93	103.2 Å²	103.2	43%	0.431	50%	0.498	S	S	.	.	H	α-helix	trans	-64.9	-38	178.9	-69.2	-29	0	0	0	113	I285 R286 Q291 E292 I293	I285-H289 WeakPolarHBondContact CG2-NE2 3.43Å; I285-H289 PolarHBondContact O-CD2 3.08Å; I285-H289 PolarHBondContact O-N 3.16Å; R286-H289 PolarHBondContact O-N 2.97Å; H289-Q291 PolarHBondContact O-N 3.19Å; H289-E292 IonicContact CE1-OE2 2.8Å; H289-E292 IonicContact CG-OE2 3.98Å; H289-E292 IonicContact ND1-OE2 2.8Å; H289-E292 PolarHBondContact ND1-OE2 2.8Å; H289-E292 PolarHBondContact O-N 3.47Å; H289-I293 WeakPolarHBondContact O-CB 3.4Å; H289-I293 WeakPolarHBondContact O-CD1 3.4Å; H289-I293 WeakPolarHBondContact O-CG1 3.43Å; H289-I293 PolarHBondContact O-N 2.86Å
290	D	92.6	Very high	87.8	Confident	93 Å²	93	103 Å²	103	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-34.4	174	-80.3	-18.6	0	0	0	112.1	R286 V288 K294	R286-D290 WeakPolarHBondContact O-CB 3.08Å; R286-D290 VanDerWaalsContact O-CG 3.31Å; R286-D290 PolarHBondContact O-N 2.95Å; V288-D290 PolarHBondContact O-N 2.87Å; D290-K294 VanDerWaalsContact O-CG 3.28Å; D290-K294 WeakPolarHBondContact O-CG 3.45Å; D290-K294 PolarHBondContact O-N 2.85Å
291	Q	91.7	Very high	86.1	Confident	91 Å²	91	101.9 Å²	101.9	43%	0.425	52%	0.518	S	S	.	.	H	α-helix	trans	-75.4	-45.5	176.7	-176.4	60.2	23.1	0	0	111.7	R287 V288 H289 I293 K294 E295	R287-Q291 WeakPolarHBondContact O-CB 3.32Å; R287-Q291 PolarHBondContact O-N 3.41Å; V288-Q291 WeakPolarHBondContact O-CB 3.3Å; V288-Q291 PolarHBondContact O-N 3.21Å; V288-Q291 VanDerWaalsContact O-N 3.1Å; H289-Q291 PolarHBondContact O-N 3.19Å; Q291-I293 VanDerWaalsContact C-N 3.29Å; Q291-I293 PolarHBondContact O-N 2.91Å; Q291-K294 WeakPolarHBondContact O-CB 3.49Å; Q291-K294 PolarHBondContact O-N 3.18Å; Q291-K294 VanDerWaalsContact O-N 3.11Å; Q291-E295 PolarHBondContact NE2-OE1 3.46Å; Q291-E295 WeakPolarHBondContact O-CG 3.21Å; Q291-E295 PolarHBondContact O-N 3.1Å
292	E	90.4	Very high	84.1	Confident	91 Å²	91	106.3 Å²	106.3	43%	0.425	53%	0.531	S	S	.	.	H	α-helix	trans	-57.7	-42.8	174.7	-73.3	174.3	160.8	0	0	111.2	V288 H289 K294 E295 L296	V288-E292 HydrophobicContact CG1-CG 4.34Å; V288-E292 WeakPolarHBondContact O-CG 3.36Å; V288-E292 PolarHBondContact O-N 2.91Å; H289-E292 IonicContact CE1-OE2 2.8Å; H289-E292 IonicContact CG-OE2 3.98Å; H289-E292 IonicContact ND1-OE2 2.8Å; H289-E292 PolarHBondContact ND1-OE2 2.8Å; H289-E292 PolarHBondContact O-N 3.47Å; E292-K294 VanDerWaalsContact C-N 3.34Å; E292-K294 PolarHBondContact O-N 3.2Å; E292-E295 PolarHBondContact O-N 3.22Å; E292-L296 WeakPolarHBondContact O-CB 3.47Å; E292-L296 VanDerWaalsContact O-CG 3.26Å; E292-L296 WeakPolarHBondContact O-CG 3.46Å; E292-L296 PolarHBondContact O-N 3.31Å
293	I	85.8	Confident	81.8	Confident	83 Å²	83	109.7 Å²	109.7	43%	0.426	55%	0.55	S	S	.	.	H	α-helix	trans	-62.4	-42	176.5	-70.3	166.1	0	0	0	110.7	H289 Q291 Q297	H289-I293 WeakPolarHBondContact O-CB 3.4Å; H289-I293 WeakPolarHBondContact O-CD1 3.4Å; H289-I293 WeakPolarHBondContact O-CG1 3.43Å; H289-I293 PolarHBondContact O-N 2.86Å; Q291-I293 VanDerWaalsContact C-N 3.29Å; Q291-I293 PolarHBondContact O-N 2.91Å; I293-Q297 HydrophobicContact CG2-CG 4.4Å; I293-Q297 VanDerWaalsContact O-CB 3.31Å; I293-Q297 WeakPolarHBondContact O-CB 3.37Å; I293-Q297 WeakPolarHBondContact O-CG 3.27Å; I293-Q297 PolarHBondContact O-N 2.8Å
294	K	86.3	Confident	79.9	Confident	124 Å²	124	109.8 Å²	109.8	54%	0.539	55%	0.553	S	S	.	*	H	α-helix	trans	-64.2	-41.7	176.4	-75.5	168.7	-171.4	166.2	0	112.3	D290 Q291 E292 Q297 A298	D290-K294 VanDerWaalsContact O-CG 3.28Å; D290-K294 WeakPolarHBondContact O-CG 3.45Å; D290-K294 PolarHBondContact O-N 2.85Å; Q291-K294 WeakPolarHBondContact O-CB 3.49Å; Q291-K294 PolarHBondContact O-N 3.18Å; Q291-K294 VanDerWaalsContact O-N 3.11Å; E292-K294 VanDerWaalsContact C-N 3.34Å; E292-K294 PolarHBondContact O-N 3.2Å; K294-Q297 PolarHBondContact O-N 2.81Å; K294-A298 WeakPolarHBondContact O-CB 3.38Å; K294-A298 PolarHBondContact O-N 2.87Å
295	E	84.1	Confident	77.8	Confident	105 Å²	105	109 Å²	109	49%	0.491	56%	0.56	S	S	.	*	H	α-helix	trans	-66.8	-44.6	178.4	-72.5	176.4	-167.1	0	0	111.6	Q291 E292 Q297 A298 L299	Q291-E295 PolarHBondContact NE2-OE1 3.46Å; Q291-E295 WeakPolarHBondContact O-CG 3.21Å; Q291-E295 PolarHBondContact O-N 3.1Å; E292-E295 PolarHBondContact O-N 3.22Å; E295-Q297 VanDerWaalsContact C-N 3.33Å; E295-Q297 PolarHBondContact O-N 2.82Å; E295-A298 PolarHBondContact O-N 3.39Å; E295-L299 PolarHBondContact O-N 2.75Å
296	L	80.3	Confident	75.6	Confident	114 Å²	114	108.3 Å²	108.3	60%	0.597	57%	0.565	S	S	*	*	H	α-helix	trans	-62.8	-39.5	174.8	-72.2	172.9	0	0	0	111.8	E292 L299 A300	E292-L296 WeakPolarHBondContact O-CB 3.47Å; E292-L296 VanDerWaalsContact O-CG 3.26Å; E292-L296 WeakPolarHBondContact O-CG 3.46Å; E292-L296 PolarHBondContact O-N 3.31Å; L296-L299 PolarHBondContact O-N 2.69Å; L296-A300 VanDerWaalsContact O-CB 3.27Å; L296-A300 WeakPolarHBondContact O-CB 3.34Å; L296-A300 PolarHBondContact O-N 3Å
297	Q	80	Confident	73.5	Confident	130 Å²	130	109.7 Å²	109.7	61%	0.607	58%	0.578	S	S	*	*	H	α-helix	trans	-64.4	-39.1	173.7	-76.4	175.6	-1.2	0	0	112.1	I293 K294 E295 A301	I293-Q297 HydrophobicContact CG2-CG 4.4Å; I293-Q297 VanDerWaalsContact O-CB 3.31Å; I293-Q297 WeakPolarHBondContact O-CB 3.37Å; I293-Q297 WeakPolarHBondContact O-CG 3.27Å; I293-Q297 PolarHBondContact O-N 2.8Å; K294-Q297 PolarHBondContact O-N 2.81Å; E295-Q297 VanDerWaalsContact C-N 3.33Å; E295-Q297 PolarHBondContact O-N 2.82Å; Q297-A301 PolarHBondContact O-N 2.9Å
298	A	76.6	Confident	71.6	Confident	67 Å²	67	104.6 Å²	104.6	55%	0.554	56%	0.564	S	S	*	*	H	α-helix	trans	-67.8	-38.9	176.5	0	0	0	0	0	112.6	K294 E295	K294-A298 WeakPolarHBondContact O-CB 3.38Å; K294-A298 PolarHBondContact O-N 2.87Å; E295-A298 PolarHBondContact O-N 3.39Å
299	L	69.6	Low	69.8	Low	120 Å²	120	111 Å²	111	63%	0.628	58%	0.583	S	S	*	*	H	α-helix	trans	-67.5	-43	174.7	-82	156.9	0	0	0	111.8	E295 L296 A301 R302	E295-L299 PolarHBondContact O-N 2.75Å; L296-L299 PolarHBondContact O-N 2.69Å; L299-A301 PolarHBondContact O-N 3.06Å; L299-R302 WeakPolarHBondContact O-CB 3.41Å; L299-R302 PolarHBondContact O-N 3.17Å
300	A	62.9	Low	68.2	Low	84 Å²	84	112 Å²	112	69%	0.694	59%	0.588	S	S	*	*	H	α-helix	trans	-63.7	-27.6	178.5	0	0	0	0	0	112.9	L296 R302	L296-A300 VanDerWaalsContact O-CB 3.27Å; L296-A300 WeakPolarHBondContact O-CB 3.34Å; L296-A300 PolarHBondContact O-N 3Å; A300-R302 PolarHBondContact O-N 2.87Å
301	A	61.6	Low	66.9	Low	86 Å²	86	113.8 Å²	113.8	71%	0.711	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-10.1	174.8	0	0	0	0	0	113.7	Q297 L299 D303	Q297-A301 PolarHBondContact O-N 2.9Å; L299-A301 PolarHBondContact O-N 3.06Å; A301-D303 PolarHBondContact O-N 2.96Å
302	R	53.1	Low	65.3	Low	196 Å²	196	115 Å²	115	74%	0.74	60%	0.595	S	S	*	*			trans	-101.1	76.6	-177.2	-167	174.4	172.7	173.1	-3.1	110.5	L299 A300 T304	L299-R302 WeakPolarHBondContact O-CB 3.41Å; L299-R302 PolarHBondContact O-N 3.17Å; A300-R302 PolarHBondContact O-N 2.87Å; R302-T304 PolarHBondContact O-N 3.41Å
303	D	44.1	Very low	64.4	Low	154 Å²	154	116.4 Å²	116.4	82%	0.824	60%	0.6	S	S	*	*			trans	-72.4	110.7	174.3	-176.1	14.5	0	0	0	111	A301	A301-D303 PolarHBondContact O-N 2.96Å
304	T	55.2	Low	63.8	Low	81 Å²	81	117.5 Å²	117.5	50%	0.497	61%	0.607	S	S	.	*			trans	-135	99.4	171.2	59.5	0	0	0	0	112.2	R302	R302-T304 PolarHBondContact O-N 3.41Å
305	T	49.9	Very low	63.4	Low	118 Å²	118	116.1 Å²	116.1	72%	0.724	60%	0.602	S	S	*	*			trans	60.6	132.6	130.7	11.4	0	0	0	0	120.6	E307	T305-E307 PolarHBondContact O-N 2.93Å
306	A	49.9	Very low	63	Low	58 Å²	58	116.1 Å²	116.1	48%	0.479	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	-10.1	-159.9	0	0	0	0	0	117.4	N308 R309	A306-N308 PolarHBondContact O-N 3.42Å; A306-R309 WeakPolarHBondContact O-CB 3.16Å; A306-R309 WeakPolarHBondContact O-CG 3.28Å; A306-R309 PolarHBondContact O-N 3.25Å
307	E	50.3	Low	63.1	Low	190 Å²	190	113.3 Å²	113.3	89%	0.888	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-16.6	-179.3	-68.7	178.9	173.3	0	0	112.8	T305 R309	T305-E307 PolarHBondContact O-N 2.93Å; E307-R309 PolarHBondContact O-N 3.47Å
308	N	53.4	Low	63.3	Low	69 Å²	69	111 Å²	111	37%	0.369	59%	0.589	S	S	.	*	H	α-helix	trans	-68.1	-16.8	169.1	-81.6	-14.5	0	0	0	112.9	A306 E310 F312	A306-N308 PolarHBondContact O-N 3.42Å; N308-E310 PolarHBondContact O-N 2.86Å; N308-F312 HydrophobicContact CB-CD2 3.4Å; N308-F312 HydrophobicContact CB-CE2 3.29Å; N308-F312 HydrophobicContact CB-CG 4.36Å; N308-F312 HydrophobicContact CB-CZ 4.22Å; N308-F312 WeakPolarHBondContact O-CB 3.43Å; N308-F312 WeakPolarHBondContact O-CD2 3.37Å; N308-F312 WeakPolarHBondContact O-CG 3.36Å; N308-F312 PolarHBondContact O-N 3.39Å
309	R	56.9	Low	63.8	Low	185 Å²	185	109.9 Å²	109.9	70%	0.698	58%	0.581	S	S	*	*	H	α-helix	trans	-64.8	-33.6	-167.8	-72.3	179.4	-179.3	176.7	1.4	115.6	A306 E307 K313	A306-R309 WeakPolarHBondContact O-CB 3.16Å; A306-R309 WeakPolarHBondContact O-CG 3.28Å; A306-R309 PolarHBondContact O-N 3.25Å; E307-R309 PolarHBondContact O-N 3.47Å; R309-K313 VanDerWaalsContact O-CB 3.31Å; R309-K313 WeakPolarHBondContact O-CB 3.43Å; R309-K313 PolarHBondContact O-N 3.41Å
310	E	58.4	Low	64.6	Low	114 Å²	114	107.5 Å²	107.5	53%	0.533	57%	0.568	S	S	.	*	H	α-helix	trans	-85.3	-39.7	-179	-76.1	-65.9	136.9	0	0	112.6	N308 K313 N314	N308-E310 PolarHBondContact O-N 2.86Å; E310-K313 WeakPolarHBondContact O-CB 3.25Å; E310-K313 PolarHBondContact O-N 3Å; E310-K313 VanDerWaalsContact O-N 3.15Å; E310-K313 WeakPolarHBondContact OE1-CD 3.29Å; E310-K313 IonicContact OE1-NZ 2.87Å; E310-K313 PolarHBondContact OE1-NZ 2.93Å; E310-N314 PolarHBondContact O-N 3.15Å; E310-N314 VanDerWaalsContact O-N 3.14Å
311	F	64.4	Low	65.9	Low	130 Å²	130	110 Å²	110	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-59.6	-48.3	169.6	176.3	-101.8	0	0	0	110.6	K313 N314 E315	F311-K313 VanDerWaalsContact C-N 3.26Å; F311-K313 PolarHBondContact O-N 3.47Å; F311-N314 PolarHBondContact O-N 3.23Å; F311-E315 HydrophobicContact CD1-CG 4.22Å; F311-E315 HydrophobicContact CD2-CG 4.3Å; F311-E315 HydrophobicContact CE1-CG 3.78Å; F311-E315 HydrophobicContact CE2-CG 3.87Å; F311-E315 HydrophobicContact CG-CG 4.46Å; F311-E315 HydrophobicContact CZ-CG 3.59Å; F311-E315 WeakPolarHBondContact O-CB 3.39Å; F311-E315 WeakPolarHBondContact O-CG 3.31Å; F311-E315 PolarHBondContact O-N 2.89Å
312	F	59	Low	67.3	Low	116 Å²	116	109.3 Å²	109.3	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-66.5	-26.9	176	-75	-110.4	0	0	0	111.7	N308 L316	N308-F312 HydrophobicContact CB-CD2 3.4Å; N308-F312 HydrophobicContact CB-CE2 3.29Å; N308-F312 HydrophobicContact CB-CG 4.36Å; N308-F312 HydrophobicContact CB-CZ 4.22Å; N308-F312 WeakPolarHBondContact O-CB 3.43Å; N308-F312 WeakPolarHBondContact O-CD2 3.37Å; N308-F312 WeakPolarHBondContact O-CG 3.36Å; N308-F312 PolarHBondContact O-N 3.39Å; F312-L316 WeakPolarHBondContact O-CA 3.41Å; F312-L316 WeakPolarHBondContact O-CB 3.03Å; F312-L316 PolarHBondContact O-N 3.23Å
313	K	71.6	Confident	69.1	Low	120 Å²	120	105 Å²	105	52%	0.522	53%	0.534	S	S	.	.	H	α-helix	trans	-65.2	-45.8	173.5	-121	-178.4	-173	171.8	0	112.2	R309 E310 F311 A317	R309-K313 VanDerWaalsContact O-CB 3.31Å; R309-K313 WeakPolarHBondContact O-CB 3.43Å; R309-K313 PolarHBondContact O-N 3.41Å; E310-K313 WeakPolarHBondContact O-CB 3.25Å; E310-K313 PolarHBondContact O-N 3Å; E310-K313 VanDerWaalsContact O-N 3.15Å; E310-K313 WeakPolarHBondContact OE1-CD 3.29Å; E310-K313 IonicContact OE1-NZ 2.87Å; E310-K313 PolarHBondContact OE1-NZ 2.93Å; F311-K313 VanDerWaalsContact C-N 3.26Å; F311-K313 PolarHBondContact O-N 3.47Å; K313-A317 WeakPolarHBondContact O-CB 3.48Å; K313-A317 PolarHBondContact O-N 3.37Å
314	N	73.3	Confident	71.4	Confident	107 Å²	107	105.7 Å²	105.7	57%	0.572	53%	0.525	S	S	*	.	H	α-helix	trans	-71.6	-43.6	-179.4	-76.9	-15.7	0	0	0	111.2	E310 F311 L316 A317 L318	E310-N314 PolarHBondContact O-N 3.15Å; E310-N314 VanDerWaalsContact O-N 3.14Å; F311-N314 PolarHBondContact O-N 3.23Å; N314-L316 VanDerWaalsContact C-N 3.33Å; N314-A317 PolarHBondContact O-N 2.87Å; N314-L318 PolarHBondContact O-N 3.36Å
315	E	76.9	Confident	73.2	Confident	95 Å²	95	106 Å²	106	44%	0.444	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-37.3	173.3	-70.4	-63.3	120	0	0	111.5	F311 L318 A319	F311-E315 HydrophobicContact CD1-CG 4.22Å; F311-E315 HydrophobicContact CD2-CG 4.3Å; F311-E315 HydrophobicContact CE1-CG 3.78Å; F311-E315 HydrophobicContact CE2-CG 3.87Å; F311-E315 HydrophobicContact CG-CG 4.46Å; F311-E315 HydrophobicContact CZ-CG 3.59Å; F311-E315 WeakPolarHBondContact O-CB 3.39Å; F311-E315 WeakPolarHBondContact O-CG 3.31Å; F311-E315 PolarHBondContact O-N 2.89Å; E315-L318 PolarHBondContact O-N 3.02Å; E315-A319 WeakPolarHBondContact O-CB 3.33Å; E315-A319 PolarHBondContact O-N 2.96Å
316	L	75	Confident	75.3	Confident	105 Å²	105	106.7 Å²	106.7	55%	0.55	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-38.3	173	-175.5	109.7	0	0	0	110.7	F312 N314 I320	F312-L316 WeakPolarHBondContact O-CA 3.41Å; F312-L316 WeakPolarHBondContact O-CB 3.03Å; F312-L316 PolarHBondContact O-N 3.23Å; N314-L316 VanDerWaalsContact C-N 3.33Å; L316-I320 HydrophobicContact CD2-CD1 3.64Å; L316-I320 HydrophobicContact CG-CD1 3.74Å; L316-I320 HydrophobicContact CG-CG1 4.29Å; L316-I320 WeakPolarHBondContact O-CB 3.27Å; L316-I320 WeakPolarHBondContact O-CD1 3.21Å; L316-I320 WeakPolarHBondContact O-CG1 3.35Å; L316-I320 PolarHBondContact O-N 3.44Å
317	A	83	Confident	77.3	Confident	55 Å²	55	111.7 Å²	111.7	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-42	175.5	0	0	0	0	0	111.8	K313 N314 R321	K313-A317 WeakPolarHBondContact O-CB 3.48Å; K313-A317 PolarHBondContact O-N 3.37Å; N314-A317 PolarHBondContact O-N 2.87Å; A317-R321 WeakPolarHBondContact O-CB 3.34Å; A317-R321 PolarHBondContact O-N 2.92Å
318	L	85.4	Confident	79.3	Confident	80 Å²	80	107.4 Å²	107.4	42%	0.419	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-47.9	173.8	-74.3	173.2	0	0	0	111.6	N314 E315 I320 R321 D322	N314-L318 PolarHBondContact O-N 3.36Å; E315-L318 PolarHBondContact O-N 3.02Å; L318-I320 VanDerWaalsContact C-N 3.33Å; L318-I320 PolarHBondContact O-N 2.78Å; L318-R321 CarbonylContact O-C 3.49Å; L318-R321 WeakPolarHBondContact O-CA 3.43Å; L318-R321 WeakPolarHBondContact O-CB 3.46Å; L318-R321 PolarHBondContact O-N 2.76Å; L318-D322 PolarHBondContact O-N 2.76Å
319	A	86.5	Confident	81.3	Confident	45 Å²	45	107 Å²	107	37%	0.372	52%	0.516	S	S	.	.	H	α-helix	trans	-60.4	-41.1	175.9	0	0	0	0	0	111.7	E315 R321 D322 I323	E315-A319 WeakPolarHBondContact O-CB 3.33Å; E315-A319 PolarHBondContact O-N 2.96Å; A319-R321 VanDerWaalsContact C-N 3.32Å; A319-R321 PolarHBondContact O-N 3.5Å; A319-D322 PolarHBondContact O-N 2.89Å; A319-I323 VanDerWaalsContact O-CB 3.28Å; A319-I323 WeakPolarHBondContact O-CB 3.22Å; A319-I323 WeakPolarHBondContact O-CD1 3.46Å; A319-I323 WeakPolarHBondContact O-CG1 3.28Å; A319-I323 PolarHBondContact O-N 2.8Å
320	I	85.7	Confident	83	Confident	70 Å²	70	102.6 Å²	102.6	36%	0.359	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-41.8	174	-74.4	165.8	0	0	0	110.4	L316 L318 R324	L316-I320 HydrophobicContact CD2-CD1 3.64Å; L316-I320 HydrophobicContact CG-CD1 3.74Å; L316-I320 HydrophobicContact CG-CG1 4.29Å; L316-I320 WeakPolarHBondContact O-CB 3.27Å; L316-I320 WeakPolarHBondContact O-CD1 3.21Å; L316-I320 WeakPolarHBondContact O-CG1 3.35Å; L316-I320 PolarHBondContact O-N 3.44Å; L318-I320 VanDerWaalsContact C-N 3.33Å; L318-I320 PolarHBondContact O-N 2.78Å; I320-R324 WeakPolarHBondContact O-CB 3.41Å; I320-R324 WeakPolarHBondContact O-CG 3.32Å; I320-R324 PolarHBondContact O-N 2.86Å
321	R	89.9	Confident	84.5	Confident	136 Å²	136	98.9 Å²	98.9	51%	0.513	49%	0.492	S	S	.	.	H	α-helix	trans	-64.4	-42.8	177.3	-171.6	-164.8	68.3	153.6	2.5	111.1	A317 L318 A319 R324 N325	A317-R321 WeakPolarHBondContact O-CB 3.34Å; A317-R321 PolarHBondContact O-N 2.92Å; L318-R321 CarbonylContact O-C 3.49Å; L318-R321 WeakPolarHBondContact O-CA 3.43Å; L318-R321 WeakPolarHBondContact O-CB 3.46Å; L318-R321 PolarHBondContact O-N 2.76Å; A319-R321 VanDerWaalsContact C-N 3.32Å; A319-R321 PolarHBondContact O-N 3.5Å; R321-R324 WeakPolarHBondContact O-CB 3.48Å; R321-R324 PolarHBondContact O-N 3.14Å; R321-N325 VanDerWaalsContact O-CG 3.23Å; R321-N325 PolarHBondContact O-N 2.77Å; R321-N325 PolarHBondContact O-ND2 2.83Å
322	D	91.3	Very high	86	Confident	71 Å²	71	97.3 Å²	97.3	38%	0.38	49%	0.493	S	S	.	.	H	α-helix	trans	-71.9	-40.4	-179.2	-66.1	-6.7	0	0	0	111.1	L318 A319 R324 N325 E326	L318-D322 PolarHBondContact O-N 2.76Å; A319-D322 PolarHBondContact O-N 2.89Å; D322-R324 VanDerWaalsContact C-N 3.29Å; D322-R324 PolarHBondContact O-N 3.18Å; D322-N325 WeakPolarHBondContact O-CB 3.48Å; D322-N325 PolarHBondContact O-N 3.46Å; D322-N325 VanDerWaalsContact O-N 3.11Å; D322-E326 PolarHBondContact O-N 2.83Å
323	I	91.2	Very high	87.7	Confident	106 Å²	106	96.5 Å²	96.5	54%	0.544	49%	0.491	S	S	.	.	H	α-helix	trans	-58.2	-41.8	169.9	-71.1	164.1	0	0	0	110.8	A319 E326 Y327	A319-I323 VanDerWaalsContact O-CB 3.28Å; A319-I323 WeakPolarHBondContact O-CB 3.22Å; A319-I323 WeakPolarHBondContact O-CD1 3.46Å; A319-I323 WeakPolarHBondContact O-CG1 3.28Å; A319-I323 PolarHBondContact O-N 2.8Å; I323-E326 PolarHBondContact O-N 2.79Å; I323-Y327 WeakPolarHBondContact O-CB 3.33Å; I323-Y327 PolarHBondContact O-N 2.67Å
324	R	91.3	Very high	88.7	Confident	168 Å²	168	95.5 Å²	95.5	63%	0.634	49%	0.491	S	S	*	.	H	α-helix	trans	-62.6	-43.3	175.4	-77.9	173.5	-179.5	-166.7	1.2	111.4	I320 R321 D322 Y327 D328	I320-R324 WeakPolarHBondContact O-CB 3.41Å; I320-R324 WeakPolarHBondContact O-CG 3.32Å; I320-R324 PolarHBondContact O-N 2.86Å; R321-R324 WeakPolarHBondContact O-CB 3.48Å; R321-R324 PolarHBondContact O-N 3.14Å; D322-R324 VanDerWaalsContact C-N 3.29Å; D322-R324 PolarHBondContact O-N 3.18Å; R324-Y327 PolarHBondContact O-N 2.82Å; R324-D328 WeakPolarHBondContact O-CB 3.32Å; R324-D328 PolarHBondContact O-N 2.81Å
325	N	93.9	Very high	89.7	Confident	87 Å²	87	96.7 Å²	96.7	47%	0.465	49%	0.491	S	S	.	.	H	α-helix	trans	-65.4	-42.2	177.5	-67.2	-22.6	0	0	0	112.1	R321 D322 D328 A329	R321-N325 VanDerWaalsContact O-CG 3.23Å; R321-N325 PolarHBondContact O-N 2.77Å; R321-N325 PolarHBondContact O-ND2 2.83Å; D322-N325 WeakPolarHBondContact O-CB 3.48Å; D322-N325 PolarHBondContact O-N 3.46Å; D322-N325 VanDerWaalsContact O-N 3.11Å; N325-D328 PolarHBondContact O-N 3.3Å; N325-A329 WeakPolarHBondContact O-CB 3.35Å; N325-A329 PolarHBondContact O-N 3.01Å
326	E	94.3	Very high	90.6	Very high	133 Å²	133	94.9 Å²	94.9	62%	0.621	49%	0.489	S	S	*	.	H	α-helix	trans	-65.1	-44	175.5	-74.8	-171.6	170.1	0	0	111.5	D322 I323 D328 A329 I330	D322-E326 PolarHBondContact O-N 2.83Å; I323-E326 PolarHBondContact O-N 2.79Å; E326-D328 VanDerWaalsContact C-N 3.33Å; E326-D328 PolarHBondContact O-N 2.89Å; E326-A329 PolarHBondContact O-N 3.39Å; E326-I330 WeakPolarHBondContact O-CB 3.4Å; E326-I330 VanDerWaalsContact O-CG1 3.28Å; E326-I330 WeakPolarHBondContact O-CG1 3.11Å; E326-I330 PolarHBondContact O-N 3.09Å
327	Y	90.9	Very high	91.5	Very high	164 Å²	164	93.7 Å²	93.7	64%	0.643	48%	0.483	S	S	*	.	H	α-helix	trans	-62.4	-41.3	176.2	-171.5	-91.5	0	0	0	111.5	I323 R324 I330 S331	I323-Y327 WeakPolarHBondContact O-CB 3.33Å; I323-Y327 PolarHBondContact O-N 2.67Å; R324-Y327 PolarHBondContact O-N 2.82Å; Y327-I330 PolarHBondContact O-N 3.42Å; Y327-S331 WeakPolarHBondContact O-CB 3.37Å; Y327-S331 PolarHBondContact O-N 2.92Å
328	D	94.1	Very high	91.8	Very high	100 Å²	100	95.7 Å²	95.7	54%	0.535	48%	0.484	S	S	.	.	H	α-helix	trans	-64	-41.8	174.4	-83.7	-10.6	0	0	0	111.4	R324 N325 E326 S331 V332	R324-D328 WeakPolarHBondContact O-CB 3.32Å; R324-D328 PolarHBondContact O-N 2.81Å; N325-D328 PolarHBondContact O-N 3.3Å; E326-D328 VanDerWaalsContact C-N 3.33Å; E326-D328 PolarHBondContact O-N 2.89Å; D328-S331 PolarHBondContact O-N 3.44Å; D328-V332 WeakPolarHBondContact O-CG2 3.33Å; D328-V332 PolarHBondContact O-N 3.37Å
329	A	93.5	Very high	92.3	Very high	61 Å²	61	96.4 Å²	96.4	50%	0.504	49%	0.488	S	S	.	.	H	α-helix	trans	-63.2	-46.2	175.9	0	0	0	0	0	112.2	N325 E326 S331 V332 Q333	N325-A329 WeakPolarHBondContact O-CB 3.35Å; N325-A329 PolarHBondContact O-N 3.01Å; E326-A329 PolarHBondContact O-N 3.39Å; A329-S331 VanDerWaalsContact C-N 3.33Å; A329-S331 PolarHBondContact O-N 3.34Å; A329-V332 PolarHBondContact O-N 3.34Å; A329-Q333 WeakPolarHBondContact O-CB 3.43Å; A329-Q333 PolarHBondContact O-N 2.82Å
330	I	93.1	Very high	92.7	Very high	92 Å²	92	96.8 Å²	96.8	47%	0.472	49%	0.489	S	S	.	.	H	α-helix	trans	-63	-40.9	175.6	-67.2	165.2	0	0	0	110.4	E326 Y327 V332 Q333 N334	E326-I330 WeakPolarHBondContact O-CB 3.4Å; E326-I330 VanDerWaalsContact O-CG1 3.28Å; E326-I330 WeakPolarHBondContact O-CG1 3.11Å; E326-I330 PolarHBondContact O-N 3.09Å; Y327-I330 PolarHBondContact O-N 3.42Å; I330-V332 PolarHBondContact O-N 3.42Å; I330-Q333 PolarHBondContact O-N 2.97Å; I330-N334 VanDerWaalsContact O-CB 3.27Å; I330-N334 WeakPolarHBondContact O-CB 3.21Å; I330-N334 VanDerWaalsContact O-CG 3.28Å; I330-N334 PolarHBondContact O-N 3.3Å
331	S	91.4	Very high	93.1	Very high	35 Å²	35	100.3 Å²	100.3	25%	0.245	50%	0.497	C	S	.	.	H	α-helix	trans	-62.7	-41.8	177.2	-175.5	0	0	0	0	111.8	Y327 D328 A329 K335	Y327-S331 WeakPolarHBondContact O-CB 3.37Å; Y327-S331 PolarHBondContact O-N 2.92Å; D328-S331 PolarHBondContact O-N 3.44Å; A329-S331 VanDerWaalsContact C-N 3.33Å; A329-S331 PolarHBondContact O-N 3.34Å; S331-K335 WeakPolarHBondContact O-CB 3.23Å; S331-K335 VanDerWaalsContact O-CG 3.26Å; S331-K335 WeakPolarHBondContact O-CG 3.04Å; S331-K335 PolarHBondContact O-N 2.83Å; S331-K335 VanDerWaalsContact O-N 3.1Å
332	V	95	Very high	93.3	Very high	98 Å²	98	100 Å²	100	59%	0.594	50%	0.497	S	S	*	.	H	α-helix	trans	-66	-44.8	174.1	170.9	0	0	0	0	111.2	D328 A329 I330 K335 S336	D328-V332 WeakPolarHBondContact O-CG2 3.33Å; D328-V332 PolarHBondContact O-N 3.37Å; A329-V332 PolarHBondContact O-N 3.34Å; I330-V332 PolarHBondContact O-N 3.42Å; V332-K335 PolarHBondContact O-N 2.89Å; V332-S336 PolarHBondContact O-N 3.48Å
333	Q	94.6	Very high	93.5	Very high	99 Å²	99	103.5 Å²	103.5	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-49.2	178	-177.5	61	24.1	0	0	111.5	A329 I330 K335 S336 D337	A329-Q333 WeakPolarHBondContact O-CB 3.43Å; A329-Q333 PolarHBondContact O-N 2.82Å; I330-Q333 PolarHBondContact O-N 2.97Å; Q333-K335 VanDerWaalsContact C-N 3.28Å; Q333-K335 PolarHBondContact O-N 2.94Å; Q333-S336 WeakPolarHBondContact O-CB 3.4Å; Q333-S336 PolarHBondContact O-N 2.95Å; Q333-D337 PolarHBondContact NE2-OD1 2.93Å; Q333-D337 PolarHBondContact NE2-OD2 3Å; Q333-D337 WeakPolarHBondContact O-CB 3.4Å; Q333-D337 PolarHBondContact O-N 3.4Å
334	N	92.3	Very high	93.6	Very high	98 Å²	98	103.8 Å²	103.8	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-57.8	-40.4	176.9	-78.2	-7.6	0	0	0	111.7	I330 M338	I330-N334 VanDerWaalsContact O-CB 3.27Å; I330-N334 WeakPolarHBondContact O-CB 3.21Å; I330-N334 VanDerWaalsContact O-CG 3.28Å; I330-N334 PolarHBondContact O-N 3.3Å; N334-M338 WeakPolarHBondContact O-CB 3.34Å; N334-M338 PolarHBondContact O-N 3.02Å
335	K	94.5	Very high	93.8	Very high	132 Å²	132	99.7 Å²	99.7	57%	0.574	50%	0.498	S	S	*	.	H	α-helix	trans	-64	-45.3	174.3	-74.9	170.6	-171.9	171.1	0	111.6	S331 V332 Q333 M338 D339	S331-K335 WeakPolarHBondContact O-CB 3.23Å; S331-K335 VanDerWaalsContact O-CG 3.26Å; S331-K335 WeakPolarHBondContact O-CG 3.04Å; S331-K335 PolarHBondContact O-N 2.83Å; S331-K335 VanDerWaalsContact O-N 3.1Å; V332-K335 PolarHBondContact O-N 2.89Å; Q333-K335 VanDerWaalsContact C-N 3.28Å; Q333-K335 PolarHBondContact O-N 2.94Å; K335-M338 PolarHBondContact O-N 3.36Å; K335-D339 WeakPolarHBondContact O-CB 3.48Å; K335-D339 PolarHBondContact O-N 3.4Å
336	S	94.9	Very high	93.8	Very high	57 Å²	57	99.1 Å²	99.1	40%	0.399	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-43.6	178.1	177.7	0	0	0	0	112.5	V332 Q333 D339 S340	V332-S336 PolarHBondContact O-N 3.48Å; Q333-S336 WeakPolarHBondContact O-CB 3.4Å; Q333-S336 PolarHBondContact O-N 2.95Å; S336-D339 PolarHBondContact O-N 2.79Å; S336-S340 WeakPolarHBondContact O-CB 3.41Å; S336-S340 PolarHBondContact O-N 3.2Å; S336-S340 PolarHBondContact O-OG 3.26Å
337	D	93.9	Very high	93.8	Very high	80 Å²	80	98.3 Å²	98.3	43%	0.428	49%	0.493	S	S	.	.	H	α-helix	trans	-68.5	-42.1	179.1	-69.9	-17.9	0	0	0	110.9	Q333 S340 W341	Q333-D337 PolarHBondContact NE2-OD1 2.93Å; Q333-D337 PolarHBondContact NE2-OD2 3Å; Q333-D337 WeakPolarHBondContact O-CB 3.4Å; Q333-D337 PolarHBondContact O-N 3.4Å; D337-S340 PolarHBondContact O-N 2.98Å; D337-W341 VanDerWaalsContact O-CB 3.3Å; D337-W341 WeakPolarHBondContact O-CB 3.47Å; D337-W341 PolarHBondContact O-N 3.13Å
338	M	90.9	Very high	94	Very high	97 Å²	97	95.8 Å²	95.8	48%	0.478	49%	0.488	S	S	.	.	H	α-helix	trans	-63.2	-44.6	175.1	-167.6	66.5	66.7	0	0	111.6	N334 K335 S340 W341 Y342	N334-M338 WeakPolarHBondContact O-CB 3.34Å; N334-M338 PolarHBondContact O-N 3.02Å; K335-M338 PolarHBondContact O-N 3.36Å; M338-S340 VanDerWaalsContact C-N 3.34Å; M338-S340 PolarHBondContact O-N 2.79Å; M338-W341 PolarHBondContact O-N 3.21Å; M338-Y342 HydrophobicContact CG-CD2 3.75Å; M338-Y342 HydrophobicContact CG-CE2 3.4Å; M338-Y342 WeakPolarHBondContact O-CD2 3.02Å; M338-Y342 PolarHBondContact O-N 2.78Å; M338-Y342 HydrophobicContact SD-CD2 4.24Å; M338-Y342 HydrophobicContact SD-CE2 3.61Å
339	D	94.8	Very high	93.9	Very high	95 Å²	95	95.9 Å²	95.9	51%	0.508	49%	0.487	S	S	.	.	H	α-helix	trans	-62.3	-41.2	175.2	-83.9	-12	0	0	0	111.7	K335 S336 K343	K335-D339 WeakPolarHBondContact O-CB 3.48Å; K335-D339 PolarHBondContact O-N 3.4Å; S336-D339 PolarHBondContact O-N 2.79Å; D339-K343 WeakPolarHBondContact O-CB 3.39Å; D339-K343 VanDerWaalsContact O-CG 3.23Å; D339-K343 WeakPolarHBondContact O-CG 3.48Å; D339-K343 PolarHBondContact O-N 2.84Å
340	S	94.5	Very high	93.9	Very high	54 Å²	54	99 Å²	99	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-66.7	-41.7	177.4	-61.1	0	0	0	0	111.5	S336 D337 M338 K343 L344	S336-S340 WeakPolarHBondContact O-CB 3.41Å; S336-S340 PolarHBondContact O-N 3.2Å; S336-S340 PolarHBondContact O-OG 3.26Å; D337-S340 PolarHBondContact O-N 2.98Å; M338-S340 VanDerWaalsContact C-N 3.34Å; M338-S340 PolarHBondContact O-N 2.79Å; S340-K343 PolarHBondContact O-N 2.89Å; S340-L344 WeakPolarHBondContact O-CG 3.4Å; S340-L344 PolarHBondContact O-N 2.74Å
341	W	94.9	Very high	93.8	Very high	143 Å²	143	97.6 Å²	97.6	54%	0.542	49%	0.487	S	S	.	.	H	α-helix	trans	-63	-47.8	175.6	-175.6	86.2	0	0	0	111.5	D337 M338 K343 L344 K345	D337-W341 VanDerWaalsContact O-CB 3.3Å; D337-W341 WeakPolarHBondContact O-CB 3.47Å; D337-W341 PolarHBondContact O-N 3.13Å; M338-W341 PolarHBondContact O-N 3.21Å; W341-K343 VanDerWaalsContact C-N 3.34Å; W341-K343 PolarHBondContact O-N 2.75Å; W341-L344 PolarHBondContact O-N 2.83Å; W341-K345 WeakPolarHBondContact O-CB 3.41Å; W341-K345 PolarHBondContact O-N 2.87Å
342	Y	93.6	Very high	93.8	Very high	129 Å²	129	98.6 Å²	98.6	51%	0.506	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-40.4	176	-78.5	-56.7	0	0	0	112	M338 K345 V346	M338-Y342 HydrophobicContact CG-CD2 3.75Å; M338-Y342 HydrophobicContact CG-CE2 3.4Å; M338-Y342 WeakPolarHBondContact O-CD2 3.02Å; M338-Y342 PolarHBondContact O-N 2.78Å; M338-Y342 HydrophobicContact SD-CD2 4.24Å; M338-Y342 HydrophobicContact SD-CE2 3.61Å; Y342-K345 PolarHBondContact O-N 2.82Å; Y342-V346 WeakPolarHBondContact O-CB 3.4Å; Y342-V346 VanDerWaalsContact O-CG2 3.23Å; Y342-V346 WeakPolarHBondContact O-CG2 3.49Å; Y342-V346 PolarHBondContact O-N 2.8Å
343	K	95.8	Very high	93.6	Very high	145 Å²	145	97 Å²	97	63%	0.63	49%	0.49	S	S	*	.	H	α-helix	trans	-60.5	-48.2	174.7	-78.4	171.1	-176.7	170.2	0	112.1	D339 S340 W341 V346 Q347	D339-K343 WeakPolarHBondContact O-CB 3.39Å; D339-K343 VanDerWaalsContact O-CG 3.23Å; D339-K343 WeakPolarHBondContact O-CG 3.48Å; D339-K343 PolarHBondContact O-N 2.84Å; S340-K343 PolarHBondContact O-N 2.89Å; W341-K343 VanDerWaalsContact C-N 3.34Å; W341-K343 PolarHBondContact O-N 2.75Å; K343-V346 PolarHBondContact O-N 2.87Å; K343-Q347 WeakPolarHBondContact O-CB 3.46Å; K343-Q347 PolarHBondContact O-N 3.1Å
344	L	94.6	Very high	93.5	Very high	112 Å²	112	94.7 Å²	94.7	59%	0.586	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-43.3	177.4	-75.8	172.3	0	0	0	111.5	S340 W341 V346 Q347 E348	S340-L344 WeakPolarHBondContact O-CG 3.4Å; S340-L344 PolarHBondContact O-N 2.74Å; W341-L344 PolarHBondContact O-N 2.83Å; L344-V346 PolarHBondContact O-N 2.93Å; L344-Q347 PolarHBondContact O-N 2.79Å; L344-E348 WeakPolarHBondContact O-CB 3.41Å; L344-E348 PolarHBondContact O-N 2.93Å
345	K	95.3	Very high	93.5	Very high	82 Å²	82	98.1 Å²	98.1	36%	0.357	49%	0.494	S	S	.	.	H	α-helix	trans	-65.1	-41.3	179.8	-165.4	71.3	-158.6	163.9	0	112.1	W341 Y342 E348 I349	W341-K345 WeakPolarHBondContact O-CB 3.41Å; W341-K345 PolarHBondContact O-N 2.87Å; Y342-K345 PolarHBondContact O-N 2.82Å; K345-E348 IonicContact NZ-OE1 3.69Å; K345-E348 IonicContact NZ-OE2 2.88Å; K345-E348 PolarHBondContact NZ-OE2 2.93Å; K345-E348 PolarHBondContact O-N 2.96Å; K345-I349 HydrophobicContact CG-CD1 4.24Å; K345-I349 VanDerWaalsContact O-CG1 3.28Å; K345-I349 WeakPolarHBondContact O-CG1 3.43Å; K345-I349 PolarHBondContact O-N 3.09Å
346	V	94.2	Very high	93.4	Very high	75 Å²	75	98.1 Å²	98.1	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-43.7	173.9	170.2	0	0	0	0	110.8	Y342 K343 L344 I349 Q350	Y342-V346 WeakPolarHBondContact O-CB 3.4Å; Y342-V346 VanDerWaalsContact O-CG2 3.23Å; Y342-V346 WeakPolarHBondContact O-CG2 3.49Å; Y342-V346 PolarHBondContact O-N 2.8Å; K343-V346 PolarHBondContact O-N 2.87Å; L344-V346 PolarHBondContact O-N 2.93Å; V346-I349 PolarHBondContact O-N 3.03Å; V346-Q350 HydrophobicContact CG1-CG 4.4Å; V346-Q350 WeakPolarHBondContact O-CB 3.32Å; V346-Q350 VanDerWaalsContact O-CG 3.27Å; V346-Q350 WeakPolarHBondContact O-CG 3.26Å; V346-Q350 PolarHBondContact O-N 3.46Å
347	Q	94.3	Very high	93.3	Very high	116 Å²	116	99.9 Å²	99.9	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-63.5	-40.8	177.2	-173.7	-179.3	-0.7	0	0	112.3	K343 L344 Q350 T351	K343-Q347 WeakPolarHBondContact O-CB 3.46Å; K343-Q347 PolarHBondContact O-N 3.1Å; L344-Q347 PolarHBondContact O-N 2.79Å; Q347-Q350 PolarHBondContact O-N 3Å; Q347-T351 WeakPolarHBondContact O-CB 3.44Å; Q347-T351 PolarHBondContact O-N 2.91Å; Q347-T351 PolarHBondContact O-OG1 2.96Å
348	E	93.3	Very high	93.2	Very high	112 Å²	112	102.3 Å²	102.3	52%	0.523	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-48.4	175.3	-172.3	-169.2	-177	0	0	111.1	L344 K345 Q350 T351 A352	L344-E348 WeakPolarHBondContact O-CB 3.41Å; L344-E348 PolarHBondContact O-N 2.93Å; K345-E348 IonicContact NZ-OE1 3.69Å; K345-E348 IonicContact NZ-OE2 2.88Å; K345-E348 PolarHBondContact NZ-OE2 2.93Å; K345-E348 PolarHBondContact O-N 2.96Å; E348-Q350 VanDerWaalsContact C-N 3.34Å; E348-Q350 PolarHBondContact O-N 3.44Å; E348-T351 PolarHBondContact O-N 2.83Å; E348-A352 WeakPolarHBondContact O-CB 3.37Å; E348-A352 PolarHBondContact O-N 3.05Å
349	I	92.5	Very high	93.3	Very high	101 Å²	101	103.3 Å²	103.3	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-60.3	-44.8	176.7	-69.1	167	0	0	0	110.6	K345 V346 T351 A352 S353	K345-I349 HydrophobicContact CG-CD1 4.24Å; K345-I349 VanDerWaalsContact O-CG1 3.28Å; K345-I349 WeakPolarHBondContact O-CG1 3.43Å; K345-I349 PolarHBondContact O-N 3.09Å; V346-I349 PolarHBondContact O-N 3.03Å; I349-T351 VanDerWaalsContact C-N 3.34Å; I349-T351 PolarHBondContact O-N 3.18Å; I349-A352 PolarHBondContact O-N 3.46Å; I349-S353 WeakPolarHBondContact O-CB 3.39Å; I349-S353 PolarHBondContact O-N 2.9Å
350	Q	93	Very high	93.2	Very high	127 Å²	127	101.4 Å²	101.4	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-61.7	-41.9	176.4	-75.7	176.6	-3.1	0	0	111.8	V346 Q347 E348 A354	V346-Q350 HydrophobicContact CG1-CG 4.4Å; V346-Q350 WeakPolarHBondContact O-CB 3.32Å; V346-Q350 VanDerWaalsContact O-CG 3.27Å; V346-Q350 WeakPolarHBondContact O-CG 3.26Å; V346-Q350 PolarHBondContact O-N 3.46Å; Q347-Q350 PolarHBondContact O-N 3Å; E348-Q350 VanDerWaalsContact C-N 3.34Å; E348-Q350 PolarHBondContact O-N 3.44Å; Q350-A354 VanDerWaalsContact O-CB 3.27Å; Q350-A354 WeakPolarHBondContact O-CB 3.4Å; Q350-A354 PolarHBondContact O-N 3.37Å
351	T	91.5	Very high	93.3	Very high	62 Å²	62	100.6 Å²	100.6	38%	0.38	51%	0.51	S	S	.	.	H	α-helix	trans	-68.2	-43.8	179.1	-55.4	0	0	0	0	111.6	Q347 E348 I349 A354 R355	Q347-T351 WeakPolarHBondContact O-CB 3.44Å; Q347-T351 PolarHBondContact O-N 2.91Å; Q347-T351 PolarHBondContact O-OG1 2.96Å; E348-T351 PolarHBondContact O-N 2.83Å; I349-T351 VanDerWaalsContact C-N 3.34Å; I349-T351 PolarHBondContact O-N 3.18Å; T351-A354 PolarHBondContact O-N 2.99Å; T351-R355 VanDerWaalsContact O-CG 3.32Å; T351-R355 WeakPolarHBondContact O-CG 3.34Å; T351-R355 PolarHBondContact O-N 3.18Å
352	A	92	Very high	93.2	Very high	56 Å²	56	101.6 Å²	101.6	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-44.9	176.2	0	0	0	0	0	111.2	E348 I349 A354 R355 Q356	E348-A352 WeakPolarHBondContact O-CB 3.37Å; E348-A352 PolarHBondContact O-N 3.05Å; I349-A352 PolarHBondContact O-N 3.46Å; A352-A354 PolarHBondContact O-N 3.5Å; A352-R355 PolarHBondContact O-N 3.44Å; A352-Q356 WeakPolarHBondContact O-CB 3.4Å; A352-Q356 PolarHBondContact O-N 3.31Å
353	S	89.6	Confident	93.2	Very high	65 Å²	65	100.4 Å²	100.4	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-61.6	-41.3	175.3	-175.5	0	0	0	0	112	I349 T357	I349-S353 WeakPolarHBondContact O-CB 3.39Å; I349-S353 PolarHBondContact O-N 2.9Å; S353-T357 WeakPolarHBondContact O-CB 3.42Å; S353-T357 PolarHBondContact O-N 2.94Å; S353-T357 PolarHBondContact O-OG1 3.43Å
354	A	92.5	Very high	93.2	Very high	50 Å²	50	100.5 Å²	100.5	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-64.6	-44.9	176.5	0	0	0	0	0	111.6	Q350 T351 A352 T357 M358	Q350-A354 VanDerWaalsContact O-CB 3.27Å; Q350-A354 WeakPolarHBondContact O-CB 3.4Å; Q350-A354 PolarHBondContact O-N 3.37Å; T351-A354 PolarHBondContact O-N 2.99Å; A352-A354 PolarHBondContact O-N 3.5Å; A354-T357 PolarHBondContact O-N 2.98Å; A354-M358 WeakPolarHBondContact O-CG 3.38Å; A354-M358 PolarHBondContact O-N 2.79Å
355	R	93.1	Very high	93.2	Very high	170 Å²	170	100.6 Å²	100.6	64%	0.642	51%	0.512	S	S	*	.	H	α-helix	trans	-60.3	-48.8	175.2	-74.2	177.5	-178.5	-146	2.3	112	T351 A352 T357 M358 E359	T351-R355 VanDerWaalsContact O-CG 3.32Å; T351-R355 WeakPolarHBondContact O-CG 3.34Å; T351-R355 PolarHBondContact O-N 3.18Å; A352-R355 PolarHBondContact O-N 3.44Å; R355-T357 VanDerWaalsContact C-N 3.28Å; R355-T357 PolarHBondContact O-N 2.75Å; R355-M358 HydrophobicContact CG-CE 4.38Å; R355-M358 PolarHBondContact O-N 3.48Å; R355-E359 PolarHBondContact O-N 2.9Å
356	Q	92	Very high	93.2	Very high	132 Å²	132	99.5 Å²	99.5	62%	0.617	51%	0.508	S	S	*	.	H	α-helix	trans	-61	-38.3	178.5	-172.2	174.5	30.5	0	0	111.9	A352 T360	A352-Q356 WeakPolarHBondContact O-CB 3.4Å; A352-Q356 PolarHBondContact O-N 3.31Å; Q356-T360 VanDerWaalsContact O-CB 3.3Å; Q356-T360 WeakPolarHBondContact O-CB 3.14Å; Q356-T360 PolarHBondContact O-N 3.22Å; Q356-T360 PolarHBondContact O-OG1 2.83Å
357	T	92.6	Very high	93.2	Very high	94 Å²	94	99 Å²	99	58%	0.577	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-44	176	-57.6	0	0	0	0	111.4	S353 A354 R355 G361	S353-T357 WeakPolarHBondContact O-CB 3.42Å; S353-T357 PolarHBondContact O-N 2.94Å; S353-T357 PolarHBondContact O-OG1 3.43Å; A354-T357 PolarHBondContact O-N 2.98Å; R355-T357 VanDerWaalsContact C-N 3.28Å; R355-T357 PolarHBondContact O-N 2.75Å; T357-G361 PolarHBondContact O-N 3.43Å
358	M	92.7	Very high	93.3	Very high	131 Å²	131	101.4 Å²	101.4	65%	0.645	51%	0.509	S	S	*	.	H	α-helix	trans	-64.2	-45.2	176.8	-71.1	-172.1	-68.8	0	0	112.2	A354 R355 G361 Y362	A354-M358 WeakPolarHBondContact O-CG 3.38Å; A354-M358 PolarHBondContact O-N 2.79Å; R355-M358 HydrophobicContact CG-CE 4.38Å; R355-M358 PolarHBondContact O-N 3.48Å; M358-G361 PolarHBondContact O-N 2.75Å; M358-Y362 PolarHBondContact O-N 3.31Å
359	E	93	Very high	93.5	Very high	118 Å²	118	100.8 Å²	100.8	55%	0.551	50%	0.502	S	S	*	.	H	α-helix	trans	-64	-43.9	178.6	-176.2	172.5	-173	0	0	111.9	R355 G361 Y362 Q363	R355-E359 PolarHBondContact O-N 2.9Å; E359-G361 VanDerWaalsContact C-N 3.26Å; E359-G361 PolarHBondContact O-N 3.07Å; E359-Y362 PolarHBondContact O-N 3.46Å; E359-Q363 WeakPolarHBondContact O-CG 3.32Å; E359-Q363 PolarHBondContact O-N 3Å
360	T	93	Very high	93.6	Very high	56 Å²	56	99.7 Å²	99.7	34%	0.344	50%	0.497	S	S	.	.	H	α-helix	trans	-61.9	-37.3	174.8	-56	0	0	0	0	111.2	Q356 K364	Q356-T360 VanDerWaalsContact O-CB 3.3Å; Q356-T360 WeakPolarHBondContact O-CB 3.14Å; Q356-T360 PolarHBondContact O-N 3.22Å; Q356-T360 PolarHBondContact O-OG1 2.83Å; T360-K364 HydrophobicContact CG2-CD 4.23Å; T360-K364 WeakPolarHBondContact O-CB 3.43Å; T360-K364 VanDerWaalsContact O-CG 3.25Å; T360-K364 WeakPolarHBondContact O-CG 3.41Å; T360-K364 PolarHBondContact O-N 3.46Å
361	G	95.4	Very high	93.8	Very high	37 Å²	37	102.6 Å²	102.6	38%	0.381	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-47.4	174.2	0	0	0	0	0	112.3	T357 M358 E359 K364 E365	T357-G361 PolarHBondContact O-N 3.43Å; M358-G361 PolarHBondContact O-N 2.75Å; E359-G361 VanDerWaalsContact C-N 3.26Å; E359-G361 PolarHBondContact O-N 3.07Å; G361-K364 PolarHBondContact O-N 3.05Å; G361-E365 PolarHBondContact O-N 3.15Å
362	Y	93.7	Very high	94	Very high	164 Å²	164	103.3 Å²	103.3	64%	0.643	51%	0.507	S	S	*	.	H	α-helix	trans	-60.6	-47.9	176.5	175.3	-101.4	0	0	0	112.2	M358 E359 K364 E365 E366	M358-Y362 PolarHBondContact O-N 3.31Å; E359-Y362 PolarHBondContact O-N 3.46Å; Y362-K364 VanDerWaalsContact C-N 3.32Å; Y362-K364 PolarHBondContact O-N 3.48Å; Y362-E365 PolarHBondContact O-N 3Å; Y362-E366 WeakPolarHBondContact O-CB 3.29Å; Y362-E366 PolarHBondContact O-N 3.37Å
363	Q	93.3	Very high	94.2	Very high	103 Å²	103	105 Å²	105	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-39.8	177.7	-70.2	178.1	-4.4	0	0	112	E359 E366 V367	E359-Q363 WeakPolarHBondContact O-CG 3.32Å; E359-Q363 PolarHBondContact O-N 3Å; Q363-E366 PolarHBondContact O-N 3.22Å; Q363-V367 WeakPolarHBondContact O-CB 3.42Å; Q363-V367 VanDerWaalsContact O-CG2 3.26Å; Q363-V367 WeakPolarHBondContact O-CG2 3.37Å; Q363-V367 PolarHBondContact O-N 2.76Å
364	K	95.9	Very high	94.4	Very high	147 Å²	147	106 Å²	106	64%	0.639	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-41.4	174.9	-79.3	175	178.8	177.8	0	112.1	T360 G361 Y362 R368	T360-K364 HydrophobicContact CG2-CD 4.23Å; T360-K364 WeakPolarHBondContact O-CB 3.43Å; T360-K364 VanDerWaalsContact O-CG 3.25Å; T360-K364 WeakPolarHBondContact O-CG 3.41Å; T360-K364 PolarHBondContact O-N 3.46Å; G361-K364 PolarHBondContact O-N 3.05Å; Y362-K364 VanDerWaalsContact C-N 3.32Å; Y362-K364 PolarHBondContact O-N 3.48Å; K364-R368 WeakPolarHBondContact O-CB 3.39Å; K364-R368 PolarHBondContact O-N 3.49Å
365	E	95	Very high	94.6	Very high	115 Å²	115	105.5 Å²	105.5	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-69.3	-39.6	178.3	-168.6	55.4	-147.5	0	0	111.8	G361 Y362 R368 R369	G361-E365 PolarHBondContact O-N 3.15Å; Y362-E365 PolarHBondContact O-N 3Å; E365-R368 WeakPolarHBondContact O-CB 3.43Å; E365-R368 PolarHBondContact O-N 3.18Å; E365-R369 WeakPolarHBondContact O-CB 3.28Å; E365-R369 PolarHBondContact O-N 3.24Å
366	E	93.8	Very high	94.7	Very high	58 Å²	58	101.8 Å²	101.8	27%	0.271	50%	0.496	S	S	.	.	H	α-helix	trans	-65.4	-42.6	175.6	-178.6	59.5	-170	0	0	111.8	Y362 Q363 R368 R369 L370	Y362-E366 WeakPolarHBondContact O-CB 3.29Å; Y362-E366 PolarHBondContact O-N 3.37Å; Q363-E366 PolarHBondContact O-N 3.22Å; E366-R368 VanDerWaalsContact C-N 3.3Å; E366-R368 PolarHBondContact O-N 3.46Å; E366-R369 PolarHBondContact O-N 2.98Å; E366-R369 IonicContact OE1-CZ 3.98Å; E366-R369 IonicContact OE1-NE 3.98Å; E366-R369 IonicContact OE1-NH2 2.75Å; E366-R369 PolarHBondContact OE1-NH2 2.86Å; E366-R369 IonicContact OE2-CZ 2.63Å; E366-R369 IonicContact OE2-NE 2.72Å; E366-R369 PolarHBondContact OE2-NE 3.43Å; E366-R369 IonicContact OE2-NH2 3.72Å; E366-R369 PolarHBondContact OE2-NH2 2.89Å; E366-L370 HydrophobicContact CG-CD1 4.32Å; E366-L370 WeakPolarHBondContact O-CB 3.36Å; E366-L370 WeakPolarHBondContact O-CG 3.45Å; E366-L370 PolarHBondContact O-N 2.91Å
367	V	94.8	Very high	94.8	Very high	64 Å²	64	100.5 Å²	100.5	39%	0.388	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-39.2	172.9	169.4	0	0	0	0	111.1	Q363 R371	Q363-V367 WeakPolarHBondContact O-CB 3.42Å; Q363-V367 VanDerWaalsContact O-CG2 3.26Å; Q363-V367 WeakPolarHBondContact O-CG2 3.37Å; Q363-V367 PolarHBondContact O-N 2.76Å; V367-R371 HydrophobicContact CG1-CG 4.47Å; V367-R371 WeakPolarHBondContact O-CB 3.5Å; V367-R371 VanDerWaalsContact O-CG 3.27Å; V367-R371 WeakPolarHBondContact O-CG 3.28Å; V367-R371 PolarHBondContact O-N 3.1Å
368	R	97.5	Very high	95	Very high	167 Å²	167	103.5 Å²	103.5	63%	0.63	49%	0.494	S	S	*	.	H	α-helix	trans	-61.9	-48.5	175	-176	-173.7	179.3	111.9	2.3	110.8	K364 E365 E366 L370 R371 T372	K364-R368 WeakPolarHBondContact O-CB 3.39Å; K364-R368 PolarHBondContact O-N 3.49Å; E365-R368 WeakPolarHBondContact O-CB 3.43Å; E365-R368 PolarHBondContact O-N 3.18Å; E366-R368 VanDerWaalsContact C-N 3.3Å; E366-R368 PolarHBondContact O-N 3.46Å; R368-L370 PolarHBondContact O-N 3.38Å; R368-R371 PolarHBondContact O-N 3.41Å; R368-T372 PolarHBondContact O-N 3.31Å; R368-T372 PolarHBondContact O-OG1 3.07Å
369	R	96.2	Very high	95.1	Very high	100 Å²	100	98.9 Å²	98.9	38%	0.377	48%	0.479	S	S	.	.	H	α-helix	trans	-58	-48.6	177.6	-170	-171.9	71.3	74.4	1	111.8	E365 E366 R371 T372 Q373	E365-R369 WeakPolarHBondContact O-CB 3.28Å; E365-R369 PolarHBondContact O-N 3.24Å; E366-R369 PolarHBondContact O-N 2.98Å; E366-R369 IonicContact OE1-CZ 3.98Å; E366-R369 IonicContact OE1-NE 3.98Å; E366-R369 IonicContact OE1-NH2 2.75Å; E366-R369 PolarHBondContact OE1-NH2 2.86Å; E366-R369 IonicContact OE2-CZ 2.63Å; E366-R369 IonicContact OE2-NE 2.72Å; E366-R369 PolarHBondContact OE2-NE 3.43Å; E366-R369 IonicContact OE2-NH2 3.72Å; E366-R369 PolarHBondContact OE2-NH2 2.89Å; R369-R371 PolarHBondContact O-N 3.35Å; R369-T372 PolarHBondContact O-N 2.9Å; R369-Q373 WeakPolarHBondContact O-CG 3.39Å; R369-Q373 PolarHBondContact O-N 3.37Å
370	L	95.5	Very high	95.3	Very high	78 Å²	78	99.4 Å²	99.4	41%	0.408	48%	0.48	S	S	.	.	H	α-helix	trans	-64.1	-38.1	178.3	-70.5	174.1	0	0	0	112.1	E366 R368 Q373 M374	E366-L370 HydrophobicContact CG-CD1 4.32Å; E366-L370 WeakPolarHBondContact O-CB 3.36Å; E366-L370 WeakPolarHBondContact O-CG 3.45Å; E366-L370 PolarHBondContact O-N 2.91Å; R368-L370 PolarHBondContact O-N 3.38Å; L370-Q373 PolarHBondContact O-N 2.85Å; L370-M374 WeakPolarHBondContact O-CB 3.37Å; L370-M374 VanDerWaalsContact O-CG 3.25Å; L370-M374 WeakPolarHBondContact O-CG 3.45Å; L370-M374 PolarHBondContact O-N 3.19Å
371	R	96.4	Very high	95.3	Very high	188 Å²	188	101.4 Å²	101.4	71%	0.709	49%	0.488	S	S	*	.	H	α-helix	trans	-63.9	-42.2	175	-78.3	175.6	179.7	165.2	1.5	112.4	V367 R368 R369 M374 G375	V367-R371 HydrophobicContact CG1-CG 4.47Å; V367-R371 WeakPolarHBondContact O-CB 3.5Å; V367-R371 VanDerWaalsContact O-CG 3.27Å; V367-R371 WeakPolarHBondContact O-CG 3.28Å; V367-R371 PolarHBondContact O-N 3.1Å; R368-R371 PolarHBondContact O-N 3.41Å; R369-R371 PolarHBondContact O-N 3.35Å; R371-M374 PolarHBondContact O-N 3.41Å; R371-G375 PolarHBondContact O-N 3.43Å
372	T	96.5	Very high	95.3	Very high	77 Å²	77	102 Å²	102	47%	0.472	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-49.1	174.7	-53.9	0	0	0	0	110.9	R368 R369 M374 G375 D376	R368-T372 PolarHBondContact O-N 3.31Å; R368-T372 PolarHBondContact O-OG1 3.07Å; R369-T372 PolarHBondContact O-N 2.9Å; T372-M374 VanDerWaalsContact C-N 3.31Å; T372-M374 PolarHBondContact O-N 3.45Å; T372-G375 WeakPolarHBondContact O-CA 3.42Å; T372-G375 PolarHBondContact O-N 3.41Å; T372-D376 PolarHBondContact O-N 2.87Å
373	Q	96.5	Very high	95.4	Very high	90 Å²	90	99.7 Å²	99.7	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-40.4	177.5	-72	-174.6	-25.6	0	0	112.7	R369 L370 G375 D376 L377	R369-Q373 WeakPolarHBondContact O-CG 3.39Å; R369-Q373 PolarHBondContact O-N 3.37Å; L370-Q373 PolarHBondContact O-N 2.85Å; Q373-G375 VanDerWaalsContact C-N 3.3Å; Q373-G375 PolarHBondContact O-N 2.95Å; Q373-D376 PolarHBondContact O-N 3.41Å; Q373-L377 WeakPolarHBondContact O-CB 3.39Å; Q373-L377 WeakPolarHBondContact O-CG 3.38Å; Q373-L377 PolarHBondContact O-N 3.18Å
374	M	94	Very high	95.4	Very high	87 Å²	87	100.2 Å²	100.2	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-66.1	-31.6	174.4	-76.9	-63	-59.6	0	0	112.7	L370 R371 T372 R378	L370-M374 WeakPolarHBondContact O-CB 3.37Å; L370-M374 VanDerWaalsContact O-CG 3.25Å; L370-M374 WeakPolarHBondContact O-CG 3.45Å; L370-M374 PolarHBondContact O-N 3.19Å; R371-M374 PolarHBondContact O-N 3.41Å; T372-M374 VanDerWaalsContact C-N 3.31Å; T372-M374 PolarHBondContact O-N 3.45Å; M374-R378 WeakPolarHBondContact O-CB 3.36Å; M374-R378 VanDerWaalsContact O-CG 3.26Å; M374-R378 WeakPolarHBondContact O-CG 3.25Å; M374-R378 PolarHBondContact O-N 2.9Å
375	G	95.7	Very high	95.5	Very high	39 Å²	39	98.8 Å²	98.8	40%	0.402	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-49	171.4	0	0	0	0	0	111.7	R371 T372 Q373 L377 R378 G379	R371-G375 PolarHBondContact O-N 3.43Å; T372-G375 WeakPolarHBondContact O-CA 3.42Å; T372-G375 PolarHBondContact O-N 3.41Å; Q373-G375 VanDerWaalsContact C-N 3.3Å; Q373-G375 PolarHBondContact O-N 2.95Å; G375-L377 PolarHBondContact O-N 3.4Å; G375-R378 PolarHBondContact O-N 2.98Å; G375-G379 PolarHBondContact O-N 2.94Å
376	D	95.9	Very high	95.5	Very high	92 Å²	92	97.3 Å²	97.3	49%	0.492	49%	0.491	S	S	.	.	H	α-helix	trans	-61	-43	178.9	-62.3	-26.6	0	0	0	112	T372 Q373 G379 K380	T372-D376 PolarHBondContact O-N 2.87Å; Q373-D376 PolarHBondContact O-N 3.41Å; D376-G379 PolarHBondContact O-N 3.01Å; D376-K380 WeakPolarHBondContact O-CG 3.41Å; D376-K380 PolarHBondContact O-N 2.87Å
377	L	93.7	Very high	95.6	Very high	105 Å²	105	102.5 Å²	102.5	55%	0.55	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-38.9	177.6	-73.6	175.3	0	0	0	112.2	Q373 G375 K380 L381	Q373-L377 WeakPolarHBondContact O-CB 3.39Å; Q373-L377 WeakPolarHBondContact O-CG 3.38Å; Q373-L377 PolarHBondContact O-N 3.18Å; G375-L377 PolarHBondContact O-N 3.4Å; L377-K380 PolarHBondContact O-N 2.86Å; L377-L381 WeakPolarHBondContact O-CB 3.39Å; L377-L381 PolarHBondContact O-N 3Å
378	R	96.3	Very high	95.5	Very high	158 Å²	158	103.4 Å²	103.4	60%	0.596	51%	0.511	S	S	*	.	H	α-helix	trans	-66.3	-39.6	174.3	-77.7	-177.4	-179.3	107.9	-3.4	112.1	M374 G375 L381 A382	M374-R378 WeakPolarHBondContact O-CB 3.36Å; M374-R378 VanDerWaalsContact O-CG 3.26Å; M374-R378 WeakPolarHBondContact O-CG 3.25Å; M374-R378 PolarHBondContact O-N 2.9Å; G375-R378 PolarHBondContact O-N 2.98Å; R378-L381 PolarHBondContact O-N 2.99Å; R378-A382 PolarHBondContact O-N 2.91Å
379	G	95.9	Very high	95.5	Very high	33 Å²	33	97.9 Å²	97.9	34%	0.34	50%	0.498	S	S	.	.	H	α-helix	trans	-60.8	-49.9	173.7	0	0	0	0	0	111.8	G375 D376 L381 A382 D383	G375-G379 PolarHBondContact O-N 2.94Å; D376-G379 PolarHBondContact O-N 3.01Å; G379-L381 VanDerWaalsContact C-N 3.29Å; G379-L381 PolarHBondContact O-N 2.93Å; G379-A382 PolarHBondContact O-N 3.49Å; G379-A382 VanDerWaalsContact O-N 3.16Å; G379-D383 PolarHBondContact O-N 3.27Å
380	K	96.7	Very high	95.5	Very high	130 Å²	130	97.8 Å²	97.8	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-59.4	-38.4	175.9	-72.7	174.4	-176.3	177.9	0	113	D376 L377 D383 L384	D376-K380 WeakPolarHBondContact O-CG 3.41Å; D376-K380 PolarHBondContact O-N 2.87Å; L377-K380 PolarHBondContact O-N 2.86Å; K380-D383 PolarHBondContact O-N 3.31Å; K380-L384 WeakPolarHBondContact O-CB 3.23Å; K380-L384 VanDerWaalsContact O-CG 3.28Å; K380-L384 WeakPolarHBondContact O-CG 3.34Å; K380-L384 PolarHBondContact O-N 3.41Å
381	L	92	Very high	95.5	Very high	97 Å²	97	97.5 Å²	97.5	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-63.2	-47.7	176.2	-174.5	66.7	0	0	0	110.7	L377 R378 G379 D383 L384 E385	L377-L381 WeakPolarHBondContact O-CB 3.39Å; L377-L381 PolarHBondContact O-N 3Å; R378-L381 PolarHBondContact O-N 2.99Å; G379-L381 VanDerWaalsContact C-N 3.29Å; G379-L381 PolarHBondContact O-N 2.93Å; L381-D383 PolarHBondContact O-N 2.63Å; L381-L384 PolarHBondContact O-N 2.65Å; L381-E385 WeakPolarHBondContact O-CB 3.35Å; L381-E385 VanDerWaalsContact O-CG 3.3Å; L381-E385 WeakPolarHBondContact O-CG 3.49Å; L381-E385 PolarHBondContact O-N 3.44Å
382	A	95.9	Very high	95.5	Very high	50 Å²	50	94 Å²	94	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-62.2	-39.9	177	0	0	0	0	0	112.7	R378 G379 E385 S386	R378-A382 PolarHBondContact O-N 2.91Å; G379-A382 PolarHBondContact O-N 3.49Å; G379-A382 VanDerWaalsContact O-N 3.16Å; A382-E385 PolarHBondContact O-N 3.37Å; A382-S386 WeakPolarHBondContact O-CB 3.34Å; A382-S386 PolarHBondContact O-N 3.32Å
383	D	95.9	Very high	95.5	Very high	116 Å²	116	96.6 Å²	96.6	62%	0.62	50%	0.499	S	S	*	.	H	α-helix	trans	-64	-42.5	175.5	-69.5	-26.9	0	0	0	111.8	G379 K380 L381 R387	G379-D383 PolarHBondContact O-N 3.27Å; K380-D383 PolarHBondContact O-N 3.31Å; L381-D383 PolarHBondContact O-N 2.63Å; D383-R387 WeakPolarHBondContact O-CB 3.45Å; D383-R387 PolarHBondContact O-N 2.89Å
384	L	94.3	Very high	95.6	Very high	114 Å²	114	96.7 Å²	96.7	60%	0.597	50%	0.5	S	S	*	.	H	α-helix	trans	-67.4	-40.5	176.9	-75.5	173.1	0	0	0	111.9	K380 L381 R387 N388	K380-L384 WeakPolarHBondContact O-CB 3.23Å; K380-L384 VanDerWaalsContact O-CG 3.28Å; K380-L384 WeakPolarHBondContact O-CG 3.34Å; K380-L384 PolarHBondContact O-N 3.41Å; L381-L384 PolarHBondContact O-N 2.65Å; L384-R387 PolarHBondContact O-N 3.14Å; L384-N388 WeakPolarHBondContact O-CB 3.43Å; L384-N388 PolarHBondContact O-N 2.89Å
385	E	96.4	Very high	95.6	Very high	117 Å²	117	97 Å²	97	55%	0.547	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-45.4	174.9	-75	172	173.8	0	0	111.4	L381 A382 R387 N388 S389	L381-E385 WeakPolarHBondContact O-CB 3.35Å; L381-E385 VanDerWaalsContact O-CG 3.3Å; L381-E385 WeakPolarHBondContact O-CG 3.49Å; L381-E385 PolarHBondContact O-N 3.44Å; A382-E385 PolarHBondContact O-N 3.37Å; E385-R387 PolarHBondContact O-N 2.9Å; E385-N388 PolarHBondContact O-N 3.27Å; E385-S389 WeakPolarHBondContact O-CB 3.32Å; E385-S389 PolarHBondContact O-N 2.88Å
386	S	95.8	Very high	95.7	Very high	83 Å²	83	101.7 Å²	101.7	58%	0.58	52%	0.518	S	S	*	.	H	α-helix	trans	-60.5	-45.2	175	-179.7	0	0	0	0	111.8	A382 S389 L390	A382-S386 WeakPolarHBondContact O-CB 3.34Å; A382-S386 PolarHBondContact O-N 3.32Å; S386-S389 PolarHBondContact O-N 3.26Å; S386-L390 PolarHBondContact O-N 3.45Å
387	R	96.3	Very high	95.7	Very high	167 Å²	167	104.1 Å²	104.1	63%	0.63	53%	0.526	S	S	*	.	H	α-helix	trans	-63.7	-41.1	175.9	-175.7	178.9	179.9	103.6	2.4	112	D383 L384 E385 L390 L391	D383-R387 WeakPolarHBondContact O-CB 3.45Å; D383-R387 PolarHBondContact O-N 2.89Å; L384-R387 PolarHBondContact O-N 3.14Å; E385-R387 PolarHBondContact O-N 2.9Å; R387-L390 PolarHBondContact O-N 2.94Å; R387-L391 HydrophobicContact CG-CD1 4.15Å; R387-L391 WeakPolarHBondContact O-CG 3.42Å; R387-L391 PolarHBondContact O-N 2.98Å
388	N	92.2	Very high	95.8	Very high	84 Å²	84	105 Å²	105	45%	0.449	53%	0.531	S	S	.	.	H	α-helix	trans	-65.7	-44.8	179.3	-163.3	50	0	0	0	110.7	L384 E385 L390 L391 E392	L384-N388 WeakPolarHBondContact O-CB 3.43Å; L384-N388 PolarHBondContact O-N 2.89Å; E385-N388 PolarHBondContact O-N 3.27Å; N388-L390 VanDerWaalsContact C-N 3.26Å; N388-L390 PolarHBondContact O-N 3.27Å; N388-L391 PolarHBondContact O-N 3.38Å; N388-E392 PolarHBondContact ND2-OE1 2.92Å; N388-E392 WeakPolarHBondContact O-CB 3.42Å; N388-E392 WeakPolarHBondContact O-CG 3.46Å; N388-E392 PolarHBondContact O-N 2.96Å
389	S	97.1	Very high	95.7	Very high	51 Å²	51	100.6 Å²	100.6	36%	0.357	52%	0.522	S	S	.	.	H	α-helix	trans	-58.2	-35.9	172.1	167.8	0	0	0	0	112.6	E385 S386 K393	E385-S389 WeakPolarHBondContact O-CB 3.32Å; E385-S389 PolarHBondContact O-N 2.88Å; S386-S389 PolarHBondContact O-N 3.26Å; S389-K393 VanDerWaalsContact O-CG 3.31Å; S389-K393 WeakPolarHBondContact O-CG 3.43Å; S389-K393 PolarHBondContact O-N 3.02Å
390	L	96.5	Very high	95.7	Very high	97 Å²	97	106.6 Å²	106.6	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-70.4	-44.1	176.5	-178.6	66.3	0	0	0	111.7	S386 R387 N388 K393 Q394	S386-L390 PolarHBondContact O-N 3.45Å; R387-L390 PolarHBondContact O-N 2.94Å; N388-L390 VanDerWaalsContact C-N 3.26Å; N388-L390 PolarHBondContact O-N 3.27Å; L390-K393 PolarHBondContact O-N 3.41Å; L390-Q394 WeakPolarHBondContact O-CG 3.22Å; L390-Q394 PolarHBondContact O-N 2.86Å
391	L	95.6	Very high	95.8	Very high	73 Å²	73	104.8 Å²	104.8	38%	0.382	53%	0.529	S	S	.	.	H	α-helix	trans	-65.5	-40.5	178.8	-73	171.5	0	0	0	111.7	R387 N388 K393 Q394 V395	R387-L391 HydrophobicContact CG-CD1 4.15Å; R387-L391 WeakPolarHBondContact O-CG 3.42Å; R387-L391 PolarHBondContact O-N 2.98Å; N388-L391 PolarHBondContact O-N 3.38Å; L391-K393 VanDerWaalsContact C-N 3.34Å; L391-K393 PolarHBondContact O-N 2.75Å; L391-Q394 PolarHBondContact O-N 3.38Å; L391-V395 WeakPolarHBondContact O-CG2 3.37Å; L391-V395 PolarHBondContact O-N 2.87Å
392	E	97	Very high	95.9	Very high	115 Å²	115	104.9 Å²	104.9	54%	0.537	53%	0.529	S	S	.	.	H	α-helix	trans	-60.2	-43.2	175.1	-75.2	171.4	-175.8	0	0	111.5	N388 V395 Q396	N388-E392 PolarHBondContact ND2-OE1 2.92Å; N388-E392 WeakPolarHBondContact O-CB 3.42Å; N388-E392 WeakPolarHBondContact O-CG 3.46Å; N388-E392 PolarHBondContact O-N 2.96Å; E392-V395 PolarHBondContact O-N 3.23Å; E392-Q396 WeakPolarHBondContact O-CB 3.42Å; E392-Q396 PolarHBondContact O-N 3.26Å
393	K	97	Very high	95.9	Very high	130 Å²	130	107.3 Å²	107.3	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-62.7	-42.4	174.2	-73.3	174.9	-176.4	179.3	0	112.5	S389 L390 L391 Q396 E397	S389-K393 VanDerWaalsContact O-CG 3.31Å; S389-K393 WeakPolarHBondContact O-CG 3.43Å; S389-K393 PolarHBondContact O-N 3.02Å; L390-K393 PolarHBondContact O-N 3.41Å; L391-K393 VanDerWaalsContact C-N 3.34Å; L391-K393 PolarHBondContact O-N 2.75Å; K393-Q396 PolarHBondContact O-N 3.46Å; K393-E397 WeakPolarHBondContact O-CB 3.13Å; K393-E397 PolarHBondContact O-N 3.09Å
394	Q	97.5	Very high	96	Very high	93 Å²	93	104.4 Å²	104.4	44%	0.435	52%	0.517	S	S	.	.	H	α-helix	trans	-64.6	-40	176.8	-75.2	179.8	-6.7	0	0	112.3	L390 L391 Q396 E397 L398	L390-Q394 WeakPolarHBondContact O-CG 3.22Å; L390-Q394 PolarHBondContact O-N 2.86Å; L391-Q394 PolarHBondContact O-N 3.38Å; Q394-Q396 VanDerWaalsContact C-N 3.33Å; Q394-E397 PolarHBondContact O-N 3.35Å; Q394-L398 WeakPolarHBondContact O-CB 3.47Å; Q394-L398 WeakPolarHBondContact O-CG 3.46Å; Q394-L398 PolarHBondContact O-N 3.49Å
395	V	94.3	Very high	96.1	Very high	92 Å²	92	101.7 Å²	101.7	56%	0.558	50%	0.502	S	S	*	.	H	α-helix	trans	-63.5	-42.6	174.4	171	0	0	0	0	110.2	L391 E392 L398 T399	L391-V395 WeakPolarHBondContact O-CG2 3.37Å; L391-V395 PolarHBondContact O-N 2.87Å; E392-V395 PolarHBondContact O-N 3.23Å; V395-L398 PolarHBondContact O-N 3.37Å; V395-T399 HydrophobicContact CG1-CG2 4.35Å; V395-T399 WeakPolarHBondContact O-CB 3.11Å; V395-T399 VanDerWaalsContact O-CG2 3.27Å; V395-T399 WeakPolarHBondContact O-CG2 3.38Å; V395-T399 PolarHBondContact O-N 3.32Å; V395-T399 PolarHBondContact O-OG1 2.88Å
396	Q	96.6	Very high	96.1	Very high	138 Å²	138	100.9 Å²	100.9	65%	0.645	50%	0.499	S	S	*	.	H	α-helix	trans	-63.7	-40.5	176.7	-167.7	174.6	13.1	0	0	112.4	E392 K393 Q394 T399 Y400	E392-Q396 WeakPolarHBondContact O-CB 3.42Å; E392-Q396 PolarHBondContact O-N 3.26Å; K393-Q396 PolarHBondContact O-N 3.46Å; Q394-Q396 VanDerWaalsContact C-N 3.33Å; Q396-T399 VanDerWaalsContact CA-OG1 3.26Å; Q396-T399 WeakPolarHBondContact CA-OG1 3.45Å; Q396-T399 PolarHBondContact O-OG1 3.44Å; Q396-Y400 WeakPolarHBondContact O-CB 3.31Å; Q396-Y400 PolarHBondContact O-N 2.86Å
397	E	97	Very high	96.1	Very high	143 Å²	143	105 Å²	105	67%	0.668	50%	0.502	S	S	*	.	H	α-helix	trans	-67.7	-43.9	177	-173.5	169.4	-159.7	0	0	112	K393 Q394 T399 Y400 Q401	K393-E397 WeakPolarHBondContact O-CB 3.13Å; K393-E397 PolarHBondContact O-N 3.09Å; Q394-E397 PolarHBondContact O-N 3.35Å; E397-T399 PolarHBondContact O-N 3.49Å; E397-Y400 PolarHBondContact O-N 3.24Å; E397-Q401 WeakPolarHBondContact O-CB 3.37Å; E397-Q401 PolarHBondContact O-N 3.18Å
398	L	95.1	Very high	96	Very high	124 Å²	124	102.5 Å²	102.5	65%	0.649	50%	0.497	S	S	*	.	H	α-helix	trans	-66.9	-35.7	176.6	-75	171.8	0	0	0	112.7	Q394 V395 L402	Q394-L398 WeakPolarHBondContact O-CB 3.47Å; Q394-L398 WeakPolarHBondContact O-CG 3.46Å; Q394-L398 PolarHBondContact O-N 3.49Å; V395-L398 PolarHBondContact O-N 3.37Å; L398-L402 VanDerWaalsContact O-CB 3.28Å; L398-L402 WeakPolarHBondContact O-CB 3.4Å; L398-L402 PolarHBondContact O-N 3.45Å
399	T	95	Very high	96.1	Very high	65 Å²	65	106.6 Å²	106.6	40%	0.399	51%	0.507	S	S	.	.	H	α-helix	trans	-68.4	-44.7	175.4	44.9	0	0	0	0	111	V395 Q396 E397 Q401 L402 E403	V395-T399 HydrophobicContact CG1-CG2 4.35Å; V395-T399 WeakPolarHBondContact O-CB 3.11Å; V395-T399 VanDerWaalsContact O-CG2 3.27Å; V395-T399 WeakPolarHBondContact O-CG2 3.38Å; V395-T399 PolarHBondContact O-N 3.32Å; V395-T399 PolarHBondContact O-OG1 2.88Å; Q396-T399 VanDerWaalsContact CA-OG1 3.26Å; Q396-T399 WeakPolarHBondContact CA-OG1 3.45Å; Q396-T399 PolarHBondContact O-OG1 3.44Å; E397-T399 PolarHBondContact O-N 3.49Å; T399-Q401 VanDerWaalsContact C-N 3.34Å; T399-Q401 PolarHBondContact O-N 2.73Å; T399-L402 PolarHBondContact O-N 3.24Å; T399-E403 WeakPolarHBondContact O-CG 3.11Å; T399-E403 PolarHBondContact O-N 2.85Å
400	Y	96.5	Very high	96.1	Very high	160 Å²	160	109.9 Å²	109.9	63%	0.627	52%	0.517	S	S	*	.	H	α-helix	trans	-58.7	-44.5	173.2	-177.7	-94.3	0	0	0	112.1	Q396 E397 L402 E403 D404	Q396-Y400 WeakPolarHBondContact O-CB 3.31Å; Q396-Y400 PolarHBondContact O-N 2.86Å; E397-Y400 PolarHBondContact O-N 3.24Å; Y400-L402 PolarHBondContact O-N 2.92Å; Y400-E403 PolarHBondContact O-N 3.32Å; Y400-D404 PolarHBondContact O-N 3.34Å
401	Q	97.1	Very high	96	Very high	92 Å²	92	108.3 Å²	108.3	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-43	176.9	-173.3	61.6	45	0	0	112.1	E397 T399 E403 D404 D405	E397-Q401 WeakPolarHBondContact O-CB 3.37Å; E397-Q401 PolarHBondContact O-N 3.18Å; T399-Q401 VanDerWaalsContact C-N 3.34Å; T399-Q401 PolarHBondContact O-N 2.73Å; Q401-E403 VanDerWaalsContact C-N 3.35Å; Q401-D404 PolarHBondContact O-N 2.93Å; Q401-D405 PolarHBondContact NE2-OD1 2.94Å; Q401-D405 WeakPolarHBondContact O-CB 3.48Å; Q401-D405 VanDerWaalsContact O-CG 3.23Å; Q401-D405 PolarHBondContact O-N 2.78Å
402	L	95.2	Very high	96	Very high	99 Å²	99	106.8 Å²	106.8	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-66.6	-37.3	179.5	-173.3	129.1	0	0	0	111.9	L398 T399 Y400 Q406	L398-L402 VanDerWaalsContact O-CB 3.28Å; L398-L402 WeakPolarHBondContact O-CB 3.4Å; L398-L402 PolarHBondContact O-N 3.45Å; T399-L402 PolarHBondContact O-N 3.24Å; Y400-L402 PolarHBondContact O-N 2.92Å; L402-Q406 VanDerWaalsContact CD2-NE2 3.34Å; L402-Q406 WeakPolarHBondContact O-CB 3.49Å; L402-Q406 WeakPolarHBondContact O-CG 3.02Å; L402-Q406 PolarHBondContact O-N 3.29Å
403	E	96.5	Very high	95.9	Very high	100 Å²	100	106.2 Å²	106.2	47%	0.467	51%	0.512	S	S	.	.	H	α-helix	trans	-66.6	-40	173.2	-73.4	178	-172.1	0	0	112	T399 Y400 Q401 R407	T399-E403 WeakPolarHBondContact O-CG 3.11Å; T399-E403 PolarHBondContact O-N 2.85Å; Y400-E403 PolarHBondContact O-N 3.32Å; Q401-E403 VanDerWaalsContact C-N 3.35Å; E403-R407 VanDerWaalsContact O-CG 3.27Å; E403-R407 WeakPolarHBondContact O-CG 3.39Å; E403-R407 PolarHBondContact O-N 3.48Å; E403-R407 VanDerWaalsContact O-N 3.08Å
404	D	96.5	Very high	95.8	Very high	56 Å²	56	104.7 Å²	104.7	30%	0.299	51%	0.51	S	S	.	.	H	α-helix	trans	-65.8	-46.8	175.6	-169.4	67.8	0	0	0	111.7	Y400 Q401 Q406 R407 Q408	Y400-D404 PolarHBondContact O-N 3.34Å; Q401-D404 PolarHBondContact O-N 2.93Å; D404-Q406 VanDerWaalsContact C-N 3.32Å; D404-Q406 PolarHBondContact O-N 2.97Å; D404-R407 WeakPolarHBondContact O-CB 3.41Å; D404-R407 PolarHBondContact O-N 2.93Å; D404-R407 VanDerWaalsContact O-N 3.16Å; D404-Q408 WeakPolarHBondContact O-CG 3.3Å; D404-Q408 PolarHBondContact O-N 3.38Å; D404-Q408 PolarHBondContact OD2-NE2 3.04Å
405	D	96.3	Very high	95.7	Very high	56 Å²	56	104.5 Å²	104.5	30%	0.299	51%	0.512	S	S	.	.	H	α-helix	trans	-59.9	-42.5	176.1	-70.4	-13.2	0	0	0	111.2	Q401 R407 Q408 Y409	Q401-D405 PolarHBondContact NE2-OD1 2.94Å; Q401-D405 WeakPolarHBondContact O-CB 3.48Å; Q401-D405 VanDerWaalsContact O-CG 3.23Å; Q401-D405 PolarHBondContact O-N 2.78Å; D405-R407 PolarHBondContact O-N 2.9Å; D405-Q408 PolarHBondContact O-N 3.46Å; D405-Y409 HydrophobicContact CB-CD2 4.46Å; D405-Y409 HydrophobicContact CB-CE2 4.16Å; D405-Y409 WeakPolarHBondContact O-CD2 3.35Å; D405-Y409 PolarHBondContact O-N 2.92Å
406	Q	96.1	Very high	95.6	Very high	100 Å²	100	106.8 Å²	106.8	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-58.9	-46.3	174.8	-80.8	176.3	0.3	0	0	111.8	L402 D404 Q408 Y409 E410	L402-Q406 VanDerWaalsContact CD2-NE2 3.34Å; L402-Q406 WeakPolarHBondContact O-CB 3.49Å; L402-Q406 WeakPolarHBondContact O-CG 3.02Å; L402-Q406 PolarHBondContact O-N 3.29Å; D404-Q406 VanDerWaalsContact C-N 3.32Å; D404-Q406 PolarHBondContact O-N 2.97Å; Q406-Q408 VanDerWaalsContact C-N 3.31Å; Q406-Q408 PolarHBondContact O-N 3.25Å; Q406-Y409 PolarHBondContact O-N 3.47Å; Q406-E410 WeakPolarHBondContact O-CB 3.22Å; Q406-E410 WeakPolarHBondContact O-CG 3.47Å; Q406-E410 PolarHBondContact O-N 3.35Å
407	R	96	Very high	95.5	Very high	170 Å²	170	103.2 Å²	103.2	64%	0.642	50%	0.496	S	S	*	.	H	α-helix	trans	-60.7	-41	176.3	-70.3	166.5	-175	-115.2	3.1	111.8	E403 D404 D405 E410 S411	E403-R407 VanDerWaalsContact O-CG 3.27Å; E403-R407 WeakPolarHBondContact O-CG 3.39Å; E403-R407 PolarHBondContact O-N 3.48Å; E403-R407 VanDerWaalsContact O-N 3.08Å; D404-R407 WeakPolarHBondContact O-CB 3.41Å; D404-R407 PolarHBondContact O-N 2.93Å; D404-R407 VanDerWaalsContact O-N 3.16Å; D405-R407 PolarHBondContact O-N 2.9Å; R407-E410 PolarHBondContact O-N 3.07Å; R407-S411 WeakPolarHBondContact O-CB 3.45Å; R407-S411 PolarHBondContact O-N 2.85Å
408	Q	96	Very high	95.3	Very high	114 Å²	114	98.6 Å²	98.6	53%	0.533	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-43.5	176.2	-68.3	-176.7	38.6	0	0	111.7	D404 D405 Q406 S411 A412	D404-Q408 WeakPolarHBondContact O-CG 3.3Å; D404-Q408 PolarHBondContact O-N 3.38Å; D404-Q408 PolarHBondContact OD2-NE2 3.04Å; D405-Q408 PolarHBondContact O-N 3.46Å; Q406-Q408 VanDerWaalsContact C-N 3.31Å; Q406-Q408 PolarHBondContact O-N 3.25Å; Q408-S411 PolarHBondContact O-N 3.43Å; Q408-A412 WeakPolarHBondContact O-CB 3.47Å; Q408-A412 PolarHBondContact O-N 2.68Å
409	Y	94	Very high	95.3	Very high	171 Å²	171	97.7 Å²	97.7	67%	0.671	48%	0.475	S	S	*	.	H	α-helix	trans	-66.1	-39.8	176.7	-70.8	-50.5	0	0	0	112.7	D405 Q406 A412 L413	D405-Y409 HydrophobicContact CB-CD2 4.46Å; D405-Y409 HydrophobicContact CB-CE2 4.16Å; D405-Y409 WeakPolarHBondContact O-CD2 3.35Å; D405-Y409 PolarHBondContact O-N 2.92Å; Q406-Y409 PolarHBondContact O-N 3.47Å; Y409-A412 PolarHBondContact O-N 3.24Å; Y409-L413 VanDerWaalsContact O-CB 3.28Å; Y409-L413 WeakPolarHBondContact O-CB 3.01Å; Y409-L413 PolarHBondContact O-N 3.03Å
410	E	95.7	Very high	95.2	Very high	119 Å²	119	98.2 Å²	98.2	56%	0.556	47%	0.474	S	S	*	.	H	α-helix	trans	-63.3	-43.6	174.8	-75	177	178.9	0	0	111.5	Q406 R407 L413 N414	Q406-E410 WeakPolarHBondContact O-CB 3.22Å; Q406-E410 WeakPolarHBondContact O-CG 3.47Å; Q406-E410 PolarHBondContact O-N 3.35Å; R407-E410 PolarHBondContact O-N 3.07Å; E410-L413 PolarHBondContact O-N 3.28Å; E410-N414 WeakPolarHBondContact O-CB 3.41Å; E410-N414 PolarHBondContact O-N 2.86Å; E410-N414 PolarHBondContact O-ND2 2.78Å
411	S	94.7	Very high	95	Very high	65 Å²	65	97 Å²	97	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-60.7	-46.9	174	-170.1	0	0	0	0	111.5	R407 Q408 L413 N414 D415	R407-S411 WeakPolarHBondContact O-CB 3.45Å; R407-S411 PolarHBondContact O-N 2.85Å; Q408-S411 PolarHBondContact O-N 3.43Å; S411-L413 VanDerWaalsContact C-N 3.32Å; S411-L413 PolarHBondContact O-N 3.41Å; S411-N414 PolarHBondContact O-N 2.79Å; S411-D415 PolarHBondContact O-N 2.94Å
412	A	96.3	Very high	94.9	Very high	40 Å²	40	98.7 Å²	98.7	33%	0.331	47%	0.474	S	S	.	.	H	α-helix	trans	-64.3	-36.9	178.6	0	0	0	0	0	112.4	Q408 Y409 R416	Q408-A412 WeakPolarHBondContact O-CB 3.47Å; Q408-A412 PolarHBondContact O-N 2.68Å; Y409-A412 PolarHBondContact O-N 3.24Å; A412-R416 VanDerWaalsContact O-CG 3.29Å; A412-R416 WeakPolarHBondContact O-CG 3.46Å; A412-R416 PolarHBondContact O-N 3.24Å
413	L	93.8	Very high	94.8	Very high	103 Å²	103	99.1 Å²	99.1	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-64.9	-46.4	175.4	-172.3	70.7	0	0	0	110.6	Y409 E410 S411 D415 R416 D417	Y409-L413 VanDerWaalsContact O-CB 3.28Å; Y409-L413 WeakPolarHBondContact O-CB 3.01Å; Y409-L413 PolarHBondContact O-N 3.03Å; E410-L413 PolarHBondContact O-N 3.28Å; S411-L413 VanDerWaalsContact C-N 3.32Å; S411-L413 PolarHBondContact O-N 3.41Å; L413-D415 VanDerWaalsContact C-N 3.33Å; L413-D415 PolarHBondContact O-N 3.34Å; L413-R416 PolarHBondContact O-N 3Å; L413-D417 WeakPolarHBondContact O-CB 3.33Å; L413-D417 PolarHBondContact O-N 3.5Å
414	N	94.8	Very high	94.7	Very high	98 Å²	98	99.9 Å²	99.9	52%	0.524	47%	0.474	S	S	.	.	H	α-helix	trans	-60.9	-41.4	177.5	-71.7	-15.9	0	0	0	112.1	E410 S411 D417 A418	E410-N414 WeakPolarHBondContact O-CB 3.41Å; E410-N414 PolarHBondContact O-N 2.86Å; E410-N414 PolarHBondContact O-ND2 2.78Å; S411-N414 PolarHBondContact O-N 2.79Å; N414-D417 PolarHBondContact O-N 3.08Å; N414-A418 WeakPolarHBondContact O-CB 3.48Å; N414-A418 PolarHBondContact O-N 3.47Å
415	D	95.8	Very high	94.6	Very high	89 Å²	89	103.3 Å²	103.3	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-42	175.1	-74.1	-19.8	0	0	0	111.9	S411 L413 A418 Q419	S411-D415 PolarHBondContact O-N 2.94Å; L413-D415 VanDerWaalsContact C-N 3.33Å; L413-D415 PolarHBondContact O-N 3.34Å; D415-A418 PolarHBondContact O-N 2.88Å; D415-Q419 WeakPolarHBondContact O-CG 3.34Å; D415-Q419 PolarHBondContact O-N 3.44Å
416	R	91.7	Very high	94.5	Very high	141 Å²	141	105 Å²	105	53%	0.532	49%	0.494	S	S	.	.	H	α-helix	trans	-68.4	-42	177.1	-70.5	-64.3	127.1	73.9	8.8	111.8	A412 L413 A418 Q419 I420	A412-R416 VanDerWaalsContact O-CG 3.29Å; A412-R416 WeakPolarHBondContact O-CG 3.46Å; A412-R416 PolarHBondContact O-N 3.24Å; L413-R416 PolarHBondContact O-N 3Å; R416-A418 VanDerWaalsContact C-N 3.3Å; R416-A418 PolarHBondContact O-N 3.33Å; R416-Q419 WeakPolarHBondContact O-CB 3.48Å; R416-Q419 PolarHBondContact O-N 2.86Å; R416-I420 VanDerWaalsContact O-CG1 3.31Å; R416-I420 WeakPolarHBondContact O-CG1 3.5Å; R416-I420 PolarHBondContact O-N 3.44Å
417	D	94.4	Very high	94.2	Very high	62 Å²	62	104 Å²	104	33%	0.332	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-37.4	175.8	-78.9	-20	0	0	0	111.6	L413 N414 I420 R421	L413-D417 WeakPolarHBondContact O-CB 3.33Å; L413-D417 PolarHBondContact O-N 3.5Å; N414-D417 PolarHBondContact O-N 3.08Å; D417-I420 PolarHBondContact O-N 2.82Å; D417-R421 WeakPolarHBondContact O-CG 3.24Å; D417-R421 PolarHBondContact O-N 3.48Å
418	A	94.4	Very high	94.1	Very high	46 Å²	46	101.8 Å²	101.8	38%	0.38	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-42.7	172.2	0	0	0	0	0	112	N414 D415 R416 R421 K422	N414-A418 WeakPolarHBondContact O-CB 3.48Å; N414-A418 PolarHBondContact O-N 3.47Å; D415-A418 PolarHBondContact O-N 2.88Å; R416-A418 VanDerWaalsContact C-N 3.3Å; R416-A418 PolarHBondContact O-N 3.33Å; A418-R421 PolarHBondContact O-N 3.38Å; A418-K422 WeakPolarHBondContact O-CB 3.28Å; A418-K422 PolarHBondContact O-N 2.99Å
419	Q	94.7	Very high	93.9	Very high	105 Å²	105	99.2 Å²	99.2	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-42.5	174.1	-72.2	173	19.5	0	0	112	D415 R416 K422 M423	D415-Q419 WeakPolarHBondContact O-CG 3.34Å; D415-Q419 PolarHBondContact O-N 3.44Å; R416-Q419 WeakPolarHBondContact O-CB 3.48Å; R416-Q419 PolarHBondContact O-N 2.86Å; Q419-K422 PolarHBondContact O-N 3.48Å; Q419-M423 WeakPolarHBondContact O-CB 3.45Å; Q419-M423 VanDerWaalsContact O-CG 3.3Å; Q419-M423 WeakPolarHBondContact O-CG 3.39Å; Q419-M423 PolarHBondContact O-N 3.18Å
420	I	93	Very high	93.9	Very high	77 Å²	77	96.3 Å²	96.3	40%	0.395	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-44.4	177.7	-69.4	166.4	0	0	0	110.7	R416 D417 M423 R424	R416-I420 VanDerWaalsContact O-CG1 3.31Å; R416-I420 WeakPolarHBondContact O-CG1 3.5Å; R416-I420 PolarHBondContact O-N 3.44Å; D417-I420 PolarHBondContact O-N 2.82Å; I420-M423 PolarHBondContact O-N 3.12Å; I420-R424 HydrophobicContact CG2-CG 4.42Å; I420-R424 WeakPolarHBondContact O-CB 3.24Å; I420-R424 WeakPolarHBondContact O-CG 3.37Å; I420-R424 PolarHBondContact O-N 3.27Å
421	R	92.4	Very high	93.7	Very high	135 Å²	135	96.7 Å²	96.7	51%	0.509	49%	0.491	S	S	.	.	H	α-helix	trans	-58.6	-48.2	174.9	-74.8	-175.7	-136.4	105.4	3.7	111.3	D417 A418 M423 R424 E425	D417-R421 WeakPolarHBondContact O-CG 3.24Å; D417-R421 PolarHBondContact O-N 3.48Å; A418-R421 PolarHBondContact O-N 3.38Å; R421-M423 PolarHBondContact O-N 3.33Å; R421-R424 WeakPolarHBondContact O-CB 3.35Å; R421-R424 PolarHBondContact O-N 3.32Å; R421-R424 VanDerWaalsContact O-N 3.14Å; R421-E425 WeakPolarHBondContact O-CG 3.28Å; R421-E425 PolarHBondContact O-N 2.85Å
422	K	94.7	Very high	93.6	Very high	126 Å²	126	97.4 Å²	97.4	55%	0.548	49%	0.493	S	S	.	.	H	α-helix	trans	-57.9	-47.9	177.1	-174.1	-179.2	177.2	-171.6	0	112.2	A418 Q419 R424 E425 E426	A418-K422 WeakPolarHBondContact O-CB 3.28Å; A418-K422 PolarHBondContact O-N 2.99Å; Q419-K422 PolarHBondContact O-N 3.48Å; K422-R424 VanDerWaalsContact C-N 3.31Å; K422-R424 PolarHBondContact O-N 2.87Å; K422-E425 PolarHBondContact O-N 3.49Å; K422-E426 WeakPolarHBondContact CE-OE1 3.35Å; K422-E426 IonicContact NZ-OE1 3.59Å; K422-E426 WeakPolarHBondContact O-CB 3.47Å; K422-E426 WeakPolarHBondContact O-CG 3.38Å; K422-E426 PolarHBondContact O-N 2.9Å
423	M	93.9	Very high	93.5	Very high	108 Å²	108	101.8 Å²	101.8	53%	0.532	51%	0.506	S	S	.	.	H	α-helix	trans	-63.2	-36.4	177	-70.8	-61.4	-52.6	0	0	112.2	Q419 I420 R421 E426 C427	Q419-M423 WeakPolarHBondContact O-CB 3.45Å; Q419-M423 VanDerWaalsContact O-CG 3.3Å; Q419-M423 WeakPolarHBondContact O-CG 3.39Å; Q419-M423 PolarHBondContact O-N 3.18Å; I420-M423 PolarHBondContact O-N 3.12Å; R421-M423 PolarHBondContact O-N 3.33Å; M423-E426 PolarHBondContact O-N 2.94Å; M423-C427 WeakPolarHBondContact O-CB 3.42Å; M423-C427 PolarHBondContact O-N 3.27Å; M423-C427 PolarHBondContact O-SG 2.98Å
424	R	93.1	Very high	93.4	Very high	117 Å²	117	102.4 Å²	102.4	44%	0.442	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-45	175.3	-76.9	-178.7	-177	173.6	7.8	111.7	I420 R421 K422 E426 C427 Q428 A620	I420-R424 HydrophobicContact CG2-CG 4.42Å; I420-R424 WeakPolarHBondContact O-CB 3.24Å; I420-R424 WeakPolarHBondContact O-CG 3.37Å; I420-R424 PolarHBondContact O-N 3.27Å; R421-R424 WeakPolarHBondContact O-CB 3.35Å; R421-R424 PolarHBondContact O-N 3.32Å; R421-R424 VanDerWaalsContact O-N 3.14Å; K422-R424 VanDerWaalsContact C-N 3.31Å; K422-R424 PolarHBondContact O-N 2.87Å; R424-E426 VanDerWaalsContact C-N 3.35Å; R424-C427 PolarHBondContact O-N 3Å; R424-Q428 WeakPolarHBondContact O-CB 3.42Å; R424-Q428 PolarHBondContact O-N 3.13Å; R424-A620 PolarHBondContact NH1-O 3.4Å
425	E	94.2	Very high	93.2	Very high	127 Å²	127	102.3 Å²	102.3	59%	0.593	51%	0.506	S	S	*	.	H	α-helix	trans	-60.9	-43.6	175	-71.7	167.9	-166.4	0	0	111.2	R421 K422 Q428 A429	R421-E425 WeakPolarHBondContact O-CG 3.28Å; R421-E425 PolarHBondContact O-N 2.85Å; K422-E425 PolarHBondContact O-N 3.49Å; E425-Q428 PolarHBondContact O-N 3.37Å; E425-A429 WeakPolarHBondContact O-CB 3.38Å; E425-A429 PolarHBondContact O-N 2.93Å
426	E	95.1	Very high	93	Very high	92 Å²	92	103.9 Å²	103.9	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-45.5	174.9	-74.2	175.1	-174.6	0	0	112.2	K422 M423 R424 Q428 A429 L430	K422-E426 WeakPolarHBondContact CE-OE1 3.35Å; K422-E426 IonicContact NZ-OE1 3.59Å; K422-E426 WeakPolarHBondContact O-CB 3.47Å; K422-E426 WeakPolarHBondContact O-CG 3.38Å; K422-E426 PolarHBondContact O-N 2.9Å; M423-E426 PolarHBondContact O-N 2.94Å; R424-E426 VanDerWaalsContact C-N 3.35Å; E426-Q428 VanDerWaalsContact C-N 3.33Å; E426-Q428 PolarHBondContact O-N 2.9Å; E426-A429 PolarHBondContact O-N 3.46Å; E426-L430 WeakPolarHBondContact O-CB 3.07Å; E426-L430 PolarHBondContact O-N 2.93Å
427	C	90.5	Very high	93	Very high	79 Å²	79	102.8 Å²	102.8	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-40	175	-74.6	0	0	0	0	112.1	M423 R424 L430 M431	M423-C427 WeakPolarHBondContact O-CB 3.42Å; M423-C427 PolarHBondContact O-N 3.27Å; M423-C427 PolarHBondContact O-SG 2.98Å; R424-C427 PolarHBondContact O-N 3Å; C427-L430 PolarHBondContact O-N 3.38Å; C427-M431 WeakPolarHBondContact O-CB 3.42Å; C427-M431 PolarHBondContact O-N 3.18Å
428	Q	92.6	Very high	92.9	Very high	124 Å²	124	103.1 Å²	103.1	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-67.4	-42.2	177.8	-171.3	174	5.4	0	0	111.2	R424 E425 E426 M431 V432	R424-Q428 WeakPolarHBondContact O-CB 3.42Å; R424-Q428 PolarHBondContact O-N 3.13Å; E425-Q428 PolarHBondContact O-N 3.37Å; E426-Q428 VanDerWaalsContact C-N 3.33Å; E426-Q428 PolarHBondContact O-N 2.9Å; Q428-M431 PolarHBondContact O-N 3.39Å; Q428-V432 WeakPolarHBondContact O-CG2 3.44Å; Q428-V432 PolarHBondContact O-N 2.95Å
429	A	93	Very high	92.7	Very high	60 Å²	60	104.4 Å²	104.4	50%	0.496	52%	0.518	S	S	.	.	H	α-helix	trans	-60.5	-46.6	174.1	0	0	0	0	0	111.7	E425 E426 M431 V432 E433	E425-A429 WeakPolarHBondContact O-CB 3.38Å; E425-A429 PolarHBondContact O-N 2.93Å; E426-A429 PolarHBondContact O-N 3.46Å; A429-M431 VanDerWaalsContact C-N 3.29Å; A429-M431 PolarHBondContact O-N 2.88Å; A429-V432 PolarHBondContact O-N 3.23Å; A429-E433 PolarHBondContact O-N 2.93Å
430	L	92.6	Very high	92.5	Very high	110 Å²	110	102.9 Å²	102.9	58%	0.576	52%	0.516	S	S	*	.	H	α-helix	trans	-62.2	-37	177.2	-171.9	69.8	0	0	0	112	E426 C427 E433 L434	E426-L430 WeakPolarHBondContact O-CB 3.07Å; E426-L430 PolarHBondContact O-N 2.93Å; C427-L430 PolarHBondContact O-N 3.38Å; L430-E433 PolarHBondContact O-N 3.49Å; L430-L434 VanDerWaalsContact O-CB 3.31Å; L430-L434 WeakPolarHBondContact O-CB 3.31Å; L430-L434 PolarHBondContact O-N 2.93Å
431	M	92.9	Very high	92.4	Very high	126 Å²	126	104.4 Å²	104.4	62%	0.621	52%	0.52	S	S	*	.	H	α-helix	trans	-66.8	-40.6	177	-174.8	169.5	61.3	0	0	112	C427 Q428 A429 L434 Q435	C427-M431 WeakPolarHBondContact O-CB 3.42Å; C427-M431 PolarHBondContact O-N 3.18Å; Q428-M431 PolarHBondContact O-N 3.39Å; A429-M431 VanDerWaalsContact C-N 3.29Å; A429-M431 PolarHBondContact O-N 2.88Å; M431-L434 PolarHBondContact O-N 3.47Å; M431-Q435 PolarHBondContact O-N 3.38Å
432	V	92.6	Very high	92.3	Very high	81 Å²	81	103 Å²	103	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-64.7	-45.1	174.1	172.7	0	0	0	0	110.6	Q428 A429 L434 Q435 M436	Q428-V432 WeakPolarHBondContact O-CG2 3.44Å; Q428-V432 PolarHBondContact O-N 2.95Å; A429-V432 PolarHBondContact O-N 3.23Å; V432-L434 VanDerWaalsContact C-N 3.34Å; V432-L434 PolarHBondContact O-N 3.36Å; V432-Q435 PolarHBondContact O-N 2.76Å; V432-M436 HydrophobicContact CG1-SD 4.22Å; V432-M436 WeakPolarHBondContact O-CG 3.46Å; V432-M436 PolarHBondContact O-N 2.8Å
433	E	93.6	Very high	92.1	Very high	132 Å²	132	99.8 Å²	99.8	62%	0.617	51%	0.51	S	S	*	.	H	α-helix	trans	-60.8	-42.2	177	-171.5	178.5	-174.3	0	0	111.9	A429 L430 Q435 M436 L437	A429-E433 PolarHBondContact O-N 2.93Å; L430-E433 PolarHBondContact O-N 3.49Å; E433-Q435 PolarHBondContact O-N 2.89Å; E433-M436 PolarHBondContact O-N 3.19Å; E433-L437 WeakPolarHBondContact O-CB 3.33Å; E433-L437 PolarHBondContact O-N 3.44Å
434	L	92	Very high	91.8	Very high	115 Å²	115	99.1 Å²	99.1	60%	0.602	51%	0.508	S	S	*	.	H	α-helix	trans	-65.5	-38.5	177	-166	151.6	0	0	0	111.8	L430 M431 V432 L437 L438	L430-L434 VanDerWaalsContact O-CB 3.31Å; L430-L434 WeakPolarHBondContact O-CB 3.31Å; L430-L434 PolarHBondContact O-N 2.93Å; M431-L434 PolarHBondContact O-N 3.47Å; V432-L434 VanDerWaalsContact C-N 3.34Å; V432-L434 PolarHBondContact O-N 3.36Å; L434-L437 PolarHBondContact O-N 3.42Å; L434-L438 WeakPolarHBondContact O-CB 3.47Å; L434-L438 PolarHBondContact O-N 3.28Å
435	Q	90.1	Very high	91.5	Very high	96 Å²	96	96.9 Å²	96.9	45%	0.449	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-44.9	174.5	-173.9	61.6	51.7	0	0	111.3	M431 V432 E433 L437 L438 D439	M431-Q435 PolarHBondContact O-N 3.38Å; V432-Q435 PolarHBondContact O-N 2.76Å; E433-Q435 PolarHBondContact O-N 2.89Å; Q435-L437 VanDerWaalsContact C-N 3.27Å; Q435-L437 PolarHBondContact O-N 3.32Å; Q435-L438 WeakPolarHBondContact O-CB 3.39Å; Q435-L438 PolarHBondContact O-N 2.81Å; Q435-L438 VanDerWaalsContact O-N 3.13Å; Q435-D439 PolarHBondContact NE2-OD1 2.97Å; Q435-D439 VanDerWaalsContact O-CG 3.27Å; Q435-D439 PolarHBondContact O-N 2.68Å
436	M	92.1	Very high	90.8	Very high	122 Å²	122	92.6 Å²	92.6	60%	0.601	49%	0.491	S	S	*	.	H	α-helix	trans	-60.5	-38.4	174.4	-69	178.5	65.8	0	0	111.8	V432 E433 D439 T440	V432-M436 HydrophobicContact CG1-SD 4.22Å; V432-M436 WeakPolarHBondContact O-CG 3.46Å; V432-M436 PolarHBondContact O-N 2.8Å; E433-M436 PolarHBondContact O-N 3.19Å; M436-D439 PolarHBondContact O-N 3.35Å; M436-T440 WeakPolarHBondContact O-CG2 3.43Å; M436-T440 PolarHBondContact O-N 3.22Å; M436-T440 PolarHBondContact O-OG1 2.99Å
437	L	92.1	Very high	90.4	Very high	118 Å²	118	92.2 Å²	92.2	62%	0.618	49%	0.489	S	S	*	.	H	α-helix	trans	-68	-36.5	175.6	-170.9	63.7	0	0	0	112	E433 L434 Q435 T440 K441	E433-L437 WeakPolarHBondContact O-CB 3.33Å; E433-L437 PolarHBondContact O-N 3.44Å; L434-L437 PolarHBondContact O-N 3.42Å; Q435-L437 VanDerWaalsContact C-N 3.27Å; Q435-L437 PolarHBondContact O-N 3.32Å; L437-T440 VanDerWaalsContact CA-OG1 3.29Å; L437-T440 WeakPolarHBondContact CA-OG1 3.45Å; L437-T440 PolarHBondContact O-OG1 3.01Å; L437-K441 VanDerWaalsContact O-CB 3.26Å; L437-K441 WeakPolarHBondContact O-CB 3.43Å; L437-K441 PolarHBondContact O-N 2.84Å
438	L	91.7	Very high	89.9	Confident	70 Å²	70	92 Å²	92	37%	0.366	48%	0.482	S	S	.	.	H	α-helix	trans	-66.4	-45.3	174.5	-177.9	64.7	0	0	0	111.3	L434 Q435 K441 Q442	L434-L438 WeakPolarHBondContact O-CB 3.47Å; L434-L438 PolarHBondContact O-N 3.28Å; Q435-L438 WeakPolarHBondContact O-CB 3.39Å; Q435-L438 PolarHBondContact O-N 2.81Å; Q435-L438 VanDerWaalsContact O-N 3.13Å; L438-K441 PolarHBondContact O-N 2.79Å; L438-Q442 WeakPolarHBondContact O-CB 2.82Å; L438-Q442 WeakPolarHBondContact O-CG 3.39Å; L438-Q442 PolarHBondContact O-N 3.38Å
439	D	89.2	Confident	89.4	Confident	73 Å²	73	88.4 Å²	88.4	39%	0.39	47%	0.474	S	S	.	.	H	α-helix	trans	-63.2	-43	179.2	-66.6	-7.7	0	0	0	111.1	Q435 M436 Q442 T443	Q435-D439 PolarHBondContact NE2-OD1 2.97Å; Q435-D439 VanDerWaalsContact O-CG 3.27Å; Q435-D439 PolarHBondContact O-N 2.68Å; M436-D439 PolarHBondContact O-N 3.35Å; D439-Q442 PolarHBondContact O-N 2.91Å; D439-T443 WeakPolarHBondContact O-CB 3.27Å; D439-T443 PolarHBondContact O-N 3.15Å; D439-T443 PolarHBondContact O-OG1 2.79Å
440	T	91.1	Very high	88.6	Confident	73 Å²	73	87.7 Å²	87.7	45%	0.448	46%	0.461	S	S	.	.	H	α-helix	trans	-64.3	-40.5	173.3	50.5	0	0	0	0	111.8	M436 L437 T443 L444	M436-T440 WeakPolarHBondContact O-CG2 3.43Å; M436-T440 PolarHBondContact O-N 3.22Å; M436-T440 PolarHBondContact O-OG1 2.99Å; L437-T440 VanDerWaalsContact CA-OG1 3.29Å; L437-T440 WeakPolarHBondContact CA-OG1 3.45Å; L437-T440 PolarHBondContact O-OG1 3.01Å; T440-T443 WeakPolarHBondContact O-CB 3.36Å; T440-T443 PolarHBondContact O-N 2.95Å; T440-L444 WeakPolarHBondContact O-CG 3.26Å; T440-L444 PolarHBondContact O-N 3.43Å
441	K	91.7	Very high	87.8	Confident	108 Å²	108	89 Å²	89	47%	0.47	46%	0.459	S	S	.	.	H	α-helix	trans	-63.7	-42.3	175	-172.1	-91.3	179.7	173	0	112.1	L437 L438 T443 L444 D445	L437-K441 VanDerWaalsContact O-CB 3.26Å; L437-K441 WeakPolarHBondContact O-CB 3.43Å; L437-K441 PolarHBondContact O-N 2.84Å; L438-K441 PolarHBondContact O-N 2.79Å; K441-T443 VanDerWaalsContact C-N 3.29Å; K441-T443 PolarHBondContact O-N 3.24Å; K441-L444 PolarHBondContact O-N 3.3Å; K441-D445 WeakPolarHBondContact CD-OD2 3.41Å; K441-D445 VanDerWaalsContact CE-CG 3.45Å; K441-D445 VanDerWaalsContact CE-OD1 3.31Å; K441-D445 WeakPolarHBondContact CE-OD1 3.45Å; K441-D445 WeakPolarHBondContact CE-OD2 3.41Å; K441-D445 IonicContact NZ-OD1 2.81Å; K441-D445 IonicContact NZ-OD2 2.83Å; K441-D445 PolarHBondContact NZ-OD2 2.82Å; K441-D445 WeakPolarHBondContact O-CB 3.37Å; K441-D445 PolarHBondContact O-N 3.21Å
442	Q	90.5	Very high	86.9	Confident	107 Å²	107	90.6 Å²	90.6	50%	0.5	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-38.9	176	-73.8	177.1	-1.6	0	0	111.3	L438 D439 D445 A446	L438-Q442 WeakPolarHBondContact O-CB 2.82Å; L438-Q442 WeakPolarHBondContact O-CG 3.39Å; L438-Q442 PolarHBondContact O-N 3.38Å; D439-Q442 PolarHBondContact O-N 2.91Å; Q442-D445 PolarHBondContact O-N 3.38Å; Q442-A446 WeakPolarHBondContact O-CB 3.48Å; Q442-A446 PolarHBondContact O-N 3.01Å
443	T	88.7	Confident	85.8	Confident	57 Å²	57	92.3 Å²	92.3	35%	0.35	46%	0.459	S	S	.	.	H	α-helix	trans	-61.3	-49.8	173.8	-54.8	0	0	0	0	110.6	D439 T440 K441 D445 A446 E447	D439-T443 WeakPolarHBondContact O-CB 3.27Å; D439-T443 PolarHBondContact O-N 3.15Å; D439-T443 PolarHBondContact O-OG1 2.79Å; T440-T443 WeakPolarHBondContact O-CB 3.36Å; T440-T443 PolarHBondContact O-N 2.95Å; K441-T443 VanDerWaalsContact C-N 3.29Å; K441-T443 PolarHBondContact O-N 3.24Å; T443-D445 PolarHBondContact O-N 3.47Å; T443-A446 WeakPolarHBondContact O-CB 3.49Å; T443-A446 PolarHBondContact O-N 2.98Å; T443-E447 WeakPolarHBondContact O-CG 3.4Å; T443-E447 PolarHBondContact O-N 3.44Å
444	L	88.5	Confident	84.7	Confident	95 Å²	95	90.2 Å²	90.2	50%	0.497	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-39.8	177.2	-70.8	172.2	0	0	0	112.7	T440 K441 A446 E447 I448	T440-L444 WeakPolarHBondContact O-CG 3.26Å; T440-L444 PolarHBondContact O-N 3.43Å; K441-L444 PolarHBondContact O-N 3.3Å; L444-A446 VanDerWaalsContact C-N 3.31Å; L444-A446 PolarHBondContact O-N 3.46Å; L444-E447 WeakPolarHBondContact O-CB 3.46Å; L444-E447 PolarHBondContact O-N 3.26Å; L444-I448 WeakPolarHBondContact O-CB 3.35Å; L444-I448 WeakPolarHBondContact O-CD1 3.29Å; L444-I448 WeakPolarHBondContact O-CG1 3.46Å; L444-I448 PolarHBondContact O-N 2.92Å
445	D	87.8	Confident	83.6	Confident	69 Å²	69	90.8 Å²	90.8	37%	0.369	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-40.2	175.2	-84.1	-9.1	0	0	0	111.9	K441 Q442 T443 I448 A449	K441-D445 WeakPolarHBondContact CD-OD2 3.41Å; K441-D445 VanDerWaalsContact CE-CG 3.45Å; K441-D445 VanDerWaalsContact CE-OD1 3.31Å; K441-D445 WeakPolarHBondContact CE-OD1 3.45Å; K441-D445 WeakPolarHBondContact CE-OD2 3.41Å; K441-D445 IonicContact NZ-OD1 2.81Å; K441-D445 IonicContact NZ-OD2 2.83Å; K441-D445 PolarHBondContact NZ-OD2 2.82Å; K441-D445 WeakPolarHBondContact O-CB 3.37Å; K441-D445 PolarHBondContact O-N 3.21Å; Q442-D445 PolarHBondContact O-N 3.38Å; T443-D445 PolarHBondContact O-N 3.47Å; D445-I448 PolarHBondContact O-N 3.49Å; D445-A449 WeakPolarHBondContact O-CB 3.39Å; D445-A449 PolarHBondContact O-N 2.58Å
446	A	78.9	Confident	82.4	Confident	38 Å²	38	93.3 Å²	93.3	31%	0.314	47%	0.466	S	S	.	.	H	α-helix	trans	-65.4	-43.9	175.8	0	0	0	0	0	110.8	Q442 T443 L444 A449 I450	Q442-A446 WeakPolarHBondContact O-CB 3.48Å; Q442-A446 PolarHBondContact O-N 3.01Å; T443-A446 WeakPolarHBondContact O-CB 3.49Å; T443-A446 PolarHBondContact O-N 2.98Å; L444-A446 VanDerWaalsContact C-N 3.31Å; L444-A446 PolarHBondContact O-N 3.46Å; A446-A449 WeakPolarHBondContact O-CB 3.41Å; A446-A449 PolarHBondContact O-N 2.98Å; A446-I450 VanDerWaalsContact O-CG1 3.28Å; A446-I450 WeakPolarHBondContact O-CG1 3.38Å; A446-I450 PolarHBondContact O-N 3.36Å
447	E	85.7	Confident	80.7	Confident	83 Å²	83	89.2 Å²	89.2	39%	0.388	45%	0.454	S	S	.	.	H	α-helix	trans	-58.8	-48	172.7	-71.3	177	-172.4	0	0	111.4	T443 L444 A449 I450 Y451	T443-E447 WeakPolarHBondContact O-CG 3.4Å; T443-E447 PolarHBondContact O-N 3.44Å; L444-E447 WeakPolarHBondContact O-CB 3.46Å; L444-E447 PolarHBondContact O-N 3.26Å; E447-A449 VanDerWaalsContact C-N 3.3Å; E447-A449 PolarHBondContact O-N 3.47Å; E447-I450 WeakPolarHBondContact O-CB 3.32Å; E447-I450 PolarHBondContact O-N 2.85Å; E447-I450 VanDerWaalsContact O-N 3.14Å; E447-Y451 HydrophobicContact CB-CD2 4.39Å; E447-Y451 HydrophobicContact CB-CE2 4.07Å; E447-Y451 WeakPolarHBondContact O-CD2 3.34Å; E447-Y451 PolarHBondContact O-N 3.24Å
448	I	79.9	Confident	78.8	Confident	75 Å²	75	91.6 Å²	91.6	39%	0.385	46%	0.462	S	S	.	.	H	α-helix	trans	-60	-40.2	176.1	-68.9	163.3	0	0	0	110.7	L444 D445 I450 Y451 R452	L444-I448 WeakPolarHBondContact O-CB 3.35Å; L444-I448 WeakPolarHBondContact O-CD1 3.29Å; L444-I448 WeakPolarHBondContact O-CG1 3.46Å; L444-I448 PolarHBondContact O-N 2.92Å; D445-I448 PolarHBondContact O-N 3.49Å; I448-I450 VanDerWaalsContact C-N 3.33Å; I448-I450 PolarHBondContact O-N 2.86Å; I448-Y451 PolarHBondContact O-N 2.97Å; I448-R452 HydrophobicContact CG2-CG 4.34Å; I448-R452 WeakPolarHBondContact O-CB 3.5Å; I448-R452 VanDerWaalsContact O-CG 3.3Å; I448-R452 WeakPolarHBondContact O-CG 3.32Å; I448-R452 PolarHBondContact O-N 3.35Å
449	A	81.9	Confident	76.7	Confident	49 Å²	49	96.6 Å²	96.6	41%	0.405	48%	0.484	S	S	.	.	H	α-helix	trans	-65.2	-37.1	177	0	0	0	0	0	112.2	D445 A446 E447 K453	D445-A449 WeakPolarHBondContact O-CB 3.39Å; D445-A449 PolarHBondContact O-N 2.58Å; A446-A449 WeakPolarHBondContact O-CB 3.41Å; A446-A449 PolarHBondContact O-N 2.98Å; E447-A449 VanDerWaalsContact C-N 3.3Å; E447-A449 PolarHBondContact O-N 3.47Å; A449-K453 WeakPolarHBondContact O-CB 3.26Å; A449-K453 PolarHBondContact O-N 2.87Å
450	I	76.6	Confident	74.5	Confident	45 Å²	45	99.7 Å²	99.7	23%	0.231	50%	0.5	C	S	.	.	H	α-helix	trans	-66.7	-46.6	173	-63.9	159.9	0	0	0	109.9	A446 E447 I448 R452 K453 M454 V471	A446-I450 VanDerWaalsContact O-CG1 3.28Å; A446-I450 WeakPolarHBondContact O-CG1 3.38Å; A446-I450 PolarHBondContact O-N 3.36Å; E447-I450 WeakPolarHBondContact O-CB 3.32Å; E447-I450 PolarHBondContact O-N 2.85Å; E447-I450 VanDerWaalsContact O-N 3.14Å; I448-I450 VanDerWaalsContact C-N 3.33Å; I448-I450 PolarHBondContact O-N 2.86Å; I450-R452 VanDerWaalsContact C-N 3.34Å; I450-R452 PolarHBondContact O-N 3.45Å; I450-K453 CarbonylContact O-C 3.59Å; I450-K453 PolarHBondContact O-N 3.18Å; I450-M454 HydrophobicContact CG2-CE 3.9Å; I450-M454 WeakPolarHBondContact O-CB 3.47Å; I450-M454 PolarHBondContact O-N 3.25Å; I450-V471 HydrophobicContact CD1-CB 4.33Å; I450-V471 HydrophobicContact CD1-CG1 3.91Å; I450-V471 HydrophobicContact CD1-CG2 3.75Å; I450-V471 HydrophobicContact CG1-CG2 4.2Å
451	Y	76	Confident	72.3	Confident	136 Å²	136	107.7 Å²	107.7	53%	0.533	52%	0.522	S	S	.	.	H	α-helix	trans	-60.6	-42.8	176.5	-69.7	-56.7	0	0	0	111.8	E447 I448 K453 M454 L455	E447-Y451 HydrophobicContact CB-CD2 4.39Å; E447-Y451 HydrophobicContact CB-CE2 4.07Å; E447-Y451 WeakPolarHBondContact O-CD2 3.34Å; E447-Y451 PolarHBondContact O-N 3.24Å; I448-Y451 PolarHBondContact O-N 2.97Å; Y451-K453 PolarHBondContact O-N 3.27Å; Y451-M454 HydrophobicContact CD1-CE 4.38Å; Y451-M454 PolarHBondContact O-N 3.07Å; Y451-L455 WeakPolarHBondContact O-CB 3.4Å; Y451-L455 WeakPolarHBondContact O-CG 3.4Å; Y451-L455 PolarHBondContact O-N 3.32Å
452	R	74.7	Confident	70.4	Confident	160 Å²	160	109.5 Å²	109.5	60%	0.604	54%	0.542	S	S	*	.	H	α-helix	trans	-57.7	-48.1	172.5	-77.3	177.6	-177.9	168.2	2.9	111.3	I448 I450 M454 L455 E456	I448-R452 HydrophobicContact CG2-CG 4.34Å; I448-R452 WeakPolarHBondContact O-CB 3.5Å; I448-R452 VanDerWaalsContact O-CG 3.3Å; I448-R452 WeakPolarHBondContact O-CG 3.32Å; I448-R452 PolarHBondContact O-N 3.35Å; I450-R452 VanDerWaalsContact C-N 3.34Å; I450-R452 PolarHBondContact O-N 3.45Å; R452-M454 VanDerWaalsContact C-N 3.3Å; R452-M454 PolarHBondContact O-N 2.84Å; R452-L455 PolarHBondContact O-N 3.14Å; R452-E456 WeakPolarHBondContact O-CB 3.41Å; R452-E456 VanDerWaalsContact O-CG 3.32Å; R452-E456 WeakPolarHBondContact O-CG 3.31Å; R452-E456 PolarHBondContact O-N 3.36Å
453	K	69.6	Low	68.5	Low	117 Å²	117	106.5 Å²	106.5	51%	0.509	54%	0.541	S	S	.	.	H	α-helix	trans	-63.8	-32.9	175.3	-88.7	-176.9	177.3	174.7	0	113.6	A449 I450 Y451 G457 L467	A449-K453 WeakPolarHBondContact O-CB 3.26Å; A449-K453 PolarHBondContact O-N 2.87Å; I450-K453 CarbonylContact O-C 3.59Å; I450-K453 PolarHBondContact O-N 3.18Å; Y451-K453 PolarHBondContact O-N 3.27Å; K453-G457 WeakPolarHBondContact O-CA 3.49Å; K453-G457 PolarHBondContact O-N 3.29Å; K453-L467 HydrophobicContact CD-CD2 3.72Å
454	M	70.4	Confident	66.4	Low	88 Å²	88	109.1 Å²	109.1	43%	0.433	55%	0.552	S	S	.	*	H	α-helix	trans	-71.3	-36.6	178.4	-151.5	179.8	-51.3	0	0	111	I450 Y451 R452 L464	I450-M454 HydrophobicContact CG2-CE 3.9Å; I450-M454 WeakPolarHBondContact O-CB 3.47Å; I450-M454 PolarHBondContact O-N 3.25Å; Y451-M454 HydrophobicContact CD1-CE 4.38Å; Y451-M454 PolarHBondContact O-N 3.07Å; R452-M454 VanDerWaalsContact C-N 3.3Å; R452-M454 PolarHBondContact O-N 2.84Å; M454-L464 HydrophobicContact CG-CD1 4.36Å
455	L	68.6	Low	64.7	Low	128 Å²	128	114.8 Å²	114.8	67%	0.67	57%	0.566	S	S	*	*	H	α-helix	trans	-74.8	-39	174.3	-72.1	161.5	0	0	0	112.3	Y451 R452	Y451-L455 WeakPolarHBondContact O-CB 3.4Å; Y451-L455 WeakPolarHBondContact O-CG 3.4Å; Y451-L455 PolarHBondContact O-N 3.32Å; R452-L455 PolarHBondContact O-N 3.14Å
456	E	64.4	Low	63	Low	149 Å²	149	119 Å²	119	70%	0.696	58%	0.584	S	S	*	*	H	α-helix	trans	-73.5	-28.7	174.9	-72.3	170.4	-174.9	0	0	112.2	R452 E458	R452-E456 WeakPolarHBondContact O-CB 3.41Å; R452-E456 VanDerWaalsContact O-CG 3.32Å; R452-E456 WeakPolarHBondContact O-CG 3.31Å; R452-E456 PolarHBondContact O-N 3.36Å; E456-E458 VanDerWaalsContact C-N 3.29Å; E456-E458 PolarHBondContact O-N 3.5Å
457	G	56.6	Low	61.5	Low	35 Å²	35	120.2 Å²	120.2	36%	0.361	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-82	2	-177.4	0	0	0	0	0	115	K453 E459 N460	K453-G457 WeakPolarHBondContact O-CA 3.49Å; K453-G457 PolarHBondContact O-N 3.29Å; G457-E459 PolarHBondContact O-N 2.96Å; G457-N460 PolarHBondContact O-N 3.37Å
458	E	52.5	Low	59.8	Low	168 Å²	168	120 Å²	120	79%	0.785	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-57.7	-11.5	172.1	-80.7	-162.7	149.1	0	0	113.2	E456	E456-E458 VanDerWaalsContact C-N 3.29Å; E456-E458 PolarHBondContact O-N 3.5Å
459	E	47.7	Very low	58.4	Low	176 Å²	176	120.8 Å²	120.8	82%	0.822	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-92.5	-17.2	170.1	-75.9	-166.2	139.9	0	0	116.5	G457	G457-E459 PolarHBondContact O-N 2.96Å
460	N	43.8	Very low	56.9	Low	137 Å²	137	124.6 Å²	124.6	73%	0.733	60%	0.601	S	S	*	*			trans	-137.9	87.5	-173.9	-76.1	75.1	0	0	0	114.4	G457 T462	G457-N460 PolarHBondContact O-N 3.37Å; N460-T462 PolarHBondContact O-N 3.22Å; N460-T462 VanDerWaalsContact O-N 3.07Å
461	R	44.2	Very low	55.6	Low	241 Å²	241	124.3 Å²	124.3	91%	0.909	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	11.8	-164.4	-112.6	177.5	175.2	-174.9	-1.1	120.3
462	T	51.9	Low	54.4	Low	146 Å²	146	122 Å²	122	90%	0.896	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.9	-5	-170.5	50.9	0	0	0	0	117.1	N460	N460-T462 PolarHBondContact O-N 3.22Å; N460-T462 VanDerWaalsContact O-N 3.07Å
463	G	49.8	Very low	53.1	Low	45 Å²	45	120.3 Å²	120.3	46%	0.464	60%	0.598	S	S	.	*	S	Bend	trans	-93.3	-8.6	178	0	0	0	0	0	116	R465 Q466	G463-R465 PolarHBondContact O-N 2.78Å; G463-Q466 PolarHBondContact O-N 3.42Å
464	L	45.1	Very low	52.1	Low	111 Å²	111	118.8 Å²	118.8	58%	0.581	60%	0.599	S	S	*	*	H	α-helix	trans	-63.3	-34.2	-161.7	-168.1	65.9	0	0	0	114.3	M454	M454-L464 HydrophobicContact CG-CD1 4.36Å
465	R	52.2	Low	50.9	Low	214 Å²	214	119.9 Å²	119.9	81%	0.808	60%	0.602	S	S	*	*	H	α-helix	trans	-74.8	-33.5	-175.7	-150.5	177.6	-169.4	-91.6	4.1	112.9	G463 L467 E469	G463-R465 PolarHBondContact O-N 2.78Å; R465-L467 VanDerWaalsContact C-N 3.32Å; R465-L467 PolarHBondContact O-N 3.22Å; R465-E469 PolarHBondContact O-N 2.99Å
466	Q	52.1	Low	49.5	Very low	158 Å²	158	118 Å²	118	74%	0.738	60%	0.599	S	S	*	*	H	α-helix	trans	-72.5	-26.8	-179.1	-102.9	178.1	-4.4	0	0	112.7	G463 Q470	G463-Q466 PolarHBondContact O-N 3.42Å; Q466-Q470 PolarHBondContact O-N 3.3Å
467	L	48.3	Very low	48.2	Very low	63 Å²	63	117.8 Å²	117.8	33%	0.33	60%	0.602	S	S	.	*	H	α-helix	trans	-81.9	-37.4	-178.2	-141.1	117.9	0	0	0	112.5	K453 R465 E469 Q470 V471	K453-L467 HydrophobicContact CD-CD2 3.72Å; R465-L467 VanDerWaalsContact C-N 3.32Å; R465-L467 PolarHBondContact O-N 3.22Å; L467-E469 PolarHBondContact O-N 3.38Å; L467-Q470 PolarHBondContact O-N 2.94Å; L467-V471 PolarHBondContact O-N 3.48Å
468	V	49.7	Very low	47.3	Very low	79 Å²	79	124.2 Å²	124.2	48%	0.479	62%	0.623	S	S	.	*	H	α-helix	trans	-59.9	-37	172.5	175.1	0	0	0	0	110.7	V471 V472	V468-V471 PolarHBondContact O-N 3.45Å; V468-V472 PolarHBondContact O-N 3.5Å
469	E	49.8	Very low	46.6	Very low	92 Å²	92	125.3 Å²	125.3	43%	0.43	63%	0.628	S	S	.	*	H	α-helix	trans	-72.4	-30.2	179	-156.6	178.7	150.8	0	0	113	R465 L467 V471 V472 K473	R465-E469 PolarHBondContact O-N 2.99Å; L467-E469 PolarHBondContact O-N 3.38Å; E469-V471 VanDerWaalsContact C-N 3.33Å; E469-V472 PolarHBondContact O-N 2.84Å; E469-K473 WeakPolarHBondContact O-CB 3.42Å; E469-K473 PolarHBondContact O-N 3.2Å; E469-K473 IonicContact OE1-NZ 3.45Å; E469-K473 PolarHBondContact OE1-NZ 3.36Å
470	Q	50.3	Low	46.1	Very low	129 Å²	129	124.2 Å²	124.2	60%	0.603	62%	0.623	S	S	*	*	H	α-helix	trans	-65.9	-35.9	171.1	-86.6	-176.5	-29.3	0	0	112	Q466 L467 K473 T474	Q466-Q470 PolarHBondContact O-N 3.3Å; L467-Q470 PolarHBondContact O-N 2.94Å; Q470-K473 PolarHBondContact O-N 3.34Å; Q470-T474 WeakPolarHBondContact O-CG2 3.49Å; Q470-T474 PolarHBondContact O-N 3.48Å; Q470-T474 PolarHBondContact O-OG1 2.79Å; Q470-T474 VanDerWaalsContact O-OG1 3.07Å
471	V	50.2	Low	45.9	Very low	38 Å²	38	125.5 Å²	125.5	23%	0.23	63%	0.625	C	S	.	*	H	α-helix	trans	-68.8	-40.9	177.5	174.1	0	0	0	0	111.3	I450 L467 V468 E469 K473 T474 H475	I450-V471 HydrophobicContact CD1-CB 4.33Å; I450-V471 HydrophobicContact CD1-CG1 3.91Å; I450-V471 HydrophobicContact CD1-CG2 3.75Å; I450-V471 HydrophobicContact CG1-CG2 4.2Å; L467-V471 PolarHBondContact O-N 3.48Å; V468-V471 PolarHBondContact O-N 3.45Å; E469-V471 VanDerWaalsContact C-N 3.33Å; V471-K473 VanDerWaalsContact C-N 3.34Å; V471-T474 PolarHBondContact O-OG1 2.83Å; V471-H475 WeakPolarHBondContact O-CB 3.45Å; V471-H475 PolarHBondContact O-CD2 3.19Å; V471-H475 PolarHBondContact O-N 3.39Å
472	V	51.2	Low	45.4	Very low	89 Å²	89	121.7 Å²	121.7	54%	0.539	62%	0.622	S	S	.	*	H	α-helix	trans	-67.7	-36.9	174.7	179.5	0	0	0	0	111.2	V468 E469 H475 S476	V468-V472 PolarHBondContact O-N 3.5Å; E469-V472 PolarHBondContact O-N 2.84Å; V472-H475 PolarHBondContact O-N 3.17Å; V472-S476 PolarHBondContact O-N 2.96Å; V472-S476 PolarHBondContact O-OG 3.46Å
473	K	47.3	Very low	44.9	Very low	124 Å²	124	120.3 Å²	120.3	54%	0.539	61%	0.614	S	S	.	*	H	α-helix	trans	-72.9	-32.8	178.3	-87.7	170.8	173.5	151.2	0	113.7	E469 Q470 V471	E469-K473 WeakPolarHBondContact O-CB 3.42Å; E469-K473 PolarHBondContact O-N 3.2Å; E469-K473 IonicContact OE1-NZ 3.45Å; E469-K473 PolarHBondContact OE1-NZ 3.36Å; Q470-K473 PolarHBondContact O-N 3.34Å; V471-K473 VanDerWaalsContact C-N 3.34Å
474	T	47.4	Very low	44.4	Very low	85 Å²	85	126.1 Å²	126.1	52%	0.521	63%	0.629	S	S	.	*	H	α-helix	trans	-74.6	-30	170.8	53.2	0	0	0	0	112	Q470 V471 S476	Q470-T474 WeakPolarHBondContact O-CG2 3.49Å; Q470-T474 PolarHBondContact O-N 3.48Å; Q470-T474 PolarHBondContact O-OG1 2.79Å; Q470-T474 VanDerWaalsContact O-OG1 3.07Å; V471-T474 PolarHBondContact O-OG1 2.83Å; T474-S476 VanDerWaalsContact C-N 3.28Å; T474-S476 PolarHBondContact O-N 3.5Å
475	H	45.8	Very low	43.9	Very low	111 Å²	111	126.5 Å²	126.5	51%	0.514	64%	0.641	S	S	.	*	H	α-helix	trans	-72.2	-18.6	176	-84.9	-55.6	0	0	0	114.5	V471 V472	V471-H475 WeakPolarHBondContact O-CB 3.45Å; V471-H475 PolarHBondContact O-CD2 3.19Å; V471-H475 PolarHBondContact O-N 3.39Å; V472-H475 PolarHBondContact O-N 3.17Å
476	S	40	Very low	43.4	Very low	87 Å²	87	123.5 Å²	123.5	61%	0.608	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-5.6	-178	-47.5	0	0	0	0	114	V472 T474	V472-S476 PolarHBondContact O-N 2.96Å; V472-S476 PolarHBondContact O-OG 3.46Å; T474-S476 VanDerWaalsContact C-N 3.28Å; T474-S476 PolarHBondContact O-N 3.5Å
477	L	37.5	Very low	42.9	Very low	145 Å²	145	126.7 Å²	126.7	76%	0.759	64%	0.643	S	S	*	*	S	Bend	trans	-114.4	11.3	-169.6	-76	173.9	0	0	0	115.4
478	Q	36.6	Very low	42.8	Very low	170 Å²	170	129.3 Å²	129.3	79%	0.794	66%	0.662	S	S	*	*	S	Bend	trans	-120.3	12.1	177.9	-109.5	152.4	-30	0	0	114.9
479	Q	37.1	Very low	42.5	Very low	192 Å²	192	131.1 Å²	131.1	90%	0.897	67%	0.672	S	S	*	*	S	Bend	trans	-96.1	13.1	178.8	-119.9	177.4	17.1	0	0	114.9
480	Q	39.1	Very low	42.2	Very low	153 Å²	153	135.8 Å²	135.8	72%	0.715	69%	0.691	S	S	*	*	S	Bend	trans	-150.2	118.2	178.8	-145	167.6	-13.6	0	0	110.5
481	E	38.2	Very low	42	Very low	163 Å²	163	131.3 Å²	131.3	76%	0.762	68%	0.68	S	S	*	*	S	Bend	trans	95.1	28.2	169	-52.3	-161.8	160.4	0	0	120.8
482	D	34.6	Very low	41.9	Very low	161 Å²	161	137.6 Å²	137.6	86%	0.861	71%	0.707	S	S	*	*			trans	-110	53.7	145.4	-80	-33.6	0	0	0	109.5	E484	D482-E484 PolarHBondContact O-N 2.91Å; D482-E484 VanDerWaalsContact O-N 3.08Å
483	T	41.7	Very low	41.7	Very low	117 Å²	117	138.4 Å²	138.4	72%	0.718	71%	0.706	S	S	*	*			trans	-57.6	107.6	155.9	35.9	0	0	0	0	108.1	S485	T483-S485 PolarHBondContact O-N 3.28Å
484	E	38.2	Very low	42.3	Very low	168 Å²	168	135 Å²	135	79%	0.785	70%	0.701	S	S	*	*			trans	49.4	68	144	-61	179.3	164.3	0	0	113.9	D482 M486	D482-E484 PolarHBondContact O-N 2.91Å; D482-E484 VanDerWaalsContact O-N 3.08Å; E484-M486 PolarHBondContact O-N 2.81Å
485	S	35.7	Very low	43.1	Very low	119 Å²	119	134.9 Å²	134.9	83%	0.832	70%	0.7	S	S	*	*			trans	-69.2	67.1	143.9	50.3	0	0	0	0	108	T483 R487	T483-S485 PolarHBondContact O-N 3.28Å; S485-R487 PolarHBondContact O-N 2.9Å
486	M	41.1	Very low	44.7	Very low	150 Å²	150	137.7 Å²	137.7	74%	0.739	71%	0.706	S	S	*	*			trans	-55.2	98	163.6	179.3	166.6	59	0	0	105.1	E484 V488	E484-M486 PolarHBondContact O-N 2.81Å; M486-V488 PolarHBondContact O-N 3.46Å
487	R	42.1	Very low	46.7	Very low	225 Å²	225	136.3 Å²	136.3	85%	0.849	69%	0.694	S	S	*	*			trans	-57.4	99.4	169.3	-170.8	179.5	-161.6	172.9	5.2	104.5	S485 V489	S485-R487 PolarHBondContact O-N 2.9Å; R487-V489 PolarHBondContact O-N 3.44Å
488	V	45.4	Very low	49	Very low	119 Å²	119	132.7 Å²	132.7	72%	0.721	68%	0.681	S	S	*	*			trans	-56.4	97.1	173.6	177.7	0	0	0	0	105.3	M486 K490	M486-V488 PolarHBondContact O-N 3.46Å; V488-K490 VanDerWaalsContact C-N 3.32Å; V488-K490 PolarHBondContact O-N 2.93Å
489	V	44.2	Very low	51.6	Low	116 Å²	116	129.3 Å²	129.3	70%	0.703	66%	0.664	S	S	*	*			trans	-60.8	106.9	167	174	0	0	0	0	103	R487 G491	R487-V489 PolarHBondContact O-N 3.44Å; V489-G491 PolarHBondContact O-N 2.93Å
490	K	42.1	Very low	54.1	Low	190 Å²	190	126.2 Å²	126.2	83%	0.826	65%	0.65	S	S	*	*			trans	-53.8	97.8	170.2	-99.9	177.2	168.9	174.5	0	105.9	V488 E492	V488-K490 VanDerWaalsContact C-N 3.32Å; V488-K490 PolarHBondContact O-N 2.93Å; K490-E492 PolarHBondContact O-N 2.87Å; K490-E492 VanDerWaalsContact O-N 3.09Å
491	G	47.3	Very low	56.6	Low	35 Å²	35	125.1 Å²	125.1	36%	0.361	64%	0.639	S	S	.	*			trans	-54.7	119	169.1	0	0	0	0	0	106.7	V489 M493	V489-G491 PolarHBondContact O-N 2.93Å; G491-M493 PolarHBondContact O-N 3.49Å
492	E	46.9	Very low	59.2	Low	171 Å²	171	120.6 Å²	120.6	80%	0.799	63%	0.625	S	S	*	*			trans	-60.1	110.6	175.6	-68.5	-176.9	152.4	0	0	107.2	K490 A494	K490-E492 PolarHBondContact O-N 2.87Å; K490-E492 VanDerWaalsContact O-N 3.09Å; E492-A494 VanDerWaalsContact C-N 3.34Å; E492-A494 PolarHBondContact O-N 3.2Å
493	M	48.4	Very low	61.9	Low	105 Å²	105	115.2 Å²	115.2	52%	0.517	60%	0.603	S	S	.	*			trans	-71.2	93.2	176.9	-69	180	74.6	0	0	108.1	G491 T495	G491-M493 PolarHBondContact O-N 3.49Å; M493-T495 PolarHBondContact O-N 3.23Å
494	A	59	Low	64.2	Low	53 Å²	53	115.2 Å²	115.2	44%	0.438	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.8	107.8	172.1	0	0	0	0	0	109.3	E492 R496	E492-A494 VanDerWaalsContact C-N 3.34Å; E492-A494 PolarHBondContact O-N 3.2Å; A494-R496 PolarHBondContact O-N 3.33Å
495	T	64.8	Low	66.6	Low	82 Å²	82	109.6 Å²	109.6	50%	0.503	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.2	113.2	173.2	-55.4	0	0	0	0	108.3	M493 Q614	M493-T495 PolarHBondContact O-N 3.23Å; T495-Q614 HydrophobicContact CG2-CG 4.49Å
496	R	78.5	Confident	69.3	Low	170 Å²	170	105.7 Å²	105.7	64%	0.642	55%	0.55	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.1	172.9	-72.3	-178.1	73.5	150.7	0.8	109.2	A494 S612 S613	A494-R496 PolarHBondContact O-N 3.33Å; R496-S612 WeakPolarHBondContact O-CA 3.41Å; R496-S613 PolarHBondContact N-O 3.4Å; R496-S613 PolarHBondContact O-N 3.24Å
497	T	82	Confident	71.8	Confident	58 Å²	58	98.7 Å²	98.7	36%	0.356	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.5	175.6	-52.7	0	0	0	0	109.2	F499 Q610 S612	T497-F499 HydrophobicContact CG2-CE1 3.96Å; T497-F499 HydrophobicContact CG2-CE2 4.04Å; T497-F499 HydrophobicContact CG2-CZ 3.61Å; T497-Q610 HydrophobicContact CG2-CG 3.57Å; T497-S612 PolarHBondContact OG1-OG 3.29Å
498	S	87	Confident	74.4	Confident	69 Å²	69	88.8 Å²	88.8	48%	0.483	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	147.1	176.3	62.8	0	0	0	0	110.5	Q610 R611	S498-Q610 WeakPolarHBondContact O-CA 3.49Å; S498-R611 PolarHBondContact N-O 3.48Å; S498-R611 PolarHBondContact O-N 3.32Å; S498-R611 PolarHBondContact OG-O 2.82Å
499	F	89.2	Confident	76.8	Confident	100 Å²	100	83.4 Å²	83.4	44%	0.439	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.2	179.9	-56.6	-81.2	0	0	0	109.7	T497 H608 I609 Q610	T497-F499 HydrophobicContact CG2-CE1 3.96Å; T497-F499 HydrophobicContact CG2-CE2 4.04Å; T497-F499 HydrophobicContact CG2-CZ 3.61Å; F499-H608 AromaticContact CD1-CE1 3.67Å; F499-H608 AromaticContact CD1-NE2 3.71Å; F499-I609 CarbonylContact C-O 3.58Å; F499-I609 WeakPolarHBondContact CA-O 3.36Å; F499-Q610 HydrophobicContact CD1-CB 4.03Å; F499-Q610 HydrophobicContact CD1-CG 4.02Å; F499-Q610 HydrophobicContact CE1-CB 4.16Å; F499-Q610 HydrophobicContact CE1-CG 3.71Å
500	Q	91.2	Very high	79	Confident	127 Å²	127	78.3 Å²	78.3	59%	0.593	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.4	172.4	-176.8	-179.5	-1.7	0	0	108.5	H608 I609	Q500-H608 CarbonylContact O-C 3.56Å; Q500-H608 WeakPolarHBondContact O-CA 3.16Å; Q500-I609 HydrophobicContact CB-CB 4.32Å; Q500-I609 PolarHBondContact N-O 3.5Å; Q500-I609 PolarHBondContact O-N 3.41Å
501	R	91.8	Very high	81.4	Confident	130 Å²	130	74.4 Å²	74.4	49%	0.491	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.8	-175.5	-60.2	172	-174.1	-98.6	0.1	109.6	I509 G510 T607 H608	R501-I509 PolarHBondContact NH1-O 3.37Å; R501-G510 PolarHBondContact NH1-O 2.98Å; R501-T607 CarbonylContact C-O 3.55Å; R501-T607 WeakPolarHBondContact CA-O 3.29Å; R501-H608 PolarHBondContact NH1-CD2 3.32Å
502	S	92.2	Very high	83.5	Confident	68 Å²	68	73 Å²	73	48%	0.476	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	141.2	173.2	-175.4	0	0	0	0	109.1	A606 T607	S502-A606 CarbonylContact O-C 3.58Å; S502-A606 VanDerWaalsContact O-CA 3.29Å; S502-A606 WeakPolarHBondContact O-CA 3.39Å; S502-T607 PolarHBondContact N-O 3.48Å; S502-T607 PolarHBondContact O-N 2.98Å
503	A	91.5	Very high	85.6	Confident	47 Å²	47	65.2 Å²	65.2	39%	0.388	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	127.9	175	0	0	0	0	0	109.6	K605 A606	A503-K605 CarbonylContact C-O 3.52Å; A503-K605 WeakPolarHBondContact CA-O 3Å; A503-A606 HydrophobicContact CB-CB 4.27Å
504	K	89	Confident	87.2	Confident	117 Å²	117	63.6 Å²	63.6	51%	0.509	35%	0.35	S	S	.	.	S	Bend	trans	-103.1	77.9	173.5	-64.4	171.6	-179.8	167.1	0	107.8	E604 K605	K504-E604 WeakPolarHBondContact CD-O 3.29Å; K504-E604 IonicContact NZ-OE2 3.8Å; K504-E604 PolarHBondContact NZ-OE2 3.18Å; K504-K605 CarbonylContact C-O 3.56Å; K504-K605 WeakPolarHBondContact CA-O 3.33Å; K504-K605 PolarHBondContact N-O 3.49Å; K504-K605 WeakPolarHBondContact O-CD 3.32Å
505	G	88.7	Confident	88.5	Confident	50 Å²	50	66.8 Å²	66.8	52%	0.515	36%	0.356	S	S	.	.	S	Bend	trans	127.6	-157.3	177.2	0	0	0	0	0	113
506	N	92.5	Very high	89.7	Confident	37 Å²	37	62.9 Å²	62.9	20%	0.198	33%	0.332	C	S	.	.	S	Bend	trans	-82.9	-11.8	-168.6	-70.3	-13	0	0	0	114	N523 T524 H525 E530	N506-N523 CarbonylContact O-C 3.51Å; N506-N523 WeakPolarHBondContact O-CA 3.42Å; N506-N523 PolarHBondContact O-OD1 2.82Å; N506-T524 PolarHBondContact O-N 3.44Å; N506-T524 PolarHBondContact O-OG1 3.21Å; N506-T524 VanDerWaalsContact O-OG1 3.13Å; N506-H525 HydrophobicContact CB-CB 3.91Å; N506-H525 PolarHBondContact OD1-CD2 2.93Å; N506-E530 HydrophobicContact CB-CG 3.56Å; N506-E530 PolarHBondContact ND2-OE1 3.4Å
507	V	93.9	Very high	90.4	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.024	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.8	-175.7	-176.7	0	0	0	0	108.9	L521 E522 E530 L532 L557 L597	V507-L521 HydrophobicContact CG1-CB 4.38Å; V507-E522 CarbonylContact C-O 3.56Å; V507-E522 WeakPolarHBondContact CA-O 3.39Å; V507-E530 HydrophobicContact CG2-CB 3.8Å; V507-E530 HydrophobicContact CG2-CG 4Å; V507-L532 HydrophobicContact CG1-CD2 4.3Å; V507-L532 HydrophobicContact CG2-CD2 4.03Å; V507-L557 HydrophobicContact CG1-CD2 4.41Å; V507-L597 HydrophobicContact CB-CD2 4.31Å; V507-L597 HydrophobicContact CG1-CD2 3.67Å
508	S	95.7	Very high	91	Very high	17 Å²	17	56.6 Å²	56.6	12%	0.119	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	154.4	178.8	107	0	0	0	0	110.5	L521 E522	S508-L521 WeakPolarHBondContact O-CA 3.39Å; S508-E522 PolarHBondContact N-O 3.24Å; S508-E522 PolarHBondContact O-N 3.07Å; S508-E522 VanDerWaalsContact OG-CD 3.28Å; S508-E522 WeakPolarHBondContact OG-CG 3.5Å; S508-E522 PolarHBondContact OG-OE1 3.02Å
509	I	95.9	Very high	91.5	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	108.9	167.8	-60.8	164	0	0	0	107.7	R501 I519 L521 T595 L597 A606 H608	R501-I509 PolarHBondContact NH1-O 3.37Å; I509-I519 HydrophobicContact CG2-CG2 4.16Å; I509-L521 HydrophobicContact CB-CD2 4.19Å; I509-L521 HydrophobicContact CG1-CD2 3.57Å; I509-L521 HydrophobicContact CG2-CD2 4.46Å; I509-T595 HydrophobicContact CD1-CG2 4.13Å; I509-T595 WeakPolarHBondContact CD1-O 3.32Å; I509-L597 HydrophobicContact CD1-CB 4.33Å; I509-A606 HydrophobicContact CD1-CB 3.99Å; I509-A606 WeakPolarHBondContact CD1-O 3.46Å; I509-A606 HydrophobicContact CG1-CB 3.85Å; I509-H608 HydrophobicContact CB-CB 4.03Å; I509-H608 HydrophobicContact CD1-CB 4.13Å; I509-H608 HydrophobicContact CG2-CB 3.74Å
510	G	91.6	Very high	91.8	Very high	8 Å²	8	49.8 Å²	49.8	8%	0.082	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-142.4	175.5	0	0	0	0	0	111.7	R501 C512 I520	R501-G510 PolarHBondContact NH1-O 2.98Å; G510-C512 PolarHBondContact O-N 2.99Å; G510-I520 WeakPolarHBondContact CA-O 3.49Å; G510-I520 PolarHBondContact N-O 3.5Å
511	E	92.1	Very high	92	Very high	108 Å²	108	43.7 Å²	43.7	51%	0.505	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	128.8	-175.9	-165.3	-173.7	157.4	0	0	112.6	F518 I520	E511-F518 HydrophobicContact CG-CE2 4.42Å; E511-I520 HydrophobicContact CB-CD1 4.04Å; E511-I520 HydrophobicContact CB-CG1 4.43Å; E511-I520 PolarHBondContact O-N 3.32Å
512	C	91.8	Very high	92.1	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.034	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.1	168.3	-67.6	0	0	0	0	107.1	G510 P514	G510-C512 PolarHBondContact O-N 2.99Å; C512-P514 WeakPolarHBondContact O-CD 3.28Å
513	S	90.4	Very high	92.3	Very high	8 Å²	8	38.3 Å²	38.3	6%	0.056	21%	0.211	C	C	.	.			trans	-59.2	125.9	178.3	175.6	0	0	0	0	110	E515 G516 K517 F518	S513-E515 PolarHBondContact O-N 3Å; S513-E515 PolarHBondContact OG-N 3.48Å; S513-G516 PolarHBondContact O-N 2.83Å; S513-K517 PolarHBondContact OG-N 3.35Å; S513-F518 WeakPolarHBondContact CB-O 3.46Å; S513-F518 PolarHBondContact N-O 2.89Å
514	P	82.7	Confident	92.3	Very high	72 Å²	72	39.7 Å²	39.7	47%	0.468	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.5	176.2	-25.2	34.7	0	0	0	113	C512 G516	C512-P514 WeakPolarHBondContact O-CD 3.28Å; P514-G516 VanDerWaalsContact C-N 3.29Å
515	E	86	Confident	92.5	Very high	119 Å²	119	37.1 Å²	37.1	56%	0.556	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	1.7	178	-61.2	178	-177.9	0	0	113	S513 K517 V589	S513-E515 PolarHBondContact O-N 3Å; S513-E515 PolarHBondContact OG-N 3.48Å; E515-K517 HydrophobicContact CB-CD 4.42Å; E515-K517 HydrophobicContact CB-CG 4.25Å; E515-K517 WeakPolarHBondContact OE2-CE 2.99Å; E515-K517 IonicContact OE2-NZ 2.58Å; E515-K517 PolarHBondContact OE2-NZ 3.33Å; E515-V589 VanDerWaalsContact C-CG2 3.47Å; E515-V589 WeakPolarHBondContact O-CG2 3.49Å
516	G	89.8	Confident	92.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	73.5	23.3	179.6	0	0	0	0	0	114.3	S513 P514 T586 W587	S513-G516 PolarHBondContact O-N 2.83Å; P514-G516 VanDerWaalsContact C-N 3.29Å; G516-T586 PolarHBondContact O-OG1 3.42Å; G516-W587 WeakPolarHBondContact O-CB 3.46Å; G516-W587 PolarHBondContact O-N 2.88Å
517	K	93.9	Very high	92.4	Very high	72 Å²	72	49.2 Å²	49.2	31%	0.313	25%	0.247	S	C	.	.	S	Bend	trans	-77.6	-41.2	-178.6	-68.4	176.4	167.6	163.5	0	114	S513 E515 W566 A567 Q570	S513-K517 PolarHBondContact OG-N 3.35Å; E515-K517 HydrophobicContact CB-CD 4.42Å; E515-K517 HydrophobicContact CB-CG 4.25Å; E515-K517 WeakPolarHBondContact OE2-CE 2.99Å; E515-K517 IonicContact OE2-NZ 2.58Å; E515-K517 PolarHBondContact OE2-NZ 3.33Å; K517-W566 HydrophobicContact CB-CZ3 4.35Å; K517-A567 PolarHBondContact O-N 3.45Å; K517-Q570 HydrophobicContact CB-CB 4.23Å; K517-Q570 HydrophobicContact CG-CB 4.34Å; K517-Q570 HydrophobicContact CG-CG 4.43Å
518	F	94.8	Very high	92.3	Very high	25 Å²	25	54 Å²	54	11%	0.11	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	163.7	-176.6	63	-95.6	0	0	0	112	E511 S513 I520 K564 V565 W566	E511-F518 HydrophobicContact CG-CE2 4.42Å; S513-F518 WeakPolarHBondContact CB-O 3.46Å; S513-F518 PolarHBondContact N-O 2.89Å; F518-I520 HydrophobicContact CD2-CD1 4.26Å; F518-I520 HydrophobicContact CD2-CG1 3.79Å; F518-I520 HydrophobicContact CE2-CD1 3.85Å; F518-I520 HydrophobicContact CE2-CG1 3.86Å; F518-K564 HydrophobicContact CB-CD 4.28Å; F518-K564 HydrophobicContact CB-CG 3.94Å; F518-K564 HydrophobicContact CD2-CD 4.01Å; F518-K564 HydrophobicContact CD2-CG 3.97Å; F518-K564 HydrophobicContact CG-CD 4.01Å; F518-K564 HydrophobicContact CG-CG 4.08Å; F518-V565 CarbonylContact C-O 3.57Å; F518-V565 VanDerWaalsContact CA-O 3.25Å; F518-V565 WeakPolarHBondContact CA-O 3.17Å; F518-W566 HydrophobicContact CB-CD2 3.92Å; F518-W566 HydrophobicContact CB-CE3 3.88Å; F518-W566 HydrophobicContact CB-CG 4.3Å; F518-W566 HydrophobicContact CB-CZ3 4.36Å; F518-W566 HydrophobicContact CD1-CE3 4.06Å; F518-W566 AromaticContact CD1-CH2 3.86Å; F518-W566 HydrophobicContact CD1-CH2 3.86Å; F518-W566 HydrophobicContact CD1-CZ2 4.42Å; F518-W566 AromaticContact CD1-CZ3 3.67Å; F518-W566 HydrophobicContact CD1-CZ3 3.67Å; F518-W566 HydrophobicContact CE1-CH2 4.39Å; F518-W566 HydrophobicContact CE1-CZ3 4.49Å; F518-W566 HydrophobicContact CG-CE3 4.4Å; F518-W566 HydrophobicContact CG-CZ3 4.41Å
519	I	95.7	Very high	92.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	133.4	170.1	-60	173.8	0	0	0	108.2	I509 L537 V565 W587 T595	I509-I519 HydrophobicContact CG2-CG2 4.16Å; I519-L537 HydrophobicContact CB-CD2 4.23Å; I519-L537 HydrophobicContact CD1-CD2 4.12Å; I519-L537 HydrophobicContact CG2-CD2 3.98Å; I519-V565 PolarHBondContact N-O 2.99Å; I519-V565 PolarHBondContact O-N 3.47Å; I519-W587 HydrophobicContact CD1-CB 4.41Å; I519-W587 HydrophobicContact CD1-CD2 3.41Å; I519-W587 VanDerWaalsContact CD1-CD2 3.41Å; I519-W587 HydrophobicContact CD1-CE3 3.52Å; I519-W587 HydrophobicContact CD1-CG 3.84Å; I519-W587 HydrophobicContact CD1-CH2 4.13Å; I519-W587 HydrophobicContact CD1-CZ2 4.08Å; I519-W587 HydrophobicContact CD1-CZ3 3.88Å; I519-W587 HydrophobicContact CG1-CD2 4.02Å; I519-W587 HydrophobicContact CG1-CG 4.02Å; I519-T595 HydrophobicContact CD1-CG2 4Å
520	I	96	Very high	92.1	Very high	25 Å²	25	58.5 Å²	58.5	13%	0.128	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.8	176.5	-55.2	-177.5	0	0	0	109.4	G510 E511 F518 V563 K564	G510-I520 WeakPolarHBondContact CA-O 3.49Å; G510-I520 PolarHBondContact N-O 3.5Å; E511-I520 HydrophobicContact CB-CD1 4.04Å; E511-I520 HydrophobicContact CB-CG1 4.43Å; E511-I520 PolarHBondContact O-N 3.32Å; F518-I520 HydrophobicContact CD2-CD1 4.26Å; F518-I520 HydrophobicContact CD2-CG1 3.79Å; F518-I520 HydrophobicContact CE2-CD1 3.85Å; F518-I520 HydrophobicContact CE2-CG1 3.86Å; I520-V563 WeakPolarHBondContact CA-O 3.32Å; I520-K564 HydrophobicContact CG1-CB 4.32Å; I520-K564 HydrophobicContact CG1-CG 4.06Å
521	L	95.9	Very high	92.1	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141.3	163.3	-58.2	-179.4	0	0	0	109.1	V507 S508 I509 L532 L537 F551 S562 V563 L597	V507-L521 HydrophobicContact CG1-CB 4.38Å; S508-L521 WeakPolarHBondContact O-CA 3.39Å; I509-L521 HydrophobicContact CB-CD2 4.19Å; I509-L521 HydrophobicContact CG1-CD2 3.57Å; I509-L521 HydrophobicContact CG2-CD2 4.46Å; L521-L532 HydrophobicContact CD1-CD1 4.44Å; L521-L537 HydrophobicContact CD2-CD1 4.3Å; L521-F551 HydrophobicContact CD1-CE1 4.28Å; L521-F551 HydrophobicContact CD1-CE2 3.73Å; L521-F551 HydrophobicContact CD1-CZ 3.31Å; L521-F551 HydrophobicContact CG-CZ 4.45Å; L521-S562 CarbonylContact O-C 3.56Å; L521-S562 WeakPolarHBondContact O-CA 3.3Å; L521-S562 WeakPolarHBondContact O-CB 3.39Å; L521-V563 HydrophobicContact CB-CG1 3.8Å; L521-V563 HydrophobicContact CD1-CG1 4.48Å; L521-V563 HydrophobicContact CG-CG1 4.48Å; L521-V563 PolarHBondContact N-O 3.12Å; L521-V563 PolarHBondContact O-N 2.95Å; L521-L597 HydrophobicContact CD1-CD1 3.94Å; L521-L597 HydrophobicContact CD1-CD2 4.16Å; L521-L597 HydrophobicContact CD2-CD2 4.37Å
522	E	94.9	Very high	92.1	Very high	81 Å²	81	55.6 Å²	55.6	38%	0.379	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	140.4	178.1	57.5	177.4	-163.4	0	0	110.4	V507 S508 T524	V507-E522 CarbonylContact C-O 3.56Å; V507-E522 WeakPolarHBondContact CA-O 3.39Å; S508-E522 PolarHBondContact N-O 3.24Å; S508-E522 PolarHBondContact O-N 3.07Å; S508-E522 VanDerWaalsContact OG-CD 3.28Å; S508-E522 WeakPolarHBondContact OG-CG 3.5Å; S508-E522 PolarHBondContact OG-OE1 3.02Å; E522-T524 HydrophobicContact CG-CG2 4.01Å
523	N	95	Very high	92.1	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.016	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	106.5	166.5	-178.2	-10.1	0	0	0	108	N506 H525 K528 L557 G560 K561	N506-N523 CarbonylContact O-C 3.51Å; N506-N523 WeakPolarHBondContact O-CA 3.42Å; N506-N523 PolarHBondContact O-OD1 2.82Å; N523-H525 VanDerWaalsContact C-N 3.27Å; N523-H525 PolarHBondContact O-N 3.43Å; N523-H525 WeakPolarHBondContact OD1-CB 3.44Å; N523-H525 PolarHBondContact OD1-N 3.12Å; N523-K528 PolarHBondContact ND2-O 3.3Å; N523-L557 HydrophobicContact CB-CD2 3.81Å; N523-L557 HydrophobicContact CB-CG 3.82Å; N523-L557 PolarHBondContact ND2-O 2.99Å; N523-G560 WeakPolarHBondContact O-CA 3.26Å; N523-G560 PolarHBondContact O-N 2.82Å; N523-G560 VanDerWaalsContact O-N 3.09Å; N523-K561 PolarHBondContact N-O 3.38Å
524	T	93.1	Very high	92.2	Very high	77 Å²	77	61.3 Å²	61.3	47%	0.472	31%	0.307	S	S	.	.			trans	-79.8	-9.5	-177	60.4	0	0	0	0	112.8	N506 E522	N506-T524 PolarHBondContact O-N 3.44Å; N506-T524 PolarHBondContact O-OG1 3.21Å; N506-T524 VanDerWaalsContact O-OG1 3.13Å; E522-T524 HydrophobicContact CG-CG2 4.01Å
525	H	93.1	Very high	92.8	Very high	63 Å²	63	59.3 Å²	59.3	29%	0.292	29%	0.29	S	S	.	.			trans	-74.5	136.4	176.1	-160.7	-77.9	0	0	0	110.9	N506 N523 S527 K528 A559 G560	N506-H525 HydrophobicContact CB-CB 3.91Å; N506-H525 PolarHBondContact OD1-CD2 2.93Å; N523-H525 VanDerWaalsContact C-N 3.27Å; N523-H525 PolarHBondContact O-N 3.43Å; N523-H525 WeakPolarHBondContact OD1-CB 3.44Å; N523-H525 PolarHBondContact OD1-N 3.12Å; H525-S527 PolarHBondContact CE1-OG 3.06Å; H525-S527 PolarHBondContact ND1-N 3.48Å; H525-S527 PolarHBondContact O-N 3.21Å; H525-K528 HydrophobicContact CB-CB 4.31Å; H525-K528 VanDerWaalsContact CE1-CB 3.41Å; H525-K528 WeakPolarHBondContact CE1-CB 3.49Å; H525-K528 WeakPolarHBondContact ND1-CB 3.38Å; H525-K528 PolarHBondContact ND1-N 3.27Å; H525-A559 CarbonylContact O-C 3.54Å; H525-A559 WeakPolarHBondContact O-CA 3.32Å; H525-A559 WeakPolarHBondContact O-CB 3.37Å; H525-G560 PolarHBondContact O-N 3.47Å
526	R	87.8	Confident	93.3	Very high	242 Å²	242	58.2 Å²	58.2	91%	0.913	28%	0.283	S	S	*	.	S	Bend	trans	-73	-28.5	-172.7	-58	-170.6	-161.4	-164.2	5.5	114.3
527	S	89.6	Confident	93.6	Very high	99 Å²	99	58.2 Å²	58.2	69%	0.692	28%	0.283	S	S	*	.	S	Bend	trans	-139.6	-1.1	-170.8	57.9	0	0	0	0	115.9	H525 A559	H525-S527 PolarHBondContact CE1-OG 3.06Å; H525-S527 PolarHBondContact ND1-N 3.48Å; H525-S527 PolarHBondContact O-N 3.21Å; S527-A559 VanDerWaalsContact C-CB 3.48Å
528	K	93	Very high	93.7	Very high	105 Å²	105	58 Å²	58	46%	0.457	28%	0.282	S	S	.	.			trans	-113.1	118.3	-173.6	-173.9	179.5	173.6	-130.2	0	108.5	N523 H525 E530	N523-K528 PolarHBondContact ND2-O 3.3Å; H525-K528 HydrophobicContact CB-CB 4.31Å; H525-K528 VanDerWaalsContact CE1-CB 3.41Å; H525-K528 WeakPolarHBondContact CE1-CB 3.49Å; H525-K528 WeakPolarHBondContact ND1-CB 3.38Å; H525-K528 PolarHBondContact ND1-N 3.27Å; K528-E530 WeakPolarHBondContact CE-OE1 3.45Å; K528-E530 IonicContact NZ-OE1 3.6Å; K528-E530 PolarHBondContact NZ-OE1 3.45Å
529	D	93.8	Very high	93.6	Very high	85 Å²	85	56.8 Å²	56.8	46%	0.455	28%	0.277	S	S	.	.			trans	-73.1	141.4	172.9	-67.8	-4	0	0	0	109.1	T556 K558 A559	D529-T556 HydrophobicContact CB-CG2 3.97Å; D529-K558 VanDerWaalsContact OD1-CA 3.28Å; D529-K558 WeakPolarHBondContact OD1-CA 3.36Å; D529-A559 PolarHBondContact OD1-N 3.46Å
530	E	92.5	Very high	93.6	Very high	31 Å²	31	61.1 Å²	61.1	15%	0.145	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.8	178.6	-76.3	-64.3	158	0	0	110.1	N506 V507 K528 L557	N506-E530 HydrophobicContact CB-CG 3.56Å; N506-E530 PolarHBondContact ND2-OE1 3.4Å; V507-E530 HydrophobicContact CG2-CB 3.8Å; V507-E530 HydrophobicContact CG2-CG 4Å; K528-E530 WeakPolarHBondContact CE-OE1 3.45Å; K528-E530 IonicContact NZ-OE1 3.6Å; K528-E530 PolarHBondContact NZ-OE1 3.45Å; E530-L557 PolarHBondContact N-O 3.48Å; E530-L557 PolarHBondContact O-N 2.77Å
531	S	93	Very high	93.5	Very high	56 Å²	56	60.5 Å²	60.5	39%	0.392	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	117.1	176.4	-170.1	0	0	0	0	109.3	D533 W535	S531-D533 PolarHBondContact O-N 3.11Å; S531-W535 PolarHBondContact O-NE1 3.36Å
532	L	91.7	Very high	93.2	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.31	C	S	.	.			trans	-96.2	36.7	175	-54.8	177.5	0	0	0	110.6	V507 L521 E534 W535 F551 F555 L557	V507-L532 HydrophobicContact CG1-CD2 4.3Å; V507-L532 HydrophobicContact CG2-CD2 4.03Å; L521-L532 HydrophobicContact CD1-CD1 4.44Å; L532-E534 PolarHBondContact O-N 3.43Å; L532-E534 VanDerWaalsContact O-N 3.1Å; L532-W535 VanDerWaalsContact C-CD1 3.45Å; L532-W535 HydrophobicContact CB-CB 4.2Å; L532-W535 HydrophobicContact CB-CD2 4.33Å; L532-W535 HydrophobicContact CB-CG 4.12Å; L532-W535 HydrophobicContact CD2-CD2 3.57Å; L532-W535 HydrophobicContact CD2-CE3 3.29Å; L532-W535 HydrophobicContact CD2-CG 4.22Å; L532-W535 HydrophobicContact CD2-CH2 3.9Å; L532-W535 HydrophobicContact CD2-CZ2 4.17Å; L532-W535 HydrophobicContact CD2-CZ3 3.46Å; L532-W535 VanDerWaalsContact CD2-CZ3 3.46Å; L532-W535 PolarHBondContact O-N 2.82Å; L532-F551 HydrophobicContact CB-CB 4.44Å; L532-F551 HydrophobicContact CB-CD1 4.38Å; L532-F551 HydrophobicContact CB-CG 4.24Å; L532-F551 HydrophobicContact CD1-CD1 4.28Å; L532-F551 HydrophobicContact CD1-CE1 4.12Å; L532-F551 HydrophobicContact CD1-CZ 4.42Å; L532-F551 WeakPolarHBondContact O-CB 3.32Å; L532-F555 HydrophobicContact CB-CD1 3.95Å; L532-F555 HydrophobicContact CD1-CD1 4.06Å; L532-F555 HydrophobicContact CD1-CE1 3.96Å; L532-F555 HydrophobicContact CG-CD1 4.33Å; L532-F555 PolarHBondContact N-O 3.13Å; L532-L557 HydrophobicContact CD1-CB 4.02Å; L532-L557 HydrophobicContact CD1-CD2 4.21Å; L532-L557 HydrophobicContact CG-CB 4.38Å
533	D	91.8	Very high	92.5	Very high	51 Å²	51	62.1 Å²	62.1	27%	0.273	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	110.1	-175.7	-173	29.5	0	0	0	111.3	S531 W535 P553 K554	S531-D533 PolarHBondContact O-N 3.11Å; D533-W535 PolarHBondContact O-N 3.06Å; D533-P553 WeakPolarHBondContact OD1-CA 3.36Å; D533-K554 PolarHBondContact OD1-N 3.42Å
534	E	91.6	Very high	92.1	Very high	82 Å²	82	71.3 Å²	71.3	38%	0.383	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	24	-176.9	-57.6	175.9	173.8	0	0	114.7	L532 K600	L532-E534 PolarHBondContact O-N 3.43Å; L532-E534 VanDerWaalsContact O-N 3.1Å; E534-K600 HydrophobicContact CB-CD 4.31Å; E534-K600 HydrophobicContact CB-CG 4.42Å; E534-K600 IonicContact OE1-NZ 3.68Å; E534-K600 WeakPolarHBondContact OE2-CD 3.5Å; E534-K600 WeakPolarHBondContact OE2-CE 3.15Å; E534-K600 IonicContact OE2-NZ 2.64Å; E534-K600 PolarHBondContact OE2-NZ 2.91Å
535	W	96.1	Very high	91.9	Very high	29 Å²	29	72.9 Å²	72.9	11%	0.11	35%	0.353	C	S	.	.			trans	-66.4	153.3	172.7	-75.6	34.7	0	0	0	110.4	S531 L532 D533 S550 F551 L597 Y598 T599 K605	S531-W535 PolarHBondContact O-NE1 3.36Å; L532-W535 VanDerWaalsContact C-CD1 3.45Å; L532-W535 HydrophobicContact CB-CB 4.2Å; L532-W535 HydrophobicContact CB-CD2 4.33Å; L532-W535 HydrophobicContact CB-CG 4.12Å; L532-W535 HydrophobicContact CD2-CD2 3.57Å; L532-W535 HydrophobicContact CD2-CE3 3.29Å; L532-W535 HydrophobicContact CD2-CG 4.22Å; L532-W535 HydrophobicContact CD2-CH2 3.9Å; L532-W535 HydrophobicContact CD2-CZ2 4.17Å; L532-W535 HydrophobicContact CD2-CZ3 3.46Å; L532-W535 VanDerWaalsContact CD2-CZ3 3.46Å; L532-W535 PolarHBondContact O-N 2.82Å; D533-W535 PolarHBondContact O-N 3.06Å; W535-S550 CarbonylContact O-C 3.48Å; W535-S550 WeakPolarHBondContact O-CA 3.37Å; W535-F551 HydrophobicContact CB-CD2 4.18Å; W535-F551 WeakPolarHBondContact O-CD2 3.33Å; W535-F551 PolarHBondContact O-N 3.07Å; W535-L597 HydrophobicContact CE3-CD1 4.08Å; W535-L597 HydrophobicContact CE3-CD2 3.77Å; W535-L597 HydrophobicContact CE3-CG 3.77Å; W535-L597 HydrophobicContact CZ3-CD2 3.78Å; W535-L597 HydrophobicContact CZ3-CG 4.18Å; W535-Y598 CarbonylContact C-O 3.58Å; W535-Y598 WeakPolarHBondContact CA-O 3.37Å; W535-Y598 WeakPolarHBondContact CB-O 3.45Å; W535-T599 HydrophobicContact CD2-CG2 4.27Å; W535-T599 HydrophobicContact CH2-CG2 4.13Å; W535-T599 HydrophobicContact CZ2-CG2 3.77Å; W535-T599 HydrophobicContact CZ3-CG2 4.48Å; W535-K605 HydrophobicContact CH2-CB 4.24Å; W535-K605 HydrophobicContact CH2-CD 4.39Å; W535-K605 HydrophobicContact CH2-CG 3.76Å; W535-K605 HydrophobicContact CZ3-CB 3.8Å; W535-K605 HydrophobicContact CZ3-CG 3.73Å
536	K	96.2	Very high	91.9	Very high	96 Å²	96	75 Å²	75	42%	0.417	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.4	-177	-65.5	-176.8	-180	174.3	0	111.1	V548 F549 Y598	K536-V548 HydrophobicContact CB-CG1 4.46Å; K536-F549 CarbonylContact C-O 3.54Å; K536-F549 WeakPolarHBondContact CA-O 3.32Å; K536-Y598 PolarHBondContact N-O 2.94Å; K536-Y598 PolarHBondContact O-N 2.83Å
537	L	96.3	Very high	92.2	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	112	170	-175.8	63.5	0	0	0	108.6	I519 L521 V548 F549 F551 W587 T595 L597	I519-L537 HydrophobicContact CB-CD2 4.23Å; I519-L537 HydrophobicContact CD1-CD2 4.12Å; I519-L537 HydrophobicContact CG2-CD2 3.98Å; L521-L537 HydrophobicContact CD2-CD1 4.3Å; L537-V548 WeakPolarHBondContact O-CA 3.4Å; L537-F549 HydrophobicContact CB-CB 4.42Å; L537-F549 PolarHBondContact N-O 3.43Å; L537-F549 PolarHBondContact O-N 2.84Å; L537-F551 HydrophobicContact CB-CE2 4.21Å; L537-W587 HydrophobicContact CD2-CH2 3.84Å; L537-W587 HydrophobicContact CD2-CZ2 4.13Å; L537-W587 HydrophobicContact CG-CH2 4.19Å; L537-T595 HydrophobicContact CD1-CG2 3.71Å; L537-T595 HydrophobicContact CG-CG2 4.38Å; L537-L597 HydrophobicContact CB-CD1 4.42Å; L537-L597 HydrophobicContact CD1-CB 4.43Å; L537-L597 HydrophobicContact CD1-CD1 4.32Å
538	K	95.2	Very high	92.4	Very high	67 Å²	67	62.3 Å²	62.3	29%	0.291	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.3	179.9	-58.8	-165.5	-177.2	177.1	0	110.4	I547 V548 T595 V596 Y598	K538-I547 CarbonylContact C-O 3.54Å; K538-I547 WeakPolarHBondContact CA-O 3.27Å; K538-V548 HydrophobicContact CB-CG2 4.4Å; K538-V548 HydrophobicContact CD-CG2 4.13Å; K538-V548 HydrophobicContact CG-CB 4.41Å; K538-V548 HydrophobicContact CG-CG1 3.98Å; K538-V548 HydrophobicContact CG-CG2 3.88Å; K538-T595 CarbonylContact O-C 3.54Å; K538-T595 WeakPolarHBondContact O-CA 3.33Å; K538-V596 PolarHBondContact N-O 3.23Å; K538-V596 PolarHBondContact O-N 2.9Å; K538-Y598 HydrophobicContact CB-CD2 4.31Å; K538-Y598 HydrophobicContact CB-CE2 4.03Å; K538-Y598 HydrophobicContact CD-CD2 3.87Å; K538-Y598 HydrophobicContact CD-CE2 3.66Å; K538-Y598 HydrophobicContact CG-CD2 3.85Å; K538-Y598 HydrophobicContact CG-CE2 3.91Å
539	R	94.3	Very high	92.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	117.5	176.1	-177.3	162.6	170.6	157.9	-3.9	110.4	E546 I547 W587 G588 I593 Q594 T595	R539-E546 CarbonylContact O-C 3.58Å; R539-E546 WeakPolarHBondContact O-CA 3.38Å; R539-I547 PolarHBondContact N-O 2.96Å; R539-I547 PolarHBondContact O-N 2.87Å; R539-W587 HydrophobicContact CB-CE3 3.98Å; R539-W587 HydrophobicContact CB-CZ3 4.13Å; R539-W587 WeakPolarHBondContact CD-O 3.3Å; R539-W587 PolarHBondContact NE-O 2.87Å; R539-W587 VanDerWaalsContact NE-O 3.1Å; R539-G588 PolarHBondContact NH2-O 2.91Å; R539-I593 HydrophobicContact CG-CG2 3.89Å; R539-Q594 CarbonylContact C-O 3.57Å; R539-Q594 WeakPolarHBondContact CA-O 3.37Å; R539-T595 HydrophobicContact CB-CG2 4.36Å; R539-T595 WeakPolarHBondContact CD-OG1 3.49Å
540	K	94.8	Very high	92.6	Very high	92 Å²	92	57.2 Å²	57.2	40%	0.4	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129	178.3	-163.3	174.5	-171.5	178.6	0	110	G543 R545 I593 Q594	K540-G543 WeakPolarHBondContact CE-O 3.48Å; K540-R545 CarbonylContact C-O 3.5Å; K540-R545 WeakPolarHBondContact CA-O 3.35Å; K540-I593 WeakPolarHBondContact O-CA 3.47Å; K540-Q594 PolarHBondContact N-O 2.87Å; K540-Q594 PolarHBondContact O-N 3.21Å
541	I	93.3	Very high	92.6	Very high	11 Å²	11	56 Å²	56	6%	0.056	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.6	-173.4	-53.9	141.8	0	0	0	108.6	G543 K544 R545 I547	I541-G543 PolarHBondContact O-N 3.31Å; I541-K544 PolarHBondContact O-N 2.9Å; I541-R545 HydrophobicContact CB-CB 4.45Å; I541-R545 HydrophobicContact CD1-CB 4.18Å; I541-R545 HydrophobicContact CD1-CG 4.26Å; I541-R545 PolarHBondContact N-O 3.48Å; I541-R545 PolarHBondContact O-N 3.48Å; I541-I547 HydrophobicContact CD1-CD1 3.99Å; I541-I547 HydrophobicContact CD1-CG1 4.45Å
542	D	89.1	Confident	92.6	Very high	67 Å²	67	55.9 Å²	55.9	36%	0.358	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	28.2	178.6	-62.3	-36.6	0	0	0	114	K544 G590 Q591 N592	D542-K544 PolarHBondContact O-N 2.95Å; D542-K544 VanDerWaalsContact O-N 3.13Å; D542-G590 WeakPolarHBondContact OD2-CA 3.24Å; D542-Q591 WeakPolarHBondContact OD1-CA 3.3Å; D542-Q591 PolarHBondContact OD1-N 3.33Å; D542-Q591 PolarHBondContact OD2-N 3.48Å; D542-N592 WeakPolarHBondContact CA-O 3.33Å; D542-N592 PolarHBondContact N-O 3.43Å; D542-N592 PolarHBondContact OD1-N 3.22Å
543	G	82.3	Confident	92.5	Very high	49 Å²	49	60.2 Å²	60.2	51%	0.505	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	-3.7	-175.5	0	0	0	0	0	115.4	K540 I541	K540-G543 WeakPolarHBondContact CE-O 3.48Å; I541-G543 PolarHBondContact O-N 3.31Å
544	K	85.7	Confident	92.3	Very high	196 Å²	196	66.6 Å²	66.6	85%	0.852	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-53.6	-169.8	-66.7	174.5	-175.2	179.3	0	113.4	I541 D542	I541-K544 PolarHBondContact O-N 2.9Å; D542-K544 PolarHBondContact O-N 2.95Å; D542-K544 VanDerWaalsContact O-N 3.13Å
545	R	89.6	Confident	92.3	Very high	109 Å²	109	63.3 Å²	63.3	41%	0.411	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	138.1	-176.5	-171.7	178.3	-175.8	-144.7	-3.3	109.9	K540 I541 E584	K540-R545 CarbonylContact C-O 3.5Å; K540-R545 WeakPolarHBondContact CA-O 3.35Å; I541-R545 HydrophobicContact CB-CB 4.45Å; I541-R545 HydrophobicContact CD1-CB 4.18Å; I541-R545 HydrophobicContact CD1-CG 4.26Å; I541-R545 PolarHBondContact N-O 3.48Å; I541-R545 PolarHBondContact O-N 3.48Å; R545-E584 IonicContact CZ-OE2 3.52Å; R545-E584 IonicContact NH2-OE2 2.67Å; R545-E584 PolarHBondContact NH2-OE2 3.41Å
546	E	92.5	Very high	92.2	Very high	109 Å²	109	64.6 Å²	64.6	51%	0.509	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	134	175.6	-172.5	175.6	-150.9	0	0	110	R539 V548	R539-E546 CarbonylContact O-C 3.58Å; R539-E546 WeakPolarHBondContact O-CA 3.38Å; E546-V548 HydrophobicContact CG-CG2 4.15Å
547	I	93.8	Very high	92.1	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.3	176.9	-62	172.5	0	0	0	107.9	K538 R539 I541 E584 T586 W587	K538-I547 CarbonylContact C-O 3.54Å; K538-I547 WeakPolarHBondContact CA-O 3.27Å; R539-I547 PolarHBondContact N-O 2.96Å; R539-I547 PolarHBondContact O-N 2.87Å; I541-I547 HydrophobicContact CD1-CD1 3.99Å; I541-I547 HydrophobicContact CD1-CG1 4.45Å; I547-E584 HydrophobicContact CG2-CB 4.35Å; I547-E584 HydrophobicContact CG2-CG 3.94Å; I547-T586 WeakPolarHBondContact CD1-O 3.42Å; I547-W587 HydrophobicContact CB-CE3 4.2Å; I547-W587 HydrophobicContact CB-CZ3 4.24Å; I547-W587 HydrophobicContact CG2-CE3 3.69Å; I547-W587 HydrophobicContact CG2-CH2 4.42Å; I547-W587 HydrophobicContact CG2-CZ3 3.58Å
548	V	94.5	Very high	92	Very high	70 Å²	70	66.3 Å²	66.3	42%	0.424	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122.8	-177.2	-176.9	0	0	0	0	109.6	K536 L537 K538 E546	K536-V548 HydrophobicContact CB-CG1 4.46Å; L537-V548 WeakPolarHBondContact O-CA 3.4Å; K538-V548 HydrophobicContact CB-CG2 4.4Å; K538-V548 HydrophobicContact CD-CG2 4.13Å; K538-V548 HydrophobicContact CG-CB 4.41Å; K538-V548 HydrophobicContact CG-CG1 3.98Å; K538-V548 HydrophobicContact CG-CG2 3.88Å; E546-V548 HydrophobicContact CG-CG2 4.15Å
549	F	94.7	Very high	91.8	Very high	20 Å²	20	64.2 Å²	64.2	9%	0.088	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137	171.5	176.1	-101.8	0	0	0	109.6	K536 L537 F551 V565 L580 C582 W587	K536-F549 CarbonylContact C-O 3.54Å; K536-F549 WeakPolarHBondContact CA-O 3.32Å; L537-F549 HydrophobicContact CB-CB 4.42Å; L537-F549 PolarHBondContact N-O 3.43Å; L537-F549 PolarHBondContact O-N 2.84Å; F549-F551 HydrophobicContact CD1-CD2 4.25Å; F549-F551 HydrophobicContact CD1-CE2 4.07Å; F549-F551 HydrophobicContact CD1-CZ 4.32Å; F549-F551 HydrophobicContact CE1-CD1 4.16Å; F549-F551 HydrophobicContact CE1-CD2 4.17Å; F549-F551 HydrophobicContact CE1-CE1 4.13Å; F549-F551 HydrophobicContact CE1-CE2 4.14Å; F549-F551 HydrophobicContact CE1-CG 4.15Å; F549-F551 HydrophobicContact CE1-CZ 4.08Å; F549-V565 HydrophobicContact CD1-CG1 3.93Å; F549-V565 HydrophobicContact CD2-CG1 4.31Å; F549-V565 HydrophobicContact CE1-CG1 3.89Å; F549-V565 HydrophobicContact CE1-CG2 4.33Å; F549-V565 HydrophobicContact CE2-CG1 4.27Å; F549-V565 HydrophobicContact CG-CG1 4.14Å; F549-V565 HydrophobicContact CZ-CG1 4.07Å; F549-L580 HydrophobicContact CE1-CD1 3.96Å; F549-L580 HydrophobicContact CZ-CB 4.06Å; F549-L580 HydrophobicContact CZ-CD1 3.95Å; F549-C582 HydrophobicContact CD2-CB 3.91Å; F549-C582 HydrophobicContact CE2-CB 4.49Å; F549-W587 HydrophobicContact CB-CH2 3.56Å; F549-W587 HydrophobicContact CB-CZ2 4.16Å; F549-W587 HydrophobicContact CG-CH2 4.45Å
550	S	94.7	Very high	91.7	Very high	63 Å²	63	67 Å²	67	44%	0.441	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.4	175.6	-54.4	0	0	0	0	109.5	W535	W535-S550 CarbonylContact O-C 3.48Å; W535-S550 WeakPolarHBondContact O-CA 3.37Å
551	F	94.4	Very high	91.6	Very high	4 Å²	4	68.9 Å²	68.9	2%	0.018	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-69.2	141.7	177.6	-78.5	-93.7	0	0	0	110.6	L521 L532 W535 L537 F549 F555 V563 V565 L580 L597	L521-F551 HydrophobicContact CD1-CE1 4.28Å; L521-F551 HydrophobicContact CD1-CE2 3.73Å; L521-F551 HydrophobicContact CD1-CZ 3.31Å; L521-F551 HydrophobicContact CG-CZ 4.45Å; L532-F551 HydrophobicContact CB-CB 4.44Å; L532-F551 HydrophobicContact CB-CD1 4.38Å; L532-F551 HydrophobicContact CB-CG 4.24Å; L532-F551 HydrophobicContact CD1-CD1 4.28Å; L532-F551 HydrophobicContact CD1-CE1 4.12Å; L532-F551 HydrophobicContact CD1-CZ 4.42Å; L532-F551 WeakPolarHBondContact O-CB 3.32Å; W535-F551 HydrophobicContact CB-CD2 4.18Å; W535-F551 WeakPolarHBondContact O-CD2 3.33Å; W535-F551 PolarHBondContact O-N 3.07Å; L537-F551 HydrophobicContact CB-CE2 4.21Å; F549-F551 HydrophobicContact CD1-CD2 4.25Å; F549-F551 HydrophobicContact CD1-CE2 4.07Å; F549-F551 HydrophobicContact CD1-CZ 4.32Å; F549-F551 HydrophobicContact CE1-CD1 4.16Å; F549-F551 HydrophobicContact CE1-CD2 4.17Å; F549-F551 HydrophobicContact CE1-CE1 4.13Å; F549-F551 HydrophobicContact CE1-CE2 4.14Å; F549-F551 HydrophobicContact CE1-CG 4.15Å; F549-F551 HydrophobicContact CE1-CZ 4.08Å; F551-F555 HydrophobicContact CB-CB 4.48Å; F551-F555 AromaticContact CD1-CD1 3.86Å; F551-F555 HydrophobicContact CD1-CD1 3.86Å; F551-F555 HydrophobicContact CD1-CD2 4.47Å; F551-F555 HydrophobicContact CD1-CE1 4.02Å; F551-F555 HydrophobicContact CD1-CG 4.09Å; F551-F555 HydrophobicContact CD1-CZ 4.4Å; F551-F555 HydrophobicContact CE1-CD1 4.46Å; F551-F555 HydrophobicContact CE1-CE1 4.18Å; F551-F555 HydrophobicContact CE1-CZ 4.45Å; F551-V563 HydrophobicContact CE1-CG1 4.18Å; F551-V565 HydrophobicContact CE1-CG2 4.33Å; F551-V565 HydrophobicContact CZ-CG2 3.99Å; F551-L580 HydrophobicContact CD1-CD1 3.64Å; F551-L580 HydrophobicContact CE1-CD1 3.53Å; F551-L597 HydrophobicContact CE2-CD1 4.23Å
552	P	91.7	Very high	91.7	Very high	54 Å²	54	71.5 Å²	71.5	35%	0.351	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-57.2	151.5	176.4	-24.4	33.5	0	0	0	112.3	F555	P552-F555 VanDerWaalsContact O-CB 3.23Å; P552-F555 WeakPolarHBondContact O-CB 3.23Å; P552-F555 PolarHBondContact O-N 2.89Å
553	P	89.8	Confident	92	Very high	92 Å²	92	68.3 Å²	68.3	60%	0.597	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	144.6	177.8	25.5	-33.3	0	0	0	111.1	D533 F555	D533-P553 WeakPolarHBondContact OD1-CA 3.36Å; P553-F555 PolarHBondContact O-N 2.82Å
554	K	86.9	Confident	92.6	Very high	184 Å²	184	68.9 Å²	68.9	80%	0.8	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	18.2	-174.5	-55	-179.9	178.6	178	0	115.1	D533 T556	D533-K554 PolarHBondContact OD1-N 3.42Å; K554-T556 PolarHBondContact O-N 3.26Å
555	F	93.3	Very high	93.1	Very high	13 Å²	13	59.6 Å²	59.6	6%	0.057	32%	0.32	C	S	.	.			trans	-66.5	128.2	173.2	-171.2	-83.5	0	0	0	110.9	L532 F551 P552 P553 L557 V563 P576 P577 L580	L532-F555 HydrophobicContact CB-CD1 3.95Å; L532-F555 HydrophobicContact CD1-CD1 4.06Å; L532-F555 HydrophobicContact CD1-CE1 3.96Å; L532-F555 HydrophobicContact CG-CD1 4.33Å; L532-F555 PolarHBondContact N-O 3.13Å; F551-F555 HydrophobicContact CB-CB 4.48Å; F551-F555 AromaticContact CD1-CD1 3.86Å; F551-F555 HydrophobicContact CD1-CD1 3.86Å; F551-F555 HydrophobicContact CD1-CD2 4.47Å; F551-F555 HydrophobicContact CD1-CE1 4.02Å; F551-F555 HydrophobicContact CD1-CG 4.09Å; F551-F555 HydrophobicContact CD1-CZ 4.4Å; F551-F555 HydrophobicContact CE1-CD1 4.46Å; F551-F555 HydrophobicContact CE1-CE1 4.18Å; F551-F555 HydrophobicContact CE1-CZ 4.45Å; P552-F555 VanDerWaalsContact O-CB 3.23Å; P552-F555 WeakPolarHBondContact O-CB 3.23Å; P552-F555 PolarHBondContact O-N 2.89Å; P553-F555 PolarHBondContact O-N 2.82Å; F555-L557 HydrophobicContact CE1-CB 4.33Å; F555-V563 HydrophobicContact CE1-CG1 4.4Å; F555-V563 HydrophobicContact CZ-CB 4.07Å; F555-V563 HydrophobicContact CZ-CG1 4.36Å; F555-V563 HydrophobicContact CZ-CG2 3.78Å; F555-P576 HydrophobicContact CE2-CB 4.45Å; F555-P577 HydrophobicContact CE2-CB 3.94Å; F555-P577 HydrophobicContact CZ-CB 3.92Å; F555-P577 WeakPolarHBondContact CZ-O 3.33Å; F555-L580 HydrophobicContact CD2-CD1 4.25Å; F555-L580 HydrophobicContact CE2-CD1 3.72Å; F555-L580 HydrophobicContact CE2-CD2 4.13Å; F555-L580 HydrophobicContact CE2-CG 4.16Å; F555-L580 HydrophobicContact CZ-CD1 4.06Å
556	T	93.7	Very high	93.4	Very high	57 Å²	57	56.1 Å²	56.1	35%	0.35	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.8	-179.9	-57.1	0	0	0	0	110.2	D529 K554	D529-T556 HydrophobicContact CB-CG2 3.97Å; K554-T556 PolarHBondContact O-N 3.26Å
557	L	93.8	Very high	93.5	Very high	3 Å²	3	51 Å²	51	2%	0.016	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	108	175.8	-171.4	61	0	0	0	109.3	V507 N523 E530 L532 F555 K561 V563	V507-L557 HydrophobicContact CG1-CD2 4.41Å; N523-L557 HydrophobicContact CB-CD2 3.81Å; N523-L557 HydrophobicContact CB-CG 3.82Å; N523-L557 PolarHBondContact ND2-O 2.99Å; E530-L557 PolarHBondContact N-O 3.48Å; E530-L557 PolarHBondContact O-N 2.77Å; L532-L557 HydrophobicContact CD1-CB 4.02Å; L532-L557 HydrophobicContact CD1-CD2 4.21Å; L532-L557 HydrophobicContact CG-CB 4.38Å; F555-L557 HydrophobicContact CE1-CB 4.33Å; L557-K561 HydrophobicContact CD1-CB 4.47Å; L557-V563 HydrophobicContact CD1-CB 4.05Å; L557-V563 HydrophobicContact CD1-CG1 4.06Å; L557-V563 HydrophobicContact CD2-CG1 4.25Å
558	K	93.4	Very high	93.3	Very high	129 Å²	129	55.3 Å²	55.3	56%	0.561	30%	0.302	S	S	*	.			trans	-60.2	150.6	-179.6	-67.2	-172.3	176.8	-176.5	0	112.1	D529 G560 K561	D529-K558 VanDerWaalsContact OD1-CA 3.28Å; D529-K558 WeakPolarHBondContact OD1-CA 3.36Å; K558-G560 PolarHBondContact O-N 2.85Å; K558-K561 HydrophobicContact CB-CB 4.26Å; K558-K561 HydrophobicContact CB-CG 3.85Å; K558-K561 WeakPolarHBondContact O-CB 3.5Å; K558-K561 PolarHBondContact O-N 2.79Å
559	A	92	Very high	92.9	Very high	22 Å²	22	58.1 Å²	58.1	18%	0.182	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	131.5	176.7	0	0	0	0	0	112.1	H525 S527 D529 K561	H525-A559 CarbonylContact O-C 3.54Å; H525-A559 WeakPolarHBondContact O-CA 3.32Å; H525-A559 WeakPolarHBondContact O-CB 3.37Å; S527-A559 VanDerWaalsContact C-CB 3.48Å; D529-A559 PolarHBondContact OD1-N 3.46Å; A559-K561 PolarHBondContact O-N 3.45Å; A559-K561 VanDerWaalsContact O-N 3.17Å
560	G	90.9	Very high	92.5	Very high	58 Å²	58	60.5 Å²	60.5	60%	0.598	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	11.7	-179.1	0	0	0	0	0	115.2	N523 H525 K558	N523-G560 WeakPolarHBondContact O-CA 3.26Å; N523-G560 PolarHBondContact O-N 2.82Å; N523-G560 VanDerWaalsContact O-N 3.09Å; H525-G560 PolarHBondContact O-N 3.47Å; K558-G560 PolarHBondContact O-N 2.85Å
561	K	94.5	Very high	91.9	Very high	132 Å²	132	60.7 Å²	60.7	57%	0.574	34%	0.338	S	S	*	.			trans	-104.7	159.9	175.8	-61.1	-59.2	-175.9	-177.9	0	111.3	N523 L557 K558 A559	N523-K561 PolarHBondContact N-O 3.38Å; L557-K561 HydrophobicContact CD1-CB 4.47Å; K558-K561 HydrophobicContact CB-CB 4.26Å; K558-K561 HydrophobicContact CB-CG 3.85Å; K558-K561 WeakPolarHBondContact O-CB 3.5Å; K558-K561 PolarHBondContact O-N 2.79Å; A559-K561 PolarHBondContact O-N 3.45Å; A559-K561 VanDerWaalsContact O-N 3.17Å
562	S	94.7	Very high	91.2	Very high	66 Å²	66	61.6 Å²	61.6	46%	0.462	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	147.7	177.6	60.4	0	0	0	0	111.3	L521	L521-S562 CarbonylContact O-C 3.56Å; L521-S562 WeakPolarHBondContact O-CA 3.3Å; L521-S562 WeakPolarHBondContact O-CB 3.39Å
563	V	95.1	Very high	90.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.7	169.3	57.1	0	0	0	0	109.3	I520 L521 F551 F555 L557 V565 P577 S578 L580	I520-V563 WeakPolarHBondContact CA-O 3.32Å; L521-V563 HydrophobicContact CB-CG1 3.8Å; L521-V563 HydrophobicContact CD1-CG1 4.48Å; L521-V563 HydrophobicContact CG-CG1 4.48Å; L521-V563 PolarHBondContact N-O 3.12Å; L521-V563 PolarHBondContact O-N 2.95Å; F551-V563 HydrophobicContact CE1-CG1 4.18Å; F555-V563 HydrophobicContact CE1-CG1 4.4Å; F555-V563 HydrophobicContact CZ-CB 4.07Å; F555-V563 HydrophobicContact CZ-CG1 4.36Å; F555-V563 HydrophobicContact CZ-CG2 3.78Å; L557-V563 HydrophobicContact CD1-CB 4.05Å; L557-V563 HydrophobicContact CD1-CG1 4.06Å; L557-V563 HydrophobicContact CD2-CG1 4.25Å; V563-V565 HydrophobicContact CG2-CG2 4.49Å; V563-P577 WeakPolarHBondContact CB-O 2.92Å; V563-P577 WeakPolarHBondContact CG2-O 3.03Å; V563-S578 WeakPolarHBondContact CA-O 3.33Å; V563-L580 HydrophobicContact CG2-CD1 3.92Å; V563-L580 HydrophobicContact CG2-CG 3.98Å
564	K	95.6	Very high	90.8	Very high	62 Å²	62	64.4 Å²	64.4	27%	0.27	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	115.9	175.7	-174.7	176.2	-67.4	-175	0	109.8	F518 I520 W566 S578 Q579 L580	F518-K564 HydrophobicContact CB-CD 4.28Å; F518-K564 HydrophobicContact CB-CG 3.94Å; F518-K564 HydrophobicContact CD2-CD 4.01Å; F518-K564 HydrophobicContact CD2-CG 3.97Å; F518-K564 HydrophobicContact CG-CD 4.01Å; F518-K564 HydrophobicContact CG-CG 4.08Å; I520-K564 HydrophobicContact CG1-CB 4.32Å; I520-K564 HydrophobicContact CG1-CG 4.06Å; K564-W566 HydrophobicContact CD-CD2 4.34Å; K564-W566 VanDerWaalsContact CD-CE2 3.43Å; K564-W566 HydrophobicContact CD-CH2 4.47Å; K564-W566 HydrophobicContact CD-CZ2 3.52Å; K564-S578 PolarHBondContact N-O 2.91Å; K564-Q579 WeakPolarHBondContact O-CA 3.37Å; K564-L580 PolarHBondContact O-N 3.4Å
565	V	95.2	Very high	90.9	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	103.7	177.5	-166.4	0	0	0	0	109.1	F518 I519 F549 F551 V563 L580 C582 W587	F518-V565 CarbonylContact C-O 3.57Å; F518-V565 VanDerWaalsContact CA-O 3.25Å; F518-V565 WeakPolarHBondContact CA-O 3.17Å; I519-V565 PolarHBondContact N-O 2.99Å; I519-V565 PolarHBondContact O-N 3.47Å; F549-V565 HydrophobicContact CD1-CG1 3.93Å; F549-V565 HydrophobicContact CD2-CG1 4.31Å; F549-V565 HydrophobicContact CE1-CG1 3.89Å; F549-V565 HydrophobicContact CE1-CG2 4.33Å; F549-V565 HydrophobicContact CE2-CG1 4.27Å; F549-V565 HydrophobicContact CG-CG1 4.14Å; F549-V565 HydrophobicContact CZ-CG1 4.07Å; F551-V565 HydrophobicContact CE1-CG2 4.33Å; F551-V565 HydrophobicContact CZ-CG2 3.99Å; V563-V565 HydrophobicContact CG2-CG2 4.49Å; V565-L580 CarbonylContact C-O 3.57Å; V565-L580 WeakPolarHBondContact CA-O 3.28Å; V565-L580 HydrophobicContact CG1-CB 4.25Å; V565-L580 HydrophobicContact CG2-CB 4.35Å; V565-C582 HydrophobicContact CG1-CB 4.37Å; V565-W587 HydrophobicContact CB-CZ2 4.28Å; V565-W587 HydrophobicContact CG1-CZ2 3.74Å; V565-W587 PolarHBondContact O-NE1 3.39Å; V565-W587 VanDerWaalsContact O-NE1 3.09Å
566	W	95.9	Very high	90.4	Very high	37 Å²	37	63 Å²	63	14%	0.14	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	148.3	178.2	-70	94	0	0	0	111.5	K517 F518 K564 Q570 G572 L580 V581 C582	K517-W566 HydrophobicContact CB-CZ3 4.35Å; F518-W566 HydrophobicContact CB-CD2 3.92Å; F518-W566 HydrophobicContact CB-CE3 3.88Å; F518-W566 HydrophobicContact CB-CG 4.3Å; F518-W566 HydrophobicContact CB-CZ3 4.36Å; F518-W566 HydrophobicContact CD1-CE3 4.06Å; F518-W566 AromaticContact CD1-CH2 3.86Å; F518-W566 HydrophobicContact CD1-CH2 3.86Å; F518-W566 HydrophobicContact CD1-CZ2 4.42Å; F518-W566 AromaticContact CD1-CZ3 3.67Å; F518-W566 HydrophobicContact CD1-CZ3 3.67Å; F518-W566 HydrophobicContact CE1-CH2 4.39Å; F518-W566 HydrophobicContact CE1-CZ3 4.49Å; F518-W566 HydrophobicContact CG-CE3 4.4Å; F518-W566 HydrophobicContact CG-CZ3 4.41Å; K564-W566 HydrophobicContact CD-CD2 4.34Å; K564-W566 VanDerWaalsContact CD-CE2 3.43Å; K564-W566 HydrophobicContact CD-CH2 4.47Å; K564-W566 HydrophobicContact CD-CZ2 3.52Å; W566-Q570 HydrophobicContact CE3-CB 4.25Å; W566-Q570 WeakPolarHBondContact CZ3-O 3.46Å; W566-G572 VanDerWaalsContact CD1-CA 3.47Å; W566-L580 PolarHBondContact N-O 2.91Å; W566-V581 HydrophobicContact CB-CG2 4.48Å; W566-V581 CarbonylContact O-C 3.52Å; W566-V581 WeakPolarHBondContact O-CA 3.5Å; W566-C582 WeakPolarHBondContact O-CB 3.37Å; W566-C582 PolarHBondContact O-N 3.41Å
567	A	93.9	Very high	90	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.008	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-71.6	153.1	160.2	0	0	0	0	0	110.2	K517 Q570 E584 T586	K517-A567 PolarHBondContact O-N 3.45Å; A567-Q570 HydrophobicContact CB-CB 4.37Å; A567-Q570 HydrophobicContact CB-CG 3.77Å; A567-Q570 PolarHBondContact O-N 3.24Å; A567-E584 CarbonylContact C-O 3.55Å; A567-E584 WeakPolarHBondContact CA-O 3.37Å; A567-E584 WeakPolarHBondContact CB-O 3.28Å; A567-T586 VanDerWaalsContact CB-CA 3.5Å
568	K	90.3	Very high	89.7	Confident	94 Å²	94	66 Å²	66	41%	0.409	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	139.7	176.9	-165.7	178.4	173.7	-178.5	0	110.1	Q570 C582 D583 E584 D585	K568-Q570 PolarHBondContact O-N 2.88Å; K568-C582 WeakPolarHBondContact CB-O 3.4Å; K568-C582 PolarHBondContact N-O 2.77Å; K568-D583 WeakPolarHBondContact CD-O 3.46Å; K568-E584 WeakPolarHBondContact CB-O 3.37Å; K568-E584 PolarHBondContact N-O 2.81Å; K568-D585 WeakPolarHBondContact O-CA 3.39Å
569	N	86.1	Confident	89.7	Confident	130 Å²	130	63 Å²	63	70%	0.695	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	6.8	178.3	-56	-43.8	0	0	0	116.3	G571 D585	N569-G571 VanDerWaalsContact C-N 3.31Å; N569-G571 PolarHBondContact O-N 3.44Å; N569-D585 PolarHBondContact ND2-OD1 2.97Å
570	Q	87.4	Confident	89.8	Confident	70 Å²	70	62 Å²	62	33%	0.327	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	20.1	179.1	-63	-61.9	-26.6	0	0	114.2	K517 W566 A567 K568 D585	K517-Q570 HydrophobicContact CB-CB 4.23Å; K517-Q570 HydrophobicContact CG-CB 4.34Å; K517-Q570 HydrophobicContact CG-CG 4.43Å; W566-Q570 HydrophobicContact CE3-CB 4.25Å; W566-Q570 WeakPolarHBondContact CZ3-O 3.46Å; A567-Q570 HydrophobicContact CB-CB 4.37Å; A567-Q570 HydrophobicContact CB-CG 3.77Å; A567-Q570 PolarHBondContact O-N 3.24Å; K568-Q570 PolarHBondContact O-N 2.88Å; Q570-D585 WeakPolarHBondContact CG-O 3.42Å; Q570-D585 PolarHBondContact NE2-O 3.46Å
571	G	80.8	Confident	89.9	Confident	67 Å²	67	61 Å²	61	69%	0.691	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	3.6	176.3	0	0	0	0	0	115.9	N569	N569-G571 VanDerWaalsContact C-N 3.31Å; N569-G571 PolarHBondContact O-N 3.44Å
572	G	81.3	Confident	89.7	Confident	22 Å²	22	55 Å²	55	23%	0.227	32%	0.323	C	S	.	.			trans	-78	140.2	173.1	0	0	0	0	0	113.2	W566	W566-G572 VanDerWaalsContact CD1-CA 3.47Å
573	V	84.1	Confident	89.5	Confident	103 Å²	103	58.6 Å²	58.6	62%	0.624	34%	0.337	S	S	*	.			trans	-101.8	137.2	166.2	-179.1	0	0	0	0	107.9	D575 Q579	V573-D575 PolarHBondContact O-N 2.88Å; V573-D575 VanDerWaalsContact O-N 3.07Å; V573-Q579 VanDerWaalsContact O-CB 3.23Å; V573-Q579 WeakPolarHBondContact O-CB 3.36Å
574	N	87.4	Confident	89.3	Confident	102 Å²	102	62.5 Å²	62.5	55%	0.545	36%	0.355	S	S	.	.			trans	-77.3	93.4	177.1	-167.3	20.2	0	0	0	109.8	V581	N574-V581 HydrophobicContact CB-CB 4.4Å; N574-V581 HydrophobicContact CB-CG2 3.91Å
575	D	88.9	Confident	89	Confident	97 Å²	97	63.6 Å²	63.6	52%	0.519	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-129.5	77.1	-178.9	-174	35	0	0	0	111.3	V573 S578 Q579	V573-D575 PolarHBondContact O-N 2.88Å; V573-D575 VanDerWaalsContact O-N 3.07Å; D575-S578 PolarHBondContact O-N 3.44Å; D575-S578 VanDerWaalsContact O-N 3.09Å; D575-S578 PolarHBondContact O-OG 3.35Å; D575-Q579 CarbonylContact C-O 3.45Å; D575-Q579 PolarHBondContact N-O 2.78Å; D575-Q579 PolarHBondContact O-N 3.44Å
576	P	84.7	Confident	88.9	Confident	72 Å²	72	65.5 Å²	65.5	47%	0.468	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	142.3	-179.5	-15.5	27.6	0	0	0	111.7	F555 L580	F555-P576 HydrophobicContact CE2-CB 4.45Å; P576-L580 HydrophobicContact CB-CD2 4.02Å; P576-L580 HydrophobicContact CG-CD2 3.82Å
577	P	84.1	Confident	88.8	Confident	70 Å²	70	63.8 Å²	63.8	46%	0.455	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.3	2.1	8.5	36.3	-35.6	0	0	0	114.1	F555 V563	F555-P577 HydrophobicContact CE2-CB 3.94Å; F555-P577 HydrophobicContact CZ-CB 3.92Å; F555-P577 WeakPolarHBondContact CZ-O 3.33Å; V563-P577 WeakPolarHBondContact CB-O 2.92Å; V563-P577 WeakPolarHBondContact CG2-O 3.03Å
578	S	87.6	Confident	88.6	Confident	53 Å²	53	64 Å²	64	37%	0.371	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-35.6	-170.6	76.2	0	0	0	0	113.1	V563 K564 D575	V563-S578 WeakPolarHBondContact CA-O 3.33Å; K564-S578 PolarHBondContact N-O 2.91Å; D575-S578 PolarHBondContact O-N 3.44Å; D575-S578 VanDerWaalsContact O-N 3.09Å; D575-S578 PolarHBondContact O-OG 3.35Å
579	Q	92.8	Very high	88.5	Confident	64 Å²	64	64 Å²	64	30%	0.299	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.7	-179.8	-60	-168.1	28.9	0	0	110.8	K564 V573 D575	K564-Q579 WeakPolarHBondContact O-CA 3.37Å; V573-Q579 VanDerWaalsContact O-CB 3.23Å; V573-Q579 WeakPolarHBondContact O-CB 3.36Å; D575-Q579 CarbonylContact C-O 3.45Å; D575-Q579 PolarHBondContact N-O 2.78Å; D575-Q579 PolarHBondContact O-N 3.44Å
580	L	93.6	Very high	88.6	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.01	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	156.7	174.4	-65.4	174.6	0	0	0	109	F549 F551 F555 V563 K564 V565 W566 P576	F549-L580 HydrophobicContact CE1-CD1 3.96Å; F549-L580 HydrophobicContact CZ-CB 4.06Å; F549-L580 HydrophobicContact CZ-CD1 3.95Å; F551-L580 HydrophobicContact CD1-CD1 3.64Å; F551-L580 HydrophobicContact CE1-CD1 3.53Å; F555-L580 HydrophobicContact CD2-CD1 4.25Å; F555-L580 HydrophobicContact CE2-CD1 3.72Å; F555-L580 HydrophobicContact CE2-CD2 4.13Å; F555-L580 HydrophobicContact CE2-CG 4.16Å; F555-L580 HydrophobicContact CZ-CD1 4.06Å; V563-L580 HydrophobicContact CG2-CD1 3.92Å; V563-L580 HydrophobicContact CG2-CG 3.98Å; K564-L580 PolarHBondContact O-N 3.4Å; V565-L580 CarbonylContact C-O 3.57Å; V565-L580 WeakPolarHBondContact CA-O 3.28Å; V565-L580 HydrophobicContact CG1-CB 4.25Å; V565-L580 HydrophobicContact CG2-CB 4.35Å; W566-L580 PolarHBondContact N-O 2.91Å; P576-L580 HydrophobicContact CB-CD2 4.02Å; P576-L580 HydrophobicContact CG-CD2 3.82Å
581	V	93.3	Very high	88.6	Confident	38 Å²	38	60.8 Å²	60.8	23%	0.23	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.9	176.7	-177.9	0	0	0	0	108.9	W566 N574	W566-V581 HydrophobicContact CB-CG2 4.48Å; W566-V581 CarbonylContact O-C 3.52Å; W566-V581 WeakPolarHBondContact O-CA 3.5Å; N574-V581 HydrophobicContact CB-CB 4.4Å; N574-V581 HydrophobicContact CB-CG2 3.91Å
582	C	91.9	Very high	89.1	Confident	4 Å²	4	61 Å²	61	3%	0.027	35%	0.349	C	S	.	.			trans	-82.4	150.1	172.2	-179.8	0	0	0	0	109.8	F549 V565 W566 K568 E584 W587	F549-C582 HydrophobicContact CD2-CB 3.91Å; F549-C582 HydrophobicContact CE2-CB 4.49Å; V565-C582 HydrophobicContact CG1-CB 4.37Å; W566-C582 WeakPolarHBondContact O-CB 3.37Å; W566-C582 PolarHBondContact O-N 3.41Å; K568-C582 WeakPolarHBondContact CB-O 3.4Å; K568-C582 PolarHBondContact N-O 2.77Å; C582-E584 PolarHBondContact O-N 3.28Å; C582-W587 HydrophobicContact CB-CZ2 3.94Å
583	D	90	Very high	89.7	Confident	142 Å²	142	60 Å²	60	76%	0.759	34%	0.338	S	S	*	.	S	Bend	trans	-70.5	-16.9	-178.2	-64.3	-44.6	0	0	0	114.1	K568	K568-D583 WeakPolarHBondContact CD-O 3.46Å
584	E	90.6	Very high	90.2	Very high	82 Å²	82	59 Å²	59	38%	0.383	33%	0.327	S	S	.	.	S	Bend	trans	-85.4	138.8	179.5	-70.5	-74.1	159.8	0	0	112	R545 I547 A567 K568 C582 T586	R545-E584 IonicContact CZ-OE2 3.52Å; R545-E584 IonicContact NH2-OE2 2.67Å; R545-E584 PolarHBondContact NH2-OE2 3.41Å; I547-E584 HydrophobicContact CG2-CB 4.35Å; I547-E584 HydrophobicContact CG2-CG 3.94Å; A567-E584 CarbonylContact C-O 3.55Å; A567-E584 WeakPolarHBondContact CA-O 3.37Å; A567-E584 WeakPolarHBondContact CB-O 3.28Å; K568-E584 WeakPolarHBondContact CB-O 3.37Å; K568-E584 PolarHBondContact N-O 2.81Å; C582-E584 PolarHBondContact O-N 3.28Å; E584-T586 PolarHBondContact O-N 3.43Å; E584-T586 VanDerWaalsContact O-N 3.15Å
585	D	90	Very high	90.6	Very high	85 Å²	85	54.1 Å²	54.1	46%	0.455	30%	0.301	S	S	.	.	S	Bend	trans	-67.9	-11.6	-179.1	-67.3	-51.1	0	0	0	114.5	K568 N569 Q570	K568-D585 WeakPolarHBondContact O-CA 3.39Å; N569-D585 PolarHBondContact ND2-OD1 2.97Å; Q570-D585 WeakPolarHBondContact CG-O 3.42Å; Q570-D585 PolarHBondContact NE2-O 3.46Å
586	T	92.3	Very high	91	Very high	41 Å²	41	49.8 Å²	49.8	25%	0.252	28%	0.278	S	S	.	.			trans	-158.1	147.4	175.8	-179	0	0	0	0	111.2	G516 I547 A567 E584 G588	G516-T586 PolarHBondContact O-OG1 3.42Å; I547-T586 WeakPolarHBondContact CD1-O 3.42Å; A567-T586 VanDerWaalsContact CB-CA 3.5Å; E584-T586 PolarHBondContact O-N 3.43Å; E584-T586 VanDerWaalsContact O-N 3.15Å; T586-G588 PolarHBondContact O-N 2.83Å; T586-G588 PolarHBondContact OG1-N 3.27Å
587	W	93.6	Very high	91.6	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	26%	0.256	C	S	.	.			trans	-77.4	-2.7	166.6	-77	107.8	0	0	0	113.9	G516 I519 L537 R539 I547 F549 V565 C582	G516-W587 WeakPolarHBondContact O-CB 3.46Å; G516-W587 PolarHBondContact O-N 2.88Å; I519-W587 HydrophobicContact CD1-CB 4.41Å; I519-W587 HydrophobicContact CD1-CD2 3.41Å; I519-W587 VanDerWaalsContact CD1-CD2 3.41Å; I519-W587 HydrophobicContact CD1-CE3 3.52Å; I519-W587 HydrophobicContact CD1-CG 3.84Å; I519-W587 HydrophobicContact CD1-CH2 4.13Å; I519-W587 HydrophobicContact CD1-CZ2 4.08Å; I519-W587 HydrophobicContact CD1-CZ3 3.88Å; I519-W587 HydrophobicContact CG1-CD2 4.02Å; I519-W587 HydrophobicContact CG1-CG 4.02Å; L537-W587 HydrophobicContact CD2-CH2 3.84Å; L537-W587 HydrophobicContact CD2-CZ2 4.13Å; L537-W587 HydrophobicContact CG-CH2 4.19Å; R539-W587 HydrophobicContact CB-CE3 3.98Å; R539-W587 HydrophobicContact CB-CZ3 4.13Å; R539-W587 WeakPolarHBondContact CD-O 3.3Å; R539-W587 PolarHBondContact NE-O 2.87Å; R539-W587 VanDerWaalsContact NE-O 3.1Å; I547-W587 HydrophobicContact CB-CE3 4.2Å; I547-W587 HydrophobicContact CB-CZ3 4.24Å; I547-W587 HydrophobicContact CG2-CE3 3.69Å; I547-W587 HydrophobicContact CG2-CH2 4.42Å; I547-W587 HydrophobicContact CG2-CZ3 3.58Å; F549-W587 HydrophobicContact CB-CH2 3.56Å; F549-W587 HydrophobicContact CB-CZ2 4.16Å; F549-W587 HydrophobicContact CG-CH2 4.45Å; V565-W587 HydrophobicContact CB-CZ2 4.28Å; V565-W587 HydrophobicContact CG1-CZ2 3.74Å; V565-W587 PolarHBondContact O-NE1 3.39Å; V565-W587 VanDerWaalsContact O-NE1 3.09Å; C582-W587 HydrophobicContact CB-CZ2 3.94Å
588	G	89.7	Confident	92.1	Very high	6 Å²	6	46.1 Å²	46.1	6%	0.062	25%	0.246	C	C	.	.			trans	80	150.1	176.3	0	0	0	0	0	115.1	R539 T586	R539-G588 PolarHBondContact NH2-O 2.91Å; T586-G588 PolarHBondContact O-N 2.83Å; T586-G588 PolarHBondContact OG1-N 3.27Å
589	V	88.6	Confident	92.4	Very high	92 Å²	92	44.1 Å²	44.1	56%	0.558	23%	0.232	S	C	*	.			trans	-121.4	140.2	179	-173.9	0	0	0	0	107.9	E515	E515-V589 VanDerWaalsContact C-CG2 3.47Å; E515-V589 WeakPolarHBondContact O-CG2 3.49Å
590	G	88.1	Confident	92.3	Very high	14 Å²	14	46.9 Å²	46.9	14%	0.144	24%	0.243	C	C	.	.			trans	-168	177.4	-176.2	0	0	0	0	0	112.4	D542	D542-G590 WeakPolarHBondContact OD2-CA 3.24Å
591	Q	87.4	Confident	92	Very high	120 Å²	120	53.6 Å²	53.6	56%	0.561	28%	0.279	S	S	*	.	S	Bend	trans	-85	-36	177.1	-68.5	-177.1	3.9	0	0	112.3	D542 R611 S612	D542-Q591 WeakPolarHBondContact OD1-CA 3.3Å; D542-Q591 PolarHBondContact OD1-N 3.33Å; D542-Q591 PolarHBondContact OD2-N 3.48Å; Q591-R611 CarbonylContact O-C 3.53Å; Q591-R611 VanDerWaalsContact O-CA 3.28Å; Q591-R611 WeakPolarHBondContact O-CA 3.23Å; Q591-S612 PolarHBondContact O-N 2.99Å
592	N	90.8	Very high	91.8	Very high	71 Å²	71	53.9 Å²	53.9	38%	0.38	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	102.1	178.4	-174.9	13.7	0	0	0	109.4	D542	D542-N592 WeakPolarHBondContact CA-O 3.33Å; D542-N592 PolarHBondContact N-O 3.43Å; D542-N592 PolarHBondContact OD1-N 3.22Å
593	I	94.2	Very high	91.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.2	-176.4	-53	175.9	0	0	0	108.6	R539 K540 I609 Q610	R539-I593 HydrophobicContact CG-CG2 3.89Å; K540-I593 WeakPolarHBondContact O-CA 3.47Å; I593-I609 CarbonylContact O-C 3.58Å; I593-I609 WeakPolarHBondContact O-CA 3.48Å; I593-Q610 HydrophobicContact CB-CB 4.23Å; I593-Q610 PolarHBondContact N-O 2.83Å; I593-Q610 PolarHBondContact O-N 3.4Å
594	Q	94.3	Very high	91.9	Very high	82 Å²	82	55.2 Å²	55.2	38%	0.383	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	118.9	174.8	-178.1	179.7	18.6	0	0	109.4	R539 K540 V596 I609	R539-Q594 CarbonylContact C-O 3.57Å; R539-Q594 WeakPolarHBondContact CA-O 3.37Å; K540-Q594 PolarHBondContact N-O 2.87Å; K540-Q594 PolarHBondContact O-N 3.21Å; Q594-V596 HydrophobicContact CG-CG2 3.78Å; Q594-I609 HydrophobicContact CG-CG1 4.08Å
595	T	95.9	Very high	92.1	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.4	175.3	-51.1	0	0	0	0	108.9	I509 I519 L537 K538 R539 T607 H608	I509-T595 HydrophobicContact CD1-CG2 4.13Å; I509-T595 WeakPolarHBondContact CD1-O 3.32Å; I519-T595 HydrophobicContact CD1-CG2 4Å; L537-T595 HydrophobicContact CD1-CG2 3.71Å; L537-T595 HydrophobicContact CG-CG2 4.38Å; K538-T595 CarbonylContact O-C 3.54Å; K538-T595 WeakPolarHBondContact O-CA 3.33Å; R539-T595 HydrophobicContact CB-CG2 4.36Å; R539-T595 WeakPolarHBondContact CD-OG1 3.49Å; T595-T607 CarbonylContact O-C 3.59Å; T595-T607 WeakPolarHBondContact O-CA 3.32Å; T595-H608 PolarHBondContact N-O 3.38Å; T595-H608 PolarHBondContact O-N 3.14Å
596	V	96.7	Very high	92.3	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.036	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.3	-175.8	-172.2	0	0	0	0	110.1	K538 Q594 Y598 E604 A606 T607	K538-V596 PolarHBondContact N-O 3.23Å; K538-V596 PolarHBondContact O-N 2.9Å; Q594-V596 HydrophobicContact CG-CG2 3.78Å; V596-Y598 HydrophobicContact CB-CD2 4.3Å; V596-Y598 HydrophobicContact CB-CE2 3.56Å; V596-Y598 HydrophobicContact CG1-CD1 4.47Å; V596-Y598 HydrophobicContact CG1-CD2 3.97Å; V596-Y598 HydrophobicContact CG1-CE1 3.96Å; V596-Y598 HydrophobicContact CG1-CE2 3.38Å; V596-Y598 HydrophobicContact CG1-CG 4.49Å; V596-E604 HydrophobicContact CG1-CB 4.48Å; V596-E604 HydrophobicContact CG1-CG 3.71Å; V596-A606 CarbonylContact C-O 3.12Å; V596-A606 WeakPolarHBondContact CA-O 3.32Å; V596-T607 WeakPolarHBondContact CG1-OG1 3.45Å; V596-T607 HydrophobicContact CG2-CG2 4.33Å
597	L	97.2	Very high	92.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.2	174.5	-177.4	66.2	0	0	0	109.5	V507 I509 L521 W535 L537 F551 K605 A606	V507-L597 HydrophobicContact CB-CD2 4.31Å; V507-L597 HydrophobicContact CG1-CD2 3.67Å; I509-L597 HydrophobicContact CD1-CB 4.33Å; L521-L597 HydrophobicContact CD1-CD1 3.94Å; L521-L597 HydrophobicContact CD1-CD2 4.16Å; L521-L597 HydrophobicContact CD2-CD2 4.37Å; W535-L597 HydrophobicContact CE3-CD1 4.08Å; W535-L597 HydrophobicContact CE3-CD2 3.77Å; W535-L597 HydrophobicContact CE3-CG 3.77Å; W535-L597 HydrophobicContact CZ3-CD2 3.78Å; W535-L597 HydrophobicContact CZ3-CG 4.18Å; L537-L597 HydrophobicContact CB-CD1 4.42Å; L537-L597 HydrophobicContact CD1-CB 4.43Å; L537-L597 HydrophobicContact CD1-CD1 4.32Å; F551-L597 HydrophobicContact CE2-CD1 4.23Å; L597-K605 PolarHBondContact O-N 3.4Å; L597-A606 HydrophobicContact CB-CB 4.15Å; L597-A606 HydrophobicContact CD2-CB 4.49Å; L597-A606 PolarHBondContact N-O 3.38Å; L597-A606 PolarHBondContact O-N 3.5Å
598	Y	96.4	Very high	92.6	Very high	65 Å²	65	48.4 Å²	48.4	26%	0.255	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	143.6	179.2	-64.4	-85.3	0	0	0	111.3	W535 K536 K538 V596 G602 E603 E604	W535-Y598 CarbonylContact C-O 3.58Å; W535-Y598 WeakPolarHBondContact CA-O 3.37Å; W535-Y598 WeakPolarHBondContact CB-O 3.45Å; K536-Y598 PolarHBondContact N-O 2.94Å; K536-Y598 PolarHBondContact O-N 2.83Å; K538-Y598 HydrophobicContact CB-CD2 4.31Å; K538-Y598 HydrophobicContact CB-CE2 4.03Å; K538-Y598 HydrophobicContact CD-CD2 3.87Å; K538-Y598 HydrophobicContact CD-CE2 3.66Å; K538-Y598 HydrophobicContact CG-CD2 3.85Å; K538-Y598 HydrophobicContact CG-CE2 3.91Å; V596-Y598 HydrophobicContact CB-CD2 4.3Å; V596-Y598 HydrophobicContact CB-CE2 3.56Å; V596-Y598 HydrophobicContact CG1-CD1 4.47Å; V596-Y598 HydrophobicContact CG1-CD2 3.97Å; V596-Y598 HydrophobicContact CG1-CE1 3.96Å; V596-Y598 HydrophobicContact CG1-CE2 3.38Å; V596-Y598 HydrophobicContact CG1-CG 4.49Å; Y598-G602 WeakPolarHBondContact CD1-O 3.28Å; Y598-E603 CarbonylContact C-O 3.59Å; Y598-E603 VanDerWaalsContact CA-O 3.25Å; Y598-E603 WeakPolarHBondContact CA-O 3.5Å; Y598-E604 HydrophobicContact CD1-CB 4.44Å; Y598-E604 HydrophobicContact CE1-CB 4.25Å
599	T	93.5	Very high	92.8	Very high	11 Å²	11	49.5 Å²	49.5	7%	0.067	26%	0.258	C	S	.	.			trans	-70.3	173.5	167.4	64.4	0	0	0	0	111.8	W535 D601 G602 E603 K605	W535-T599 HydrophobicContact CD2-CG2 4.27Å; W535-T599 HydrophobicContact CH2-CG2 4.13Å; W535-T599 HydrophobicContact CZ2-CG2 3.77Å; W535-T599 HydrophobicContact CZ3-CG2 4.48Å; T599-D601 PolarHBondContact O-N 3.49Å; T599-D601 PolarHBondContact OG1-N 3.35Å; T599-G602 PolarHBondContact O-N 3.35Å; T599-G602 PolarHBondContact OG1-N 3.03Å; T599-E603 HydrophobicContact CG2-CB 4.2Å; T599-E603 PolarHBondContact N-O 3.18Å; T599-E603 WeakPolarHBondContact OG1-CB 3.49Å; T599-E603 PolarHBondContact OG1-N 2.99Å; T599-E603 VanDerWaalsContact OG1-N 3.08Å; T599-K605 HydrophobicContact CG2-CD 3.95Å; T599-K605 HydrophobicContact CG2-CG 3.39Å
600	K	89.3	Confident	93	Very high	121 Å²	121	45.5 Å²	45.5	53%	0.526	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-35.6	170	-178.7	171.3	175.5	151.3	0	113	E534 G602	E534-K600 HydrophobicContact CB-CD 4.31Å; E534-K600 HydrophobicContact CB-CG 4.42Å; E534-K600 IonicContact OE1-NZ 3.68Å; E534-K600 WeakPolarHBondContact OE2-CD 3.5Å; E534-K600 WeakPolarHBondContact OE2-CE 3.15Å; E534-K600 IonicContact OE2-NZ 2.64Å; E534-K600 PolarHBondContact OE2-NZ 2.91Å; K600-G602 VanDerWaalsContact C-N 3.26Å; K600-G602 PolarHBondContact O-N 3.44Å
601	D	88.9	Confident	93.1	Very high	143 Å²	143	51.4 Å²	51.4	77%	0.765	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-3.9	178.6	-52.8	-53.1	0	0	0	113.4	T599	T599-D601 PolarHBondContact O-N 3.49Å; T599-D601 PolarHBondContact OG1-N 3.35Å
602	G	88.2	Confident	93.1	Very high	45 Å²	45	46.7 Å²	46.7	46%	0.464	23%	0.231	S	C	.	.			trans	85.4	13.4	-178.5	0	0	0	0	0	114.5	Y598 T599 K600	Y598-G602 WeakPolarHBondContact CD1-O 3.28Å; T599-G602 PolarHBondContact O-N 3.35Å; T599-G602 PolarHBondContact OG1-N 3.03Å; K600-G602 VanDerWaalsContact C-N 3.26Å; K600-G602 PolarHBondContact O-N 3.44Å
603	E	91.9	Very high	92.5	Very high	108 Å²	108	46.2 Å²	46.2	51%	0.505	23%	0.234	S	C	.	.			trans	-76.1	132	173.6	-62.1	-170.1	158.8	0	0	111.2	Y598 T599 K605	Y598-E603 CarbonylContact C-O 3.59Å; Y598-E603 VanDerWaalsContact CA-O 3.25Å; Y598-E603 WeakPolarHBondContact CA-O 3.5Å; T599-E603 HydrophobicContact CG2-CB 4.2Å; T599-E603 PolarHBondContact N-O 3.18Å; T599-E603 WeakPolarHBondContact OG1-CB 3.49Å; T599-E603 PolarHBondContact OG1-N 2.99Å; T599-E603 VanDerWaalsContact OG1-N 3.08Å; E603-K605 PolarHBondContact O-N 3.02Å; E603-K605 WeakPolarHBondContact OE2-CE 3.48Å; E603-K605 IonicContact OE2-NZ 2.85Å; E603-K605 PolarHBondContact OE2-NZ 3.02Å
604	E	93.1	Very high	91.3	Very high	66 Å²	66	50.9 Å²	50.9	31%	0.308	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	120.9	171.8	-178.6	-165.5	-171.6	0	0	110.9	K504 V596 Y598 T607	K504-E604 WeakPolarHBondContact CD-O 3.29Å; K504-E604 IonicContact NZ-OE2 3.8Å; K504-E604 PolarHBondContact NZ-OE2 3.18Å; V596-E604 HydrophobicContact CG1-CB 4.48Å; V596-E604 HydrophobicContact CG1-CG 3.71Å; Y598-E604 HydrophobicContact CD1-CB 4.44Å; Y598-E604 HydrophobicContact CE1-CB 4.25Å; E604-T607 WeakPolarHBondContact OE1-CB 3.22Å; E604-T607 PolarHBondContact OE1-OG1 3.02Å
605	K	93.2	Very high	89.6	Confident	52 Å²	52	52.4 Å²	52.4	23%	0.226	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-26.7	177.1	-67.7	-67.7	178.2	-159.9	0	113.9	A503 K504 W535 L597 T599 E603	A503-K605 CarbonylContact C-O 3.52Å; A503-K605 WeakPolarHBondContact CA-O 3Å; K504-K605 CarbonylContact C-O 3.56Å; K504-K605 WeakPolarHBondContact CA-O 3.33Å; K504-K605 PolarHBondContact N-O 3.49Å; K504-K605 WeakPolarHBondContact O-CD 3.32Å; W535-K605 HydrophobicContact CH2-CB 4.24Å; W535-K605 HydrophobicContact CH2-CD 4.39Å; W535-K605 HydrophobicContact CH2-CG 3.76Å; W535-K605 HydrophobicContact CZ3-CB 3.8Å; W535-K605 HydrophobicContact CZ3-CG 3.73Å; L597-K605 PolarHBondContact O-N 3.4Å; T599-K605 HydrophobicContact CG2-CD 3.95Å; T599-K605 HydrophobicContact CG2-CG 3.39Å; E603-K605 PolarHBondContact O-N 3.02Å; E603-K605 WeakPolarHBondContact OE2-CE 3.48Å; E603-K605 IonicContact OE2-NZ 2.85Å; E603-K605 PolarHBondContact OE2-NZ 3.02Å
606	A	95.3	Very high	87.4	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	147	173.7	0	0	0	0	0	110.8	S502 A503 I509 V596 L597	S502-A606 CarbonylContact O-C 3.58Å; S502-A606 VanDerWaalsContact O-CA 3.29Å; S502-A606 WeakPolarHBondContact O-CA 3.39Å; A503-A606 HydrophobicContact CB-CB 4.27Å; I509-A606 HydrophobicContact CD1-CB 3.99Å; I509-A606 WeakPolarHBondContact CD1-O 3.46Å; I509-A606 HydrophobicContact CG1-CB 3.85Å; V596-A606 CarbonylContact C-O 3.12Å; V596-A606 WeakPolarHBondContact CA-O 3.32Å; L597-A606 HydrophobicContact CB-CB 4.15Å; L597-A606 HydrophobicContact CD2-CB 4.49Å; L597-A606 PolarHBondContact N-O 3.38Å; L597-A606 PolarHBondContact O-N 3.5Å
607	T	96.3	Very high	85.1	Confident	11 Å²	11	58.4 Å²	58.4	7%	0.067	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136.3	179.1	-76	0	0	0	0	110.3	R501 S502 T595 V596 E604 I609	R501-T607 CarbonylContact C-O 3.55Å; R501-T607 WeakPolarHBondContact CA-O 3.29Å; S502-T607 PolarHBondContact N-O 3.48Å; S502-T607 PolarHBondContact O-N 2.98Å; T595-T607 CarbonylContact O-C 3.59Å; T595-T607 WeakPolarHBondContact O-CA 3.32Å; V596-T607 WeakPolarHBondContact CG1-OG1 3.45Å; V596-T607 HydrophobicContact CG2-CG2 4.33Å; E604-T607 WeakPolarHBondContact OE1-CB 3.22Å; E604-T607 PolarHBondContact OE1-OG1 3.02Å; T607-I609 HydrophobicContact CG2-CD1 4.04Å; T607-I609 HydrophobicContact CG2-CG1 3.82Å
608	H	95.3	Very high	82.7	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120.4	174.4	176.1	-73.8	0	0	0	108.2	F499 Q500 R501 I509 T595	F499-H608 AromaticContact CD1-CE1 3.67Å; F499-H608 AromaticContact CD1-NE2 3.71Å; Q500-H608 CarbonylContact O-C 3.56Å; Q500-H608 WeakPolarHBondContact O-CA 3.16Å; R501-H608 PolarHBondContact NH1-CD2 3.32Å; I509-H608 HydrophobicContact CB-CB 4.03Å; I509-H608 HydrophobicContact CD1-CB 4.13Å; I509-H608 HydrophobicContact CG2-CB 3.74Å; T595-H608 PolarHBondContact N-O 3.38Å; T595-H608 PolarHBondContact O-N 3.14Å
609	I	94.1	Very high	80.4	Confident	30 Å²	30	64.6 Å²	64.6	15%	0.154	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.5	179.2	-61.8	167.6	0	0	0	107.6	F499 Q500 I593 Q594 T607 R611	F499-I609 CarbonylContact C-O 3.58Å; F499-I609 WeakPolarHBondContact CA-O 3.36Å; Q500-I609 HydrophobicContact CB-CB 4.32Å; Q500-I609 PolarHBondContact N-O 3.5Å; Q500-I609 PolarHBondContact O-N 3.41Å; I593-I609 CarbonylContact O-C 3.58Å; I593-I609 WeakPolarHBondContact O-CA 3.48Å; Q594-I609 HydrophobicContact CG-CG1 4.08Å; T607-I609 HydrophobicContact CG2-CD1 4.04Å; T607-I609 HydrophobicContact CG2-CG1 3.82Å; I609-R611 HydrophobicContact CG2-CG 4.05Å
610	Q	92.6	Very high	78.2	Confident	7 Å²	7	70.5 Å²	70.5	3%	0.033	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.5	174.8	173.4	-176.2	-26.5	0	0	109	T497 S498 F499 I593	T497-Q610 HydrophobicContact CG2-CG 3.57Å; S498-Q610 WeakPolarHBondContact O-CA 3.49Å; F499-Q610 HydrophobicContact CD1-CB 4.03Å; F499-Q610 HydrophobicContact CD1-CG 4.02Å; F499-Q610 HydrophobicContact CE1-CB 4.16Å; F499-Q610 HydrophobicContact CE1-CG 3.71Å; I593-Q610 HydrophobicContact CB-CB 4.23Å; I593-Q610 PolarHBondContact N-O 2.83Å; I593-Q610 PolarHBondContact O-N 3.4Å
611	R	90.7	Very high	77.6	Confident	138 Å²	138	68 Å²	68	52%	0.521	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	116.9	174.8	-60.5	-176.9	-173.7	-152.7	4.2	110.2	S498 Q591 I609	S498-R611 PolarHBondContact N-O 3.48Å; S498-R611 PolarHBondContact O-N 3.32Å; S498-R611 PolarHBondContact OG-O 2.82Å; Q591-R611 CarbonylContact O-C 3.53Å; Q591-R611 VanDerWaalsContact O-CA 3.28Å; Q591-R611 WeakPolarHBondContact O-CA 3.23Å; I609-R611 HydrophobicContact CG2-CG 4.05Å
612	S	86.4	Confident	77	Confident	21 Å²	21	64 Å²	64	15%	0.147	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115	176.6	-49.4	0	0	0	0	108.9	R496 T497 Q591	R496-S612 WeakPolarHBondContact O-CA 3.41Å; T497-S612 PolarHBondContact OG1-OG 3.29Å; Q591-S612 PolarHBondContact O-N 2.99Å
613	S	79.2	Confident	76.4	Confident	62 Å²	62	65.1 Å²	65.1	43%	0.434	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.8	173.9	62	0	0	0	0	109.8	R496 Q615	R496-S613 PolarHBondContact N-O 3.4Å; R496-S613 PolarHBondContact O-N 3.24Å; S613-Q615 PolarHBondContact O-N 3.34Å
614	Q	69.3	Low	75.5	Confident	98 Å²	98	62.5 Å²	62.5	46%	0.458	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	103.5	169.3	-65.6	178.9	5.8	0	0	108.2	T495	T495-Q614 HydrophobicContact CG2-CG 4.49Å
615	Q	57.4	Low	74.4	Confident	114 Å²	114	62.3 Å²	62.3	53%	0.533	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115	166.3	-78.8	-179.9	-16.7	0	0	107.4	S613 S617	S613-Q615 PolarHBondContact O-N 3.34Å; Q615-S617 VanDerWaalsContact C-N 3.31Å; Q615-S617 PolarHBondContact O-N 3.05Å; Q615-S617 VanDerWaalsContact O-N 3.1Å
616	T	50.7	Low	73.1	Confident	67 Å²	67	63 Å²	63	41%	0.411	37%	0.369	S	S	.	.			trans	-75	93.8	161.8	44.9	0	0	0	0	106.6	T618	T616-T618 PolarHBondContact O-N 3.25Å
617	S	49	Very low	71.6	Confident	65 Å²	65	67.4 Å²	67.4	46%	0.455	40%	0.395	S	S	.	.			trans	-61.3	95.8	157.8	40.8	0	0	0	0	106.4	Q615 T619	Q615-S617 VanDerWaalsContact C-N 3.31Å; Q615-S617 PolarHBondContact O-N 3.05Å; Q615-S617 VanDerWaalsContact O-N 3.1Å; S617-T619 VanDerWaalsContact C-N 3.25Å; S617-T619 PolarHBondContact O-N 3.22Å
618	T	45.5	Very low	69.7	Low	111 Å²	111	71.8 Å²	71.8	68%	0.681	42%	0.42	S	S	*	.			trans	-70.5	95.5	165.6	29.3	0	0	0	0	105.1	T616 A620	T616-T618 PolarHBondContact O-N 3.25Å; T618-A620 PolarHBondContact O-N 3.37Å
619	T	48.7	Very low	67.5	Low	85 Å²	85	77.7 Å²	77.7	52%	0.521	45%	0.454	S	S	.	.			trans	-62.3	90.7	161.2	-6.4	0	0	0	0	105.7	S617	S617-T619 VanDerWaalsContact C-N 3.25Å; S617-T619 PolarHBondContact O-N 3.22Å
620	A	46.6	Very low	65.1	Low	134 Å²	134	82 Å²	82	100%	1.107	48%	0.482	S	S	*	.			trans	-69.7	0	166.4	0	0	0	0	0	109.8	R424 T618	R424-A620 PolarHBondContact NH1-O 3.4Å; T618-A620 PolarHBondContact O-N 3.37Å

Retrieved 620 of 620 residues in 478.9 ms (Link to these results)

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